NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
591403 |
2mmv   |
19869 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mmv
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 1999
_Distance_constraint_stats_list.Viol_count 4734
_Distance_constraint_stats_list.Viol_total 23444.645
_Distance_constraint_stats_list.Viol_max 0.827
_Distance_constraint_stats_list.Viol_rms 0.1014
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0293
_Distance_constraint_stats_list.Viol_average_violations_only 0.2476
_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 8 PRO 1.006 0.239 11 0 "[ . 1 . 2]"
1 9 LYS 1.460 0.454 13 0 "[ . 1 . 2]"
1 10 THR 14.094 0.590 12 7 "[*-**. 1 +**. 2]"
1 11 ARG 24.002 0.555 14 4 "[ * . 1 - +.* 2]"
1 12 VAL 47.059 0.589 20 18 "[******* *-******** +]"
1 13 SER 0.041 0.030 18 0 "[ . 1 . 2]"
1 14 VAL 9.759 0.514 14 1 "[ . 1 +. 2]"
1 15 ARG 12.197 0.517 8 4 "[ . + 1 - .* *]"
1 16 ILE 24.805 0.565 5 15 "[ * *+ * **-******* *]"
1 17 TYR 17.886 0.554 13 8 "[ * ** ** + * *2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 GLN 25.066 0.827 19 11 "[ **** ***1 - .* *+2]"
1 20 ASP 9.655 0.539 12 1 "[ . 1 + . 2]"
1 21 TYR 38.482 0.609 18 14 "[ * ** ****- *** *+ *]"
1 22 THR 3.309 0.545 16 2 "[ . 1 - .+ 2]"
1 23 ILE 33.531 0.605 7 15 "[** ** +***- *** ***]"
1 24 VAL 29.904 0.559 3 8 "[**+ . * 1 - *.** 2]"
1 25 GLY 20.042 0.565 11 9 "[* *-* *+* ** 2]"
1 26 ALA 5.660 0.590 12 4 "[ - . 1 +**. 2]"
1 27 GLU 14.946 0.598 20 10 "[ *. * *1 * *** *-+]"
1 28 SER 4.879 0.514 20 1 "[ . 1 . +]"
1 29 PRO 5.701 0.552 12 2 "[ . - + . 2]"
1 30 ALA 5.218 0.560 1 2 "[+ .- 1 . 2]"
1 31 HIS 8.757 0.554 14 5 "[ *. 1 *+. * -]"
1 32 ILE 22.052 0.616 10 15 "[ ***** *+* -** ****]"
1 33 ARG 15.537 0.560 1 7 "[+ .** - * *. *2]"
1 34 LEU 14.230 0.554 14 5 "[ *. 1 -+. * *2]"
1 35 VAL 9.464 0.594 19 3 "[ . - 1 .* +2]"
1 36 ALA 23.156 0.616 10 12 "[ ** *+* *****-*]"
1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 PHE 8.501 0.549 6 6 "[ .+* 1* *-. *2]"
1 39 VAL 9.247 0.563 3 2 "[ + . 1- . 2]"
1 40 ASP 0.591 0.384 19 0 "[ . 1 . 2]"
1 41 ASP 2.266 0.524 11 1 "[ . 1+ . 2]"
1 42 LYS 15.988 0.597 12 10 "[* *** *-*+ * *2]"
1 43 MET 16.479 0.630 4 11 "[ **+. ***** *-* 2]"
1 44 HIS 4.356 0.409 7 0 "[ . 1 . 2]"
1 45 GLU 2.831 0.540 9 2 "[ . +1- . 2]"
1 46 PHE 15.808 0.618 4 12 "[- *+. **1*** . ****]"
1 47 SER 19.111 0.614 7 11 "[ ***.*+ *** -*. *2]"
1 48 GLU 6.824 0.510 10 1 "[ . + . 2]"
1 49 LYS 4.001 0.510 10 2 "[- . + . 2]"
1 50 GLN 9.484 0.595 3 12 "[* +*.** *** - .** *]"
1 51 PRO 7.923 0.582 13 11 "[ * * *1**+-.* ***]"
1 52 MET 19.913 0.582 13 14 "[** * *****+*.* -**]"
1 53 LEU 17.668 0.595 3 15 "[* +*.****** -*.*** *]"
1 54 ASP 0.011 0.011 6 0 "[ . 1 . 2]"
1 55 VAL 0.011 0.011 6 0 "[ . 1 . 2]"
1 56 PRO 15.967 0.533 18 5 "[ * . * 1* . +-2]"
1 57 LYS 4.030 0.528 3 2 "[ + . 1 . -2]"
1 58 LEU 31.445 0.630 4 15 "[ **+* ***** ***-* *2]"
1 59 ALA 2.467 0.434 6 0 "[ . 1 . 2]"
1 60 VAL 9.906 0.559 19 3 "[ . - 1 . *+2]"
1 61 LEU 8.818 0.630 16 4 "[ . * 1 - .+ * 2]"
1 62 THR 33.725 0.618 4 15 "[***+* ****** . -***]"
1 63 ALA 11.396 0.559 19 3 "[- * . 1 . +2]"
1 64 VAL 9.560 0.494 17 0 "[ . 1 . 2]"
1 65 GLN 24.559 0.635 14 5 "[ * 1 +.- **]"
1 66 ILE 26.947 0.597 12 13 "[***** ** + * -***]"
1 67 ALA 5.599 0.513 9 1 "[ . +1 . 2]"
1 68 SER 0.416 0.185 16 0 "[ . 1 . 2]"
1 69 GLU 2.940 0.516 8 1 "[ . + 1 . 2]"
1 70 TYR 18.690 0.626 8 8 "[* *.* +-1* . **]"
1 71 LEU 19.008 0.541 5 3 "[ +- * . 2]"
1 72 LYS 14.076 0.626 5 10 "[* * + *-*** .* * 2]"
1 73 LEU 39.220 0.574 12 13 "[* * *** * +****- *2]"
1 74 LYS 37.924 0.583 7 12 "[* * **+ * *****- 2]"
1 75 GLU 18.509 0.551 7 5 "[ . +* * * -2]"
1 76 GLU 17.696 0.565 17 8 "[* .* -* ** * + 2]"
1 77 TYR 35.587 0.717 2 20 [*+**************-***]
1 78 GLN 1.580 0.486 13 0 "[ . 1 . 2]"
1 79 ARG 13.162 0.667 18 14 "[** * -****** ** + *]"
1 80 LEU 40.548 0.667 18 15 "[** **-****** ** + *]"
1 81 ARG 20.959 0.572 4 11 "[** +* *- * *. ***]"
1 82 GLU 12.680 0.576 16 5 "[ - . **1 .+ *]"
1 83 GLN 4.663 0.516 11 2 "[ -. 1+ . 2]"
1 84 LEU 19.569 0.659 4 14 "[* *+* ** 1***** *-*]"
1 85 LYS 22.419 0.659 4 14 "[* *+* ***1 **** *-*]"
1 86 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 8 PRO 1.640 0.623 3 1 "[ + . 1 . 2]"
2 9 LYS 2.334 0.623 3 1 "[ + . 1 . 2]"
2 10 THR 14.402 0.615 12 5 "[ ***. 1 + . - 2]"
2 11 ARG 18.858 0.534 4 2 "[ +. 1 . - 2]"
2 12 VAL 46.268 0.581 13 19 "[*******-****+***** *]"
2 13 SER 0.124 0.082 14 0 "[ . 1 . 2]"
2 14 VAL 12.558 0.549 18 2 "[ . - 1 . + 2]"
2 15 ARG 10.985 0.523 8 3 "[ * . + 1 . - 2]"
2 16 ILE 21.742 0.538 10 5 "[ * . * + - . *2]"
2 17 TYR 19.741 0.552 10 10 "[ *- .* * +** ** * 2]"
2 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 GLN 10.395 0.523 8 1 "[ . + 1 . 2]"
2 20 ASP 7.243 0.490 12 0 "[ . 1 . 2]"
2 21 TYR 30.334 0.600 8 12 "[ * . *+ ***- .*****]"
2 22 THR 3.299 0.529 7 1 "[ . + 1 . 2]"
2 23 ILE 30.504 0.635 14 10 "[ * ** *** +.* * -]"
2 24 VAL 29.019 0.547 4 9 "[** +* * 1 ***- 2]"
2 25 GLY 20.398 0.542 17 12 "[* *** *-***.*+ *]"
2 26 ALA 4.038 0.615 12 4 "[ **. 1 + . - 2]"
2 27 GLU 22.108 0.626 5 17 "[****+***-*****.* **2]"
2 28 SER 4.639 0.378 19 0 "[ . 1 . 2]"
2 29 PRO 3.962 0.552 12 3 "[ . -*1 + . 2]"
2 30 ALA 5.492 0.579 11 5 "[* .* *+ . - 2]"
2 31 HIS 9.506 0.555 6 6 "[ .+ ** -*. * 2]"
2 32 ILE 20.849 0.641 5 15 "[ ***+** *1* *** -***]"
2 33 ARG 17.397 0.580 19 12 "[** .** *** -***+2]"
2 34 LEU 15.662 0.580 19 7 "[ .* ** -*. * +2]"
2 35 VAL 10.298 0.607 17 7 "[ * *. * 1 -. + **]"
2 36 ALA 27.450 0.641 5 11 "[ *+ * *1 *-* ****]"
2 37 ALA 0.167 0.105 16 0 "[ . 1 . 2]"
2 38 PHE 5.905 0.520 20 2 "[ . - 1 . +]"
2 39 VAL 7.290 0.580 7 2 "[ . + 1 . - 2]"
2 40 ASP 1.417 0.502 3 1 "[ + . 1 . 2]"
2 41 ASP 0.320 0.180 3 0 "[ . 1 . 2]"
2 42 LYS 14.636 0.590 12 12 "[ ** * *** + -** **]"
2 43 MET 19.918 0.594 13 18 "[ ***-** ****+*******]"
2 44 HIS 5.608 0.502 6 1 "[ .+ 1 . 2]"
2 45 GLU 1.835 0.568 10 2 "[ - . + . 2]"
2 46 PHE 17.724 0.600 4 16 "[-**+* * **********2]"
2 47 SER 22.355 0.563 2 15 "[*+* . *******- ****]"
2 48 GLU 8.424 0.521 18 1 "[ . 1 . + 2]"
2 49 LYS 5.620 0.521 18 2 "[ . - . + 2]"
2 50 GLN 16.971 0.625 17 17 "[********** **- +***]"
2 51 PRO 9.926 0.602 18 13 "[ * ** -**1****.**+ 2]"
2 52 MET 30.742 0.827 19 17 "[ *****-*******.***+2]"
2 53 LEU 24.223 0.625 17 18 "[********** **-*+***]"
2 54 ASP 0.056 0.051 6 0 "[ . 1 . 2]"
2 55 VAL 0.052 0.051 6 0 "[ . 1 . 2]"
2 56 PRO 19.197 0.534 8 6 "[ * +*1* .- * 2]"
2 57 LYS 4.603 0.534 8 4 "[ . +*1 .- * 2]"
2 58 LEU 35.771 0.594 13 19 "[****-*******+**** **]"
2 59 ALA 0.260 0.081 4 0 "[ . 1 . 2]"
2 60 VAL 12.098 0.552 9 4 "[ - +1 .** 2]"
2 61 LEU 5.663 0.418 13 0 "[ . 1 . 2]"
2 62 THR 36.220 0.600 4 15 "[***+* 1***-******]"
2 63 ALA 18.953 0.557 20 8 "[ ** * -1 * ** +]"
2 64 VAL 9.523 0.418 13 0 "[ . 1 . 2]"
2 65 GLN 22.803 0.589 19 8 "[* *. ** 1- *. *+2]"
2 66 ILE 23.653 0.590 12 12 "[*** - **1*+ ** **]"
2 67 ALA 5.463 0.542 4 5 "[* +. 1 - . **]"
2 68 SER 1.365 0.360 11 0 "[ . 1 . 2]"
2 69 GLU 2.659 0.589 20 1 "[ . 1 . +]"
2 70 TYR 16.712 0.535 6 2 "[- .+ 1 . 2]"
2 71 LEU 22.371 0.713 15 11 "[* *- **1* *+ ***]"
2 72 LYS 15.050 0.598 20 11 "[ ** * *1 * *** *-+]"
2 73 LEU 35.017 0.583 7 11 "[**- .*+ *1 ** ** *]"
2 74 LYS 33.654 0.713 15 13 "[*** *- ** * *+ ***]"
2 75 GLU 18.535 0.584 1 7 "[+ * ** ** -]"
2 76 GLU 21.175 0.636 13 15 "[* *** **** +**** -*]"
2 77 TYR 28.978 0.572 4 14 "[* +***-** ***.** *2]"
2 78 GLN 2.165 0.185 8 0 "[ . 1 . 2]"
2 79 ARG 5.852 0.415 10 0 "[ . 1 . 2]"
2 80 LEU 27.545 0.717 2 13 "[*+ ***- ** **** *]"
2 81 ARG 21.264 0.613 18 14 "[* * ***- 1*** ***+ *]"
2 82 GLU 10.744 0.526 7 2 "[ . + 1 - 2]"
2 83 GLN 4.933 0.586 2 2 "[ + . 1- . 2]"
2 84 LEU 17.868 0.603 12 12 "[*** . * 1*+*-.****2]"
2 85 LYS 22.928 0.603 12 13 "[* * . ** 1*+*-*****2]"
2 86 LYS 0.110 0.080 12 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 8 PRO HA 1 9 LYS H . . 2.570 2.573 2.193 2.681 0.111 15 0 "[ . 1 . 2]" 1
2 1 8 PRO HA 1 9 LYS QG . . 4.710 4.190 3.750 4.601 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO QB 1 9 LYS H . . 3.650 2.270 2.135 3.662 0.012 11 0 "[ . 1 . 2]" 1
4 1 8 PRO HB2 1 9 LYS H . . 4.520 2.316 2.161 3.981 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO HB3 1 9 LYS H . . 4.520 3.400 2.885 4.278 . 0 0 "[ . 1 . 2]" 1
6 1 8 PRO QG 1 9 LYS H . . 4.560 3.878 3.690 4.799 0.239 11 0 "[ . 1 . 2]" 1
7 1 9 LYS H 1 9 LYS HB2 . . 3.910 2.984 2.233 3.802 . 0 0 "[ . 1 . 2]" 1
8 1 9 LYS H 1 9 LYS HB3 . . 3.910 3.153 2.487 3.606 . 0 0 "[ . 1 . 2]" 1
9 1 9 LYS H 1 9 LYS HG2 . . 4.080 2.854 2.156 4.038 . 0 0 "[ . 1 . 2]" 1
10 1 9 LYS H 1 9 LYS QG . . 3.430 2.265 2.134 2.794 . 0 0 "[ . 1 . 2]" 1
11 1 9 LYS H 1 9 LYS HG3 . . 4.080 2.886 2.208 3.673 . 0 0 "[ . 1 . 2]" 1
12 1 9 LYS H 1 10 THR H . . 4.650 4.373 3.944 4.583 . 0 0 "[ . 1 . 2]" 1
13 1 9 LYS HA 1 9 LYS HG2 . . 4.250 3.096 2.294 3.859 . 0 0 "[ . 1 . 2]" 1
14 1 9 LYS HA 1 9 LYS QG . . 3.650 2.832 2.237 3.373 . 0 0 "[ . 1 . 2]" 1
15 1 9 LYS HA 1 9 LYS HG3 . . 4.250 3.417 2.531 3.963 . 0 0 "[ . 1 . 2]" 1
16 1 9 LYS HA 1 10 THR H . . 2.840 2.185 2.130 2.329 . 0 0 "[ . 1 . 2]" 1
17 1 9 LYS HA 1 10 THR MG . . 4.500 3.995 3.773 4.238 . 0 0 "[ . 1 . 2]" 1
18 1 9 LYS HA 1 26 ALA MB . . 4.550 2.856 2.104 5.004 0.454 13 0 "[ . 1 . 2]" 1
19 1 9 LYS QB 1 9 LYS QD . . 2.710 2.177 2.124 2.291 . 0 0 "[ . 1 . 2]" 1
20 1 9 LYS QB 1 9 LYS QE . . 4.560 3.033 2.152 3.668 . 0 0 "[ . 1 . 2]" 1
21 1 9 LYS QB 1 10 THR H . . 4.170 3.405 2.660 3.795 . 0 0 "[ . 1 . 2]" 1
22 1 9 LYS HB2 1 10 THR H . . 4.770 3.936 2.701 4.561 . 0 0 "[ . 1 . 2]" 1
23 1 9 LYS HB3 1 10 THR H . . 4.770 3.970 3.197 4.371 . 0 0 "[ . 1 . 2]" 1
24 1 9 LYS QD 1 24 VAL QG . . 4.510 2.714 2.137 4.138 . 0 0 "[ . 1 . 2]" 1
25 1 9 LYS QE 1 24 VAL QG . . 4.960 3.478 2.280 4.675 . 0 0 "[ . 1 . 2]" 1
26 1 10 THR H 1 10 THR HB . . 3.400 2.657 2.443 3.309 . 0 0 "[ . 1 . 2]" 1
27 1 10 THR H 1 10 THR MG . . 3.540 2.251 2.149 2.547 . 0 0 "[ . 1 . 2]" 1
28 1 10 THR H 1 11 ARG H . . 4.540 4.536 4.272 4.607 0.067 4 0 "[ . 1 . 2]" 1
29 1 10 THR H 1 24 VAL QG . . 4.380 3.881 3.035 4.417 0.037 4 0 "[ . 1 . 2]" 1
30 1 10 THR H 1 25 GLY H . . 4.340 4.389 3.382 4.872 0.532 1 2 "[+ -. 1 . 2]" 1
31 1 10 THR H 1 26 ALA HA . . 4.050 3.872 2.895 4.640 0.590 12 2 "[ - . 1 + . 2]" 1
32 1 10 THR H 1 26 ALA MB . . 4.420 3.539 2.128 4.980 0.560 13 2 "[ . 1 +-. 2]" 1
33 1 10 THR HA 1 10 THR MG . . 3.640 3.208 3.187 3.219 . 0 0 "[ . 1 . 2]" 1
34 1 10 THR HA 1 11 ARG H . . 2.710 2.402 2.256 2.775 0.065 12 0 "[ . 1 . 2]" 1
35 1 10 THR HB 1 11 ARG H . . 4.150 3.877 3.466 4.066 . 0 0 "[ . 1 . 2]" 1
36 1 10 THR MG 1 11 ARG H . . 4.170 3.151 2.534 3.467 . 0 0 "[ . 1 . 2]" 1
37 1 10 THR MG 1 12 VAL HA . . 4.690 4.676 4.214 5.220 0.530 1 2 "[+- . 1 . 2]" 1
38 1 10 THR MG 1 12 VAL HB . . 3.710 3.766 3.414 4.173 0.463 2 0 "[ . 1 . 2]" 1
39 1 11 ARG H 1 11 ARG QB . . 3.190 2.731 2.428 3.092 . 0 0 "[ . 1 . 2]" 1
40 1 11 ARG H 1 11 ARG QD . . 4.820 4.192 3.464 4.843 0.023 5 0 "[ . 1 . 2]" 1
41 1 11 ARG H 1 11 ARG HG2 . . 4.130 2.894 2.080 4.144 0.014 15 0 "[ . 1 . 2]" 1
42 1 11 ARG H 1 11 ARG HG3 . . 4.130 3.025 2.493 3.746 . 0 0 "[ . 1 . 2]" 1
43 1 11 ARG H 1 12 VAL H . . 4.630 4.464 4.335 4.541 . 0 0 "[ . 1 . 2]" 1
44 1 11 ARG H 1 24 VAL HA . . 4.450 4.779 4.449 4.997 0.547 2 1 "[ + . 1 . 2]" 1
45 1 11 ARG H 1 24 VAL QG . . 4.380 4.613 4.300 4.866 0.486 4 0 "[ . 1 . 2]" 1
46 1 11 ARG H 1 25 GLY H . . 4.760 4.695 4.360 5.148 0.388 20 0 "[ . 1 . 2]" 1
47 1 11 ARG HA 1 12 VAL H . . 2.930 2.232 2.149 2.338 . 0 0 "[ . 1 . 2]" 1
48 1 11 ARG HA 1 12 VAL HB . . 4.560 4.377 4.259 4.540 . 0 0 "[ . 1 . 2]" 1
49 1 11 ARG HA 1 24 VAL HA . . 1.930 2.241 2.074 2.426 0.496 6 0 "[ . 1 . 2]" 1
50 1 11 ARG HA 1 24 VAL QG . . 3.710 3.350 3.192 3.498 . 0 0 "[ . 1 . 2]" 1
51 1 11 ARG HA 1 25 GLY H . . 2.640 2.656 2.297 3.087 0.447 12 0 "[ . 1 . 2]" 1
52 1 11 ARG QB 1 12 VAL H . . 3.850 2.849 2.498 3.215 . 0 0 "[ . 1 . 2]" 1
53 1 11 ARG QB 1 24 VAL QG . . 3.920 3.514 2.773 4.475 0.555 14 1 "[ . 1 +. 2]" 1
54 1 11 ARG QD 1 22 THR HB . . 4.680 3.835 2.436 5.225 0.545 16 2 "[ . 1 - .+ 2]" 1
55 1 11 ARG QD 1 22 THR MG . . 4.610 2.798 2.235 3.631 . 0 0 "[ . 1 . 2]" 1
56 1 11 ARG QG 1 12 VAL H . . 4.200 3.936 3.338 4.410 0.210 17 0 "[ . 1 . 2]" 1
57 1 12 VAL H 1 12 VAL HB . . 3.390 3.108 2.856 3.428 0.038 16 0 "[ . 1 . 2]" 1
58 1 12 VAL H 1 12 VAL QG . . 4.060 2.269 2.173 2.396 . 0 0 "[ . 1 . 2]" 1
59 1 12 VAL H 1 13 SER H . . 4.570 4.414 4.340 4.500 . 0 0 "[ . 1 . 2]" 1
60 1 12 VAL H 1 23 ILE H . . 3.910 3.066 2.789 3.339 . 0 0 "[ . 1 . 2]" 1
61 1 12 VAL H 1 24 VAL HA . . 3.090 3.523 3.230 3.649 0.559 3 7 "[**+ . * 1 - .** 2]" 1
62 1 12 VAL H 1 25 GLY H . . 3.160 3.567 3.194 3.725 0.565 11 6 "[- *.* *+* . 2]" 1
63 1 12 VAL HA 1 12 VAL QG . . 3.140 2.302 2.200 2.420 . 0 0 "[ . 1 . 2]" 1
64 1 12 VAL HA 1 13 SER H . . 2.790 2.231 2.176 2.337 . 0 0 "[ . 1 . 2]" 1
65 1 12 VAL HB 1 13 SER H . . 4.440 4.070 3.948 4.176 . 0 0 "[ . 1 . 2]" 1
66 1 12 VAL HB 1 25 GLY H . . 4.160 4.418 4.016 4.680 0.520 16 4 "[* - 1 *+ 2]" 1
67 1 12 VAL QG 1 13 SER H . . 3.240 2.271 2.138 2.476 . 0 0 "[ . 1 . 2]" 1
68 1 12 VAL QG 1 14 VAL QG . . 2.870 2.196 2.124 2.348 . 0 0 "[ . 1 . 2]" 1
69 1 12 VAL QG 1 25 GLY QA . . 4.650 2.727 2.174 3.580 . 0 0 "[ . 1 . 2]" 1
70 1 12 VAL QG 1 29 PRO HA . . 4.140 4.337 3.607 4.692 0.552 12 2 "[ . - + . 2]" 1
71 1 12 VAL QG 1 32 ILE H . . 4.500 4.993 4.792 5.089 0.589 20 11 "[ ***** ** -*. * +]" 1
72 1 12 VAL QG 1 32 ILE QG . . 4.130 2.696 2.145 3.274 . 0 0 "[ . 1 . 2]" 1
73 1 12 VAL QG 1 33 ARG HA . . 4.170 4.249 3.813 4.708 0.538 1 2 "[+ . - 1 . 2]" 1
74 1 12 VAL QG 1 33 ARG QD . . 4.130 3.767 2.915 4.671 0.541 12 2 "[ . - + . 2]" 1
75 1 13 SER H 1 13 SER HB2 . . 3.700 2.815 2.515 3.561 . 0 0 "[ . 1 . 2]" 1
76 1 13 SER H 1 13 SER HB3 . . 3.700 3.543 2.406 3.730 0.030 18 0 "[ . 1 . 2]" 1
77 1 13 SER H 1 14 VAL H . . 4.680 4.356 4.115 4.468 . 0 0 "[ . 1 . 2]" 1
78 1 13 SER HA 1 14 VAL H . . 3.300 2.162 2.146 2.177 . 0 0 "[ . 1 . 2]" 1
79 1 13 SER HA 1 14 VAL QG . . 3.820 3.386 3.178 3.518 . 0 0 "[ . 1 . 2]" 1
80 1 13 SER HA 1 22 THR MG . . 4.580 2.992 2.685 3.462 . 0 0 "[ . 1 . 2]" 1
81 1 13 SER HA 1 23 ILE H . . 4.090 3.488 3.242 3.816 . 0 0 "[ . 1 . 2]" 1
82 1 13 SER QB 1 14 VAL H . . 3.970 3.390 3.150 3.875 . 0 0 "[ . 1 . 2]" 1
83 1 13 SER QB 1 14 VAL QG . . 4.670 4.186 4.027 4.335 . 0 0 "[ . 1 . 2]" 1
84 1 13 SER QB 1 22 THR HA . . 4.330 3.727 3.426 4.071 . 0 0 "[ . 1 . 2]" 1
85 1 13 SER HB2 1 14 VAL H . . 4.690 4.090 3.541 4.368 . 0 0 "[ . 1 . 2]" 1
86 1 13 SER HB3 1 14 VAL H . . 4.690 3.673 3.271 4.379 . 0 0 "[ . 1 . 2]" 1
87 1 14 VAL H 1 14 VAL MG1 . . 4.260 3.003 2.647 3.500 . 0 0 "[ . 1 . 2]" 1
88 1 14 VAL H 1 14 VAL QG . . 3.390 2.143 2.106 2.174 . 0 0 "[ . 1 . 2]" 1
89 1 14 VAL H 1 14 VAL MG2 . . 4.260 2.198 2.174 2.223 . 0 0 "[ . 1 . 2]" 1
90 1 14 VAL H 1 15 ARG H . . 4.920 4.468 4.421 4.516 . 0 0 "[ . 1 . 2]" 1
91 1 14 VAL H 1 21 TYR H . . 3.980 2.864 2.655 3.120 . 0 0 "[ . 1 . 2]" 1
92 1 14 VAL H 1 22 THR MG . . 4.700 4.734 4.344 5.166 0.466 15 0 "[ . 1 . 2]" 1
93 1 14 VAL H 1 23 ILE H . . 4.440 4.190 3.579 4.756 0.316 3 0 "[ . 1 . 2]" 1
94 1 14 VAL H 1 36 ALA MB . . 4.860 5.022 4.921 5.228 0.368 14 0 "[ . 1 . 2]" 1
95 1 14 VAL HB 1 15 ARG H . . 3.280 2.448 2.148 2.793 . 0 0 "[ . 1 . 2]" 1
96 1 14 VAL HB 1 36 ALA MB . . 3.570 2.144 2.111 2.178 . 0 0 "[ . 1 . 2]" 1
97 1 14 VAL QG 1 15 ARG H . . 3.960 3.152 2.949 3.333 . 0 0 "[ . 1 . 2]" 1
98 1 14 VAL QG 1 33 ARG H . . 4.690 4.861 4.598 5.204 0.514 14 1 "[ . 1 +. 2]" 1
99 1 14 VAL QG 1 33 ARG HA . . 3.690 2.992 2.611 3.532 . 0 0 "[ . 1 . 2]" 1
100 1 14 VAL MG1 1 36 ALA MB . . 3.160 2.545 2.293 2.910 . 0 0 "[ . 1 . 2]" 1
101 1 14 VAL MG2 1 36 ALA MB . . 3.160 2.245 2.170 2.553 . 0 0 "[ . 1 . 2]" 1
102 1 15 ARG H 1 15 ARG QB . . 3.570 2.411 2.266 2.568 . 0 0 "[ . 1 . 2]" 1
103 1 15 ARG H 1 15 ARG QD . . 4.920 4.772 4.404 5.145 0.225 14 0 "[ . 1 . 2]" 1
104 1 15 ARG H 1 15 ARG HG2 . . 4.840 4.506 4.337 4.694 . 0 0 "[ . 1 . 2]" 1
105 1 15 ARG H 1 15 ARG QG . . 4.150 4.067 3.970 4.179 0.029 17 0 "[ . 1 . 2]" 1
106 1 15 ARG H 1 15 ARG HG3 . . 4.840 4.646 4.400 4.874 0.034 1 0 "[ . 1 . 2]" 1
107 1 15 ARG H 1 16 ILE H . . 4.340 4.366 4.217 4.466 0.126 20 0 "[ . 1 . 2]" 1
108 1 15 ARG H 1 36 ALA MB . . 4.220 3.404 3.010 3.732 . 0 0 "[ . 1 . 2]" 1
109 1 15 ARG HA 1 16 ILE H . . 3.200 2.149 2.135 2.162 . 0 0 "[ . 1 . 2]" 1
110 1 15 ARG HA 1 21 TYR H . . 3.150 3.418 3.238 3.657 0.507 20 1 "[ . 1 . +]" 1
111 1 15 ARG HA 1 21 TYR QD . . 4.790 4.098 3.306 5.275 0.485 16 0 "[ . 1 . 2]" 1
112 1 15 ARG QD 1 18 GLY H . . 4.900 3.699 2.187 4.777 . 0 0 "[ . 1 . 2]" 1
113 1 15 ARG QD 1 19 GLN H . . 4.700 4.788 3.980 5.217 0.517 8 3 "[ . + 1 - .* 2]" 1
114 1 15 ARG QG 1 16 ILE H . . 3.990 2.847 2.605 3.106 . 0 0 "[ . 1 . 2]" 1
115 1 15 ARG QG 1 16 ILE HA . . 4.870 3.982 3.564 4.447 . 0 0 "[ . 1 . 2]" 1
116 1 15 ARG QG 1 18 GLY H . . 4.430 2.849 2.365 3.430 . 0 0 "[ . 1 . 2]" 1
117 1 15 ARG QG 1 18 GLY QA . . 4.020 3.023 2.731 3.318 . 0 0 "[ . 1 . 2]" 1
118 1 15 ARG QG 1 19 GLN H . . 4.070 3.511 2.903 4.029 . 0 0 "[ . 1 . 2]" 1
119 1 15 ARG HG2 1 16 ILE H . . 4.800 3.063 2.631 3.532 . 0 0 "[ . 1 . 2]" 1
120 1 15 ARG HG2 1 19 GLN H . . 4.770 3.834 2.961 4.711 . 0 0 "[ . 1 . 2]" 1
121 1 15 ARG HG3 1 16 ILE H . . 4.800 3.705 3.000 4.615 . 0 0 "[ . 1 . 2]" 1
122 1 15 ARG HG3 1 19 GLN H . . 4.770 4.339 3.621 5.148 0.378 17 0 "[ . 1 . 2]" 1
123 1 16 ILE H 1 16 ILE HB . . 4.150 2.854 2.694 3.010 . 0 0 "[ . 1 . 2]" 1
124 1 16 ILE H 1 16 ILE MG . . 4.050 3.927 3.830 3.979 . 0 0 "[ . 1 . 2]" 1
125 1 16 ILE H 1 17 TYR H . . 4.740 4.227 4.129 4.308 . 0 0 "[ . 1 . 2]" 1
126 1 16 ILE H 1 19 GLN H . . 3.450 3.494 2.960 3.973 0.523 9 3 "[ . +1 * .- 2]" 1
127 1 16 ILE H 1 20 ASP HA . . 3.050 3.234 2.890 3.589 0.539 12 1 "[ . 1 + . 2]" 1
128 1 16 ILE H 1 21 TYR H . . 3.810 4.277 4.063 4.375 0.565 5 13 "[ * *+ * **- *** ** *]" 1
129 1 16 ILE H 1 21 TYR QD . . 4.140 3.190 2.433 4.629 0.489 16 0 "[ . 1 . 2]" 1
130 1 16 ILE H 1 21 TYR QE . . 4.200 3.177 2.351 4.201 0.001 16 0 "[ . 1 . 2]" 1
131 1 16 ILE HA 1 17 TYR HA . . 4.560 4.355 4.321 4.385 . 0 0 "[ . 1 . 2]" 1
132 1 16 ILE HB 1 21 TYR QD . . 4.130 2.852 2.183 3.523 . 0 0 "[ . 1 . 2]" 1
133 1 16 ILE HB 1 21 TYR QE . . 4.240 2.229 2.101 2.669 . 0 0 "[ . 1 . 2]" 1
134 1 16 ILE HB 2 60 VAL QG . . 4.140 2.966 2.588 3.606 . 0 0 "[ . 1 . 2]" 1
135 1 16 ILE MD 1 16 ILE MG . . 3.110 2.202 2.152 2.739 . 0 0 "[ . 1 . 2]" 1
136 1 16 ILE MD 1 21 TYR QD . . 4.470 2.313 2.157 2.676 . 0 0 "[ . 1 . 2]" 1
137 1 16 ILE MD 1 21 TYR QE . . 3.770 3.280 2.258 3.783 0.013 6 0 "[ . 1 . 2]" 1
138 1 16 ILE MD 1 36 ALA HA . . 4.000 2.812 2.132 3.247 . 0 0 "[ . 1 . 2]" 1
139 1 16 ILE MD 1 36 ALA MB . . 3.410 2.912 2.400 3.403 . 0 0 "[ . 1 . 2]" 1
140 1 16 ILE MD 1 39 VAL QG . . 3.430 2.922 2.531 3.368 . 0 0 "[ . 1 . 2]" 1
141 1 16 ILE MD 2 60 VAL QG . . 3.640 2.801 2.404 3.410 . 0 0 "[ . 1 . 2]" 1
142 1 16 ILE MG 1 17 TYR H . . 4.210 2.707 2.538 2.885 . 0 0 "[ . 1 . 2]" 1
143 1 16 ILE MG 1 17 TYR HA . . 4.460 3.975 3.759 4.182 . 0 0 "[ . 1 . 2]" 1
144 1 16 ILE MG 1 21 TYR QD . . 4.480 4.220 3.822 4.646 0.166 13 0 "[ . 1 . 2]" 1
145 1 16 ILE MG 1 21 TYR QE . . 3.470 3.562 2.436 3.857 0.387 1 0 "[ . 1 . 2]" 1
146 1 16 ILE MG 1 39 VAL QG . . 4.720 2.497 2.165 2.857 . 0 0 "[ . 1 . 2]" 1
147 1 16 ILE MG 1 40 ASP HA . . 3.800 2.511 2.225 2.934 . 0 0 "[ . 1 . 2]" 1
148 1 16 ILE MG 2 60 VAL HB . . 4.570 4.593 3.143 5.097 0.527 16 1 "[ . 1 .+ 2]" 1
149 1 16 ILE MG 2 60 VAL QG . . 4.770 2.468 2.179 3.315 . 0 0 "[ . 1 . 2]" 1
150 1 17 TYR H 1 17 TYR QD . . 4.300 3.607 3.104 4.120 . 0 0 "[ . 1 . 2]" 1
151 1 17 TYR H 1 18 GLY H . . 3.930 2.693 2.607 2.886 . 0 0 "[ . 1 . 2]" 1
152 1 17 TYR HA 1 17 TYR QD . . 3.900 2.461 2.177 2.958 . 0 0 "[ . 1 . 2]" 1
153 1 17 TYR QB 1 18 GLY H . . 4.730 3.724 3.248 3.839 . 0 0 "[ . 1 . 2]" 1
154 1 17 TYR QB 1 40 ASP HA . . 4.490 4.131 3.835 4.482 . 0 0 "[ . 1 . 2]" 1
155 1 17 TYR QB 1 43 MET QB . . 4.310 4.127 3.628 4.833 0.523 15 1 "[ . 1 + 2]" 1
156 1 17 TYR QE 1 44 HIS HA . . 3.470 2.910 2.290 3.718 0.248 13 0 "[ . 1 . 2]" 1
157 1 17 TYR QE 1 47 SER HB2 . . 4.440 4.556 4.028 4.982 0.542 6 3 "[ .+ 1 - . *2]" 1
158 1 17 TYR QE 1 47 SER QB . . 3.870 3.963 3.152 4.347 0.477 9 0 "[ . 1 . 2]" 1
159 1 17 TYR QE 1 47 SER HB3 . . 4.440 4.470 3.258 4.966 0.526 9 3 "[ * . +- . 2]" 1
160 1 17 TYR QE 1 58 LEU QD . . 3.720 3.835 2.910 4.274 0.554 13 3 "[ - 1 + * 2]" 1
161 1 18 GLY H 1 19 GLN H . . 3.650 2.770 2.207 3.234 . 0 0 "[ . 1 . 2]" 1
162 1 19 GLN H 1 19 GLN HB2 . . 3.970 2.383 2.188 2.657 . 0 0 "[ . 1 . 2]" 1
163 1 19 GLN H 1 19 GLN QB . . 3.340 2.345 2.165 2.608 . 0 0 "[ . 1 . 2]" 1
164 1 19 GLN H 1 19 GLN HB3 . . 3.970 3.522 3.078 3.791 . 0 0 "[ . 1 . 2]" 1
165 1 19 GLN H 1 19 GLN QG . . 3.710 3.319 2.530 3.978 0.268 8 0 "[ . 1 . 2]" 1
166 1 19 GLN H 1 20 ASP H . . 4.440 4.546 4.451 4.596 0.156 16 0 "[ . 1 . 2]" 1
167 1 19 GLN H 1 21 TYR QE . . 4.340 3.870 3.339 4.687 0.347 7 0 "[ . 1 . 2]" 1
168 1 19 GLN HA 1 19 GLN QG . . 3.420 2.525 2.193 3.059 . 0 0 "[ . 1 . 2]" 1
169 1 19 GLN HA 1 20 ASP H . . 2.950 2.275 2.214 2.350 . 0 0 "[ . 1 . 2]" 1
170 1 19 GLN QB 1 20 ASP H . . 4.290 2.821 2.467 3.306 . 0 0 "[ . 1 . 2]" 1
171 1 19 GLN QB 2 60 VAL QG . . 4.070 4.045 3.814 4.285 0.215 16 0 "[ . 1 . 2]" 1
172 1 19 GLN HB2 1 21 TYR QE . . 3.600 3.054 2.382 3.658 0.058 8 0 "[ . 1 . 2]" 1
173 1 19 GLN HB3 1 21 TYR QE . . 3.600 3.202 2.375 3.984 0.384 15 0 "[ . 1 . 2]" 1
174 1 19 GLN HB3 2 52 MET HG3 . . 4.960 4.948 3.979 5.780 0.820 19 6 "[ * * 1 * .- *+2]" 1
175 1 19 GLN QG 1 20 ASP H . . 4.750 3.844 3.153 4.441 . 0 0 "[ . 1 . 2]" 1
176 1 19 GLN QG 1 21 TYR QE . . 4.280 4.051 3.621 4.654 0.374 18 0 "[ . 1 . 2]" 1
177 1 19 GLN QG 2 52 MET HG3 . . 4.510 4.882 4.329 5.337 0.827 19 7 "[ * -. * 1 * .* *+2]" 1
178 1 20 ASP H 1 21 TYR H . . 4.770 4.517 4.440 4.580 . 0 0 "[ . 1 . 2]" 1
179 1 20 ASP H 1 21 TYR QE . . 4.830 4.968 4.334 5.206 0.376 9 0 "[ . 1 . 2]" 1
180 1 20 ASP HA 1 21 TYR H . . 3.130 2.199 2.170 2.254 . 0 0 "[ . 1 . 2]" 1
181 1 21 TYR H 1 21 TYR QD . . 3.980 3.185 2.754 3.416 . 0 0 "[ . 1 . 2]" 1
182 1 21 TYR H 1 22 THR H . . 4.950 4.365 4.196 4.444 . 0 0 "[ . 1 . 2]" 1
183 1 21 TYR HA 1 21 TYR QD . . 4.300 2.742 2.448 3.006 . 0 0 "[ . 1 . 2]" 1
184 1 21 TYR HA 1 22 THR H . . 3.340 2.237 2.154 2.410 . 0 0 "[ . 1 . 2]" 1
185 1 21 TYR QB 1 22 THR H . . 3.510 2.852 2.337 3.254 . 0 0 "[ . 1 . 2]" 1
186 1 21 TYR QB 1 23 ILE MD . . 4.060 4.017 3.159 4.610 0.550 13 1 "[ . 1 + . 2]" 1
187 1 21 TYR QB 2 64 VAL QG . . 4.510 3.286 2.628 3.666 . 0 0 "[ . 1 . 2]" 1
188 1 21 TYR QD 1 22 THR H . . 4.680 4.055 3.606 4.446 . 0 0 "[ . 1 . 2]" 1
189 1 21 TYR QD 1 23 ILE MD . . 4.810 5.271 4.712 5.415 0.605 7 13 "[ * ** +**** -** * *]" 1
190 1 21 TYR QD 2 52 MET QG . . 4.830 3.677 2.590 5.439 0.609 18 1 "[ . 1 . + 2]" 1
191 1 21 TYR QD 2 60 VAL QG . . 3.550 3.416 3.100 3.585 0.035 11 0 "[ . 1 . 2]" 1
192 1 21 TYR QD 2 61 LEU MD1 . . 4.400 2.859 2.267 3.655 . 0 0 "[ . 1 . 2]" 1
193 1 21 TYR QD 2 64 VAL QG . . 4.990 3.879 2.449 4.396 . 0 0 "[ . 1 . 2]" 1
194 1 21 TYR QE 2 57 LYS HA . . 4.040 3.079 2.154 3.816 . 0 0 "[ . 1 . 2]" 1
195 1 21 TYR QE 2 60 VAL QG . . 3.010 2.551 2.160 2.770 . 0 0 "[ . 1 . 2]" 1
196 1 22 THR H 1 22 THR HB . . 4.080 2.965 2.573 3.623 . 0 0 "[ . 1 . 2]" 1
197 1 22 THR H 1 22 THR MG . . 4.710 3.684 2.843 3.958 . 0 0 "[ . 1 . 2]" 1
198 1 22 THR H 1 23 ILE H . . 4.940 4.280 4.092 4.434 . 0 0 "[ . 1 . 2]" 1
199 1 22 THR H 1 23 ILE MG . . 4.340 3.975 3.391 4.238 . 0 0 "[ . 1 . 2]" 1
200 1 22 THR HB 1 23 ILE H . . 4.850 4.037 3.339 4.349 . 0 0 "[ . 1 . 2]" 1
201 1 22 THR MG 1 23 ILE H . . 4.960 3.186 2.732 3.833 . 0 0 "[ . 1 . 2]" 1
202 1 23 ILE H 1 23 ILE HB . . 3.620 3.800 3.700 3.926 0.306 3 0 "[ . 1 . 2]" 1
203 1 23 ILE H 1 23 ILE MD . . 4.520 3.232 2.094 3.874 . 0 0 "[ . 1 . 2]" 1
204 1 23 ILE H 1 23 ILE QG . . 4.320 2.366 2.093 3.383 . 0 0 "[ . 1 . 2]" 1
205 1 23 ILE H 1 23 ILE MG . . 3.930 2.923 2.453 3.243 . 0 0 "[ . 1 . 2]" 1
206 1 23 ILE H 1 24 VAL H . . 4.740 4.448 4.390 4.556 . 0 0 "[ . 1 . 2]" 1
207 1 23 ILE HA 1 23 ILE MD . . 4.050 4.010 3.577 4.196 0.146 8 0 "[ . 1 . 2]" 1
208 1 23 ILE HA 1 23 ILE MG . . 3.470 2.320 2.185 2.590 . 0 0 "[ . 1 . 2]" 1
209 1 23 ILE HA 1 24 VAL H . . 3.130 2.507 2.347 2.622 . 0 0 "[ . 1 . 2]" 1
210 1 23 ILE HB 1 23 ILE MD . . 3.680 2.649 2.290 3.256 . 0 0 "[ . 1 . 2]" 1
211 1 23 ILE MD 1 23 ILE MG . . 3.270 2.106 1.979 2.173 . 0 0 "[ . 1 . 2]" 1
212 1 23 ILE MD 1 24 VAL H . . 4.850 4.144 3.666 4.739 . 0 0 "[ . 1 . 2]" 1
213 1 23 ILE MD 2 64 VAL HB . . 4.480 4.362 4.190 4.863 0.383 17 0 "[ . 1 . 2]" 1
214 1 23 ILE MD 2 64 VAL MG1 . . 3.160 2.597 2.302 3.447 0.287 17 0 "[ . 1 . 2]" 1
215 1 23 ILE MD 2 64 VAL QG . . 2.760 2.141 2.039 2.432 . 0 0 "[ . 1 . 2]" 1
216 1 23 ILE MD 2 64 VAL MG2 . . 3.160 2.321 2.122 2.609 . 0 0 "[ . 1 . 2]" 1
217 1 23 ILE MD 2 65 GLN QG . . 4.140 4.318 3.246 4.729 0.589 19 7 "[* *. * 1- *. *+2]" 1
218 1 23 ILE QG 1 24 VAL H . . 4.970 3.357 2.582 3.720 . 0 0 "[ . 1 . 2]" 1
219 1 23 ILE QG 1 24 VAL HA . . 4.680 4.244 3.853 4.555 . 0 0 "[ . 1 . 2]" 1
220 1 23 ILE QG 2 64 VAL MG1 . . 4.160 3.694 2.465 4.365 0.205 7 0 "[ . 1 . 2]" 1
221 1 23 ILE QG 2 64 VAL QG . . 3.470 3.276 2.376 3.568 0.098 10 0 "[ . 1 . 2]" 1
222 1 23 ILE QG 2 64 VAL MG2 . . 4.160 3.734 3.104 4.133 . 0 0 "[ . 1 . 2]" 1
223 1 23 ILE MG 1 24 VAL H . . 3.630 3.536 3.302 3.801 0.171 1 0 "[ . 1 . 2]" 1
224 1 23 ILE MG 2 61 LEU MD1 . . 4.360 2.292 2.180 2.931 . 0 0 "[ . 1 . 2]" 1
225 1 23 ILE MG 2 61 LEU MD2 . . 4.780 3.911 3.344 4.990 0.210 17 0 "[ . 1 . 2]" 1
226 1 23 ILE MG 2 65 GLN HA . . 3.700 3.880 3.504 4.218 0.518 8 2 "[ . -+ 1 . 2]" 1
227 1 23 ILE MG 2 65 GLN QB . . 3.770 3.668 2.649 4.204 0.434 3 0 "[ . 1 . 2]" 1
228 1 23 ILE MG 2 65 GLN QG . . 4.500 3.248 2.190 4.388 . 0 0 "[ . 1 . 2]" 1
229 1 24 VAL H 1 24 VAL HB . . 3.490 2.558 2.489 2.626 . 0 0 "[ . 1 . 2]" 1
230 1 24 VAL H 1 24 VAL QG . . 3.940 2.242 2.163 2.467 . 0 0 "[ . 1 . 2]" 1
231 1 24 VAL HA 1 25 GLY H . . 3.340 2.169 2.157 2.201 . 0 0 "[ . 1 . 2]" 1
232 1 24 VAL HB 2 65 GLN QG . . 4.720 4.455 3.460 5.153 0.433 16 0 "[ . 1 . 2]" 1
233 1 24 VAL QG 1 25 GLY H . . 3.610 2.747 2.394 3.007 . 0 0 "[ . 1 . 2]" 1
234 1 26 ALA H 1 27 GLU H . . 4.070 2.869 2.132 3.907 . 0 0 "[ . 1 . 2]" 1
235 1 26 ALA HA 1 27 GLU H . . 3.470 2.885 2.318 3.464 . 0 0 "[ . 1 . 2]" 1
236 1 26 ALA MB 1 27 GLU H . . 3.660 3.507 2.767 3.718 0.058 12 0 "[ . 1 . 2]" 1
237 1 27 GLU H 1 27 GLU QB . . 3.880 2.656 2.127 3.355 . 0 0 "[ . 1 . 2]" 1
238 1 27 GLU H 1 27 GLU QG . . 3.840 3.664 2.074 4.319 0.479 4 0 "[ . 1 . 2]" 1
239 1 27 GLU H 1 28 SER H . . 4.410 3.139 2.202 4.387 . 0 0 "[ . 1 . 2]" 1
240 1 27 GLU HA 1 27 GLU QG . . 3.690 2.694 2.151 3.383 . 0 0 "[ . 1 . 2]" 1
241 1 27 GLU HA 1 28 SER H . . 3.370 3.340 2.566 3.587 0.217 2 0 "[ . 1 . 2]" 1
242 1 27 GLU QB 1 28 SER H . . 4.070 2.257 2.019 3.597 . 0 0 "[ . 1 . 2]" 1
243 1 27 GLU QB 2 72 LYS H . . 4.890 5.279 4.608 5.488 0.598 20 10 "[ *. * *1 * *** *-+]" 1
244 1 28 SER H 1 31 HIS H . . 4.390 4.419 4.064 4.904 0.514 20 1 "[ . 1 . +]" 1
245 1 28 SER H 1 31 HIS QB . . 4.060 3.191 2.628 4.292 0.232 20 0 "[ . 1 . 2]" 1
246 1 29 PRO HA 1 32 ILE H . . 4.300 4.009 3.811 4.459 0.159 10 0 "[ . 1 . 2]" 1
247 1 29 PRO HA 1 32 ILE MD . . 4.570 2.357 2.165 2.858 . 0 0 "[ . 1 . 2]" 1
248 1 29 PRO HA 1 32 ILE QG . . 4.570 2.560 2.176 4.344 . 0 0 "[ . 1 . 2]" 1
249 1 29 PRO QB 1 30 ALA H . . 4.010 3.023 2.322 3.594 . 0 0 "[ . 1 . 2]" 1
250 1 29 PRO QG 1 30 ALA H . . 3.630 2.800 2.376 3.996 0.366 10 0 "[ . 1 . 2]" 1
251 1 30 ALA H 1 30 ALA MB . . 3.030 2.282 2.240 2.373 . 0 0 "[ . 1 . 2]" 1
252 1 30 ALA H 1 31 HIS H . . 3.690 2.404 2.184 2.643 . 0 0 "[ . 1 . 2]" 1
253 1 30 ALA HA 1 33 ARG H . . 4.360 3.656 3.491 3.900 . 0 0 "[ . 1 . 2]" 1
254 1 30 ALA HA 1 33 ARG QB . . 3.670 2.884 2.280 3.598 . 0 0 "[ . 1 . 2]" 1
255 1 30 ALA HA 1 33 ARG QG . . 4.180 3.796 2.187 4.650 0.470 19 0 "[ . 1 . 2]" 1
256 1 30 ALA MB 1 31 HIS H . . 3.470 2.725 2.331 3.347 . 0 0 "[ . 1 . 2]" 1
257 1 30 ALA MB 1 31 HIS HA . . 4.190 3.859 3.774 4.049 . 0 0 "[ . 1 . 2]" 1
258 1 30 ALA MB 1 33 ARG QD . . 4.940 4.708 3.539 5.500 0.560 1 2 "[+ .- 1 . 2]" 1
259 1 31 HIS H 1 31 HIS QB . . 3.540 2.184 2.079 2.360 . 0 0 "[ . 1 . 2]" 1
260 1 31 HIS H 1 32 ILE H . . 3.530 2.620 2.210 2.856 . 0 0 "[ . 1 . 2]" 1
261 1 31 HIS HA 1 34 LEU H . . 4.570 3.620 3.306 3.894 . 0 0 "[ . 1 . 2]" 1
262 1 31 HIS HA 1 34 LEU QB . . 3.840 4.012 2.747 4.394 0.554 14 4 "[ *. 1 -+. * 2]" 1
263 1 31 HIS HA 1 34 LEU QD . . 3.830 2.380 2.150 3.565 . 0 0 "[ . 1 . 2]" 1
264 1 31 HIS HA 1 35 VAL QG . . 4.970 4.177 3.730 4.801 . 0 0 "[ . 1 . 2]" 1
265 1 31 HIS QB 1 32 ILE H . . 3.890 2.566 2.268 2.852 . 0 0 "[ . 1 . 2]" 1
266 1 32 ILE H 1 32 ILE HB . . 3.700 3.647 3.609 3.742 0.042 17 0 "[ . 1 . 2]" 1
267 1 32 ILE H 1 32 ILE MD . . 4.100 3.512 2.049 3.780 . 0 0 "[ . 1 . 2]" 1
268 1 32 ILE H 1 32 ILE HG12 . . 4.050 2.307 2.129 3.616 . 0 0 "[ . 1 . 2]" 1
269 1 32 ILE H 1 32 ILE QG . . 3.550 2.248 2.046 3.387 . 0 0 "[ . 1 . 2]" 1
270 1 32 ILE H 1 32 ILE HG13 . . 4.050 3.298 2.511 4.087 0.037 17 0 "[ . 1 . 2]" 1
271 1 32 ILE H 1 32 ILE MG . . 3.970 2.216 2.096 2.633 . 0 0 "[ . 1 . 2]" 1
272 1 32 ILE H 1 33 ARG H . . 3.960 2.647 2.339 2.828 . 0 0 "[ . 1 . 2]" 1
273 1 32 ILE HA 1 32 ILE MD . . 4.190 4.142 3.684 4.209 0.019 13 0 "[ . 1 . 2]" 1
274 1 32 ILE HA 1 32 ILE MG . . 3.600 2.320 2.207 2.601 . 0 0 "[ . 1 . 2]" 1
275 1 32 ILE HA 1 35 VAL H . . 4.390 3.350 3.062 3.542 . 0 0 "[ . 1 . 2]" 1
276 1 32 ILE HA 1 35 VAL HB . . 4.000 3.233 2.523 4.594 0.594 19 1 "[ . 1 . +2]" 1
277 1 32 ILE HA 1 36 ALA H . . 4.400 4.869 4.530 5.016 0.616 10 11 "[ ** *+* ** **-*]" 1
278 1 32 ILE MD 1 32 ILE MG . . 2.440 2.131 2.066 2.316 . 0 0 "[ . 1 . 2]" 1
279 1 32 ILE MD 1 33 ARG H . . 4.890 4.133 2.390 4.749 . 0 0 "[ . 1 . 2]" 1
280 1 32 ILE QG 1 32 ILE MG . . 3.100 2.312 2.177 2.394 . 0 0 "[ . 1 . 2]" 1
281 1 32 ILE QG 1 33 ARG H . . 3.660 2.714 2.219 3.393 . 0 0 "[ . 1 . 2]" 1
282 1 32 ILE QG 1 33 ARG HA . . 3.590 3.436 3.193 3.935 0.345 5 0 "[ . 1 . 2]" 1
283 1 32 ILE QG 1 33 ARG QB . . 3.960 3.716 3.244 4.299 0.339 14 0 "[ . 1 . 2]" 1
284 1 32 ILE MG 1 33 ARG H . . 4.500 4.097 3.942 4.265 . 0 0 "[ . 1 . 2]" 1
285 1 33 ARG H 1 33 ARG QB . . 2.950 2.245 2.119 2.512 . 0 0 "[ . 1 . 2]" 1
286 1 33 ARG H 1 33 ARG QD . . 4.960 3.669 2.710 4.664 . 0 0 "[ . 1 . 2]" 1
287 1 33 ARG H 1 33 ARG QG . . 4.760 3.350 2.236 4.065 . 0 0 "[ . 1 . 2]" 1
288 1 33 ARG H 1 34 LEU H . . 3.450 2.427 2.132 2.584 . 0 0 "[ . 1 . 2]" 1
289 1 33 ARG HA 1 33 ARG QD . . 4.430 3.061 2.150 4.171 . 0 0 "[ . 1 . 2]" 1
290 1 33 ARG QB 1 33 ARG HD2 . . 3.550 2.991 2.253 3.320 . 0 0 "[ . 1 . 2]" 1
291 1 33 ARG QB 1 33 ARG QD . . 3.090 2.329 2.126 2.863 . 0 0 "[ . 1 . 2]" 1
292 1 33 ARG QB 1 33 ARG HD3 . . 3.550 2.562 2.237 3.441 . 0 0 "[ . 1 . 2]" 1
293 1 33 ARG QB 1 34 LEU H . . 3.100 2.761 2.556 3.045 . 0 0 "[ . 1 . 2]" 1
294 1 33 ARG QB 1 34 LEU QD . . 4.200 4.045 2.654 4.723 0.523 19 1 "[ . 1 . +2]" 1
295 1 34 LEU H 1 34 LEU QB . . 3.300 2.536 2.189 2.809 . 0 0 "[ . 1 . 2]" 1
296 1 34 LEU H 1 34 LEU QD . . 4.390 2.936 2.330 3.771 . 0 0 "[ . 1 . 2]" 1
297 1 34 LEU H 1 34 LEU HG . . 4.100 2.566 2.132 4.476 0.376 18 0 "[ . 1 . 2]" 1
298 1 34 LEU H 1 35 VAL H . . 3.630 2.417 2.179 2.597 . 0 0 "[ . 1 . 2]" 1
299 1 34 LEU HA 1 34 LEU QD . . 3.250 3.202 2.165 3.440 0.190 2 0 "[ . 1 . 2]" 1
300 1 34 LEU HA 1 34 LEU HG . . 4.040 3.502 2.347 3.713 . 0 0 "[ . 1 . 2]" 1
301 1 34 LEU HA 1 37 ALA MB . . 3.670 2.688 2.182 3.170 . 0 0 "[ . 1 . 2]" 1
302 1 34 LEU QB 1 34 LEU HG . . 2.420 2.492 2.389 2.528 0.108 14 0 "[ . 1 . 2]" 1
303 1 34 LEU QB 1 35 VAL H . . 3.750 3.540 2.800 3.779 0.029 20 0 "[ . 1 . 2]" 1
304 1 34 LEU HB2 1 35 VAL H . . 4.370 4.026 2.870 4.303 . 0 0 "[ . 1 . 2]" 1
305 1 34 LEU HB3 1 35 VAL H . . 4.370 4.011 2.863 4.293 . 0 0 "[ . 1 . 2]" 1
306 1 34 LEU QD 1 35 VAL H . . 3.830 3.338 2.848 4.164 0.334 16 0 "[ . 1 . 2]" 1
307 1 34 LEU QD 2 71 LEU QD . . 3.010 2.409 2.163 3.461 0.451 7 0 "[ . 1 . 2]" 1
308 1 34 LEU MD1 1 35 VAL H . . 4.990 3.540 2.886 4.887 . 0 0 "[ . 1 . 2]" 1
309 1 34 LEU MD2 1 35 VAL H . . 4.990 4.287 4.016 4.965 . 0 0 "[ . 1 . 2]" 1
310 1 34 LEU MD2 2 71 LEU QD . . 4.250 3.514 2.244 4.675 0.425 16 0 "[ . 1 . 2]" 1
311 1 35 VAL H 1 35 VAL HB . . 3.680 2.668 2.458 3.638 . 0 0 "[ . 1 . 2]" 1
312 1 35 VAL H 1 36 ALA H . . 3.560 2.728 2.592 2.819 . 0 0 "[ . 1 . 2]" 1
313 1 35 VAL H 1 36 ALA MB . . 4.690 4.368 4.253 4.461 . 0 0 "[ . 1 . 2]" 1
314 1 35 VAL H 1 37 ALA H . . 4.930 4.198 3.953 4.455 . 0 0 "[ . 1 . 2]" 1
315 1 35 VAL HA 1 38 PHE H . . 4.790 3.557 3.275 3.805 . 0 0 "[ . 1 . 2]" 1
316 1 35 VAL HA 1 38 PHE QB . . 4.510 2.756 2.226 3.133 . 0 0 "[ . 1 . 2]" 1
317 1 35 VAL HA 2 67 ALA MB . . 4.380 3.891 3.086 4.175 . 0 0 "[ . 1 . 2]" 1
318 1 35 VAL HA 2 71 LEU QD . . 3.620 3.018 2.434 3.822 0.202 6 0 "[ . 1 . 2]" 1
319 1 35 VAL HB 1 36 ALA H . . 3.780 2.606 2.306 3.846 0.066 2 0 "[ . 1 . 2]" 1
320 1 35 VAL HB 1 36 ALA HA . . 5.000 4.242 4.064 4.479 . 0 0 "[ . 1 . 2]" 1
321 1 35 VAL HB 2 64 VAL QG . . 4.510 3.305 2.439 3.737 . 0 0 "[ . 1 . 2]" 1
322 1 35 VAL QG 1 36 ALA H . . 3.740 3.026 2.168 3.276 . 0 0 "[ . 1 . 2]" 1
323 1 35 VAL QG 1 36 ALA HA . . 3.990 3.342 3.179 3.553 . 0 0 "[ . 1 . 2]" 1
324 1 35 VAL QG 1 36 ALA MB . . 3.500 3.736 2.884 4.028 0.528 16 1 "[ . 1 .+ 2]" 1
325 1 35 VAL QG 1 38 PHE H . . 4.860 4.369 4.164 4.537 . 0 0 "[ . 1 . 2]" 1
326 1 35 VAL QG 1 38 PHE QD . . 4.400 4.083 2.875 4.927 0.527 7 1 "[ . + 1 . 2]" 1
327 1 35 VAL QG 2 67 ALA MB . . 4.140 2.309 2.084 3.108 . 0 0 "[ . 1 . 2]" 1
328 1 35 VAL QG 2 68 SER H . . 3.980 2.912 2.527 3.426 . 0 0 "[ . 1 . 2]" 1
329 1 35 VAL QG 2 68 SER HA . . 4.110 2.488 2.050 2.979 . 0 0 "[ . 1 . 2]" 1
330 1 35 VAL MG1 2 71 LEU QD . . 4.510 2.887 2.093 3.861 . 0 0 "[ . 1 . 2]" 1
331 1 36 ALA H 1 36 ALA MB . . 3.260 2.214 2.201 2.242 . 0 0 "[ . 1 . 2]" 1
332 1 36 ALA H 1 37 ALA H . . 3.660 2.697 2.527 2.849 . 0 0 "[ . 1 . 2]" 1
333 1 36 ALA H 1 37 ALA MB . . 4.570 4.364 4.251 4.484 . 0 0 "[ . 1 . 2]" 1
334 1 36 ALA H 2 64 VAL QG . . 4.150 3.765 3.478 4.079 . 0 0 "[ . 1 . 2]" 1
335 1 36 ALA HA 1 39 VAL HB . . 3.930 3.364 3.051 4.464 0.534 11 1 "[ . 1+ . 2]" 1
336 1 36 ALA HA 1 39 VAL QG . . 4.030 3.190 2.457 3.624 . 0 0 "[ . 1 . 2]" 1
337 1 36 ALA HA 2 64 VAL HB . . 4.370 4.233 3.930 4.739 0.369 16 0 "[ . 1 . 2]" 1
338 1 36 ALA HA 2 64 VAL QG . . 3.760 2.562 2.200 3.114 . 0 0 "[ . 1 . 2]" 1
339 1 36 ALA MB 1 37 ALA H . . 3.550 2.479 2.366 2.673 . 0 0 "[ . 1 . 2]" 1
340 1 36 ALA MB 1 39 VAL QG . . 4.180 4.267 3.572 4.584 0.404 19 0 "[ . 1 . 2]" 1
341 1 36 ALA MB 2 64 VAL QG . . 3.540 3.156 2.613 3.661 0.121 16 0 "[ . 1 . 2]" 1
342 1 37 ALA H 1 37 ALA MB . . 3.060 2.234 2.223 2.262 . 0 0 "[ . 1 . 2]" 1
343 1 37 ALA H 1 38 PHE H . . 3.670 2.604 2.398 2.706 . 0 0 "[ . 1 . 2]" 1
344 1 37 ALA HA 1 40 ASP H . . 4.690 3.463 3.365 3.658 . 0 0 "[ . 1 . 2]" 1
345 1 37 ALA HA 1 40 ASP QB . . 3.590 2.415 2.193 2.766 . 0 0 "[ . 1 . 2]" 1
346 1 37 ALA MB 1 38 PHE H . . 3.400 2.697 2.554 2.892 . 0 0 "[ . 1 . 2]" 1
347 1 37 ALA MB 1 38 PHE HA . . 4.410 3.860 3.816 3.919 . 0 0 "[ . 1 . 2]" 1
348 1 37 ALA MB 1 39 VAL H . . 4.870 4.699 4.498 4.868 . 0 0 "[ . 1 . 2]" 1
349 1 37 ALA MB 1 40 ASP QB . . 4.510 3.765 3.529 4.092 . 0 0 "[ . 1 . 2]" 1
350 1 38 PHE H 1 38 PHE HB2 . . 3.380 2.519 2.264 2.771 . 0 0 "[ . 1 . 2]" 1
351 1 38 PHE H 1 38 PHE HB3 . . 3.380 2.529 2.281 2.787 . 0 0 "[ . 1 . 2]" 1
352 1 38 PHE H 1 38 PHE QD . . 4.370 4.146 4.018 4.187 . 0 0 "[ . 1 . 2]" 1
353 1 38 PHE H 1 39 VAL H . . 4.060 2.682 2.586 2.767 . 0 0 "[ . 1 . 2]" 1
354 1 38 PHE HA 1 38 PHE QD . . 3.740 2.613 2.171 3.079 . 0 0 "[ . 1 . 2]" 1
355 1 38 PHE HA 1 41 ASP HB2 . . 4.460 3.972 2.753 4.749 0.289 6 0 "[ . 1 . 2]" 1
356 1 38 PHE HA 1 41 ASP HB3 . . 4.460 3.545 2.713 4.984 0.524 11 1 "[ . 1+ . 2]" 1
357 1 38 PHE QB 1 39 VAL H . . 4.020 2.480 2.301 2.632 . 0 0 "[ . 1 . 2]" 1
358 1 38 PHE QB 2 71 LEU QD . . 4.060 3.555 2.851 4.467 0.407 6 0 "[ . 1 . 2]" 1
359 1 38 PHE QD 1 39 VAL H . . 4.400 3.636 3.200 4.131 . 0 0 "[ . 1 . 2]" 1
360 1 38 PHE QD 1 66 ILE MG . . 4.100 3.646 3.070 4.014 . 0 0 "[ . 1 . 2]" 1
361 1 38 PHE QD 2 67 ALA MB . . 3.510 2.900 2.222 3.992 0.482 13 0 "[ . 1 . 2]" 1
362 1 38 PHE QD 2 71 LEU QD . . 3.790 3.781 2.840 4.339 0.549 6 4 "[ .+ 1* -. *2]" 1
363 1 38 PHE QE 1 66 ILE MG . . 3.880 2.449 2.151 3.134 . 0 0 "[ . 1 . 2]" 1
364 1 38 PHE QE 2 67 ALA MB . . 4.350 3.571 2.544 4.867 0.517 13 1 "[ . 1 + . 2]" 1
365 1 39 VAL H 1 39 VAL HB . . 3.910 2.553 2.473 2.621 . 0 0 "[ . 1 . 2]" 1
366 1 39 VAL H 1 39 VAL MG1 . . 3.980 3.698 2.182 3.796 . 0 0 "[ . 1 . 2]" 1
367 1 39 VAL H 1 39 VAL MG2 . . 3.980 2.317 2.171 3.777 . 0 0 "[ . 1 . 2]" 1
368 1 39 VAL H 1 40 ASP H . . 4.050 2.542 2.464 2.698 . 0 0 "[ . 1 . 2]" 1
369 1 39 VAL HA 1 39 VAL MG1 . . 3.720 2.428 2.339 3.217 . 0 0 "[ . 1 . 2]" 1
370 1 39 VAL HA 1 39 VAL MG2 . . 3.720 2.350 2.236 2.411 . 0 0 "[ . 1 . 2]" 1
371 1 39 VAL HA 1 42 LYS H . . 4.460 3.358 3.113 3.508 . 0 0 "[ . 1 . 2]" 1
372 1 39 VAL HB 1 40 ASP H . . 4.120 2.695 2.440 3.941 . 0 0 "[ . 1 . 2]" 1
373 1 39 VAL HB 2 60 VAL QG . . 4.720 4.357 3.952 5.209 0.489 12 0 "[ . 1 . 2]" 1
374 1 39 VAL HB 2 64 VAL HA . . 4.690 4.164 3.051 4.536 . 0 0 "[ . 1 . 2]" 1
375 1 39 VAL QG 1 40 ASP H . . 3.640 3.194 2.225 3.314 . 0 0 "[ . 1 . 2]" 1
376 1 39 VAL QG 1 43 MET H . . 4.850 3.716 3.430 3.991 . 0 0 "[ . 1 . 2]" 1
377 1 39 VAL QG 1 62 THR HB . . 3.590 3.501 2.871 4.153 0.563 3 1 "[ + . 1 . 2]" 1
378 1 39 VAL QG 2 60 VAL QG . . 4.880 2.656 2.275 3.311 . 0 0 "[ . 1 . 2]" 1
379 1 39 VAL QG 2 63 ALA MB . . 2.870 2.279 2.128 2.587 . 0 0 "[ . 1 . 2]" 1
380 1 39 VAL QG 2 64 VAL H . . 4.560 3.139 2.985 3.371 . 0 0 "[ . 1 . 2]" 1
381 1 39 VAL QG 2 64 VAL HB . . 3.830 2.644 2.163 2.937 . 0 0 "[ . 1 . 2]" 1
382 1 39 VAL QG 2 67 ALA MB . . 4.040 2.632 2.288 3.471 . 0 0 "[ . 1 . 2]" 1
383 1 39 VAL MG1 1 40 ASP H . . 4.370 3.466 2.239 3.679 . 0 0 "[ . 1 . 2]" 1
384 1 39 VAL MG1 2 63 ALA MB . . 3.890 2.441 2.225 3.815 . 0 0 "[ . 1 . 2]" 1
385 1 39 VAL MG1 2 64 VAL HA . . 3.640 3.562 2.988 4.027 0.387 8 0 "[ . 1 . 2]" 1
386 1 39 VAL MG2 1 40 ASP H . . 4.370 3.798 3.689 3.919 . 0 0 "[ . 1 . 2]" 1
387 1 39 VAL MG2 2 63 ALA MB . . 3.170 3.005 2.232 3.503 0.333 15 0 "[ . 1 . 2]" 1
388 1 39 VAL MG2 2 64 VAL HA . . 3.640 2.179 2.047 3.190 . 0 0 "[ . 1 . 2]" 1
389 1 40 ASP H 1 40 ASP QB . . 3.580 2.224 2.156 2.268 . 0 0 "[ . 1 . 2]" 1
390 1 40 ASP HA 1 43 MET QB . . 4.060 3.267 2.474 4.444 0.384 19 0 "[ . 1 . 2]" 1
391 1 40 ASP QB 1 41 ASP H . . 3.460 2.506 2.306 2.761 . 0 0 "[ . 1 . 2]" 1
392 1 41 ASP H 1 41 ASP HB2 . . 3.940 2.545 2.157 3.005 . 0 0 "[ . 1 . 2]" 1
393 1 41 ASP H 1 41 ASP QB . . 3.350 2.220 2.124 2.293 . 0 0 "[ . 1 . 2]" 1
394 1 41 ASP H 1 41 ASP HB3 . . 3.940 2.668 2.187 3.545 . 0 0 "[ . 1 . 2]" 1
395 1 41 ASP H 1 42 LYS H . . 3.790 2.615 2.443 2.755 . 0 0 "[ . 1 . 2]" 1
396 1 41 ASP H 1 42 LYS QB . . 4.800 4.391 4.183 4.712 . 0 0 "[ . 1 . 2]" 1
397 1 41 ASP HA 1 44 HIS QB . . 4.160 2.630 2.194 4.427 0.267 9 0 "[ . 1 . 2]" 1
398 1 41 ASP QB 1 42 LYS H . . 3.990 2.591 2.329 2.769 . 0 0 "[ . 1 . 2]" 1
399 1 41 ASP QB 1 42 LYS HA . . 4.390 4.082 3.758 4.479 0.089 8 0 "[ . 1 . 2]" 1
400 1 41 ASP QB 1 42 LYS QB . . 4.730 4.095 3.866 4.662 . 0 0 "[ . 1 . 2]" 1
401 1 41 ASP HB2 1 42 LYS H . . 4.770 3.677 2.622 4.054 . 0 0 "[ . 1 . 2]" 1
402 1 41 ASP HB3 1 42 LYS H . . 4.770 2.739 2.356 3.371 . 0 0 "[ . 1 . 2]" 1
403 1 42 LYS H 1 42 LYS QB . . 3.530 2.246 2.175 2.441 . 0 0 "[ . 1 . 2]" 1
404 1 42 LYS H 1 42 LYS QD . . 4.880 4.335 3.919 4.563 . 0 0 "[ . 1 . 2]" 1
405 1 42 LYS H 1 42 LYS QG . . 4.250 3.510 2.280 4.036 . 0 0 "[ . 1 . 2]" 1
406 1 42 LYS H 1 43 MET H . . 3.760 2.736 2.607 2.896 . 0 0 "[ . 1 . 2]" 1
407 1 42 LYS H 1 44 HIS H . . 4.990 4.006 3.756 4.593 . 0 0 "[ . 1 . 2]" 1
408 1 42 LYS H 1 62 THR MG . . 4.570 4.745 4.307 5.087 0.517 5 1 "[ + 1 . 2]" 1
409 1 42 LYS HA 1 42 LYS QD . . 4.070 3.284 2.173 4.161 0.091 11 0 "[ . 1 . 2]" 1
410 1 42 LYS HA 1 42 LYS QG . . 3.790 2.424 2.171 3.027 . 0 0 "[ . 1 . 2]" 1
411 1 42 LYS HA 1 45 GLU QG . . 3.550 2.441 2.146 3.803 0.253 9 0 "[ . 1 . 2]" 1
412 1 42 LYS HA 1 62 THR MG . . 4.380 4.099 3.642 4.483 0.103 14 0 "[ . 1 . 2]" 1
413 1 42 LYS QB 1 43 MET H . . 3.940 2.561 2.288 2.753 . 0 0 "[ . 1 . 2]" 1
414 1 42 LYS QD 1 62 THR HA . . 4.580 4.152 3.061 4.977 0.397 4 0 "[ . 1 . 2]" 1
415 1 42 LYS QD 1 66 ILE H . . 3.900 4.233 3.602 4.497 0.597 12 9 "[* *** *- + * *2]" 1
416 1 42 LYS QD 1 66 ILE HA . . 4.270 3.908 3.117 4.669 0.399 15 0 "[ . 1 . 2]" 1
417 1 42 LYS QE 1 45 GLU QG . . 4.720 4.162 2.544 5.242 0.522 11 1 "[ . 1+ . 2]" 1
418 1 42 LYS QG 1 43 MET H . . 4.430 3.963 3.294 4.366 . 0 0 "[ . 1 . 2]" 1
419 1 42 LYS QG 1 45 GLU QG . . 4.520 3.638 2.829 5.060 0.540 9 1 "[ . +1 . 2]" 1
420 1 43 MET H 1 43 MET QB . . 3.450 2.362 2.168 2.684 . 0 0 "[ . 1 . 2]" 1
421 1 43 MET H 1 44 HIS H . . 3.780 2.587 2.415 2.922 . 0 0 "[ . 1 . 2]" 1
422 1 43 MET H 1 58 LEU QD . . 4.760 4.980 4.211 5.390 0.630 4 6 "[ **+. * *1- . 2]" 1
423 1 43 MET H 1 62 THR HB . . 4.710 4.826 4.380 5.319 0.609 3 3 "[ *+ . - . 2]" 1
424 1 43 MET H 1 62 THR MG . . 4.410 3.142 2.814 3.474 . 0 0 "[ . 1 . 2]" 1
425 1 43 MET HA 1 62 THR HB . . 4.570 4.436 3.972 4.698 0.128 19 0 "[ . 1 . 2]" 1
426 1 43 MET HA 1 62 THR MG . . 3.970 2.249 2.093 2.977 . 0 0 "[ . 1 . 2]" 1
427 1 43 MET QB 1 44 HIS H . . 3.790 2.999 2.356 3.866 0.076 19 0 "[ . 1 . 2]" 1
428 1 43 MET QB 1 58 LEU QD . . 3.540 2.820 2.208 3.754 0.214 3 0 "[ . 1 . 2]" 1
429 1 43 MET QB 1 58 LEU HG . . 4.720 4.810 4.024 5.268 0.548 17 5 "[ . ** * .-+ 2]" 1
430 1 43 MET QB 1 62 THR MG . . 3.850 3.147 2.133 3.977 0.127 9 0 "[ . 1 . 2]" 1
431 1 43 MET HB2 1 44 HIS H . . 4.480 3.288 2.438 4.353 . 0 0 "[ . 1 . 2]" 1
432 1 43 MET HB3 1 44 HIS H . . 4.480 3.684 2.710 4.339 . 0 0 "[ . 1 . 2]" 1
433 1 44 HIS H 1 44 HIS QB . . 3.260 2.224 2.133 2.478 . 0 0 "[ . 1 . 2]" 1
434 1 44 HIS H 1 45 GLU H . . 3.310 2.608 2.184 2.883 . 0 0 "[ . 1 . 2]" 1
435 1 44 HIS H 1 58 LEU QD . . 4.740 4.846 4.258 5.149 0.409 7 0 "[ . 1 . 2]" 1
436 1 44 HIS HA 1 47 SER H . . 4.280 3.581 3.212 3.945 . 0 0 "[ . 1 . 2]" 1
437 1 44 HIS HA 1 58 LEU QD . . 4.590 4.426 3.690 4.963 0.373 8 0 "[ . 1 . 2]" 1
438 1 44 HIS QB 1 45 GLU H . . 3.680 2.738 2.308 3.712 0.032 9 0 "[ . 1 . 2]" 1
439 1 44 HIS QB 1 45 GLU HA . . 4.850 4.018 3.699 4.621 . 0 0 "[ . 1 . 2]" 1
440 1 45 GLU H 1 45 GLU HB2 . . 3.660 3.587 2.807 3.714 0.054 6 0 "[ . 1 . 2]" 1
441 1 45 GLU H 1 45 GLU QB . . 3.030 2.508 2.170 2.892 . 0 0 "[ . 1 . 2]" 1
442 1 45 GLU H 1 45 GLU HB3 . . 3.660 2.564 2.259 3.029 . 0 0 "[ . 1 . 2]" 1
443 1 45 GLU H 1 45 GLU HG2 . . 4.190 2.413 2.117 4.247 0.057 9 0 "[ . 1 . 2]" 1
444 1 45 GLU H 1 45 GLU HG3 . . 4.190 3.382 2.517 4.527 0.337 9 0 "[ . 1 . 2]" 1
445 1 45 GLU H 1 46 PHE H . . 3.520 2.509 2.147 2.761 . 0 0 "[ . 1 . 2]" 1
446 1 45 GLU HA 1 45 GLU QG . . 3.740 3.309 2.664 3.368 . 0 0 "[ . 1 . 2]" 1
447 1 45 GLU QB 1 45 GLU QG . . 2.360 2.088 2.079 2.095 . 0 0 "[ . 1 . 2]" 1
448 1 45 GLU QB 1 46 PHE H . . 3.930 3.573 2.449 3.848 . 0 0 "[ . 1 . 2]" 1
449 1 45 GLU HB2 1 46 PHE H . . 4.640 4.076 3.749 4.312 . 0 0 "[ . 1 . 2]" 1
450 1 45 GLU HB3 1 46 PHE H . . 4.640 3.999 2.477 4.340 . 0 0 "[ . 1 . 2]" 1
451 1 45 GLU QG 1 46 PHE H . . 4.690 2.508 2.140 2.962 . 0 0 "[ . 1 . 2]" 1
452 1 45 GLU QG 1 46 PHE HA . . 4.520 3.402 3.171 3.752 . 0 0 "[ . 1 . 2]" 1
453 1 46 PHE H 1 46 PHE HB2 . . 3.800 2.291 2.180 2.479 . 0 0 "[ . 1 . 2]" 1
454 1 46 PHE H 1 46 PHE HB3 . . 3.800 3.500 2.719 3.682 . 0 0 "[ . 1 . 2]" 1
455 1 46 PHE H 1 46 PHE QD . . 3.970 3.244 2.611 4.150 0.180 3 0 "[ . 1 . 2]" 1
456 1 46 PHE H 1 47 SER H . . 2.940 2.367 2.185 2.560 . 0 0 "[ . 1 . 2]" 1
457 1 46 PHE H 1 58 LEU QD . . 4.620 3.775 3.308 4.121 . 0 0 "[ . 1 . 2]" 1
458 1 46 PHE HA 1 46 PHE QD . . 3.920 2.397 2.126 2.705 . 0 0 "[ . 1 . 2]" 1
459 1 46 PHE HA 1 49 LYS QB . . 4.390 3.217 2.455 3.926 . 0 0 "[ . 1 . 2]" 1
460 1 46 PHE HA 1 49 LYS QD . . 4.840 4.340 2.820 5.146 0.306 17 0 "[ . 1 . 2]" 1
461 1 46 PHE HA 1 49 LYS HG2 . . 4.600 2.838 2.139 4.286 . 0 0 "[ . 1 . 2]" 1
462 1 46 PHE HA 1 49 LYS HG3 . . 4.600 3.078 2.188 5.110 0.510 1 1 "[+ . 1 . 2]" 1
463 1 46 PHE QB 1 47 SER H . . 3.720 3.104 2.912 3.440 . 0 0 "[ . 1 . 2]" 1
464 1 46 PHE QB 1 58 LEU QD . . 3.960 2.237 2.102 2.636 . 0 0 "[ . 1 . 2]" 1
465 1 46 PHE QB 1 58 LEU HG . . 4.480 3.777 2.681 4.794 0.314 6 0 "[ . 1 . 2]" 1
466 1 46 PHE QD 1 58 LEU MD1 . . 4.830 4.194 2.387 5.308 0.478 20 0 "[ . 1 . 2]" 1
467 1 46 PHE QD 1 58 LEU QD . . 4.100 3.622 2.352 4.040 . 0 0 "[ . 1 . 2]" 1
468 1 46 PHE QD 1 58 LEU MD2 . . 4.830 4.262 3.213 5.117 0.287 9 0 "[ . 1 . 2]" 1
469 1 46 PHE QD 1 61 LEU QD . . 4.650 2.855 2.170 4.108 . 0 0 "[ . 1 . 2]" 1
470 1 46 PHE QD 1 62 THR H . . 4.990 4.988 3.524 5.573 0.583 17 1 "[ . 1 . + 2]" 1
471 1 46 PHE QD 1 62 THR HB . . 4.070 4.484 4.018 4.688 0.618 4 11 "[* *+. **1*** . -**]" 1
472 1 46 PHE QD 1 62 THR MG . . 4.330 2.317 2.073 4.276 . 0 0 "[ . 1 . 2]" 1
473 1 47 SER H 1 47 SER HB2 . . 3.690 2.789 2.225 3.626 . 0 0 "[ . 1 . 2]" 1
474 1 47 SER H 1 47 SER HB3 . . 3.690 3.336 2.423 3.616 . 0 0 "[ . 1 . 2]" 1
475 1 47 SER H 1 48 GLU H . . 3.500 2.586 2.465 2.697 . 0 0 "[ . 1 . 2]" 1
476 1 47 SER H 1 58 LEU QD . . 3.630 2.958 2.728 3.319 . 0 0 "[ . 1 . 2]" 1
477 1 47 SER H 1 58 LEU HG . . 4.360 4.710 4.243 4.974 0.614 7 9 "[ ***. + *1* *-. *2]" 1
478 1 47 SER HA 1 49 LYS H . . 4.150 3.838 3.630 4.071 . 0 0 "[ . 1 . 2]" 1
479 1 47 SER HA 1 50 GLN H . . 4.300 3.651 3.330 4.016 . 0 0 "[ . 1 . 2]" 1
480 1 47 SER HA 1 58 LEU QD . . 4.000 2.208 2.105 2.439 . 0 0 "[ . 1 . 2]" 1
481 1 47 SER QB 1 58 LEU QD . . 3.410 3.091 2.239 3.639 0.229 17 0 "[ . 1 . 2]" 1
482 1 48 GLU H 1 48 GLU QB . . 3.390 2.459 2.192 2.905 . 0 0 "[ . 1 . 2]" 1
483 1 48 GLU H 1 48 GLU QG . . 3.780 2.885 2.070 4.026 0.246 19 0 "[ . 1 . 2]" 1
484 1 48 GLU H 1 49 LYS H . . 3.410 2.445 2.246 2.603 . 0 0 "[ . 1 . 2]" 1
485 1 48 GLU H 1 50 GLN H . . 4.890 4.285 4.032 4.697 . 0 0 "[ . 1 . 2]" 1
486 1 48 GLU HA 1 48 GLU HG2 . . 3.840 3.429 2.552 4.223 0.383 2 0 "[ . 1 . 2]" 1
487 1 48 GLU HA 1 48 GLU QG . . 3.190 2.939 2.277 3.446 0.256 2 0 "[ . 1 . 2]" 1
488 1 48 GLU HA 1 48 GLU HG3 . . 3.840 3.286 2.396 3.868 0.028 18 0 "[ . 1 . 2]" 1
489 1 48 GLU QB 1 49 LYS H . . 4.110 3.345 2.743 3.905 . 0 0 "[ . 1 . 2]" 1
490 1 48 GLU HB2 1 49 LYS H . . 4.940 3.989 3.115 4.275 . 0 0 "[ . 1 . 2]" 1
491 1 48 GLU HB3 1 49 LYS H . . 4.940 3.766 2.801 4.515 . 0 0 "[ . 1 . 2]" 1
492 1 48 GLU QG 1 49 LYS H . . 3.820 3.437 2.397 4.330 0.510 10 1 "[ . + . 2]" 1
493 1 49 LYS H 1 49 LYS HB2 . . 3.680 2.455 2.201 2.711 . 0 0 "[ . 1 . 2]" 1
494 1 49 LYS H 1 49 LYS QB . . 3.110 2.416 2.177 2.643 . 0 0 "[ . 1 . 2]" 1
495 1 49 LYS H 1 49 LYS HB3 . . 3.680 3.609 3.445 3.713 0.033 7 0 "[ . 1 . 2]" 1
496 1 49 LYS H 1 49 LYS HG2 . . 4.820 2.583 2.184 4.457 . 0 0 "[ . 1 . 2]" 1
497 1 49 LYS H 1 49 LYS QG . . 4.200 2.508 2.168 3.790 . 0 0 "[ . 1 . 2]" 1
498 1 49 LYS H 1 49 LYS HG3 . . 4.820 3.701 3.368 4.101 . 0 0 "[ . 1 . 2]" 1
499 1 49 LYS H 1 50 GLN H . . 3.170 2.435 2.157 2.692 . 0 0 "[ . 1 . 2]" 1
500 1 49 LYS H 1 51 PRO QD . . 4.940 4.223 3.548 4.892 . 0 0 "[ . 1 . 2]" 1
501 1 49 LYS HA 1 49 LYS QD . . 3.840 2.368 2.102 3.470 . 0 0 "[ . 1 . 2]" 1
502 1 49 LYS HA 1 49 LYS QG . . 3.340 2.806 2.187 3.188 . 0 0 "[ . 1 . 2]" 1
503 1 49 LYS QB 1 50 GLN H . . 3.810 2.588 2.166 3.152 . 0 0 "[ . 1 . 2]" 1
504 1 49 LYS QB 1 51 PRO QD . . 4.050 2.744 2.279 3.198 . 0 0 "[ . 1 . 2]" 1
505 1 49 LYS HB2 1 50 GLN H . . 4.530 2.660 2.187 3.250 . 0 0 "[ . 1 . 2]" 1
506 1 49 LYS HB3 1 50 GLN H . . 4.530 3.606 3.041 4.242 . 0 0 "[ . 1 . 2]" 1
507 1 49 LYS QE 1 49 LYS QG . . 3.330 2.286 2.138 2.787 . 0 0 "[ . 1 . 2]" 1
508 1 50 GLN H 1 50 GLN QG . . 4.350 2.726 2.414 4.154 . 0 0 "[ . 1 . 2]" 1
509 1 50 GLN H 1 51 PRO HD2 . . 4.690 3.321 3.021 3.858 . 0 0 "[ . 1 . 2]" 1
510 1 50 GLN H 1 51 PRO QD . . 3.920 2.575 2.268 2.878 . 0 0 "[ . 1 . 2]" 1
511 1 50 GLN H 1 51 PRO HD3 . . 4.690 2.726 2.288 3.132 . 0 0 "[ . 1 . 2]" 1
512 1 50 GLN H 1 53 LEU QD . . 4.690 5.136 4.509 5.285 0.595 3 12 "[* +*.** *** - .** *]" 1
513 1 50 GLN QB 1 51 PRO QD . . 4.570 3.778 3.614 3.869 . 0 0 "[ . 1 . 2]" 1
514 1 50 GLN QB 1 53 LEU QD . . 4.240 2.232 2.162 2.479 . 0 0 "[ . 1 . 2]" 1
515 1 50 GLN QG 1 53 LEU QD . . 3.600 2.704 2.153 3.812 0.212 16 0 "[ . 1 . 2]" 1
516 1 51 PRO QD 1 52 MET H . . 3.750 2.842 2.181 3.370 . 0 0 "[ . 1 . 2]" 1
517 1 51 PRO HD2 1 52 MET H . . 4.530 2.913 2.197 3.518 . 0 0 "[ . 1 . 2]" 1
518 1 51 PRO HD3 1 52 MET H . . 4.530 4.040 3.699 4.315 . 0 0 "[ . 1 . 2]" 1
519 1 51 PRO QG 1 52 MET H . . 3.710 2.344 2.107 3.358 . 0 0 "[ . 1 . 2]" 1
520 1 51 PRO QG 1 52 MET QG . . 3.250 3.627 2.961 3.832 0.582 13 11 "[ * * *1**+-.* ***]" 1
521 1 52 MET H 1 52 MET HB2 . . 3.780 2.746 2.514 3.781 0.001 5 0 "[ . 1 . 2]" 1
522 1 52 MET H 1 52 MET HB3 . . 3.780 3.676 2.951 3.846 0.066 10 0 "[ . 1 . 2]" 1
523 1 52 MET H 1 52 MET HG2 . . 3.920 3.164 2.358 4.412 0.492 16 0 "[ . 1 . 2]" 1
524 1 52 MET H 1 52 MET QG . . 3.300 2.815 2.337 3.207 . 0 0 "[ . 1 . 2]" 1
525 1 52 MET H 1 52 MET HG3 . . 3.920 3.780 3.052 4.320 0.400 4 0 "[ . 1 . 2]" 1
526 1 52 MET H 1 53 LEU H . . 2.930 2.158 2.103 2.255 . 0 0 "[ . 1 . 2]" 1
527 1 52 MET H 1 53 LEU QD . . 4.470 4.692 3.787 5.005 0.535 8 6 "[* . + * *. - *]" 1
528 1 52 MET HA 1 52 MET QG . . 3.680 2.866 2.273 3.465 . 0 0 "[ . 1 . 2]" 1
529 1 52 MET QB 1 53 LEU H . . 4.130 3.549 3.283 3.946 . 0 0 "[ . 1 . 2]" 1
530 1 52 MET QG 2 21 TYR QD . . 4.830 3.709 2.432 5.272 0.442 5 0 "[ . 1 . 2]" 1
531 1 53 LEU H 1 53 LEU HB2 . . 3.980 3.347 3.250 3.472 . 0 0 "[ . 1 . 2]" 1
532 1 53 LEU H 1 53 LEU QB . . 3.250 3.195 3.123 3.281 0.031 6 0 "[ . 1 . 2]" 1
533 1 53 LEU H 1 53 LEU HB3 . . 3.980 4.048 4.007 4.073 0.093 8 0 "[ . 1 . 2]" 1
534 1 53 LEU H 1 53 LEU QD . . 3.540 3.182 2.164 3.545 0.005 1 0 "[ . 1 . 2]" 1
535 1 53 LEU H 1 53 LEU HG . . 3.830 2.992 2.612 3.791 . 0 0 "[ . 1 . 2]" 1
536 1 53 LEU H 1 54 ASP H . . 4.780 2.946 2.641 3.316 . 0 0 "[ . 1 . 2]" 1
537 1 53 LEU HA 1 53 LEU QD . . 3.270 2.375 2.146 2.781 . 0 0 "[ . 1 . 2]" 1
538 1 53 LEU HA 1 53 LEU HG . . 4.230 2.597 2.323 2.865 . 0 0 "[ . 1 . 2]" 1
539 1 53 LEU HA 1 54 ASP H . . 2.880 2.625 2.316 2.854 . 0 0 "[ . 1 . 2]" 1
540 1 54 ASP H 1 54 ASP QB . . 3.580 2.726 2.410 2.886 . 0 0 "[ . 1 . 2]" 1
541 1 54 ASP H 1 55 VAL H . . 4.960 4.167 3.183 4.381 . 0 0 "[ . 1 . 2]" 1
542 1 54 ASP HA 1 55 VAL H . . 3.480 2.347 2.178 3.491 0.011 6 0 "[ . 1 . 2]" 1
543 1 54 ASP QB 1 55 VAL H . . 4.100 3.421 1.887 3.745 . 0 0 "[ . 1 . 2]" 1
544 1 54 ASP QB 1 57 LYS H . . 4.850 2.921 2.644 3.255 . 0 0 "[ . 1 . 2]" 1
545 1 54 ASP HB2 1 55 VAL H . . 4.660 3.957 2.119 4.362 . 0 0 "[ . 1 . 2]" 1
546 1 54 ASP HB3 1 55 VAL H . . 4.660 3.754 2.117 4.197 . 0 0 "[ . 1 . 2]" 1
547 1 55 VAL H 1 55 VAL HB . . 3.840 2.720 2.560 3.521 . 0 0 "[ . 1 . 2]" 1
548 1 55 VAL H 1 56 PRO HD2 . . 4.120 2.250 2.120 2.640 . 0 0 "[ . 1 . 2]" 1
549 1 55 VAL H 1 56 PRO QD . . 3.350 2.199 2.105 2.391 . 0 0 "[ . 1 . 2]" 1
550 1 55 VAL H 1 56 PRO HD3 . . 4.120 3.326 2.733 3.572 . 0 0 "[ . 1 . 2]" 1
551 1 56 PRO HA 1 59 ALA H . . 4.470 3.461 3.094 3.675 . 0 0 "[ . 1 . 2]" 1
552 1 56 PRO HA 1 59 ALA MB . . 3.730 2.822 2.467 3.242 . 0 0 "[ . 1 . 2]" 1
553 1 56 PRO HA 1 60 VAL QG . . 4.320 4.311 3.667 4.853 0.533 18 2 "[ . - 1 . + 2]" 1
554 1 56 PRO HA 2 56 PRO QB . . 3.920 2.579 2.197 3.458 . 0 0 "[ . 1 . 2]" 1
555 1 56 PRO HA 2 56 PRO HG2 . . 4.900 5.079 4.587 5.382 0.482 12 0 "[ . 1 . 2]" 1
556 1 56 PRO HA 2 56 PRO HG3 . . 4.900 4.239 3.125 4.747 . 0 0 "[ . 1 . 2]" 1
557 1 56 PRO HA 2 59 ALA MB . . 3.820 3.268 2.889 3.781 . 0 0 "[ . 1 . 2]" 1
558 1 56 PRO QB 1 59 ALA MB . . 4.750 4.161 3.601 4.535 . 0 0 "[ . 1 . 2]" 1
559 1 56 PRO QB 2 56 PRO HA . . 3.920 2.562 2.145 3.201 . 0 0 "[ . 1 . 2]" 1
560 1 56 PRO QB 2 56 PRO QD . . 4.270 2.650 2.159 3.344 . 0 0 "[ . 1 . 2]" 1
561 1 56 PRO QB 2 59 ALA MB . . 4.400 3.622 2.942 4.207 . 0 0 "[ . 1 . 2]" 1
562 1 56 PRO QD 1 57 LYS H . . 4.310 2.912 2.648 3.102 . 0 0 "[ . 1 . 2]" 1
563 1 56 PRO QD 2 56 PRO QB . . 4.270 2.725 2.199 3.702 . 0 0 "[ . 1 . 2]" 1
564 1 56 PRO HG2 1 57 LYS H . . 4.010 2.822 2.423 4.037 0.027 3 0 "[ . 1 . 2]" 1
565 1 56 PRO HG2 2 56 PRO HA . . 4.900 5.167 4.875 5.426 0.526 11 1 "[ . 1+ . 2]" 1
566 1 56 PRO HG3 1 57 LYS H . . 4.010 4.167 3.948 4.538 0.528 3 2 "[ + . 1 . -2]" 1
567 1 56 PRO HG3 2 56 PRO HA . . 4.900 4.418 3.455 4.881 . 0 0 "[ . 1 . 2]" 1
568 1 57 LYS H 1 57 LYS QB . . 3.210 2.334 2.091 2.616 . 0 0 "[ . 1 . 2]" 1
569 1 57 LYS H 1 58 LEU H . . 3.350 2.518 2.413 2.667 . 0 0 "[ . 1 . 2]" 1
570 1 57 LYS H 1 59 ALA H . . 4.650 4.189 3.997 4.476 . 0 0 "[ . 1 . 2]" 1
571 1 57 LYS HA 1 57 LYS QD . . 4.740 2.475 2.091 4.106 . 0 0 "[ . 1 . 2]" 1
572 1 57 LYS HA 1 57 LYS QE . . 4.930 4.095 3.478 4.664 . 0 0 "[ . 1 . 2]" 1
573 1 57 LYS HA 1 59 ALA H . . 4.680 4.478 4.139 4.905 0.225 20 0 "[ . 1 . 2]" 1
574 1 57 LYS HA 1 60 VAL H . . 4.560 3.722 3.329 3.965 . 0 0 "[ . 1 . 2]" 1
575 1 57 LYS HA 1 60 VAL MG1 . . 4.830 2.844 2.168 4.385 . 0 0 "[ . 1 . 2]" 1
576 1 57 LYS HA 1 60 VAL QG . . 3.820 2.200 2.146 2.730 . 0 0 "[ . 1 . 2]" 1
577 1 57 LYS HA 1 60 VAL MG2 . . 4.830 3.620 2.161 4.838 0.008 15 0 "[ . 1 . 2]" 1
578 1 57 LYS HA 2 21 TYR QE . . 4.040 3.186 2.315 4.111 0.071 20 0 "[ . 1 . 2]" 1
579 1 57 LYS QB 1 57 LYS QE . . 4.050 3.393 2.129 3.893 . 0 0 "[ . 1 . 2]" 1
580 1 57 LYS QB 1 58 LEU H . . 3.590 2.965 2.575 3.313 . 0 0 "[ . 1 . 2]" 1
581 1 57 LYS QB 1 58 LEU HA . . 4.770 3.963 3.848 4.129 . 0 0 "[ . 1 . 2]" 1
582 1 57 LYS HB2 1 58 LEU H . . 4.140 3.180 2.714 3.658 . 0 0 "[ . 1 . 2]" 1
583 1 57 LYS HB3 1 58 LEU H . . 4.140 3.751 2.631 4.317 0.177 2 0 "[ . 1 . 2]" 1
584 1 57 LYS QD 2 19 GLN QB . . 4.420 3.856 2.930 4.437 0.017 1 0 "[ . 1 . 2]" 1
585 1 58 LEU H 1 58 LEU HB2 . . 3.720 2.481 2.163 2.728 . 0 0 "[ . 1 . 2]" 1
586 1 58 LEU H 1 58 LEU QB . . 2.980 2.223 2.112 2.338 . 0 0 "[ . 1 . 2]" 1
587 1 58 LEU H 1 58 LEU HB3 . . 3.720 2.615 2.355 3.066 . 0 0 "[ . 1 . 2]" 1
588 1 58 LEU H 1 58 LEU MD1 . . 4.740 4.193 3.932 4.346 . 0 0 "[ . 1 . 2]" 1
589 1 58 LEU H 1 58 LEU QD . . 3.560 3.638 3.286 3.797 0.237 11 0 "[ . 1 . 2]" 1
590 1 58 LEU H 1 58 LEU MD2 . . 4.740 4.043 3.401 4.318 . 0 0 "[ . 1 . 2]" 1
591 1 58 LEU H 1 59 ALA H . . 3.510 2.411 2.185 2.579 . 0 0 "[ . 1 . 2]" 1
592 1 58 LEU HA 1 58 LEU MD1 . . 3.930 2.892 2.208 3.779 . 0 0 "[ . 1 . 2]" 1
593 1 58 LEU HA 1 58 LEU QD . . 3.320 2.300 2.028 3.112 . 0 0 "[ . 1 . 2]" 1
594 1 58 LEU HA 1 58 LEU MD2 . . 3.930 2.843 2.118 3.929 . 0 0 "[ . 1 . 2]" 1
595 1 58 LEU HA 1 58 LEU HG . . 3.980 3.250 2.469 3.747 . 0 0 "[ . 1 . 2]" 1
596 1 58 LEU HA 1 61 LEU QD . . 4.660 3.251 2.954 3.710 . 0 0 "[ . 1 . 2]" 1
597 1 58 LEU QB 1 59 ALA H . . 4.030 2.523 2.199 2.738 . 0 0 "[ . 1 . 2]" 1
598 1 58 LEU QD 1 59 ALA H . . 4.150 3.489 3.006 3.895 . 0 0 "[ . 1 . 2]" 1
599 1 58 LEU QD 1 59 ALA HA . . 4.500 3.407 2.620 4.223 . 0 0 "[ . 1 . 2]" 1
600 1 58 LEU MD1 1 59 ALA H . . 4.790 4.076 3.078 4.889 0.099 7 0 "[ . 1 . 2]" 1
601 1 58 LEU MD2 1 59 ALA H . . 4.790 4.135 3.182 4.711 . 0 0 "[ . 1 . 2]" 1
602 1 59 ALA H 1 59 ALA MB . . 2.960 2.220 2.181 2.236 . 0 0 "[ . 1 . 2]" 1
603 1 59 ALA H 1 60 VAL H . . 3.630 2.738 2.524 2.891 . 0 0 "[ . 1 . 2]" 1
604 1 59 ALA H 2 56 PRO HA . . 4.960 4.957 4.479 5.394 0.434 6 0 "[ . 1 . 2]" 1
605 1 59 ALA HA 1 62 THR H . . 4.010 3.633 3.353 4.022 0.012 16 0 "[ . 1 . 2]" 1
606 1 59 ALA HA 2 60 VAL HA . . 4.880 4.315 3.828 4.868 . 0 0 "[ . 1 . 2]" 1
607 1 59 ALA HA 2 60 VAL QG . . 4.780 3.836 3.288 4.376 . 0 0 "[ . 1 . 2]" 1
608 1 59 ALA MB 1 60 VAL H . . 3.700 2.556 2.320 2.967 . 0 0 "[ . 1 . 2]" 1
609 1 59 ALA MB 1 60 VAL HA . . 4.650 3.850 3.785 3.994 . 0 0 "[ . 1 . 2]" 1
610 1 59 ALA MB 2 56 PRO HA . . 3.820 3.208 2.912 3.564 . 0 0 "[ . 1 . 2]" 1
611 1 59 ALA MB 2 56 PRO QB . . 4.400 3.649 3.099 4.266 . 0 0 "[ . 1 . 2]" 1
612 1 59 ALA MB 2 60 VAL H . . 3.920 2.765 2.389 3.344 . 0 0 "[ . 1 . 2]" 1
613 1 59 ALA MB 2 60 VAL HA . . 4.140 2.765 2.318 3.361 . 0 0 "[ . 1 . 2]" 1
614 1 59 ALA MB 2 60 VAL QG . . 3.410 2.788 2.142 3.327 . 0 0 "[ . 1 . 2]" 1
615 1 60 VAL H 1 60 VAL HB . . 3.530 3.000 2.431 3.698 0.168 13 0 "[ . 1 . 2]" 1
616 1 60 VAL H 1 60 VAL MG1 . . 3.930 2.341 2.162 3.822 . 0 0 "[ . 1 . 2]" 1
617 1 60 VAL H 1 60 VAL QG . . 3.070 2.122 1.974 2.312 . 0 0 "[ . 1 . 2]" 1
618 1 60 VAL H 1 60 VAL MG2 . . 3.930 3.073 2.178 3.794 . 0 0 "[ . 1 . 2]" 1
619 1 60 VAL H 1 61 LEU H . . 3.690 2.518 2.212 2.661 . 0 0 "[ . 1 . 2]" 1
620 1 60 VAL H 2 59 ALA MB . . 3.920 2.813 2.205 3.367 . 0 0 "[ . 1 . 2]" 1
621 1 60 VAL HA 1 60 VAL MG1 . . 3.680 2.825 2.339 3.214 . 0 0 "[ . 1 . 2]" 1
622 1 60 VAL HA 1 60 VAL QG . . 3.110 2.273 2.163 2.334 . 0 0 "[ . 1 . 2]" 1
623 1 60 VAL HA 1 60 VAL MG2 . . 3.680 2.685 2.254 3.226 . 0 0 "[ . 1 . 2]" 1
624 1 60 VAL HA 1 63 ALA H . . 4.350 3.268 3.016 3.567 . 0 0 "[ . 1 . 2]" 1
625 1 60 VAL HA 1 63 ALA MB . . 3.690 2.540 2.242 2.871 . 0 0 "[ . 1 . 2]" 1
626 1 60 VAL HA 2 59 ALA HA . . 4.880 4.377 3.933 4.855 . 0 0 "[ . 1 . 2]" 1
627 1 60 VAL HA 2 59 ALA MB . . 4.140 2.804 2.324 3.394 . 0 0 "[ . 1 . 2]" 1
628 1 60 VAL HB 1 63 ALA MB . . 4.260 4.281 3.731 4.819 0.559 19 1 "[ . 1 . +2]" 1
629 1 60 VAL HB 2 16 ILE MG . . 4.570 4.028 2.414 4.906 0.336 20 0 "[ . 1 . 2]" 1
630 1 60 VAL QG 1 61 LEU H . . 4.100 2.343 2.188 3.285 . 0 0 "[ . 1 . 2]" 1
631 1 60 VAL QG 1 61 LEU HA . . 4.630 3.159 3.036 3.696 . 0 0 "[ . 1 . 2]" 1
632 1 60 VAL QG 1 61 LEU QD . . 4.430 3.658 3.095 4.199 . 0 0 "[ . 1 . 2]" 1
633 1 60 VAL QG 1 63 ALA MB . . 4.790 3.227 2.607 3.959 . 0 0 "[ . 1 . 2]" 1
634 1 60 VAL QG 1 64 VAL QG . . 4.710 3.649 3.231 4.382 . 0 0 "[ . 1 . 2]" 1
635 1 60 VAL QG 2 16 ILE MD . . 3.640 3.121 2.213 4.012 0.372 11 0 "[ . 1 . 2]" 1
636 1 60 VAL QG 2 16 ILE MG . . 4.770 2.710 2.180 3.679 . 0 0 "[ . 1 . 2]" 1
637 1 60 VAL QG 2 19 GLN QB . . 4.070 4.045 3.900 4.351 0.281 7 0 "[ . 1 . 2]" 1
638 1 60 VAL QG 2 21 TYR QD . . 3.550 3.415 3.075 3.612 0.062 10 0 "[ . 1 . 2]" 1
639 1 60 VAL QG 2 21 TYR QE . . 3.010 2.588 2.125 2.833 . 0 0 "[ . 1 . 2]" 1
640 1 60 VAL QG 2 39 VAL QG . . 4.880 3.024 2.319 4.222 . 0 0 "[ . 1 . 2]" 1
641 1 60 VAL QG 2 59 ALA HA . . 4.780 3.684 3.058 4.408 . 0 0 "[ . 1 . 2]" 1
642 1 60 VAL QG 2 59 ALA MB . . 3.410 2.540 2.086 3.328 . 0 0 "[ . 1 . 2]" 1
643 1 60 VAL MG1 1 61 LEU H . . 4.740 3.084 2.216 4.063 . 0 0 "[ . 1 . 2]" 1
644 1 60 VAL MG1 2 21 TYR QE . . 4.240 3.214 2.510 4.289 0.049 9 0 "[ . 1 . 2]" 1
645 1 60 VAL MG2 1 61 LEU H . . 4.740 3.234 2.198 4.063 . 0 0 "[ . 1 . 2]" 1
646 1 60 VAL MG2 2 21 TYR QE . . 4.240 3.019 2.234 3.831 . 0 0 "[ . 1 . 2]" 1
647 1 61 LEU H 1 61 LEU HB2 . . 3.960 2.433 2.199 2.582 . 0 0 "[ . 1 . 2]" 1
648 1 61 LEU H 1 61 LEU QB . . 3.430 2.222 2.139 2.259 . 0 0 "[ . 1 . 2]" 1
649 1 61 LEU H 1 61 LEU HB3 . . 3.960 2.608 2.442 2.924 . 0 0 "[ . 1 . 2]" 1
650 1 61 LEU H 1 61 LEU MD1 . . 4.890 4.006 3.627 4.150 . 0 0 "[ . 1 . 2]" 1
651 1 61 LEU H 1 61 LEU QD . . 3.960 3.666 3.442 3.746 . 0 0 "[ . 1 . 2]" 1
652 1 61 LEU H 1 61 LEU MD2 . . 4.890 4.261 4.218 4.317 . 0 0 "[ . 1 . 2]" 1
653 1 61 LEU H 1 61 LEU HG . . 4.650 4.485 4.434 4.595 . 0 0 "[ . 1 . 2]" 1
654 1 61 LEU H 1 62 THR H . . 3.770 2.592 2.459 2.708 . 0 0 "[ . 1 . 2]" 1
655 1 61 LEU HA 1 61 LEU QD . . 3.280 2.232 2.040 2.628 . 0 0 "[ . 1 . 2]" 1
656 1 61 LEU HA 1 61 LEU HG . . 3.820 2.853 2.600 3.099 . 0 0 "[ . 1 . 2]" 1
657 1 61 LEU HA 1 64 VAL H . . 3.890 3.775 3.595 3.952 0.062 17 0 "[ . 1 . 2]" 1
658 1 61 LEU HA 1 64 VAL HB . . 4.230 4.344 4.035 4.724 0.494 17 0 "[ . 1 . 2]" 1
659 1 61 LEU HA 1 64 VAL QG . . 4.010 2.340 2.149 2.650 . 0 0 "[ . 1 . 2]" 1
660 1 61 LEU HA 1 65 GLN H . . 4.360 4.438 4.174 4.723 0.363 14 0 "[ . 1 . 2]" 1
661 1 61 LEU QB 1 62 THR H . . 3.580 2.611 2.343 2.943 . 0 0 "[ . 1 . 2]" 1
662 1 61 LEU QB 1 62 THR HA . . 4.640 4.078 3.834 4.254 . 0 0 "[ . 1 . 2]" 1
663 1 61 LEU HB2 1 62 THR H . . 4.150 3.811 3.474 4.050 . 0 0 "[ . 1 . 2]" 1
664 1 61 LEU HB3 1 62 THR H . . 4.150 2.661 2.367 3.041 . 0 0 "[ . 1 . 2]" 1
665 1 61 LEU QD 1 62 THR H . . 4.990 3.941 3.602 4.277 . 0 0 "[ . 1 . 2]" 1
666 1 61 LEU MD1 2 23 ILE MD . . 4.090 4.066 2.522 4.720 0.630 16 4 "[ . * 1 - .+ * 2]" 1
667 1 61 LEU HG 1 62 THR HA . . 4.640 4.100 3.717 4.805 0.165 13 0 "[ . 1 . 2]" 1
668 1 61 LEU HG 1 64 VAL QG . . 4.350 3.643 3.295 3.947 . 0 0 "[ . 1 . 2]" 1
669 1 62 THR H 1 62 THR HB . . 4.010 3.394 2.439 3.657 . 0 0 "[ . 1 . 2]" 1
670 1 62 THR H 1 62 THR MG . . 3.960 2.819 2.170 3.760 . 0 0 "[ . 1 . 2]" 1
671 1 62 THR H 1 63 ALA H . . 3.810 2.510 2.407 2.611 . 0 0 "[ . 1 . 2]" 1
672 1 62 THR H 1 64 VAL QG . . 4.660 4.342 4.166 4.560 . 0 0 "[ . 1 . 2]" 1
673 1 62 THR H 2 63 ALA MB . . 4.830 4.837 4.341 5.264 0.434 17 0 "[ . 1 . 2]" 1
674 1 62 THR HA 1 62 THR MG . . 3.740 2.244 2.112 2.453 . 0 0 "[ . 1 . 2]" 1
675 1 62 THR HA 1 63 ALA HA . . 4.910 4.841 4.819 4.866 . 0 0 "[ . 1 . 2]" 1
676 1 62 THR HA 1 66 ILE MD . . 3.980 4.233 3.901 4.496 0.516 3 2 "[ + . 1 . - 2]" 1
677 1 62 THR HB 1 63 ALA H . . 4.530 3.408 2.573 3.928 . 0 0 "[ . 1 . 2]" 1
678 1 62 THR HB 1 65 GLN QB . . 4.740 4.601 3.985 5.259 0.519 19 1 "[ . 1 . +2]" 1
679 1 62 THR MG 1 63 ALA H . . 4.150 3.994 3.512 4.261 0.111 9 0 "[ . 1 . 2]" 1
680 1 63 ALA H 1 63 ALA MB . . 3.150 2.218 2.198 2.247 . 0 0 "[ . 1 . 2]" 1
681 1 63 ALA H 1 64 VAL H . . 3.920 2.791 2.710 2.879 . 0 0 "[ . 1 . 2]" 1
682 1 63 ALA H 1 64 VAL QG . . 3.980 4.028 3.915 4.150 0.170 9 0 "[ . 1 . 2]" 1
683 1 63 ALA H 2 63 ALA MB . . 4.190 3.251 2.840 3.664 . 0 0 "[ . 1 . 2]" 1
684 1 63 ALA HA 1 66 ILE H . . 4.610 3.765 3.565 4.073 . 0 0 "[ . 1 . 2]" 1
685 1 63 ALA HA 2 63 ALA MB . . 3.220 2.507 2.191 2.790 . 0 0 "[ . 1 . 2]" 1
686 1 63 ALA HA 2 66 ILE MG . . 4.340 4.584 3.549 4.885 0.545 3 2 "[- + . 1 . 2]" 1
687 1 63 ALA MB 1 64 VAL H . . 3.650 2.385 2.249 2.528 . 0 0 "[ . 1 . 2]" 1
688 1 63 ALA MB 1 64 VAL HB . . 4.220 3.803 3.696 3.910 . 0 0 "[ . 1 . 2]" 1
689 1 63 ALA MB 2 39 VAL MG1 . . 3.890 2.553 2.185 3.991 0.101 7 0 "[ . 1 . 2]" 1
690 1 63 ALA MB 2 39 VAL QG . . 2.870 2.301 2.133 2.618 . 0 0 "[ . 1 . 2]" 1
691 1 63 ALA MB 2 39 VAL MG2 . . 3.890 2.966 2.179 3.465 . 0 0 "[ . 1 . 2]" 1
692 1 63 ALA MB 2 62 THR H . . 4.830 4.846 4.054 5.267 0.437 3 0 "[ . 1 . 2]" 1
693 1 63 ALA MB 2 63 ALA H . . 4.190 3.263 2.575 3.587 . 0 0 "[ . 1 . 2]" 1
694 1 63 ALA MB 2 63 ALA HA . . 3.220 2.536 2.330 2.980 . 0 0 "[ . 1 . 2]" 1
695 1 64 VAL H 1 64 VAL HB . . 3.550 2.517 2.425 2.618 . 0 0 "[ . 1 . 2]" 1
696 1 64 VAL H 1 64 VAL MG1 . . 3.900 2.206 2.158 2.284 . 0 0 "[ . 1 . 2]" 1
697 1 64 VAL H 1 64 VAL QG . . 3.240 2.191 2.146 2.266 . 0 0 "[ . 1 . 2]" 1
698 1 64 VAL H 1 64 VAL MG2 . . 3.900 3.773 3.742 3.793 . 0 0 "[ . 1 . 2]" 1
699 1 64 VAL H 1 65 GLN H . . 3.650 2.606 2.432 2.738 . 0 0 "[ . 1 . 2]" 1
700 1 64 VAL H 2 39 VAL QG . . 4.560 3.155 2.944 3.385 . 0 0 "[ . 1 . 2]" 1
701 1 64 VAL HA 1 65 GLN HA . . 4.910 4.721 4.587 4.816 . 0 0 "[ . 1 . 2]" 1
702 1 64 VAL HA 1 67 ALA MB . . 3.960 2.680 2.419 3.052 . 0 0 "[ . 1 . 2]" 1
703 1 64 VAL HA 2 39 VAL HB . . 4.690 4.194 2.724 4.608 . 0 0 "[ . 1 . 2]" 1
704 1 64 VAL HA 2 39 VAL MG1 . . 3.640 3.607 2.838 3.987 0.347 9 0 "[ . 1 . 2]" 1
705 1 64 VAL HA 2 39 VAL MG2 . . 3.640 2.202 2.059 2.870 . 0 0 "[ . 1 . 2]" 1
706 1 64 VAL HB 1 65 GLN H . . 4.660 4.024 3.971 4.119 . 0 0 "[ . 1 . 2]" 1
707 1 64 VAL HB 2 23 ILE MD . . 4.480 4.319 4.105 4.581 0.101 16 0 "[ . 1 . 2]" 1
708 1 64 VAL HB 2 36 ALA HA . . 4.370 4.314 3.914 4.858 0.488 16 0 "[ . 1 . 2]" 1
709 1 64 VAL HB 2 39 VAL MG1 . . 4.420 3.090 2.289 3.463 . 0 0 "[ . 1 . 2]" 1
710 1 64 VAL HB 2 39 VAL QG . . 3.830 2.575 2.185 2.885 . 0 0 "[ . 1 . 2]" 1
711 1 64 VAL QG 1 65 GLN H . . 3.490 2.300 2.181 2.442 . 0 0 "[ . 1 . 2]" 1
712 1 64 VAL QG 1 65 GLN HA . . 4.070 3.072 3.021 3.157 . 0 0 "[ . 1 . 2]" 1
713 1 64 VAL QG 1 65 GLN QG . . 4.690 3.261 2.356 4.036 . 0 0 "[ . 1 . 2]" 1
714 1 64 VAL QG 1 67 ALA H . . 4.800 4.382 4.188 4.620 . 0 0 "[ . 1 . 2]" 1
715 1 64 VAL QG 1 67 ALA MB . . 3.940 3.378 3.079 3.939 . 0 0 "[ . 1 . 2]" 1
716 1 64 VAL QG 1 68 SER H . . 4.170 3.936 3.632 4.355 0.185 16 0 "[ . 1 . 2]" 1
717 1 64 VAL QG 2 21 TYR QB . . 4.510 3.328 2.906 3.718 . 0 0 "[ . 1 . 2]" 1
718 1 64 VAL QG 2 21 TYR QD . . 4.990 3.990 2.579 4.572 . 0 0 "[ . 1 . 2]" 1
719 1 64 VAL QG 2 23 ILE MD . . 2.760 2.144 2.049 2.368 . 0 0 "[ . 1 . 2]" 1
720 1 64 VAL QG 2 23 ILE QG . . 3.470 2.975 2.302 3.548 0.078 10 0 "[ . 1 . 2]" 1
721 1 64 VAL QG 2 35 VAL HB . . 4.510 3.282 2.893 3.794 . 0 0 "[ . 1 . 2]" 1
722 1 64 VAL QG 2 36 ALA H . . 4.150 3.826 3.487 4.076 . 0 0 "[ . 1 . 2]" 1
723 1 64 VAL QG 2 36 ALA HA . . 3.760 2.701 2.367 3.242 . 0 0 "[ . 1 . 2]" 1
724 1 64 VAL QG 2 36 ALA MB . . 3.540 3.275 2.803 3.742 0.202 4 0 "[ . 1 . 2]" 1
725 1 64 VAL MG1 1 65 GLN H . . 4.310 2.317 2.195 2.462 . 0 0 "[ . 1 . 2]" 1
726 1 64 VAL MG1 2 23 ILE MD . . 3.160 2.471 2.232 2.929 . 0 0 "[ . 1 . 2]" 1
727 1 64 VAL MG1 2 23 ILE QG . . 4.160 3.333 2.372 3.972 . 0 0 "[ . 1 . 2]" 1
728 1 64 VAL MG2 1 65 GLN H . . 4.310 3.877 3.755 4.056 . 0 0 "[ . 1 . 2]" 1
729 1 64 VAL MG2 2 23 ILE MD . . 3.160 2.396 2.182 2.791 . 0 0 "[ . 1 . 2]" 1
730 1 64 VAL MG2 2 23 ILE QG . . 4.160 3.388 2.701 4.112 . 0 0 "[ . 1 . 2]" 1
731 1 65 GLN H 1 65 GLN QB . . 3.230 2.223 2.119 2.354 . 0 0 "[ . 1 . 2]" 1
732 1 65 GLN H 1 65 GLN QG . . 3.630 3.379 2.535 3.970 0.340 7 0 "[ . 1 . 2]" 1
733 1 65 GLN H 1 66 ILE H . . 3.910 2.576 2.319 2.741 . 0 0 "[ . 1 . 2]" 1
734 1 65 GLN HA 1 65 GLN QG . . 2.960 2.305 2.154 2.529 . 0 0 "[ . 1 . 2]" 1
735 1 65 GLN HA 1 66 ILE HA . . 4.880 4.812 4.748 4.869 . 0 0 "[ . 1 . 2]" 1
736 1 65 GLN HA 2 23 ILE MG . . 3.700 3.865 3.302 4.189 0.489 18 0 "[ . 1 . 2]" 1
737 1 65 GLN QB 1 65 GLN QG . . 2.420 2.055 2.016 2.095 . 0 0 "[ . 1 . 2]" 1
738 1 65 GLN QB 1 66 ILE H . . 3.720 2.561 2.372 2.917 . 0 0 "[ . 1 . 2]" 1
739 1 65 GLN QB 2 23 ILE MG . . 3.770 3.668 2.826 4.152 0.382 17 0 "[ . 1 . 2]" 1
740 1 65 GLN QG 2 23 ILE MD . . 4.140 4.300 3.298 4.775 0.635 14 3 "[ * 1 +. -]" 1
741 1 65 GLN QG 2 23 ILE MG . . 4.500 2.904 2.202 4.012 . 0 0 "[ . 1 . 2]" 1
742 1 65 GLN QG 2 24 VAL HB . . 4.220 4.441 3.761 4.729 0.509 16 1 "[ . 1 .+ 2]" 1
743 1 66 ILE H 1 66 ILE MG . . 3.650 3.745 3.715 3.763 0.113 19 0 "[ . 1 . 2]" 1
744 1 66 ILE H 1 67 ALA H . . 3.920 2.686 2.546 2.804 . 0 0 "[ . 1 . 2]" 1
745 1 66 ILE HA 1 66 ILE MD . . 3.930 3.832 3.797 3.853 . 0 0 "[ . 1 . 2]" 1
746 1 66 ILE HA 1 66 ILE MG . . 3.550 2.534 2.463 2.605 . 0 0 "[ . 1 . 2]" 1
747 1 66 ILE HA 1 68 SER H . . 4.770 4.542 4.249 4.716 . 0 0 "[ . 1 . 2]" 1
748 1 66 ILE HA 1 69 GLU H . . 4.740 3.618 3.442 3.846 . 0 0 "[ . 1 . 2]" 1
749 1 66 ILE HA 1 69 GLU QB . . 4.150 2.870 2.330 4.308 0.158 16 0 "[ . 1 . 2]" 1
750 1 66 ILE HA 1 69 GLU QG . . 4.600 3.421 2.106 4.485 . 0 0 "[ . 1 . 2]" 1
751 1 66 ILE MD 1 66 ILE MG . . 3.140 2.153 2.127 2.168 . 0 0 "[ . 1 . 2]" 1
752 1 66 ILE MG 1 67 ALA H . . 3.720 3.212 3.084 3.356 . 0 0 "[ . 1 . 2]" 1
753 1 66 ILE MG 1 67 ALA HA . . 4.710 3.192 3.094 3.314 . 0 0 "[ . 1 . 2]" 1
754 1 66 ILE MG 1 70 TYR QD . . 3.960 2.480 2.141 3.601 . 0 0 "[ . 1 . 2]" 1
755 1 66 ILE MG 2 63 ALA HA . . 4.340 4.631 3.960 4.897 0.557 20 7 "[ ** * -1 * * +]" 1
756 1 66 ILE MG 2 63 ALA MB . . 4.140 4.375 4.026 4.634 0.494 15 0 "[ . 1 . 2]" 1
757 1 66 ILE MG 2 67 ALA HA . . 3.620 2.779 2.367 3.286 . 0 0 "[ . 1 . 2]" 1
758 1 66 ILE MG 2 67 ALA MB . . 3.760 2.273 2.156 2.678 . 0 0 "[ . 1 . 2]" 1
759 1 67 ALA H 1 67 ALA MB . . 3.610 2.224 2.198 2.235 . 0 0 "[ . 1 . 2]" 1
760 1 67 ALA H 1 68 SER H . . 3.900 2.764 2.643 2.848 . 0 0 "[ . 1 . 2]" 1
761 1 67 ALA HA 1 70 TYR H . . 4.210 3.664 3.480 3.925 . 0 0 "[ . 1 . 2]" 1
762 1 67 ALA HA 1 70 TYR HB2 . . 4.950 3.180 2.608 3.732 . 0 0 "[ . 1 . 2]" 1
763 1 67 ALA HA 1 70 TYR QB . . 4.270 3.124 2.560 3.672 . 0 0 "[ . 1 . 2]" 1
764 1 67 ALA HA 1 70 TYR HB3 . . 4.950 4.611 3.561 5.463 0.513 9 1 "[ . +1 . 2]" 1
765 1 67 ALA HA 2 66 ILE MG . . 3.620 2.798 2.398 3.369 . 0 0 "[ . 1 . 2]" 1
766 1 67 ALA HA 2 70 TYR QD . . 4.210 4.154 3.205 4.690 0.480 4 0 "[ . 1 . 2]" 1
767 1 67 ALA MB 1 68 SER H . . 3.740 2.478 2.308 2.838 . 0 0 "[ . 1 . 2]" 1
768 1 67 ALA MB 2 35 VAL HA . . 4.380 3.911 2.898 4.300 . 0 0 "[ . 1 . 2]" 1
769 1 67 ALA MB 2 35 VAL QG . . 4.140 2.211 2.064 2.821 . 0 0 "[ . 1 . 2]" 1
770 1 67 ALA MB 2 38 PHE QD . . 3.600 2.981 2.419 3.703 0.103 9 0 "[ . 1 . 2]" 1
771 1 67 ALA MB 2 38 PHE QE . . 4.350 3.546 2.386 4.604 0.254 9 0 "[ . 1 . 2]" 1
772 1 67 ALA MB 2 39 VAL QG . . 4.040 2.747 2.322 3.560 . 0 0 "[ . 1 . 2]" 1
773 1 67 ALA MB 2 66 ILE MG . . 3.760 2.251 2.142 2.542 . 0 0 "[ . 1 . 2]" 1
774 1 68 SER H 1 68 SER QB . . 3.530 2.689 2.173 2.899 . 0 0 "[ . 1 . 2]" 1
775 1 68 SER H 1 69 GLU H . . 3.890 2.679 2.554 2.777 . 0 0 "[ . 1 . 2]" 1
776 1 68 SER H 1 71 LEU QD . . 4.980 4.113 3.392 5.141 0.161 16 0 "[ . 1 . 2]" 1
777 1 68 SER H 2 35 VAL QG . . 3.980 2.868 2.654 3.308 . 0 0 "[ . 1 . 2]" 1
778 1 68 SER HA 1 71 LEU QB . . 4.160 2.414 2.134 2.875 . 0 0 "[ . 1 . 2]" 1
779 1 68 SER HA 2 35 VAL QG . . 4.110 2.516 2.125 2.937 . 0 0 "[ . 1 . 2]" 1
780 1 68 SER QB 1 69 GLU H . . 3.770 2.965 2.439 3.481 . 0 0 "[ . 1 . 2]" 1
781 1 69 GLU H 1 69 GLU HB2 . . 4.080 2.451 2.165 3.628 . 0 0 "[ . 1 . 2]" 1
782 1 69 GLU H 1 69 GLU QB . . 3.440 2.314 2.144 2.592 . 0 0 "[ . 1 . 2]" 1
783 1 69 GLU H 1 69 GLU HB3 . . 4.080 3.455 2.472 3.600 . 0 0 "[ . 1 . 2]" 1
784 1 69 GLU H 1 69 GLU HG2 . . 4.270 3.002 2.307 3.794 . 0 0 "[ . 1 . 2]" 1
785 1 69 GLU H 1 69 GLU QG . . 3.570 2.511 2.209 2.997 . 0 0 "[ . 1 . 2]" 1
786 1 69 GLU H 1 69 GLU HG3 . . 4.270 3.200 2.235 4.080 . 0 0 "[ . 1 . 2]" 1
787 1 69 GLU H 1 70 TYR H . . 3.690 2.668 2.511 2.800 . 0 0 "[ . 1 . 2]" 1
788 1 69 GLU H 1 70 TYR QB . . 4.940 4.560 4.233 4.779 . 0 0 "[ . 1 . 2]" 1
789 1 69 GLU H 1 71 LEU H . . 4.470 3.997 3.691 4.169 . 0 0 "[ . 1 . 2]" 1
790 1 69 GLU H 1 72 LYS QG . . 4.980 4.981 4.508 5.496 0.516 8 1 "[ . + 1 . 2]" 1
791 1 69 GLU HA 1 69 GLU HG2 . . 3.940 2.731 2.269 3.891 . 0 0 "[ . 1 . 2]" 1
792 1 69 GLU HA 1 69 GLU QG . . 3.420 2.600 2.223 3.344 . 0 0 "[ . 1 . 2]" 1
793 1 69 GLU HA 1 69 GLU HG3 . . 3.940 3.402 2.775 3.726 . 0 0 "[ . 1 . 2]" 1
794 1 69 GLU HA 1 72 LYS QG . . 4.060 2.961 2.440 3.551 . 0 0 "[ . 1 . 2]" 1
795 1 69 GLU QB 1 70 TYR QD . . 4.210 3.406 2.299 4.496 0.286 8 0 "[ . 1 . 2]" 1
796 1 69 GLU HB2 1 70 TYR H . . 4.280 3.014 2.377 4.213 . 0 0 "[ . 1 . 2]" 1
797 1 69 GLU HB3 1 70 TYR H . . 4.280 3.661 3.091 4.216 . 0 0 "[ . 1 . 2]" 1
798 1 69 GLU QG 1 70 TYR H . . 4.500 4.149 2.562 4.590 0.090 8 0 "[ . 1 . 2]" 1
799 1 70 TYR H 1 70 TYR HB2 . . 4.040 2.285 2.202 2.453 . 0 0 "[ . 1 . 2]" 1
800 1 70 TYR H 1 70 TYR QB . . 3.380 2.258 2.181 2.418 . 0 0 "[ . 1 . 2]" 1
801 1 70 TYR H 1 70 TYR HB3 . . 4.040 3.534 3.286 3.667 . 0 0 "[ . 1 . 2]" 1
802 1 70 TYR H 1 70 TYR QD . . 3.990 3.017 2.257 3.903 . 0 0 "[ . 1 . 2]" 1
803 1 70 TYR H 1 71 LEU H . . 4.090 2.313 2.156 2.659 . 0 0 "[ . 1 . 2]" 1
804 1 70 TYR HA 1 70 TYR QD . . 3.390 2.670 2.187 2.993 . 0 0 "[ . 1 . 2]" 1
805 1 70 TYR HA 1 70 TYR QE . . 4.510 4.401 4.185 4.563 0.053 4 0 "[ . 1 . 2]" 1
806 1 70 TYR HA 1 71 LEU H . . 3.500 3.472 3.398 3.505 0.005 14 0 "[ . 1 . 2]" 1
807 1 70 TYR HA 1 72 LYS H . . 4.590 4.125 3.856 4.427 . 0 0 "[ . 1 . 2]" 1
808 1 70 TYR HA 1 73 LEU H . . 3.510 3.279 3.039 3.400 . 0 0 "[ . 1 . 2]" 1
809 1 70 TYR HA 1 73 LEU QD . . 3.920 3.715 3.046 4.408 0.488 6 0 "[ . 1 . 2]" 1
810 1 70 TYR HA 1 73 LEU HG . . 4.760 4.610 3.947 5.287 0.527 19 1 "[ . 1 . +2]" 1
811 1 70 TYR QB 1 71 LEU H . . 3.530 2.989 2.801 3.163 . 0 0 "[ . 1 . 2]" 1
812 1 70 TYR QB 2 70 TYR QD . . 4.380 2.479 2.131 2.983 . 0 0 "[ . 1 . 2]" 1
813 1 70 TYR HB2 1 71 LEU H . . 4.910 3.165 2.911 3.529 . 0 0 "[ . 1 . 2]" 1
814 1 70 TYR HB3 1 71 LEU H . . 4.910 3.702 3.471 3.970 . 0 0 "[ . 1 . 2]" 1
815 1 70 TYR QD 1 73 LEU QD . . 4.220 3.322 2.349 4.563 0.343 16 0 "[ . 1 . 2]" 1
816 1 70 TYR QD 2 67 ALA HA . . 4.210 4.079 3.009 4.752 0.542 4 4 "[* +. 1 . -*]" 1
817 1 70 TYR QD 2 70 TYR QB . . 4.380 2.654 2.130 3.224 . 0 0 "[ . 1 . 2]" 1
818 1 70 TYR QD 2 71 LEU QD . . 4.140 4.307 3.820 4.766 0.626 8 2 "[ .- + 1 . 2]" 1
819 1 70 TYR QD 2 74 LYS QG . . 4.690 3.909 2.775 4.823 0.133 17 0 "[ . 1 . 2]" 1
820 1 70 TYR QE 2 71 LEU H . . 4.700 4.769 4.037 5.247 0.547 1 3 "[+ . -1* . 2]" 1
821 1 70 TYR QE 2 71 LEU QD . . 4.110 2.804 2.263 3.252 . 0 0 "[ . 1 . 2]" 1
822 1 70 TYR QE 2 74 LYS QE . . 4.800 3.028 2.154 4.267 . 0 0 "[ . 1 . 2]" 1
823 1 71 LEU H 1 71 LEU QB . . 2.930 2.161 2.097 2.255 . 0 0 "[ . 1 . 2]" 1
824 1 71 LEU H 1 71 LEU QD . . 4.170 3.341 2.625 3.647 . 0 0 "[ . 1 . 2]" 1
825 1 71 LEU H 1 72 LYS H . . 4.010 2.648 2.519 2.760 . 0 0 "[ . 1 . 2]" 1
826 1 71 LEU H 2 70 TYR QE . . 4.700 4.626 4.119 5.235 0.535 6 1 "[ .+ 1 . 2]" 1
827 1 71 LEU HA 1 71 LEU QD . . 3.080 2.165 2.001 2.303 . 0 0 "[ . 1 . 2]" 1
828 1 71 LEU HA 1 72 LYS H . . 3.510 3.513 3.465 3.549 0.039 7 0 "[ . 1 . 2]" 1
829 1 71 LEU HA 1 73 LEU H . . 4.510 3.816 3.635 4.151 . 0 0 "[ . 1 . 2]" 1
830 1 71 LEU HA 1 74 LYS H . . 3.550 3.453 3.204 3.693 0.143 13 0 "[ . 1 . 2]" 1
831 1 71 LEU HA 1 74 LYS QB . . 4.100 3.850 3.207 4.365 0.265 8 0 "[ . 1 . 2]" 1
832 1 71 LEU HA 1 74 LYS QD . . 4.800 3.343 2.302 4.451 . 0 0 "[ . 1 . 2]" 1
833 1 71 LEU HA 1 74 LYS QE . . 4.340 4.213 3.031 4.881 0.541 5 2 "[ + - . 2]" 1
834 1 71 LEU HA 1 74 LYS QG . . 3.870 2.365 2.089 2.998 . 0 0 "[ . 1 . 2]" 1
835 1 71 LEU HA 1 75 GLU H . . 4.930 4.443 4.172 4.791 . 0 0 "[ . 1 . 2]" 1
836 1 71 LEU HA 1 75 GLU QB . . 4.790 4.869 4.503 5.139 0.349 13 0 "[ . 1 . 2]" 1
837 1 71 LEU QB 1 71 LEU QD . . 2.830 1.963 1.940 2.056 . 0 0 "[ . 1 . 2]" 1
838 1 71 LEU QB 1 72 LYS H . . 4.030 2.742 2.518 2.945 . 0 0 "[ . 1 . 2]" 1
839 1 71 LEU QB 1 72 LYS HA . . 4.680 3.860 3.733 3.995 . 0 0 "[ . 1 . 2]" 1
840 1 71 LEU QB 2 34 LEU QD . . 4.180 4.153 3.534 4.602 0.422 19 0 "[ . 1 . 2]" 1
841 1 71 LEU QD 1 72 LYS H . . 4.420 4.175 4.008 4.325 . 0 0 "[ . 1 . 2]" 1
842 1 71 LEU QD 1 74 LYS QD . . 4.380 2.507 2.123 3.514 . 0 0 "[ . 1 . 2]" 1
843 1 71 LEU QD 1 74 LYS QE . . 3.760 3.239 2.155 4.278 0.518 6 1 "[ .+ 1 . 2]" 1
844 1 71 LEU QD 2 34 LEU QD . . 3.010 2.310 2.093 2.739 . 0 0 "[ . 1 . 2]" 1
845 1 71 LEU QD 2 35 VAL HA . . 3.620 2.950 2.364 3.596 . 0 0 "[ . 1 . 2]" 1
846 1 71 LEU QD 2 38 PHE QB . . 4.060 3.584 2.847 4.289 0.229 11 0 "[ . 1 . 2]" 1
847 1 71 LEU QD 2 38 PHE QD . . 3.790 3.745 2.980 4.215 0.425 17 0 "[ . 1 . 2]" 1
848 1 71 LEU QD 2 70 TYR QD . . 4.140 4.179 3.515 4.545 0.405 7 0 "[ . 1 . 2]" 1
849 1 71 LEU QD 2 70 TYR QE . . 4.110 2.625 2.182 3.196 . 0 0 "[ . 1 . 2]" 1
850 1 72 LYS H 1 72 LYS QB . . 3.340 2.527 2.339 2.744 . 0 0 "[ . 1 . 2]" 1
851 1 72 LYS H 1 72 LYS QD . . 4.770 3.858 3.152 4.277 . 0 0 "[ . 1 . 2]" 1
852 1 72 LYS H 1 72 LYS HG2 . . 4.330 2.445 2.138 3.399 . 0 0 "[ . 1 . 2]" 1
853 1 72 LYS H 1 72 LYS HG3 . . 4.330 3.067 2.069 3.736 . 0 0 "[ . 1 . 2]" 1
854 1 72 LYS H 2 27 GLU QB . . 4.890 5.213 4.495 5.516 0.626 5 8 "[* * + *-1 * .* * 2]" 1
855 1 72 LYS HA 1 72 LYS QD . . 4.350 4.229 3.779 4.535 0.185 6 0 "[ . 1 . 2]" 1
856 1 72 LYS HA 1 72 LYS QG . . 3.650 3.282 2.484 3.475 . 0 0 "[ . 1 . 2]" 1
857 1 72 LYS HA 1 73 LEU H . . 3.500 3.393 3.266 3.470 . 0 0 "[ . 1 . 2]" 1
858 1 72 LYS HA 1 74 LYS H . . 4.500 4.455 4.090 4.760 0.260 1 0 "[ . 1 . 2]" 1
859 1 72 LYS HA 1 75 GLU H . . 3.520 3.471 3.200 3.721 0.201 20 0 "[ . 1 . 2]" 1
860 1 72 LYS HA 1 75 GLU QB . . 4.280 2.807 2.234 3.815 . 0 0 "[ . 1 . 2]" 1
861 1 72 LYS HA 1 75 GLU QG . . 4.080 3.297 2.107 4.345 0.265 9 0 "[ . 1 . 2]" 1
862 1 72 LYS HA 1 76 GLU H . . 4.650 4.373 3.964 4.813 0.163 20 0 "[ . 1 . 2]" 1
863 1 72 LYS QB 1 72 LYS QD . . 3.270 2.226 2.121 2.581 . 0 0 "[ . 1 . 2]" 1
864 1 72 LYS QB 1 73 LEU H . . 3.900 3.637 2.839 3.872 . 0 0 "[ . 1 . 2]" 1
865 1 72 LYS HG2 2 27 GLU QG . . 4.770 4.248 2.529 5.318 0.548 11 2 "[ . -+ . 2]" 1
866 1 73 LEU H 1 73 LEU QB . . 3.530 2.258 2.173 2.342 . 0 0 "[ . 1 . 2]" 1
867 1 73 LEU H 1 73 LEU MD1 . . 4.440 4.220 4.070 4.328 . 0 0 "[ . 1 . 2]" 1
868 1 73 LEU H 1 73 LEU QD . . 3.820 3.714 3.577 3.819 . 0 0 "[ . 1 . 2]" 1
869 1 73 LEU H 1 73 LEU MD2 . . 4.440 4.139 3.818 4.345 . 0 0 "[ . 1 . 2]" 1
870 1 73 LEU H 1 73 LEU HG . . 4.570 4.520 4.234 4.728 0.158 9 0 "[ . 1 . 2]" 1
871 1 73 LEU H 1 74 LYS H . . 3.960 2.418 2.222 2.688 . 0 0 "[ . 1 . 2]" 1
872 1 73 LEU HA 1 73 LEU QD . . 3.600 2.116 2.016 2.300 . 0 0 "[ . 1 . 2]" 1
873 1 73 LEU HA 1 74 LYS H . . 3.560 3.540 3.471 3.568 0.008 11 0 "[ . 1 . 2]" 1
874 1 73 LEU HA 1 75 GLU H . . 4.760 4.075 3.810 4.213 . 0 0 "[ . 1 . 2]" 1
875 1 73 LEU HA 1 76 GLU H . . 3.620 3.544 3.294 3.731 0.111 13 0 "[ . 1 . 2]" 1
876 1 73 LEU HA 1 76 GLU QB . . 4.030 3.496 2.693 4.315 0.285 17 0 "[ . 1 . 2]" 1
877 1 73 LEU HA 1 77 TYR H . . 4.830 4.696 4.200 5.138 0.308 16 0 "[ . 1 . 2]" 1
878 1 73 LEU QD 1 74 LYS H . . 3.640 3.657 3.149 4.149 0.509 7 1 "[ . + 1 . 2]" 1
879 1 73 LEU QD 1 74 LYS HA . . 3.960 3.662 2.786 4.393 0.433 7 0 "[ . 1 . 2]" 1
880 1 73 LEU QD 1 74 LYS QB . . 4.740 4.103 3.470 4.590 . 0 0 "[ . 1 . 2]" 1
881 1 73 LEU QD 1 75 GLU H . . 4.830 4.751 4.343 5.237 0.407 7 0 "[ . 1 . 2]" 1
882 1 73 LEU QD 1 76 GLU QB . . 4.180 3.624 2.683 4.407 0.227 17 0 "[ . 1 . 2]" 1
883 1 73 LEU QD 1 76 GLU QG . . 3.910 3.167 2.422 4.428 0.518 1 2 "[+ . 1 - . 2]" 1
884 1 73 LEU QD 1 77 TYR H . . 4.430 4.275 3.450 4.943 0.513 14 2 "[ . 1 +. - 2]" 1
885 1 73 LEU QD 1 77 TYR QB . . 4.500 3.918 2.687 4.866 0.366 10 0 "[ . 1 . 2]" 1
886 1 73 LEU QD 2 74 LYS QD . . 4.470 3.532 2.169 4.456 . 0 0 "[ . 1 . 2]" 1
887 1 73 LEU QD 2 74 LYS QE . . 4.370 2.811 2.135 4.056 . 0 0 "[ . 1 . 2]" 1
888 1 73 LEU MD1 1 74 LYS H . . 4.490 4.006 3.232 4.699 0.209 19 0 "[ . 1 . 2]" 1
889 1 73 LEU MD1 1 74 LYS HA . . 4.620 3.935 2.814 4.921 0.301 12 0 "[ . 1 . 2]" 1
890 1 73 LEU MD2 1 74 LYS H . . 4.490 4.437 4.157 4.628 0.138 7 0 "[ . 1 . 2]" 1
891 1 73 LEU MD2 1 74 LYS HA . . 4.620 4.841 4.477 5.165 0.545 1 3 "[+ .- 1 * . 2]" 1
892 1 73 LEU HG 1 74 LYS H . . 4.420 4.414 3.451 4.958 0.538 5 4 "[ * + 1 *- 2]" 1
893 1 73 LEU HG 2 74 LYS QE . . 4.390 4.069 2.658 4.964 0.574 12 2 "[ . - + . 2]" 1
894 1 74 LYS H 1 74 LYS HB2 . . 4.040 3.613 3.495 3.652 . 0 0 "[ . 1 . 2]" 1
895 1 74 LYS H 1 74 LYS QB . . 3.270 2.479 2.175 2.669 . 0 0 "[ . 1 . 2]" 1
896 1 74 LYS H 1 74 LYS HB3 . . 4.040 2.527 2.197 2.748 . 0 0 "[ . 1 . 2]" 1
897 1 74 LYS H 1 74 LYS QG . . 4.140 2.395 2.145 2.967 . 0 0 "[ . 1 . 2]" 1
898 1 74 LYS H 1 75 GLU H . . 3.640 2.492 2.324 2.622 . 0 0 "[ . 1 . 2]" 1
899 1 74 LYS HA 1 74 LYS QD . . 4.650 4.242 3.669 4.554 . 0 0 "[ . 1 . 2]" 1
900 1 74 LYS HA 1 74 LYS QG . . 3.990 3.353 3.230 3.441 . 0 0 "[ . 1 . 2]" 1
901 1 74 LYS HA 1 75 GLU H . . 3.630 3.445 3.358 3.495 . 0 0 "[ . 1 . 2]" 1
902 1 74 LYS HA 1 75 GLU HA . . 4.630 4.735 4.624 4.830 0.200 12 0 "[ . 1 . 2]" 1
903 1 74 LYS HA 1 76 GLU H . . 4.630 4.269 3.958 4.554 . 0 0 "[ . 1 . 2]" 1
904 1 74 LYS HA 1 77 TYR H . . 4.440 3.385 3.150 3.673 . 0 0 "[ . 1 . 2]" 1
905 1 74 LYS HA 1 77 TYR HB2 . . 4.700 3.244 2.653 3.911 . 0 0 "[ . 1 . 2]" 1
906 1 74 LYS HA 1 77 TYR QB . . 4.040 2.680 2.140 3.336 . 0 0 "[ . 1 . 2]" 1
907 1 74 LYS HA 1 77 TYR HB3 . . 4.700 2.884 2.210 3.748 . 0 0 "[ . 1 . 2]" 1
908 1 74 LYS QB 1 74 LYS QD . . 3.010 2.244 2.111 2.344 . 0 0 "[ . 1 . 2]" 1
909 1 74 LYS QB 1 74 LYS QE . . 3.740 2.316 2.140 3.672 . 0 0 "[ . 1 . 2]" 1
910 1 74 LYS QB 1 75 GLU H . . 3.580 3.618 3.524 3.733 0.153 4 0 "[ . 1 . 2]" 1
911 1 74 LYS QB 1 75 GLU QB . . 4.790 4.862 4.767 4.987 0.197 17 0 "[ . 1 . 2]" 1
912 1 74 LYS HB2 1 74 LYS QD . . 3.490 2.462 2.206 3.010 . 0 0 "[ . 1 . 2]" 1
913 1 74 LYS HB2 1 74 LYS QE . . 4.300 2.451 2.177 4.127 . 0 0 "[ . 1 . 2]" 1
914 1 74 LYS HB2 1 75 GLU H . . 4.290 4.110 3.932 4.329 0.039 18 0 "[ . 1 . 2]" 1
915 1 74 LYS HB2 2 73 LEU MD1 . . 4.010 3.428 2.208 4.593 0.583 7 2 "[ . + 1 . - 2]" 1
916 1 74 LYS HB3 1 74 LYS QD . . 3.490 2.908 2.234 3.430 . 0 0 "[ . 1 . 2]" 1
917 1 74 LYS HB3 1 74 LYS QE . . 4.300 3.080 2.263 4.116 . 0 0 "[ . 1 . 2]" 1
918 1 74 LYS HB3 1 75 GLU H . . 4.290 4.034 3.732 4.216 . 0 0 "[ . 1 . 2]" 1
919 1 74 LYS QD 2 73 LEU QD . . 4.470 3.547 2.177 4.568 0.098 12 0 "[ . 1 . 2]" 1
920 1 74 LYS QE 1 74 LYS QG . . 3.390 2.310 2.154 2.670 . 0 0 "[ . 1 . 2]" 1
921 1 74 LYS QE 2 70 TYR QE . . 4.800 3.050 2.173 4.881 0.081 10 0 "[ . 1 . 2]" 1
922 1 74 LYS QE 2 73 LEU QD . . 4.370 3.090 2.095 4.592 0.222 14 0 "[ . 1 . 2]" 1
923 1 74 LYS QE 2 73 LEU HG . . 4.390 4.116 2.789 4.947 0.557 15 3 "[ . 1 *+ - 2]" 1
924 1 74 LYS QG 1 75 GLU H . . 4.390 2.415 2.177 2.774 . 0 0 "[ . 1 . 2]" 1
925 1 74 LYS QG 1 75 GLU QB . . 3.580 3.249 2.923 3.509 . 0 0 "[ . 1 . 2]" 1
926 1 75 GLU H 1 75 GLU QB . . 2.950 2.286 2.142 2.587 . 0 0 "[ . 1 . 2]" 1
927 1 75 GLU H 1 75 GLU QG . . 4.050 3.515 2.147 4.073 0.023 5 0 "[ . 1 . 2]" 1
928 1 75 GLU H 1 76 GLU H . . 3.370 2.534 2.368 2.669 . 0 0 "[ . 1 . 2]" 1
929 1 75 GLU HA 1 75 GLU QG . . 3.640 3.008 2.431 3.428 . 0 0 "[ . 1 . 2]" 1
930 1 75 GLU HA 1 76 GLU H . . 3.600 3.525 3.438 3.573 . 0 0 "[ . 1 . 2]" 1
931 1 75 GLU HA 1 77 TYR H . . 4.900 4.099 3.705 4.349 . 0 0 "[ . 1 . 2]" 1
932 1 75 GLU HA 1 78 GLN H . . 3.700 3.555 3.122 3.862 0.162 17 0 "[ . 1 . 2]" 1
933 1 75 GLU QB 1 76 GLU H . . 3.320 2.893 2.372 3.590 0.270 16 0 "[ . 1 . 2]" 1
934 1 75 GLU QG 1 76 GLU H . . 3.740 3.319 2.150 4.285 0.545 15 2 "[ . - + 2]" 1
935 1 75 GLU QG 1 76 GLU HA . . 4.410 3.690 2.869 4.743 0.333 15 0 "[ . 1 . 2]" 1
936 1 75 GLU QG 2 27 GLU QG . . 4.750 4.523 3.550 5.301 0.551 7 3 "[ . +* 1 . -2]" 1
937 1 76 GLU H 1 76 GLU QB . . 3.300 2.373 2.178 2.557 . 0 0 "[ . 1 . 2]" 1
938 1 76 GLU H 1 76 GLU HG2 . . 4.380 3.410 2.192 4.624 0.244 11 0 "[ . 1 . 2]" 1
939 1 76 GLU H 1 76 GLU QG . . 4.410 3.095 2.166 4.057 . 0 0 "[ . 1 . 2]" 1
940 1 76 GLU H 1 76 GLU HG3 . . 4.260 3.766 2.774 4.552 0.292 10 0 "[ . 1 . 2]" 1
941 1 76 GLU H 1 77 TYR H . . 3.480 2.547 2.406 2.729 . 0 0 "[ . 1 . 2]" 1
942 1 76 GLU H 1 78 GLN H . . 4.760 4.372 4.184 4.636 . 0 0 "[ . 1 . 2]" 1
943 1 76 GLU HA 1 76 GLU QG . . 3.640 3.016 2.252 3.394 . 0 0 "[ . 1 . 2]" 1
944 1 76 GLU HA 1 77 TYR H . . 3.480 3.475 3.417 3.532 0.052 9 0 "[ . 1 . 2]" 1
945 1 76 GLU HA 1 78 GLN H . . 4.760 4.397 3.985 4.707 . 0 0 "[ . 1 . 2]" 1
946 1 76 GLU HA 1 79 ARG H . . 3.680 3.223 3.034 3.404 . 0 0 "[ . 1 . 2]" 1
947 1 76 GLU HA 1 79 ARG QG . . 4.080 3.410 2.333 4.109 0.029 19 0 "[ . 1 . 2]" 1
948 1 76 GLU QB 1 77 TYR H . . 3.770 3.182 2.539 3.666 . 0 0 "[ . 1 . 2]" 1
949 1 76 GLU QG 1 77 TYR HA . . 4.210 3.589 3.025 4.437 0.227 10 0 "[ . 1 . 2]" 1
950 1 76 GLU QG 2 77 TYR QE . . 3.880 4.122 3.220 4.445 0.565 17 7 "[* .* -* ** . + 2]" 1
951 1 77 TYR H 1 77 TYR HB2 . . 3.780 2.636 2.510 2.730 . 0 0 "[ . 1 . 2]" 1
952 1 77 TYR H 1 77 TYR HB3 . . 3.780 2.393 2.314 2.502 . 0 0 "[ . 1 . 2]" 1
953 1 77 TYR H 1 77 TYR QD . . 4.260 4.188 4.166 4.202 . 0 0 "[ . 1 . 2]" 1
954 1 77 TYR H 1 78 GLN H . . 3.650 2.744 2.621 2.863 . 0 0 "[ . 1 . 2]" 1
955 1 77 TYR HA 1 77 TYR QD . . 3.460 2.256 2.142 2.409 . 0 0 "[ . 1 . 2]" 1
956 1 77 TYR HA 1 78 GLN H . . 3.650 3.544 3.509 3.570 . 0 0 "[ . 1 . 2]" 1
957 1 77 TYR HA 1 79 ARG H . . 4.650 4.268 4.020 4.602 . 0 0 "[ . 1 . 2]" 1
958 1 77 TYR HA 1 80 LEU H . . 3.730 3.766 3.483 4.282 0.552 6 1 "[ .+ 1 . 2]" 1
959 1 77 TYR HA 1 80 LEU QB . . 4.570 3.494 2.649 5.084 0.514 16 1 "[ . 1 .+ 2]" 1
960 1 77 TYR HA 1 80 LEU QD . . 4.360 3.033 2.176 3.882 . 0 0 "[ . 1 . 2]" 1
961 1 77 TYR QB 1 78 GLN H . . 3.660 2.488 2.318 2.747 . 0 0 "[ . 1 . 2]" 1
962 1 77 TYR HB2 1 78 GLN H . . 4.190 3.880 3.770 4.038 . 0 0 "[ . 1 . 2]" 1
963 1 77 TYR HB3 1 78 GLN H . . 4.190 2.519 2.339 2.796 . 0 0 "[ . 1 . 2]" 1
964 1 77 TYR QD 1 78 GLN H . . 4.290 3.849 3.430 4.179 . 0 0 "[ . 1 . 2]" 1
965 1 77 TYR QD 1 78 GLN HA . . 4.780 4.344 4.075 4.535 . 0 0 "[ . 1 . 2]" 1
966 1 77 TYR QD 1 80 LEU QD . . 4.830 3.035 2.509 3.688 . 0 0 "[ . 1 . 2]" 1
967 1 77 TYR QD 2 80 LEU MD1 . . 4.230 4.488 3.881 4.947 0.717 2 5 "[ + .*- 1 . ** 2]" 1
968 1 77 TYR QD 2 80 LEU MD2 . . 4.410 4.048 3.600 4.943 0.533 10 1 "[ . + . 2]" 1
969 1 77 TYR QE 1 80 LEU QD . . 4.090 3.929 3.431 4.609 0.519 7 1 "[ . + 1 . 2]" 1
970 1 77 TYR QE 1 81 ARG HD2 . . 3.980 2.770 2.199 4.174 0.194 9 0 "[ . 1 . 2]" 1
971 1 77 TYR QE 1 81 ARG QD . . 3.480 2.568 2.174 3.287 . 0 0 "[ . 1 . 2]" 1
972 1 77 TYR QE 1 81 ARG HD3 . . 3.980 3.632 2.449 4.085 0.105 8 0 "[ . 1 . 2]" 1
973 1 77 TYR QE 2 76 GLU QG . . 3.880 4.302 3.385 4.516 0.636 13 14 "[* *** **1* +**** -*]" 1
974 1 77 TYR QE 2 80 LEU QD . . 4.140 2.207 2.079 2.637 . 0 0 "[ . 1 . 2]" 1
975 1 77 TYR QE 2 81 ARG QD . . 4.530 4.069 3.573 4.692 0.162 18 0 "[ . 1 . 2]" 1
976 1 77 TYR QE 2 81 ARG HG2 . . 4.420 4.388 3.603 5.033 0.613 18 7 "[ * **- 1 * * + 2]" 1
977 1 77 TYR QE 2 81 ARG QG . . 3.840 3.826 3.397 4.046 0.206 15 0 "[ . 1 . 2]" 1
978 1 77 TYR QE 2 81 ARG HG3 . . 4.420 4.367 3.880 4.958 0.538 12 1 "[ . 1 + . 2]" 1
979 1 78 GLN H 1 78 GLN HB2 . . 3.980 2.723 2.295 3.642 . 0 0 "[ . 1 . 2]" 1
980 1 78 GLN H 1 78 GLN QB . . 3.390 2.385 2.123 2.670 . 0 0 "[ . 1 . 2]" 1
981 1 78 GLN H 1 78 GLN HB3 . . 3.980 3.259 2.178 3.605 . 0 0 "[ . 1 . 2]" 1
982 1 78 GLN H 1 78 GLN HG2 . . 4.180 2.926 2.118 4.217 0.037 13 0 "[ . 1 . 2]" 1
983 1 78 GLN H 1 78 GLN HG3 . . 4.180 3.235 2.179 4.666 0.486 13 0 "[ . 1 . 2]" 1
984 1 78 GLN H 1 79 ARG H . . 3.720 2.520 2.257 2.617 . 0 0 "[ . 1 . 2]" 1
985 1 78 GLN HA 1 78 GLN HG2 . . 4.080 3.093 2.593 4.143 0.063 18 0 "[ . 1 . 2]" 1
986 1 78 GLN HA 1 78 GLN HG3 . . 4.080 3.432 2.767 3.783 . 0 0 "[ . 1 . 2]" 1
987 1 78 GLN HA 1 79 ARG H . . 3.720 3.476 3.409 3.512 . 0 0 "[ . 1 . 2]" 1
988 1 78 GLN HA 1 80 LEU H . . 4.720 4.433 3.950 4.820 0.100 7 0 "[ . 1 . 2]" 1
989 1 78 GLN HA 1 81 ARG H . . 3.720 3.499 3.105 4.154 0.434 7 0 "[ . 1 . 2]" 1
990 1 78 GLN QG 1 79 ARG H . . 4.790 3.753 2.419 4.393 . 0 0 "[ . 1 . 2]" 1
991 1 79 ARG H 1 79 ARG HB2 . . 3.900 2.398 2.167 2.710 . 0 0 "[ . 1 . 2]" 1
992 1 79 ARG H 1 79 ARG QB . . 3.390 2.281 2.145 2.558 . 0 0 "[ . 1 . 2]" 1
993 1 79 ARG H 1 79 ARG HB3 . . 3.900 3.134 2.359 3.640 . 0 0 "[ . 1 . 2]" 1
994 1 79 ARG H 1 79 ARG QD . . 4.350 3.894 2.200 4.608 0.258 17 0 "[ . 1 . 2]" 1
995 1 79 ARG H 1 79 ARG HG2 . . 4.500 3.851 2.172 4.634 0.134 5 0 "[ . 1 . 2]" 1
996 1 79 ARG H 1 79 ARG HG3 . . 4.380 3.818 2.426 4.558 0.178 12 0 "[ . 1 . 2]" 1
997 1 79 ARG H 1 80 LEU H . . 3.790 2.592 2.332 3.013 . 0 0 "[ . 1 . 2]" 1
998 1 79 ARG H 1 80 LEU QD . . 4.730 4.963 3.748 5.397 0.667 18 13 "[** * -****** * + *]" 1
999 1 79 ARG HA 1 79 ARG HG2 . . 4.080 3.157 2.360 3.862 . 0 0 "[ . 1 . 2]" 1
1000 1 79 ARG HA 1 79 ARG HG3 . . 4.080 2.998 2.326 3.844 . 0 0 "[ . 1 . 2]" 1
1001 1 79 ARG HA 1 80 LEU H . . 3.790 3.527 3.459 3.594 . 0 0 "[ . 1 . 2]" 1
1002 1 79 ARG HA 1 81 ARG H . . 4.790 4.398 3.787 4.689 . 0 0 "[ . 1 . 2]" 1
1003 1 79 ARG HA 1 82 GLU H . . 3.580 3.708 3.309 4.156 0.576 16 1 "[ . 1 .+ 2]" 1
1004 1 79 ARG HA 1 82 GLU HG2 . . 3.930 2.294 2.174 2.649 . 0 0 "[ . 1 . 2]" 1
1005 1 79 ARG HA 1 82 GLU QG . . 3.420 2.258 2.155 2.607 . 0 0 "[ . 1 . 2]" 1
1006 1 79 ARG HA 1 82 GLU HG3 . . 3.930 3.594 2.620 4.016 0.086 1 0 "[ . 1 . 2]" 1
1007 1 79 ARG QB 1 80 LEU H . . 3.880 2.565 2.280 2.771 . 0 0 "[ . 1 . 2]" 1
1008 1 79 ARG QB 1 80 LEU QD . . 4.940 4.489 3.629 5.033 0.093 15 0 "[ . 1 . 2]" 1
1009 1 80 LEU H 1 80 LEU QB . . 3.170 2.277 2.128 2.603 . 0 0 "[ . 1 . 2]" 1
1010 1 80 LEU H 1 80 LEU QD . . 3.240 3.330 2.174 3.740 0.500 7 1 "[ . + 1 . 2]" 1
1011 1 80 LEU H 1 80 LEU HG . . 4.510 3.813 2.337 4.421 . 0 0 "[ . 1 . 2]" 1
1012 1 80 LEU H 1 81 ARG H . . 3.670 2.565 2.324 2.774 . 0 0 "[ . 1 . 2]" 1
1013 1 80 LEU HA 1 80 LEU QD . . 4.180 2.784 2.218 3.461 . 0 0 "[ . 1 . 2]" 1
1014 1 80 LEU HA 1 81 ARG H . . 3.670 3.499 3.280 3.563 . 0 0 "[ . 1 . 2]" 1
1015 1 80 LEU HA 1 82 GLU H . . 4.670 4.521 4.308 4.725 0.055 2 0 "[ . 1 . 2]" 1
1016 1 80 LEU HA 1 83 GLN H . . 3.670 3.629 3.304 3.904 0.234 20 0 "[ . 1 . 2]" 1
1017 1 80 LEU QB 1 81 ARG H . . 3.930 2.953 2.416 3.873 . 0 0 "[ . 1 . 2]" 1
1018 1 80 LEU QB 1 81 ARG HA . . 4.760 4.366 4.142 4.786 0.026 6 0 "[ . 1 . 2]" 1
1019 1 80 LEU QD 1 81 ARG H . . 4.520 3.295 2.176 3.841 . 0 0 "[ . 1 . 2]" 1
1020 1 80 LEU QD 1 81 ARG HA . . 3.810 3.515 2.626 4.057 0.247 9 0 "[ . 1 . 2]" 1
1021 1 80 LEU QD 1 81 ARG QB . . 4.200 4.160 3.077 4.683 0.483 18 0 "[ . 1 . 2]" 1
1022 1 80 LEU QD 1 81 ARG QD . . 4.000 4.130 3.386 4.560 0.560 20 6 "[** * - . * +]" 1
1023 1 80 LEU QD 1 81 ARG QG . . 3.940 2.773 2.111 3.276 . 0 0 "[ . 1 . 2]" 1
1024 1 80 LEU QD 1 82 GLU H . . 4.870 5.044 4.150 5.389 0.519 2 1 "[ + . 1 . 2]" 1
1025 1 80 LEU QD 2 77 TYR QE . . 4.140 2.240 2.133 2.496 . 0 0 "[ . 1 . 2]" 1
1026 1 80 LEU QD 2 81 ARG QB . . 4.060 4.356 4.081 4.527 0.467 9 0 "[ . 1 . 2]" 1
1027 1 81 ARG H 1 81 ARG HB2 . . 4.100 2.344 2.168 2.556 . 0 0 "[ . 1 . 2]" 1
1028 1 81 ARG H 1 81 ARG QB . . 3.310 2.313 2.147 2.506 . 0 0 "[ . 1 . 2]" 1
1029 1 81 ARG H 1 81 ARG HB3 . . 4.100 3.560 3.455 3.609 . 0 0 "[ . 1 . 2]" 1
1030 1 81 ARG H 1 81 ARG QG . . 3.680 2.671 2.209 3.137 . 0 0 "[ . 1 . 2]" 1
1031 1 81 ARG H 1 82 GLU H . . 3.370 2.613 2.355 2.789 . 0 0 "[ . 1 . 2]" 1
1032 1 81 ARG H 1 82 GLU QG . . 4.740 4.162 3.744 4.971 0.231 7 0 "[ . 1 . 2]" 1
1033 1 81 ARG HA 1 81 ARG QD . . 4.340 3.685 2.854 4.188 . 0 0 "[ . 1 . 2]" 1
1034 1 81 ARG HA 1 81 ARG QG . . 3.620 2.310 2.162 2.424 . 0 0 "[ . 1 . 2]" 1
1035 1 81 ARG HA 1 82 GLU H . . 3.670 3.546 3.484 3.578 . 0 0 "[ . 1 . 2]" 1
1036 1 81 ARG HA 1 83 GLN H . . 4.370 4.114 3.762 4.309 . 0 0 "[ . 1 . 2]" 1
1037 1 81 ARG HA 1 84 LEU H . . 3.670 3.511 3.163 3.872 0.202 12 0 "[ . 1 . 2]" 1
1038 1 81 ARG QB 1 81 ARG QD . . 3.260 2.308 2.139 2.454 . 0 0 "[ . 1 . 2]" 1
1039 1 81 ARG QB 1 82 GLU H . . 3.580 2.665 2.407 2.934 . 0 0 "[ . 1 . 2]" 1
1040 1 81 ARG HB2 1 82 GLU H . . 4.090 2.767 2.458 3.194 . 0 0 "[ . 1 . 2]" 1
1041 1 81 ARG HB3 1 82 GLU H . . 4.090 3.533 3.179 3.809 . 0 0 "[ . 1 . 2]" 1
1042 1 81 ARG QG 1 82 GLU H . . 4.730 4.231 3.990 4.561 . 0 0 "[ . 1 . 2]" 1
1043 1 81 ARG QG 2 77 TYR QE . . 3.840 4.291 3.832 4.412 0.572 4 7 "[* +* *- 1 *. *2]" 1
1044 1 81 ARG QG 2 80 LEU MD1 . . 4.400 3.881 3.264 4.670 0.270 10 0 "[ . 1 . 2]" 1
1045 1 82 GLU H 1 82 GLU QB . . 2.920 2.442 2.216 2.620 . 0 0 "[ . 1 . 2]" 1
1046 1 82 GLU H 1 82 GLU QG . . 3.490 2.355 2.146 3.030 . 0 0 "[ . 1 . 2]" 1
1047 1 82 GLU H 1 83 GLN H . . 2.950 2.557 2.393 2.650 . 0 0 "[ . 1 . 2]" 1
1048 1 82 GLU HA 1 82 GLU QG . . 3.580 3.332 3.186 3.445 . 0 0 "[ . 1 . 2]" 1
1049 1 82 GLU HA 1 83 GLN H . . 3.500 3.464 3.367 3.512 0.012 20 0 "[ . 1 . 2]" 1
1050 1 82 GLU HA 1 84 LEU H . . 4.500 3.872 3.600 4.135 . 0 0 "[ . 1 . 2]" 1
1051 1 82 GLU HA 1 85 LYS H . . 3.500 3.449 3.057 4.054 0.554 8 2 "[ . + 1 . -]" 1
1052 1 82 GLU HA 1 85 LYS QB . . 3.730 3.112 2.267 4.265 0.535 9 1 "[ . +1 . 2]" 1
1053 1 82 GLU HA 1 85 LYS QD . . 4.140 2.705 2.162 3.959 . 0 0 "[ . 1 . 2]" 1
1054 1 82 GLU HA 1 85 LYS QG . . 3.970 2.836 2.112 4.000 0.030 11 0 "[ . 1 . 2]" 1
1055 1 82 GLU QB 1 83 GLN H . . 4.860 3.589 3.455 3.800 . 0 0 "[ . 1 . 2]" 1
1056 1 82 GLU QB 1 85 LYS QD . . 4.510 3.759 2.736 4.931 0.421 15 0 "[ . 1 . 2]" 1
1057 1 82 GLU QG 1 83 GLN H . . 3.740 2.434 2.191 2.830 . 0 0 "[ . 1 . 2]" 1
1058 1 82 GLU QG 1 83 GLN HA . . 4.290 3.306 2.952 3.642 . 0 0 "[ . 1 . 2]" 1
1059 1 83 GLN H 1 83 GLN QB . . 3.090 2.308 2.140 2.669 . 0 0 "[ . 1 . 2]" 1
1060 1 83 GLN H 1 83 GLN HG2 . . 4.620 3.822 2.187 4.638 0.018 1 0 "[ . 1 . 2]" 1
1061 1 83 GLN H 1 83 GLN QG . . 3.850 3.358 2.164 4.070 0.220 1 0 "[ . 1 . 2]" 1
1062 1 83 GLN H 1 83 GLN HG3 . . 4.620 3.978 2.403 4.546 . 0 0 "[ . 1 . 2]" 1
1063 1 83 GLN H 1 84 LEU H . . 3.290 2.453 2.199 2.578 . 0 0 "[ . 1 . 2]" 1
1064 1 83 GLN H 1 84 LEU QB . . 4.850 4.160 3.913 4.331 . 0 0 "[ . 1 . 2]" 1
1065 1 83 GLN HA 1 83 GLN HG2 . . 4.060 3.330 2.389 3.846 . 0 0 "[ . 1 . 2]" 1
1066 1 83 GLN HA 1 83 GLN QG . . 3.440 2.710 2.289 3.350 . 0 0 "[ . 1 . 2]" 1
1067 1 83 GLN HA 1 83 GLN HG3 . . 3.990 2.955 2.384 3.770 . 0 0 "[ . 1 . 2]" 1
1068 1 83 GLN HA 1 84 LEU H . . 3.690 3.425 3.323 3.499 . 0 0 "[ . 1 . 2]" 1
1069 1 83 GLN HA 1 85 LYS H . . 4.690 3.989 3.442 4.704 0.014 2 0 "[ . 1 . 2]" 1
1070 1 83 GLN QB 1 84 LEU H . . 4.100 3.145 2.616 3.787 . 0 0 "[ . 1 . 2]" 1
1071 1 83 GLN HB2 1 84 LEU H . . 4.690 3.926 3.171 4.443 . 0 0 "[ . 1 . 2]" 1
1072 1 83 GLN HB3 1 84 LEU H . . 4.690 3.407 2.684 4.247 . 0 0 "[ . 1 . 2]" 1
1073 1 83 GLN QG 1 84 LEU QD . . 4.760 4.135 2.234 5.276 0.516 11 2 "[ -. 1+ . 2]" 1
1074 1 84 LEU H 1 84 LEU QB . . 3.000 2.201 2.122 2.353 . 0 0 "[ . 1 . 2]" 1
1075 1 84 LEU H 1 84 LEU MD1 . . 4.640 4.227 4.024 4.328 . 0 0 "[ . 1 . 2]" 1
1076 1 84 LEU H 1 84 LEU QD . . 4.060 3.467 2.900 3.848 . 0 0 "[ . 1 . 2]" 1
1077 1 84 LEU H 1 84 LEU MD2 . . 4.640 3.793 2.957 4.395 . 0 0 "[ . 1 . 2]" 1
1078 1 84 LEU HA 1 84 LEU MD1 . . 4.230 2.483 2.119 3.796 . 0 0 "[ . 1 . 2]" 1
1079 1 84 LEU HA 1 84 LEU MD2 . . 4.230 2.797 2.114 3.935 . 0 0 "[ . 1 . 2]" 1
1080 1 84 LEU HA 1 85 LYS H . . 3.600 3.364 2.992 3.530 . 0 0 "[ . 1 . 2]" 1
1081 1 84 LEU QB 1 84 LEU QD . . 2.780 2.007 1.940 2.098 . 0 0 "[ . 1 . 2]" 1
1082 1 84 LEU QB 1 85 LYS H . . 3.760 3.063 2.540 3.708 . 0 0 "[ . 1 . 2]" 1
1083 1 84 LEU QD 1 85 LYS H . . 3.600 4.085 3.855 4.259 0.659 4 9 "[ *+* * 1 *-* * *]" 1
1084 1 84 LEU QD 1 85 LYS HA . . 4.070 4.409 3.892 4.620 0.550 12 7 "[* * . * 1 + * *-2]" 1
1085 1 85 LYS H 1 85 LYS HB2 . . 3.660 3.067 2.325 3.931 0.271 8 0 "[ . 1 . 2]" 1
1086 1 85 LYS H 1 85 LYS QB . . 3.010 2.511 2.277 3.138 0.128 20 0 "[ . 1 . 2]" 1
1087 1 85 LYS H 1 85 LYS HB3 . . 3.660 3.158 2.304 3.700 0.040 12 0 "[ . 1 . 2]" 1
1088 1 85 LYS H 1 85 LYS QD . . 4.290 3.971 3.335 4.574 0.284 8 0 "[ . 1 . 2]" 1
1089 1 85 LYS H 1 85 LYS QG . . 3.470 2.493 2.168 2.895 . 0 0 "[ . 1 . 2]" 1
1090 1 85 LYS QB 1 85 LYS QD . . 3.030 2.197 2.119 2.329 . 0 0 "[ . 1 . 2]" 1
1091 1 85 LYS HB2 1 85 LYS QD . . 3.630 2.467 2.251 2.818 . 0 0 "[ . 1 . 2]" 1
1092 1 85 LYS HB3 1 85 LYS QD . . 3.630 2.570 2.231 3.149 . 0 0 "[ . 1 . 2]" 1
1093 1 86 LYS HA 1 86 LYS QD . . 4.430 3.722 2.122 4.366 . 0 0 "[ . 1 . 2]" 1
1094 2 8 PRO HA 2 9 LYS H . . 2.570 2.574 2.158 2.684 0.114 15 0 "[ . 1 . 2]" 1
1095 2 8 PRO HA 2 9 LYS QG . . 4.710 4.224 3.836 5.333 0.623 3 1 "[ + . 1 . 2]" 1
1096 2 8 PRO QB 2 9 LYS H . . 3.650 2.278 2.140 3.505 . 0 0 "[ . 1 . 2]" 1
1097 2 8 PRO HB2 2 9 LYS H . . 4.520 2.327 2.164 3.788 . 0 0 "[ . 1 . 2]" 1
1098 2 8 PRO HB3 2 9 LYS H . . 4.520 3.380 2.862 4.132 . 0 0 "[ . 1 . 2]" 1
1099 2 8 PRO QG 2 9 LYS H . . 4.560 3.911 3.709 4.771 0.211 11 0 "[ . 1 . 2]" 1
1100 2 9 LYS H 2 9 LYS HB2 . . 3.910 2.720 2.161 3.633 . 0 0 "[ . 1 . 2]" 1
1101 2 9 LYS H 2 9 LYS HB3 . . 3.910 3.324 2.480 3.740 . 0 0 "[ . 1 . 2]" 1
1102 2 9 LYS H 2 9 LYS HG2 . . 4.080 3.210 2.183 4.449 0.369 3 0 "[ . 1 . 2]" 1
1103 2 9 LYS H 2 9 LYS QG . . 3.430 2.421 2.097 3.692 0.262 3 0 "[ . 1 . 2]" 1
1104 2 9 LYS H 2 9 LYS HG3 . . 4.080 2.751 2.180 3.943 . 0 0 "[ . 1 . 2]" 1
1105 2 9 LYS H 2 10 THR H . . 4.650 4.382 4.009 4.583 . 0 0 "[ . 1 . 2]" 1
1106 2 9 LYS HA 2 9 LYS HG2 . . 4.250 2.801 2.205 3.840 . 0 0 "[ . 1 . 2]" 1
1107 2 9 LYS HA 2 9 LYS QG . . 3.650 2.614 2.176 3.363 . 0 0 "[ . 1 . 2]" 1
1108 2 9 LYS HA 2 9 LYS HG3 . . 4.250 3.257 2.568 3.914 . 0 0 "[ . 1 . 2]" 1
1109 2 9 LYS HA 2 10 THR H . . 2.840 2.197 2.142 2.478 . 0 0 "[ . 1 . 2]" 1
1110 2 9 LYS HA 2 10 THR MG . . 4.500 4.024 3.823 4.265 . 0 0 "[ . 1 . 2]" 1
1111 2 9 LYS HA 2 26 ALA MB . . 4.550 2.793 2.110 4.296 . 0 0 "[ . 1 . 2]" 1
1112 2 9 LYS QB 2 9 LYS QD . . 2.710 2.169 2.116 2.270 . 0 0 "[ . 1 . 2]" 1
1113 2 9 LYS QB 2 9 LYS QE . . 4.560 2.905 2.117 3.693 . 0 0 "[ . 1 . 2]" 1
1114 2 9 LYS QB 2 10 THR H . . 4.170 3.386 2.441 3.917 . 0 0 "[ . 1 . 2]" 1
1115 2 9 LYS HB2 2 10 THR H . . 4.770 4.110 2.467 4.638 . 0 0 "[ . 1 . 2]" 1
1116 2 9 LYS HB3 2 10 THR H . . 4.770 3.773 2.656 4.457 . 0 0 "[ . 1 . 2]" 1
1117 2 9 LYS QD 2 24 VAL QG . . 4.510 2.602 2.144 4.315 . 0 0 "[ . 1 . 2]" 1
1118 2 9 LYS QE 2 24 VAL QG . . 4.960 3.634 2.663 5.006 0.046 9 0 "[ . 1 . 2]" 1
1119 2 10 THR H 2 10 THR HB . . 3.400 2.652 2.407 3.349 . 0 0 "[ . 1 . 2]" 1
1120 2 10 THR H 2 10 THR MG . . 3.540 2.284 2.166 2.743 . 0 0 "[ . 1 . 2]" 1
1121 2 10 THR H 2 11 ARG H . . 4.540 4.535 4.317 4.613 0.073 10 0 "[ . 1 . 2]" 1
1122 2 10 THR H 2 24 VAL QG . . 4.380 3.913 2.977 4.234 . 0 0 "[ . 1 . 2]" 1
1123 2 10 THR H 2 25 GLY H . . 4.340 4.479 3.857 4.832 0.492 14 0 "[ . 1 . 2]" 1
1124 2 10 THR H 2 26 ALA HA . . 4.050 3.830 2.933 4.665 0.615 12 2 "[ - . 1 + . 2]" 1
1125 2 10 THR H 2 26 ALA MB . . 4.420 3.313 2.101 4.929 0.509 4 2 "[ +. 1 . - 2]" 1
1126 2 10 THR HA 2 10 THR MG . . 3.640 3.208 3.191 3.216 . 0 0 "[ . 1 . 2]" 1
1127 2 10 THR HA 2 11 ARG H . . 2.710 2.388 2.246 2.717 0.007 12 0 "[ . 1 . 2]" 1
1128 2 10 THR HB 2 11 ARG H . . 4.150 3.894 3.595 4.075 . 0 0 "[ . 1 . 2]" 1
1129 2 10 THR MG 2 11 ARG H . . 4.170 3.159 2.627 3.518 . 0 0 "[ . 1 . 2]" 1
1130 2 10 THR MG 2 12 VAL HA . . 4.690 4.703 4.104 5.230 0.540 2 1 "[ + . 1 . 2]" 1
1131 2 10 THR MG 2 12 VAL HB . . 3.710 3.803 3.301 4.196 0.486 2 0 "[ . 1 . 2]" 1
1132 2 11 ARG H 2 11 ARG QB . . 3.190 2.792 2.476 3.041 . 0 0 "[ . 1 . 2]" 1
1133 2 11 ARG H 2 11 ARG QD . . 4.820 4.044 3.797 4.421 . 0 0 "[ . 1 . 2]" 1
1134 2 11 ARG H 2 11 ARG HG2 . . 4.130 2.466 2.111 3.856 . 0 0 "[ . 1 . 2]" 1
1135 2 11 ARG H 2 11 ARG HG3 . . 4.130 3.120 2.446 3.632 . 0 0 "[ . 1 . 2]" 1
1136 2 11 ARG H 2 12 VAL H . . 4.630 4.492 4.421 4.558 . 0 0 "[ . 1 . 2]" 1
1137 2 11 ARG H 2 24 VAL HA . . 4.450 4.744 4.334 4.976 0.526 18 1 "[ . 1 . + 2]" 1
1138 2 11 ARG H 2 24 VAL QG . . 4.380 4.524 4.012 4.914 0.534 4 2 "[ +. 1 . - 2]" 1
1139 2 11 ARG H 2 25 GLY H . . 4.760 4.693 4.374 5.142 0.382 6 0 "[ . 1 . 2]" 1
1140 2 11 ARG HA 2 12 VAL H . . 2.930 2.259 2.189 2.343 . 0 0 "[ . 1 . 2]" 1
1141 2 11 ARG HA 2 12 VAL HB . . 4.560 4.336 4.202 4.476 . 0 0 "[ . 1 . 2]" 1
1142 2 11 ARG HA 2 24 VAL HA . . 1.930 2.177 1.978 2.453 0.523 18 1 "[ . 1 . + 2]" 1
1143 2 11 ARG HA 2 24 VAL QG . . 3.710 3.276 2.957 3.536 . 0 0 "[ . 1 . 2]" 1
1144 2 11 ARG HA 2 25 GLY H . . 2.640 2.601 2.178 2.993 0.353 6 0 "[ . 1 . 2]" 1
1145 2 11 ARG QB 2 12 VAL H . . 3.850 2.773 2.546 3.052 . 0 0 "[ . 1 . 2]" 1
1146 2 11 ARG QB 2 24 VAL QG . . 3.920 3.231 2.525 4.205 0.285 18 0 "[ . 1 . 2]" 1
1147 2 11 ARG QD 2 22 THR HB . . 4.680 4.029 3.096 4.611 . 0 0 "[ . 1 . 2]" 1
1148 2 11 ARG QD 2 22 THR MG . . 4.610 2.605 2.196 3.528 . 0 0 "[ . 1 . 2]" 1
1149 2 11 ARG QG 2 12 VAL H . . 4.200 3.833 3.406 4.355 0.155 18 0 "[ . 1 . 2]" 1
1150 2 12 VAL H 2 12 VAL HB . . 3.390 3.127 2.897 3.315 . 0 0 "[ . 1 . 2]" 1
1151 2 12 VAL H 2 12 VAL QG . . 4.060 2.292 2.188 2.441 . 0 0 "[ . 1 . 2]" 1
1152 2 12 VAL H 2 13 SER H . . 4.570 4.407 4.294 4.494 . 0 0 "[ . 1 . 2]" 1
1153 2 12 VAL H 2 23 ILE H . . 3.910 3.010 2.813 3.576 . 0 0 "[ . 1 . 2]" 1
1154 2 12 VAL H 2 24 VAL HA . . 3.090 3.469 3.222 3.637 0.547 4 7 "[** +* - 1 * * 2]" 1
1155 2 12 VAL H 2 25 GLY H . . 3.160 3.597 3.280 3.691 0.531 12 11 "[* *-* **+**.* *]" 1
1156 2 12 VAL HA 2 12 VAL QG . . 3.140 2.296 2.230 2.404 . 0 0 "[ . 1 . 2]" 1
1157 2 12 VAL HA 2 13 SER H . . 2.790 2.239 2.174 2.303 . 0 0 "[ . 1 . 2]" 1
1158 2 12 VAL HB 2 13 SER H . . 4.440 4.059 3.970 4.176 . 0 0 "[ . 1 . 2]" 1
1159 2 12 VAL HB 2 25 GLY H . . 4.160 4.373 3.899 4.702 0.542 17 4 "[* . 1- .*+ 2]" 1
1160 2 12 VAL QG 2 13 SER H . . 3.240 2.231 2.165 2.482 . 0 0 "[ . 1 . 2]" 1
1161 2 12 VAL QG 2 14 VAL QG . . 2.860 2.209 2.084 2.359 . 0 0 "[ . 1 . 2]" 1
1162 2 12 VAL QG 2 25 GLY QA . . 4.650 2.738 2.332 3.588 . 0 0 "[ . 1 . 2]" 1
1163 2 12 VAL QG 2 29 PRO HA . . 4.140 4.239 3.419 4.692 0.552 12 3 "[ . -*1 + . 2]" 1
1164 2 12 VAL QG 2 32 ILE H . . 4.500 4.968 4.784 5.081 0.581 13 8 "[ * .** 1* + . -* *]" 1
1165 2 12 VAL QG 2 32 ILE QG . . 4.120 2.573 2.039 2.975 . 0 0 "[ . 1 . 2]" 1
1166 2 12 VAL QG 2 33 ARG HA . . 4.170 4.230 3.753 4.747 0.577 7 2 "[ . + 1 .- 2]" 1
1167 2 12 VAL QG 2 33 ARG QD . . 4.120 3.836 2.739 4.683 0.563 12 3 "[ * . 1 + - 2]" 1
1168 2 13 SER H 2 13 SER HB2 . . 3.700 2.878 2.507 3.583 . 0 0 "[ . 1 . 2]" 1
1169 2 13 SER H 2 13 SER HB3 . . 3.700 3.588 3.074 3.782 0.082 14 0 "[ . 1 . 2]" 1
1170 2 13 SER H 2 14 VAL H . . 4.680 4.367 4.086 4.459 . 0 0 "[ . 1 . 2]" 1
1171 2 13 SER HA 2 14 VAL H . . 3.300 2.166 2.148 2.185 . 0 0 "[ . 1 . 2]" 1
1172 2 13 SER HA 2 14 VAL QG . . 3.820 3.343 3.131 3.566 . 0 0 "[ . 1 . 2]" 1
1173 2 13 SER HA 2 22 THR MG . . 4.580 3.055 2.706 3.489 . 0 0 "[ . 1 . 2]" 1
1174 2 13 SER HA 2 23 ILE H . . 4.090 3.508 3.180 3.914 . 0 0 "[ . 1 . 2]" 1
1175 2 13 SER QB 2 14 VAL H . . 3.970 3.322 3.065 3.653 . 0 0 "[ . 1 . 2]" 1
1176 2 13 SER QB 2 14 VAL QG . . 4.670 4.147 4.008 4.421 . 0 0 "[ . 1 . 2]" 1
1177 2 13 SER QB 2 22 THR HA . . 4.330 3.675 3.030 4.308 . 0 0 "[ . 1 . 2]" 1
1178 2 13 SER HB2 2 14 VAL H . . 4.690 4.018 3.486 4.317 . 0 0 "[ . 1 . 2]" 1
1179 2 13 SER HB3 2 14 VAL H . . 4.690 3.616 3.175 4.307 . 0 0 "[ . 1 . 2]" 1
1180 2 14 VAL H 2 14 VAL MG1 . . 4.260 3.117 2.665 3.561 . 0 0 "[ . 1 . 2]" 1
1181 2 14 VAL H 2 14 VAL QG . . 3.390 2.153 2.095 2.191 . 0 0 "[ . 1 . 2]" 1
1182 2 14 VAL H 2 14 VAL MG2 . . 4.260 2.199 2.127 2.245 . 0 0 "[ . 1 . 2]" 1
1183 2 14 VAL H 2 15 ARG H . . 4.920 4.444 4.216 4.538 . 0 0 "[ . 1 . 2]" 1
1184 2 14 VAL H 2 21 TYR H . . 3.930 2.905 2.664 3.232 . 0 0 "[ . 1 . 2]" 1
1185 2 14 VAL H 2 22 THR MG . . 4.700 4.794 4.146 5.229 0.529 7 1 "[ . + 1 . 2]" 1
1186 2 14 VAL H 2 23 ILE H . . 4.440 4.341 3.631 4.691 0.251 6 0 "[ . 1 . 2]" 1
1187 2 14 VAL H 2 36 ALA MB . . 4.860 5.034 4.802 5.285 0.425 16 0 "[ . 1 . 2]" 1
1188 2 14 VAL HB 2 15 ARG H . . 3.280 2.460 2.155 3.444 0.164 18 0 "[ . 1 . 2]" 1
1189 2 14 VAL HB 2 36 ALA MB . . 3.570 2.160 2.088 2.406 . 0 0 "[ . 1 . 2]" 1
1190 2 14 VAL QG 2 15 ARG H . . 3.960 3.132 2.856 3.552 . 0 0 "[ . 1 . 2]" 1
1191 2 14 VAL QG 2 33 ARG H . . 4.690 4.899 4.544 5.239 0.549 18 1 "[ . 1 . + 2]" 1
1192 2 14 VAL QG 2 33 ARG HA . . 3.690 3.001 2.312 3.399 . 0 0 "[ . 1 . 2]" 1
1193 2 14 VAL MG1 2 36 ALA MB . . 3.160 2.505 2.232 2.960 . 0 0 "[ . 1 . 2]" 1
1194 2 14 VAL MG2 2 36 ALA MB . . 3.160 2.378 2.152 3.468 0.308 18 0 "[ . 1 . 2]" 1
1195 2 15 ARG H 2 15 ARG QB . . 3.570 2.389 2.260 2.556 . 0 0 "[ . 1 . 2]" 1
1196 2 15 ARG H 2 15 ARG QD . . 4.920 4.750 4.224 5.083 0.163 19 0 "[ . 1 . 2]" 1
1197 2 15 ARG H 2 15 ARG HG2 . . 4.840 4.497 4.277 4.707 . 0 0 "[ . 1 . 2]" 1
1198 2 15 ARG H 2 15 ARG QG . . 4.150 4.045 3.946 4.136 . 0 0 "[ . 1 . 2]" 1
1199 2 15 ARG H 2 15 ARG HG3 . . 4.840 4.601 4.354 4.838 . 0 0 "[ . 1 . 2]" 1
1200 2 15 ARG H 2 16 ILE H . . 4.290 4.362 4.120 4.495 0.205 3 0 "[ . 1 . 2]" 1
1201 2 15 ARG H 2 36 ALA MB . . 4.220 3.367 2.907 3.728 . 0 0 "[ . 1 . 2]" 1
1202 2 15 ARG HA 2 16 ILE H . . 3.200 2.150 2.130 2.188 . 0 0 "[ . 1 . 2]" 1
1203 2 15 ARG HA 2 21 TYR H . . 3.150 3.377 3.047 3.662 0.512 3 2 "[ + . 1 . - 2]" 1
1204 2 15 ARG HA 2 21 TYR QD . . 4.790 4.085 3.154 5.244 0.454 16 0 "[ . 1 . 2]" 1
1205 2 15 ARG QD 2 18 GLY H . . 4.970 3.798 2.224 4.834 . 0 0 "[ . 1 . 2]" 1
1206 2 15 ARG QD 2 19 GLN H . . 4.750 4.683 3.813 5.273 0.523 8 1 "[ . + 1 . 2]" 1
1207 2 15 ARG QG 2 16 ILE H . . 3.990 2.868 2.577 3.215 . 0 0 "[ . 1 . 2]" 1
1208 2 15 ARG QG 2 16 ILE HA . . 4.870 3.953 3.389 4.400 . 0 0 "[ . 1 . 2]" 1
1209 2 15 ARG QG 2 18 GLY H . . 4.420 2.799 2.474 3.289 . 0 0 "[ . 1 . 2]" 1
1210 2 15 ARG QG 2 18 GLY QA . . 4.020 2.928 2.696 3.203 . 0 0 "[ . 1 . 2]" 1
1211 2 15 ARG QG 2 19 GLN H . . 4.070 3.368 2.622 3.791 . 0 0 "[ . 1 . 2]" 1
1212 2 15 ARG HG2 2 16 ILE H . . 4.800 3.310 2.608 3.899 . 0 0 "[ . 1 . 2]" 1
1213 2 15 ARG HG2 2 19 GLN H . . 4.770 3.897 3.145 4.930 0.160 2 0 "[ . 1 . 2]" 1
1214 2 15 ARG HG3 2 16 ILE H . . 4.800 3.460 2.658 4.630 . 0 0 "[ . 1 . 2]" 1
1215 2 15 ARG HG3 2 19 GLN H . . 4.770 3.957 2.695 5.208 0.438 17 0 "[ . 1 . 2]" 1
1216 2 16 ILE H 2 16 ILE HB . . 4.150 2.800 2.681 2.929 . 0 0 "[ . 1 . 2]" 1
1217 2 16 ILE H 2 16 ILE MG . . 4.050 3.907 3.817 3.960 . 0 0 "[ . 1 . 2]" 1
1218 2 16 ILE H 2 17 TYR H . . 4.740 4.221 4.039 4.361 . 0 0 "[ . 1 . 2]" 1
1219 2 16 ILE H 2 19 GLN H . . 3.430 3.373 2.907 3.924 0.494 4 0 "[ . 1 . 2]" 1
1220 2 16 ILE H 2 20 ASP HA . . 3.180 3.309 2.860 3.670 0.490 12 0 "[ . 1 . 2]" 1
1221 2 16 ILE H 2 21 TYR H . . 3.810 4.188 3.835 4.348 0.538 10 5 "[ * . * + - . *2]" 1
1222 2 16 ILE H 2 21 TYR QD . . 4.140 3.104 2.417 4.630 0.490 16 0 "[ . 1 . 2]" 1
1223 2 16 ILE H 2 21 TYR QE . . 4.200 3.228 2.539 4.109 . 0 0 "[ . 1 . 2]" 1
1224 2 16 ILE HA 2 17 TYR HA . . 4.560 4.353 4.312 4.385 . 0 0 "[ . 1 . 2]" 1
1225 2 16 ILE HB 2 21 TYR QD . . 4.130 2.684 2.170 3.515 . 0 0 "[ . 1 . 2]" 1
1226 2 16 ILE HB 2 21 TYR QE . . 4.240 2.277 2.079 2.724 . 0 0 "[ . 1 . 2]" 1
1227 2 16 ILE MD 2 16 ILE MG . . 3.110 2.251 2.151 3.067 . 0 0 "[ . 1 . 2]" 1
1228 2 16 ILE MD 2 21 TYR QD . . 4.470 2.354 2.140 2.804 . 0 0 "[ . 1 . 2]" 1
1229 2 16 ILE MD 2 21 TYR QE . . 3.770 3.459 2.754 4.002 0.232 13 0 "[ . 1 . 2]" 1
1230 2 16 ILE MD 2 36 ALA HA . . 4.000 2.911 2.192 3.498 . 0 0 "[ . 1 . 2]" 1
1231 2 16 ILE MD 2 36 ALA MB . . 3.410 3.011 2.480 3.698 0.288 17 0 "[ . 1 . 2]" 1
1232 2 16 ILE MD 2 39 VAL QG . . 3.430 2.868 2.223 3.445 0.015 3 0 "[ . 1 . 2]" 1
1233 2 16 ILE MG 2 17 TYR H . . 4.210 2.739 2.571 2.975 . 0 0 "[ . 1 . 2]" 1
1234 2 16 ILE MG 2 17 TYR HA . . 4.460 3.963 3.765 4.130 . 0 0 "[ . 1 . 2]" 1
1235 2 16 ILE MG 2 21 TYR QD . . 4.480 4.129 3.732 4.719 0.239 18 0 "[ . 1 . 2]" 1
1236 2 16 ILE MG 2 21 TYR QE . . 3.470 3.517 2.880 3.854 0.384 2 0 "[ . 1 . 2]" 1
1237 2 16 ILE MG 2 39 VAL QG . . 4.720 2.389 2.141 2.878 . 0 0 "[ . 1 . 2]" 1
1238 2 16 ILE MG 2 40 ASP HA . . 3.800 2.613 2.263 3.296 . 0 0 "[ . 1 . 2]" 1
1239 2 17 TYR H 2 17 TYR QD . . 4.300 3.568 2.814 3.919 . 0 0 "[ . 1 . 2]" 1
1240 2 17 TYR H 2 18 GLY H . . 3.930 2.676 2.582 2.749 . 0 0 "[ . 1 . 2]" 1
1241 2 17 TYR HA 2 17 TYR QD . . 3.900 2.462 2.139 2.867 . 0 0 "[ . 1 . 2]" 1
1242 2 17 TYR QB 2 18 GLY H . . 4.730 3.730 3.526 3.897 . 0 0 "[ . 1 . 2]" 1
1243 2 17 TYR QB 2 40 ASP HA . . 4.490 4.115 3.617 4.572 0.082 11 0 "[ . 1 . 2]" 1
1244 2 17 TYR QB 2 43 MET QB . . 4.310 4.130 3.390 4.862 0.552 10 3 "[ - . + . * 2]" 1
1245 2 17 TYR QE 2 44 HIS HA . . 3.470 2.886 2.216 3.754 0.284 15 0 "[ . 1 . 2]" 1
1246 2 17 TYR QE 2 47 SER HB2 . . 4.440 4.596 3.824 4.991 0.551 11 2 "[ . 1+ . - 2]" 1
1247 2 17 TYR QE 2 47 SER QB . . 3.870 3.958 3.119 4.342 0.472 10 0 "[ . 1 . 2]" 1
1248 2 17 TYR QE 2 47 SER HB3 . . 4.440 4.500 3.179 4.983 0.543 12 6 "[ * . * * + *- 2]" 1
1249 2 17 TYR QE 2 58 LEU QD . . 3.720 3.786 3.293 4.236 0.516 6 2 "[ - .+ 1 . 2]" 1
1250 2 18 GLY H 2 19 GLN H . . 3.650 2.678 2.366 3.155 . 0 0 "[ . 1 . 2]" 1
1251 2 19 GLN H 2 19 GLN QB . . 3.340 2.415 2.169 2.687 . 0 0 "[ . 1 . 2]" 1
1252 2 19 GLN H 2 19 GLN HG2 . . 4.280 3.551 2.341 4.589 0.309 12 0 "[ . 1 . 2]" 1
1253 2 19 GLN H 2 19 GLN QG . . 3.710 3.119 2.315 3.978 0.268 17 0 "[ . 1 . 2]" 1
1254 2 19 GLN H 2 19 GLN HG3 . . 4.280 3.865 2.781 4.618 0.338 7 0 "[ . 1 . 2]" 1
1255 2 19 GLN H 2 20 ASP H . . 4.440 4.524 4.359 4.598 0.158 10 0 "[ . 1 . 2]" 1
1256 2 19 GLN H 2 21 TYR QE . . 4.340 3.773 3.304 4.656 0.316 18 0 "[ . 1 . 2]" 1
1257 2 19 GLN HA 2 19 GLN HG2 . . 3.970 2.980 2.520 3.648 . 0 0 "[ . 1 . 2]" 1
1258 2 19 GLN HA 2 19 GLN QG . . 3.420 2.588 2.206 2.976 . 0 0 "[ . 1 . 2]" 1
1259 2 19 GLN HA 2 19 GLN HG3 . . 3.970 3.250 2.232 3.876 . 0 0 "[ . 1 . 2]" 1
1260 2 19 GLN HA 2 20 ASP H . . 2.950 2.293 2.162 2.420 . 0 0 "[ . 1 . 2]" 1
1261 2 19 GLN QB 2 20 ASP H . . 4.290 2.742 2.365 3.434 . 0 0 "[ . 1 . 2]" 1
1262 2 19 GLN QB 2 21 TYR QE . . 3.570 2.532 2.208 2.929 . 0 0 "[ . 1 . 2]" 1
1263 2 19 GLN QG 2 20 ASP H . . 4.750 4.038 2.891 4.521 . 0 0 "[ . 1 . 2]" 1
1264 2 19 GLN QG 2 21 TYR QE . . 4.280 3.979 3.334 4.521 0.241 6 0 "[ . 1 . 2]" 1
1265 2 20 ASP H 2 21 TYR H . . 4.770 4.503 4.426 4.553 . 0 0 "[ . 1 . 2]" 1
1266 2 20 ASP H 2 21 TYR QE . . 4.830 4.893 4.501 5.253 0.423 18 0 "[ . 1 . 2]" 1
1267 2 20 ASP HA 2 21 TYR H . . 3.130 2.178 2.155 2.210 . 0 0 "[ . 1 . 2]" 1
1268 2 21 TYR H 2 21 TYR QD . . 3.980 3.184 2.944 3.543 . 0 0 "[ . 1 . 2]" 1
1269 2 21 TYR H 2 22 THR H . . 4.950 4.384 4.198 4.462 . 0 0 "[ . 1 . 2]" 1
1270 2 21 TYR HA 2 21 TYR QD . . 4.300 2.733 2.201 2.940 . 0 0 "[ . 1 . 2]" 1
1271 2 21 TYR HA 2 22 THR H . . 3.340 2.256 2.151 2.377 . 0 0 "[ . 1 . 2]" 1
1272 2 21 TYR QB 2 22 THR H . . 3.510 2.801 2.408 3.317 . 0 0 "[ . 1 . 2]" 1
1273 2 21 TYR QB 2 23 ILE MD . . 4.060 3.692 2.772 4.610 0.550 16 1 "[ . 1 .+ 2]" 1
1274 2 21 TYR QD 2 22 THR H . . 4.680 4.021 3.676 4.388 . 0 0 "[ . 1 . 2]" 1
1275 2 21 TYR QD 2 23 ILE MD . . 4.810 5.052 4.282 5.410 0.600 8 7 "[ . *+ *** . * -]" 1
1276 2 22 THR H 2 22 THR HB . . 4.080 2.854 2.551 3.619 . 0 0 "[ . 1 . 2]" 1
1277 2 22 THR H 2 22 THR MG . . 4.710 3.779 3.278 3.941 . 0 0 "[ . 1 . 2]" 1
1278 2 22 THR H 2 23 ILE H . . 4.940 4.308 3.975 4.442 . 0 0 "[ . 1 . 2]" 1
1279 2 22 THR H 2 23 ILE MG . . 4.340 3.908 3.446 4.518 0.178 3 0 "[ . 1 . 2]" 1
1280 2 22 THR HB 2 23 ILE H . . 4.850 4.072 3.469 4.288 . 0 0 "[ . 1 . 2]" 1
1281 2 22 THR MG 2 23 ILE H . . 4.960 3.007 2.751 3.778 . 0 0 "[ . 1 . 2]" 1
1282 2 23 ILE H 2 23 ILE HB . . 3.620 3.828 3.630 3.936 0.316 15 0 "[ . 1 . 2]" 1
1283 2 23 ILE H 2 23 ILE MD . . 4.520 2.813 2.083 3.913 . 0 0 "[ . 1 . 2]" 1
1284 2 23 ILE H 2 23 ILE QG . . 4.320 2.524 2.116 3.281 . 0 0 "[ . 1 . 2]" 1
1285 2 23 ILE H 2 23 ILE MG . . 3.930 3.038 2.399 3.465 . 0 0 "[ . 1 . 2]" 1
1286 2 23 ILE H 2 24 VAL H . . 4.740 4.420 4.347 4.512 . 0 0 "[ . 1 . 2]" 1
1287 2 23 ILE HA 2 23 ILE MD . . 4.050 3.846 3.356 4.197 0.147 7 0 "[ . 1 . 2]" 1
1288 2 23 ILE HA 2 23 ILE MG . . 3.470 2.329 2.184 2.534 . 0 0 "[ . 1 . 2]" 1
1289 2 23 ILE HA 2 24 VAL H . . 3.130 2.541 2.379 2.679 . 0 0 "[ . 1 . 2]" 1
1290 2 23 ILE HB 2 23 ILE MD . . 3.680 2.884 2.310 3.264 . 0 0 "[ . 1 . 2]" 1
1291 2 23 ILE MD 2 23 ILE MG . . 3.270 2.084 2.002 2.162 . 0 0 "[ . 1 . 2]" 1
1292 2 23 ILE MD 2 24 VAL H . . 4.850 4.249 3.461 4.701 . 0 0 "[ . 1 . 2]" 1
1293 2 23 ILE QG 2 24 VAL H . . 4.970 3.316 2.713 3.753 . 0 0 "[ . 1 . 2]" 1
1294 2 23 ILE QG 2 24 VAL HA . . 4.680 4.254 3.889 4.674 . 0 0 "[ . 1 . 2]" 1
1295 2 23 ILE MG 2 24 VAL H . . 3.630 3.486 2.877 3.779 0.149 9 0 "[ . 1 . 2]" 1
1296 2 24 VAL H 2 24 VAL HB . . 3.490 2.532 2.397 2.755 . 0 0 "[ . 1 . 2]" 1
1297 2 24 VAL H 2 24 VAL QG . . 3.940 2.294 2.180 2.522 . 0 0 "[ . 1 . 2]" 1
1298 2 24 VAL HA 2 25 GLY H . . 3.340 2.167 2.154 2.188 . 0 0 "[ . 1 . 2]" 1
1299 2 24 VAL QG 2 25 GLY H . . 3.610 2.719 2.565 2.935 . 0 0 "[ . 1 . 2]" 1
1300 2 26 ALA H 2 27 GLU H . . 4.070 3.100 2.105 4.043 . 0 0 "[ . 1 . 2]" 1
1301 2 26 ALA HA 2 27 GLU H . . 3.470 2.758 2.275 3.363 . 0 0 "[ . 1 . 2]" 1
1302 2 26 ALA MB 2 27 GLU H . . 3.660 3.577 3.184 3.729 0.069 12 0 "[ . 1 . 2]" 1
1303 2 27 GLU H 2 27 GLU QB . . 3.880 2.591 2.173 2.949 . 0 0 "[ . 1 . 2]" 1
1304 2 27 GLU H 2 27 GLU QG . . 3.660 3.902 2.140 4.285 0.625 2 8 "[ + *.* * * -*. * 2]" 1
1305 2 27 GLU H 2 28 SER H . . 4.410 2.875 2.208 4.325 . 0 0 "[ . 1 . 2]" 1
1306 2 27 GLU HA 2 27 GLU QG . . 3.690 2.692 2.100 3.387 . 0 0 "[ . 1 . 2]" 1
1307 2 27 GLU HA 2 28 SER H . . 3.400 3.430 2.651 3.587 0.187 8 0 "[ . 1 . 2]" 1
1308 2 27 GLU QB 2 28 SER H . . 4.070 2.275 2.075 3.501 . 0 0 "[ . 1 . 2]" 1
1309 2 28 SER H 2 31 HIS H . . 4.340 4.363 4.019 4.718 0.378 19 0 "[ . 1 . 2]" 1
1310 2 28 SER H 2 31 HIS QB . . 4.060 3.169 2.731 3.845 . 0 0 "[ . 1 . 2]" 1
1311 2 29 PRO HA 2 32 ILE H . . 4.300 3.998 3.768 4.393 0.093 8 0 "[ . 1 . 2]" 1
1312 2 29 PRO HA 2 32 ILE MD . . 4.570 2.311 2.152 2.541 . 0 0 "[ . 1 . 2]" 1
1313 2 29 PRO HA 2 32 ILE QG . . 4.570 2.617 2.154 4.310 . 0 0 "[ . 1 . 2]" 1
1314 2 29 PRO QB 2 30 ALA H . . 4.010 3.043 2.419 3.634 . 0 0 "[ . 1 . 2]" 1
1315 2 29 PRO QG 2 30 ALA H . . 3.630 2.678 2.376 3.805 0.175 18 0 "[ . 1 . 2]" 1
1316 2 30 ALA H 2 30 ALA MB . . 3.030 2.277 2.234 2.362 . 0 0 "[ . 1 . 2]" 1
1317 2 30 ALA H 2 31 HIS H . . 3.690 2.446 2.178 2.599 . 0 0 "[ . 1 . 2]" 1
1318 2 30 ALA HA 2 33 ARG H . . 4.360 3.622 3.410 3.917 . 0 0 "[ . 1 . 2]" 1
1319 2 30 ALA HA 2 33 ARG QB . . 3.670 2.751 2.350 3.336 . 0 0 "[ . 1 . 2]" 1
1320 2 30 ALA HA 2 33 ARG QG . . 4.180 3.972 2.366 4.689 0.509 17 1 "[ . 1 . + 2]" 1
1321 2 30 ALA MB 2 31 HIS H . . 3.470 2.697 2.329 3.403 . 0 0 "[ . 1 . 2]" 1
1322 2 30 ALA MB 2 31 HIS HA . . 4.190 3.853 3.773 4.077 . 0 0 "[ . 1 . 2]" 1
1323 2 30 ALA MB 2 33 ARG QD . . 4.940 4.812 3.738 5.519 0.579 11 4 "[* .* -+ . 2]" 1
1324 2 31 HIS H 2 31 HIS QB . . 3.540 2.197 2.090 2.366 . 0 0 "[ . 1 . 2]" 1
1325 2 31 HIS H 2 32 ILE H . . 3.530 2.630 2.213 2.844 . 0 0 "[ . 1 . 2]" 1
1326 2 31 HIS HA 2 34 LEU H . . 4.570 3.705 3.388 3.958 . 0 0 "[ . 1 . 2]" 1
1327 2 31 HIS HA 2 34 LEU QB . . 3.840 4.139 2.889 4.395 0.555 6 6 "[ .+ ** -*. * 2]" 1
1328 2 31 HIS HA 2 34 LEU QD . . 3.830 2.245 2.133 2.700 . 0 0 "[ . 1 . 2]" 1
1329 2 31 HIS HA 2 35 VAL QG . . 4.970 4.253 3.850 5.249 0.279 16 0 "[ . 1 . 2]" 1
1330 2 31 HIS QB 2 32 ILE H . . 3.890 2.587 2.251 2.915 . 0 0 "[ . 1 . 2]" 1
1331 2 32 ILE H 2 32 ILE HB . . 3.700 3.656 3.614 3.759 0.059 14 0 "[ . 1 . 2]" 1
1332 2 32 ILE H 2 32 ILE MD . . 4.100 3.415 2.081 3.728 . 0 0 "[ . 1 . 2]" 1
1333 2 32 ILE H 2 32 ILE HG12 . . 4.050 2.384 2.118 3.752 . 0 0 "[ . 1 . 2]" 1
1334 2 32 ILE H 2 32 ILE QG . . 3.550 2.323 2.098 3.457 . 0 0 "[ . 1 . 2]" 1
1335 2 32 ILE H 2 32 ILE HG13 . . 4.050 3.443 3.132 4.079 0.029 14 0 "[ . 1 . 2]" 1
1336 2 32 ILE H 2 32 ILE MG . . 3.970 2.191 2.075 2.323 . 0 0 "[ . 1 . 2]" 1
1337 2 32 ILE H 2 33 ARG H . . 3.960 2.616 2.302 2.817 . 0 0 "[ . 1 . 2]" 1
1338 2 32 ILE HA 2 32 ILE MD . . 4.190 4.117 3.629 4.220 0.030 4 0 "[ . 1 . 2]" 1
1339 2 32 ILE HA 2 32 ILE MG . . 3.600 2.339 2.248 2.602 . 0 0 "[ . 1 . 2]" 1
1340 2 32 ILE HA 2 35 VAL H . . 4.390 3.336 2.993 3.547 . 0 0 "[ . 1 . 2]" 1
1341 2 32 ILE HA 2 35 VAL HB . . 4.000 3.240 2.658 4.551 0.551 2 1 "[ + . 1 . 2]" 1
1342 2 32 ILE HA 2 36 ALA H . . 4.400 4.886 4.503 5.041 0.641 5 10 "[ *+ *1 -** ****]" 1
1343 2 32 ILE MD 2 32 ILE MG . . 2.440 2.112 2.060 2.154 . 0 0 "[ . 1 . 2]" 1
1344 2 32 ILE MD 2 33 ARG H . . 4.890 4.088 2.347 4.823 . 0 0 "[ . 1 . 2]" 1
1345 2 32 ILE QG 2 32 ILE MG . . 3.100 2.332 2.284 2.412 . 0 0 "[ . 1 . 2]" 1
1346 2 32 ILE QG 2 33 ARG H . . 3.660 2.809 2.367 3.583 . 0 0 "[ . 1 . 2]" 1
1347 2 32 ILE QG 2 33 ARG HA . . 3.590 3.382 3.230 3.650 0.060 4 0 "[ . 1 . 2]" 1
1348 2 32 ILE QG 2 33 ARG QB . . 3.960 3.692 3.322 4.387 0.427 14 0 "[ . 1 . 2]" 1
1349 2 32 ILE MG 2 33 ARG H . . 4.500 4.076 3.952 4.183 . 0 0 "[ . 1 . 2]" 1
1350 2 33 ARG H 2 33 ARG QB . . 2.950 2.230 2.130 2.428 . 0 0 "[ . 1 . 2]" 1
1351 2 33 ARG H 2 33 ARG QD . . 4.960 3.755 2.888 4.583 . 0 0 "[ . 1 . 2]" 1
1352 2 33 ARG H 2 33 ARG QG . . 4.760 3.564 2.330 4.080 . 0 0 "[ . 1 . 2]" 1
1353 2 33 ARG H 2 34 LEU H . . 3.450 2.430 2.203 2.579 . 0 0 "[ . 1 . 2]" 1
1354 2 33 ARG HA 2 33 ARG QD . . 4.430 2.985 2.153 4.166 . 0 0 "[ . 1 . 2]" 1
1355 2 33 ARG QB 2 33 ARG HD2 . . 3.550 3.001 2.307 3.387 . 0 0 "[ . 1 . 2]" 1
1356 2 33 ARG QB 2 33 ARG QD . . 3.090 2.300 2.134 2.894 . 0 0 "[ . 1 . 2]" 1
1357 2 33 ARG QB 2 33 ARG HD3 . . 3.550 2.460 2.255 3.480 . 0 0 "[ . 1 . 2]" 1
1358 2 33 ARG QB 2 34 LEU H . . 3.100 2.763 2.507 3.046 . 0 0 "[ . 1 . 2]" 1
1359 2 33 ARG QB 2 34 LEU QD . . 4.200 4.091 3.113 4.780 0.580 19 1 "[ . 1 . +2]" 1
1360 2 34 LEU H 2 34 LEU QB . . 3.300 2.536 2.097 2.804 . 0 0 "[ . 1 . 2]" 1
1361 2 34 LEU H 2 34 LEU QD . . 4.390 2.893 2.635 3.300 . 0 0 "[ . 1 . 2]" 1
1362 2 34 LEU H 2 34 LEU HG . . 4.100 2.409 2.161 4.094 . 0 0 "[ . 1 . 2]" 1
1363 2 34 LEU H 2 35 VAL H . . 3.630 2.424 2.194 2.565 . 0 0 "[ . 1 . 2]" 1
1364 2 34 LEU HA 2 34 LEU QD . . 3.250 3.281 2.199 3.432 0.182 14 0 "[ . 1 . 2]" 1
1365 2 34 LEU HA 2 34 LEU HG . . 4.040 3.593 3.119 3.707 . 0 0 "[ . 1 . 2]" 1
1366 2 34 LEU HA 2 37 ALA MB . . 3.670 2.783 2.280 3.732 0.062 16 0 "[ . 1 . 2]" 1
1367 2 34 LEU QB 2 34 LEU HG . . 2.420 2.499 2.374 2.537 0.117 19 0 "[ . 1 . 2]" 1
1368 2 34 LEU QB 2 35 VAL H . . 3.750 3.571 2.538 3.793 0.043 8 0 "[ . 1 . 2]" 1
1369 2 34 LEU HB2 2 35 VAL H . . 4.370 4.024 2.582 4.366 . 0 0 "[ . 1 . 2]" 1
1370 2 34 LEU HB3 2 35 VAL H . . 4.370 4.078 3.352 4.288 . 0 0 "[ . 1 . 2]" 1
1371 2 34 LEU QD 2 35 VAL H . . 3.830 3.226 2.905 4.045 0.215 7 0 "[ . 1 . 2]" 1
1372 2 35 VAL H 2 35 VAL HB . . 3.680 2.649 2.400 3.643 . 0 0 "[ . 1 . 2]" 1
1373 2 35 VAL H 2 36 ALA H . . 3.560 2.723 2.596 2.966 . 0 0 "[ . 1 . 2]" 1
1374 2 35 VAL H 2 36 ALA MB . . 4.690 4.367 4.228 4.604 . 0 0 "[ . 1 . 2]" 1
1375 2 35 VAL H 2 37 ALA H . . 4.930 4.269 3.987 4.719 . 0 0 "[ . 1 . 2]" 1
1376 2 35 VAL HA 2 38 PHE H . . 4.790 3.542 3.277 3.886 . 0 0 "[ . 1 . 2]" 1
1377 2 35 VAL HA 2 38 PHE QB . . 4.510 2.667 2.151 3.063 . 0 0 "[ . 1 . 2]" 1
1378 2 35 VAL HB 2 36 ALA H . . 3.780 2.580 2.368 3.870 0.090 2 0 "[ . 1 . 2]" 1
1379 2 35 VAL HB 2 36 ALA HA . . 5.000 4.207 4.010 4.506 . 0 0 "[ . 1 . 2]" 1
1380 2 35 VAL QG 2 36 ALA H . . 3.740 3.105 2.301 3.264 . 0 0 "[ . 1 . 2]" 1
1381 2 35 VAL QG 2 36 ALA HA . . 3.990 3.419 3.113 3.702 . 0 0 "[ . 1 . 2]" 1
1382 2 35 VAL QG 2 36 ALA MB . . 3.500 3.844 3.078 4.107 0.607 17 5 "[ *. 1 -. + **]" 1
1383 2 35 VAL QG 2 38 PHE H . . 4.860 4.362 4.113 4.587 . 0 0 "[ . 1 . 2]" 1
1384 2 35 VAL QG 2 38 PHE QD . . 4.400 3.886 2.720 4.917 0.517 7 1 "[ . + 1 . 2]" 1
1385 2 36 ALA H 2 36 ALA MB . . 3.260 2.210 2.186 2.246 . 0 0 "[ . 1 . 2]" 1
1386 2 36 ALA H 2 37 ALA H . . 3.660 2.732 2.587 3.042 . 0 0 "[ . 1 . 2]" 1
1387 2 36 ALA H 2 37 ALA MB . . 4.570 4.392 4.259 4.675 0.105 16 0 "[ . 1 . 2]" 1
1388 2 36 ALA HA 2 39 VAL HB . . 3.880 3.371 2.825 4.460 0.580 7 1 "[ . + 1 . 2]" 1
1389 2 36 ALA HA 2 39 VAL QG . . 4.030 3.184 2.153 3.725 . 0 0 "[ . 1 . 2]" 1
1390 2 36 ALA MB 2 37 ALA H . . 3.550 2.423 2.191 2.628 . 0 0 "[ . 1 . 2]" 1
1391 2 36 ALA MB 2 39 VAL QG . . 4.180 4.238 3.449 4.626 0.446 16 0 "[ . 1 . 2]" 1
1392 2 37 ALA H 2 37 ALA MB . . 3.060 2.233 2.220 2.243 . 0 0 "[ . 1 . 2]" 1
1393 2 37 ALA H 2 38 PHE H . . 3.670 2.610 2.535 2.688 . 0 0 "[ . 1 . 2]" 1
1394 2 37 ALA HA 2 40 ASP H . . 4.690 3.463 3.277 3.700 . 0 0 "[ . 1 . 2]" 1
1395 2 37 ALA HA 2 40 ASP QB . . 3.590 2.417 2.154 2.749 . 0 0 "[ . 1 . 2]" 1
1396 2 37 ALA MB 2 38 PHE H . . 3.400 2.688 2.519 2.879 . 0 0 "[ . 1 . 2]" 1
1397 2 37 ALA MB 2 38 PHE HA . . 4.410 3.864 3.826 3.930 . 0 0 "[ . 1 . 2]" 1
1398 2 37 ALA MB 2 39 VAL H . . 4.870 4.695 4.552 4.813 . 0 0 "[ . 1 . 2]" 1
1399 2 37 ALA MB 2 40 ASP QB . . 4.510 3.748 3.488 4.088 . 0 0 "[ . 1 . 2]" 1
1400 2 38 PHE H 2 38 PHE HB2 . . 3.380 2.532 2.326 2.876 . 0 0 "[ . 1 . 2]" 1
1401 2 38 PHE H 2 38 PHE HB3 . . 3.380 2.509 2.217 2.745 . 0 0 "[ . 1 . 2]" 1
1402 2 38 PHE H 2 38 PHE QD . . 4.370 4.154 4.049 4.185 . 0 0 "[ . 1 . 2]" 1
1403 2 38 PHE H 2 39 VAL H . . 4.060 2.680 2.576 2.805 . 0 0 "[ . 1 . 2]" 1
1404 2 38 PHE HA 2 38 PHE QD . . 3.740 2.605 2.159 3.028 . 0 0 "[ . 1 . 2]" 1
1405 2 38 PHE HA 2 41 ASP HB2 . . 4.460 4.045 3.212 4.640 0.180 3 0 "[ . 1 . 2]" 1
1406 2 38 PHE HA 2 41 ASP HB3 . . 4.460 3.357 2.793 4.472 0.012 10 0 "[ . 1 . 2]" 1
1407 2 38 PHE QB 2 39 VAL H . . 4.020 2.482 2.293 2.629 . 0 0 "[ . 1 . 2]" 1
1408 2 38 PHE QD 2 39 VAL H . . 4.400 3.614 3.318 4.055 . 0 0 "[ . 1 . 2]" 1
1409 2 38 PHE QD 2 66 ILE MG . . 4.100 3.735 2.903 4.620 0.520 20 1 "[ . 1 . +]" 1
1410 2 38 PHE QE 2 66 ILE MG . . 3.880 2.508 2.164 4.232 0.352 20 0 "[ . 1 . 2]" 1
1411 2 39 VAL H 2 39 VAL HB . . 3.910 2.526 2.455 2.601 . 0 0 "[ . 1 . 2]" 1
1412 2 39 VAL H 2 39 VAL MG1 . . 3.980 3.625 2.166 3.794 . 0 0 "[ . 1 . 2]" 1
1413 2 39 VAL H 2 39 VAL MG2 . . 3.980 2.381 2.145 3.780 . 0 0 "[ . 1 . 2]" 1
1414 2 39 VAL H 2 40 ASP H . . 4.050 2.542 2.462 2.658 . 0 0 "[ . 1 . 2]" 1
1415 2 39 VAL HA 2 39 VAL MG1 . . 3.720 2.488 2.340 3.211 . 0 0 "[ . 1 . 2]" 1
1416 2 39 VAL HA 2 39 VAL MG2 . . 3.720 2.346 2.234 2.434 . 0 0 "[ . 1 . 2]" 1
1417 2 39 VAL HA 2 42 LYS H . . 4.460 3.372 3.229 3.593 . 0 0 "[ . 1 . 2]" 1
1418 2 39 VAL HB 2 40 ASP H . . 4.120 2.748 2.468 4.013 . 0 0 "[ . 1 . 2]" 1
1419 2 39 VAL QG 2 40 ASP H . . 3.640 3.121 2.193 3.302 . 0 0 "[ . 1 . 2]" 1
1420 2 39 VAL QG 2 43 MET H . . 4.850 3.743 3.547 4.023 . 0 0 "[ . 1 . 2]" 1
1421 2 39 VAL QG 2 62 THR HB . . 3.590 3.521 2.749 4.104 0.514 18 1 "[ . 1 . + 2]" 1
1422 2 39 VAL MG1 2 40 ASP H . . 4.370 3.353 2.207 3.617 . 0 0 "[ . 1 . 2]" 1
1423 2 39 VAL MG2 2 40 ASP H . . 4.370 3.814 3.673 3.984 . 0 0 "[ . 1 . 2]" 1
1424 2 40 ASP H 2 40 ASP QB . . 3.580 2.212 2.159 2.263 . 0 0 "[ . 1 . 2]" 1
1425 2 40 ASP HA 2 43 MET QB . . 4.060 3.361 2.615 4.562 0.502 3 1 "[ + . 1 . 2]" 1
1426 2 40 ASP QB 2 41 ASP H . . 3.460 2.484 2.270 2.697 . 0 0 "[ . 1 . 2]" 1
1427 2 41 ASP H 2 41 ASP HB2 . . 3.940 2.553 2.156 3.009 . 0 0 "[ . 1 . 2]" 1
1428 2 41 ASP H 2 41 ASP QB . . 3.350 2.226 2.131 2.306 . 0 0 "[ . 1 . 2]" 1
1429 2 41 ASP H 2 41 ASP HB3 . . 3.940 2.566 2.189 3.342 . 0 0 "[ . 1 . 2]" 1
1430 2 41 ASP H 2 42 LYS H . . 3.790 2.622 2.532 2.742 . 0 0 "[ . 1 . 2]" 1
1431 2 41 ASP H 2 42 LYS QB . . 4.800 4.409 4.263 4.753 . 0 0 "[ . 1 . 2]" 1
1432 2 41 ASP HA 2 44 HIS QB . . 4.160 2.581 2.071 3.086 . 0 0 "[ . 1 . 2]" 1
1433 2 41 ASP QB 2 42 LYS H . . 3.990 2.596 2.356 2.863 . 0 0 "[ . 1 . 2]" 1
1434 2 41 ASP QB 2 42 LYS HA . . 4.390 4.097 3.749 4.447 0.057 5 0 "[ . 1 . 2]" 1
1435 2 41 ASP QB 2 42 LYS QB . . 4.730 4.114 3.685 4.648 . 0 0 "[ . 1 . 2]" 1
1436 2 41 ASP HB2 2 42 LYS H . . 4.770 3.826 3.209 4.023 . 0 0 "[ . 1 . 2]" 1
1437 2 41 ASP HB3 2 42 LYS H . . 4.770 2.652 2.395 3.080 . 0 0 "[ . 1 . 2]" 1
1438 2 42 LYS H 2 42 LYS QB . . 3.530 2.239 2.076 2.466 . 0 0 "[ . 1 . 2]" 1
1439 2 42 LYS H 2 42 LYS QD . . 4.880 4.229 3.026 4.620 . 0 0 "[ . 1 . 2]" 1
1440 2 42 LYS H 2 42 LYS QG . . 4.250 3.483 2.184 4.043 . 0 0 "[ . 1 . 2]" 1
1441 2 42 LYS H 2 43 MET H . . 3.760 2.743 2.566 2.843 . 0 0 "[ . 1 . 2]" 1
1442 2 42 LYS H 2 44 HIS H . . 4.990 3.982 3.784 4.319 . 0 0 "[ . 1 . 2]" 1
1443 2 42 LYS H 2 62 THR MG . . 4.570 4.629 4.250 5.095 0.525 3 1 "[ + . 1 . 2]" 1
1444 2 42 LYS HA 2 42 LYS QD . . 4.070 3.514 2.179 4.106 0.036 2 0 "[ . 1 . 2]" 1
1445 2 42 LYS HA 2 42 LYS QG . . 3.790 2.324 2.115 2.788 . 0 0 "[ . 1 . 2]" 1
1446 2 42 LYS HA 2 45 GLU QG . . 3.550 2.440 2.155 4.107 0.557 3 1 "[ + . 1 . 2]" 1
1447 2 42 LYS HA 2 62 THR MG . . 4.380 3.927 3.472 4.142 . 0 0 "[ . 1 . 2]" 1
1448 2 42 LYS QB 2 43 MET H . . 3.940 2.582 2.336 2.726 . 0 0 "[ . 1 . 2]" 1
1449 2 42 LYS QD 2 62 THR HA . . 4.580 4.404 3.554 5.152 0.572 5 3 "[ * + 1 -. 2]" 1
1450 2 42 LYS QD 2 66 ILE H . . 3.900 4.272 3.793 4.490 0.590 12 10 "[ ** * **1 + ** -*]" 1
1451 2 42 LYS QD 2 66 ILE HA . . 4.270 3.762 3.365 4.300 0.030 8 0 "[ . 1 . 2]" 1
1452 2 42 LYS QE 2 45 GLU QG . . 4.720 4.037 3.082 5.288 0.568 10 1 "[ . + . 2]" 1
1453 2 42 LYS QG 2 43 MET H . . 4.430 4.056 3.500 4.286 . 0 0 "[ . 1 . 2]" 1
1454 2 42 LYS QG 2 45 GLU QG . . 4.520 3.515 2.530 4.664 0.144 3 0 "[ . 1 . 2]" 1
1455 2 43 MET H 2 43 MET QB . . 3.450 2.354 2.104 2.726 . 0 0 "[ . 1 . 2]" 1
1456 2 43 MET H 2 44 HIS H . . 3.780 2.557 2.430 2.693 . 0 0 "[ . 1 . 2]" 1
1457 2 43 MET H 2 58 LEU QD . . 4.760 5.086 4.435 5.342 0.582 2 9 "[ +-*. * ** *. **]" 1
1458 2 43 MET H 2 62 THR HB . . 4.710 4.822 4.277 5.254 0.544 16 2 "[ . 1 .+- 2]" 1
1459 2 43 MET H 2 62 THR MG . . 4.410 3.085 2.717 3.498 . 0 0 "[ . 1 . 2]" 1
1460 2 43 MET HA 2 62 THR HB . . 4.570 4.462 4.130 4.883 0.313 16 0 "[ . 1 . 2]" 1
1461 2 43 MET HA 2 62 THR MG . . 3.970 2.240 2.099 2.715 . 0 0 "[ . 1 . 2]" 1
1462 2 43 MET QB 2 44 HIS H . . 3.790 3.039 2.566 3.880 0.090 18 0 "[ . 1 . 2]" 1
1463 2 43 MET QB 2 58 LEU QD . . 3.540 2.871 2.190 3.424 . 0 0 "[ . 1 . 2]" 1
1464 2 43 MET QB 2 58 LEU HG . . 4.720 4.744 3.491 5.314 0.594 13 8 "[ -** 1**+ ** 2]" 1
1465 2 43 MET QB 2 62 THR MG . . 3.850 3.260 2.183 3.790 . 0 0 "[ . 1 . 2]" 1
1466 2 43 MET HB2 2 44 HIS H . . 4.480 3.260 2.667 4.272 . 0 0 "[ . 1 . 2]" 1
1467 2 43 MET HB3 2 44 HIS H . . 4.480 3.739 3.266 4.452 . 0 0 "[ . 1 . 2]" 1
1468 2 44 HIS H 2 44 HIS QB . . 3.260 2.216 2.109 2.426 . 0 0 "[ . 1 . 2]" 1
1469 2 44 HIS H 2 45 GLU H . . 3.310 2.558 2.173 2.838 . 0 0 "[ . 1 . 2]" 1
1470 2 44 HIS H 2 58 LEU QD . . 4.740 4.911 4.349 5.242 0.502 6 1 "[ .+ 1 . 2]" 1
1471 2 44 HIS HA 2 47 SER H . . 4.280 3.570 3.306 4.147 . 0 0 "[ . 1 . 2]" 1
1472 2 44 HIS HA 2 58 LEU QD . . 4.590 4.419 3.962 5.078 0.488 6 0 "[ . 1 . 2]" 1
1473 2 44 HIS QB 2 45 GLU H . . 3.680 2.813 2.329 3.251 . 0 0 "[ . 1 . 2]" 1
1474 2 44 HIS QB 2 45 GLU HA . . 4.850 4.041 3.776 4.671 . 0 0 "[ . 1 . 2]" 1
1475 2 45 GLU H 2 45 GLU HB2 . . 3.660 3.612 3.279 3.711 0.051 20 0 "[ . 1 . 2]" 1
1476 2 45 GLU H 2 45 GLU QB . . 3.030 2.482 2.164 2.884 . 0 0 "[ . 1 . 2]" 1
1477 2 45 GLU H 2 45 GLU HB3 . . 3.660 2.531 2.195 3.008 . 0 0 "[ . 1 . 2]" 1
1478 2 45 GLU H 2 45 GLU HG2 . . 4.190 2.506 2.177 3.785 . 0 0 "[ . 1 . 2]" 1
1479 2 45 GLU H 2 45 GLU HG3 . . 4.190 3.410 2.449 4.414 0.224 3 0 "[ . 1 . 2]" 1
1480 2 45 GLU H 2 46 PHE H . . 3.520 2.452 2.161 2.680 . 0 0 "[ . 1 . 2]" 1
1481 2 45 GLU HA 2 45 GLU QG . . 3.740 3.313 2.886 3.370 . 0 0 "[ . 1 . 2]" 1
1482 2 45 GLU QB 2 45 GLU QG . . 2.360 2.087 2.043 2.097 . 0 0 "[ . 1 . 2]" 1
1483 2 45 GLU QB 2 46 PHE H . . 3.930 3.567 3.037 3.736 . 0 0 "[ . 1 . 2]" 1
1484 2 45 GLU HB2 2 46 PHE H . . 4.640 4.093 3.809 4.321 . 0 0 "[ . 1 . 2]" 1
1485 2 45 GLU HB3 2 46 PHE H . . 4.640 3.959 3.112 4.209 . 0 0 "[ . 1 . 2]" 1
1486 2 45 GLU QG 2 46 PHE H . . 4.690 2.447 2.162 2.930 . 0 0 "[ . 1 . 2]" 1
1487 2 45 GLU QG 2 46 PHE HA . . 4.520 3.327 3.072 3.716 . 0 0 "[ . 1 . 2]" 1
1488 2 46 PHE H 2 46 PHE HB2 . . 3.800 2.271 2.149 2.495 . 0 0 "[ . 1 . 2]" 1
1489 2 46 PHE H 2 46 PHE HB3 . . 3.800 3.517 3.170 3.644 . 0 0 "[ . 1 . 2]" 1
1490 2 46 PHE H 2 46 PHE QD . . 3.970 3.230 2.586 4.008 0.038 11 0 "[ . 1 . 2]" 1
1491 2 46 PHE H 2 47 SER H . . 2.940 2.380 2.178 2.559 . 0 0 "[ . 1 . 2]" 1
1492 2 46 PHE H 2 58 LEU QD . . 4.620 3.811 3.582 4.114 . 0 0 "[ . 1 . 2]" 1
1493 2 46 PHE HA 2 46 PHE QD . . 3.920 2.434 2.132 2.805 . 0 0 "[ . 1 . 2]" 1
1494 2 46 PHE HA 2 49 LYS QB . . 4.390 3.181 2.381 4.120 . 0 0 "[ . 1 . 2]" 1
1495 2 46 PHE HA 2 49 LYS QD . . 4.840 4.156 2.265 5.358 0.518 10 1 "[ . + . 2]" 1
1496 2 46 PHE HA 2 49 LYS HG2 . . 4.600 2.962 2.146 4.195 . 0 0 "[ . 1 . 2]" 1
1497 2 46 PHE HA 2 49 LYS HG3 . . 4.600 2.966 2.254 4.883 0.283 1 0 "[ . 1 . 2]" 1
1498 2 46 PHE QB 2 47 SER H . . 3.720 3.146 2.946 3.490 . 0 0 "[ . 1 . 2]" 1
1499 2 46 PHE QB 2 58 LEU QD . . 3.960 2.243 2.110 2.935 . 0 0 "[ . 1 . 2]" 1
1500 2 46 PHE QB 2 58 LEU HG . . 4.480 3.564 2.285 4.819 0.339 6 0 "[ . 1 . 2]" 1
1501 2 46 PHE QD 2 58 LEU MD1 . . 4.880 4.235 3.305 5.404 0.524 8 1 "[ . + 1 . 2]" 1
1502 2 46 PHE QD 2 58 LEU QD . . 4.100 3.697 3.098 4.344 0.244 8 0 "[ . 1 . 2]" 1
1503 2 46 PHE QD 2 58 LEU MD2 . . 4.880 4.372 3.388 5.354 0.474 2 0 "[ . 1 . 2]" 1
1504 2 46 PHE QD 2 61 LEU QD . . 4.650 2.762 2.180 3.555 . 0 0 "[ . 1 . 2]" 1
1505 2 46 PHE QD 2 62 THR H . . 4.990 4.901 3.296 5.512 0.522 3 3 "[- + . 1 . * 2]" 1
1506 2 46 PHE QD 2 62 THR HB . . 4.170 4.581 3.908 4.770 0.600 4 13 "[***+* 1**-**** *2]" 1
1507 2 46 PHE QD 2 62 THR MG . . 4.330 2.278 2.068 3.307 . 0 0 "[ . 1 . 2]" 1
1508 2 47 SER H 2 47 SER HB2 . . 3.690 2.833 2.223 3.579 . 0 0 "[ . 1 . 2]" 1
1509 2 47 SER H 2 47 SER HB3 . . 3.690 3.221 2.580 3.607 . 0 0 "[ . 1 . 2]" 1
1510 2 47 SER H 2 48 GLU H . . 3.500 2.594 2.510 2.765 . 0 0 "[ . 1 . 2]" 1
1511 2 47 SER H 2 58 LEU QD . . 3.630 3.005 2.787 3.394 . 0 0 "[ . 1 . 2]" 1
1512 2 47 SER H 2 58 LEU HG . . 4.360 4.765 4.381 4.923 0.563 2 10 "[*+* . **1 * - * **]" 1
1513 2 47 SER HA 2 49 LYS H . . 4.150 3.799 3.569 4.192 0.042 4 0 "[ . 1 . 2]" 1
1514 2 47 SER HA 2 50 GLN H . . 4.300 3.687 3.424 4.081 . 0 0 "[ . 1 . 2]" 1
1515 2 47 SER HA 2 58 LEU QD . . 4.000 2.203 2.062 2.477 . 0 0 "[ . 1 . 2]" 1
1516 2 47 SER QB 2 58 LEU QD . . 3.420 2.973 2.213 3.596 0.176 17 0 "[ . 1 . 2]" 1
1517 2 48 GLU H 2 48 GLU QB . . 3.390 2.488 2.241 2.788 . 0 0 "[ . 1 . 2]" 1
1518 2 48 GLU H 2 48 GLU QG . . 3.690 2.830 2.113 4.078 0.388 16 0 "[ . 1 . 2]" 1
1519 2 48 GLU H 2 49 LYS H . . 3.410 2.443 2.234 2.637 . 0 0 "[ . 1 . 2]" 1
1520 2 48 GLU H 2 50 GLN H . . 4.900 4.322 3.985 4.685 . 0 0 "[ . 1 . 2]" 1
1521 2 48 GLU HA 2 48 GLU HG2 . . 3.840 3.608 2.528 4.180 0.340 13 0 "[ . 1 . 2]" 1
1522 2 48 GLU HA 2 48 GLU QG . . 3.190 2.995 2.266 3.405 0.215 13 0 "[ . 1 . 2]" 1
1523 2 48 GLU HA 2 48 GLU HG3 . . 3.840 3.290 2.291 3.702 . 0 0 "[ . 1 . 2]" 1
1524 2 48 GLU QB 2 49 LYS H . . 4.110 3.434 2.837 3.920 . 0 0 "[ . 1 . 2]" 1
1525 2 48 GLU HB2 2 49 LYS H . . 4.940 4.040 3.215 4.352 . 0 0 "[ . 1 . 2]" 1
1526 2 48 GLU HB3 2 49 LYS H . . 4.940 3.853 2.897 4.453 . 0 0 "[ . 1 . 2]" 1
1527 2 48 GLU QG 2 49 LYS H . . 3.820 3.349 2.404 4.341 0.521 18 1 "[ . 1 . + 2]" 1
1528 2 49 LYS H 2 49 LYS HB2 . . 3.680 2.478 2.174 2.775 . 0 0 "[ . 1 . 2]" 1
1529 2 49 LYS H 2 49 LYS QB . . 3.110 2.434 2.153 2.697 . 0 0 "[ . 1 . 2]" 1
1530 2 49 LYS H 2 49 LYS HB3 . . 3.680 3.591 3.178 3.681 0.001 7 0 "[ . 1 . 2]" 1
1531 2 49 LYS H 2 49 LYS HG2 . . 4.820 2.749 2.160 4.346 . 0 0 "[ . 1 . 2]" 1
1532 2 49 LYS H 2 49 LYS QG . . 4.200 2.566 2.146 3.696 . 0 0 "[ . 1 . 2]" 1
1533 2 49 LYS H 2 49 LYS HG3 . . 4.820 3.604 2.299 4.530 . 0 0 "[ . 1 . 2]" 1
1534 2 49 LYS H 2 50 GLN H . . 3.170 2.420 2.244 2.641 . 0 0 "[ . 1 . 2]" 1
1535 2 49 LYS H 2 51 PRO QD . . 4.940 4.260 3.585 4.723 . 0 0 "[ . 1 . 2]" 1
1536 2 49 LYS HA 2 49 LYS QD . . 3.840 2.564 2.074 3.956 0.116 16 0 "[ . 1 . 2]" 1
1537 2 49 LYS HA 2 49 LYS QG . . 3.340 2.760 2.203 3.221 . 0 0 "[ . 1 . 2]" 1
1538 2 49 LYS QB 2 50 GLN H . . 3.810 2.541 2.170 3.132 . 0 0 "[ . 1 . 2]" 1
1539 2 49 LYS QB 2 51 PRO HD2 . . 4.530 4.284 3.682 4.905 0.375 2 0 "[ . 1 . 2]" 1
1540 2 49 LYS QB 2 51 PRO HD3 . . 4.260 2.841 2.361 3.410 . 0 0 "[ . 1 . 2]" 1
1541 2 49 LYS HB2 2 50 GLN H . . 4.530 2.630 2.194 3.628 . 0 0 "[ . 1 . 2]" 1
1542 2 49 LYS HB3 2 50 GLN H . . 4.530 3.574 3.027 3.974 . 0 0 "[ . 1 . 2]" 1
1543 2 49 LYS QE 2 49 LYS QG . . 3.330 2.277 2.132 2.619 . 0 0 "[ . 1 . 2]" 1
1544 2 50 GLN H 2 50 GLN QG . . 4.350 2.914 2.432 4.128 . 0 0 "[ . 1 . 2]" 1
1545 2 50 GLN H 2 51 PRO HD2 . . 4.690 3.458 2.999 4.016 . 0 0 "[ . 1 . 2]" 1
1546 2 50 GLN H 2 51 PRO QD . . 3.920 2.542 2.276 2.800 . 0 0 "[ . 1 . 2]" 1
1547 2 50 GLN H 2 51 PRO HD3 . . 4.690 2.655 2.298 3.016 . 0 0 "[ . 1 . 2]" 1
1548 2 50 GLN H 2 53 LEU QD . . 4.690 5.169 4.600 5.315 0.625 17 15 "[ ******* * **- +***]" 1
1549 2 50 GLN QB 2 51 PRO QD . . 4.570 3.794 3.678 3.876 . 0 0 "[ . 1 . 2]" 1
1550 2 50 GLN QB 2 53 LEU QD . . 4.240 2.368 2.123 3.658 . 0 0 "[ . 1 . 2]" 1
1551 2 50 GLN QG 2 53 LEU MD1 . . 4.230 4.282 2.613 4.851 0.621 20 8 "[* * .* ** -. * +]" 1
1552 2 50 GLN QG 2 53 LEU QD . . 3.600 2.712 2.147 3.833 0.233 5 0 "[ . 1 . 2]" 1
1553 2 50 GLN QG 2 53 LEU MD2 . . 4.230 2.905 2.175 4.751 0.521 5 1 "[ + 1 . 2]" 1
1554 2 51 PRO QD 2 52 MET H . . 3.750 2.717 2.195 3.367 . 0 0 "[ . 1 . 2]" 1
1555 2 51 PRO HD2 2 52 MET H . . 4.530 2.774 2.210 3.509 . 0 0 "[ . 1 . 2]" 1
1556 2 51 PRO HD3 2 52 MET H . . 4.530 3.989 3.741 4.333 . 0 0 "[ . 1 . 2]" 1
1557 2 51 PRO QG 2 52 MET H . . 3.710 2.473 2.099 3.619 . 0 0 "[ . 1 . 2]" 1
1558 2 51 PRO QG 2 52 MET QG . . 3.250 3.634 2.688 3.852 0.602 18 13 "[ * ** -**1****.**+ 2]" 1
1559 2 52 MET H 2 52 MET HB2 . . 3.780 2.721 2.435 3.780 0.000 5 0 "[ . 1 . 2]" 1
1560 2 52 MET H 2 52 MET HB3 . . 3.780 3.655 2.980 3.789 0.009 8 0 "[ . 1 . 2]" 1
1561 2 52 MET H 2 52 MET HG2 . . 3.920 2.959 2.286 4.262 0.342 19 0 "[ . 1 . 2]" 1
1562 2 52 MET H 2 52 MET QG . . 3.300 2.766 2.269 3.254 . 0 0 "[ . 1 . 2]" 1
1563 2 52 MET H 2 52 MET HG3 . . 3.920 3.910 3.032 4.303 0.383 12 0 "[ . 1 . 2]" 1
1564 2 52 MET H 2 53 LEU H . . 2.930 2.178 2.089 2.362 . 0 0 "[ . 1 . 2]" 1
1565 2 52 MET H 2 53 LEU QD . . 4.470 4.615 3.776 5.014 0.544 18 5 "[ .* * .- +*2]" 1
1566 2 52 MET HA 2 52 MET QG . . 3.680 2.942 2.342 3.476 . 0 0 "[ . 1 . 2]" 1
1567 2 52 MET QB 2 53 LEU H . . 4.130 3.537 3.324 3.950 . 0 0 "[ . 1 . 2]" 1
1568 2 53 LEU H 2 53 LEU HB2 . . 3.980 3.353 3.206 3.537 . 0 0 "[ . 1 . 2]" 1
1569 2 53 LEU H 2 53 LEU QB . . 3.250 3.196 3.086 3.304 0.054 3 0 "[ . 1 . 2]" 1
1570 2 53 LEU H 2 53 LEU HB3 . . 3.980 4.039 3.958 4.099 0.119 18 0 "[ . 1 . 2]" 1
1571 2 53 LEU H 2 53 LEU QD . . 3.540 3.088 2.236 3.537 . 0 0 "[ . 1 . 2]" 1
1572 2 53 LEU H 2 53 LEU HG . . 3.830 2.993 2.508 3.737 . 0 0 "[ . 1 . 2]" 1
1573 2 53 LEU H 2 54 ASP H . . 4.780 2.924 2.546 3.189 . 0 0 "[ . 1 . 2]" 1
1574 2 53 LEU HA 2 53 LEU QD . . 3.270 2.395 2.139 2.975 . 0 0 "[ . 1 . 2]" 1
1575 2 53 LEU HA 2 53 LEU HG . . 4.230 2.609 2.286 3.132 . 0 0 "[ . 1 . 2]" 1
1576 2 53 LEU HA 2 54 ASP H . . 2.880 2.627 2.454 2.884 0.004 18 0 "[ . 1 . 2]" 1
1577 2 54 ASP H 2 54 ASP QB . . 3.580 2.744 2.415 2.902 . 0 0 "[ . 1 . 2]" 1
1578 2 54 ASP H 2 55 VAL H . . 4.960 4.138 2.664 4.453 . 0 0 "[ . 1 . 2]" 1
1579 2 54 ASP HA 2 55 VAL H . . 3.480 2.367 2.167 3.531 0.051 6 0 "[ . 1 . 2]" 1
1580 2 54 ASP QB 2 55 VAL H . . 4.100 3.349 1.938 3.693 . 0 0 "[ . 1 . 2]" 1
1581 2 54 ASP QB 2 57 LYS H . . 4.850 2.965 2.588 3.719 . 0 0 "[ . 1 . 2]" 1
1582 2 54 ASP HB2 2 55 VAL H . . 4.660 3.859 2.155 4.380 . 0 0 "[ . 1 . 2]" 1
1583 2 54 ASP HB3 2 55 VAL H . . 4.660 3.746 2.153 4.156 . 0 0 "[ . 1 . 2]" 1
1584 2 55 VAL H 2 55 VAL HB . . 3.840 2.730 2.418 3.640 . 0 0 "[ . 1 . 2]" 1
1585 2 55 VAL H 2 56 PRO HD2 . . 4.120 2.274 2.146 2.604 . 0 0 "[ . 1 . 2]" 1
1586 2 55 VAL H 2 56 PRO QD . . 3.350 2.206 2.130 2.377 . 0 0 "[ . 1 . 2]" 1
1587 2 55 VAL H 2 56 PRO HD3 . . 4.120 3.240 2.450 3.614 . 0 0 "[ . 1 . 2]" 1
1588 2 56 PRO HA 2 59 ALA MB . . 3.730 2.813 2.535 3.251 . 0 0 "[ . 1 . 2]" 1
1589 2 56 PRO HA 2 60 VAL QG . . 4.320 4.481 4.028 4.835 0.515 5 1 "[ + 1 . 2]" 1
1590 2 56 PRO QB 2 59 ALA MB . . 4.750 4.209 3.921 4.648 . 0 0 "[ . 1 . 2]" 1
1591 2 56 PRO QD 2 57 LYS H . . 4.310 2.895 2.455 3.277 . 0 0 "[ . 1 . 2]" 1
1592 2 56 PRO HG2 2 57 LYS H . . 4.010 2.917 2.444 4.010 0.000 8 0 "[ . 1 . 2]" 1
1593 2 56 PRO HG3 2 57 LYS H . . 4.010 4.180 3.994 4.544 0.534 8 4 "[ . +*1 .- * 2]" 1
1594 2 57 LYS H 2 57 LYS QB . . 3.210 2.336 2.164 2.610 . 0 0 "[ . 1 . 2]" 1
1595 2 57 LYS H 2 58 LEU H . . 3.350 2.526 2.412 2.749 . 0 0 "[ . 1 . 2]" 1
1596 2 57 LYS H 2 59 ALA H . . 4.650 4.208 4.029 4.523 . 0 0 "[ . 1 . 2]" 1
1597 2 57 LYS HA 2 57 LYS QD . . 4.740 2.661 2.123 4.024 . 0 0 "[ . 1 . 2]" 1
1598 2 57 LYS HA 2 57 LYS QE . . 4.930 4.147 2.855 5.426 0.496 17 0 "[ . 1 . 2]" 1
1599 2 57 LYS HA 2 59 ALA H . . 4.680 4.515 4.303 4.761 0.081 4 0 "[ . 1 . 2]" 1
1600 2 57 LYS HA 2 60 VAL H . . 4.560 3.728 3.381 4.070 . 0 0 "[ . 1 . 2]" 1
1601 2 57 LYS HA 2 60 VAL QG . . 3.820 2.248 2.166 2.838 . 0 0 "[ . 1 . 2]" 1
1602 2 57 LYS QB 2 57 LYS QE . . 4.050 3.394 2.120 3.887 . 0 0 "[ . 1 . 2]" 1
1603 2 57 LYS QB 2 58 LEU H . . 3.590 3.022 2.634 3.727 0.137 17 0 "[ . 1 . 2]" 1
1604 2 57 LYS QB 2 58 LEU HA . . 4.770 4.012 3.737 4.566 . 0 0 "[ . 1 . 2]" 1
1605 2 57 LYS HB2 2 58 LEU H . . 4.140 3.178 2.684 4.228 0.088 17 0 "[ . 1 . 2]" 1
1606 2 57 LYS HB3 2 58 LEU H . . 4.140 3.857 3.190 4.308 0.168 2 0 "[ . 1 . 2]" 1
1607 2 58 LEU H 2 58 LEU HB2 . . 3.720 2.480 2.278 2.842 . 0 0 "[ . 1 . 2]" 1
1608 2 58 LEU H 2 58 LEU QB . . 2.980 2.249 2.179 2.354 . 0 0 "[ . 1 . 2]" 1
1609 2 58 LEU H 2 58 LEU HB3 . . 3.720 2.624 2.423 2.885 . 0 0 "[ . 1 . 2]" 1
1610 2 58 LEU H 2 58 LEU MD1 . . 4.740 4.135 3.840 4.315 . 0 0 "[ . 1 . 2]" 1
1611 2 58 LEU H 2 58 LEU QD . . 3.480 3.681 3.491 3.828 0.348 2 0 "[ . 1 . 2]" 1
1612 2 58 LEU H 2 58 LEU MD2 . . 4.740 4.163 3.694 4.374 . 0 0 "[ . 1 . 2]" 1
1613 2 58 LEU H 2 59 ALA H . . 3.510 2.394 2.188 2.645 . 0 0 "[ . 1 . 2]" 1
1614 2 58 LEU HA 2 58 LEU MD1 . . 3.930 2.776 2.251 3.595 . 0 0 "[ . 1 . 2]" 1
1615 2 58 LEU HA 2 58 LEU QD . . 3.320 2.303 2.045 3.030 . 0 0 "[ . 1 . 2]" 1
1616 2 58 LEU HA 2 58 LEU MD2 . . 3.930 3.045 2.112 3.928 . 0 0 "[ . 1 . 2]" 1
1617 2 58 LEU HA 2 58 LEU HG . . 3.980 3.118 2.377 3.744 . 0 0 "[ . 1 . 2]" 1
1618 2 58 LEU HA 2 61 LEU QD . . 4.660 3.125 2.927 3.444 . 0 0 "[ . 1 . 2]" 1
1619 2 58 LEU QB 2 59 ALA H . . 4.030 2.482 2.333 2.612 . 0 0 "[ . 1 . 2]" 1
1620 2 58 LEU QD 2 59 ALA H . . 4.150 3.554 3.048 3.990 . 0 0 "[ . 1 . 2]" 1
1621 2 58 LEU QD 2 59 ALA HA . . 4.500 3.526 2.663 4.333 . 0 0 "[ . 1 . 2]" 1
1622 2 58 LEU MD1 2 59 ALA H . . 4.790 4.168 3.126 4.850 0.060 7 0 "[ . 1 . 2]" 1
1623 2 58 LEU MD2 2 59 ALA H . . 4.790 4.160 3.406 4.684 . 0 0 "[ . 1 . 2]" 1
1624 2 59 ALA H 2 59 ALA MB . . 2.960 2.212 2.191 2.231 . 0 0 "[ . 1 . 2]" 1
1625 2 59 ALA H 2 60 VAL H . . 3.630 2.746 2.609 2.859 . 0 0 "[ . 1 . 2]" 1
1626 2 59 ALA HA 2 62 THR H . . 4.010 3.663 3.427 3.933 . 0 0 "[ . 1 . 2]" 1
1627 2 59 ALA MB 2 60 VAL H . . 3.700 2.544 2.309 2.759 . 0 0 "[ . 1 . 2]" 1
1628 2 59 ALA MB 2 60 VAL HA . . 4.650 3.846 3.782 3.914 . 0 0 "[ . 1 . 2]" 1
1629 2 60 VAL H 2 60 VAL HB . . 3.530 2.679 2.475 3.675 0.145 12 0 "[ . 1 . 2]" 1
1630 2 60 VAL H 2 60 VAL QG . . 3.070 2.158 2.034 2.235 . 0 0 "[ . 1 . 2]" 1
1631 2 60 VAL H 2 61 LEU H . . 3.690 2.499 2.359 2.655 . 0 0 "[ . 1 . 2]" 1
1632 2 60 VAL HA 2 60 VAL QG . . 3.110 2.254 2.141 2.354 . 0 0 "[ . 1 . 2]" 1
1633 2 60 VAL HA 2 63 ALA H . . 4.350 3.213 3.055 3.412 . 0 0 "[ . 1 . 2]" 1
1634 2 60 VAL HA 2 63 ALA MB . . 3.690 2.472 2.255 2.872 . 0 0 "[ . 1 . 2]" 1
1635 2 60 VAL HB 2 63 ALA MB . . 4.360 4.383 3.632 4.912 0.552 9 2 "[ . +1 . - 2]" 1
1636 2 60 VAL QG 2 61 LEU H . . 4.100 2.430 2.184 3.286 . 0 0 "[ . 1 . 2]" 1
1637 2 60 VAL QG 2 61 LEU HA . . 4.630 3.130 3.002 3.608 . 0 0 "[ . 1 . 2]" 1
1638 2 60 VAL QG 2 61 LEU QD . . 4.440 3.737 3.351 4.477 0.037 9 0 "[ . 1 . 2]" 1
1639 2 60 VAL QG 2 63 ALA MB . . 4.790 2.987 2.674 3.639 . 0 0 "[ . 1 . 2]" 1
1640 2 60 VAL QG 2 64 VAL QG . . 4.710 3.434 3.166 3.985 . 0 0 "[ . 1 . 2]" 1
1641 2 61 LEU H 2 61 LEU HB2 . . 3.960 2.456 2.331 2.532 . 0 0 "[ . 1 . 2]" 1
1642 2 61 LEU H 2 61 LEU QB . . 3.430 2.226 2.197 2.257 . 0 0 "[ . 1 . 2]" 1
1643 2 61 LEU H 2 61 LEU HB3 . . 3.960 2.562 2.455 2.688 . 0 0 "[ . 1 . 2]" 1
1644 2 61 LEU H 2 61 LEU MD1 . . 4.890 4.045 3.894 4.156 . 0 0 "[ . 1 . 2]" 1
1645 2 61 LEU H 2 61 LEU QD . . 3.960 3.684 3.599 3.729 . 0 0 "[ . 1 . 2]" 1
1646 2 61 LEU H 2 61 LEU MD2 . . 4.890 4.246 4.208 4.342 . 0 0 "[ . 1 . 2]" 1
1647 2 61 LEU H 2 61 LEU HG . . 4.650 4.486 4.434 4.558 . 0 0 "[ . 1 . 2]" 1
1648 2 61 LEU H 2 62 THR H . . 3.770 2.607 2.484 2.724 . 0 0 "[ . 1 . 2]" 1
1649 2 61 LEU HA 2 61 LEU QD . . 3.280 2.218 2.124 2.431 . 0 0 "[ . 1 . 2]" 1
1650 2 61 LEU HA 2 61 LEU HG . . 3.820 2.939 2.661 3.084 . 0 0 "[ . 1 . 2]" 1
1651 2 61 LEU HA 2 64 VAL H . . 3.890 3.791 3.618 4.025 0.135 13 0 "[ . 1 . 2]" 1
1652 2 61 LEU HA 2 64 VAL HB . . 4.230 4.337 3.978 4.648 0.418 13 0 "[ . 1 . 2]" 1
1653 2 61 LEU HA 2 64 VAL QG . . 4.010 2.344 2.179 2.604 . 0 0 "[ . 1 . 2]" 1
1654 2 61 LEU HA 2 65 GLN H . . 4.360 4.484 4.263 4.714 0.354 3 0 "[ . 1 . 2]" 1
1655 2 61 LEU QB 2 62 THR H . . 3.580 2.601 2.267 2.911 . 0 0 "[ . 1 . 2]" 1
1656 2 61 LEU QB 2 62 THR HA . . 4.640 4.124 4.023 4.223 . 0 0 "[ . 1 . 2]" 1
1657 2 61 LEU HB2 2 62 THR H . . 4.150 3.843 3.663 4.030 . 0 0 "[ . 1 . 2]" 1
1658 2 61 LEU HB3 2 62 THR H . . 4.150 2.647 2.289 2.987 . 0 0 "[ . 1 . 2]" 1
1659 2 61 LEU QD 2 62 THR H . . 4.990 3.932 3.573 4.201 . 0 0 "[ . 1 . 2]" 1
1660 2 61 LEU HG 2 62 THR HA . . 4.640 3.991 3.732 4.311 . 0 0 "[ . 1 . 2]" 1
1661 2 61 LEU HG 2 64 VAL QG . . 4.350 3.736 3.436 4.038 . 0 0 "[ . 1 . 2]" 1
1662 2 62 THR H 2 62 THR HB . . 4.010 3.389 2.652 3.649 . 0 0 "[ . 1 . 2]" 1
1663 2 62 THR H 2 62 THR MG . . 3.960 2.917 2.199 3.762 . 0 0 "[ . 1 . 2]" 1
1664 2 62 THR H 2 63 ALA H . . 3.810 2.502 2.415 2.677 . 0 0 "[ . 1 . 2]" 1
1665 2 62 THR H 2 64 VAL QG . . 4.660 4.322 4.172 4.537 . 0 0 "[ . 1 . 2]" 1
1666 2 62 THR HA 2 62 THR MG . . 3.740 2.212 2.114 2.425 . 0 0 "[ . 1 . 2]" 1
1667 2 62 THR HA 2 63 ALA HA . . 4.910 4.845 4.819 4.879 . 0 0 "[ . 1 . 2]" 1
1668 2 62 THR HA 2 66 ILE MD . . 3.980 4.289 3.881 4.516 0.536 20 3 "[ - 1* . +]" 1
1669 2 62 THR HB 2 63 ALA H . . 4.530 3.336 2.535 3.799 . 0 0 "[ . 1 . 2]" 1
1670 2 62 THR HB 2 65 GLN QB . . 4.740 4.587 4.151 5.284 0.544 19 1 "[ . 1 . +2]" 1
1671 2 62 THR MG 2 63 ALA H . . 4.150 4.050 3.611 4.237 0.087 5 0 "[ . 1 . 2]" 1
1672 2 63 ALA H 2 63 ALA MB . . 3.150 2.221 2.201 2.229 . 0 0 "[ . 1 . 2]" 1
1673 2 63 ALA H 2 64 VAL H . . 3.920 2.792 2.687 2.862 . 0 0 "[ . 1 . 2]" 1
1674 2 63 ALA H 2 64 VAL QG . . 3.980 4.026 3.894 4.135 0.155 9 0 "[ . 1 . 2]" 1
1675 2 63 ALA HA 2 66 ILE H . . 4.610 3.716 3.487 3.822 . 0 0 "[ . 1 . 2]" 1
1676 2 63 ALA MB 2 64 VAL H . . 3.650 2.388 2.259 2.521 . 0 0 "[ . 1 . 2]" 1
1677 2 63 ALA MB 2 64 VAL HB . . 4.220 3.800 3.712 3.914 . 0 0 "[ . 1 . 2]" 1
1678 2 64 VAL H 2 64 VAL HB . . 3.550 2.509 2.439 2.588 . 0 0 "[ . 1 . 2]" 1
1679 2 64 VAL H 2 64 VAL MG1 . . 3.900 2.205 2.175 2.251 . 0 0 "[ . 1 . 2]" 1
1680 2 64 VAL H 2 64 VAL QG . . 3.240 2.191 2.162 2.234 . 0 0 "[ . 1 . 2]" 1
1681 2 64 VAL H 2 64 VAL MG2 . . 3.900 3.771 3.748 3.792 . 0 0 "[ . 1 . 2]" 1
1682 2 64 VAL H 2 65 GLN H . . 3.650 2.602 2.507 2.754 . 0 0 "[ . 1 . 2]" 1
1683 2 64 VAL HA 2 65 GLN HA . . 4.910 4.714 4.633 4.781 . 0 0 "[ . 1 . 2]" 1
1684 2 64 VAL HA 2 67 ALA MB . . 3.960 2.655 2.484 3.306 . 0 0 "[ . 1 . 2]" 1
1685 2 64 VAL HB 2 65 GLN H . . 4.660 4.027 3.967 4.150 . 0 0 "[ . 1 . 2]" 1
1686 2 64 VAL QG 2 65 GLN H . . 3.490 2.322 2.180 2.488 . 0 0 "[ . 1 . 2]" 1
1687 2 64 VAL QG 2 65 GLN HA . . 4.070 3.081 3.034 3.195 . 0 0 "[ . 1 . 2]" 1
1688 2 64 VAL QG 2 65 GLN QG . . 4.690 3.475 2.166 4.274 . 0 0 "[ . 1 . 2]" 1
1689 2 64 VAL QG 2 67 ALA H . . 4.800 4.363 4.170 4.648 . 0 0 "[ . 1 . 2]" 1
1690 2 64 VAL QG 2 67 ALA MB . . 3.940 3.350 3.002 3.925 . 0 0 "[ . 1 . 2]" 1
1691 2 64 VAL QG 2 68 SER H . . 4.170 3.963 3.566 4.476 0.306 17 0 "[ . 1 . 2]" 1
1692 2 64 VAL MG1 2 65 GLN H . . 4.310 2.340 2.194 2.511 . 0 0 "[ . 1 . 2]" 1
1693 2 64 VAL MG2 2 65 GLN H . . 4.310 3.891 3.778 4.060 . 0 0 "[ . 1 . 2]" 1
1694 2 65 GLN H 2 65 GLN QB . . 3.230 2.242 2.132 2.408 . 0 0 "[ . 1 . 2]" 1
1695 2 65 GLN H 2 65 GLN QG . . 3.630 3.546 2.285 3.985 0.355 14 0 "[ . 1 . 2]" 1
1696 2 65 GLN H 2 66 ILE H . . 3.910 2.544 2.328 2.693 . 0 0 "[ . 1 . 2]" 1
1697 2 65 GLN HA 2 65 GLN QG . . 2.960 2.325 2.170 2.556 . 0 0 "[ . 1 . 2]" 1
1698 2 65 GLN HA 2 66 ILE HA . . 4.880 4.801 4.694 4.858 . 0 0 "[ . 1 . 2]" 1
1699 2 65 GLN QB 2 65 GLN QG . . 2.320 2.063 2.016 2.093 . 0 0 "[ . 1 . 2]" 1
1700 2 65 GLN QB 2 66 ILE H . . 3.720 2.583 2.381 2.925 . 0 0 "[ . 1 . 2]" 1
1701 2 66 ILE H 2 66 ILE MG . . 3.650 3.704 2.796 3.777 0.127 16 0 "[ . 1 . 2]" 1
1702 2 66 ILE H 2 67 ALA H . . 3.920 2.652 2.430 2.827 . 0 0 "[ . 1 . 2]" 1
1703 2 66 ILE HA 2 66 ILE MD . . 3.930 3.759 2.180 3.875 . 0 0 "[ . 1 . 2]" 1
1704 2 66 ILE HA 2 66 ILE MG . . 3.550 2.548 2.396 3.129 . 0 0 "[ . 1 . 2]" 1
1705 2 66 ILE HA 2 68 SER H . . 4.770 4.501 4.221 4.712 . 0 0 "[ . 1 . 2]" 1
1706 2 66 ILE HA 2 69 GLU H . . 4.740 3.591 3.271 4.219 . 0 0 "[ . 1 . 2]" 1
1707 2 66 ILE HA 2 69 GLU QB . . 4.150 2.891 2.329 4.262 0.112 1 0 "[ . 1 . 2]" 1
1708 2 66 ILE HA 2 69 GLU QG . . 4.600 3.400 2.206 4.907 0.307 11 0 "[ . 1 . 2]" 1
1709 2 66 ILE MD 2 66 ILE MG . . 3.140 2.204 2.123 3.194 0.054 20 0 "[ . 1 . 2]" 1
1710 2 66 ILE MG 2 67 ALA H . . 3.720 3.225 2.597 3.417 . 0 0 "[ . 1 . 2]" 1
1711 2 66 ILE MG 2 67 ALA HA . . 4.710 3.238 2.964 3.410 . 0 0 "[ . 1 . 2]" 1
1712 2 66 ILE MG 2 70 TYR QD . . 3.960 2.742 2.194 4.389 0.429 20 0 "[ . 1 . 2]" 1
1713 2 67 ALA H 2 67 ALA MB . . 3.610 2.223 2.198 2.279 . 0 0 "[ . 1 . 2]" 1
1714 2 67 ALA H 2 68 SER H . . 3.900 2.747 2.405 2.858 . 0 0 "[ . 1 . 2]" 1
1715 2 67 ALA HA 2 70 TYR H . . 4.210 3.675 3.513 3.889 . 0 0 "[ . 1 . 2]" 1
1716 2 67 ALA HA 2 70 TYR HB2 . . 4.950 3.243 2.693 3.711 . 0 0 "[ . 1 . 2]" 1
1717 2 67 ALA HA 2 70 TYR QB . . 4.270 3.185 2.647 3.648 . 0 0 "[ . 1 . 2]" 1
1718 2 67 ALA HA 2 70 TYR HB3 . . 4.950 4.679 3.876 5.372 0.422 3 0 "[ . 1 . 2]" 1
1719 2 67 ALA MB 2 68 SER H . . 3.740 2.496 2.330 2.817 . 0 0 "[ . 1 . 2]" 1
1720 2 68 SER H 2 68 SER QB . . 3.530 2.641 2.216 2.930 . 0 0 "[ . 1 . 2]" 1
1721 2 68 SER H 2 69 GLU H . . 3.890 2.665 2.409 2.804 . 0 0 "[ . 1 . 2]" 1
1722 2 68 SER H 2 71 LEU QD . . 4.980 4.407 3.682 5.340 0.360 11 0 "[ . 1 . 2]" 1
1723 2 68 SER HA 2 71 LEU QB . . 4.160 2.472 2.132 2.901 . 0 0 "[ . 1 . 2]" 1
1724 2 68 SER QB 2 69 GLU H . . 3.770 2.953 2.430 3.417 . 0 0 "[ . 1 . 2]" 1
1725 2 69 GLU H 2 69 GLU HB2 . . 4.080 2.452 2.131 3.654 . 0 0 "[ . 1 . 2]" 1
1726 2 69 GLU H 2 69 GLU QB . . 3.440 2.316 2.099 2.595 . 0 0 "[ . 1 . 2]" 1
1727 2 69 GLU H 2 69 GLU HB3 . . 4.080 3.428 2.569 3.598 . 0 0 "[ . 1 . 2]" 1
1728 2 69 GLU H 2 69 GLU HG2 . . 4.270 3.029 2.170 4.047 . 0 0 "[ . 1 . 2]" 1
1729 2 69 GLU H 2 69 GLU QG . . 3.570 2.613 2.152 3.627 0.057 3 0 "[ . 1 . 2]" 1
1730 2 69 GLU H 2 69 GLU HG3 . . 4.270 3.363 2.347 4.395 0.125 3 0 "[ . 1 . 2]" 1
1731 2 69 GLU H 2 70 TYR H . . 3.690 2.678 2.563 2.860 . 0 0 "[ . 1 . 2]" 1
1732 2 69 GLU H 2 70 TYR QB . . 4.940 4.589 4.372 4.900 . 0 0 "[ . 1 . 2]" 1
1733 2 69 GLU H 2 71 LEU H . . 4.470 4.011 3.878 4.168 . 0 0 "[ . 1 . 2]" 1
1734 2 69 GLU H 2 72 LYS QG . . 4.980 4.931 4.467 5.569 0.589 20 1 "[ . 1 . +]" 1
1735 2 69 GLU HA 2 69 GLU HG2 . . 3.940 2.698 2.250 3.721 . 0 0 "[ . 1 . 2]" 1
1736 2 69 GLU HA 2 69 GLU QG . . 3.420 2.581 2.226 3.374 . 0 0 "[ . 1 . 2]" 1
1737 2 69 GLU HA 2 69 GLU HG3 . . 3.940 3.450 2.726 3.865 . 0 0 "[ . 1 . 2]" 1
1738 2 69 GLU HA 2 72 LYS QG . . 4.060 2.966 2.224 3.817 . 0 0 "[ . 1 . 2]" 1
1739 2 69 GLU QB 2 70 TYR QD . . 4.210 3.155 2.434 4.054 . 0 0 "[ . 1 . 2]" 1
1740 2 69 GLU HB2 2 70 TYR H . . 4.280 3.057 2.612 4.222 . 0 0 "[ . 1 . 2]" 1
1741 2 69 GLU HB3 2 70 TYR H . . 4.280 3.602 2.597 4.285 0.005 1 0 "[ . 1 . 2]" 1
1742 2 69 GLU QG 2 70 TYR H . . 4.500 4.161 2.637 4.679 0.179 11 0 "[ . 1 . 2]" 1
1743 2 70 TYR H 2 70 TYR HB2 . . 4.040 2.288 2.206 2.376 . 0 0 "[ . 1 . 2]" 1
1744 2 70 TYR H 2 70 TYR QB . . 3.380 2.261 2.181 2.345 . 0 0 "[ . 1 . 2]" 1
1745 2 70 TYR H 2 70 TYR HB3 . . 4.040 3.539 3.368 3.611 . 0 0 "[ . 1 . 2]" 1
1746 2 70 TYR H 2 70 TYR QD . . 3.990 2.902 2.398 3.481 . 0 0 "[ . 1 . 2]" 1
1747 2 70 TYR H 2 71 LEU H . . 4.090 2.321 2.165 2.543 . 0 0 "[ . 1 . 2]" 1
1748 2 70 TYR HA 2 70 TYR QD . . 3.390 2.725 2.111 3.068 . 0 0 "[ . 1 . 2]" 1
1749 2 70 TYR HA 2 70 TYR QE . . 4.510 4.421 4.189 4.566 0.056 4 0 "[ . 1 . 2]" 1
1750 2 70 TYR HA 2 71 LEU H . . 3.500 3.475 3.381 3.525 0.025 10 0 "[ . 1 . 2]" 1
1751 2 70 TYR HA 2 72 LYS H . . 4.590 4.166 3.789 4.408 . 0 0 "[ . 1 . 2]" 1
1752 2 70 TYR HA 2 73 LEU H . . 3.510 3.256 3.062 3.437 . 0 0 "[ . 1 . 2]" 1
1753 2 70 TYR HA 2 73 LEU QD . . 3.920 3.751 3.023 4.332 0.412 4 0 "[ . 1 . 2]" 1
1754 2 70 TYR HA 2 73 LEU HG . . 4.760 4.508 3.806 5.235 0.475 15 0 "[ . 1 . 2]" 1
1755 2 70 TYR QB 2 71 LEU H . . 3.530 2.981 2.813 3.230 . 0 0 "[ . 1 . 2]" 1
1756 2 70 TYR HB2 2 71 LEU H . . 4.910 3.152 2.933 3.503 . 0 0 "[ . 1 . 2]" 1
1757 2 70 TYR HB3 2 71 LEU H . . 4.910 3.705 3.506 3.958 . 0 0 "[ . 1 . 2]" 1
1758 2 70 TYR QD 2 73 LEU QD . . 4.220 3.638 2.426 4.724 0.504 1 1 "[+ . 1 . 2]" 1
1759 2 71 LEU H 2 71 LEU QB . . 2.930 2.174 2.107 2.265 . 0 0 "[ . 1 . 2]" 1
1760 2 71 LEU H 2 71 LEU QD . . 4.170 3.458 2.639 3.762 . 0 0 "[ . 1 . 2]" 1
1761 2 71 LEU H 2 72 LYS H . . 4.010 2.631 2.438 2.771 . 0 0 "[ . 1 . 2]" 1
1762 2 71 LEU HA 2 71 LEU QD . . 3.080 2.169 2.015 2.305 . 0 0 "[ . 1 . 2]" 1
1763 2 71 LEU HA 2 72 LYS H . . 3.510 3.514 3.425 3.547 0.037 7 0 "[ . 1 . 2]" 1
1764 2 71 LEU HA 2 73 LEU H . . 4.510 3.926 3.628 4.386 . 0 0 "[ . 1 . 2]" 1
1765 2 71 LEU HA 2 74 LYS H . . 3.550 3.486 3.285 3.667 0.117 20 0 "[ . 1 . 2]" 1
1766 2 71 LEU HA 2 74 LYS QB . . 4.100 3.914 2.878 4.471 0.371 8 0 "[ . 1 . 2]" 1
1767 2 71 LEU HA 2 74 LYS QD . . 4.800 3.352 2.700 4.066 . 0 0 "[ . 1 . 2]" 1
1768 2 71 LEU HA 2 74 LYS QE . . 4.340 4.277 2.998 5.053 0.713 15 6 "[* *- 1 + **2]" 1
1769 2 71 LEU HA 2 74 LYS QG . . 3.870 2.272 2.085 2.681 . 0 0 "[ . 1 . 2]" 1
1770 2 71 LEU HA 2 75 GLU H . . 4.930 4.435 4.128 4.829 . 0 0 "[ . 1 . 2]" 1
1771 2 71 LEU HA 2 75 GLU QB . . 4.790 4.838 4.479 5.302 0.512 20 1 "[ . 1 . +]" 1
1772 2 71 LEU QB 2 71 LEU QD . . 2.830 1.966 1.942 2.058 . 0 0 "[ . 1 . 2]" 1
1773 2 71 LEU QB 2 72 LYS H . . 4.030 2.729 2.385 3.067 . 0 0 "[ . 1 . 2]" 1
1774 2 71 LEU QB 2 72 LYS HA . . 4.680 3.931 3.796 4.146 . 0 0 "[ . 1 . 2]" 1
1775 2 71 LEU QD 2 72 LYS H . . 4.420 4.135 3.914 4.376 . 0 0 "[ . 1 . 2]" 1
1776 2 71 LEU QD 2 74 LYS QD . . 4.380 2.288 2.110 2.816 . 0 0 "[ . 1 . 2]" 1
1777 2 71 LEU QD 2 74 LYS QE . . 3.760 3.216 2.336 3.912 0.152 19 0 "[ . 1 . 2]" 1
1778 2 72 LYS H 2 72 LYS QB . . 3.340 2.516 2.166 2.785 . 0 0 "[ . 1 . 2]" 1
1779 2 72 LYS H 2 72 LYS QD . . 4.770 3.933 3.037 4.433 . 0 0 "[ . 1 . 2]" 1
1780 2 72 LYS H 2 72 LYS HG2 . . 4.330 2.460 2.100 3.617 . 0 0 "[ . 1 . 2]" 1
1781 2 72 LYS H 2 72 LYS HG3 . . 4.330 3.102 2.082 3.981 . 0 0 "[ . 1 . 2]" 1
1782 2 72 LYS HA 2 72 LYS QD . . 4.350 4.132 2.226 4.515 0.165 14 0 "[ . 1 . 2]" 1
1783 2 72 LYS HA 2 72 LYS QG . . 3.650 3.231 2.307 3.463 . 0 0 "[ . 1 . 2]" 1
1784 2 72 LYS HA 2 73 LEU H . . 3.500 3.427 3.318 3.526 0.026 15 0 "[ . 1 . 2]" 1
1785 2 72 LYS HA 2 74 LYS H . . 4.500 4.555 4.336 4.710 0.210 12 0 "[ . 1 . 2]" 1
1786 2 72 LYS HA 2 75 GLU H . . 3.520 3.449 3.157 3.651 0.131 5 0 "[ . 1 . 2]" 1
1787 2 72 LYS HA 2 75 GLU QB . . 4.280 2.540 2.230 3.003 . 0 0 "[ . 1 . 2]" 1
1788 2 72 LYS HA 2 75 GLU QG . . 4.080 3.969 3.503 4.634 0.554 16 2 "[ - 1 .+ 2]" 1
1789 2 72 LYS HA 2 76 GLU H . . 4.650 4.307 3.918 4.831 0.181 9 0 "[ . 1 . 2]" 1
1790 2 72 LYS QB 2 72 LYS QD . . 3.270 2.232 2.115 2.833 . 0 0 "[ . 1 . 2]" 1
1791 2 72 LYS QB 2 73 LEU H . . 3.900 3.518 2.555 3.787 . 0 0 "[ . 1 . 2]" 1
1792 2 73 LEU H 2 73 LEU QB . . 3.530 2.235 2.190 2.274 . 0 0 "[ . 1 . 2]" 1
1793 2 73 LEU H 2 73 LEU MD1 . . 4.440 4.212 4.024 4.300 . 0 0 "[ . 1 . 2]" 1
1794 2 73 LEU H 2 73 LEU QD . . 3.820 3.688 3.611 3.789 . 0 0 "[ . 1 . 2]" 1
1795 2 73 LEU H 2 73 LEU MD2 . . 4.440 4.094 3.880 4.282 . 0 0 "[ . 1 . 2]" 1
1796 2 73 LEU H 2 73 LEU HG . . 4.500 4.527 4.384 4.645 0.145 4 0 "[ . 1 . 2]" 1
1797 2 73 LEU H 2 74 LYS H . . 3.960 2.544 2.333 2.692 . 0 0 "[ . 1 . 2]" 1
1798 2 73 LEU HA 2 73 LEU QD . . 3.600 2.104 2.043 2.208 . 0 0 "[ . 1 . 2]" 1
1799 2 73 LEU HA 2 74 LYS H . . 3.560 3.559 3.539 3.573 0.013 4 0 "[ . 1 . 2]" 1
1800 2 73 LEU HA 2 75 GLU H . . 4.760 4.024 3.833 4.207 . 0 0 "[ . 1 . 2]" 1
1801 2 73 LEU HA 2 76 GLU H . . 3.620 3.564 3.309 3.754 0.134 8 0 "[ . 1 . 2]" 1
1802 2 73 LEU HA 2 76 GLU QB . . 4.030 3.514 2.404 4.291 0.261 6 0 "[ . 1 . 2]" 1
1803 2 73 LEU QD 2 74 LYS H . . 3.640 3.572 3.099 4.042 0.402 15 0 "[ . 1 . 2]" 1
1804 2 73 LEU QD 2 74 LYS HA . . 3.960 3.591 2.756 4.361 0.401 15 0 "[ . 1 . 2]" 1
1805 2 73 LEU QD 2 74 LYS QB . . 4.740 4.056 3.421 4.702 . 0 0 "[ . 1 . 2]" 1
1806 2 73 LEU QD 2 75 GLU H . . 4.830 4.671 4.269 5.112 0.282 11 0 "[ . 1 . 2]" 1
1807 2 73 LEU QD 2 76 GLU QB . . 4.180 3.655 2.559 4.473 0.293 19 0 "[ . 1 . 2]" 1
1808 2 73 LEU QD 2 76 GLU QG . . 3.910 3.079 2.399 3.749 . 0 0 "[ . 1 . 2]" 1
1809 2 73 LEU QD 2 77 TYR H . . 4.430 4.030 3.444 4.735 0.305 17 0 "[ . 1 . 2]" 1
1810 2 73 LEU QD 2 77 TYR QB . . 4.500 3.528 2.678 4.492 . 0 0 "[ . 1 . 2]" 1
1811 2 73 LEU MD1 2 74 LYS H . . 4.490 3.916 3.176 4.604 0.114 16 0 "[ . 1 . 2]" 1
1812 2 73 LEU MD1 2 74 LYS HA . . 4.620 3.848 2.784 4.992 0.372 16 0 "[ . 1 . 2]" 1
1813 2 73 LEU MD2 2 74 LYS H . . 4.490 4.382 3.995 4.620 0.130 14 0 "[ . 1 . 2]" 1
1814 2 73 LEU MD2 2 74 LYS HA . . 4.620 4.851 4.412 5.162 0.542 14 3 "[* . -1 +. 2]" 1
1815 2 73 LEU HG 2 74 LYS H . . 4.380 4.377 3.570 4.927 0.547 9 6 "[ *- .* +1 *. *]" 1
1816 2 74 LYS H 2 74 LYS HB2 . . 4.040 3.616 3.531 3.649 . 0 0 "[ . 1 . 2]" 1
1817 2 74 LYS H 2 74 LYS QB . . 3.270 2.494 2.218 2.673 . 0 0 "[ . 1 . 2]" 1
1818 2 74 LYS H 2 74 LYS HB3 . . 4.040 2.543 2.242 2.752 . 0 0 "[ . 1 . 2]" 1
1819 2 74 LYS H 2 74 LYS QG . . 4.140 2.352 2.089 2.881 . 0 0 "[ . 1 . 2]" 1
1820 2 74 LYS H 2 75 GLU H . . 3.640 2.538 2.469 2.625 . 0 0 "[ . 1 . 2]" 1
1821 2 74 LYS HA 2 74 LYS QD . . 4.650 4.182 3.708 4.469 . 0 0 "[ . 1 . 2]" 1
1822 2 74 LYS HA 2 74 LYS QG . . 3.990 3.369 3.274 3.477 . 0 0 "[ . 1 . 2]" 1
1823 2 74 LYS HA 2 75 GLU H . . 3.630 3.435 3.349 3.500 . 0 0 "[ . 1 . 2]" 1
1824 2 74 LYS HA 2 75 GLU HA . . 4.630 4.759 4.678 4.817 0.187 12 0 "[ . 1 . 2]" 1
1825 2 74 LYS HA 2 76 GLU H . . 4.630 4.431 4.046 4.711 0.081 14 0 "[ . 1 . 2]" 1
1826 2 74 LYS HA 2 77 TYR H . . 4.440 3.299 3.094 3.482 . 0 0 "[ . 1 . 2]" 1
1827 2 74 LYS HA 2 77 TYR HB2 . . 4.700 2.916 2.383 3.368 . 0 0 "[ . 1 . 2]" 1
1828 2 74 LYS HA 2 77 TYR QB . . 4.040 2.326 2.159 2.711 . 0 0 "[ . 1 . 2]" 1
1829 2 74 LYS HA 2 77 TYR HB3 . . 4.700 2.467 2.219 2.953 . 0 0 "[ . 1 . 2]" 1
1830 2 74 LYS QB 2 74 LYS QD . . 3.010 2.252 2.178 2.477 . 0 0 "[ . 1 . 2]" 1
1831 2 74 LYS QB 2 74 LYS QE . . 3.740 2.191 2.115 2.335 . 0 0 "[ . 1 . 2]" 1
1832 2 74 LYS QB 2 75 GLU H . . 3.580 3.635 3.428 3.792 0.212 6 0 "[ . 1 . 2]" 1
1833 2 74 LYS QB 2 75 GLU QB . . 4.800 4.897 4.756 4.998 0.198 18 0 "[ . 1 . 2]" 1
1834 2 74 LYS HB2 2 74 LYS QD . . 3.490 2.414 2.230 2.841 . 0 0 "[ . 1 . 2]" 1
1835 2 74 LYS HB2 2 74 LYS QE . . 4.300 2.300 2.162 2.807 . 0 0 "[ . 1 . 2]" 1
1836 2 74 LYS HB2 2 75 GLU H . . 4.290 4.100 3.927 4.286 . 0 0 "[ . 1 . 2]" 1
1837 2 74 LYS HB3 2 74 LYS QD . . 3.490 3.001 2.262 3.464 . 0 0 "[ . 1 . 2]" 1
1838 2 74 LYS HB3 2 74 LYS QE . . 4.300 3.078 2.241 3.677 . 0 0 "[ . 1 . 2]" 1
1839 2 74 LYS HB3 2 75 GLU H . . 4.290 4.075 3.665 4.240 . 0 0 "[ . 1 . 2]" 1
1840 2 74 LYS QE 2 74 LYS QG . . 3.390 2.360 2.193 2.706 . 0 0 "[ . 1 . 2]" 1
1841 2 74 LYS QG 2 75 GLU H . . 4.390 2.447 2.270 2.883 . 0 0 "[ . 1 . 2]" 1
1842 2 74 LYS QG 2 75 GLU QB . . 3.580 3.361 3.117 3.746 0.166 7 0 "[ . 1 . 2]" 1
1843 2 75 GLU H 2 75 GLU QB . . 2.950 2.216 2.110 2.287 . 0 0 "[ . 1 . 2]" 1
1844 2 75 GLU H 2 75 GLU QG . . 4.050 4.026 3.941 4.086 0.036 6 0 "[ . 1 . 2]" 1
1845 2 75 GLU H 2 76 GLU H . . 3.370 2.594 2.411 2.761 . 0 0 "[ . 1 . 2]" 1
1846 2 75 GLU HA 2 75 GLU QG . . 3.640 2.719 2.333 3.030 . 0 0 "[ . 1 . 2]" 1
1847 2 75 GLU HA 2 76 GLU H . . 3.600 3.547 3.468 3.584 . 0 0 "[ . 1 . 2]" 1
1848 2 75 GLU HA 2 77 TYR H . . 4.900 4.191 3.966 4.397 . 0 0 "[ . 1 . 2]" 1
1849 2 75 GLU HA 2 78 GLN H . . 3.700 3.675 3.383 3.885 0.185 8 0 "[ . 1 . 2]" 1
1850 2 75 GLU QB 2 76 GLU H . . 3.110 2.461 2.239 2.768 . 0 0 "[ . 1 . 2]" 1
1851 2 75 GLU QG 2 76 GLU H . . 3.740 3.827 3.451 4.286 0.546 11 5 "[- * *+ * 2]" 1
1852 2 75 GLU QG 2 76 GLU HA . . 4.410 4.092 3.569 4.994 0.584 1 1 "[+ . 1 . 2]" 1
1853 2 76 GLU H 2 76 GLU QB . . 3.300 2.340 2.198 2.556 . 0 0 "[ . 1 . 2]" 1
1854 2 76 GLU H 2 76 GLU HG2 . . 4.430 3.399 2.186 4.594 0.164 16 0 "[ . 1 . 2]" 1
1855 2 76 GLU H 2 76 GLU QG . . 4.410 3.120 2.169 4.017 . 0 0 "[ . 1 . 2]" 1
1856 2 76 GLU H 2 76 GLU HG3 . . 4.240 3.864 3.219 4.484 0.244 15 0 "[ . 1 . 2]" 1
1857 2 76 GLU H 2 77 TYR H . . 3.480 2.549 2.417 2.709 . 0 0 "[ . 1 . 2]" 1
1858 2 76 GLU H 2 78 GLN H . . 4.760 4.365 4.160 4.629 . 0 0 "[ . 1 . 2]" 1
1859 2 76 GLU HA 2 76 GLU QG . . 3.640 3.105 2.491 3.371 . 0 0 "[ . 1 . 2]" 1
1860 2 76 GLU HA 2 77 TYR H . . 3.480 3.469 3.397 3.519 0.039 9 0 "[ . 1 . 2]" 1
1861 2 76 GLU HA 2 78 GLN H . . 4.760 4.273 3.845 4.878 0.118 11 0 "[ . 1 . 2]" 1
1862 2 76 GLU HA 2 79 ARG H . . 3.680 3.211 2.903 3.652 . 0 0 "[ . 1 . 2]" 1
1863 2 76 GLU HA 2 79 ARG QG . . 4.080 3.344 2.214 4.415 0.335 11 0 "[ . 1 . 2]" 1
1864 2 76 GLU QB 2 77 TYR H . . 3.770 3.139 2.482 3.647 . 0 0 "[ . 1 . 2]" 1
1865 2 76 GLU QG 2 77 TYR HA . . 4.210 3.365 2.983 3.906 . 0 0 "[ . 1 . 2]" 1
1866 2 77 TYR H 2 77 TYR HB2 . . 3.780 2.632 2.475 2.869 . 0 0 "[ . 1 . 2]" 1
1867 2 77 TYR H 2 77 TYR HB3 . . 3.780 2.375 2.183 2.487 . 0 0 "[ . 1 . 2]" 1
1868 2 77 TYR H 2 77 TYR QD . . 4.260 4.166 4.069 4.204 . 0 0 "[ . 1 . 2]" 1
1869 2 77 TYR H 2 78 GLN H . . 3.650 2.794 2.642 2.960 . 0 0 "[ . 1 . 2]" 1
1870 2 77 TYR HA 2 77 TYR QD . . 3.460 2.403 2.158 2.727 . 0 0 "[ . 1 . 2]" 1
1871 2 77 TYR HA 2 78 GLN H . . 3.650 3.538 3.501 3.572 . 0 0 "[ . 1 . 2]" 1
1872 2 77 TYR HA 2 79 ARG H . . 4.650 4.366 3.713 4.798 0.148 2 0 "[ . 1 . 2]" 1
1873 2 77 TYR HA 2 80 LEU H . . 3.800 4.103 3.846 4.354 0.554 16 2 "[ - 1 .+ 2]" 1
1874 2 77 TYR HA 2 80 LEU QB . . 4.570 4.547 4.152 4.931 0.361 10 0 "[ . 1 . 2]" 1
1875 2 77 TYR HA 2 80 LEU QD . . 4.360 2.239 2.118 2.437 . 0 0 "[ . 1 . 2]" 1
1876 2 77 TYR QB 2 78 GLN H . . 3.660 2.575 2.290 2.828 . 0 0 "[ . 1 . 2]" 1
1877 2 77 TYR HB2 2 78 GLN H . . 4.190 3.942 3.755 4.130 . 0 0 "[ . 1 . 2]" 1
1878 2 77 TYR HB3 2 78 GLN H . . 4.190 2.611 2.310 2.879 . 0 0 "[ . 1 . 2]" 1
1879 2 77 TYR QD 2 78 GLN H . . 4.290 3.739 3.243 4.263 . 0 0 "[ . 1 . 2]" 1
1880 2 77 TYR QD 2 78 GLN HA . . 4.780 4.208 3.714 4.580 . 0 0 "[ . 1 . 2]" 1
1881 2 77 TYR QD 2 80 LEU QD . . 4.830 3.001 2.296 3.383 . 0 0 "[ . 1 . 2]" 1
1882 2 77 TYR QE 2 80 LEU QD . . 4.040 4.196 3.533 4.610 0.570 16 2 "[ . - 1 .+ 2]" 1
1883 2 77 TYR QE 2 81 ARG QD . . 3.480 2.703 2.162 3.385 . 0 0 "[ . 1 . 2]" 1
1884 2 78 GLN H 2 78 GLN HB2 . . 3.980 2.646 2.234 3.661 . 0 0 "[ . 1 . 2]" 1
1885 2 78 GLN H 2 78 GLN QB . . 3.390 2.405 2.211 2.624 . 0 0 "[ . 1 . 2]" 1
1886 2 78 GLN H 2 78 GLN HB3 . . 3.980 3.396 2.557 3.673 . 0 0 "[ . 1 . 2]" 1
1887 2 78 GLN H 2 78 GLN HG2 . . 4.180 2.883 2.111 4.164 . 0 0 "[ . 1 . 2]" 1
1888 2 78 GLN H 2 78 GLN HG3 . . 4.180 3.287 2.165 3.992 . 0 0 "[ . 1 . 2]" 1
1889 2 78 GLN H 2 79 ARG H . . 3.720 2.447 2.211 2.689 . 0 0 "[ . 1 . 2]" 1
1890 2 78 GLN HA 2 78 GLN HG2 . . 4.080 3.012 2.337 3.819 . 0 0 "[ . 1 . 2]" 1
1891 2 78 GLN HA 2 78 GLN HG3 . . 4.080 3.453 2.640 3.850 . 0 0 "[ . 1 . 2]" 1
1892 2 78 GLN HA 2 79 ARG H . . 3.720 3.458 3.167 3.536 . 0 0 "[ . 1 . 2]" 1
1893 2 78 GLN HA 2 80 LEU H . . 4.720 4.684 4.465 4.871 0.151 3 0 "[ . 1 . 2]" 1
1894 2 78 GLN HA 2 81 ARG H . . 3.720 3.585 3.357 3.822 0.102 7 0 "[ . 1 . 2]" 1
1895 2 78 GLN QG 2 79 ARG H . . 4.790 3.859 2.169 4.675 . 0 0 "[ . 1 . 2]" 1
1896 2 79 ARG H 2 79 ARG HB2 . . 3.900 2.425 2.162 2.646 . 0 0 "[ . 1 . 2]" 1
1897 2 79 ARG H 2 79 ARG QB . . 3.390 2.312 2.123 2.583 . 0 0 "[ . 1 . 2]" 1
1898 2 79 ARG H 2 79 ARG HB3 . . 3.900 3.137 2.405 3.677 . 0 0 "[ . 1 . 2]" 1
1899 2 79 ARG H 2 79 ARG QD . . 4.350 3.984 2.893 4.765 0.415 10 0 "[ . 1 . 2]" 1
1900 2 79 ARG H 2 79 ARG HG2 . . 4.510 3.551 2.177 4.601 0.091 12 0 "[ . 1 . 2]" 1
1901 2 79 ARG H 2 79 ARG HG3 . . 4.380 3.983 2.613 4.510 0.130 12 0 "[ . 1 . 2]" 1
1902 2 79 ARG H 2 80 LEU H . . 3.790 2.769 2.347 3.015 . 0 0 "[ . 1 . 2]" 1
1903 2 79 ARG H 2 80 LEU QD . . 4.650 4.002 3.221 4.406 . 0 0 "[ . 1 . 2]" 1
1904 2 79 ARG HA 2 79 ARG HG2 . . 4.080 3.034 2.172 3.769 . 0 0 "[ . 1 . 2]" 1
1905 2 79 ARG HA 2 79 ARG HG3 . . 4.080 3.156 2.385 3.750 . 0 0 "[ . 1 . 2]" 1
1906 2 79 ARG HA 2 80 LEU H . . 3.790 3.578 3.553 3.601 . 0 0 "[ . 1 . 2]" 1
1907 2 79 ARG HA 2 81 ARG H . . 4.790 4.158 3.846 4.459 . 0 0 "[ . 1 . 2]" 1
1908 2 79 ARG HA 2 82 GLU H . . 3.580 3.688 3.461 3.856 0.276 5 0 "[ . 1 . 2]" 1
1909 2 79 ARG HA 2 82 GLU HG2 . . 3.930 2.337 2.193 2.866 . 0 0 "[ . 1 . 2]" 1
1910 2 79 ARG HA 2 82 GLU QG . . 3.420 2.284 2.163 2.756 . 0 0 "[ . 1 . 2]" 1
1911 2 79 ARG HA 2 82 GLU HG3 . . 3.930 3.524 2.766 4.092 0.162 3 0 "[ . 1 . 2]" 1
1912 2 79 ARG QB 2 80 LEU H . . 3.880 2.422 2.296 2.768 . 0 0 "[ . 1 . 2]" 1
1913 2 79 ARG QB 2 80 LEU QD . . 4.890 3.924 3.598 4.358 . 0 0 "[ . 1 . 2]" 1
1914 2 80 LEU H 2 80 LEU QB . . 3.170 2.344 2.151 2.474 . 0 0 "[ . 1 . 2]" 1
1915 2 80 LEU H 2 80 LEU MD1 . . 4.340 3.930 2.161 4.317 . 0 0 "[ . 1 . 2]" 1
1916 2 80 LEU H 2 80 LEU QD . . 3.240 2.472 2.152 2.773 . 0 0 "[ . 1 . 2]" 1
1917 2 80 LEU H 2 80 LEU MD2 . . 4.340 2.679 2.193 3.997 . 0 0 "[ . 1 . 2]" 1
1918 2 80 LEU H 2 80 LEU HG . . 4.190 3.157 2.511 3.909 . 0 0 "[ . 1 . 2]" 1
1919 2 80 LEU H 2 81 ARG H . . 3.670 2.573 2.469 2.648 . 0 0 "[ . 1 . 2]" 1
1920 2 80 LEU HA 2 80 LEU QD . . 4.180 3.392 3.104 3.470 . 0 0 "[ . 1 . 2]" 1
1921 2 80 LEU HA 2 81 ARG H . . 3.670 3.436 3.329 3.498 . 0 0 "[ . 1 . 2]" 1
1922 2 80 LEU HA 2 82 GLU H . . 4.670 4.473 4.096 4.711 0.041 5 0 "[ . 1 . 2]" 1
1923 2 80 LEU HA 2 83 GLN H . . 3.670 3.574 3.221 3.962 0.292 16 0 "[ . 1 . 2]" 1
1924 2 80 LEU QB 2 81 ARG H . . 3.930 3.641 3.507 3.856 . 0 0 "[ . 1 . 2]" 1
1925 2 80 LEU QB 2 81 ARG HA . . 4.760 4.620 4.472 4.792 0.032 14 0 "[ . 1 . 2]" 1
1926 2 80 LEU QD 2 81 ARG HA . . 3.820 3.258 2.621 3.843 0.023 4 0 "[ . 1 . 2]" 1
1927 2 80 LEU QD 2 81 ARG QB . . 4.200 3.699 3.137 4.127 . 0 0 "[ . 1 . 2]" 1
1928 2 80 LEU QD 2 81 ARG QD . . 4.000 3.404 2.979 3.863 . 0 0 "[ . 1 . 2]" 1
1929 2 80 LEU QD 2 81 ARG QG . . 3.940 2.379 2.097 2.823 . 0 0 "[ . 1 . 2]" 1
1930 2 80 LEU QD 2 82 GLU H . . 4.870 4.690 4.069 5.000 0.130 13 0 "[ . 1 . 2]" 1
1931 2 80 LEU MD1 2 81 ARG H . . 4.520 3.730 2.136 4.774 0.254 14 0 "[ . 1 . 2]" 1
1932 2 80 LEU MD1 2 81 ARG HA . . 4.540 3.635 2.798 4.640 0.100 14 0 "[ . 1 . 2]" 1
1933 2 80 LEU MD2 2 81 ARG H . . 4.520 3.308 2.281 3.924 . 0 0 "[ . 1 . 2]" 1
1934 2 80 LEU MD2 2 81 ARG HA . . 4.540 4.420 2.722 5.131 0.591 6 8 "[* .+ - 1* *** *]" 1
1935 2 81 ARG H 2 81 ARG QB . . 3.310 2.338 2.240 2.478 . 0 0 "[ . 1 . 2]" 1
1936 2 81 ARG H 2 81 ARG HG2 . . 4.320 3.235 2.517 3.854 . 0 0 "[ . 1 . 2]" 1
1937 2 81 ARG H 2 81 ARG QG . . 3.680 2.666 2.454 2.901 . 0 0 "[ . 1 . 2]" 1
1938 2 81 ARG H 2 81 ARG HG3 . . 4.320 3.161 2.507 3.962 . 0 0 "[ . 1 . 2]" 1
1939 2 81 ARG H 2 82 GLU H . . 3.370 2.438 2.196 2.654 . 0 0 "[ . 1 . 2]" 1
1940 2 81 ARG H 2 82 GLU QG . . 4.740 3.937 3.586 5.014 0.274 17 0 "[ . 1 . 2]" 1
1941 2 81 ARG HA 2 81 ARG QD . . 4.340 3.575 2.451 4.194 . 0 0 "[ . 1 . 2]" 1
1942 2 81 ARG HA 2 81 ARG HG2 . . 4.120 2.494 2.240 2.935 . 0 0 "[ . 1 . 2]" 1
1943 2 81 ARG HA 2 81 ARG QG . . 3.620 2.428 2.189 2.841 . 0 0 "[ . 1 . 2]" 1
1944 2 81 ARG HA 2 81 ARG HG3 . . 4.120 3.381 2.913 3.791 . 0 0 "[ . 1 . 2]" 1
1945 2 81 ARG HA 2 82 GLU H . . 3.670 3.535 3.482 3.564 . 0 0 "[ . 1 . 2]" 1
1946 2 81 ARG HA 2 83 GLN H . . 4.370 4.045 3.642 4.317 . 0 0 "[ . 1 . 2]" 1
1947 2 81 ARG HA 2 84 LEU H . . 3.670 3.586 3.157 3.905 0.235 12 0 "[ . 1 . 2]" 1
1948 2 81 ARG QB 2 81 ARG QD . . 3.260 2.431 2.228 2.732 . 0 0 "[ . 1 . 2]" 1
1949 2 81 ARG QB 2 82 GLU H . . 3.580 2.674 2.424 2.935 . 0 0 "[ . 1 . 2]" 1
1950 2 81 ARG QG 2 82 GLU H . . 4.730 4.214 4.069 4.364 . 0 0 "[ . 1 . 2]" 1
1951 2 82 GLU H 2 82 GLU QB . . 2.920 2.472 2.174 2.638 . 0 0 "[ . 1 . 2]" 1
1952 2 82 GLU H 2 82 GLU QG . . 3.490 2.309 2.154 3.064 . 0 0 "[ . 1 . 2]" 1
1953 2 82 GLU H 2 83 GLN H . . 2.950 2.511 2.358 2.607 . 0 0 "[ . 1 . 2]" 1
1954 2 82 GLU HA 2 82 GLU QG . . 3.580 3.343 3.319 3.440 . 0 0 "[ . 1 . 2]" 1
1955 2 82 GLU HA 2 83 GLN H . . 3.500 3.441 3.311 3.512 0.012 1 0 "[ . 1 . 2]" 1
1956 2 82 GLU HA 2 84 LEU H . . 4.500 3.770 3.428 4.350 . 0 0 "[ . 1 . 2]" 1
1957 2 82 GLU HA 2 85 LYS H . . 3.500 3.540 3.078 3.980 0.480 20 0 "[ . 1 . 2]" 1
1958 2 82 GLU HA 2 85 LYS QB . . 3.730 3.568 2.719 4.256 0.526 7 2 "[ . + 1 - 2]" 1
1959 2 82 GLU HA 2 85 LYS QD . . 4.140 2.976 2.125 3.941 . 0 0 "[ . 1 . 2]" 1
1960 2 82 GLU HA 2 85 LYS QG . . 3.970 2.624 2.131 4.223 0.253 2 0 "[ . 1 . 2]" 1
1961 2 82 GLU QB 2 83 GLN H . . 4.860 3.606 3.391 3.817 . 0 0 "[ . 1 . 2]" 1
1962 2 82 GLU QB 2 85 LYS QD . . 4.510 3.860 2.206 4.774 0.264 16 0 "[ . 1 . 2]" 1
1963 2 82 GLU QG 2 83 GLN H . . 3.740 2.457 2.157 2.966 . 0 0 "[ . 1 . 2]" 1
1964 2 82 GLU QG 2 83 GLN HA . . 4.180 3.357 2.974 3.986 . 0 0 "[ . 1 . 2]" 1
1965 2 83 GLN H 2 83 GLN QB . . 3.090 2.291 2.133 2.676 . 0 0 "[ . 1 . 2]" 1
1966 2 83 GLN H 2 83 GLN HG2 . . 4.620 3.986 2.187 4.635 0.015 8 0 "[ . 1 . 2]" 1
1967 2 83 GLN H 2 83 GLN QG . . 3.850 3.540 2.164 4.117 0.267 8 0 "[ . 1 . 2]" 1
1968 2 83 GLN H 2 83 GLN HG3 . . 4.620 4.129 2.518 4.606 . 0 0 "[ . 1 . 2]" 1
1969 2 83 GLN H 2 84 LEU H . . 3.290 2.478 2.328 2.609 . 0 0 "[ . 1 . 2]" 1
1970 2 83 GLN H 2 84 LEU QB . . 4.850 4.144 3.880 4.369 . 0 0 "[ . 1 . 2]" 1
1971 2 83 GLN HA 2 83 GLN HG2 . . 4.040 3.309 2.706 3.978 . 0 0 "[ . 1 . 2]" 1
1972 2 83 GLN HA 2 83 GLN QG . . 3.440 2.701 2.185 3.340 . 0 0 "[ . 1 . 2]" 1
1973 2 83 GLN HA 2 83 GLN HG3 . . 4.040 2.893 2.226 3.767 . 0 0 "[ . 1 . 2]" 1
1974 2 83 GLN HA 2 84 LEU H . . 3.690 3.399 3.210 3.528 . 0 0 "[ . 1 . 2]" 1
1975 2 83 GLN HA 2 85 LYS H . . 4.690 3.969 3.324 4.978 0.288 6 0 "[ . 1 . 2]" 1
1976 2 83 GLN QB 2 84 LEU H . . 4.100 3.176 2.615 3.894 . 0 0 "[ . 1 . 2]" 1
1977 2 83 GLN HB2 2 84 LEU H . . 4.690 4.050 3.668 4.396 . 0 0 "[ . 1 . 2]" 1
1978 2 83 GLN HB3 2 84 LEU H . . 4.690 3.363 2.677 4.346 . 0 0 "[ . 1 . 2]" 1
1979 2 83 GLN QG 2 84 LEU QD . . 4.760 4.140 2.332 5.346 0.586 2 2 "[ + . 1- . 2]" 1
1980 2 84 LEU H 2 84 LEU QB . . 3.000 2.209 2.118 2.360 . 0 0 "[ . 1 . 2]" 1
1981 2 84 LEU H 2 84 LEU MD1 . . 4.640 4.248 4.049 4.481 . 0 0 "[ . 1 . 2]" 1
1982 2 84 LEU H 2 84 LEU QD . . 4.060 3.475 2.911 3.873 . 0 0 "[ . 1 . 2]" 1
1983 2 84 LEU H 2 84 LEU MD2 . . 4.640 3.785 2.966 4.358 . 0 0 "[ . 1 . 2]" 1
1984 2 84 LEU HA 2 84 LEU MD1 . . 4.230 2.489 2.132 3.781 . 0 0 "[ . 1 . 2]" 1
1985 2 84 LEU HA 2 84 LEU MD2 . . 4.230 2.771 2.090 3.944 . 0 0 "[ . 1 . 2]" 1
1986 2 84 LEU HA 2 85 LYS H . . 3.600 3.366 3.047 3.562 . 0 0 "[ . 1 . 2]" 1
1987 2 84 LEU QB 2 84 LEU QD . . 2.780 2.016 1.906 2.098 . 0 0 "[ . 1 . 2]" 1
1988 2 84 LEU QB 2 85 LYS H . . 3.760 3.036 2.163 3.610 . 0 0 "[ . 1 . 2]" 1
1989 2 84 LEU QD 2 85 LYS H . . 3.600 3.996 3.170 4.203 0.603 12 7 "[* * . 1*+*-.* 2]" 1
1990 2 84 LEU QD 2 85 LYS HA . . 4.070 4.288 2.977 4.633 0.563 3 6 "[* + . * 1 . *-*2]" 1
1991 2 85 LYS H 2 85 LYS HB2 . . 3.660 3.129 2.308 3.751 0.091 17 0 "[ . 1 . 2]" 1
1992 2 85 LYS H 2 85 LYS QB . . 3.010 2.546 2.280 2.818 . 0 0 "[ . 1 . 2]" 1
1993 2 85 LYS H 2 85 LYS HB3 . . 3.660 3.135 2.526 3.699 0.039 1 0 "[ . 1 . 2]" 1
1994 2 85 LYS H 2 85 LYS QD . . 4.290 4.013 3.614 4.461 0.171 20 0 "[ . 1 . 2]" 1
1995 2 85 LYS H 2 85 LYS QG . . 3.470 2.437 2.147 3.135 . 0 0 "[ . 1 . 2]" 1
1996 2 85 LYS QB 2 85 LYS QD . . 3.030 2.164 2.100 2.258 . 0 0 "[ . 1 . 2]" 1
1997 2 85 LYS HB2 2 85 LYS QD . . 3.630 2.393 2.182 2.902 . 0 0 "[ . 1 . 2]" 1
1998 2 85 LYS HB3 2 85 LYS QD . . 3.630 2.610 2.197 3.133 . 0 0 "[ . 1 . 2]" 1
1999 2 86 LYS HA 2 86 LYS QD . . 4.430 3.875 2.201 4.510 0.080 12 0 "[ . 1 . 2]" 1
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