NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
425193 |
2gdt   |
7014 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2gdt
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 2363
_Distance_constraint_stats_list.Viol_count 3853
_Distance_constraint_stats_list.Viol_total 6331.993
_Distance_constraint_stats_list.Viol_max 0.915
_Distance_constraint_stats_list.Viol_rms 0.0342
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0067
_Distance_constraint_stats_list.Viol_average_violations_only 0.0822
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 HIS 7.653 0.579 8 1 "[ . + 1 . 2]"
1 3 VAL 8.889 0.489 19 0 "[ . 1 . 2]"
1 4 GLN 9.840 0.529 13 1 "[ . 1 + . 2]"
1 5 LEU 4.626 0.106 11 0 "[ . 1 . 2]"
1 6 SER 1.546 0.081 2 0 "[ . 1 . 2]"
1 7 LEU 4.665 0.805 20 1 "[ . 1 . +]"
1 8 PRO 5.869 0.105 12 0 "[ . 1 . 2]"
1 9 VAL 3.076 0.095 19 0 "[ . 1 . 2]"
1 10 LEU 1.149 0.105 12 0 "[ . 1 . 2]"
1 11 GLN 7.102 0.915 3 4 "[* +-. 1 . *]"
1 12 VAL 5.735 0.879 1 2 "[+ -. 1 . 2]"
1 13 ARG 9.507 0.915 3 3 "[ +*. 1 . *]"
1 14 ASP 5.539 0.271 3 0 "[ . 1 . 2]"
1 15 VAL 9.758 0.880 13 2 "[ . 1- + . 2]"
1 16 LEU 7.045 0.902 11 2 "[ . 1+ * . 2]"
1 17 VAL 10.428 0.417 14 0 "[ . 1 . 2]"
1 18 ARG 9.141 0.469 16 0 "[ . 1 . 2]"
1 19 GLY 2.874 0.086 2 0 "[ . 1 . 2]"
1 20 PHE 6.796 0.104 15 0 "[ . 1 . 2]"
1 21 GLY 4.079 0.759 2 1 "[ + . 1 . 2]"
1 22 ASP 2.511 0.759 2 1 "[ + . 1 . 2]"
1 23 SER 2.673 0.081 4 0 "[ . 1 . 2]"
1 24 VAL 4.998 0.736 4 2 "[ +. 1- . 2]"
1 25 GLU 10.360 0.821 11 7 "[ * *.* *+ * . *2]"
1 26 GLU 3.964 0.090 13 0 "[ . 1 . 2]"
1 27 ALA 2.891 0.106 14 0 "[ . 1 . 2]"
1 28 LEU 13.275 0.821 11 8 "[ * *.* *+ - .* *2]"
1 29 SER 2.863 0.561 6 1 "[ .+ 1 . 2]"
1 30 GLU 5.796 0.561 6 1 "[ .+ 1 . 2]"
1 31 ALA 4.169 0.587 10 1 "[ . + . 2]"
1 32 ARG 3.831 0.105 17 0 "[ . 1 . 2]"
1 33 GLU 3.975 0.324 8 0 "[ . 1 . 2]"
1 34 HIS 3.560 0.152 11 0 "[ . 1 . 2]"
1 35 LEU 3.327 0.099 20 0 "[ . 1 . 2]"
1 36 LYS 8.305 0.434 17 0 "[ . 1 . 2]"
1 37 ASN 2.036 0.388 15 0 "[ . 1 . 2]"
1 38 GLY 0.724 0.071 16 0 "[ . 1 . 2]"
1 39 THR 3.818 0.102 14 0 "[ . 1 . 2]"
1 40 CYS 0.481 0.069 18 0 "[ . 1 . 2]"
1 41 GLY 0.133 0.074 4 0 "[ . 1 . 2]"
1 42 LEU 3.676 0.190 18 0 "[ . 1 . 2]"
1 43 VAL 2.722 0.119 8 0 "[ . 1 . 2]"
1 44 GLU 1.301 0.079 4 0 "[ . 1 . 2]"
1 45 LEU 7.367 0.115 20 0 "[ . 1 . 2]"
1 46 GLU 3.350 0.095 6 0 "[ . 1 . 2]"
1 47 LYS 1.564 0.330 14 0 "[ . 1 . 2]"
1 48 GLY 1.265 0.330 14 0 "[ . 1 . 2]"
1 49 VAL 7.362 0.096 16 0 "[ . 1 . 2]"
1 50 LEU 4.134 0.112 18 0 "[ . 1 . 2]"
1 51 PRO 3.962 0.088 6 0 "[ . 1 . 2]"
1 52 GLN 2.670 0.088 16 0 "[ . 1 . 2]"
1 53 LEU 5.133 0.115 2 0 "[ . 1 . 2]"
1 54 GLU 6.403 0.469 16 0 "[ . 1 . 2]"
1 55 GLN 22.763 0.813 4 10 "[** +*** 1 * . **-2]"
1 56 PRO 8.312 0.632 5 6 "[* + * 1 * . * -2]"
1 57 TYR 16.108 0.477 6 0 "[ . 1 . 2]"
1 58 VAL 0.280 0.091 15 0 "[ . 1 . 2]"
1 59 PHE 13.743 0.554 13 1 "[ . 1 + . 2]"
1 60 ILE 12.879 0.136 14 0 "[ . 1 . 2]"
1 61 LYS 11.987 0.135 9 0 "[ . 1 . 2]"
1 62 ARG 3.588 0.176 3 0 "[ . 1 . 2]"
1 63 SER 2.205 0.542 13 1 "[ . 1 + . 2]"
1 64 ASP 0.721 0.078 15 0 "[ . 1 . 2]"
1 65 ALA 8.275 0.849 12 5 "[ . * +*-. *]"
1 66 LEU 13.433 0.849 12 5 "[ . * +*-. *]"
1 68 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 HIS 0.726 0.145 19 0 "[ . 1 . 2]"
1 72 HIS 5.169 0.485 3 0 "[ . 1 . 2]"
1 73 LYS 4.252 0.485 3 0 "[ . 1 . 2]"
1 74 VAL 2.715 0.104 2 0 "[ . 1 . 2]"
1 75 VAL 3.854 0.118 13 0 "[ . 1 . 2]"
1 76 GLU 6.991 0.108 20 0 "[ . 1 . 2]"
1 77 LEU 5.780 0.587 10 1 "[ . + . 2]"
1 78 VAL 5.161 0.113 13 0 "[ . 1 . 2]"
1 79 ALA 6.895 0.465 7 0 "[ . 1 . 2]"
1 80 GLU 6.585 0.523 12 1 "[ . 1 + . 2]"
1 81 MET 1.423 0.078 13 0 "[ . 1 . 2]"
1 82 ASP 4.041 0.591 17 2 "[ . - 1 . + 2]"
1 83 GLY 3.343 0.094 15 0 "[ . 1 . 2]"
1 84 ILE 5.363 0.183 16 0 "[ . 1 . 2]"
1 85 GLN 3.171 0.523 12 1 "[ . 1 + . 2]"
1 86 TYR 10.133 0.554 13 1 "[ . 1 + . 2]"
1 87 GLY 0.077 0.077 9 0 "[ . 1 . 2]"
1 88 ARG 2.291 0.110 1 0 "[ . 1 . 2]"
1 89 SER 1.913 0.705 14 2 "[ . 1 - +. 2]"
1 90 GLY 2.380 0.705 14 2 "[ . 1 - +. 2]"
1 91 ILE 8.374 0.231 12 0 "[ . 1 . 2]"
1 92 THR 7.640 0.136 14 0 "[ . 1 . 2]"
1 93 LEU 3.019 0.118 13 0 "[ . 1 . 2]"
1 94 GLY 6.729 0.119 4 0 "[ . 1 . 2]"
1 95 VAL 8.393 0.371 11 0 "[ . 1 . 2]"
1 96 LEU 4.828 0.371 11 0 "[ . 1 . 2]"
1 97 VAL 2.564 0.084 15 0 "[ . 1 . 2]"
1 98 PRO 4.225 0.091 14 0 "[ . 1 . 2]"
1 99 HIS 3.669 0.090 12 0 "[ . 1 . 2]"
1 100 VAL 0.446 0.071 12 0 "[ . 1 . 2]"
1 101 GLY 1.004 0.087 3 0 "[ . 1 . 2]"
1 102 GLU 2.017 0.138 13 0 "[ . 1 . 2]"
1 103 THR 5.665 0.138 13 0 "[ . 1 . 2]"
1 104 PRO 4.790 0.101 2 0 "[ . 1 . 2]"
1 105 ILE 5.142 0.490 5 0 "[ . 1 . 2]"
1 106 ALA 2.492 0.098 11 0 "[ . 1 . 2]"
1 107 TYR 7.340 0.105 14 0 "[ . 1 . 2]"
1 108 ARG 7.475 0.448 8 0 "[ . 1 . 2]"
1 109 ASN 8.610 0.805 20 2 "[ . 1 - . +]"
1 110 VAL 1.590 0.101 14 0 "[ . 1 . 2]"
1 111 LEU 11.574 0.111 14 0 "[ . 1 . 2]"
1 112 LEU 6.342 0.489 19 0 "[ . 1 . 2]"
1 113 ARG 6.639 0.294 10 0 "[ . 1 . 2]"
1 114 LYS 3.385 0.579 8 1 "[ . + 1 . 2]"
1 115 ASN 0.126 0.086 6 0 "[ . 1 . 2]"
1 116 GLY 0.126 0.086 6 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 HIS HA 1 2 HIS HD2 . . 4.970 4.035 3.485 4.623 . 0 0 "[ . 1 . 2]" 1
2 1 2 HIS HA 1 3 VAL H . . 2.960 2.493 2.303 2.704 . 0 0 "[ . 1 . 2]" 1
3 1 2 HIS HA 1 3 VAL HA . . 4.880 4.506 4.325 4.631 . 0 0 "[ . 1 . 2]" 1
4 1 2 HIS HA 1 3 VAL HB . . 5.440 4.949 4.249 5.512 0.072 7 0 "[ . 1 . 2]" 1
5 1 2 HIS HA 1 3 VAL QG . . 4.460 3.395 2.932 4.358 . 0 0 "[ . 1 . 2]" 1
6 1 2 HIS HA 1 111 LEU MD1 . . 5.360 4.091 3.830 4.380 . 0 0 "[ . 1 . 2]" 1
7 1 2 HIS HA 1 112 LEU H . . 5.500 4.627 4.240 5.080 . 0 0 "[ . 1 . 2]" 1
8 1 2 HIS HA 1 113 ARG H . . 5.500 5.368 5.013 5.575 0.075 10 0 "[ . 1 . 2]" 1
9 1 2 HIS HA 1 113 ARG HA . . 3.430 3.289 2.600 3.516 0.086 10 0 "[ . 1 . 2]" 1
10 1 2 HIS HA 1 113 ARG QG . . 5.500 5.182 4.503 5.605 0.105 14 0 "[ . 1 . 2]" 1
11 1 2 HIS HA 1 114 LYS H . . 3.860 2.880 2.084 3.623 . 0 0 "[ . 1 . 2]" 1
12 1 2 HIS HA 1 114 LYS HB2 . . 4.320 3.089 2.343 4.899 0.579 8 1 "[ . + 1 . 2]" 1
13 1 2 HIS HA 1 114 LYS HB3 . . 5.030 4.385 3.471 5.108 0.078 11 0 "[ . 1 . 2]" 1
14 1 2 HIS HA 1 114 LYS QG . . 4.500 3.790 2.010 4.593 0.093 18 0 "[ . 1 . 2]" 1
15 1 2 HIS HB2 1 2 HIS HD2 . . 3.440 3.365 2.897 3.531 0.091 7 0 "[ . 1 . 2]" 1
16 1 2 HIS HB2 1 3 VAL H . . 3.690 3.587 3.119 3.768 0.078 16 0 "[ . 1 . 2]" 1
17 1 2 HIS HB2 1 74 VAL QG . . 5.270 3.238 2.860 3.763 . 0 0 "[ . 1 . 2]" 1
18 1 2 HIS HB2 1 111 LEU HA . . 5.070 4.998 4.727 5.149 0.079 20 0 "[ . 1 . 2]" 1
19 1 2 HIS HB2 1 111 LEU HB2 . . 5.340 4.128 3.717 4.539 . 0 0 "[ . 1 . 2]" 1
20 1 2 HIS HB2 1 111 LEU HB3 . . 4.240 2.841 2.384 3.222 . 0 0 "[ . 1 . 2]" 1
21 1 2 HIS HB2 1 111 LEU MD1 . . 4.140 2.335 2.140 2.686 . 0 0 "[ . 1 . 2]" 1
22 1 2 HIS HB2 1 111 LEU MD2 . . 4.390 4.450 4.316 4.499 0.109 13 0 "[ . 1 . 2]" 1
23 1 2 HIS HB2 1 111 LEU HG . . 5.120 3.051 2.758 3.281 . 0 0 "[ . 1 . 2]" 1
24 1 2 HIS HB2 1 112 LEU H . . 5.060 4.356 3.755 4.768 . 0 0 "[ . 1 . 2]" 1
25 1 2 HIS HB2 1 113 ARG HA . . 4.770 4.664 4.210 4.856 0.086 19 0 "[ . 1 . 2]" 1
26 1 2 HIS HB3 1 2 HIS HD2 . . 3.490 2.540 2.406 2.846 . 0 0 "[ . 1 . 2]" 1
27 1 2 HIS HB3 1 3 VAL H . . 3.580 2.449 2.082 2.730 . 0 0 "[ . 1 . 2]" 1
28 1 2 HIS HB3 1 3 VAL HA . . 5.500 4.775 4.487 4.973 . 0 0 "[ . 1 . 2]" 1
29 1 2 HIS HB3 1 74 VAL QG . . 4.530 3.379 2.892 3.896 . 0 0 "[ . 1 . 2]" 1
30 1 2 HIS HB3 1 111 LEU HA . . 5.500 4.330 4.037 4.492 . 0 0 "[ . 1 . 2]" 1
31 1 2 HIS HB3 1 111 LEU HB2 . . 5.090 3.921 3.348 4.236 . 0 0 "[ . 1 . 2]" 1
32 1 2 HIS HB3 1 111 LEU HB3 . . 4.050 2.313 2.094 2.524 . 0 0 "[ . 1 . 2]" 1
33 1 2 HIS HB3 1 111 LEU MD1 . . 3.840 2.687 2.108 3.114 . 0 0 "[ . 1 . 2]" 1
34 1 2 HIS HB3 1 111 LEU HG . . 4.130 3.771 3.430 4.200 0.070 1 0 "[ . 1 . 2]" 1
35 1 2 HIS HB3 1 112 LEU H . . 5.170 3.024 2.542 3.546 . 0 0 "[ . 1 . 2]" 1
36 1 2 HIS HB3 1 112 LEU HA . . 5.500 4.581 4.170 4.955 . 0 0 "[ . 1 . 2]" 1
37 1 2 HIS HB3 1 113 ARG HA . . 4.210 3.428 2.783 3.739 . 0 0 "[ . 1 . 2]" 1
38 1 2 HIS HB3 1 114 LYS H . . 5.500 4.312 3.547 5.214 . 0 0 "[ . 1 . 2]" 1
39 1 2 HIS HD2 1 3 VAL H . . 5.480 4.584 3.886 5.238 . 0 0 "[ . 1 . 2]" 1
40 1 2 HIS HD2 1 74 VAL QG . . 3.270 2.242 1.965 2.843 . 0 0 "[ . 1 . 2]" 1
41 1 2 HIS HD2 1 111 LEU HB3 . . 3.850 3.266 2.567 3.688 . 0 0 "[ . 1 . 2]" 1
42 1 2 HIS HD2 1 111 LEU MD1 . . 4.650 4.532 3.859 4.738 0.088 4 0 "[ . 1 . 2]" 1
43 1 2 HIS HD2 1 111 LEU HG . . 5.500 4.709 3.954 5.419 . 0 0 "[ . 1 . 2]" 1
44 1 2 HIS HD2 1 112 LEU QD . . 5.470 4.886 4.234 5.367 . 0 0 "[ . 1 . 2]" 1
45 1 2 HIS HD2 1 113 ARG H . . 5.500 3.674 3.022 4.237 . 0 0 "[ . 1 . 2]" 1
46 1 2 HIS HD2 1 113 ARG HA . . 3.320 2.672 2.070 3.376 0.056 1 0 "[ . 1 . 2]" 1
47 1 2 HIS HD2 1 113 ARG HB3 . . 5.330 4.535 2.405 5.494 0.164 15 0 "[ . 1 . 2]" 1
48 1 2 HIS HD2 1 114 LYS H . . 5.500 4.517 3.760 5.224 . 0 0 "[ . 1 . 2]" 1
49 1 3 VAL H 1 3 VAL HB . . 3.430 2.833 2.142 3.497 0.067 20 0 "[ . 1 . 2]" 1
50 1 3 VAL H 1 3 VAL QG . . 3.350 2.418 1.986 2.934 . 0 0 "[ . 1 . 2]" 1
51 1 3 VAL H 1 111 LEU HA . . 4.840 4.413 3.878 4.907 0.067 8 0 "[ . 1 . 2]" 1
52 1 3 VAL H 1 112 LEU HB2 . . 5.470 4.415 3.589 5.124 . 0 0 "[ . 1 . 2]" 1
53 1 3 VAL H 1 112 LEU HB3 . . 4.430 3.424 2.936 3.917 . 0 0 "[ . 1 . 2]" 1
54 1 3 VAL H 1 113 ARG HA . . 4.630 4.271 3.861 4.490 . 0 0 "[ . 1 . 2]" 1
55 1 3 VAL H 1 114 LYS QD . . 5.070 4.695 2.980 5.140 0.070 17 0 "[ . 1 . 2]" 1
56 1 3 VAL H 1 114 LYS QG . . 5.440 3.893 2.559 4.982 . 0 0 "[ . 1 . 2]" 1
57 1 3 VAL HA 1 3 VAL QG . . 3.280 2.159 2.104 2.231 . 0 0 "[ . 1 . 2]" 1
58 1 3 VAL HA 1 4 GLN H . . 2.710 2.272 2.043 2.530 . 0 0 "[ . 1 . 2]" 1
59 1 3 VAL HA 1 4 GLN HA . . 5.020 4.427 4.268 4.535 . 0 0 "[ . 1 . 2]" 1
60 1 3 VAL HA 1 4 GLN HB2 . . 4.620 4.324 4.093 4.570 . 0 0 "[ . 1 . 2]" 1
61 1 3 VAL HA 1 5 LEU QD . . 5.500 5.194 4.484 5.436 . 0 0 "[ . 1 . 2]" 1
62 1 3 VAL HA 1 5 LEU HG . . 5.500 5.463 5.123 5.576 0.076 6 0 "[ . 1 . 2]" 1
63 1 3 VAL HA 1 111 LEU MD1 . . 5.220 3.400 3.056 3.768 . 0 0 "[ . 1 . 2]" 1
64 1 3 VAL HA 1 112 LEU H . . 5.500 4.580 4.366 4.795 . 0 0 "[ . 1 . 2]" 1
65 1 3 VAL HB 1 4 GLN H . . 3.950 3.914 3.524 4.053 0.103 9 0 "[ . 1 . 2]" 1
66 1 3 VAL HB 1 112 LEU H . . 4.910 3.810 3.214 4.627 . 0 0 "[ . 1 . 2]" 1
67 1 3 VAL HB 1 112 LEU HB2 . . 4.280 4.005 3.207 4.375 0.095 9 0 "[ . 1 . 2]" 1
68 1 3 VAL HB 1 112 LEU HB3 . . 4.070 3.136 2.235 4.135 0.065 9 0 "[ . 1 . 2]" 1
69 1 3 VAL HB 1 112 LEU QD . . 4.630 3.896 2.990 4.567 . 0 0 "[ . 1 . 2]" 1
70 1 3 VAL HB 1 114 LYS QE . . 4.060 3.919 2.593 4.164 0.104 12 0 "[ . 1 . 2]" 1
71 1 3 VAL HB 1 114 LYS QG . . 5.320 3.995 2.279 5.056 . 0 0 "[ . 1 . 2]" 1
72 1 3 VAL QG 1 4 GLN H . . 3.630 2.811 2.276 3.480 . 0 0 "[ . 1 . 2]" 1
73 1 3 VAL QG 1 4 GLN HA . . 5.500 4.196 3.697 4.695 . 0 0 "[ . 1 . 2]" 1
74 1 3 VAL QG 1 4 GLN HB3 . . 5.500 4.702 4.138 5.455 . 0 0 "[ . 1 . 2]" 1
75 1 3 VAL QG 1 4 GLN QG . . 5.500 5.118 4.678 5.616 0.116 20 0 "[ . 1 . 2]" 1
76 1 3 VAL QG 1 112 LEU H . . 4.890 3.529 2.840 4.132 . 0 0 "[ . 1 . 2]" 1
77 1 3 VAL QG 1 112 LEU HB2 . . 3.630 3.548 2.082 4.119 0.489 19 0 "[ . 1 . 2]" 1
78 1 3 VAL QG 1 112 LEU HB3 . . 4.000 2.793 1.979 3.873 . 0 0 "[ . 1 . 2]" 1
79 1 3 VAL QG 1 112 LEU QD . . 4.200 3.129 1.953 3.952 . 0 0 "[ . 1 . 2]" 1
80 1 3 VAL QG 1 114 LYS HA . . 4.530 3.972 2.131 4.660 0.130 17 0 "[ . 1 . 2]" 1
81 1 3 VAL QG 1 114 LYS HB2 . . 4.880 2.955 2.203 4.775 . 0 0 "[ . 1 . 2]" 1
82 1 3 VAL QG 1 114 LYS HB3 . . 5.150 3.641 2.717 4.966 . 0 0 "[ . 1 . 2]" 1
83 1 3 VAL QG 1 114 LYS QD . . 3.420 2.484 1.983 3.441 0.021 18 0 "[ . 1 . 2]" 1
84 1 3 VAL QG 1 114 LYS QE . . 4.140 2.188 1.764 3.797 . 0 0 "[ . 1 . 2]" 1
85 1 3 VAL QG 1 114 LYS QG . . 3.620 2.247 1.924 2.783 . 0 0 "[ . 1 . 2]" 1
86 1 4 GLN H 1 4 GLN HB2 . . 3.370 2.381 2.165 2.645 . 0 0 "[ . 1 . 2]" 1
87 1 4 GLN H 1 4 GLN HB3 . . 3.230 2.940 2.659 3.304 0.074 14 0 "[ . 1 . 2]" 1
88 1 4 GLN H 1 4 GLN QG . . 3.750 3.818 3.468 3.869 0.119 17 0 "[ . 1 . 2]" 1
89 1 4 GLN H 1 5 LEU H . . 4.640 4.549 4.380 4.641 0.001 5 0 "[ . 1 . 2]" 1
90 1 4 GLN H 1 5 LEU HG . . 5.500 4.743 4.039 5.151 . 0 0 "[ . 1 . 2]" 1
91 1 4 GLN H 1 111 LEU HA . . 5.500 4.481 4.300 4.653 . 0 0 "[ . 1 . 2]" 1
92 1 4 GLN H 1 111 LEU MD1 . . 4.630 3.039 2.588 3.558 . 0 0 "[ . 1 . 2]" 1
93 1 4 GLN HA 1 4 GLN QG . . 3.270 2.129 2.048 2.236 . 0 0 "[ . 1 . 2]" 1
94 1 4 GLN HA 1 5 LEU H . . 2.800 2.214 2.117 2.278 . 0 0 "[ . 1 . 2]" 1
95 1 4 GLN HA 1 5 LEU HB2 . . 4.690 4.532 4.366 4.729 0.039 2 0 "[ . 1 . 2]" 1
96 1 4 GLN HA 1 5 LEU HG . . 5.310 4.115 3.878 4.354 . 0 0 "[ . 1 . 2]" 1
97 1 4 GLN HA 1 110 VAL H . . 4.850 4.608 4.430 4.890 0.040 8 0 "[ . 1 . 2]" 1
98 1 4 GLN HA 1 111 LEU HA . . 3.420 2.061 1.918 2.172 . 0 0 "[ . 1 . 2]" 1
99 1 4 GLN HA 1 111 LEU HB3 . . 5.390 4.221 3.815 4.500 . 0 0 "[ . 1 . 2]" 1
100 1 4 GLN HA 1 111 LEU MD1 . . 3.620 2.196 2.102 2.539 . 0 0 "[ . 1 . 2]" 1
101 1 4 GLN HA 1 112 LEU H . . 4.280 3.644 3.298 3.888 . 0 0 "[ . 1 . 2]" 1
102 1 4 GLN HB2 1 4 GLN HE22 . . 5.500 4.623 4.084 4.913 . 0 0 "[ . 1 . 2]" 1
103 1 4 GLN HB2 1 111 LEU MD1 . . 3.720 2.637 2.347 3.277 . 0 0 "[ . 1 . 2]" 1
104 1 4 GLN HB2 1 111 LEU MD2 . . 3.880 3.743 2.790 3.991 0.111 14 0 "[ . 1 . 2]" 1
105 1 4 GLN HB3 1 4 GLN QG . . 2.680 2.426 2.339 2.552 . 0 0 "[ . 1 . 2]" 1
106 1 4 GLN HB3 1 5 LEU H . . 4.220 3.698 3.294 4.127 . 0 0 "[ . 1 . 2]" 1
107 1 4 GLN HB3 1 111 LEU HA . . 5.040 5.025 4.836 5.109 0.069 16 0 "[ . 1 . 2]" 1
108 1 4 GLN HB3 1 111 LEU MD1 . . 4.740 3.856 3.687 4.056 . 0 0 "[ . 1 . 2]" 1
109 1 4 GLN HE21 1 5 LEU H . . 5.500 4.408 2.876 5.120 . 0 0 "[ . 1 . 2]" 1
110 1 4 GLN HE21 1 109 ASN HD21 . . 5.160 4.020 2.612 5.689 0.529 13 1 "[ . 1 + . 2]" 1
111 1 4 GLN HE21 1 111 LEU MD1 . . 5.500 5.108 4.115 5.589 0.089 2 0 "[ . 1 . 2]" 1
112 1 4 GLN HE22 1 109 ASN HB3 . . 5.500 4.412 2.472 5.660 0.160 14 0 "[ . 1 . 2]" 1
113 1 4 GLN HE22 1 109 ASN HD21 . . 5.500 4.017 2.097 5.554 0.054 3 0 "[ . 1 . 2]" 1
114 1 4 GLN QG 1 5 LEU H . . 3.490 2.488 2.068 3.391 . 0 0 "[ . 1 . 2]" 1
115 1 4 GLN QG 1 6 SER H . . 5.500 5.379 4.339 5.581 0.081 5 0 "[ . 1 . 2]" 1
116 1 4 GLN QG 1 72 HIS QB . . 4.750 4.603 3.934 4.851 0.101 17 0 "[ . 1 . 2]" 1
117 1 4 GLN QG 1 72 HIS HD2 . . 5.500 4.869 3.789 5.588 0.088 13 0 "[ . 1 . 2]" 1
118 1 4 GLN QG 1 109 ASN HB3 . . 4.850 4.418 2.899 4.976 0.126 13 0 "[ . 1 . 2]" 1
119 1 4 GLN QG 1 110 VAL H . . 4.810 3.514 3.188 4.431 . 0 0 "[ . 1 . 2]" 1
120 1 4 GLN QG 1 110 VAL MG2 . . 5.500 4.615 4.325 5.564 0.064 14 0 "[ . 1 . 2]" 1
121 1 4 GLN QG 1 111 LEU HA . . 4.450 3.259 2.968 3.495 . 0 0 "[ . 1 . 2]" 1
122 1 4 GLN QG 1 111 LEU HB2 . . 4.640 4.734 4.702 4.747 0.107 2 0 "[ . 1 . 2]" 1
123 1 4 GLN QG 1 111 LEU MD1 . . 3.690 2.346 2.077 3.105 . 0 0 "[ . 1 . 2]" 1
124 1 4 GLN QG 1 111 LEU MD2 . . 3.450 2.032 1.867 2.140 . 0 0 "[ . 1 . 2]" 1
125 1 4 GLN QG 1 111 LEU HG . . 5.120 4.317 3.917 4.521 . 0 0 "[ . 1 . 2]" 1
126 1 5 LEU H 1 5 LEU HB2 . . 3.340 2.779 2.668 2.982 . 0 0 "[ . 1 . 2]" 1
127 1 5 LEU H 1 5 LEU QD . . 4.320 3.734 3.489 3.879 . 0 0 "[ . 1 . 2]" 1
128 1 5 LEU H 1 5 LEU HG . . 4.140 3.422 3.030 3.683 . 0 0 "[ . 1 . 2]" 1
129 1 5 LEU H 1 6 SER H . . 4.800 4.322 3.936 4.467 . 0 0 "[ . 1 . 2]" 1
130 1 5 LEU H 1 109 ASN HA . . 5.320 4.624 4.310 4.920 . 0 0 "[ . 1 . 2]" 1
131 1 5 LEU H 1 110 VAL H . . 3.810 2.991 2.757 3.179 . 0 0 "[ . 1 . 2]" 1
132 1 5 LEU H 1 110 VAL MG2 . . 4.190 3.295 2.967 3.692 . 0 0 "[ . 1 . 2]" 1
133 1 5 LEU H 1 111 LEU HA . . 4.020 2.952 2.839 3.124 . 0 0 "[ . 1 . 2]" 1
134 1 5 LEU H 1 111 LEU MD2 . . 4.070 3.973 3.540 4.160 0.090 5 0 "[ . 1 . 2]" 1
135 1 5 LEU H 1 112 LEU HB2 . . 5.500 4.969 4.299 5.447 . 0 0 "[ . 1 . 2]" 1
136 1 5 LEU HA 1 5 LEU QD . . 3.110 2.150 2.060 2.286 . 0 0 "[ . 1 . 2]" 1
137 1 5 LEU HA 1 5 LEU HG . . 4.230 3.100 2.851 3.297 . 0 0 "[ . 1 . 2]" 1
138 1 5 LEU HA 1 6 SER H . . 2.660 2.304 2.043 2.453 . 0 0 "[ . 1 . 2]" 1
139 1 5 LEU HA 1 6 SER QB . . 5.170 4.531 4.000 4.802 . 0 0 "[ . 1 . 2]" 1
140 1 5 LEU HA 1 111 LEU HA . . 5.500 5.584 5.549 5.601 0.101 17 0 "[ . 1 . 2]" 1
141 1 5 LEU HB2 1 5 LEU QD . . 3.000 2.280 2.242 2.336 . 0 0 "[ . 1 . 2]" 1
142 1 5 LEU HB2 1 5 LEU HG . . 2.750 2.516 2.453 2.575 . 0 0 "[ . 1 . 2]" 1
143 1 5 LEU HB2 1 6 SER H . . 4.310 3.982 3.654 4.358 0.048 20 0 "[ . 1 . 2]" 1
144 1 5 LEU HB2 1 110 VAL H . . 4.450 4.088 3.416 4.508 0.058 15 0 "[ . 1 . 2]" 1
145 1 5 LEU HB2 1 110 VAL MG2 . . 3.140 2.558 2.143 2.921 . 0 0 "[ . 1 . 2]" 1
146 1 5 LEU HB3 1 6 SER H . . 3.600 2.871 2.488 3.671 0.071 14 0 "[ . 1 . 2]" 1
147 1 5 LEU HB3 1 6 SER HA . . 4.990 4.494 4.218 4.846 . 0 0 "[ . 1 . 2]" 1
148 1 5 LEU HB3 1 110 VAL H . . 5.230 4.996 4.564 5.277 0.047 10 0 "[ . 1 . 2]" 1
149 1 5 LEU HB3 1 110 VAL MG2 . . 3.730 3.663 3.390 3.813 0.083 13 0 "[ . 1 . 2]" 1
150 1 5 LEU QD 1 6 SER H . . 4.180 3.396 3.018 3.839 . 0 0 "[ . 1 . 2]" 1
151 1 5 LEU QD 1 36 LYS H . . 5.500 5.239 4.716 5.606 0.106 11 0 "[ . 1 . 2]" 1
152 1 5 LEU QD 1 112 LEU HB2 . . 3.810 2.391 2.179 2.828 . 0 0 "[ . 1 . 2]" 1
153 1 5 LEU HG 1 111 LEU HA . . 5.000 4.450 3.921 5.019 0.019 1 0 "[ . 1 . 2]" 1
154 1 5 LEU HG 1 112 LEU HB2 . . 3.570 3.128 2.501 3.624 0.054 1 0 "[ . 1 . 2]" 1
155 1 5 LEU HG 1 112 LEU HB3 . . 4.750 3.904 2.622 4.689 . 0 0 "[ . 1 . 2]" 1
156 1 6 SER H 1 6 SER QB . . 3.370 2.856 2.433 3.108 . 0 0 "[ . 1 . 2]" 1
157 1 6 SER H 1 7 LEU H . . 5.000 4.405 4.147 4.619 . 0 0 "[ . 1 . 2]" 1
158 1 6 SER H 1 7 LEU MD2 . . 5.100 4.503 3.879 5.152 0.052 13 0 "[ . 1 . 2]" 1
159 1 6 SER H 1 109 ASN HA . . 4.910 4.641 4.195 4.963 0.053 15 0 "[ . 1 . 2]" 1
160 1 6 SER H 1 110 VAL MG2 . . 5.500 4.738 4.272 5.137 . 0 0 "[ . 1 . 2]" 1
161 1 6 SER HA 1 7 LEU H . . 2.860 2.310 2.207 2.466 . 0 0 "[ . 1 . 2]" 1
162 1 6 SER HA 1 7 LEU HB2 . . 4.690 4.411 4.245 4.732 0.042 13 0 "[ . 1 . 2]" 1
163 1 6 SER HA 1 7 LEU MD2 . . 5.470 4.828 4.400 5.360 . 0 0 "[ . 1 . 2]" 1
164 1 6 SER HA 1 7 LEU HG . . 4.470 3.758 3.361 4.211 . 0 0 "[ . 1 . 2]" 1
165 1 6 SER HA 1 108 ARG H . . 4.630 4.570 4.282 4.701 0.071 12 0 "[ . 1 . 2]" 1
166 1 6 SER HA 1 109 ASN H . . 5.500 4.572 4.339 4.857 . 0 0 "[ . 1 . 2]" 1
167 1 6 SER HA 1 109 ASN HA . . 3.150 2.084 1.886 2.387 . 0 0 "[ . 1 . 2]" 1
168 1 6 SER HA 1 109 ASN HB2 . . 4.600 4.232 3.149 4.681 0.081 2 0 "[ . 1 . 2]" 1
169 1 6 SER HA 1 109 ASN HB3 . . 4.950 3.890 3.239 4.678 . 0 0 "[ . 1 . 2]" 1
170 1 6 SER HA 1 110 VAL H . . 3.870 3.367 3.126 3.693 . 0 0 "[ . 1 . 2]" 1
171 1 6 SER HA 1 110 VAL MG2 . . 4.700 3.706 3.040 4.184 . 0 0 "[ . 1 . 2]" 1
172 1 6 SER QB 1 7 LEU H . . 4.180 2.898 2.443 3.551 . 0 0 "[ . 1 . 2]" 1
173 1 6 SER QB 1 107 TYR QB . . 4.570 3.638 3.186 4.159 . 0 0 "[ . 1 . 2]" 1
174 1 6 SER QB 1 107 TYR QD . . 3.710 3.073 2.612 3.467 . 0 0 "[ . 1 . 2]" 1
175 1 6 SER QB 1 107 TYR QE . . 4.740 4.312 3.527 4.635 . 0 0 "[ . 1 . 2]" 1
176 1 6 SER QB 1 109 ASN HA . . 4.510 3.215 2.855 3.539 . 0 0 "[ . 1 . 2]" 1
177 1 6 SER QB 1 110 VAL H . . 5.390 4.741 4.182 5.089 . 0 0 "[ . 1 . 2]" 1
178 1 7 LEU H 1 7 LEU HB2 . . 3.480 2.675 2.487 2.913 . 0 0 "[ . 1 . 2]" 1
179 1 7 LEU H 1 7 LEU HB3 . . 4.020 3.796 3.686 3.914 . 0 0 "[ . 1 . 2]" 1
180 1 7 LEU H 1 7 LEU MD1 . . 4.340 4.094 3.743 4.402 0.062 13 0 "[ . 1 . 2]" 1
181 1 7 LEU H 1 7 LEU MD2 . . 4.730 4.105 3.854 4.330 . 0 0 "[ . 1 . 2]" 1
182 1 7 LEU H 1 7 LEU HG . . 3.700 3.258 2.965 3.579 . 0 0 "[ . 1 . 2]" 1
183 1 7 LEU H 1 8 PRO HD2 . . 5.500 4.849 4.717 5.140 . 0 0 "[ . 1 . 2]" 1
184 1 7 LEU H 1 8 PRO HD3 . . 5.500 4.867 4.491 5.043 . 0 0 "[ . 1 . 2]" 1
185 1 7 LEU H 1 107 TYR HA . . 4.650 4.448 4.199 4.680 0.030 6 0 "[ . 1 . 2]" 1
186 1 7 LEU H 1 107 TYR QB . . 5.140 3.910 3.519 4.592 . 0 0 "[ . 1 . 2]" 1
187 1 7 LEU H 1 107 TYR QD . . 5.310 3.528 3.169 4.229 . 0 0 "[ . 1 . 2]" 1
188 1 7 LEU H 1 108 ARG H . . 3.810 2.770 2.509 3.025 . 0 0 "[ . 1 . 2]" 1
189 1 7 LEU H 1 108 ARG HB2 . . 4.940 4.505 3.874 4.987 0.047 9 0 "[ . 1 . 2]" 1
190 1 7 LEU H 1 108 ARG HB3 . . 5.040 4.133 3.276 4.920 . 0 0 "[ . 1 . 2]" 1
191 1 7 LEU H 1 109 ASN H . . 4.900 4.848 4.552 4.982 0.082 12 0 "[ . 1 . 2]" 1
192 1 7 LEU H 1 109 ASN HA . . 3.960 3.567 3.085 3.918 . 0 0 "[ . 1 . 2]" 1
193 1 7 LEU H 1 109 ASN HB3 . . 5.500 5.289 4.477 6.305 0.805 20 1 "[ . 1 . +]" 1
194 1 7 LEU H 1 110 VAL MG2 . . 5.070 4.537 3.729 5.103 0.033 12 0 "[ . 1 . 2]" 1
195 1 7 LEU HA 1 7 LEU MD1 . . 4.520 3.913 3.838 3.970 . 0 0 "[ . 1 . 2]" 1
196 1 7 LEU HA 1 7 LEU MD2 . . 3.170 2.184 2.064 2.312 . 0 0 "[ . 1 . 2]" 1
197 1 7 LEU HA 1 8 PRO HD2 . . 3.200 2.331 2.127 2.693 . 0 0 "[ . 1 . 2]" 1
198 1 7 LEU HA 1 8 PRO HD3 . . 3.210 2.481 2.049 2.722 . 0 0 "[ . 1 . 2]" 1
199 1 7 LEU HA 1 8 PRO HG2 . . 4.850 4.523 4.361 4.720 . 0 0 "[ . 1 . 2]" 1
200 1 7 LEU HA 1 8 PRO HG3 . . 4.630 4.590 4.270 4.684 0.054 8 0 "[ . 1 . 2]" 1
201 1 7 LEU HA 1 41 GLY QA . . 4.970 3.810 3.274 4.376 . 0 0 "[ . 1 . 2]" 1
202 1 7 LEU HA 1 107 TYR HA . . 5.500 5.515 5.334 5.575 0.075 15 0 "[ . 1 . 2]" 1
203 1 7 LEU HA 1 107 TYR QD . . 4.300 4.078 3.581 4.379 0.079 15 0 "[ . 1 . 2]" 1
204 1 7 LEU HB2 1 8 PRO HD2 . . 4.490 3.989 3.717 4.540 0.050 4 0 "[ . 1 . 2]" 1
205 1 7 LEU HB2 1 41 GLY QA . . 4.280 4.061 3.639 4.234 . 0 0 "[ . 1 . 2]" 1
206 1 7 LEU HB2 1 42 LEU HB2 . . 4.670 2.922 2.456 3.486 . 0 0 "[ . 1 . 2]" 1
207 1 7 LEU HB2 1 42 LEU HB3 . . 4.990 3.823 3.302 4.732 . 0 0 "[ . 1 . 2]" 1
208 1 7 LEU HB2 1 108 ARG H . . 5.000 3.621 3.031 4.069 . 0 0 "[ . 1 . 2]" 1
209 1 7 LEU HB3 1 7 LEU MD2 . . 3.550 2.380 2.253 2.486 . 0 0 "[ . 1 . 2]" 1
210 1 7 LEU HB3 1 8 PRO HD2 . . 4.160 2.550 2.151 3.172 . 0 0 "[ . 1 . 2]" 1
211 1 7 LEU HB3 1 8 PRO HD3 . . 4.430 3.918 3.486 4.488 0.058 19 0 "[ . 1 . 2]" 1
212 1 7 LEU HB3 1 42 LEU H . . 4.680 3.407 2.860 4.422 . 0 0 "[ . 1 . 2]" 1
213 1 7 LEU HB3 1 42 LEU HB2 . . 4.350 3.059 2.373 3.565 . 0 0 "[ . 1 . 2]" 1
214 1 7 LEU HB3 1 42 LEU HB3 . . 4.620 3.920 3.275 4.677 0.057 8 0 "[ . 1 . 2]" 1
215 1 7 LEU HB3 1 108 ARG H . . 5.500 4.723 4.265 5.169 . 0 0 "[ . 1 . 2]" 1
216 1 7 LEU MD1 1 8 PRO HD2 . . 5.500 4.357 3.829 5.090 . 0 0 "[ . 1 . 2]" 1
217 1 7 LEU MD1 1 40 CYS QB . . 5.500 4.148 3.325 5.047 . 0 0 "[ . 1 . 2]" 1
218 1 7 LEU MD1 1 41 GLY H . . 5.500 4.630 4.053 5.558 0.058 19 0 "[ . 1 . 2]" 1
219 1 7 LEU MD1 1 42 LEU HB2 . . 4.070 2.656 2.081 4.148 0.078 17 0 "[ . 1 . 2]" 1
220 1 7 LEU MD2 1 8 PRO HD2 . . 4.210 2.876 2.418 3.388 . 0 0 "[ . 1 . 2]" 1
221 1 7 LEU MD2 1 8 PRO HD3 . . 4.580 3.672 3.100 4.296 . 0 0 "[ . 1 . 2]" 1
222 1 7 LEU MD2 1 40 CYS H . . 5.120 3.691 3.344 4.153 . 0 0 "[ . 1 . 2]" 1
223 1 7 LEU MD2 1 40 CYS HA . . 5.050 4.305 3.925 4.713 . 0 0 "[ . 1 . 2]" 1
224 1 7 LEU MD2 1 40 CYS QB . . 3.840 2.726 2.256 3.644 . 0 0 "[ . 1 . 2]" 1
225 1 7 LEU MD2 1 41 GLY QA . . 4.640 2.945 2.448 3.454 . 0 0 "[ . 1 . 2]" 1
226 1 7 LEU HG 1 8 PRO HD2 . . 5.500 4.696 4.239 5.290 . 0 0 "[ . 1 . 2]" 1
227 1 7 LEU HG 1 109 ASN HA . . 5.290 5.114 4.716 5.363 0.073 6 0 "[ . 1 . 2]" 1
228 1 8 PRO HA 1 9 VAL H . . 2.950 2.309 2.168 2.482 . 0 0 "[ . 1 . 2]" 1
229 1 8 PRO HA 1 9 VAL HA . . 5.390 4.524 4.442 4.616 . 0 0 "[ . 1 . 2]" 1
230 1 8 PRO HA 1 9 VAL HB . . 5.100 4.800 4.579 5.004 . 0 0 "[ . 1 . 2]" 1
231 1 8 PRO HA 1 9 VAL MG2 . . 4.410 3.587 3.410 3.817 . 0 0 "[ . 1 . 2]" 1
232 1 8 PRO HA 1 10 LEU MD2 . . 5.430 5.019 4.540 5.535 0.105 12 0 "[ . 1 . 2]" 1
233 1 8 PRO HA 1 104 PRO HB2 . . 4.250 3.902 3.572 4.330 0.080 14 0 "[ . 1 . 2]" 1
234 1 8 PRO HA 1 104 PRO HB3 . . 4.950 3.637 2.981 4.200 . 0 0 "[ . 1 . 2]" 1
235 1 8 PRO HA 1 104 PRO HG2 . . 5.500 5.067 4.544 5.461 . 0 0 "[ . 1 . 2]" 1
236 1 8 PRO HA 1 104 PRO HG3 . . 5.150 4.299 3.622 5.040 . 0 0 "[ . 1 . 2]" 1
237 1 8 PRO HA 1 106 ALA H . . 4.870 4.773 4.581 4.931 0.061 16 0 "[ . 1 . 2]" 1
238 1 8 PRO HA 1 107 TYR H . . 5.500 4.962 4.687 5.238 . 0 0 "[ . 1 . 2]" 1
239 1 8 PRO HA 1 107 TYR HA . . 3.400 2.390 2.174 2.630 . 0 0 "[ . 1 . 2]" 1
240 1 8 PRO HA 1 107 TYR QB . . 5.120 3.793 3.640 4.189 . 0 0 "[ . 1 . 2]" 1
241 1 8 PRO HA 1 107 TYR QD . . 3.120 3.063 2.717 3.164 0.044 6 0 "[ . 1 . 2]" 1
242 1 8 PRO HA 1 107 TYR QE . . 3.440 3.398 3.173 3.512 0.072 2 0 "[ . 1 . 2]" 1
243 1 8 PRO HA 1 108 ARG H . . 4.440 3.847 3.636 3.966 . 0 0 "[ . 1 . 2]" 1
244 1 8 PRO HB2 1 9 VAL H . . 4.380 3.146 2.549 3.579 . 0 0 "[ . 1 . 2]" 1
245 1 8 PRO HB2 1 10 LEU MD1 . . 5.480 3.741 3.091 4.210 . 0 0 "[ . 1 . 2]" 1
246 1 8 PRO HB2 1 10 LEU MD2 . . 3.550 2.798 2.356 3.356 . 0 0 "[ . 1 . 2]" 1
247 1 8 PRO HB2 1 10 LEU HG . . 5.310 3.010 2.473 3.400 . 0 0 "[ . 1 . 2]" 1
248 1 8 PRO HB2 1 41 GLY QA . . 4.810 4.015 3.764 4.203 . 0 0 "[ . 1 . 2]" 1
249 1 8 PRO HB2 1 104 PRO HA . . 4.450 4.041 3.403 4.336 . 0 0 "[ . 1 . 2]" 1
250 1 8 PRO HB2 1 104 PRO HB2 . . 3.790 3.431 2.990 3.850 0.060 19 0 "[ . 1 . 2]" 1
251 1 8 PRO HB2 1 104 PRO HB3 . . 4.430 2.095 2.007 2.266 . 0 0 "[ . 1 . 2]" 1
252 1 8 PRO HB2 1 104 PRO HG2 . . 4.320 4.181 3.522 4.398 0.078 8 0 "[ . 1 . 2]" 1
253 1 8 PRO HB2 1 104 PRO HG3 . . 4.010 2.816 2.303 3.413 . 0 0 "[ . 1 . 2]" 1
254 1 8 PRO HB2 1 107 TYR QE . . 3.970 4.059 4.036 4.075 0.105 14 0 "[ . 1 . 2]" 1
255 1 8 PRO HB3 1 9 VAL H . . 4.520 3.877 3.513 4.160 . 0 0 "[ . 1 . 2]" 1
256 1 8 PRO HB3 1 10 LEU MD2 . . 4.640 4.053 3.623 4.681 0.041 14 0 "[ . 1 . 2]" 1
257 1 8 PRO HB3 1 104 PRO HB3 . . 4.700 3.160 2.664 3.637 . 0 0 "[ . 1 . 2]" 1
258 1 8 PRO HB3 1 104 PRO HG2 . . 4.170 4.073 3.165 4.247 0.077 10 0 "[ . 1 . 2]" 1
259 1 8 PRO HB3 1 104 PRO HG3 . . 4.210 2.746 2.314 3.528 . 0 0 "[ . 1 . 2]" 1
260 1 8 PRO HB3 1 107 TYR HA . . 5.350 4.657 4.426 4.901 . 0 0 "[ . 1 . 2]" 1
261 1 8 PRO HB3 1 107 TYR QD . . 3.940 3.932 3.712 4.023 0.083 17 0 "[ . 1 . 2]" 1
262 1 8 PRO HB3 1 107 TYR QE . . 3.560 2.836 2.419 3.053 . 0 0 "[ . 1 . 2]" 1
263 1 8 PRO HD2 1 41 GLY QA . . 4.090 2.084 1.959 2.233 . 0 0 "[ . 1 . 2]" 1
264 1 8 PRO HD2 1 42 LEU H . . 5.440 4.131 3.771 4.840 . 0 0 "[ . 1 . 2]" 1
265 1 8 PRO HD3 1 41 GLY QA . . 4.810 3.670 3.451 3.815 . 0 0 "[ . 1 . 2]" 1
266 1 8 PRO HD3 1 107 TYR QD . . 5.500 4.096 3.533 4.508 . 0 0 "[ . 1 . 2]" 1
267 1 8 PRO HD3 1 107 TYR QE . . 3.450 3.076 2.643 3.525 0.075 20 0 "[ . 1 . 2]" 1
268 1 8 PRO HG2 1 10 LEU MD1 . . 5.500 2.907 2.260 4.083 . 0 0 "[ . 1 . 2]" 1
269 1 8 PRO HG2 1 10 LEU MD2 . . 5.320 3.507 3.055 4.094 . 0 0 "[ . 1 . 2]" 1
270 1 8 PRO HG2 1 10 LEU HG . . 5.500 3.212 2.843 4.541 . 0 0 "[ . 1 . 2]" 1
271 1 8 PRO HG2 1 41 GLY H . . 5.500 4.635 4.418 5.574 0.074 4 0 "[ . 1 . 2]" 1
272 1 8 PRO HG2 1 41 GLY QA . . 3.940 2.254 1.999 3.548 . 0 0 "[ . 1 . 2]" 1
273 1 8 PRO HG2 1 42 LEU H . . 5.430 3.754 3.364 5.497 0.067 4 0 "[ . 1 . 2]" 1
274 1 8 PRO HG2 1 99 HIS HB2 . . 5.370 2.989 2.739 3.452 . 0 0 "[ . 1 . 2]" 1
275 1 8 PRO HG2 1 99 HIS HD2 . . 5.500 4.299 4.001 4.892 . 0 0 "[ . 1 . 2]" 1
276 1 8 PRO HG2 1 104 PRO HB3 . . 4.430 4.319 4.071 4.496 0.066 9 0 "[ . 1 . 2]" 1
277 1 8 PRO HG3 1 10 LEU MD1 . . 5.500 3.822 3.053 5.581 0.081 4 0 "[ . 1 . 2]" 1
278 1 8 PRO HG3 1 10 LEU MD2 . . 5.330 3.901 3.429 4.742 . 0 0 "[ . 1 . 2]" 1
279 1 8 PRO HG3 1 107 TYR QE . . 5.220 4.139 2.326 4.642 . 0 0 "[ . 1 . 2]" 1
280 1 9 VAL H 1 9 VAL HB . . 3.340 2.648 2.421 2.841 . 0 0 "[ . 1 . 2]" 1
281 1 9 VAL H 1 9 VAL MG1 . . 4.300 3.861 3.754 3.934 . 0 0 "[ . 1 . 2]" 1
282 1 9 VAL H 1 9 VAL MG2 . . 3.350 2.525 2.302 2.781 . 0 0 "[ . 1 . 2]" 1
283 1 9 VAL H 1 10 LEU MD2 . . 5.190 4.481 3.756 5.059 . 0 0 "[ . 1 . 2]" 1
284 1 9 VAL H 1 104 PRO HA . . 4.890 4.312 3.994 4.884 . 0 0 "[ . 1 . 2]" 1
285 1 9 VAL H 1 104 PRO HB2 . . 4.110 3.183 2.612 4.163 0.053 9 0 "[ . 1 . 2]" 1
286 1 9 VAL H 1 104 PRO HB3 . . 4.420 3.047 2.588 3.423 . 0 0 "[ . 1 . 2]" 1
287 1 9 VAL H 1 105 ILE H . . 5.030 3.951 3.610 4.344 . 0 0 "[ . 1 . 2]" 1
288 1 9 VAL H 1 105 ILE HG12 . . 5.500 4.639 4.473 4.786 . 0 0 "[ . 1 . 2]" 1
289 1 9 VAL H 1 106 ALA H . . 3.750 3.046 2.872 3.199 . 0 0 "[ . 1 . 2]" 1
290 1 9 VAL H 1 106 ALA MB . . 4.930 3.949 3.671 4.184 . 0 0 "[ . 1 . 2]" 1
291 1 9 VAL H 1 107 TYR HA . . 3.330 2.807 2.361 3.226 . 0 0 "[ . 1 . 2]" 1
292 1 9 VAL H 1 107 TYR QB . . 5.500 4.766 4.423 5.136 . 0 0 "[ . 1 . 2]" 1
293 1 9 VAL H 1 107 TYR QD . . 5.130 4.060 3.852 4.421 . 0 0 "[ . 1 . 2]" 1
294 1 9 VAL H 1 107 TYR QE . . 5.500 4.706 4.502 4.952 . 0 0 "[ . 1 . 2]" 1
295 1 9 VAL H 1 108 ARG H . . 4.940 4.476 3.913 4.979 0.039 8 0 "[ . 1 . 2]" 1
296 1 9 VAL HA 1 9 VAL MG1 . . 3.590 2.355 2.256 2.567 . 0 0 "[ . 1 . 2]" 1
297 1 9 VAL HA 1 9 VAL MG2 . . 3.210 2.508 2.402 2.580 . 0 0 "[ . 1 . 2]" 1
298 1 9 VAL HA 1 10 LEU H . . 2.860 2.191 2.086 2.438 . 0 0 "[ . 1 . 2]" 1
299 1 9 VAL HA 1 10 LEU MD2 . . 5.500 4.846 4.297 5.255 . 0 0 "[ . 1 . 2]" 1
300 1 9 VAL HA 1 10 LEU HG . . 4.520 3.734 3.342 4.001 . 0 0 "[ . 1 . 2]" 1
301 1 9 VAL HA 1 42 LEU HA . . 5.440 4.759 4.218 5.448 0.008 11 0 "[ . 1 . 2]" 1
302 1 9 VAL HA 1 42 LEU HB2 . . 5.030 4.194 3.642 4.693 . 0 0 "[ . 1 . 2]" 1
303 1 9 VAL HA 1 42 LEU HB3 . . 3.700 2.624 2.259 3.154 . 0 0 "[ . 1 . 2]" 1
304 1 9 VAL HA 1 43 VAL HA . . 5.160 4.436 3.732 4.874 . 0 0 "[ . 1 . 2]" 1
305 1 9 VAL HA 1 105 ILE HG12 . . 5.420 5.216 4.839 5.474 0.054 8 0 "[ . 1 . 2]" 1
306 1 9 VAL HB 1 10 LEU H . . 5.120 4.188 3.970 4.371 . 0 0 "[ . 1 . 2]" 1
307 1 9 VAL HB 1 105 ILE H . . 4.480 3.634 3.378 3.944 . 0 0 "[ . 1 . 2]" 1
308 1 9 VAL HB 1 105 ILE MD . . 4.240 3.379 2.919 3.965 . 0 0 "[ . 1 . 2]" 1
309 1 9 VAL HB 1 105 ILE HG12 . . 4.360 2.791 2.485 2.940 . 0 0 "[ . 1 . 2]" 1
310 1 9 VAL HB 1 105 ILE HG13 . . 4.220 4.217 3.738 4.296 0.076 20 0 "[ . 1 . 2]" 1
311 1 9 VAL HB 1 106 ALA H . . 3.420 2.696 2.322 2.960 . 0 0 "[ . 1 . 2]" 1
312 1 9 VAL HB 1 106 ALA HA . . 4.770 4.463 4.059 4.656 . 0 0 "[ . 1 . 2]" 1
313 1 9 VAL HB 1 106 ALA MB . . 3.270 2.333 2.104 2.708 . 0 0 "[ . 1 . 2]" 1
314 1 9 VAL HB 1 107 TYR H . . 4.870 4.536 4.147 4.747 . 0 0 "[ . 1 . 2]" 1
315 1 9 VAL HB 1 107 TYR HA . . 5.190 4.165 3.825 4.390 . 0 0 "[ . 1 . 2]" 1
316 1 9 VAL MG1 1 10 LEU H . . 3.520 2.856 2.552 3.256 . 0 0 "[ . 1 . 2]" 1
317 1 9 VAL MG1 1 42 LEU HB3 . . 4.780 3.209 2.431 4.070 . 0 0 "[ . 1 . 2]" 1
318 1 9 VAL MG1 1 43 VAL HA . . 4.710 3.382 2.427 4.547 . 0 0 "[ . 1 . 2]" 1
319 1 9 VAL MG1 1 44 GLU H . . 3.890 3.419 3.018 3.954 0.064 11 0 "[ . 1 . 2]" 1
320 1 9 VAL MG1 1 44 GLU HA . . 5.500 4.568 4.034 5.039 . 0 0 "[ . 1 . 2]" 1
321 1 9 VAL MG1 1 44 GLU HG2 . . 4.620 3.453 2.883 4.199 . 0 0 "[ . 1 . 2]" 1
322 1 9 VAL MG1 1 44 GLU HG3 . . 3.660 2.506 2.050 3.043 . 0 0 "[ . 1 . 2]" 1
323 1 9 VAL MG1 1 105 ILE HG13 . . 4.300 3.660 2.991 4.127 . 0 0 "[ . 1 . 2]" 1
324 1 9 VAL MG1 1 106 ALA H . . 4.700 4.128 3.664 4.451 . 0 0 "[ . 1 . 2]" 1
325 1 9 VAL MG1 1 106 ALA MB . . 3.870 3.077 2.476 3.365 . 0 0 "[ . 1 . 2]" 1
326 1 9 VAL MG1 1 107 TYR H . . 5.500 5.442 4.956 5.575 0.075 9 0 "[ . 1 . 2]" 1
327 1 9 VAL MG1 1 107 TYR HA . . 5.500 5.046 4.874 5.195 . 0 0 "[ . 1 . 2]" 1
328 1 9 VAL MG1 1 108 ARG H . . 5.500 5.467 5.211 5.581 0.081 10 0 "[ . 1 . 2]" 1
329 1 9 VAL MG2 1 44 GLU HG3 . . 4.640 4.162 3.781 4.642 0.002 6 0 "[ . 1 . 2]" 1
330 1 9 VAL MG2 1 106 ALA H . . 4.430 3.848 3.695 4.097 . 0 0 "[ . 1 . 2]" 1
331 1 9 VAL MG2 1 106 ALA HA . . 5.210 4.452 4.251 4.651 . 0 0 "[ . 1 . 2]" 1
332 1 9 VAL MG2 1 106 ALA MB . . 3.390 2.508 2.232 2.766 . 0 0 "[ . 1 . 2]" 1
333 1 9 VAL MG2 1 107 TYR H . . 4.850 3.369 3.226 3.487 . 0 0 "[ . 1 . 2]" 1
334 1 9 VAL MG2 1 107 TYR HA . . 3.840 2.325 2.177 2.458 . 0 0 "[ . 1 . 2]" 1
335 1 9 VAL MG2 1 107 TYR QB . . 5.500 4.061 3.932 4.200 . 0 0 "[ . 1 . 2]" 1
336 1 9 VAL MG2 1 107 TYR QD . . 4.460 4.481 4.397 4.555 0.095 19 0 "[ . 1 . 2]" 1
337 1 9 VAL MG2 1 108 ARG H . . 4.020 2.866 2.545 3.096 . 0 0 "[ . 1 . 2]" 1
338 1 9 VAL MG2 1 108 ARG HD2 . . 5.480 4.222 3.639 4.856 . 0 0 "[ . 1 . 2]" 1
339 1 9 VAL MG2 1 108 ARG HD3 . . 4.990 3.670 2.661 4.665 . 0 0 "[ . 1 . 2]" 1
340 1 10 LEU H 1 10 LEU HB2 . . 3.740 2.555 2.425 2.758 . 0 0 "[ . 1 . 2]" 1
341 1 10 LEU H 1 10 LEU MD1 . . 4.240 3.728 3.486 3.971 . 0 0 "[ . 1 . 2]" 1
342 1 10 LEU H 1 10 LEU MD2 . . 4.290 3.978 3.637 4.267 . 0 0 "[ . 1 . 2]" 1
343 1 10 LEU H 1 10 LEU HG . . 3.920 2.887 2.497 3.226 . 0 0 "[ . 1 . 2]" 1
344 1 10 LEU H 1 11 GLN H . . 5.450 4.447 4.206 4.548 . 0 0 "[ . 1 . 2]" 1
345 1 10 LEU H 1 42 LEU HA . . 5.500 5.157 4.747 5.585 0.085 11 0 "[ . 1 . 2]" 1
346 1 10 LEU H 1 42 LEU HB3 . . 5.430 4.193 3.841 4.799 . 0 0 "[ . 1 . 2]" 1
347 1 10 LEU H 1 43 VAL QG . . 4.410 3.548 3.103 4.348 . 0 0 "[ . 1 . 2]" 1
348 1 10 LEU HA 1 10 LEU MD2 . . 3.440 2.347 2.221 2.619 . 0 0 "[ . 1 . 2]" 1
349 1 10 LEU HA 1 11 GLN H . . 2.990 2.366 2.218 2.580 . 0 0 "[ . 1 . 2]" 1
350 1 10 LEU HA 1 11 GLN QB . . 5.030 4.515 4.095 4.691 . 0 0 "[ . 1 . 2]" 1
351 1 10 LEU HA 1 11 GLN QG . . 5.500 4.238 3.788 4.674 . 0 0 "[ . 1 . 2]" 1
352 1 10 LEU HA 1 104 PRO HA . . 4.080 2.497 2.210 2.816 . 0 0 "[ . 1 . 2]" 1
353 1 10 LEU HA 1 105 ILE H . . 4.190 3.339 3.087 3.557 . 0 0 "[ . 1 . 2]" 1
354 1 10 LEU HA 1 105 ILE MG . . 4.990 4.166 3.837 4.413 . 0 0 "[ . 1 . 2]" 1
355 1 10 LEU HA 1 106 ALA H . . 5.500 4.984 4.697 5.171 . 0 0 "[ . 1 . 2]" 1
356 1 10 LEU HB2 1 11 GLN H . . 4.410 3.902 3.348 4.362 . 0 0 "[ . 1 . 2]" 1
357 1 10 LEU HB2 1 15 VAL MG2 . . 3.470 2.242 1.963 2.610 . 0 0 "[ . 1 . 2]" 1
358 1 10 LEU HB3 1 10 LEU MD1 . . 3.570 2.577 2.479 2.725 . 0 0 "[ . 1 . 2]" 1
359 1 10 LEU HB3 1 11 GLN H . . 3.690 2.966 2.307 3.600 . 0 0 "[ . 1 . 2]" 1
360 1 10 LEU HB3 1 15 VAL MG2 . . 3.490 2.235 2.010 2.601 . 0 0 "[ . 1 . 2]" 1
361 1 10 LEU HB3 1 102 GLU HB3 . . 5.500 4.258 2.741 5.551 0.051 9 0 "[ . 1 . 2]" 1
362 1 10 LEU MD1 1 40 CYS HA . . 5.500 4.961 4.646 5.350 . 0 0 "[ . 1 . 2]" 1
363 1 10 LEU MD1 1 41 GLY H . . 4.900 3.780 3.442 4.268 . 0 0 "[ . 1 . 2]" 1
364 1 10 LEU MD1 1 41 GLY QA . . 3.850 2.303 2.037 2.857 . 0 0 "[ . 1 . 2]" 1
365 1 10 LEU MD1 1 42 LEU H . . 4.360 3.660 3.139 4.420 0.060 10 0 "[ . 1 . 2]" 1
366 1 10 LEU MD1 1 97 VAL QG . . 3.940 2.417 2.071 2.728 . 0 0 "[ . 1 . 2]" 1
367 1 10 LEU MD1 1 98 PRO HA . . 5.430 5.319 4.984 5.517 0.087 13 0 "[ . 1 . 2]" 1
368 1 10 LEU MD1 1 99 HIS H . . 5.500 4.378 4.028 4.686 . 0 0 "[ . 1 . 2]" 1
369 1 10 LEU MD1 1 99 HIS HB2 . . 4.870 2.612 2.186 3.188 . 0 0 "[ . 1 . 2]" 1
370 1 10 LEU MD1 1 99 HIS HB3 . . 4.790 3.996 3.676 4.407 . 0 0 "[ . 1 . 2]" 1
371 1 10 LEU MD1 1 99 HIS HD2 . . 3.410 2.390 2.105 3.121 . 0 0 "[ . 1 . 2]" 1
372 1 10 LEU MD1 1 100 VAL H . . 5.020 3.541 3.085 4.095 . 0 0 "[ . 1 . 2]" 1
373 1 10 LEU MD1 1 102 GLU HB2 . . 4.520 3.260 2.125 4.348 . 0 0 "[ . 1 . 2]" 1
374 1 10 LEU MD1 1 102 GLU QG . . 5.170 3.852 2.343 4.677 . 0 0 "[ . 1 . 2]" 1
375 1 10 LEU MD1 1 104 PRO HA . . 5.500 4.797 4.563 5.020 . 0 0 "[ . 1 . 2]" 1
376 1 10 LEU MD2 1 11 GLN H . . 4.450 3.845 3.501 4.234 . 0 0 "[ . 1 . 2]" 1
377 1 10 LEU MD2 1 41 GLY QA . . 4.710 4.088 3.595 4.512 . 0 0 "[ . 1 . 2]" 1
378 1 10 LEU MD2 1 42 LEU H . . 5.500 5.078 4.582 5.508 0.008 12 0 "[ . 1 . 2]" 1
379 1 10 LEU MD2 1 97 VAL QG . . 5.180 4.568 4.228 4.854 . 0 0 "[ . 1 . 2]" 1
380 1 10 LEU MD2 1 99 HIS HD2 . . 3.740 2.553 2.186 3.216 . 0 0 "[ . 1 . 2]" 1
381 1 10 LEU MD2 1 102 GLU HA . . 5.500 4.598 4.132 5.077 . 0 0 "[ . 1 . 2]" 1
382 1 10 LEU MD2 1 102 GLU HB2 . . 4.180 2.634 2.048 3.821 . 0 0 "[ . 1 . 2]" 1
383 1 10 LEU MD2 1 102 GLU HB3 . . 4.330 3.251 2.142 4.174 . 0 0 "[ . 1 . 2]" 1
384 1 10 LEU MD2 1 102 GLU QG . . 5.500 3.816 3.233 4.570 . 0 0 "[ . 1 . 2]" 1
385 1 10 LEU MD2 1 103 THR H . . 5.500 2.863 2.150 3.571 . 0 0 "[ . 1 . 2]" 1
386 1 10 LEU MD2 1 103 THR HA . . 5.500 3.916 3.545 4.076 . 0 0 "[ . 1 . 2]" 1
387 1 10 LEU MD2 1 104 PRO HA . . 3.420 2.112 2.012 2.280 . 0 0 "[ . 1 . 2]" 1
388 1 10 LEU MD2 1 104 PRO HB2 . . 4.240 3.847 3.576 4.226 . 0 0 "[ . 1 . 2]" 1
389 1 10 LEU MD2 1 104 PRO HB3 . . 4.760 2.529 2.151 3.192 . 0 0 "[ . 1 . 2]" 1
390 1 10 LEU MD2 1 104 PRO HD2 . . 5.500 3.986 3.769 4.437 . 0 0 "[ . 1 . 2]" 1
391 1 10 LEU MD2 1 104 PRO HG2 . . 5.130 4.300 3.980 4.609 . 0 0 "[ . 1 . 2]" 1
392 1 10 LEU MD2 1 104 PRO HG3 . . 4.500 3.375 2.634 4.059 . 0 0 "[ . 1 . 2]" 1
393 1 10 LEU MD2 1 105 ILE H . . 4.460 3.964 3.697 4.148 . 0 0 "[ . 1 . 2]" 1
394 1 10 LEU MD2 1 106 ALA H . . 5.500 5.150 4.703 5.371 . 0 0 "[ . 1 . 2]" 1
395 1 10 LEU HG 1 11 GLN H . . 5.500 5.091 4.876 5.310 . 0 0 "[ . 1 . 2]" 1
396 1 10 LEU HG 1 41 GLY QA . . 4.650 3.216 2.679 3.915 . 0 0 "[ . 1 . 2]" 1
397 1 10 LEU HG 1 42 LEU H . . 4.270 3.688 3.208 4.325 0.055 12 0 "[ . 1 . 2]" 1
398 1 11 GLN H 1 11 GLN QB . . 3.410 2.355 2.055 2.491 . 0 0 "[ . 1 . 2]" 1
399 1 11 GLN H 1 11 GLN QG . . 3.690 2.771 2.220 3.195 . 0 0 "[ . 1 . 2]" 1
400 1 11 GLN H 1 14 ASP H . . 4.900 4.055 3.544 4.418 . 0 0 "[ . 1 . 2]" 1
401 1 11 GLN H 1 14 ASP HB2 . . 4.540 2.864 2.254 3.369 . 0 0 "[ . 1 . 2]" 1
402 1 11 GLN H 1 14 ASP HB3 . . 5.140 4.197 3.672 4.781 . 0 0 "[ . 1 . 2]" 1
403 1 11 GLN H 1 15 VAL MG2 . . 4.990 3.597 3.028 3.954 . 0 0 "[ . 1 . 2]" 1
404 1 11 GLN H 1 104 PRO HA . . 4.450 4.284 3.949 4.516 0.066 19 0 "[ . 1 . 2]" 1
405 1 11 GLN H 1 105 ILE H . . 5.500 4.768 4.414 5.568 0.068 6 0 "[ . 1 . 2]" 1
406 1 11 GLN H 1 105 ILE MD . . 5.500 2.769 2.144 4.093 . 0 0 "[ . 1 . 2]" 1
407 1 11 GLN H 1 105 ILE MG . . 4.490 3.968 3.363 4.395 . 0 0 "[ . 1 . 2]" 1
408 1 11 GLN HA 1 11 GLN HE21 . . 5.500 4.015 3.123 5.211 . 0 0 "[ . 1 . 2]" 1
409 1 11 GLN HA 1 11 GLN HE22 . . 5.500 5.170 4.362 5.528 0.028 1 0 "[ . 1 . 2]" 1
410 1 11 GLN HA 1 11 GLN QG . . 3.430 2.228 2.124 2.431 . 0 0 "[ . 1 . 2]" 1
411 1 11 GLN HA 1 12 VAL H . . 2.780 2.278 2.197 2.348 . 0 0 "[ . 1 . 2]" 1
412 1 11 GLN HA 1 12 VAL HA . . 4.380 4.366 4.270 4.433 0.053 3 0 "[ . 1 . 2]" 1
413 1 11 GLN HA 1 12 VAL HB . . 4.500 4.467 4.220 4.573 0.073 16 0 "[ . 1 . 2]" 1
414 1 11 GLN HA 1 12 VAL QG . . 4.220 3.905 3.576 4.115 . 0 0 "[ . 1 . 2]" 1
415 1 11 GLN HA 1 13 ARG H . . 4.360 3.848 3.653 4.030 . 0 0 "[ . 1 . 2]" 1
416 1 11 GLN HA 1 14 ASP H . . 5.230 4.522 4.247 4.687 . 0 0 "[ . 1 . 2]" 1
417 1 11 GLN HA 1 105 ILE MD . . 4.160 3.110 2.808 3.542 . 0 0 "[ . 1 . 2]" 1
418 1 11 GLN HA 1 105 ILE MG . . 5.190 4.942 4.518 5.262 0.072 3 0 "[ . 1 . 2]" 1
419 1 11 GLN QB 1 12 VAL H . . 4.780 2.894 2.571 3.294 . 0 0 "[ . 1 . 2]" 1
420 1 11 GLN QB 1 13 ARG H . . 3.640 2.328 1.926 2.504 . 0 0 "[ . 1 . 2]" 1
421 1 11 GLN QB 1 13 ARG HG2 . . 4.620 2.663 2.025 4.614 . 0 0 "[ . 1 . 2]" 1
422 1 11 GLN QB 1 13 ARG HG3 . . 4.890 2.529 2.077 3.618 . 0 0 "[ . 1 . 2]" 1
423 1 11 GLN QB 1 14 ASP H . . 4.090 2.615 2.303 2.927 . 0 0 "[ . 1 . 2]" 1
424 1 11 GLN QB 1 14 ASP HA . . 5.440 4.540 4.182 5.015 . 0 0 "[ . 1 . 2]" 1
425 1 11 GLN QB 1 14 ASP HB2 . . 4.580 2.641 2.259 3.008 . 0 0 "[ . 1 . 2]" 1
426 1 11 GLN QB 1 14 ASP HB3 . . 4.500 4.150 3.818 4.436 . 0 0 "[ . 1 . 2]" 1
427 1 11 GLN QB 1 15 VAL H . . 5.070 4.173 3.876 4.542 . 0 0 "[ . 1 . 2]" 1
428 1 11 GLN QB 1 105 ILE MD . . 4.960 3.464 2.942 3.875 . 0 0 "[ . 1 . 2]" 1
429 1 11 GLN QB 1 105 ILE MG . . 4.640 4.125 3.712 4.381 . 0 0 "[ . 1 . 2]" 1
430 1 11 GLN HE21 1 105 ILE MD . . 4.820 3.816 2.482 4.597 . 0 0 "[ . 1 . 2]" 1
431 1 11 GLN HE21 1 105 ILE MG . . 4.510 4.157 3.480 5.000 0.490 5 0 "[ . 1 . 2]" 1
432 1 11 GLN HE22 1 12 VAL QG . . 5.500 5.438 4.633 6.379 0.879 1 2 "[+ -. 1 . 2]" 1
433 1 11 GLN HE22 1 105 ILE MD . . 5.500 4.903 4.035 5.320 . 0 0 "[ . 1 . 2]" 1
434 1 11 GLN HE22 1 105 ILE MG . . 5.030 4.820 4.376 5.124 0.094 19 0 "[ . 1 . 2]" 1
435 1 11 GLN QG 1 12 VAL H . . 5.020 3.933 3.762 4.173 . 0 0 "[ . 1 . 2]" 1
436 1 11 GLN QG 1 13 ARG H . . 4.830 4.477 4.154 4.577 . 0 0 "[ . 1 . 2]" 1
437 1 11 GLN QG 1 13 ARG HG2 . . 5.500 4.530 3.805 6.415 0.915 3 3 "[ +-. 1 . *]" 1
438 1 11 GLN QG 1 14 ASP H . . 5.310 4.673 4.323 4.899 . 0 0 "[ . 1 . 2]" 1
439 1 11 GLN QG 1 105 ILE HB . . 5.500 4.728 4.338 4.953 . 0 0 "[ . 1 . 2]" 1
440 1 11 GLN QG 1 105 ILE MD . . 3.860 1.998 1.910 2.140 . 0 0 "[ . 1 . 2]" 1
441 1 11 GLN QG 1 105 ILE HG12 . . 5.500 4.541 4.130 4.753 . 0 0 "[ . 1 . 2]" 1
442 1 11 GLN QG 1 105 ILE HG13 . . 5.500 3.752 3.141 4.701 . 0 0 "[ . 1 . 2]" 1
443 1 11 GLN QG 1 105 ILE MG . . 3.610 2.612 2.254 2.962 . 0 0 "[ . 1 . 2]" 1
444 1 12 VAL H 1 12 VAL HB . . 2.950 2.436 2.224 2.613 . 0 0 "[ . 1 . 2]" 1
445 1 12 VAL H 1 12 VAL QG . . 3.130 2.110 1.909 2.326 . 0 0 "[ . 1 . 2]" 1
446 1 12 VAL H 1 13 ARG H . . 3.560 2.667 2.614 2.734 . 0 0 "[ . 1 . 2]" 1
447 1 12 VAL H 1 13 ARG HA . . 5.160 5.239 5.225 5.248 0.088 8 0 "[ . 1 . 2]" 1
448 1 12 VAL H 1 14 ASP H . . 5.270 4.283 4.140 4.480 . 0 0 "[ . 1 . 2]" 1
449 1 12 VAL H 1 15 VAL H . . 5.500 5.032 4.783 5.400 . 0 0 "[ . 1 . 2]" 1
450 1 12 VAL H 1 43 VAL QG . . 4.910 3.220 2.453 3.831 . 0 0 "[ . 1 . 2]" 1
451 1 12 VAL H 1 49 VAL MG2 . . 5.440 4.330 3.841 5.013 . 0 0 "[ . 1 . 2]" 1
452 1 12 VAL HA 1 12 VAL QG . . 3.060 2.261 2.188 2.460 . 0 0 "[ . 1 . 2]" 1
453 1 12 VAL HA 1 13 ARG HA . . 5.250 4.710 4.548 4.841 . 0 0 "[ . 1 . 2]" 1
454 1 12 VAL HA 1 14 ASP H . . 4.380 4.143 3.745 4.436 0.056 11 0 "[ . 1 . 2]" 1
455 1 12 VAL HA 1 15 VAL H . . 3.940 3.597 3.100 4.015 0.075 13 0 "[ . 1 . 2]" 1
456 1 12 VAL HA 1 15 VAL HB . . 3.960 2.734 2.167 3.555 . 0 0 "[ . 1 . 2]" 1
457 1 12 VAL HA 1 15 VAL MG2 . . 3.150 3.003 2.086 3.257 0.107 20 0 "[ . 1 . 2]" 1
458 1 12 VAL HA 1 43 VAL QG . . 3.740 2.643 2.315 3.408 . 0 0 "[ . 1 . 2]" 1
459 1 12 VAL HA 1 53 LEU QD . . 4.830 3.836 3.382 4.573 . 0 0 "[ . 1 . 2]" 1
460 1 12 VAL HB 1 13 ARG H . . 4.730 4.174 3.988 4.309 . 0 0 "[ . 1 . 2]" 1
461 1 12 VAL HB 1 43 VAL QG . . 3.120 2.293 1.955 2.829 . 0 0 "[ . 1 . 2]" 1
462 1 12 VAL HB 1 49 VAL HA . . 5.150 4.499 3.860 5.172 0.022 1 0 "[ . 1 . 2]" 1
463 1 12 VAL HB 1 49 VAL MG2 . . 4.510 2.803 2.157 4.129 . 0 0 "[ . 1 . 2]" 1
464 1 12 VAL QG 1 13 ARG H . . 3.090 2.633 2.423 3.099 0.009 20 0 "[ . 1 . 2]" 1
465 1 12 VAL QG 1 13 ARG HA . . 3.990 3.321 3.080 3.767 . 0 0 "[ . 1 . 2]" 1
466 1 12 VAL QG 1 13 ARG HB2 . . 5.500 4.552 4.127 4.932 . 0 0 "[ . 1 . 2]" 1
467 1 12 VAL QG 1 13 ARG HB3 . . 4.600 3.616 2.957 4.787 0.187 20 0 "[ . 1 . 2]" 1
468 1 12 VAL QG 1 13 ARG QD . . 5.050 4.668 3.981 5.028 . 0 0 "[ . 1 . 2]" 1
469 1 12 VAL QG 1 13 ARG HG2 . . 4.760 3.558 2.627 4.426 . 0 0 "[ . 1 . 2]" 1
470 1 12 VAL QG 1 14 ASP H . . 4.910 4.331 4.203 4.477 . 0 0 "[ . 1 . 2]" 1
471 1 12 VAL QG 1 15 VAL H . . 5.010 4.538 4.226 4.754 . 0 0 "[ . 1 . 2]" 1
472 1 12 VAL QG 1 15 VAL HB . . 4.650 3.684 3.064 4.195 . 0 0 "[ . 1 . 2]" 1
473 1 12 VAL QG 1 18 ARG QD . . 5.150 3.140 2.109 4.059 . 0 0 "[ . 1 . 2]" 1
474 1 12 VAL QG 1 18 ARG HE . . 5.500 3.241 2.106 5.148 . 0 0 "[ . 1 . 2]" 1
475 1 12 VAL QG 1 49 VAL H . . 5.500 4.714 4.214 5.048 . 0 0 "[ . 1 . 2]" 1
476 1 12 VAL QG 1 49 VAL HA . . 3.820 2.594 2.148 2.976 . 0 0 "[ . 1 . 2]" 1
477 1 12 VAL QG 1 49 VAL HB . . 5.480 4.211 3.923 4.470 . 0 0 "[ . 1 . 2]" 1
478 1 12 VAL QG 1 49 VAL MG1 . . 3.900 2.476 2.076 2.955 . 0 0 "[ . 1 . 2]" 1
479 1 12 VAL QG 1 49 VAL MG2 . . 3.520 2.156 1.942 2.719 . 0 0 "[ . 1 . 2]" 1
480 1 12 VAL QG 1 52 GLN H . . 5.500 4.381 3.655 4.876 . 0 0 "[ . 1 . 2]" 1
481 1 12 VAL QG 1 52 GLN HB2 . . 3.620 2.587 2.164 3.064 . 0 0 "[ . 1 . 2]" 1
482 1 12 VAL QG 1 52 GLN HE21 . . 4.330 2.788 2.078 3.594 . 0 0 "[ . 1 . 2]" 1
483 1 12 VAL QG 1 52 GLN HE22 . . 3.770 2.478 2.223 3.245 . 0 0 "[ . 1 . 2]" 1
484 1 12 VAL QG 1 52 GLN HG3 . . 4.730 3.930 3.415 4.269 . 0 0 "[ . 1 . 2]" 1
485 1 12 VAL QG 1 53 LEU H . . 5.130 4.283 3.588 4.755 . 0 0 "[ . 1 . 2]" 1
486 1 12 VAL QG 1 53 LEU HA . . 4.380 4.086 3.594 4.381 0.001 14 0 "[ . 1 . 2]" 1
487 1 12 VAL QG 1 53 LEU QD . . 3.340 1.919 1.797 3.009 . 0 0 "[ . 1 . 2]" 1
488 1 12 VAL QG 1 53 LEU HG . . 3.820 3.614 2.665 3.905 0.085 20 0 "[ . 1 . 2]" 1
489 1 13 ARG H 1 13 ARG HB2 . . 3.690 3.484 2.472 3.709 0.019 13 0 "[ . 1 . 2]" 1
490 1 13 ARG H 1 13 ARG HB3 . . 3.030 2.975 2.501 3.720 0.690 20 3 "[ -*. 1 . +]" 1
491 1 13 ARG H 1 13 ARG QD . . 4.340 4.010 3.626 4.405 0.065 20 0 "[ . 1 . 2]" 1
492 1 13 ARG H 1 13 ARG HG2 . . 3.820 2.415 1.934 3.235 . 0 0 "[ . 1 . 2]" 1
493 1 13 ARG H 1 13 ARG HG3 . . 3.640 2.593 2.112 3.681 0.041 2 0 "[ . 1 . 2]" 1
494 1 13 ARG H 1 14 ASP H . . 3.350 2.465 2.123 2.567 . 0 0 "[ . 1 . 2]" 1
495 1 13 ARG H 1 14 ASP HA . . 5.070 5.119 4.827 5.155 0.085 14 0 "[ . 1 . 2]" 1
496 1 13 ARG H 1 14 ASP HB2 . . 5.350 4.361 4.087 4.576 . 0 0 "[ . 1 . 2]" 1
497 1 13 ARG H 1 15 VAL H . . 4.550 3.976 3.706 4.263 . 0 0 "[ . 1 . 2]" 1
498 1 13 ARG HA 1 13 ARG HB2 . . 2.850 2.583 2.368 3.067 0.217 3 0 "[ . 1 . 2]" 1
499 1 13 ARG HA 1 13 ARG QD . . 4.470 4.302 3.600 4.527 0.057 5 0 "[ . 1 . 2]" 1
500 1 13 ARG HA 1 13 ARG HG2 . . 4.020 3.641 2.387 3.996 . 0 0 "[ . 1 . 2]" 1
501 1 13 ARG HA 1 13 ARG HG3 . . 3.800 3.662 3.253 3.817 0.017 8 0 "[ . 1 . 2]" 1
502 1 13 ARG HA 1 14 ASP HA . . 5.050 4.762 4.612 4.843 . 0 0 "[ . 1 . 2]" 1
503 1 13 ARG HA 1 15 VAL H . . 4.410 4.405 4.172 4.492 0.082 4 0 "[ . 1 . 2]" 1
504 1 13 ARG HB2 1 13 ARG QD . . 3.560 2.395 2.106 2.805 . 0 0 "[ . 1 . 2]" 1
505 1 13 ARG HB3 1 14 ASP H . . 4.440 4.203 3.970 4.488 0.048 1 0 "[ . 1 . 2]" 1
506 1 13 ARG QD 1 13 ARG HG3 . . 2.720 2.425 2.135 2.566 . 0 0 "[ . 1 . 2]" 1
507 1 13 ARG QD 1 14 ASP H . . 5.500 4.530 3.877 5.579 0.079 20 0 "[ . 1 . 2]" 1
508 1 13 ARG HG2 1 14 ASP H . . 4.750 3.653 2.370 5.021 0.271 3 0 "[ . 1 . 2]" 1
509 1 14 ASP H 1 14 ASP HB2 . . 3.290 2.205 2.017 2.372 . 0 0 "[ . 1 . 2]" 1
510 1 14 ASP H 1 14 ASP HB3 . . 3.650 3.473 3.322 3.588 . 0 0 "[ . 1 . 2]" 1
511 1 14 ASP H 1 15 VAL H . . 3.020 2.244 1.926 2.409 . 0 0 "[ . 1 . 2]" 1
512 1 14 ASP H 1 15 VAL HA . . 5.270 4.957 4.695 5.133 . 0 0 "[ . 1 . 2]" 1
513 1 14 ASP H 1 15 VAL MG1 . . 5.470 5.482 5.203 5.565 0.095 19 0 "[ . 1 . 2]" 1
514 1 14 ASP H 1 15 VAL MG2 . . 4.210 3.568 3.296 3.822 . 0 0 "[ . 1 . 2]" 1
515 1 14 ASP HA 1 15 VAL MG2 . . 4.920 4.818 4.636 5.002 0.082 8 0 "[ . 1 . 2]" 1
516 1 14 ASP HB2 1 15 VAL H . . 4.120 2.761 2.527 3.081 . 0 0 "[ . 1 . 2]" 1
517 1 14 ASP HB2 1 15 VAL MG1 . . 5.500 5.495 5.258 5.602 0.102 8 0 "[ . 1 . 2]" 1
518 1 14 ASP HB2 1 15 VAL MG2 . . 4.490 3.130 2.795 3.771 . 0 0 "[ . 1 . 2]" 1
519 1 14 ASP HB3 1 15 VAL H . . 4.510 3.391 3.005 3.736 . 0 0 "[ . 1 . 2]" 1
520 1 14 ASP HB3 1 15 VAL MG1 . . 5.500 5.563 5.195 5.620 0.120 10 0 "[ . 1 . 2]" 1
521 1 14 ASP HB3 1 15 VAL MG2 . . 4.760 3.675 2.860 4.322 . 0 0 "[ . 1 . 2]" 1
522 1 14 ASP HB3 1 102 GLU QG . . 5.030 3.342 2.116 4.084 . 0 0 "[ . 1 . 2]" 1
523 1 15 VAL H 1 15 VAL HB . . 2.990 2.533 2.126 3.014 0.024 8 0 "[ . 1 . 2]" 1
524 1 15 VAL H 1 15 VAL MG1 . . 4.170 3.709 3.563 3.781 . 0 0 "[ . 1 . 2]" 1
525 1 15 VAL H 1 15 VAL MG2 . . 3.030 2.138 1.974 2.264 . 0 0 "[ . 1 . 2]" 1
526 1 15 VAL H 1 16 LEU H . . 4.940 3.780 3.607 4.080 . 0 0 "[ . 1 . 2]" 1
527 1 15 VAL H 1 97 VAL QG . . 5.480 5.027 4.856 5.275 . 0 0 "[ . 1 . 2]" 1
528 1 15 VAL HA 1 15 VAL MG1 . . 3.590 2.323 2.052 2.534 . 0 0 "[ . 1 . 2]" 1
529 1 15 VAL HA 1 15 VAL MG2 . . 3.350 2.520 2.304 2.657 . 0 0 "[ . 1 . 2]" 1
530 1 15 VAL HA 1 16 LEU H . . 3.020 2.359 2.246 2.470 . 0 0 "[ . 1 . 2]" 1
531 1 15 VAL HA 1 16 LEU HA . . 4.850 4.621 4.452 4.682 . 0 0 "[ . 1 . 2]" 1
532 1 15 VAL HA 1 16 LEU HB2 . . 4.690 4.373 4.182 5.570 0.880 13 2 "[ . 1- + . 2]" 1
533 1 15 VAL HA 1 16 LEU HB3 . . 5.500 5.472 4.258 5.586 0.086 19 0 "[ . 1 . 2]" 1
534 1 15 VAL HA 1 16 LEU HG . . 4.730 4.540 4.223 4.810 0.080 11 0 "[ . 1 . 2]" 1
535 1 15 VAL HA 1 17 VAL H . . 4.580 3.437 3.105 3.742 . 0 0 "[ . 1 . 2]" 1
536 1 15 VAL HA 1 97 VAL QG . . 5.500 4.482 4.124 4.805 . 0 0 "[ . 1 . 2]" 1
537 1 15 VAL HA 1 102 GLU QG . . 3.970 3.136 2.024 3.952 . 0 0 "[ . 1 . 2]" 1
538 1 15 VAL HB 1 18 ARG QD . . 5.050 4.172 2.238 4.733 . 0 0 "[ . 1 . 2]" 1
539 1 15 VAL HB 1 18 ARG HE . . 4.960 3.693 1.885 5.049 0.089 13 0 "[ . 1 . 2]" 1
540 1 15 VAL HB 1 18 ARG HG2 . . 4.670 3.303 2.357 4.367 . 0 0 "[ . 1 . 2]" 1
541 1 15 VAL MG1 1 16 LEU H . . 3.960 3.841 3.547 3.993 0.033 10 0 "[ . 1 . 2]" 1
542 1 15 VAL MG1 1 17 VAL H . . 3.670 2.925 2.609 3.421 . 0 0 "[ . 1 . 2]" 1
543 1 15 VAL MG1 1 17 VAL HA . . 5.500 4.262 4.032 4.560 . 0 0 "[ . 1 . 2]" 1
544 1 15 VAL MG1 1 18 ARG H . . 4.900 3.803 3.464 4.217 . 0 0 "[ . 1 . 2]" 1
545 1 15 VAL MG1 1 18 ARG HA . . 3.470 2.535 2.071 3.095 . 0 0 "[ . 1 . 2]" 1
546 1 15 VAL MG1 1 18 ARG QD . . 4.800 3.767 2.259 4.280 . 0 0 "[ . 1 . 2]" 1
547 1 15 VAL MG1 1 18 ARG HE . . 5.130 4.013 2.007 5.157 0.027 2 0 "[ . 1 . 2]" 1
548 1 15 VAL MG1 1 18 ARG HG2 . . 3.780 3.089 2.261 3.582 . 0 0 "[ . 1 . 2]" 1
549 1 15 VAL MG1 1 18 ARG HG3 . . 4.080 2.704 2.052 4.188 0.108 10 0 "[ . 1 . 2]" 1
550 1 15 VAL MG1 1 19 GLY H . . 5.210 4.725 4.481 5.090 . 0 0 "[ . 1 . 2]" 1
551 1 15 VAL MG1 1 97 VAL H . . 5.500 5.108 4.871 5.266 . 0 0 "[ . 1 . 2]" 1
552 1 15 VAL MG1 1 97 VAL HA . . 5.500 4.270 4.016 4.600 . 0 0 "[ . 1 . 2]" 1
553 1 15 VAL MG1 1 97 VAL HB . . 3.790 2.235 2.017 2.588 . 0 0 "[ . 1 . 2]" 1
554 1 15 VAL MG1 1 97 VAL QG . . 3.720 1.954 1.865 2.098 . 0 0 "[ . 1 . 2]" 1
555 1 15 VAL MG2 1 97 VAL QG . . 3.620 2.281 2.083 2.590 . 0 0 "[ . 1 . 2]" 1
556 1 16 LEU H 1 16 LEU HB2 . . 3.720 2.502 2.159 3.631 . 0 0 "[ . 1 . 2]" 1
557 1 16 LEU H 1 16 LEU HB3 . . 4.000 3.405 2.014 3.586 . 0 0 "[ . 1 . 2]" 1
558 1 16 LEU H 1 16 LEU MD2 . . 4.160 3.322 1.651 3.822 . 0 0 "[ . 1 . 2]" 1
559 1 16 LEU H 1 16 LEU HG . . 3.770 2.390 2.074 3.342 . 0 0 "[ . 1 . 2]" 1
560 1 16 LEU H 1 17 VAL H . . 4.150 3.085 2.775 3.264 . 0 0 "[ . 1 . 2]" 1
561 1 16 LEU H 1 17 VAL HA . . 5.500 5.545 5.297 5.592 0.092 13 0 "[ . 1 . 2]" 1
562 1 16 LEU H 1 17 VAL QG . . 5.180 4.405 3.941 4.835 . 0 0 "[ . 1 . 2]" 1
563 1 16 LEU H 1 102 GLU QG . . 5.170 3.653 2.700 4.485 . 0 0 "[ . 1 . 2]" 1
564 1 16 LEU HA 1 16 LEU MD2 . . 3.090 2.261 2.037 3.992 0.902 11 1 "[ . 1+ . 2]" 1
565 1 16 LEU HA 1 16 LEU HG . . 4.120 3.052 2.567 3.920 . 0 0 "[ . 1 . 2]" 1
566 1 16 LEU HB2 1 16 LEU MD1 . . 2.860 2.302 2.108 2.402 . 0 0 "[ . 1 . 2]" 1
567 1 16 LEU HB2 1 17 VAL H . . 4.250 2.943 2.375 4.249 . 0 0 "[ . 1 . 2]" 1
568 1 16 LEU HB2 1 17 VAL QG . . 3.850 3.177 2.353 4.027 0.177 11 0 "[ . 1 . 2]" 1
569 1 16 LEU HB3 1 16 LEU MD1 . . 3.610 2.447 2.263 3.185 . 0 0 "[ . 1 . 2]" 1
570 1 16 LEU HB3 1 17 VAL H . . 4.170 3.631 3.305 4.141 . 0 0 "[ . 1 . 2]" 1
571 1 16 LEU HB3 1 17 VAL QG . . 3.950 3.406 2.680 3.970 0.020 3 0 "[ . 1 . 2]" 1
572 1 16 LEU MD2 1 17 VAL H . . 4.750 4.697 3.041 4.857 0.107 14 0 "[ . 1 . 2]" 1
573 1 16 LEU HG 1 17 VAL H . . 5.500 4.494 2.576 5.130 . 0 0 "[ . 1 . 2]" 1
574 1 17 VAL H 1 17 VAL HB . . 3.810 3.150 2.488 3.882 0.072 6 0 "[ . 1 . 2]" 1
575 1 17 VAL H 1 17 VAL QG . . 3.600 2.413 1.871 3.001 . 0 0 "[ . 1 . 2]" 1
576 1 17 VAL H 1 18 ARG H . . 5.250 4.055 3.800 4.274 . 0 0 "[ . 1 . 2]" 1
577 1 17 VAL H 1 19 GLY H . . 5.500 5.397 4.925 5.582 0.082 17 0 "[ . 1 . 2]" 1
578 1 17 VAL HA 1 17 VAL QG . . 3.180 2.310 2.057 2.640 . 0 0 "[ . 1 . 2]" 1
579 1 17 VAL HA 1 18 ARG H . . 2.820 2.136 2.046 2.241 . 0 0 "[ . 1 . 2]" 1
580 1 17 VAL HA 1 18 ARG HG2 . . 5.250 5.094 3.223 5.582 0.332 1 0 "[ . 1 . 2]" 1
581 1 17 VAL HA 1 18 ARG HG3 . . 5.500 4.141 3.554 4.949 . 0 0 "[ . 1 . 2]" 1
582 1 17 VAL HA 1 19 GLY H . . 3.980 3.638 3.355 4.034 0.054 2 0 "[ . 1 . 2]" 1
583 1 17 VAL HB 1 18 ARG H . . 5.060 4.244 3.259 4.558 . 0 0 "[ . 1 . 2]" 1
584 1 17 VAL HB 1 19 GLY H . . 4.780 4.387 3.459 4.854 0.074 11 0 "[ . 1 . 2]" 1
585 1 17 VAL QG 1 18 ARG H . . 3.620 3.230 2.941 3.539 . 0 0 "[ . 1 . 2]" 1
586 1 17 VAL QG 1 18 ARG HA . . 5.500 4.043 3.809 4.589 . 0 0 "[ . 1 . 2]" 1
587 1 17 VAL QG 1 18 ARG HG2 . . 5.500 5.501 4.581 5.917 0.417 14 0 "[ . 1 . 2]" 1
588 1 17 VAL QG 1 19 GLY H . . 3.350 2.426 1.867 3.284 . 0 0 "[ . 1 . 2]" 1
589 1 17 VAL QG 1 98 PRO QD . . 4.320 3.280 2.781 3.862 . 0 0 "[ . 1 . 2]" 1
590 1 17 VAL QG 1 98 PRO HG2 . . 3.270 2.601 2.002 3.275 0.005 18 0 "[ . 1 . 2]" 1
591 1 18 ARG H 1 18 ARG HB2 . . 3.170 2.704 2.102 3.246 0.076 2 0 "[ . 1 . 2]" 1
592 1 18 ARG H 1 18 ARG HB3 . . 3.950 3.645 3.428 3.802 . 0 0 "[ . 1 . 2]" 1
593 1 18 ARG H 1 18 ARG QD . . 4.660 2.663 1.700 4.298 . 0 0 "[ . 1 . 2]" 1
594 1 18 ARG H 1 18 ARG HG2 . . 4.240 3.574 2.152 3.952 . 0 0 "[ . 1 . 2]" 1
595 1 18 ARG H 1 18 ARG HG3 . . 3.850 2.806 2.125 3.088 . 0 0 "[ . 1 . 2]" 1
596 1 18 ARG H 1 19 GLY H . . 3.350 2.749 2.341 3.298 . 0 0 "[ . 1 . 2]" 1
597 1 18 ARG H 1 19 GLY QA . . 5.240 4.219 3.928 4.478 . 0 0 "[ . 1 . 2]" 1
598 1 18 ARG H 1 54 GLU H . . 5.500 4.787 4.211 5.547 0.047 16 0 "[ . 1 . 2]" 1
599 1 18 ARG H 1 54 GLU HG2 . . 5.010 3.661 2.374 4.672 . 0 0 "[ . 1 . 2]" 1
600 1 18 ARG H 1 54 GLU HG3 . . 5.500 3.863 2.575 5.162 . 0 0 "[ . 1 . 2]" 1
601 1 18 ARG HA 1 18 ARG QD . . 4.500 3.763 3.227 4.094 . 0 0 "[ . 1 . 2]" 1
602 1 18 ARG HA 1 18 ARG HG2 . . 3.630 3.272 2.414 3.770 0.140 14 0 "[ . 1 . 2]" 1
603 1 18 ARG HA 1 18 ARG HG3 . . 4.050 2.935 2.470 4.030 . 0 0 "[ . 1 . 2]" 1
604 1 18 ARG HA 1 19 GLY H . . 3.510 3.164 2.634 3.468 . 0 0 "[ . 1 . 2]" 1
605 1 18 ARG HA 1 53 LEU HA . . 5.500 5.205 4.416 5.583 0.083 16 0 "[ . 1 . 2]" 1
606 1 18 ARG HA 1 53 LEU QD . . 3.840 3.582 2.675 3.884 0.044 1 0 "[ . 1 . 2]" 1
607 1 18 ARG HB2 1 19 GLY H . . 5.260 3.968 3.392 4.447 . 0 0 "[ . 1 . 2]" 1
608 1 18 ARG HB2 1 53 LEU QD . . 4.550 2.495 2.010 3.980 . 0 0 "[ . 1 . 2]" 1
609 1 18 ARG HB2 1 54 GLU H . . 4.090 2.960 2.072 3.564 . 0 0 "[ . 1 . 2]" 1
610 1 18 ARG HB3 1 18 ARG QD . . 3.910 2.893 2.143 3.251 . 0 0 "[ . 1 . 2]" 1
611 1 18 ARG HB3 1 18 ARG HE . . 5.500 4.396 2.522 5.222 . 0 0 "[ . 1 . 2]" 1
612 1 18 ARG HB3 1 19 GLY H . . 4.740 4.518 4.206 4.719 . 0 0 "[ . 1 . 2]" 1
613 1 18 ARG HB3 1 53 LEU HA . . 4.010 3.389 2.111 4.064 0.054 8 0 "[ . 1 . 2]" 1
614 1 18 ARG HB3 1 53 LEU QD . . 4.550 2.053 1.892 2.582 . 0 0 "[ . 1 . 2]" 1
615 1 18 ARG QD 1 53 LEU HA . . 3.630 2.215 2.003 2.524 . 0 0 "[ . 1 . 2]" 1
616 1 18 ARG QD 1 53 LEU QD . . 4.080 2.300 1.875 2.898 . 0 0 "[ . 1 . 2]" 1
617 1 18 ARG QD 1 54 GLU H . . 5.320 3.950 3.247 4.339 . 0 0 "[ . 1 . 2]" 1
618 1 18 ARG QD 1 54 GLU HG2 . . 5.360 4.134 3.244 5.829 0.469 16 0 "[ . 1 . 2]" 1
619 1 18 ARG HE 1 53 LEU QD . . 5.500 3.654 1.538 4.689 . 0 0 "[ . 1 . 2]" 1
620 1 18 ARG HG2 1 53 LEU HA . . 5.390 3.905 2.982 4.637 . 0 0 "[ . 1 . 2]" 1
621 1 18 ARG HG2 1 53 LEU QD . . 4.500 2.653 1.994 4.406 . 0 0 "[ . 1 . 2]" 1
622 1 19 GLY H 1 20 PHE H . . 4.940 3.979 3.324 4.520 . 0 0 "[ . 1 . 2]" 1
623 1 19 GLY H 1 20 PHE HA . . 5.500 4.613 4.001 5.342 . 0 0 "[ . 1 . 2]" 1
624 1 19 GLY H 1 21 GLY H . . 5.000 5.068 5.044 5.086 0.086 2 0 "[ . 1 . 2]" 1
625 1 19 GLY H 1 54 GLU HB2 . . 5.500 4.736 4.151 5.579 0.079 16 0 "[ . 1 . 2]" 1
626 1 19 GLY H 1 97 VAL HB . . 5.500 5.301 4.738 5.570 0.070 17 0 "[ . 1 . 2]" 1
627 1 19 GLY H 1 97 VAL QG . . 4.860 4.411 3.911 4.809 . 0 0 "[ . 1 . 2]" 1
628 1 19 GLY H 1 98 PRO QD . . 4.130 3.743 3.484 3.878 . 0 0 "[ . 1 . 2]" 1
629 1 19 GLY H 1 98 PRO HG2 . . 4.710 4.588 4.038 4.781 0.071 11 0 "[ . 1 . 2]" 1
630 1 19 GLY QA 1 20 PHE HA . . 5.010 4.149 4.017 4.251 . 0 0 "[ . 1 . 2]" 1
631 1 19 GLY QA 1 21 GLY H . . 4.370 3.064 2.742 3.571 . 0 0 "[ . 1 . 2]" 1
632 1 19 GLY QA 1 54 GLU H . . 5.130 3.944 3.382 4.481 . 0 0 "[ . 1 . 2]" 1
633 1 19 GLY QA 1 54 GLU HB2 . . 4.630 2.785 2.299 3.800 . 0 0 "[ . 1 . 2]" 1
634 1 19 GLY QA 1 54 GLU HB3 . . 4.550 3.716 3.181 4.033 . 0 0 "[ . 1 . 2]" 1
635 1 19 GLY QA 1 97 VAL QG . . 4.840 4.303 3.551 4.656 . 0 0 "[ . 1 . 2]" 1
636 1 20 PHE H 1 20 PHE HB2 . . 3.760 2.382 2.160 2.513 . 0 0 "[ . 1 . 2]" 1
637 1 20 PHE H 1 20 PHE QD . . 4.000 3.028 2.459 3.442 . 0 0 "[ . 1 . 2]" 1
638 1 20 PHE H 1 21 GLY H . . 3.300 2.599 2.204 3.105 . 0 0 "[ . 1 . 2]" 1
639 1 20 PHE H 1 27 ALA HA . . 4.950 4.150 3.719 4.473 . 0 0 "[ . 1 . 2]" 1
640 1 20 PHE H 1 27 ALA MB . . 4.610 3.082 2.836 3.463 . 0 0 "[ . 1 . 2]" 1
641 1 20 PHE H 1 30 GLU HB2 . . 5.500 5.352 5.080 5.525 0.025 3 0 "[ . 1 . 2]" 1
642 1 20 PHE H 1 58 VAL QG . . 5.500 3.753 3.384 4.280 . 0 0 "[ . 1 . 2]" 1
643 1 20 PHE H 1 98 PRO QD . . 5.500 3.796 3.032 4.721 . 0 0 "[ . 1 . 2]" 1
644 1 20 PHE HA 1 20 PHE QD . . 3.210 2.577 2.281 2.890 . 0 0 "[ . 1 . 2]" 1
645 1 20 PHE HA 1 27 ALA HA . . 4.610 4.645 4.404 4.701 0.091 10 0 "[ . 1 . 2]" 1
646 1 20 PHE HA 1 27 ALA MB . . 5.500 4.689 4.505 4.944 . 0 0 "[ . 1 . 2]" 1
647 1 20 PHE HA 1 30 GLU HB2 . . 5.230 4.522 3.990 4.828 . 0 0 "[ . 1 . 2]" 1
648 1 20 PHE HA 1 30 GLU HB3 . . 5.280 4.279 3.888 4.741 . 0 0 "[ . 1 . 2]" 1
649 1 20 PHE HA 1 30 GLU QG . . 5.500 4.409 3.957 5.262 . 0 0 "[ . 1 . 2]" 1
650 1 20 PHE HA 1 98 PRO QD . . 5.260 3.443 2.800 4.155 . 0 0 "[ . 1 . 2]" 1
651 1 20 PHE HA 1 98 PRO HG2 . . 5.500 4.325 3.408 5.548 0.048 17 0 "[ . 1 . 2]" 1
652 1 20 PHE HA 1 98 PRO HG3 . . 5.280 2.960 2.336 3.799 . 0 0 "[ . 1 . 2]" 1
653 1 20 PHE HB2 1 21 GLY H . . 4.140 3.089 2.734 3.434 . 0 0 "[ . 1 . 2]" 1
654 1 20 PHE HB2 1 27 ALA HA . . 3.520 2.172 1.951 2.540 . 0 0 "[ . 1 . 2]" 1
655 1 20 PHE HB2 1 27 ALA MB . . 3.760 2.377 2.178 2.667 . 0 0 "[ . 1 . 2]" 1
656 1 20 PHE HB2 1 28 LEU H . . 5.310 5.275 5.131 5.385 0.075 18 0 "[ . 1 . 2]" 1
657 1 20 PHE HB2 1 30 GLU HB2 . . 4.590 3.099 2.733 3.708 . 0 0 "[ . 1 . 2]" 1
658 1 20 PHE HB2 1 30 GLU HB3 . . 4.780 4.034 3.483 4.842 0.062 3 0 "[ . 1 . 2]" 1
659 1 20 PHE HB2 1 31 ALA H . . 5.080 4.114 3.581 4.486 . 0 0 "[ . 1 . 2]" 1
660 1 20 PHE HB2 1 31 ALA MB . . 4.730 3.948 3.380 4.421 . 0 0 "[ . 1 . 2]" 1
661 1 20 PHE HB3 1 21 GLY H . . 4.500 3.815 3.297 4.101 . 0 0 "[ . 1 . 2]" 1
662 1 20 PHE HB3 1 27 ALA HA . . 3.450 2.721 2.182 3.074 . 0 0 "[ . 1 . 2]" 1
663 1 20 PHE HB3 1 27 ALA MB . . 4.000 3.721 3.173 4.045 0.045 16 0 "[ . 1 . 2]" 1
664 1 20 PHE HB3 1 30 GLU H . . 4.780 4.373 4.058 4.630 . 0 0 "[ . 1 . 2]" 1
665 1 20 PHE HB3 1 30 GLU HB2 . . 3.880 2.124 2.017 2.363 . 0 0 "[ . 1 . 2]" 1
666 1 20 PHE HB3 1 30 GLU HB3 . . 3.880 2.467 2.048 3.122 . 0 0 "[ . 1 . 2]" 1
667 1 20 PHE HB3 1 30 GLU QG . . 4.910 2.817 2.280 3.306 . 0 0 "[ . 1 . 2]" 1
668 1 20 PHE HB3 1 31 ALA H . . 4.580 3.828 3.224 4.291 . 0 0 "[ . 1 . 2]" 1
669 1 20 PHE HB3 1 31 ALA MB . . 5.480 4.313 3.695 4.957 . 0 0 "[ . 1 . 2]" 1
670 1 20 PHE HB3 1 58 VAL QG . . 5.500 4.329 3.888 4.820 . 0 0 "[ . 1 . 2]" 1
671 1 20 PHE QD 1 27 ALA HA . . 4.200 3.808 3.198 4.225 0.025 20 0 "[ . 1 . 2]" 1
672 1 20 PHE QD 1 27 ALA MB . . 5.090 2.984 2.529 3.394 . 0 0 "[ . 1 . 2]" 1
673 1 20 PHE QD 1 30 GLU H . . 5.500 5.401 4.962 5.575 0.075 19 0 "[ . 1 . 2]" 1
674 1 20 PHE QD 1 30 GLU HB2 . . 3.940 3.572 3.239 3.881 . 0 0 "[ . 1 . 2]" 1
675 1 20 PHE QD 1 30 GLU HB3 . . 3.700 3.061 2.303 3.791 0.091 17 0 "[ . 1 . 2]" 1
676 1 20 PHE QD 1 30 GLU QG . . 4.900 4.306 3.806 4.713 . 0 0 "[ . 1 . 2]" 1
677 1 20 PHE QD 1 31 ALA H . . 4.910 3.907 3.202 4.279 . 0 0 "[ . 1 . 2]" 1
678 1 20 PHE QD 1 31 ALA HA . . 4.740 3.702 3.412 4.030 . 0 0 "[ . 1 . 2]" 1
679 1 20 PHE QD 1 31 ALA MB . . 3.860 2.762 2.462 3.352 . 0 0 "[ . 1 . 2]" 1
680 1 20 PHE QD 1 34 HIS H . . 5.500 5.255 5.024 5.597 0.097 11 0 "[ . 1 . 2]" 1
681 1 20 PHE QD 1 34 HIS HD2 . . 4.070 4.065 3.325 4.171 0.101 11 0 "[ . 1 . 2]" 1
682 1 20 PHE QD 1 58 VAL H . . 5.500 4.422 3.927 5.047 . 0 0 "[ . 1 . 2]" 1
683 1 20 PHE QD 1 58 VAL HB . . 4.040 3.286 2.670 3.869 . 0 0 "[ . 1 . 2]" 1
684 1 20 PHE QD 1 58 VAL QG . . 3.570 2.195 1.999 2.437 . 0 0 "[ . 1 . 2]" 1
685 1 20 PHE QD 1 96 LEU HB2 . . 4.520 4.379 4.042 4.624 0.104 15 0 "[ . 1 . 2]" 1
686 1 20 PHE QD 1 96 LEU HB3 . . 4.790 4.634 3.934 4.872 0.082 16 0 "[ . 1 . 2]" 1
687 1 20 PHE QD 1 97 VAL HA . . 4.750 3.946 3.299 4.474 . 0 0 "[ . 1 . 2]" 1
688 1 20 PHE QD 1 98 PRO QD . . 4.820 3.254 2.955 3.827 . 0 0 "[ . 1 . 2]" 1
689 1 20 PHE QD 1 98 PRO HG2 . . 4.540 4.476 3.961 4.631 0.091 14 0 "[ . 1 . 2]" 1
690 1 20 PHE QD 1 98 PRO HG3 . . 4.530 2.835 2.264 3.098 . 0 0 "[ . 1 . 2]" 1
691 1 20 PHE QE 1 31 ALA HA . . 4.500 3.120 2.616 3.653 . 0 0 "[ . 1 . 2]" 1
692 1 20 PHE QE 1 31 ALA MB . . 4.390 2.693 2.268 3.263 . 0 0 "[ . 1 . 2]" 1
693 1 20 PHE QE 1 34 HIS H . . 5.500 4.615 3.698 5.601 0.101 11 0 "[ . 1 . 2]" 1
694 1 20 PHE QE 1 34 HIS QB . . 4.820 2.498 2.110 4.162 . 0 0 "[ . 1 . 2]" 1
695 1 20 PHE QE 1 34 HIS HD2 . . 4.270 2.884 2.335 3.438 . 0 0 "[ . 1 . 2]" 1
696 1 20 PHE QE 1 35 LEU QD . . 5.010 4.333 3.655 4.780 . 0 0 "[ . 1 . 2]" 1
697 1 20 PHE QE 1 96 LEU H . . 5.500 4.293 3.957 4.622 . 0 0 "[ . 1 . 2]" 1
698 1 20 PHE QE 1 96 LEU HB2 . . 4.000 2.582 2.044 3.394 . 0 0 "[ . 1 . 2]" 1
699 1 20 PHE QE 1 96 LEU HB3 . . 4.210 2.356 2.026 2.605 . 0 0 "[ . 1 . 2]" 1
700 1 20 PHE QE 1 96 LEU QD . . 4.880 3.580 3.126 3.811 . 0 0 "[ . 1 . 2]" 1
701 1 20 PHE QE 1 96 LEU HG . . 5.500 4.440 3.429 5.145 . 0 0 "[ . 1 . 2]" 1
702 1 20 PHE QE 1 97 VAL H . . 5.220 3.719 3.238 4.166 . 0 0 "[ . 1 . 2]" 1
703 1 20 PHE QE 1 97 VAL HA . . 4.440 3.292 2.898 3.689 . 0 0 "[ . 1 . 2]" 1
704 1 20 PHE QE 1 98 PRO HA . . 4.560 2.482 2.070 3.773 . 0 0 "[ . 1 . 2]" 1
705 1 20 PHE QE 1 98 PRO HB3 . . 4.750 2.763 2.239 3.528 . 0 0 "[ . 1 . 2]" 1
706 1 20 PHE QE 1 98 PRO QD . . 5.210 3.296 2.642 3.747 . 0 0 "[ . 1 . 2]" 1
707 1 20 PHE QE 1 98 PRO HG2 . . 5.500 4.704 4.000 5.355 . 0 0 "[ . 1 . 2]" 1
708 1 20 PHE QE 1 98 PRO HG3 . . 4.880 3.501 2.465 4.052 . 0 0 "[ . 1 . 2]" 1
709 1 20 PHE HZ 1 31 ALA HA . . 3.940 3.300 2.738 3.939 . 0 0 "[ . 1 . 2]" 1
710 1 20 PHE HZ 1 31 ALA MB . . 3.880 3.763 3.210 3.970 0.090 12 0 "[ . 1 . 2]" 1
711 1 20 PHE HZ 1 40 CYS HA . . 3.930 3.362 2.703 3.923 . 0 0 "[ . 1 . 2]" 1
712 1 20 PHE HZ 1 40 CYS QB . . 4.390 2.939 2.140 3.600 . 0 0 "[ . 1 . 2]" 1
713 1 20 PHE HZ 1 41 GLY H . . 5.500 3.913 3.583 4.534 . 0 0 "[ . 1 . 2]" 1
714 1 20 PHE HZ 1 96 LEU HB3 . . 3.660 2.962 2.218 3.726 0.066 15 0 "[ . 1 . 2]" 1
715 1 20 PHE HZ 1 97 VAL H . . 4.830 3.507 3.110 3.898 . 0 0 "[ . 1 . 2]" 1
716 1 20 PHE HZ 1 97 VAL HA . . 4.260 3.736 3.199 4.144 . 0 0 "[ . 1 . 2]" 1
717 1 20 PHE HZ 1 98 PRO HA . . 4.020 3.403 2.941 4.071 0.051 7 0 "[ . 1 . 2]" 1
718 1 20 PHE HZ 1 98 PRO QD . . 5.500 3.958 3.504 4.326 . 0 0 "[ . 1 . 2]" 1
719 1 20 PHE HZ 1 98 PRO HG3 . . 5.490 5.176 4.526 5.567 0.077 5 0 "[ . 1 . 2]" 1
720 1 20 PHE HZ 1 99 HIS H . . 5.500 5.040 4.313 5.567 0.067 10 0 "[ . 1 . 2]" 1
721 1 21 GLY H 1 22 ASP H . . 4.640 4.119 1.824 4.380 . 0 0 "[ . 1 . 2]" 1
722 1 21 GLY H 1 22 ASP QB . . 5.500 5.269 4.428 5.596 0.096 13 0 "[ . 1 . 2]" 1
723 1 21 GLY H 1 27 ALA HA . . 4.890 3.580 3.062 4.096 . 0 0 "[ . 1 . 2]" 1
724 1 21 GLY H 1 27 ALA MB . . 4.100 2.815 2.366 3.268 . 0 0 "[ . 1 . 2]" 1
725 1 21 GLY H 1 30 GLU HB2 . . 5.500 5.264 4.644 5.574 0.074 7 0 "[ . 1 . 2]" 1
726 1 21 GLY HA2 1 22 ASP H . . 3.280 2.627 2.490 3.011 . 0 0 "[ . 1 . 2]" 1
727 1 21 GLY HA2 1 22 ASP QB . . 4.730 3.947 3.537 4.428 . 0 0 "[ . 1 . 2]" 1
728 1 21 GLY HA2 1 23 SER H . . 4.660 4.405 4.068 4.736 0.076 18 0 "[ . 1 . 2]" 1
729 1 21 GLY HA2 1 27 ALA MB . . 5.410 4.545 4.076 5.134 . 0 0 "[ . 1 . 2]" 1
730 1 21 GLY HA3 1 22 ASP H . . 3.320 2.555 2.222 3.353 0.033 2 0 "[ . 1 . 2]" 1
731 1 21 GLY HA3 1 22 ASP HA . . 4.450 4.549 4.399 5.209 0.759 2 1 "[ + . 1 . 2]" 1
732 1 21 GLY HA3 1 22 ASP QB . . 4.900 4.484 4.107 4.851 . 0 0 "[ . 1 . 2]" 1
733 1 21 GLY HA3 1 26 GLU HB2 . . 5.210 2.921 2.348 3.371 . 0 0 "[ . 1 . 2]" 1
734 1 21 GLY HA3 1 26 GLU HB3 . . 4.630 2.622 2.080 3.147 . 0 0 "[ . 1 . 2]" 1
735 1 21 GLY HA3 1 26 GLU QG . . 4.550 3.979 3.361 4.357 . 0 0 "[ . 1 . 2]" 1
736 1 21 GLY HA3 1 27 ALA MB . . 4.850 3.446 2.563 4.207 . 0 0 "[ . 1 . 2]" 1
737 1 22 ASP H 1 22 ASP QB . . 3.300 2.428 2.144 3.293 . 0 0 "[ . 1 . 2]" 1
738 1 22 ASP H 1 23 SER H . . 3.170 2.439 1.767 3.196 0.026 2 0 "[ . 1 . 2]" 1
739 1 22 ASP H 1 26 GLU HB2 . . 4.420 3.498 2.388 4.477 0.057 2 0 "[ . 1 . 2]" 1
740 1 22 ASP H 1 26 GLU QG . . 5.500 3.721 2.987 5.279 . 0 0 "[ . 1 . 2]" 1
741 1 22 ASP H 1 27 ALA MB . . 5.500 4.646 3.485 5.254 . 0 0 "[ . 1 . 2]" 1
742 1 22 ASP HA 1 56 PRO QD . . 3.620 3.169 2.719 3.432 . 0 0 "[ . 1 . 2]" 1
743 1 22 ASP HA 1 56 PRO HG3 . . 4.920 3.205 2.308 4.438 . 0 0 "[ . 1 . 2]" 1
744 1 22 ASP QB 1 23 SER H . . 3.880 3.473 2.953 3.945 0.065 1 0 "[ . 1 . 2]" 1
745 1 23 SER H 1 23 SER HB2 . . 3.690 2.738 2.407 3.139 . 0 0 "[ . 1 . 2]" 1
746 1 23 SER H 1 24 VAL H . . 4.910 4.451 4.233 4.553 . 0 0 "[ . 1 . 2]" 1
747 1 23 SER H 1 24 VAL HA . . 5.440 5.054 4.539 5.407 . 0 0 "[ . 1 . 2]" 1
748 1 23 SER H 1 26 GLU HB2 . . 3.550 2.369 1.962 2.597 . 0 0 "[ . 1 . 2]" 1
749 1 23 SER H 1 26 GLU HB3 . . 3.780 3.707 3.335 3.861 0.081 4 0 "[ . 1 . 2]" 1
750 1 23 SER H 1 26 GLU QG . . 5.070 3.101 2.411 3.739 . 0 0 "[ . 1 . 2]" 1
751 1 23 SER H 1 27 ALA H . . 4.200 3.617 3.201 4.001 . 0 0 "[ . 1 . 2]" 1
752 1 23 SER H 1 27 ALA MB . . 4.870 3.894 3.397 4.488 . 0 0 "[ . 1 . 2]" 1
753 1 23 SER H 1 56 PRO QD . . 5.350 4.530 4.213 4.803 . 0 0 "[ . 1 . 2]" 1
754 1 23 SER H 1 56 PRO HG2 . . 5.260 3.962 3.144 4.707 . 0 0 "[ . 1 . 2]" 1
755 1 23 SER H 1 56 PRO HG3 . . 4.120 3.042 2.439 4.073 . 0 0 "[ . 1 . 2]" 1
756 1 23 SER HA 1 23 SER HB2 . . 2.980 3.018 2.941 3.041 0.061 10 0 "[ . 1 . 2]" 1
757 1 23 SER HA 1 23 SER HB3 . . 3.010 2.518 2.255 2.760 . 0 0 "[ . 1 . 2]" 1
758 1 23 SER HA 1 24 VAL H . . 2.930 2.404 2.249 2.627 . 0 0 "[ . 1 . 2]" 1
759 1 23 SER HA 1 24 VAL HA . . 4.390 4.302 4.162 4.453 0.063 6 0 "[ . 1 . 2]" 1
760 1 23 SER HA 1 26 GLU QG . . 5.100 4.613 4.084 5.023 . 0 0 "[ . 1 . 2]" 1
761 1 23 SER HA 1 56 PRO HG3 . . 4.280 2.984 2.413 3.375 . 0 0 "[ . 1 . 2]" 1
762 1 23 SER HB2 1 24 VAL H . . 4.170 3.778 3.220 4.230 0.060 14 0 "[ . 1 . 2]" 1
763 1 23 SER HB2 1 25 GLU H . . 4.570 3.949 2.957 4.388 . 0 0 "[ . 1 . 2]" 1
764 1 23 SER HB2 1 25 GLU HB2 . . 4.740 4.457 3.591 4.807 0.067 5 0 "[ . 1 . 2]" 1
765 1 23 SER HB2 1 26 GLU H . . 5.130 2.987 2.344 3.448 . 0 0 "[ . 1 . 2]" 1
766 1 23 SER HB2 1 26 GLU HB2 . . 5.110 3.056 2.477 3.746 . 0 0 "[ . 1 . 2]" 1
767 1 23 SER HB2 1 26 GLU QG . . 4.510 2.136 1.994 2.440 . 0 0 "[ . 1 . 2]" 1
768 1 23 SER HB3 1 24 VAL H . . 3.730 2.635 2.351 2.974 . 0 0 "[ . 1 . 2]" 1
769 1 23 SER HB3 1 24 VAL QG . . 5.380 3.810 2.899 4.162 . 0 0 "[ . 1 . 2]" 1
770 1 23 SER HB3 1 25 GLU H . . 4.040 3.219 2.342 3.687 . 0 0 "[ . 1 . 2]" 1
771 1 23 SER HB3 1 25 GLU HB2 . . 4.480 4.128 2.945 4.556 0.076 13 0 "[ . 1 . 2]" 1
772 1 23 SER HB3 1 26 GLU H . . 4.910 3.520 2.320 4.079 . 0 0 "[ . 1 . 2]" 1
773 1 23 SER HB3 1 56 PRO HG3 . . 5.420 5.068 4.744 5.322 . 0 0 "[ . 1 . 2]" 1
774 1 24 VAL H 1 24 VAL HB . . 3.360 2.910 2.264 3.458 0.098 20 0 "[ . 1 . 2]" 1
775 1 24 VAL H 1 24 VAL QG . . 3.450 1.915 1.733 2.193 . 0 0 "[ . 1 . 2]" 1
776 1 24 VAL H 1 25 GLU H . . 3.940 2.838 2.616 3.003 . 0 0 "[ . 1 . 2]" 1
777 1 24 VAL H 1 26 GLU H . . 5.500 4.170 3.910 4.370 . 0 0 "[ . 1 . 2]" 1
778 1 24 VAL H 1 56 PRO HB3 . . 5.500 3.149 2.757 3.656 . 0 0 "[ . 1 . 2]" 1
779 1 24 VAL H 1 56 PRO HG2 . . 5.500 5.320 4.544 5.580 0.080 7 0 "[ . 1 . 2]" 1
780 1 24 VAL H 1 56 PRO HG3 . . 5.020 4.030 3.549 4.350 . 0 0 "[ . 1 . 2]" 1
781 1 24 VAL HA 1 24 VAL QG . . 3.300 2.250 2.044 2.655 . 0 0 "[ . 1 . 2]" 1
782 1 24 VAL HA 1 26 GLU H . . 5.220 4.360 4.096 4.731 . 0 0 "[ . 1 . 2]" 1
783 1 24 VAL HA 1 27 ALA H . . 4.220 3.696 3.335 4.059 . 0 0 "[ . 1 . 2]" 1
784 1 24 VAL HA 1 27 ALA MB . . 3.510 2.976 2.427 3.485 . 0 0 "[ . 1 . 2]" 1
785 1 24 VAL HA 1 28 LEU H . . 4.640 3.916 3.543 4.183 . 0 0 "[ . 1 . 2]" 1
786 1 24 VAL HA 1 56 PRO HB2 . . 4.210 2.214 1.964 3.005 . 0 0 "[ . 1 . 2]" 1
787 1 24 VAL HA 1 56 PRO HB3 . . 4.520 2.342 2.046 2.607 . 0 0 "[ . 1 . 2]" 1
788 1 24 VAL HA 1 56 PRO HG2 . . 4.450 4.198 3.808 4.487 0.037 7 0 "[ . 1 . 2]" 1
789 1 24 VAL HA 1 56 PRO HG3 . . 4.060 3.837 3.382 4.122 0.062 7 0 "[ . 1 . 2]" 1
790 1 24 VAL HA 1 79 ALA MB . . 4.040 2.813 2.461 3.219 . 0 0 "[ . 1 . 2]" 1
791 1 24 VAL HA 1 80 GLU H . . 5.500 4.782 4.223 5.557 0.057 4 0 "[ . 1 . 2]" 1
792 1 24 VAL HA 1 81 MET HA . . 5.090 5.033 4.603 5.167 0.077 4 0 "[ . 1 . 2]" 1
793 1 24 VAL HB 1 25 GLU HA . . 5.500 4.495 3.856 5.559 0.059 11 0 "[ . 1 . 2]" 1
794 1 24 VAL HB 1 25 GLU HG3 . . 5.500 4.381 2.935 6.236 0.736 4 2 "[ +. 1- . 2]" 1
795 1 24 VAL HB 1 79 ALA MB . . 4.200 3.421 2.030 4.303 0.103 16 0 "[ . 1 . 2]" 1
796 1 24 VAL HB 1 80 GLU HA . . 5.210 4.777 3.597 5.305 0.095 3 0 "[ . 1 . 2]" 1
797 1 24 VAL QG 1 25 GLU H . . 3.850 2.718 1.948 3.253 . 0 0 "[ . 1 . 2]" 1
798 1 24 VAL QG 1 25 GLU HA . . 5.110 3.189 2.905 3.970 . 0 0 "[ . 1 . 2]" 1
799 1 24 VAL QG 1 25 GLU HB2 . . 5.500 4.158 3.226 4.919 . 0 0 "[ . 1 . 2]" 1
800 1 24 VAL QG 1 25 GLU HG2 . . 5.500 3.332 2.538 4.424 . 0 0 "[ . 1 . 2]" 1
801 1 24 VAL QG 1 25 GLU HG3 . . 5.000 3.200 2.216 4.227 . 0 0 "[ . 1 . 2]" 1
802 1 24 VAL QG 1 28 LEU H . . 4.960 4.130 3.621 4.697 . 0 0 "[ . 1 . 2]" 1
803 1 24 VAL QG 1 56 PRO HB2 . . 4.540 3.315 2.954 4.014 . 0 0 "[ . 1 . 2]" 1
804 1 24 VAL QG 1 56 PRO HB3 . . 4.470 2.518 2.155 3.401 . 0 0 "[ . 1 . 2]" 1
805 1 24 VAL QG 1 56 PRO QD . . 5.500 4.417 4.002 4.969 . 0 0 "[ . 1 . 2]" 1
806 1 24 VAL QG 1 56 PRO HG3 . . 4.990 4.135 3.305 4.786 . 0 0 "[ . 1 . 2]" 1
807 1 24 VAL QG 1 79 ALA H . . 5.500 4.002 3.298 4.862 . 0 0 "[ . 1 . 2]" 1
808 1 24 VAL QG 1 79 ALA MB . . 3.180 2.117 1.879 2.797 . 0 0 "[ . 1 . 2]" 1
809 1 24 VAL QG 1 80 GLU H . . 5.050 3.355 2.747 4.309 . 0 0 "[ . 1 . 2]" 1
810 1 24 VAL QG 1 80 GLU HA . . 4.510 2.874 2.359 3.775 . 0 0 "[ . 1 . 2]" 1
811 1 24 VAL QG 1 81 MET H . . 5.500 2.728 2.176 3.463 . 0 0 "[ . 1 . 2]" 1
812 1 24 VAL QG 1 81 MET HA . . 4.760 3.062 2.192 4.070 . 0 0 "[ . 1 . 2]" 1
813 1 24 VAL QG 1 81 MET HB2 . . 5.310 3.040 2.140 3.845 . 0 0 "[ . 1 . 2]" 1
814 1 24 VAL QG 1 81 MET HB3 . . 4.650 2.480 1.946 3.731 . 0 0 "[ . 1 . 2]" 1
815 1 24 VAL QG 1 81 MET ME . . 3.870 3.295 2.339 3.923 0.053 11 0 "[ . 1 . 2]" 1
816 1 25 GLU H 1 25 GLU HB2 . . 2.980 2.298 2.062 2.524 . 0 0 "[ . 1 . 2]" 1
817 1 25 GLU H 1 25 GLU HG2 . . 4.020 3.367 2.603 3.958 . 0 0 "[ . 1 . 2]" 1
818 1 25 GLU H 1 25 GLU HG3 . . 3.900 2.684 2.343 3.203 . 0 0 "[ . 1 . 2]" 1
819 1 25 GLU H 1 26 GLU H . . 3.460 2.636 2.518 2.775 . 0 0 "[ . 1 . 2]" 1
820 1 25 GLU H 1 27 ALA MB . . 5.500 5.136 4.922 5.349 . 0 0 "[ . 1 . 2]" 1
821 1 25 GLU H 1 28 LEU H . . 5.500 4.849 4.640 5.072 . 0 0 "[ . 1 . 2]" 1
822 1 25 GLU H 1 79 ALA MB . . 5.500 4.813 4.385 5.225 . 0 0 "[ . 1 . 2]" 1
823 1 25 GLU HA 1 25 GLU HG2 . . 3.710 2.301 2.164 2.633 . 0 0 "[ . 1 . 2]" 1
824 1 25 GLU HA 1 25 GLU HG3 . . 3.520 3.153 2.579 3.601 0.081 4 0 "[ . 1 . 2]" 1
825 1 25 GLU HA 1 26 GLU HA . . 5.150 4.914 4.773 4.997 . 0 0 "[ . 1 . 2]" 1
826 1 25 GLU HA 1 27 ALA H . . 4.860 4.661 4.516 4.798 . 0 0 "[ . 1 . 2]" 1
827 1 25 GLU HA 1 28 LEU H . . 4.110 3.537 3.197 3.813 . 0 0 "[ . 1 . 2]" 1
828 1 25 GLU HA 1 28 LEU QB . . 3.860 2.722 2.222 3.138 . 0 0 "[ . 1 . 2]" 1
829 1 25 GLU HA 1 28 LEU MD1 . . 3.970 3.635 3.019 4.407 0.437 16 0 "[ . 1 . 2]" 1
830 1 25 GLU HB2 1 25 GLU HG3 . . 3.000 2.376 2.248 2.586 . 0 0 "[ . 1 . 2]" 1
831 1 25 GLU HB2 1 26 GLU H . . 2.990 2.964 2.675 3.077 0.087 15 0 "[ . 1 . 2]" 1
832 1 25 GLU HB3 1 26 GLU H . . 3.810 3.697 3.356 3.889 0.079 4 0 "[ . 1 . 2]" 1
833 1 25 GLU HG3 1 28 LEU QB . . 5.150 5.297 4.417 5.971 0.821 11 7 "[ * *.* *+ - . *2]" 1
834 1 26 GLU H 1 26 GLU HB2 . . 3.350 2.510 2.370 2.721 . 0 0 "[ . 1 . 2]" 1
835 1 26 GLU H 1 26 GLU QG . . 3.910 2.375 2.092 3.215 . 0 0 "[ . 1 . 2]" 1
836 1 26 GLU H 1 27 ALA H . . 3.180 2.733 2.562 2.997 . 0 0 "[ . 1 . 2]" 1
837 1 26 GLU H 1 27 ALA MB . . 4.410 4.336 4.127 4.498 0.088 15 0 "[ . 1 . 2]" 1
838 1 26 GLU H 1 28 LEU H . . 4.680 4.162 3.853 4.452 . 0 0 "[ . 1 . 2]" 1
839 1 26 GLU HA 1 26 GLU QG . . 3.650 2.827 2.326 3.224 . 0 0 "[ . 1 . 2]" 1
840 1 26 GLU HA 1 27 ALA MB . . 5.500 5.019 4.979 5.097 . 0 0 "[ . 1 . 2]" 1
841 1 26 GLU HA 1 28 LEU H . . 4.970 4.751 4.534 4.984 0.014 11 0 "[ . 1 . 2]" 1
842 1 26 GLU HB2 1 27 ALA H . . 3.600 2.204 2.056 2.287 . 0 0 "[ . 1 . 2]" 1
843 1 26 GLU HB2 1 27 ALA MB . . 5.500 3.576 3.323 3.844 . 0 0 "[ . 1 . 2]" 1
844 1 26 GLU HB2 1 56 PRO HB2 . . 5.490 5.323 5.031 5.556 0.066 6 0 "[ . 1 . 2]" 1
845 1 26 GLU HB2 1 56 PRO HG2 . . 4.950 4.991 4.334 5.040 0.090 13 0 "[ . 1 . 2]" 1
846 1 26 GLU HB2 1 56 PRO HG3 . . 5.300 4.600 4.179 5.364 0.064 18 0 "[ . 1 . 2]" 1
847 1 26 GLU HB3 1 27 ALA H . . 3.720 3.231 3.053 3.440 . 0 0 "[ . 1 . 2]" 1
848 1 26 GLU HB3 1 27 ALA MB . . 5.370 4.320 4.152 4.652 . 0 0 "[ . 1 . 2]" 1
849 1 26 GLU QG 1 27 ALA H . . 4.900 3.891 3.616 4.173 . 0 0 "[ . 1 . 2]" 1
850 1 27 ALA H 1 27 ALA MB . . 3.080 2.181 2.135 2.226 . 0 0 "[ . 1 . 2]" 1
851 1 27 ALA H 1 28 LEU H . . 3.390 2.850 2.695 3.075 . 0 0 "[ . 1 . 2]" 1
852 1 27 ALA H 1 28 LEU QB . . 5.170 4.459 4.356 4.587 . 0 0 "[ . 1 . 2]" 1
853 1 27 ALA H 1 58 VAL QG . . 5.250 4.373 4.112 4.906 . 0 0 "[ . 1 . 2]" 1
854 1 27 ALA H 1 79 ALA MB . . 5.500 4.724 4.419 5.013 . 0 0 "[ . 1 . 2]" 1
855 1 27 ALA HA 1 29 SER H . . 4.800 4.371 4.182 4.617 . 0 0 "[ . 1 . 2]" 1
856 1 27 ALA HA 1 30 GLU HB2 . . 4.050 2.624 2.328 2.779 . 0 0 "[ . 1 . 2]" 1
857 1 27 ALA HA 1 30 GLU HB3 . . 4.270 4.147 3.689 4.353 0.083 3 0 "[ . 1 . 2]" 1
858 1 27 ALA HA 1 30 GLU QG . . 5.060 2.927 2.404 3.306 . 0 0 "[ . 1 . 2]" 1
859 1 27 ALA HA 1 31 ALA H . . 5.280 3.770 3.576 3.913 . 0 0 "[ . 1 . 2]" 1
860 1 27 ALA HA 1 31 ALA MB . . 5.450 4.300 4.076 4.516 . 0 0 "[ . 1 . 2]" 1
861 1 27 ALA HA 1 58 VAL QG . . 4.840 3.511 3.232 3.846 . 0 0 "[ . 1 . 2]" 1
862 1 27 ALA HA 1 79 ALA MB . . 5.500 5.450 5.171 5.606 0.106 14 0 "[ . 1 . 2]" 1
863 1 27 ALA MB 1 28 LEU H . . 3.470 2.596 2.504 2.736 . 0 0 "[ . 1 . 2]" 1
864 1 27 ALA MB 1 28 LEU HA . . 5.100 3.962 3.808 4.097 . 0 0 "[ . 1 . 2]" 1
865 1 27 ALA MB 1 28 LEU QB . . 5.370 3.905 3.796 4.077 . 0 0 "[ . 1 . 2]" 1
866 1 27 ALA MB 1 29 SER H . . 5.500 4.619 4.484 4.786 . 0 0 "[ . 1 . 2]" 1
867 1 27 ALA MB 1 30 GLU HB2 . . 5.500 4.146 3.850 4.306 . 0 0 "[ . 1 . 2]" 1
868 1 27 ALA MB 1 31 ALA H . . 5.500 4.478 4.287 4.623 . 0 0 "[ . 1 . 2]" 1
869 1 27 ALA MB 1 31 ALA MB . . 4.640 3.935 3.700 4.114 . 0 0 "[ . 1 . 2]" 1
870 1 27 ALA MB 1 56 PRO HB2 . . 3.940 2.250 2.063 2.479 . 0 0 "[ . 1 . 2]" 1
871 1 27 ALA MB 1 56 PRO QD . . 4.430 4.038 3.765 4.218 . 0 0 "[ . 1 . 2]" 1
872 1 27 ALA MB 1 56 PRO HG2 . . 3.830 2.426 2.160 3.478 . 0 0 "[ . 1 . 2]" 1
873 1 27 ALA MB 1 58 VAL HB . . 5.500 4.133 2.424 4.390 . 0 0 "[ . 1 . 2]" 1
874 1 27 ALA MB 1 58 VAL QG . . 3.320 1.995 1.876 2.283 . 0 0 "[ . 1 . 2]" 1
875 1 27 ALA MB 1 79 ALA MB . . 4.250 3.131 2.827 3.452 . 0 0 "[ . 1 . 2]" 1
876 1 28 LEU H 1 28 LEU QB . . 3.100 2.033 1.894 2.089 . 0 0 "[ . 1 . 2]" 1
877 1 28 LEU H 1 28 LEU MD1 . . 4.360 4.041 3.659 4.165 . 0 0 "[ . 1 . 2]" 1
878 1 28 LEU H 1 28 LEU MD2 . . 4.380 4.300 4.195 4.349 . 0 0 "[ . 1 . 2]" 1
879 1 28 LEU H 1 28 LEU HG . . 3.820 3.893 3.870 3.928 0.108 16 0 "[ . 1 . 2]" 1
880 1 28 LEU H 1 29 SER H . . 3.310 2.833 2.705 3.018 . 0 0 "[ . 1 . 2]" 1
881 1 28 LEU H 1 31 ALA H . . 5.500 4.737 4.660 4.923 . 0 0 "[ . 1 . 2]" 1
882 1 28 LEU H 1 79 ALA MB . . 4.630 3.170 2.788 3.427 . 0 0 "[ . 1 . 2]" 1
883 1 28 LEU HA 1 28 LEU MD1 . . 3.940 3.684 2.758 3.834 . 0 0 "[ . 1 . 2]" 1
884 1 28 LEU HA 1 28 LEU MD2 . . 3.090 2.473 2.202 3.641 0.551 16 1 "[ . 1 .+ 2]" 1
885 1 28 LEU HA 1 28 LEU HG . . 4.000 2.399 2.031 2.517 . 0 0 "[ . 1 . 2]" 1
886 1 28 LEU HA 1 29 SER HA . . 5.090 4.831 4.745 4.918 . 0 0 "[ . 1 . 2]" 1
887 1 28 LEU HA 1 30 GLU H . . 4.960 4.820 4.632 5.007 0.047 2 0 "[ . 1 . 2]" 1
888 1 28 LEU HA 1 31 ALA H . . 4.050 3.715 3.400 4.046 . 0 0 "[ . 1 . 2]" 1
889 1 28 LEU HA 1 31 ALA MB . . 3.460 2.642 2.275 3.069 . 0 0 "[ . 1 . 2]" 1
890 1 28 LEU HA 1 32 ARG H . . 4.980 4.270 4.029 4.748 . 0 0 "[ . 1 . 2]" 1
891 1 28 LEU HA 1 58 VAL QG . . 3.970 2.423 2.061 2.893 . 0 0 "[ . 1 . 2]" 1
892 1 28 LEU HA 1 77 LEU MD2 . . 5.500 3.986 2.832 5.503 0.003 10 0 "[ . 1 . 2]" 1
893 1 28 LEU HA 1 79 ALA MB . . 4.820 3.200 2.778 3.495 . 0 0 "[ . 1 . 2]" 1
894 1 28 LEU QB 1 28 LEU MD1 . . 3.230 2.100 2.064 2.170 . 0 0 "[ . 1 . 2]" 1
895 1 28 LEU QB 1 28 LEU MD2 . . 3.130 2.387 2.165 2.475 . 0 0 "[ . 1 . 2]" 1
896 1 28 LEU QB 1 29 SER H . . 3.540 2.658 2.432 2.883 . 0 0 "[ . 1 . 2]" 1
897 1 28 LEU QB 1 29 SER HA . . 4.980 3.941 3.822 4.077 . 0 0 "[ . 1 . 2]" 1
898 1 28 LEU QB 1 79 ALA MB . . 3.860 2.423 2.125 2.619 . 0 0 "[ . 1 . 2]" 1
899 1 28 LEU MD1 1 29 SER H . . 4.870 4.743 4.545 4.942 0.072 20 0 "[ . 1 . 2]" 1
900 1 28 LEU MD1 1 79 ALA H . . 4.460 3.180 2.324 4.064 . 0 0 "[ . 1 . 2]" 1
901 1 28 LEU MD1 1 79 ALA MB . . 3.870 2.258 1.990 2.716 . 0 0 "[ . 1 . 2]" 1
902 1 28 LEU MD2 1 29 SER H . . 5.420 4.069 3.741 4.282 . 0 0 "[ . 1 . 2]" 1
903 1 28 LEU MD2 1 29 SER HA . . 5.500 3.878 3.323 4.221 . 0 0 "[ . 1 . 2]" 1
904 1 28 LEU MD2 1 77 LEU H . . 5.340 4.727 4.359 5.354 0.014 7 0 "[ . 1 . 2]" 1
905 1 28 LEU MD2 1 77 LEU HA . . 4.960 4.404 3.864 5.425 0.465 7 0 "[ . 1 . 2]" 1
906 1 28 LEU MD2 1 77 LEU HB2 . . 4.190 3.050 2.469 3.702 . 0 0 "[ . 1 . 2]" 1
907 1 28 LEU MD2 1 77 LEU HB3 . . 3.480 2.362 2.063 3.615 0.135 7 0 "[ . 1 . 2]" 1
908 1 28 LEU MD2 1 79 ALA MB . . 3.510 3.632 3.531 3.975 0.465 7 0 "[ . 1 . 2]" 1
909 1 28 LEU HG 1 29 SER H . . 5.170 5.040 4.202 5.231 0.061 20 0 "[ . 1 . 2]" 1
910 1 28 LEU HG 1 78 VAL HA . . 5.130 3.973 3.406 4.850 . 0 0 "[ . 1 . 2]" 1
911 1 28 LEU HG 1 79 ALA MB . . 3.620 2.341 2.110 3.734 0.114 16 0 "[ . 1 . 2]" 1
912 1 29 SER H 1 29 SER QB . . 2.970 2.250 2.041 2.495 . 0 0 "[ . 1 . 2]" 1
913 1 29 SER H 1 30 GLU H . . 3.250 2.625 2.400 2.875 . 0 0 "[ . 1 . 2]" 1
914 1 29 SER H 1 30 GLU QG . . 5.220 4.251 3.934 4.570 . 0 0 "[ . 1 . 2]" 1
915 1 29 SER H 1 31 ALA H . . 4.590 4.006 3.839 4.155 . 0 0 "[ . 1 . 2]" 1
916 1 29 SER HA 1 31 ALA H . . 5.500 4.514 4.353 4.693 . 0 0 "[ . 1 . 2]" 1
917 1 29 SER HA 1 31 ALA MB . . 5.190 4.782 4.494 4.968 . 0 0 "[ . 1 . 2]" 1
918 1 29 SER HA 1 32 ARG H . . 4.170 3.675 3.358 3.997 . 0 0 "[ . 1 . 2]" 1
919 1 29 SER HA 1 32 ARG QB . . 4.190 3.133 2.577 4.057 . 0 0 "[ . 1 . 2]" 1
920 1 29 SER HA 1 32 ARG QD . . 4.020 3.084 2.147 3.877 . 0 0 "[ . 1 . 2]" 1
921 1 29 SER QB 1 30 GLU H . . 3.560 2.334 2.148 2.757 . 0 0 "[ . 1 . 2]" 1
922 1 29 SER QB 1 30 GLU HB3 . . 5.090 5.218 5.163 5.651 0.561 6 1 "[ .+ 1 . 2]" 1
923 1 29 SER QB 1 30 GLU QG . . 5.330 3.239 2.812 3.907 . 0 0 "[ . 1 . 2]" 1
924 1 29 SER QB 1 32 ARG H . . 5.500 5.069 4.868 5.375 . 0 0 "[ . 1 . 2]" 1
925 1 30 GLU H 1 30 GLU HB2 . . 3.440 2.355 2.200 2.608 . 0 0 "[ . 1 . 2]" 1
926 1 30 GLU H 1 30 GLU HB3 . . 3.790 3.498 3.433 3.583 . 0 0 "[ . 1 . 2]" 1
927 1 30 GLU H 1 30 GLU QG . . 3.660 2.255 2.087 2.533 . 0 0 "[ . 1 . 2]" 1
928 1 30 GLU H 1 31 ALA H . . 3.520 2.752 2.619 2.876 . 0 0 "[ . 1 . 2]" 1
929 1 30 GLU H 1 31 ALA MB . . 4.970 4.316 4.141 4.461 . 0 0 "[ . 1 . 2]" 1
930 1 30 GLU H 1 32 ARG H . . 5.060 4.458 4.315 4.628 . 0 0 "[ . 1 . 2]" 1
931 1 30 GLU HA 1 30 GLU QG . . 3.760 2.911 2.514 3.351 . 0 0 "[ . 1 . 2]" 1
932 1 30 GLU HA 1 31 ALA MB . . 5.500 5.011 4.946 5.068 . 0 0 "[ . 1 . 2]" 1
933 1 30 GLU HA 1 32 ARG H . . 5.500 4.663 4.488 4.820 . 0 0 "[ . 1 . 2]" 1
934 1 30 GLU HA 1 33 GLU H . . 3.650 3.283 3.068 3.404 . 0 0 "[ . 1 . 2]" 1
935 1 30 GLU HA 1 33 GLU HB2 . . 3.790 2.982 2.146 3.874 0.084 10 0 "[ . 1 . 2]" 1
936 1 30 GLU HA 1 33 GLU HB3 . . 3.530 2.921 2.280 3.854 0.324 8 0 "[ . 1 . 2]" 1
937 1 30 GLU HA 1 33 GLU QG . . 4.540 3.685 2.570 4.190 . 0 0 "[ . 1 . 2]" 1
938 1 30 GLU HA 1 34 HIS H . . 4.660 4.062 3.838 4.398 . 0 0 "[ . 1 . 2]" 1
939 1 30 GLU HB2 1 31 ALA H . . 3.900 2.421 2.260 2.655 . 0 0 "[ . 1 . 2]" 1
940 1 30 GLU HB3 1 31 ALA H . . 4.150 3.473 3.209 3.769 . 0 0 "[ . 1 . 2]" 1
941 1 30 GLU HB3 1 33 GLU H . . 5.070 5.048 4.904 5.136 0.066 8 0 "[ . 1 . 2]" 1
942 1 30 GLU QG 1 31 ALA H . . 4.970 3.977 3.891 4.074 . 0 0 "[ . 1 . 2]" 1
943 1 30 GLU QG 1 31 ALA MB . . 5.500 5.112 4.979 5.226 . 0 0 "[ . 1 . 2]" 1
944 1 31 ALA H 1 31 ALA MB . . 3.130 2.168 2.103 2.281 . 0 0 "[ . 1 . 2]" 1
945 1 31 ALA H 1 32 ARG H . . 3.540 2.914 2.800 3.057 . 0 0 "[ . 1 . 2]" 1
946 1 31 ALA H 1 33 GLU H . . 4.370 4.041 3.848 4.199 . 0 0 "[ . 1 . 2]" 1
947 1 31 ALA H 1 58 VAL QG . . 4.450 3.553 3.361 3.746 . 0 0 "[ . 1 . 2]" 1
948 1 31 ALA H 1 77 LEU MD2 . . 5.500 5.086 4.361 6.087 0.587 10 1 "[ . + . 2]" 1
949 1 31 ALA HA 1 32 ARG HA . . 5.340 4.823 4.698 4.950 . 0 0 "[ . 1 . 2]" 1
950 1 31 ALA HA 1 33 GLU H . . 4.470 4.220 3.912 4.427 . 0 0 "[ . 1 . 2]" 1
951 1 31 ALA HA 1 34 HIS H . . 4.180 3.321 3.147 3.584 . 0 0 "[ . 1 . 2]" 1
952 1 31 ALA HA 1 34 HIS QB . . 3.870 2.822 2.464 3.895 0.025 11 0 "[ . 1 . 2]" 1
953 1 31 ALA HA 1 35 LEU H . . 4.870 3.836 3.697 4.042 . 0 0 "[ . 1 . 2]" 1
954 1 31 ALA HA 1 35 LEU QD . . 5.500 3.706 2.921 4.656 . 0 0 "[ . 1 . 2]" 1
955 1 31 ALA HA 1 35 LEU HG . . 5.470 4.369 3.590 5.549 0.079 15 0 "[ . 1 . 2]" 1
956 1 31 ALA HA 1 77 LEU MD1 . . 4.940 4.892 4.036 5.054 0.114 17 0 "[ . 1 . 2]" 1
957 1 31 ALA MB 1 32 ARG H . . 3.520 2.394 2.238 2.593 . 0 0 "[ . 1 . 2]" 1
958 1 31 ALA MB 1 32 ARG QB . . 5.460 4.035 3.536 4.431 . 0 0 "[ . 1 . 2]" 1
959 1 31 ALA MB 1 33 GLU H . . 4.840 4.362 4.158 4.530 . 0 0 "[ . 1 . 2]" 1
960 1 31 ALA MB 1 34 HIS H . . 5.350 4.537 4.377 4.682 . 0 0 "[ . 1 . 2]" 1
961 1 31 ALA MB 1 34 HIS QB . . 4.920 4.262 4.028 5.072 0.152 11 0 "[ . 1 . 2]" 1
962 1 31 ALA MB 1 58 VAL HA . . 5.420 4.881 4.597 5.179 . 0 0 "[ . 1 . 2]" 1
963 1 31 ALA MB 1 58 VAL HB . . 4.400 3.413 3.115 3.728 . 0 0 "[ . 1 . 2]" 1
964 1 31 ALA MB 1 77 LEU HA . . 5.230 5.252 4.898 5.337 0.107 1 0 "[ . 1 . 2]" 1
965 1 31 ALA MB 1 77 LEU MD2 . . 4.120 2.388 1.997 3.179 . 0 0 "[ . 1 . 2]" 1
966 1 32 ARG H 1 32 ARG QB . . 3.260 2.283 1.926 2.580 . 0 0 "[ . 1 . 2]" 1
967 1 32 ARG H 1 32 ARG QD . . 5.010 3.644 2.498 4.300 . 0 0 "[ . 1 . 2]" 1
968 1 32 ARG H 1 32 ARG QG . . 4.100 2.965 2.090 3.996 . 0 0 "[ . 1 . 2]" 1
969 1 32 ARG H 1 33 GLU H . . 3.540 2.788 2.656 3.017 . 0 0 "[ . 1 . 2]" 1
970 1 32 ARG H 1 34 HIS H . . 4.990 4.347 4.172 4.583 . 0 0 "[ . 1 . 2]" 1
971 1 32 ARG H 1 35 LEU H . . 5.500 4.807 4.693 4.899 . 0 0 "[ . 1 . 2]" 1
972 1 32 ARG H 1 77 LEU MD2 . . 5.240 4.131 3.406 4.836 . 0 0 "[ . 1 . 2]" 1
973 1 32 ARG HA 1 32 ARG QD . . 4.610 4.078 3.822 4.301 . 0 0 "[ . 1 . 2]" 1
974 1 32 ARG HA 1 32 ARG QG . . 3.550 2.513 2.118 3.426 . 0 0 "[ . 1 . 2]" 1
975 1 32 ARG HA 1 33 GLU HA . . 4.560 4.644 4.637 4.653 0.093 17 0 "[ . 1 . 2]" 1
976 1 32 ARG HA 1 34 HIS H . . 4.970 4.534 4.138 4.840 . 0 0 "[ . 1 . 2]" 1
977 1 32 ARG HA 1 35 LEU H . . 3.990 3.661 3.470 3.946 . 0 0 "[ . 1 . 2]" 1
978 1 32 ARG HA 1 35 LEU HA . . 5.500 5.492 5.336 5.575 0.075 12 0 "[ . 1 . 2]" 1
979 1 32 ARG HA 1 35 LEU HB2 . . 3.180 2.584 2.338 2.728 . 0 0 "[ . 1 . 2]" 1
980 1 32 ARG HA 1 35 LEU HB3 . . 4.080 4.084 3.809 4.161 0.081 2 0 "[ . 1 . 2]" 1
981 1 32 ARG HA 1 35 LEU QD . . 3.380 2.426 2.080 2.761 . 0 0 "[ . 1 . 2]" 1
982 1 32 ARG HA 1 36 LYS H . . 4.940 4.241 3.998 4.535 . 0 0 "[ . 1 . 2]" 1
983 1 32 ARG HA 1 77 LEU MD1 . . 4.350 2.756 2.268 4.284 . 0 0 "[ . 1 . 2]" 1
984 1 32 ARG HA 1 77 LEU MD2 . . 4.200 4.197 3.927 4.305 0.105 17 0 "[ . 1 . 2]" 1
985 1 32 ARG QB 1 33 GLU H . . 3.800 2.877 2.424 3.533 . 0 0 "[ . 1 . 2]" 1
986 1 32 ARG QB 1 77 LEU MD1 . . 5.500 3.162 2.119 4.785 . 0 0 "[ . 1 . 2]" 1
987 1 32 ARG QG 1 33 GLU H . . 5.500 4.114 2.351 4.609 . 0 0 "[ . 1 . 2]" 1
988 1 32 ARG QG 1 77 LEU MD1 . . 4.380 2.427 1.859 4.018 . 0 0 "[ . 1 . 2]" 1
989 1 33 GLU H 1 33 GLU HB2 . . 3.330 2.447 1.924 3.307 . 0 0 "[ . 1 . 2]" 1
990 1 33 GLU H 1 33 GLU HB3 . . 3.260 2.695 1.770 3.390 0.130 5 0 "[ . 1 . 2]" 1
991 1 33 GLU H 1 33 GLU QG . . 3.640 3.336 2.803 3.537 . 0 0 "[ . 1 . 2]" 1
992 1 33 GLU H 1 34 HIS H . . 3.220 2.639 2.285 2.872 . 0 0 "[ . 1 . 2]" 1
993 1 33 GLU H 1 34 HIS HA . . 5.500 5.255 5.019 5.425 . 0 0 "[ . 1 . 2]" 1
994 1 33 GLU H 1 35 LEU H . . 4.940 3.973 3.679 4.230 . 0 0 "[ . 1 . 2]" 1
995 1 33 GLU HA 1 33 GLU QG . . 3.880 2.527 2.030 3.231 . 0 0 "[ . 1 . 2]" 1
996 1 33 GLU HA 1 37 ASN QD . . 5.500 3.914 3.107 4.824 . 0 0 "[ . 1 . 2]" 1
997 1 33 GLU HB3 1 34 HIS H . . 3.810 3.131 2.611 3.436 . 0 0 "[ . 1 . 2]" 1
998 1 33 GLU HB3 1 37 ASN QD . . 5.320 3.892 2.629 4.872 . 0 0 "[ . 1 . 2]" 1
999 1 33 GLU QG 1 34 HIS H . . 5.020 3.777 2.530 4.553 . 0 0 "[ . 1 . 2]" 1
1000 1 33 GLU QG 1 36 LYS QE . . 5.500 4.301 3.190 5.380 . 0 0 "[ . 1 . 2]" 1
1001 1 33 GLU QG 1 37 ASN QD . . 4.730 2.995 2.117 3.908 . 0 0 "[ . 1 . 2]" 1
1002 1 34 HIS H 1 34 HIS QB . . 3.330 2.277 2.063 2.467 . 0 0 "[ . 1 . 2]" 1
1003 1 34 HIS H 1 35 LEU H . . 3.490 2.412 2.133 2.606 . 0 0 "[ . 1 . 2]" 1
1004 1 34 HIS H 1 35 LEU HB2 . . 4.680 4.391 4.039 4.712 0.032 5 0 "[ . 1 . 2]" 1
1005 1 34 HIS H 1 35 LEU QD . . 5.500 4.394 3.559 4.969 . 0 0 "[ . 1 . 2]" 1
1006 1 34 HIS H 1 35 LEU HG . . 5.500 4.881 4.398 5.599 0.099 20 0 "[ . 1 . 2]" 1
1007 1 34 HIS H 1 36 LYS H . . 5.080 4.019 3.612 4.480 . 0 0 "[ . 1 . 2]" 1
1008 1 34 HIS H 1 37 ASN H . . 5.500 4.686 4.517 4.909 . 0 0 "[ . 1 . 2]" 1
1009 1 34 HIS H 1 37 ASN HB2 . . 5.500 5.074 4.780 5.382 . 0 0 "[ . 1 . 2]" 1
1010 1 34 HIS H 1 40 CYS QB . . 5.500 4.506 4.179 5.162 . 0 0 "[ . 1 . 2]" 1
1011 1 34 HIS HA 1 34 HIS HD2 . . 4.760 3.947 3.613 4.518 . 0 0 "[ . 1 . 2]" 1
1012 1 34 HIS HA 1 36 LYS H . . 5.390 4.248 3.982 4.696 . 0 0 "[ . 1 . 2]" 1
1013 1 34 HIS HA 1 37 ASN H . . 4.000 3.208 2.974 3.563 . 0 0 "[ . 1 . 2]" 1
1014 1 34 HIS HA 1 37 ASN HB2 . . 3.840 2.388 2.033 2.703 . 0 0 "[ . 1 . 2]" 1
1015 1 34 HIS HA 1 37 ASN HB3 . . 4.310 4.028 3.649 4.379 0.069 20 0 "[ . 1 . 2]" 1
1016 1 34 HIS HA 1 37 ASN QD . . 4.820 2.525 1.882 3.195 . 0 0 "[ . 1 . 2]" 1
1017 1 34 HIS HA 1 39 THR H . . 4.720 3.427 3.185 4.338 . 0 0 "[ . 1 . 2]" 1
1018 1 34 HIS HA 1 40 CYS QB . . 5.330 4.247 3.935 5.221 . 0 0 "[ . 1 . 2]" 1
1019 1 34 HIS QB 1 35 LEU H . . 3.920 2.869 2.621 3.636 . 0 0 "[ . 1 . 2]" 1
1020 1 34 HIS QB 1 36 LYS H . . 5.500 4.881 4.703 5.364 . 0 0 "[ . 1 . 2]" 1
1021 1 34 HIS QB 1 39 THR H . . 5.260 3.603 3.158 4.550 . 0 0 "[ . 1 . 2]" 1
1022 1 34 HIS QB 1 40 CYS QB . . 4.430 2.354 2.040 4.400 . 0 0 "[ . 1 . 2]" 1
1023 1 34 HIS HD2 1 39 THR HB . . 5.100 3.467 2.352 4.779 . 0 0 "[ . 1 . 2]" 1
1024 1 34 HIS HD2 1 39 THR MG . . 5.500 4.087 2.280 5.556 0.056 12 0 "[ . 1 . 2]" 1
1025 1 34 HIS HD2 1 98 PRO HA . . 4.450 2.989 2.417 3.341 . 0 0 "[ . 1 . 2]" 1
1026 1 34 HIS HD2 1 98 PRO HB2 . . 5.160 3.696 3.184 4.472 . 0 0 "[ . 1 . 2]" 1
1027 1 34 HIS HD2 1 98 PRO HG2 . . 5.210 5.236 5.029 5.294 0.084 15 0 "[ . 1 . 2]" 1
1028 1 34 HIS HD2 1 99 HIS H . . 5.500 3.825 3.438 4.215 . 0 0 "[ . 1 . 2]" 1
1029 1 35 LEU H 1 35 LEU HB2 . . 3.240 2.327 2.201 2.426 . 0 0 "[ . 1 . 2]" 1
1030 1 35 LEU H 1 35 LEU HB3 . . 3.710 3.559 3.464 3.611 . 0 0 "[ . 1 . 2]" 1
1031 1 35 LEU H 1 35 LEU QD . . 4.280 2.962 2.299 3.294 . 0 0 "[ . 1 . 2]" 1
1032 1 35 LEU H 1 35 LEU HG . . 3.490 2.837 2.337 3.540 0.050 14 0 "[ . 1 . 2]" 1
1033 1 35 LEU H 1 36 LYS H . . 3.520 2.746 2.595 2.927 . 0 0 "[ . 1 . 2]" 1
1034 1 35 LEU H 1 37 ASN H . . 4.870 4.172 3.906 4.363 . 0 0 "[ . 1 . 2]" 1
1035 1 35 LEU H 1 38 GLY H . . 5.300 4.586 4.360 4.863 . 0 0 "[ . 1 . 2]" 1
1036 1 35 LEU H 1 40 CYS QB . . 4.660 3.410 3.160 3.915 . 0 0 "[ . 1 . 2]" 1
1037 1 35 LEU HA 1 35 LEU QD . . 3.170 2.329 2.036 2.956 . 0 0 "[ . 1 . 2]" 1
1038 1 35 LEU HA 1 35 LEU HG . . 3.930 2.679 2.055 3.148 . 0 0 "[ . 1 . 2]" 1
1039 1 35 LEU HA 1 37 ASN H . . 5.380 4.552 3.996 4.778 . 0 0 "[ . 1 . 2]" 1
1040 1 35 LEU HA 1 38 GLY H . . 3.900 3.428 3.027 3.770 . 0 0 "[ . 1 . 2]" 1
1041 1 35 LEU HA 1 39 THR H . . 4.510 4.334 3.114 4.581 0.071 3 0 "[ . 1 . 2]" 1
1042 1 35 LEU HA 1 40 CYS H . . 4.580 4.320 3.929 4.539 . 0 0 "[ . 1 . 2]" 1
1043 1 35 LEU HA 1 40 CYS HA . . 5.470 5.437 5.319 5.539 0.069 18 0 "[ . 1 . 2]" 1
1044 1 35 LEU HA 1 40 CYS QB . . 3.670 2.621 2.405 2.835 . 0 0 "[ . 1 . 2]" 1
1045 1 35 LEU HB2 1 36 LYS H . . 3.910 2.716 2.286 3.082 . 0 0 "[ . 1 . 2]" 1
1046 1 35 LEU HB3 1 36 LYS H . . 4.150 3.458 2.978 3.879 . 0 0 "[ . 1 . 2]" 1
1047 1 35 LEU QD 1 36 LYS H . . 4.940 4.118 3.885 4.344 . 0 0 "[ . 1 . 2]" 1
1048 1 35 LEU QD 1 38 GLY H . . 5.500 4.970 4.607 5.246 . 0 0 "[ . 1 . 2]" 1
1049 1 35 LEU QD 1 38 GLY QA . . 5.410 4.646 4.120 5.058 . 0 0 "[ . 1 . 2]" 1
1050 1 35 LEU QD 1 40 CYS H . . 5.200 4.594 3.795 5.033 . 0 0 "[ . 1 . 2]" 1
1051 1 35 LEU QD 1 40 CYS QB . . 3.600 2.364 1.889 3.252 . 0 0 "[ . 1 . 2]" 1
1052 1 35 LEU HG 1 40 CYS QB . . 4.500 3.002 2.486 3.643 . 0 0 "[ . 1 . 2]" 1
1053 1 36 LYS H 1 36 LYS HB2 . . 3.090 2.244 2.069 2.452 . 0 0 "[ . 1 . 2]" 1
1054 1 36 LYS H 1 36 LYS HB3 . . 3.190 2.646 2.126 3.255 0.065 19 0 "[ . 1 . 2]" 1
1055 1 36 LYS H 1 36 LYS QD . . 5.020 4.441 2.987 4.813 . 0 0 "[ . 1 . 2]" 1
1056 1 36 LYS H 1 36 LYS QE . . 5.500 4.172 3.319 4.838 . 0 0 "[ . 1 . 2]" 1
1057 1 36 LYS H 1 36 LYS HG2 . . 4.180 4.345 4.022 4.614 0.434 17 0 "[ . 1 . 2]" 1
1058 1 36 LYS H 1 36 LYS HG3 . . 4.870 4.325 4.238 4.533 . 0 0 "[ . 1 . 2]" 1
1059 1 36 LYS H 1 37 ASN HA . . 5.500 5.300 5.095 5.403 . 0 0 "[ . 1 . 2]" 1
1060 1 36 LYS H 1 37 ASN HB2 . . 5.500 4.699 4.410 4.882 . 0 0 "[ . 1 . 2]" 1
1061 1 36 LYS H 1 39 THR H . . 5.500 5.528 5.385 5.585 0.085 6 0 "[ . 1 . 2]" 1
1062 1 36 LYS HA 1 36 LYS HB3 . . 2.980 3.020 2.868 3.051 0.071 12 0 "[ . 1 . 2]" 1
1063 1 36 LYS HA 1 36 LYS QD . . 3.990 3.199 2.130 3.817 . 0 0 "[ . 1 . 2]" 1
1064 1 36 LYS HA 1 36 LYS QE . . 4.220 4.170 3.559 4.318 0.098 13 0 "[ . 1 . 2]" 1
1065 1 36 LYS HA 1 36 LYS HG2 . . 3.740 2.791 2.210 3.714 . 0 0 "[ . 1 . 2]" 1
1066 1 36 LYS HA 1 36 LYS HG3 . . 3.720 2.989 2.182 3.687 . 0 0 "[ . 1 . 2]" 1
1067 1 36 LYS HA 1 37 ASN HA . . 4.830 4.829 4.676 4.897 0.067 4 0 "[ . 1 . 2]" 1
1068 1 36 LYS HA 1 38 GLY H . . 4.620 4.319 3.786 4.691 0.071 9 0 "[ . 1 . 2]" 1
1069 1 36 LYS HB2 1 36 LYS QE . . 4.340 2.873 2.045 3.626 . 0 0 "[ . 1 . 2]" 1
1070 1 36 LYS HB2 1 37 ASN H . . 3.820 3.664 3.047 3.898 0.078 2 0 "[ . 1 . 2]" 1
1071 1 36 LYS HB3 1 36 LYS QD . . 3.570 3.078 2.722 3.454 . 0 0 "[ . 1 . 2]" 1
1072 1 36 LYS HB3 1 36 LYS QE . . 4.380 2.328 1.905 3.493 . 0 0 "[ . 1 . 2]" 1
1073 1 36 LYS HB3 1 37 ASN H . . 3.550 2.632 2.399 3.102 . 0 0 "[ . 1 . 2]" 1
1074 1 36 LYS HB3 1 37 ASN HA . . 5.060 4.346 3.907 4.703 . 0 0 "[ . 1 . 2]" 1
1075 1 36 LYS HB3 1 37 ASN QD . . 5.500 3.810 2.916 4.898 . 0 0 "[ . 1 . 2]" 1
1076 1 36 LYS HB3 1 38 GLY H . . 5.030 4.978 4.831 5.087 0.057 15 0 "[ . 1 . 2]" 1
1077 1 36 LYS HG2 1 37 ASN H . . 5.380 4.596 3.761 5.064 . 0 0 "[ . 1 . 2]" 1
1078 1 36 LYS HG3 1 37 ASN H . . 5.070 4.823 3.992 5.458 0.388 15 0 "[ . 1 . 2]" 1
1079 1 37 ASN H 1 37 ASN HB2 . . 3.370 2.431 2.303 2.534 . 0 0 "[ . 1 . 2]" 1
1080 1 37 ASN H 1 37 ASN HB3 . . 3.590 3.606 3.529 3.662 0.072 7 0 "[ . 1 . 2]" 1
1081 1 37 ASN H 1 37 ASN QD . . 4.730 2.751 1.990 3.666 . 0 0 "[ . 1 . 2]" 1
1082 1 37 ASN H 1 38 GLY QA . . 5.280 4.525 4.208 4.735 . 0 0 "[ . 1 . 2]" 1
1083 1 37 ASN H 1 39 THR H . . 4.420 4.031 3.473 4.482 0.062 11 0 "[ . 1 . 2]" 1
1084 1 37 ASN H 1 39 THR MG . . 5.500 4.925 4.045 5.535 0.035 17 0 "[ . 1 . 2]" 1
1085 1 37 ASN HA 1 38 GLY QA . . 5.230 4.383 4.278 4.425 . 0 0 "[ . 1 . 2]" 1
1086 1 37 ASN HA 1 39 THR MG . . 4.900 4.443 3.918 4.915 0.015 17 0 "[ . 1 . 2]" 1
1087 1 37 ASN HB2 1 38 GLY H . . 4.590 2.788 2.299 3.533 . 0 0 "[ . 1 . 2]" 1
1088 1 37 ASN HB2 1 39 THR H . . 4.560 2.645 2.215 3.497 . 0 0 "[ . 1 . 2]" 1
1089 1 37 ASN HB2 1 39 THR MG . . 4.030 3.018 2.102 3.512 . 0 0 "[ . 1 . 2]" 1
1090 1 37 ASN HB3 1 38 GLY H . . 4.850 3.646 3.239 4.199 . 0 0 "[ . 1 . 2]" 1
1091 1 37 ASN HB3 1 39 THR H . . 4.530 3.348 2.785 4.320 . 0 0 "[ . 1 . 2]" 1
1092 1 37 ASN HB3 1 39 THR MG . . 3.950 2.510 2.184 2.928 . 0 0 "[ . 1 . 2]" 1
1093 1 37 ASN QD 1 38 GLY H . . 5.500 4.480 3.967 5.260 . 0 0 "[ . 1 . 2]" 1
1094 1 37 ASN QD 1 39 THR MG . . 5.310 4.239 2.563 4.841 . 0 0 "[ . 1 . 2]" 1
1095 1 38 GLY H 1 39 THR H . . 3.270 2.253 1.987 2.557 . 0 0 "[ . 1 . 2]" 1
1096 1 38 GLY H 1 39 THR HA . . 5.140 4.984 4.740 5.211 0.071 16 0 "[ . 1 . 2]" 1
1097 1 38 GLY H 1 39 THR MG . . 4.930 3.975 3.290 4.535 . 0 0 "[ . 1 . 2]" 1
1098 1 38 GLY H 1 40 CYS H . . 5.040 4.436 4.065 4.882 . 0 0 "[ . 1 . 2]" 1
1099 1 38 GLY QA 1 39 THR H . . 3.490 2.945 2.543 3.013 . 0 0 "[ . 1 . 2]" 1
1100 1 38 GLY QA 1 39 THR HA . . 5.100 4.141 4.093 4.204 . 0 0 "[ . 1 . 2]" 1
1101 1 38 GLY QA 1 39 THR MG . . 4.880 3.876 3.538 4.335 . 0 0 "[ . 1 . 2]" 1
1102 1 38 GLY QA 1 40 CYS H . . 4.500 3.517 3.330 3.844 . 0 0 "[ . 1 . 2]" 1
1103 1 38 GLY QA 1 40 CYS QB . . 5.500 4.115 3.703 4.863 . 0 0 "[ . 1 . 2]" 1
1104 1 39 THR H 1 39 THR MG . . 3.690 2.560 2.009 3.144 . 0 0 "[ . 1 . 2]" 1
1105 1 39 THR H 1 40 CYS H . . 3.450 3.160 2.660 3.436 . 0 0 "[ . 1 . 2]" 1
1106 1 39 THR H 1 40 CYS HA . . 5.500 5.035 4.643 5.188 . 0 0 "[ . 1 . 2]" 1
1107 1 39 THR H 1 40 CYS QB . . 4.450 3.876 3.453 4.026 . 0 0 "[ . 1 . 2]" 1
1108 1 39 THR HA 1 39 THR MG . . 3.110 2.507 2.257 3.212 0.102 14 0 "[ . 1 . 2]" 1
1109 1 39 THR HA 1 40 CYS H . . 3.470 2.734 2.597 2.884 . 0 0 "[ . 1 . 2]" 1
1110 1 39 THR HA 1 40 CYS HA . . 5.260 4.439 4.297 4.534 . 0 0 "[ . 1 . 2]" 1
1111 1 39 THR HA 1 40 CYS QB . . 5.500 4.640 4.510 4.762 . 0 0 "[ . 1 . 2]" 1
1112 1 39 THR HA 1 99 HIS H . . 5.100 3.696 3.345 4.140 . 0 0 "[ . 1 . 2]" 1
1113 1 39 THR HA 1 99 HIS HB2 . . 4.360 4.409 4.152 4.450 0.090 12 0 "[ . 1 . 2]" 1
1114 1 39 THR HA 1 99 HIS HB3 . . 3.890 2.740 2.439 2.953 . 0 0 "[ . 1 . 2]" 1
1115 1 39 THR HB 1 40 CYS H . . 5.140 4.536 4.476 4.667 . 0 0 "[ . 1 . 2]" 1
1116 1 39 THR HB 1 99 HIS H . . 4.680 3.994 3.538 4.764 0.084 8 0 "[ . 1 . 2]" 1
1117 1 39 THR HB 1 99 HIS HB3 . . 4.910 4.332 3.950 4.846 . 0 0 "[ . 1 . 2]" 1
1118 1 39 THR MG 1 40 CYS H . . 5.170 4.333 4.005 4.482 . 0 0 "[ . 1 . 2]" 1
1119 1 39 THR MG 1 99 HIS H . . 5.500 4.767 4.023 5.336 . 0 0 "[ . 1 . 2]" 1
1120 1 40 CYS H 1 40 CYS QB . . 3.540 2.564 2.398 2.794 . 0 0 "[ . 1 . 2]" 1
1121 1 40 CYS H 1 41 GLY H . . 4.830 4.363 4.264 4.470 . 0 0 "[ . 1 . 2]" 1
1122 1 40 CYS H 1 98 PRO HA . . 5.190 4.954 4.729 5.204 0.014 7 0 "[ . 1 . 2]" 1
1123 1 40 CYS H 1 99 HIS H . . 5.500 3.772 3.500 4.143 . 0 0 "[ . 1 . 2]" 1
1124 1 40 CYS H 1 99 HIS HB3 . . 4.720 3.085 2.809 3.454 . 0 0 "[ . 1 . 2]" 1
1125 1 40 CYS HA 1 41 GLY H . . 3.030 2.254 2.138 2.441 . 0 0 "[ . 1 . 2]" 1
1126 1 40 CYS HA 1 41 GLY QA . . 4.730 3.955 3.871 4.023 . 0 0 "[ . 1 . 2]" 1
1127 1 40 CYS HA 1 97 VAL QG . . 5.500 4.361 4.206 4.578 . 0 0 "[ . 1 . 2]" 1
1128 1 40 CYS HA 1 98 PRO HA . . 3.600 2.422 2.126 2.691 . 0 0 "[ . 1 . 2]" 1
1129 1 40 CYS HA 1 99 HIS H . . 3.550 2.302 2.156 2.504 . 0 0 "[ . 1 . 2]" 1
1130 1 40 CYS HA 1 99 HIS HB2 . . 4.760 3.706 3.451 3.964 . 0 0 "[ . 1 . 2]" 1
1131 1 40 CYS HA 1 99 HIS HB3 . . 4.560 3.522 3.196 3.757 . 0 0 "[ . 1 . 2]" 1
1132 1 40 CYS QB 1 41 GLY H . . 4.230 3.528 2.964 3.719 . 0 0 "[ . 1 . 2]" 1
1133 1 40 CYS QB 1 98 PRO HA . . 4.920 3.797 3.309 4.127 . 0 0 "[ . 1 . 2]" 1
1134 1 40 CYS QB 1 98 PRO HB3 . . 5.500 5.334 5.109 5.391 . 0 0 "[ . 1 . 2]" 1
1135 1 40 CYS QB 1 99 HIS H . . 5.500 4.128 3.982 4.321 . 0 0 "[ . 1 . 2]" 1
1136 1 41 GLY H 1 42 LEU H . . 5.040 4.311 3.804 4.411 . 0 0 "[ . 1 . 2]" 1
1137 1 41 GLY H 1 96 LEU HA . . 5.120 4.429 4.107 4.647 . 0 0 "[ . 1 . 2]" 1
1138 1 41 GLY H 1 96 LEU QD . . 5.400 4.151 3.356 4.851 . 0 0 "[ . 1 . 2]" 1
1139 1 41 GLY H 1 97 VAL H . . 3.930 2.787 2.516 2.966 . 0 0 "[ . 1 . 2]" 1
1140 1 41 GLY H 1 97 VAL QG . . 4.270 2.874 2.664 3.056 . 0 0 "[ . 1 . 2]" 1
1141 1 41 GLY H 1 98 PRO HA . . 4.420 3.713 3.429 4.060 . 0 0 "[ . 1 . 2]" 1
1142 1 41 GLY H 1 99 HIS H . . 4.600 3.568 3.348 3.893 . 0 0 "[ . 1 . 2]" 1
1143 1 41 GLY H 1 99 HIS HA . . 5.500 4.454 4.133 4.815 . 0 0 "[ . 1 . 2]" 1
1144 1 41 GLY H 1 99 HIS HB2 . . 4.070 3.464 3.237 3.762 . 0 0 "[ . 1 . 2]" 1
1145 1 41 GLY H 1 99 HIS HB3 . . 4.750 4.289 3.846 4.653 . 0 0 "[ . 1 . 2]" 1
1146 1 41 GLY QA 1 42 LEU H . . 3.390 2.283 2.129 2.343 . 0 0 "[ . 1 . 2]" 1
1147 1 41 GLY QA 1 96 LEU QD . . 4.950 4.172 3.673 4.572 . 0 0 "[ . 1 . 2]" 1
1148 1 41 GLY QA 1 97 VAL H . . 5.060 4.065 3.861 4.195 . 0 0 "[ . 1 . 2]" 1
1149 1 41 GLY QA 1 97 VAL QG . . 4.120 2.975 2.845 3.094 . 0 0 "[ . 1 . 2]" 1
1150 1 41 GLY QA 1 99 HIS H . . 5.450 4.545 4.374 4.673 . 0 0 "[ . 1 . 2]" 1
1151 1 41 GLY QA 1 99 HIS HB2 . . 4.080 2.770 2.637 3.075 . 0 0 "[ . 1 . 2]" 1
1152 1 41 GLY QA 1 99 HIS HB3 . . 4.770 4.113 3.827 4.316 . 0 0 "[ . 1 . 2]" 1
1153 1 42 LEU H 1 42 LEU HB2 . . 3.770 2.963 2.736 3.336 . 0 0 "[ . 1 . 2]" 1
1154 1 42 LEU H 1 42 LEU HB3 . . 3.470 2.553 2.386 2.937 . 0 0 "[ . 1 . 2]" 1
1155 1 42 LEU H 1 42 LEU QD . . 4.650 3.919 3.817 4.124 . 0 0 "[ . 1 . 2]" 1
1156 1 42 LEU H 1 42 LEU HG . . 5.060 4.465 4.370 4.607 . 0 0 "[ . 1 . 2]" 1
1157 1 42 LEU H 1 43 VAL H . . 5.030 4.401 4.195 4.536 . 0 0 "[ . 1 . 2]" 1
1158 1 42 LEU H 1 96 LEU HA . . 5.500 4.979 4.554 5.155 . 0 0 "[ . 1 . 2]" 1
1159 1 42 LEU H 1 96 LEU QD . . 4.880 4.453 4.035 4.822 . 0 0 "[ . 1 . 2]" 1
1160 1 42 LEU H 1 97 VAL QG . . 5.500 3.623 2.530 4.088 . 0 0 "[ . 1 . 2]" 1
1161 1 42 LEU HA 1 42 LEU QD . . 3.030 2.248 2.109 2.517 . 0 0 "[ . 1 . 2]" 1
1162 1 42 LEU HA 1 42 LEU HG . . 4.250 2.992 2.822 3.144 . 0 0 "[ . 1 . 2]" 1
1163 1 42 LEU HA 1 43 VAL H . . 2.920 2.223 2.119 2.556 . 0 0 "[ . 1 . 2]" 1
1164 1 42 LEU HA 1 43 VAL HA . . 5.500 4.494 4.426 4.654 . 0 0 "[ . 1 . 2]" 1
1165 1 42 LEU HA 1 43 VAL HB . . 4.330 4.377 4.273 4.423 0.093 8 0 "[ . 1 . 2]" 1
1166 1 42 LEU HA 1 95 VAL H . . 4.830 4.428 3.928 4.783 . 0 0 "[ . 1 . 2]" 1
1167 1 42 LEU HA 1 96 LEU H . . 5.500 4.977 4.741 5.361 . 0 0 "[ . 1 . 2]" 1
1168 1 42 LEU HA 1 96 LEU HA . . 3.690 2.601 2.355 2.975 . 0 0 "[ . 1 . 2]" 1
1169 1 42 LEU HA 1 96 LEU QD . . 3.740 2.643 2.137 3.131 . 0 0 "[ . 1 . 2]" 1
1170 1 42 LEU HA 1 97 VAL H . . 4.120 3.702 3.293 4.141 0.021 17 0 "[ . 1 . 2]" 1
1171 1 42 LEU HA 1 97 VAL QG . . 5.500 3.241 2.804 3.659 . 0 0 "[ . 1 . 2]" 1
1172 1 42 LEU HB2 1 43 VAL H . . 4.600 4.220 3.920 4.415 . 0 0 "[ . 1 . 2]" 1
1173 1 42 LEU HB2 1 96 LEU QD . . 4.390 3.163 2.718 3.792 . 0 0 "[ . 1 . 2]" 1
1174 1 42 LEU HB3 1 43 VAL H . . 4.930 4.040 3.291 4.374 . 0 0 "[ . 1 . 2]" 1
1175 1 42 LEU QD 1 43 VAL H . . 3.590 2.710 2.376 3.158 . 0 0 "[ . 1 . 2]" 1
1176 1 42 LEU QD 1 44 GLU HA . . 4.720 3.726 3.371 4.017 . 0 0 "[ . 1 . 2]" 1
1177 1 42 LEU QD 1 44 GLU HG2 . . 4.330 3.673 2.568 4.296 . 0 0 "[ . 1 . 2]" 1
1178 1 42 LEU QD 1 44 GLU HG3 . . 4.270 3.854 3.137 4.251 . 0 0 "[ . 1 . 2]" 1
1179 1 42 LEU QD 1 45 LEU H . . 5.500 4.884 4.663 5.136 . 0 0 "[ . 1 . 2]" 1
1180 1 42 LEU QD 1 60 ILE HB . . 4.520 4.465 4.332 4.535 0.015 20 0 "[ . 1 . 2]" 1
1181 1 42 LEU QD 1 60 ILE MD . . 2.880 1.890 1.799 1.946 . 0 0 "[ . 1 . 2]" 1
1182 1 42 LEU QD 1 60 ILE HG12 . . 4.580 2.773 2.489 3.089 . 0 0 "[ . 1 . 2]" 1
1183 1 42 LEU QD 1 60 ILE HG13 . . 3.720 3.613 3.251 3.738 0.018 5 0 "[ . 1 . 2]" 1
1184 1 42 LEU QD 1 94 GLY H . . 4.630 3.374 2.913 3.600 . 0 0 "[ . 1 . 2]" 1
1185 1 42 LEU QD 1 94 GLY HA2 . . 4.240 3.639 3.389 3.989 . 0 0 "[ . 1 . 2]" 1
1186 1 42 LEU QD 1 94 GLY HA3 . . 3.570 2.231 2.083 2.572 . 0 0 "[ . 1 . 2]" 1
1187 1 42 LEU QD 1 95 VAL H . . 3.700 3.084 2.713 3.665 . 0 0 "[ . 1 . 2]" 1
1188 1 42 LEU QD 1 96 LEU HA . . 4.530 3.248 2.656 3.697 . 0 0 "[ . 1 . 2]" 1
1189 1 42 LEU QD 1 96 LEU QD . . 2.770 2.182 1.898 2.724 . 0 0 "[ . 1 . 2]" 1
1190 1 42 LEU QD 1 108 ARG HA . . 4.300 4.334 4.297 4.351 0.051 15 0 "[ . 1 . 2]" 1
1191 1 42 LEU QD 1 108 ARG HB2 . . 3.550 2.310 2.120 2.432 . 0 0 "[ . 1 . 2]" 1
1192 1 42 LEU QD 1 108 ARG HB3 . . 3.740 2.384 2.158 2.765 . 0 0 "[ . 1 . 2]" 1
1193 1 42 LEU QD 1 108 ARG HD2 . . 4.200 3.673 2.870 4.235 0.035 11 0 "[ . 1 . 2]" 1
1194 1 42 LEU QD 1 108 ARG HD3 . . 4.060 3.580 2.502 4.250 0.190 18 0 "[ . 1 . 2]" 1
1195 1 42 LEU QD 1 108 ARG HG2 . . 3.500 2.716 2.054 3.538 0.038 19 0 "[ . 1 . 2]" 1
1196 1 42 LEU HG 1 43 VAL H . . 4.170 2.673 1.723 3.357 . 0 0 "[ . 1 . 2]" 1
1197 1 42 LEU HG 1 43 VAL HA . . 5.500 3.822 3.504 4.167 . 0 0 "[ . 1 . 2]" 1
1198 1 42 LEU HG 1 43 VAL HB . . 5.500 4.870 4.587 5.155 . 0 0 "[ . 1 . 2]" 1
1199 1 42 LEU HG 1 44 GLU H . . 5.380 4.264 3.827 5.030 . 0 0 "[ . 1 . 2]" 1
1200 1 42 LEU HG 1 44 GLU HA . . 4.900 3.900 3.643 4.364 . 0 0 "[ . 1 . 2]" 1
1201 1 42 LEU HG 1 44 GLU HG3 . . 4.750 4.338 3.612 4.824 0.074 3 0 "[ . 1 . 2]" 1
1202 1 42 LEU HG 1 60 ILE MD . . 5.500 4.144 3.843 4.317 . 0 0 "[ . 1 . 2]" 1
1203 1 42 LEU HG 1 94 GLY HA2 . . 5.420 4.642 3.854 5.144 . 0 0 "[ . 1 . 2]" 1
1204 1 42 LEU HG 1 94 GLY HA3 . . 4.460 3.099 2.342 3.506 . 0 0 "[ . 1 . 2]" 1
1205 1 42 LEU HG 1 95 VAL H . . 5.170 3.852 3.240 4.194 . 0 0 "[ . 1 . 2]" 1
1206 1 42 LEU HG 1 96 LEU QD . . 4.680 4.291 3.933 4.677 . 0 0 "[ . 1 . 2]" 1
1207 1 43 VAL H 1 43 VAL HB . . 3.350 2.486 2.185 3.238 . 0 0 "[ . 1 . 2]" 1
1208 1 43 VAL H 1 43 VAL QG . . 3.630 2.846 2.350 3.113 . 0 0 "[ . 1 . 2]" 1
1209 1 43 VAL H 1 44 GLU H . . 5.020 4.320 4.116 4.515 . 0 0 "[ . 1 . 2]" 1
1210 1 43 VAL H 1 94 GLY HA2 . . 5.480 4.954 4.071 5.537 0.057 19 0 "[ . 1 . 2]" 1
1211 1 43 VAL H 1 94 GLY HA3 . . 5.010 3.915 3.114 4.555 . 0 0 "[ . 1 . 2]" 1
1212 1 43 VAL H 1 95 VAL H . . 3.800 2.818 2.187 3.276 . 0 0 "[ . 1 . 2]" 1
1213 1 43 VAL H 1 95 VAL HA . . 5.500 4.782 4.258 5.008 . 0 0 "[ . 1 . 2]" 1
1214 1 43 VAL H 1 95 VAL HB . . 4.580 4.012 3.580 4.677 0.097 4 0 "[ . 1 . 2]" 1
1215 1 43 VAL H 1 96 LEU HA . . 4.370 3.636 3.377 4.390 0.020 8 0 "[ . 1 . 2]" 1
1216 1 43 VAL H 1 97 VAL H . . 5.320 4.801 4.240 5.363 0.043 8 0 "[ . 1 . 2]" 1
1217 1 43 VAL H 1 97 VAL QG . . 4.860 3.326 2.730 3.683 . 0 0 "[ . 1 . 2]" 1
1218 1 43 VAL HA 1 43 VAL QG . . 3.310 2.166 2.090 2.342 . 0 0 "[ . 1 . 2]" 1
1219 1 43 VAL HA 1 44 GLU H . . 2.890 2.200 2.076 2.439 . 0 0 "[ . 1 . 2]" 1
1220 1 43 VAL HA 1 44 GLU HA . . 4.970 4.421 4.298 4.516 . 0 0 "[ . 1 . 2]" 1
1221 1 43 VAL HA 1 44 GLU HG3 . . 4.820 3.972 3.354 4.602 . 0 0 "[ . 1 . 2]" 1
1222 1 43 VAL HA 1 94 GLY HA3 . . 5.400 5.443 5.208 5.491 0.091 2 0 "[ . 1 . 2]" 1
1223 1 43 VAL HA 1 95 VAL H . . 5.220 4.725 4.303 4.942 . 0 0 "[ . 1 . 2]" 1
1224 1 43 VAL HA 1 97 VAL QG . . 5.500 4.114 3.673 4.455 . 0 0 "[ . 1 . 2]" 1
1225 1 43 VAL HB 1 95 VAL H . . 4.200 3.366 2.481 4.248 0.048 8 0 "[ . 1 . 2]" 1
1226 1 43 VAL HB 1 95 VAL HB . . 3.670 2.942 2.183 3.789 0.119 8 0 "[ . 1 . 2]" 1
1227 1 43 VAL HB 1 97 VAL QG . . 4.990 2.893 2.482 3.688 . 0 0 "[ . 1 . 2]" 1
1228 1 43 VAL QG 1 44 GLU H . . 3.680 2.725 2.279 3.072 . 0 0 "[ . 1 . 2]" 1
1229 1 43 VAL QG 1 44 GLU HA . . 5.400 4.074 3.623 4.249 . 0 0 "[ . 1 . 2]" 1
1230 1 43 VAL QG 1 44 GLU HG3 . . 5.500 4.564 4.122 4.967 . 0 0 "[ . 1 . 2]" 1
1231 1 43 VAL QG 1 45 LEU HA . . 5.180 3.843 3.389 4.195 . 0 0 "[ . 1 . 2]" 1
1232 1 43 VAL QG 1 94 GLY HA2 . . 4.810 4.641 3.557 4.797 . 0 0 "[ . 1 . 2]" 1
1233 1 43 VAL QG 1 95 VAL H . . 4.180 3.496 2.112 3.912 . 0 0 "[ . 1 . 2]" 1
1234 1 43 VAL QG 1 97 VAL H . . 4.930 4.459 3.925 4.859 . 0 0 "[ . 1 . 2]" 1
1235 1 43 VAL QG 1 97 VAL QG . . 3.190 1.964 1.827 2.467 . 0 0 "[ . 1 . 2]" 1
1236 1 44 GLU H 1 44 GLU HB2 . . 3.350 2.433 2.256 2.703 . 0 0 "[ . 1 . 2]" 1
1237 1 44 GLU H 1 44 GLU HB3 . . 3.730 3.591 3.486 3.701 . 0 0 "[ . 1 . 2]" 1
1238 1 44 GLU H 1 44 GLU HG2 . . 4.040 3.595 3.201 3.951 . 0 0 "[ . 1 . 2]" 1
1239 1 44 GLU H 1 44 GLU HG3 . . 3.640 2.448 2.139 3.145 . 0 0 "[ . 1 . 2]" 1
1240 1 44 GLU H 1 45 LEU H . . 5.010 4.577 4.457 4.699 . 0 0 "[ . 1 . 2]" 1
1241 1 44 GLU HA 1 44 GLU HG2 . . 3.340 2.591 2.198 3.406 0.066 7 0 "[ . 1 . 2]" 1
1242 1 44 GLU HA 1 44 GLU HG3 . . 3.870 3.024 2.379 3.357 . 0 0 "[ . 1 . 2]" 1
1243 1 44 GLU HA 1 45 LEU H . . 2.920 2.229 2.062 2.417 . 0 0 "[ . 1 . 2]" 1
1244 1 44 GLU HA 1 45 LEU HA . . 5.010 4.402 4.282 4.479 . 0 0 "[ . 1 . 2]" 1
1245 1 44 GLU HA 1 45 LEU HG . . 4.620 4.428 4.047 4.698 0.078 6 0 "[ . 1 . 2]" 1
1246 1 44 GLU HA 1 94 GLY HA2 . . 3.900 3.118 2.331 3.581 . 0 0 "[ . 1 . 2]" 1
1247 1 44 GLU HA 1 95 VAL H . . 4.580 4.147 3.579 4.614 0.034 16 0 "[ . 1 . 2]" 1
1248 1 44 GLU HB2 1 45 LEU H . . 4.200 4.014 3.371 4.263 0.063 9 0 "[ . 1 . 2]" 1
1249 1 44 GLU HB3 1 45 LEU H . . 3.670 2.988 2.168 3.494 . 0 0 "[ . 1 . 2]" 1
1250 1 44 GLU HG2 1 45 LEU H . . 4.600 4.253 3.271 4.616 0.016 7 0 "[ . 1 . 2]" 1
1251 1 44 GLU HG3 1 45 LEU H . . 5.140 4.954 4.339 5.219 0.079 4 0 "[ . 1 . 2]" 1
1252 1 45 LEU H 1 45 LEU HB2 . . 3.270 2.255 2.129 2.455 . 0 0 "[ . 1 . 2]" 1
1253 1 45 LEU H 1 45 LEU HB3 . . 3.690 3.539 3.398 3.710 0.020 18 0 "[ . 1 . 2]" 1
1254 1 45 LEU H 1 45 LEU MD1 . . 4.300 3.638 3.275 3.961 . 0 0 "[ . 1 . 2]" 1
1255 1 45 LEU H 1 45 LEU MD2 . . 4.530 4.163 3.957 4.327 . 0 0 "[ . 1 . 2]" 1
1256 1 45 LEU H 1 45 LEU HG . . 3.410 3.112 2.638 3.474 0.064 3 0 "[ . 1 . 2]" 1
1257 1 45 LEU H 1 46 GLU H . . 5.030 4.399 3.885 4.649 . 0 0 "[ . 1 . 2]" 1
1258 1 45 LEU H 1 94 GLY H . . 5.290 5.138 4.625 5.370 0.080 4 0 "[ . 1 . 2]" 1
1259 1 45 LEU H 1 94 GLY HA2 . . 3.930 2.693 2.048 3.245 . 0 0 "[ . 1 . 2]" 1
1260 1 45 LEU H 1 94 GLY HA3 . . 4.190 3.822 3.160 4.267 0.077 8 0 "[ . 1 . 2]" 1
1261 1 45 LEU H 1 95 VAL H . . 5.390 4.644 4.075 5.437 0.047 17 0 "[ . 1 . 2]" 1
1262 1 45 LEU HA 1 45 LEU MD1 . . 3.690 3.765 3.700 3.795 0.105 20 0 "[ . 1 . 2]" 1
1263 1 45 LEU HA 1 45 LEU MD2 . . 3.280 2.136 2.054 2.457 . 0 0 "[ . 1 . 2]" 1
1264 1 45 LEU HA 1 45 LEU HG . . 4.250 2.516 2.369 2.696 . 0 0 "[ . 1 . 2]" 1
1265 1 45 LEU HA 1 46 GLU H . . 3.220 2.145 2.022 2.266 . 0 0 "[ . 1 . 2]" 1
1266 1 45 LEU HA 1 46 GLU HA . . 4.360 4.415 4.346 4.442 0.082 20 0 "[ . 1 . 2]" 1
1267 1 45 LEU HA 1 46 GLU HG2 . . 5.500 4.930 3.673 5.584 0.084 4 0 "[ . 1 . 2]" 1
1268 1 45 LEU HA 1 46 GLU HG3 . . 5.500 4.761 3.907 5.590 0.090 11 0 "[ . 1 . 2]" 1
1269 1 45 LEU HA 1 49 VAL HB . . 4.110 3.388 2.925 3.894 . 0 0 "[ . 1 . 2]" 1
1270 1 45 LEU HA 1 49 VAL MG1 . . 3.900 2.742 2.295 3.484 . 0 0 "[ . 1 . 2]" 1
1271 1 45 LEU HA 1 49 VAL MG2 . . 3.760 3.273 2.399 3.856 0.096 16 0 "[ . 1 . 2]" 1
1272 1 45 LEU HA 1 95 VAL QG . . 4.780 3.994 3.388 4.661 . 0 0 "[ . 1 . 2]" 1
1273 1 45 LEU HB2 1 46 GLU H . . 5.030 4.445 4.028 4.656 . 0 0 "[ . 1 . 2]" 1
1274 1 45 LEU HB2 1 94 GLY HA2 . . 4.710 3.203 2.687 3.788 . 0 0 "[ . 1 . 2]" 1
1275 1 45 LEU HB3 1 45 LEU MD2 . . 2.830 2.295 2.197 2.372 . 0 0 "[ . 1 . 2]" 1
1276 1 45 LEU HB3 1 46 GLU H . . 4.560 3.572 2.752 4.252 . 0 0 "[ . 1 . 2]" 1
1277 1 45 LEU HB3 1 94 GLY HA2 . . 5.060 4.574 4.154 5.040 . 0 0 "[ . 1 . 2]" 1
1278 1 45 LEU MD1 1 50 LEU QD . . 4.370 3.867 3.414 4.343 . 0 0 "[ . 1 . 2]" 1
1279 1 45 LEU MD1 1 59 PHE HB2 . . 5.010 5.029 4.643 5.125 0.115 20 0 "[ . 1 . 2]" 1
1280 1 45 LEU MD1 1 59 PHE QD . . 4.490 2.511 2.087 3.036 . 0 0 "[ . 1 . 2]" 1
1281 1 45 LEU MD1 1 59 PHE QE . . 4.100 2.923 2.406 3.599 . 0 0 "[ . 1 . 2]" 1
1282 1 45 LEU MD1 1 87 GLY HA2 . . 5.270 2.663 1.985 3.514 . 0 0 "[ . 1 . 2]" 1
1283 1 45 LEU MD1 1 87 GLY HA3 . . 4.870 3.956 3.048 4.947 0.077 9 0 "[ . 1 . 2]" 1
1284 1 45 LEU MD1 1 92 THR HB . . 4.330 2.642 2.205 3.201 . 0 0 "[ . 1 . 2]" 1
1285 1 45 LEU MD1 1 92 THR MG . . 3.650 2.071 1.896 2.669 . 0 0 "[ . 1 . 2]" 1
1286 1 45 LEU MD1 1 94 GLY H . . 5.040 3.251 2.850 3.900 . 0 0 "[ . 1 . 2]" 1
1287 1 45 LEU MD1 1 94 GLY HA2 . . 3.900 2.687 2.335 3.323 . 0 0 "[ . 1 . 2]" 1
1288 1 45 LEU MD1 1 95 VAL H . . 4.480 4.224 3.696 4.555 0.075 18 0 "[ . 1 . 2]" 1
1289 1 45 LEU MD2 1 50 LEU QD . . 4.110 2.328 2.049 2.590 . 0 0 "[ . 1 . 2]" 1
1290 1 45 LEU MD2 1 59 PHE QE . . 3.450 2.141 2.059 2.325 . 0 0 "[ . 1 . 2]" 1
1291 1 45 LEU MD2 1 92 THR MG . . 4.350 3.921 3.572 4.457 0.107 9 0 "[ . 1 . 2]" 1
1292 1 45 LEU MD2 1 94 GLY HA2 . . 4.130 4.078 3.844 4.199 0.069 19 0 "[ . 1 . 2]" 1
1293 1 45 LEU MD2 1 95 VAL H . . 4.760 4.565 3.957 4.831 0.071 2 0 "[ . 1 . 2]" 1
1294 1 45 LEU HG 1 50 LEU QD . . 5.500 4.439 4.176 4.888 . 0 0 "[ . 1 . 2]" 1
1295 1 45 LEU HG 1 94 GLY HA2 . . 4.080 2.398 2.144 2.591 . 0 0 "[ . 1 . 2]" 1
1296 1 45 LEU HG 1 94 GLY HA3 . . 4.440 4.009 3.815 4.237 . 0 0 "[ . 1 . 2]" 1
1297 1 45 LEU HG 1 95 VAL H . . 5.280 3.534 3.073 3.790 . 0 0 "[ . 1 . 2]" 1
1298 1 45 LEU HG 1 95 VAL QG . . 4.990 2.546 2.126 3.134 . 0 0 "[ . 1 . 2]" 1
1299 1 46 GLU H 1 46 GLU HB3 . . 4.120 3.597 2.850 3.931 . 0 0 "[ . 1 . 2]" 1
1300 1 46 GLU H 1 46 GLU HG2 . . 4.500 3.695 2.261 4.313 . 0 0 "[ . 1 . 2]" 1
1301 1 46 GLU H 1 46 GLU HG3 . . 4.410 3.523 2.164 4.501 0.091 16 0 "[ . 1 . 2]" 1
1302 1 46 GLU H 1 49 VAL H . . 4.700 3.832 3.384 4.515 . 0 0 "[ . 1 . 2]" 1
1303 1 46 GLU H 1 49 VAL HB . . 3.830 2.393 1.962 2.875 . 0 0 "[ . 1 . 2]" 1
1304 1 46 GLU H 1 49 VAL MG1 . . 4.140 3.101 2.827 3.598 . 0 0 "[ . 1 . 2]" 1
1305 1 46 GLU H 1 49 VAL MG2 . . 3.570 2.475 1.634 3.593 0.023 20 0 "[ . 1 . 2]" 1
1306 1 46 GLU HA 1 46 GLU HB2 . . 3.050 2.954 2.483 3.055 0.005 9 0 "[ . 1 . 2]" 1
1307 1 46 GLU HA 1 46 GLU HG2 . . 3.810 2.705 2.147 3.714 . 0 0 "[ . 1 . 2]" 1
1308 1 46 GLU HA 1 46 GLU HG3 . . 3.820 3.486 3.105 3.896 0.076 8 0 "[ . 1 . 2]" 1
1309 1 46 GLU HA 1 47 LYS HB2 . . 5.090 4.623 4.253 4.979 . 0 0 "[ . 1 . 2]" 1
1310 1 46 GLU HA 1 47 LYS HB3 . . 5.500 5.126 4.839 5.411 . 0 0 "[ . 1 . 2]" 1
1311 1 46 GLU HA 1 49 VAL H . . 5.500 5.132 4.629 5.578 0.078 8 0 "[ . 1 . 2]" 1
1312 1 46 GLU HA 1 49 VAL MG2 . . 5.020 4.168 3.766 5.065 0.045 6 0 "[ . 1 . 2]" 1
1313 1 46 GLU HB2 1 47 LYS H . . 4.910 3.450 2.450 4.089 . 0 0 "[ . 1 . 2]" 1
1314 1 46 GLU HB3 1 47 LYS H . . 4.760 2.538 1.974 3.861 . 0 0 "[ . 1 . 2]" 1
1315 1 46 GLU HB3 1 49 VAL H . . 5.500 4.340 3.049 5.533 0.033 8 0 "[ . 1 . 2]" 1
1316 1 46 GLU HB3 1 49 VAL MG2 . . 3.760 3.189 2.063 3.855 0.095 6 0 "[ . 1 . 2]" 1
1317 1 46 GLU HG2 1 47 LYS H . . 5.500 4.212 3.007 5.038 . 0 0 "[ . 1 . 2]" 1
1318 1 46 GLU HG2 1 49 VAL MG2 . . 4.120 3.615 2.012 4.213 0.093 4 0 "[ . 1 . 2]" 1
1319 1 46 GLU HG3 1 49 VAL MG1 . . 5.500 4.784 4.106 5.585 0.085 8 0 "[ . 1 . 2]" 1
1320 1 46 GLU HG3 1 49 VAL MG2 . . 4.100 2.779 2.087 3.455 . 0 0 "[ . 1 . 2]" 1
1321 1 47 LYS H 1 47 LYS HG3 . . 5.500 4.391 4.228 4.517 . 0 0 "[ . 1 . 2]" 1
1322 1 47 LYS HA 1 47 LYS QE . . 4.810 4.108 2.070 4.899 0.089 2 0 "[ . 1 . 2]" 1
1323 1 47 LYS HA 1 47 LYS HG2 . . 3.950 3.392 2.856 3.898 . 0 0 "[ . 1 . 2]" 1
1324 1 47 LYS HA 1 48 GLY HA3 . . 5.440 5.302 5.190 5.378 . 0 0 "[ . 1 . 2]" 1
1325 1 47 LYS HA 1 49 VAL H . . 4.550 4.122 3.677 4.543 . 0 0 "[ . 1 . 2]" 1
1326 1 47 LYS HB2 1 47 LYS QD . . 3.540 2.371 2.178 2.897 . 0 0 "[ . 1 . 2]" 1
1327 1 47 LYS HB2 1 47 LYS QE . . 4.720 3.434 1.998 4.103 . 0 0 "[ . 1 . 2]" 1
1328 1 47 LYS QD 1 47 LYS HG2 . . 2.660 2.352 2.137 2.512 . 0 0 "[ . 1 . 2]" 1
1329 1 47 LYS QE 1 47 LYS HG2 . . 3.440 2.691 2.224 3.509 0.069 9 0 "[ . 1 . 2]" 1
1330 1 47 LYS QE 1 47 LYS HG3 . . 3.320 2.645 2.104 3.520 0.200 14 0 "[ . 1 . 2]" 1
1331 1 47 LYS HG2 1 48 GLY HA2 . . 5.500 4.408 3.516 5.539 0.039 12 0 "[ . 1 . 2]" 1
1332 1 47 LYS HG3 1 48 GLY HA2 . . 5.240 4.748 3.474 5.570 0.330 14 0 "[ . 1 . 2]" 1
1333 1 48 GLY HA2 1 49 VAL MG2 . . 5.500 4.902 4.494 5.398 . 0 0 "[ . 1 . 2]" 1
1334 1 48 GLY HA2 1 51 PRO HD2 . . 4.860 2.919 2.469 3.505 . 0 0 "[ . 1 . 2]" 1
1335 1 48 GLY HA2 1 51 PRO HD3 . . 5.390 3.641 2.999 4.357 . 0 0 "[ . 1 . 2]" 1
1336 1 48 GLY HA2 1 51 PRO HG2 . . 5.480 3.057 2.535 3.965 . 0 0 "[ . 1 . 2]" 1
1337 1 48 GLY HA2 1 52 GLN HE21 . . 5.320 4.689 4.013 5.390 0.070 13 0 "[ . 1 . 2]" 1
1338 1 48 GLY HA3 1 51 PRO HD2 . . 4.420 4.136 3.819 4.460 0.040 19 0 "[ . 1 . 2]" 1
1339 1 48 GLY HA3 1 51 PRO HG2 . . 4.910 4.153 3.657 4.906 . 0 0 "[ . 1 . 2]" 1
1340 1 48 GLY HA3 1 52 GLN HE21 . . 5.500 4.027 3.130 5.012 . 0 0 "[ . 1 . 2]" 1
1341 1 48 GLY HA3 1 52 GLN HE22 . . 5.500 4.851 4.077 5.315 . 0 0 "[ . 1 . 2]" 1
1342 1 48 GLY HA3 1 52 GLN HG3 . . 5.140 4.598 3.703 5.041 . 0 0 "[ . 1 . 2]" 1
1343 1 49 VAL H 1 49 VAL HB . . 3.010 2.234 2.063 2.668 . 0 0 "[ . 1 . 2]" 1
1344 1 49 VAL H 1 49 VAL MG1 . . 3.880 3.646 3.468 3.902 0.022 8 0 "[ . 1 . 2]" 1
1345 1 49 VAL H 1 49 VAL MG2 . . 3.320 2.879 2.310 3.260 . 0 0 "[ . 1 . 2]" 1
1346 1 49 VAL H 1 50 LEU H . . 3.470 2.462 1.933 2.732 . 0 0 "[ . 1 . 2]" 1
1347 1 49 VAL H 1 50 LEU HG . . 5.200 4.943 4.497 5.295 0.095 6 0 "[ . 1 . 2]" 1
1348 1 49 VAL H 1 51 PRO HD2 . . 4.830 3.097 2.356 3.733 . 0 0 "[ . 1 . 2]" 1
1349 1 49 VAL H 1 51 PRO HD3 . . 4.220 3.969 3.471 4.288 0.068 18 0 "[ . 1 . 2]" 1
1350 1 49 VAL H 1 52 GLN HE21 . . 5.500 4.597 4.125 5.153 . 0 0 "[ . 1 . 2]" 1
1351 1 49 VAL HA 1 49 VAL MG1 . . 3.380 2.731 2.480 2.917 . 0 0 "[ . 1 . 2]" 1
1352 1 49 VAL HA 1 49 VAL MG2 . . 3.260 2.246 2.158 2.362 . 0 0 "[ . 1 . 2]" 1
1353 1 49 VAL HA 1 50 LEU HB2 . . 5.500 5.571 5.467 5.590 0.090 19 0 "[ . 1 . 2]" 1
1354 1 49 VAL HA 1 52 GLN H . . 5.300 4.088 3.404 5.094 . 0 0 "[ . 1 . 2]" 1
1355 1 49 VAL HA 1 52 GLN HB2 . . 4.650 3.159 2.559 3.980 . 0 0 "[ . 1 . 2]" 1
1356 1 49 VAL HA 1 52 GLN HB3 . . 5.210 4.762 4.207 5.282 0.072 18 0 "[ . 1 . 2]" 1
1357 1 49 VAL HA 1 52 GLN HE21 . . 3.830 2.583 1.753 3.083 . 0 0 "[ . 1 . 2]" 1
1358 1 49 VAL HA 1 52 GLN HE22 . . 4.150 3.875 2.715 4.238 0.088 16 0 "[ . 1 . 2]" 1
1359 1 49 VAL HA 1 52 GLN HG2 . . 5.020 5.051 4.808 5.106 0.086 2 0 "[ . 1 . 2]" 1
1360 1 49 VAL HA 1 52 GLN HG3 . . 4.800 3.521 3.072 3.923 . 0 0 "[ . 1 . 2]" 1
1361 1 49 VAL HB 1 50 LEU H . . 3.710 2.640 2.331 2.997 . 0 0 "[ . 1 . 2]" 1
1362 1 49 VAL HB 1 50 LEU QD . . 4.880 3.840 3.026 4.353 . 0 0 "[ . 1 . 2]" 1
1363 1 49 VAL HB 1 50 LEU HG . . 5.370 4.633 3.945 5.428 0.058 6 0 "[ . 1 . 2]" 1
1364 1 49 VAL HB 1 51 PRO HD2 . . 5.230 4.602 4.316 5.098 . 0 0 "[ . 1 . 2]" 1
1365 1 49 VAL HB 1 51 PRO HD3 . . 5.330 5.406 5.366 5.418 0.088 6 0 "[ . 1 . 2]" 1
1366 1 49 VAL MG1 1 50 LEU H . . 3.950 2.841 2.513 3.271 . 0 0 "[ . 1 . 2]" 1
1367 1 49 VAL MG1 1 50 LEU HA . . 4.070 3.258 3.056 3.487 . 0 0 "[ . 1 . 2]" 1
1368 1 49 VAL MG1 1 50 LEU QD . . 4.070 2.637 2.331 3.182 . 0 0 "[ . 1 . 2]" 1
1369 1 49 VAL MG1 1 51 PRO HD2 . . 5.500 4.658 4.542 4.900 . 0 0 "[ . 1 . 2]" 1
1370 1 49 VAL MG1 1 51 PRO HD3 . . 5.500 5.363 4.889 5.575 0.075 9 0 "[ . 1 . 2]" 1
1371 1 49 VAL MG2 1 50 LEU H . . 4.420 4.052 3.884 4.227 . 0 0 "[ . 1 . 2]" 1
1372 1 49 VAL MG2 1 50 LEU HA . . 5.500 5.471 5.252 5.572 0.072 18 0 "[ . 1 . 2]" 1
1373 1 49 VAL MG2 1 50 LEU QD . . 5.500 4.696 4.227 4.948 . 0 0 "[ . 1 . 2]" 1
1374 1 49 VAL MG2 1 52 GLN HE21 . . 5.150 3.586 3.208 3.997 . 0 0 "[ . 1 . 2]" 1
1375 1 49 VAL MG2 1 52 GLN HE22 . . 5.500 4.050 3.525 4.644 . 0 0 "[ . 1 . 2]" 1
1376 1 49 VAL MG2 1 53 LEU QD . . 5.310 3.479 2.782 4.260 . 0 0 "[ . 1 . 2]" 1
1377 1 50 LEU H 1 50 LEU HB2 . . 3.680 2.261 2.194 2.332 . 0 0 "[ . 1 . 2]" 1
1378 1 50 LEU H 1 50 LEU HB3 . . 4.140 3.512 3.469 3.564 . 0 0 "[ . 1 . 2]" 1
1379 1 50 LEU H 1 50 LEU QD . . 4.250 2.769 2.012 3.183 . 0 0 "[ . 1 . 2]" 1
1380 1 50 LEU H 1 50 LEU HG . . 3.500 2.877 2.588 3.391 . 0 0 "[ . 1 . 2]" 1
1381 1 50 LEU H 1 51 PRO HD2 . . 3.610 2.836 2.662 3.119 . 0 0 "[ . 1 . 2]" 1
1382 1 50 LEU H 1 51 PRO HD3 . . 3.610 3.088 2.774 3.356 . 0 0 "[ . 1 . 2]" 1
1383 1 50 LEU H 1 51 PRO HG2 . . 5.380 5.076 4.906 5.290 . 0 0 "[ . 1 . 2]" 1
1384 1 50 LEU H 1 52 GLN H . . 5.500 4.503 4.241 4.927 . 0 0 "[ . 1 . 2]" 1
1385 1 50 LEU HA 1 50 LEU QD . . 3.360 2.113 1.953 2.682 . 0 0 "[ . 1 . 2]" 1
1386 1 50 LEU HA 1 52 GLN H . . 5.270 3.761 3.502 4.041 . 0 0 "[ . 1 . 2]" 1
1387 1 50 LEU HA 1 53 LEU H . . 4.100 3.459 3.217 3.633 . 0 0 "[ . 1 . 2]" 1
1388 1 50 LEU HA 1 53 LEU HB2 . . 5.120 2.708 2.348 3.058 . 0 0 "[ . 1 . 2]" 1
1389 1 50 LEU HA 1 53 LEU HB3 . . 5.350 4.252 3.933 4.607 . 0 0 "[ . 1 . 2]" 1
1390 1 50 LEU HA 1 53 LEU QD . . 4.190 3.069 2.007 3.988 . 0 0 "[ . 1 . 2]" 1
1391 1 50 LEU HA 1 57 TYR QE . . 3.690 3.696 3.247 3.802 0.112 18 0 "[ . 1 . 2]" 1
1392 1 50 LEU HB2 1 51 PRO HD2 . . 3.660 3.216 2.937 3.482 . 0 0 "[ . 1 . 2]" 1
1393 1 50 LEU HB2 1 51 PRO HD3 . . 3.400 2.151 2.020 2.336 . 0 0 "[ . 1 . 2]" 1
1394 1 50 LEU HB3 1 51 PRO HA . . 5.080 4.164 4.054 4.299 . 0 0 "[ . 1 . 2]" 1
1395 1 50 LEU HB3 1 51 PRO HD2 . . 4.360 4.166 3.926 4.397 0.037 5 0 "[ . 1 . 2]" 1
1396 1 50 LEU HB3 1 51 PRO HD3 . . 3.850 3.055 2.838 3.297 . 0 0 "[ . 1 . 2]" 1
1397 1 50 LEU HB3 1 57 TYR QE . . 5.280 3.728 3.259 4.381 . 0 0 "[ . 1 . 2]" 1
1398 1 50 LEU QD 1 51 PRO HD2 . . 5.500 4.522 4.051 4.763 . 0 0 "[ . 1 . 2]" 1
1399 1 50 LEU QD 1 51 PRO HD3 . . 5.100 3.930 3.571 4.120 . 0 0 "[ . 1 . 2]" 1
1400 1 50 LEU QD 1 53 LEU H . . 5.500 4.678 4.334 5.235 . 0 0 "[ . 1 . 2]" 1
1401 1 50 LEU QD 1 53 LEU QD . . 4.590 3.112 1.961 4.060 . 0 0 "[ . 1 . 2]" 1
1402 1 50 LEU QD 1 57 TYR HB3 . . 5.490 3.226 2.755 4.307 . 0 0 "[ . 1 . 2]" 1
1403 1 50 LEU QD 1 57 TYR QD . . 3.220 2.687 2.429 3.032 . 0 0 "[ . 1 . 2]" 1
1404 1 50 LEU QD 1 57 TYR QE . . 3.230 2.395 2.019 2.675 . 0 0 "[ . 1 . 2]" 1
1405 1 50 LEU QD 1 59 PHE QE . . 3.370 2.437 2.066 3.091 . 0 0 "[ . 1 . 2]" 1
1406 1 50 LEU QD 1 59 PHE HZ . . 3.330 2.378 1.913 2.969 . 0 0 "[ . 1 . 2]" 1
1407 1 50 LEU QD 1 83 GLY HA2 . . 4.990 3.842 3.310 4.342 . 0 0 "[ . 1 . 2]" 1
1408 1 50 LEU QD 1 83 GLY HA3 . . 4.400 2.639 2.308 3.088 . 0 0 "[ . 1 . 2]" 1
1409 1 50 LEU QD 1 87 GLY H . . 5.500 4.411 3.756 5.247 . 0 0 "[ . 1 . 2]" 1
1410 1 50 LEU QD 1 87 GLY HA2 . . 4.630 3.678 2.697 4.276 . 0 0 "[ . 1 . 2]" 1
1411 1 50 LEU QD 1 87 GLY HA3 . . 4.600 2.893 2.063 3.761 . 0 0 "[ . 1 . 2]" 1
1412 1 50 LEU QD 1 95 VAL HB . . 5.380 4.826 4.261 5.363 . 0 0 "[ . 1 . 2]" 1
1413 1 50 LEU QD 1 95 VAL QG . . 3.620 2.842 2.380 3.291 . 0 0 "[ . 1 . 2]" 1
1414 1 50 LEU HG 1 51 PRO HD2 . . 5.200 5.126 4.827 5.286 0.086 14 0 "[ . 1 . 2]" 1
1415 1 50 LEU HG 1 51 PRO HD3 . . 5.010 4.423 4.146 4.817 . 0 0 "[ . 1 . 2]" 1
1416 1 51 PRO HA 1 53 LEU H . . 4.440 3.916 3.552 4.285 . 0 0 "[ . 1 . 2]" 1
1417 1 51 PRO HB2 1 52 GLN H . . 4.390 4.251 3.528 4.450 0.060 15 0 "[ . 1 . 2]" 1
1418 1 51 PRO HB2 1 52 GLN HG2 . . 5.500 4.853 3.947 5.541 0.041 2 0 "[ . 1 . 2]" 1
1419 1 51 PRO HD2 1 52 GLN H . . 4.390 3.208 2.543 3.803 . 0 0 "[ . 1 . 2]" 1
1420 1 51 PRO HD3 1 52 GLN H . . 4.950 4.205 3.816 4.463 . 0 0 "[ . 1 . 2]" 1
1421 1 51 PRO HD3 1 53 LEU H . . 5.500 5.453 5.213 5.581 0.081 19 0 "[ . 1 . 2]" 1
1422 1 51 PRO HG2 1 52 GLN H . . 5.190 3.855 3.212 4.361 . 0 0 "[ . 1 . 2]" 1
1423 1 51 PRO HG2 1 52 GLN HG2 . . 5.500 4.237 3.341 5.571 0.071 5 0 "[ . 1 . 2]" 1
1424 1 51 PRO HG3 1 52 GLN H . . 5.500 4.992 4.568 5.337 . 0 0 "[ . 1 . 2]" 1
1425 1 52 GLN H 1 52 GLN HB2 . . 4.090 2.759 2.379 3.037 . 0 0 "[ . 1 . 2]" 1
1426 1 52 GLN H 1 52 GLN HB3 . . 3.990 3.814 3.607 3.983 . 0 0 "[ . 1 . 2]" 1
1427 1 52 GLN H 1 52 GLN HE21 . . 5.500 4.612 3.958 5.286 . 0 0 "[ . 1 . 2]" 1
1428 1 52 GLN H 1 52 GLN HG2 . . 4.120 3.874 3.385 4.196 0.076 15 0 "[ . 1 . 2]" 1
1429 1 52 GLN H 1 52 GLN HG3 . . 3.750 3.017 2.567 3.551 . 0 0 "[ . 1 . 2]" 1
1430 1 52 GLN H 1 53 LEU H . . 3.210 1.869 1.515 2.218 . 0 0 "[ . 1 . 2]" 1
1431 1 52 GLN H 1 53 LEU HB2 . . 5.500 3.743 3.317 4.276 . 0 0 "[ . 1 . 2]" 1
1432 1 52 GLN H 1 53 LEU HG . . 5.500 4.591 3.095 5.573 0.073 4 0 "[ . 1 . 2]" 1
1433 1 52 GLN HA 1 52 GLN HG2 . . 3.010 2.597 2.440 2.788 . 0 0 "[ . 1 . 2]" 1
1434 1 52 GLN HA 1 52 GLN HG3 . . 3.680 3.298 2.962 3.600 . 0 0 "[ . 1 . 2]" 1
1435 1 52 GLN HB2 1 52 GLN HE21 . . 4.270 2.938 2.118 3.609 . 0 0 "[ . 1 . 2]" 1
1436 1 52 GLN HB2 1 52 GLN HE22 . . 4.580 3.969 3.690 4.288 . 0 0 "[ . 1 . 2]" 1
1437 1 52 GLN HB2 1 53 LEU H . . 4.270 3.274 2.768 3.818 . 0 0 "[ . 1 . 2]" 1
1438 1 52 GLN HB2 1 53 LEU QD . . 5.500 2.854 2.265 4.351 . 0 0 "[ . 1 . 2]" 1
1439 1 52 GLN HB3 1 52 GLN HE21 . . 4.720 3.788 2.849 4.222 . 0 0 "[ . 1 . 2]" 1
1440 1 52 GLN HB3 1 52 GLN HE22 . . 5.000 4.256 3.815 4.656 . 0 0 "[ . 1 . 2]" 1
1441 1 52 GLN HB3 1 53 LEU H . . 4.950 4.180 3.888 4.506 . 0 0 "[ . 1 . 2]" 1
1442 1 52 GLN HE21 1 52 GLN HG3 . . 3.590 2.376 2.204 2.843 . 0 0 "[ . 1 . 2]" 1
1443 1 52 GLN HG2 1 53 LEU H . . 5.500 5.110 4.898 5.298 . 0 0 "[ . 1 . 2]" 1
1444 1 52 GLN HG3 1 53 LEU H . . 4.930 4.514 4.160 4.889 . 0 0 "[ . 1 . 2]" 1
1445 1 52 GLN HG3 1 53 LEU QD . . 5.470 4.631 4.182 5.300 . 0 0 "[ . 1 . 2]" 1
1446 1 53 LEU H 1 53 LEU HB2 . . 3.450 2.222 2.000 2.359 . 0 0 "[ . 1 . 2]" 1
1447 1 53 LEU H 1 53 LEU HB3 . . 3.760 3.494 3.297 3.614 . 0 0 "[ . 1 . 2]" 1
1448 1 53 LEU H 1 53 LEU QD . . 4.490 2.736 2.309 3.301 . 0 0 "[ . 1 . 2]" 1
1449 1 53 LEU H 1 53 LEU HG . . 3.730 3.427 2.346 3.830 0.100 4 0 "[ . 1 . 2]" 1
1450 1 53 LEU H 1 54 GLU H . . 4.940 4.519 4.406 4.652 . 0 0 "[ . 1 . 2]" 1
1451 1 53 LEU H 1 57 TYR QD . . 5.500 5.281 4.913 5.570 0.070 11 0 "[ . 1 . 2]" 1
1452 1 53 LEU H 1 57 TYR QE . . 4.330 3.860 3.593 4.205 . 0 0 "[ . 1 . 2]" 1
1453 1 53 LEU HA 1 53 LEU QD . . 3.090 2.175 2.024 2.862 . 0 0 "[ . 1 . 2]" 1
1454 1 53 LEU HA 1 54 GLU H . . 3.060 2.550 2.370 2.797 . 0 0 "[ . 1 . 2]" 1
1455 1 53 LEU HA 1 55 GLN H . . 5.500 5.540 5.353 5.589 0.089 11 0 "[ . 1 . 2]" 1
1456 1 53 LEU HA 1 57 TYR QE . . 4.310 4.299 4.101 4.418 0.108 18 0 "[ . 1 . 2]" 1
1457 1 53 LEU HB2 1 54 GLU H . . 3.910 3.610 3.372 3.898 . 0 0 "[ . 1 . 2]" 1
1458 1 53 LEU HB2 1 57 TYR QD . . 3.490 3.190 2.694 3.560 0.070 20 0 "[ . 1 . 2]" 1
1459 1 53 LEU HB2 1 57 TYR QE . . 2.790 2.308 1.948 2.832 0.042 20 0 "[ . 1 . 2]" 1
1460 1 53 LEU HB3 1 54 GLU H . . 3.240 2.305 2.104 2.598 . 0 0 "[ . 1 . 2]" 1
1461 1 53 LEU HB3 1 57 TYR QD . . 5.250 2.438 2.207 2.649 . 0 0 "[ . 1 . 2]" 1
1462 1 53 LEU HB3 1 57 TYR QE . . 5.030 2.452 2.000 2.943 . 0 0 "[ . 1 . 2]" 1
1463 1 53 LEU QD 1 54 GLU H . . 4.020 3.231 2.451 3.866 . 0 0 "[ . 1 . 2]" 1
1464 1 53 LEU QD 1 57 TYR QD . . 5.390 2.697 2.408 3.185 . 0 0 "[ . 1 . 2]" 1
1465 1 53 LEU QD 1 57 TYR QE . . 5.080 3.611 3.046 3.981 . 0 0 "[ . 1 . 2]" 1
1466 1 53 LEU QD 1 97 VAL HB . . 5.500 4.938 4.352 5.327 . 0 0 "[ . 1 . 2]" 1
1467 1 53 LEU QD 1 97 VAL QG . . 3.450 2.781 2.234 3.165 . 0 0 "[ . 1 . 2]" 1
1468 1 53 LEU HG 1 54 GLU H . . 5.290 4.608 3.593 5.001 . 0 0 "[ . 1 . 2]" 1
1469 1 53 LEU HG 1 57 TYR QE . . 4.440 4.324 4.057 4.555 0.115 2 0 "[ . 1 . 2]" 1
1470 1 54 GLU H 1 54 GLU HB2 . . 3.920 2.513 2.236 3.484 . 0 0 "[ . 1 . 2]" 1
1471 1 54 GLU H 1 54 GLU HB3 . . 3.500 3.557 3.375 3.638 0.138 19 0 "[ . 1 . 2]" 1
1472 1 54 GLU H 1 54 GLU HG2 . . 3.690 2.733 2.044 3.419 . 0 0 "[ . 1 . 2]" 1
1473 1 54 GLU H 1 54 GLU HG3 . . 3.970 3.287 2.038 4.014 0.044 10 0 "[ . 1 . 2]" 1
1474 1 54 GLU H 1 55 GLN H . . 4.850 3.126 2.872 3.341 . 0 0 "[ . 1 . 2]" 1
1475 1 54 GLU H 1 57 TYR QE . . 4.990 3.397 3.043 3.728 . 0 0 "[ . 1 . 2]" 1
1476 1 54 GLU HA 1 54 GLU HG2 . . 3.500 2.978 2.247 3.803 0.303 12 0 "[ . 1 . 2]" 1
1477 1 54 GLU HA 1 54 GLU HG3 . . 3.690 3.627 3.170 3.775 0.085 13 0 "[ . 1 . 2]" 1
1478 1 54 GLU HA 1 55 GLN HA . . 5.000 4.646 4.464 4.841 . 0 0 "[ . 1 . 2]" 1
1479 1 54 GLU HA 1 55 GLN HB2 . . 4.260 4.344 4.327 4.355 0.095 3 0 "[ . 1 . 2]" 1
1480 1 54 GLU HA 1 57 TYR QE . . 4.370 4.416 4.110 4.472 0.102 18 0 "[ . 1 . 2]" 1
1481 1 54 GLU HB2 1 55 GLN H . . 3.500 2.106 1.937 2.303 . 0 0 "[ . 1 . 2]" 1
1482 1 54 GLU HB2 1 55 GLN HA . . 5.500 4.747 4.507 4.913 . 0 0 "[ . 1 . 2]" 1
1483 1 54 GLU HB3 1 55 GLN H . . 4.280 2.864 2.388 3.662 . 0 0 "[ . 1 . 2]" 1
1484 1 54 GLU HG2 1 55 GLN H . . 4.890 4.334 3.449 4.765 . 0 0 "[ . 1 . 2]" 1
1485 1 54 GLU HG3 1 55 GLN H . . 4.700 4.337 3.914 4.562 . 0 0 "[ . 1 . 2]" 1
1486 1 55 GLN H 1 55 GLN HB2 . . 3.450 3.033 2.777 3.403 . 0 0 "[ . 1 . 2]" 1
1487 1 55 GLN H 1 55 GLN HB3 . . 4.100 3.615 3.243 3.829 . 0 0 "[ . 1 . 2]" 1
1488 1 55 GLN H 1 55 GLN HE21 . . 5.500 5.201 4.526 5.579 0.079 11 0 "[ . 1 . 2]" 1
1489 1 55 GLN H 1 55 GLN HG3 . . 4.440 4.623 4.067 5.253 0.813 4 4 "[ - +.* 1 . * 2]" 1
1490 1 55 GLN H 1 57 TYR HA . . 5.500 4.939 4.481 5.310 . 0 0 "[ . 1 . 2]" 1
1491 1 55 GLN H 1 57 TYR QE . . 5.130 3.441 3.041 3.751 . 0 0 "[ . 1 . 2]" 1
1492 1 55 GLN HA 1 55 GLN HG2 . . 4.000 2.770 2.083 3.648 . 0 0 "[ . 1 . 2]" 1
1493 1 55 GLN HA 1 55 GLN HG3 . . 3.920 3.106 2.227 3.626 . 0 0 "[ . 1 . 2]" 1
1494 1 55 GLN HA 1 57 TYR H . . 4.660 4.276 4.143 4.510 . 0 0 "[ . 1 . 2]" 1
1495 1 55 GLN HA 1 57 TYR QD . . 4.900 3.987 3.767 4.244 . 0 0 "[ . 1 . 2]" 1
1496 1 55 GLN HA 1 57 TYR QE . . 3.950 2.749 2.419 3.025 . 0 0 "[ . 1 . 2]" 1
1497 1 55 GLN HB2 1 55 GLN HE22 . . 5.500 4.615 4.093 4.974 . 0 0 "[ . 1 . 2]" 1
1498 1 55 GLN HB3 1 57 TYR H . . 4.910 4.997 4.987 5.009 0.099 19 0 "[ . 1 . 2]" 1
1499 1 55 GLN HE21 1 57 TYR QE . . 5.120 3.915 2.584 5.200 0.080 14 0 "[ . 1 . 2]" 1
1500 1 55 GLN HE21 1 82 ASP HA . . 4.570 3.232 2.519 3.711 . 0 0 "[ . 1 . 2]" 1
1501 1 55 GLN HE22 1 56 PRO QD . . 5.500 5.592 5.163 6.132 0.632 5 6 "[* + * 1 * . * -2]" 1
1502 1 55 GLN HE22 1 82 ASP HA . . 4.430 3.895 2.447 4.645 0.215 17 0 "[ . 1 . 2]" 1
1503 1 55 GLN HE22 1 82 ASP QB . . 5.500 4.747 2.917 6.091 0.591 17 2 "[ . - 1 . + 2]" 1
1504 1 55 GLN HG2 1 57 TYR QE . . 5.360 4.754 3.991 5.479 0.119 5 0 "[ . 1 . 2]" 1
1505 1 55 GLN HG3 1 57 TYR QE . . 4.990 4.999 4.054 5.467 0.477 6 0 "[ . 1 . 2]" 1
1506 1 56 PRO HA 1 57 TYR H . . 3.170 2.180 2.076 2.300 . 0 0 "[ . 1 . 2]" 1
1507 1 56 PRO HB2 1 79 ALA HA . . 5.240 5.271 4.940 5.322 0.082 5 0 "[ . 1 . 2]" 1
1508 1 56 PRO HB2 1 80 GLU H . . 4.990 4.663 4.217 5.074 0.084 13 0 "[ . 1 . 2]" 1
1509 1 56 PRO HB3 1 80 GLU H . . 5.500 4.976 4.552 5.505 0.005 13 0 "[ . 1 . 2]" 1
1510 1 56 PRO HB3 1 81 MET HA . . 3.580 3.476 3.011 3.658 0.078 13 0 "[ . 1 . 2]" 1
1511 1 56 PRO QD 1 81 MET ME . . 4.710 4.390 2.905 4.661 . 0 0 "[ . 1 . 2]" 1
1512 1 56 PRO HG3 1 81 MET HA . . 5.500 5.173 3.547 5.560 0.060 10 0 "[ . 1 . 2]" 1
1513 1 57 TYR H 1 57 TYR HB2 . . 3.660 2.727 2.421 3.053 . 0 0 "[ . 1 . 2]" 1
1514 1 57 TYR H 1 57 TYR QD . . 4.020 3.009 2.848 3.121 . 0 0 "[ . 1 . 2]" 1
1515 1 57 TYR H 1 57 TYR QE . . 5.500 4.224 4.038 4.454 . 0 0 "[ . 1 . 2]" 1
1516 1 57 TYR H 1 59 PHE QE . . 5.500 5.089 4.639 5.451 . 0 0 "[ . 1 . 2]" 1
1517 1 57 TYR H 1 79 ALA HA . . 5.200 4.975 4.764 5.266 0.066 10 0 "[ . 1 . 2]" 1
1518 1 57 TYR H 1 80 GLU H . . 4.090 3.340 2.915 3.861 . 0 0 "[ . 1 . 2]" 1
1519 1 57 TYR H 1 80 GLU HB2 . . 5.500 4.834 4.268 5.443 . 0 0 "[ . 1 . 2]" 1
1520 1 57 TYR H 1 81 MET HA . . 4.240 3.431 2.824 4.318 0.078 4 0 "[ . 1 . 2]" 1
1521 1 57 TYR H 1 95 VAL QG . . 5.500 4.499 4.243 4.774 . 0 0 "[ . 1 . 2]" 1
1522 1 57 TYR HA 1 57 TYR QD . . 3.060 2.476 2.337 2.689 . 0 0 "[ . 1 . 2]" 1
1523 1 57 TYR HA 1 58 VAL H . . 3.400 2.213 2.122 2.287 . 0 0 "[ . 1 . 2]" 1
1524 1 57 TYR HA 1 80 GLU H . . 5.500 4.843 4.378 5.191 . 0 0 "[ . 1 . 2]" 1
1525 1 57 TYR HA 1 95 VAL QG . . 4.520 2.573 2.270 2.810 . 0 0 "[ . 1 . 2]" 1
1526 1 57 TYR HB2 1 58 VAL H . . 5.130 4.331 4.166 4.443 . 0 0 "[ . 1 . 2]" 1
1527 1 57 TYR HB2 1 59 PHE QE . . 3.140 3.036 2.743 3.225 0.085 14 0 "[ . 1 . 2]" 1
1528 1 57 TYR HB2 1 59 PHE HZ . . 3.840 3.027 2.659 3.559 . 0 0 "[ . 1 . 2]" 1
1529 1 57 TYR HB2 1 79 ALA HA . . 5.160 4.819 4.593 5.226 0.066 10 0 "[ . 1 . 2]" 1
1530 1 57 TYR HB2 1 95 VAL QG . . 5.160 3.188 2.660 3.602 . 0 0 "[ . 1 . 2]" 1
1531 1 57 TYR HB3 1 58 VAL H . . 4.530 3.865 3.504 4.150 . 0 0 "[ . 1 . 2]" 1
1532 1 57 TYR HB3 1 59 PHE QD . . 5.500 3.890 3.601 4.187 . 0 0 "[ . 1 . 2]" 1
1533 1 57 TYR HB3 1 59 PHE QE . . 3.870 2.924 2.376 3.271 . 0 0 "[ . 1 . 2]" 1
1534 1 57 TYR HB3 1 59 PHE HZ . . 4.270 3.680 3.061 4.340 0.070 14 0 "[ . 1 . 2]" 1
1535 1 57 TYR HB3 1 80 GLU H . . 5.360 5.145 4.840 5.433 0.073 5 0 "[ . 1 . 2]" 1
1536 1 57 TYR HB3 1 95 VAL QG . . 3.970 2.119 1.916 2.406 . 0 0 "[ . 1 . 2]" 1
1537 1 57 TYR QD 1 58 VAL H . . 5.140 4.516 4.296 4.719 . 0 0 "[ . 1 . 2]" 1
1538 1 57 TYR QD 1 59 PHE QE . . 3.290 3.336 3.062 3.412 0.122 5 0 "[ . 1 . 2]" 1
1539 1 57 TYR QD 1 80 GLU H . . 5.090 4.690 4.245 5.155 0.065 20 0 "[ . 1 . 2]" 1
1540 1 57 TYR QD 1 83 GLY HA2 . . 4.010 3.015 2.475 3.448 . 0 0 "[ . 1 . 2]" 1
1541 1 57 TYR QD 1 83 GLY HA3 . . 4.100 2.816 2.200 3.433 . 0 0 "[ . 1 . 2]" 1
1542 1 57 TYR QD 1 84 ILE H . . 5.500 5.204 4.900 5.574 0.074 12 0 "[ . 1 . 2]" 1
1543 1 57 TYR QD 1 95 VAL QG . . 3.440 3.200 2.988 3.328 . 0 0 "[ . 1 . 2]" 1
1544 1 57 TYR QE 1 82 ASP HA . . 3.270 3.132 2.439 3.366 0.096 2 0 "[ . 1 . 2]" 1
1545 1 57 TYR QE 1 83 GLY HA2 . . 4.400 4.359 4.131 4.481 0.081 19 0 "[ . 1 . 2]" 1
1546 1 57 TYR QE 1 83 GLY HA3 . . 3.650 3.434 3.185 3.736 0.086 7 0 "[ . 1 . 2]" 1
1547 1 58 VAL H 1 58 VAL HB . . 3.760 2.588 2.327 2.736 . 0 0 "[ . 1 . 2]" 1
1548 1 58 VAL H 1 58 VAL QG . . 4.060 2.135 1.853 2.306 . 0 0 "[ . 1 . 2]" 1
1549 1 58 VAL H 1 79 ALA HA . . 5.500 4.475 3.747 4.891 . 0 0 "[ . 1 . 2]" 1
1550 1 58 VAL H 1 95 VAL QG . . 5.330 2.505 2.296 2.787 . 0 0 "[ . 1 . 2]" 1
1551 1 58 VAL HA 1 59 PHE H . . 2.900 2.230 2.114 2.309 . 0 0 "[ . 1 . 2]" 1
1552 1 58 VAL HA 1 59 PHE HA . . 5.500 4.544 4.490 4.598 . 0 0 "[ . 1 . 2]" 1
1553 1 58 VAL HA 1 59 PHE HB2 . . 4.900 4.588 4.416 4.721 . 0 0 "[ . 1 . 2]" 1
1554 1 58 VAL HA 1 59 PHE QD . . 4.940 4.808 4.396 4.986 0.046 12 0 "[ . 1 . 2]" 1
1555 1 58 VAL HA 1 79 ALA HA . . 3.190 2.198 1.804 2.605 . 0 0 "[ . 1 . 2]" 1
1556 1 58 VAL HA 1 79 ALA MB . . 3.690 2.734 2.315 3.606 . 0 0 "[ . 1 . 2]" 1
1557 1 58 VAL HA 1 80 GLU H . . 4.060 3.872 3.561 4.041 . 0 0 "[ . 1 . 2]" 1
1558 1 58 VAL HB 1 59 PHE H . . 5.000 4.473 4.295 4.582 . 0 0 "[ . 1 . 2]" 1
1559 1 58 VAL HB 1 96 LEU H . . 4.860 3.136 2.702 4.887 0.027 15 0 "[ . 1 . 2]" 1
1560 1 58 VAL HB 1 96 LEU HB2 . . 4.440 2.648 2.219 4.453 0.013 15 0 "[ . 1 . 2]" 1
1561 1 58 VAL HB 1 96 LEU HB3 . . 4.980 4.049 3.668 5.071 0.091 15 0 "[ . 1 . 2]" 1
1562 1 58 VAL HB 1 97 VAL QG . . 5.500 5.035 4.558 5.487 . 0 0 "[ . 1 . 2]" 1
1563 1 58 VAL QG 1 59 PHE H . . 3.660 3.256 2.868 3.446 . 0 0 "[ . 1 . 2]" 1
1564 1 58 VAL QG 1 77 LEU HA . . 4.240 3.643 3.361 3.844 . 0 0 "[ . 1 . 2]" 1
1565 1 58 VAL QG 1 77 LEU HB3 . . 3.800 3.381 2.939 3.836 0.036 8 0 "[ . 1 . 2]" 1
1566 1 58 VAL QG 1 77 LEU MD2 . . 4.020 2.239 1.894 3.689 . 0 0 "[ . 1 . 2]" 1
1567 1 58 VAL QG 1 78 VAL H . . 4.220 3.129 2.856 3.432 . 0 0 "[ . 1 . 2]" 1
1568 1 58 VAL QG 1 79 ALA H . . 5.500 4.538 4.119 5.103 . 0 0 "[ . 1 . 2]" 1
1569 1 58 VAL QG 1 79 ALA HA . . 4.220 3.233 2.945 3.513 . 0 0 "[ . 1 . 2]" 1
1570 1 58 VAL QG 1 79 ALA MB . . 4.880 2.292 2.063 3.253 . 0 0 "[ . 1 . 2]" 1
1571 1 58 VAL QG 1 80 GLU H . . 5.500 4.361 4.090 4.771 . 0 0 "[ . 1 . 2]" 1
1572 1 58 VAL QG 1 96 LEU H . . 5.020 3.490 2.379 3.738 . 0 0 "[ . 1 . 2]" 1
1573 1 58 VAL QG 1 96 LEU HB2 . . 4.310 2.692 2.049 3.151 . 0 0 "[ . 1 . 2]" 1
1574 1 59 PHE H 1 59 PHE HB2 . . 3.590 2.401 2.197 2.515 . 0 0 "[ . 1 . 2]" 1
1575 1 59 PHE H 1 59 PHE HB3 . . 4.030 3.581 3.508 3.695 . 0 0 "[ . 1 . 2]" 1
1576 1 59 PHE H 1 59 PHE QD . . 3.810 3.240 2.905 3.454 . 0 0 "[ . 1 . 2]" 1
1577 1 59 PHE H 1 59 PHE QE . . 5.370 4.803 4.465 5.087 . 0 0 "[ . 1 . 2]" 1
1578 1 59 PHE H 1 60 ILE H . . 5.030 4.534 4.449 4.600 . 0 0 "[ . 1 . 2]" 1
1579 1 59 PHE H 1 60 ILE HA . . 5.380 5.310 5.050 5.436 0.056 4 0 "[ . 1 . 2]" 1
1580 1 59 PHE H 1 78 VAL H . . 3.990 3.561 3.119 3.885 . 0 0 "[ . 1 . 2]" 1
1581 1 59 PHE H 1 78 VAL HB . . 5.020 3.631 3.213 5.100 0.080 14 0 "[ . 1 . 2]" 1
1582 1 59 PHE H 1 78 VAL QG . . 4.880 3.799 2.757 4.195 . 0 0 "[ . 1 . 2]" 1
1583 1 59 PHE H 1 79 ALA H . . 5.500 4.447 3.752 5.077 . 0 0 "[ . 1 . 2]" 1
1584 1 59 PHE H 1 79 ALA HA . . 3.760 2.721 2.263 3.259 . 0 0 "[ . 1 . 2]" 1
1585 1 59 PHE H 1 79 ALA MB . . 4.620 4.043 3.661 4.574 . 0 0 "[ . 1 . 2]" 1
1586 1 59 PHE H 1 80 GLU H . . 5.500 4.208 3.733 4.479 . 0 0 "[ . 1 . 2]" 1
1587 1 59 PHE H 1 95 VAL QG . . 5.500 3.783 3.003 4.402 . 0 0 "[ . 1 . 2]" 1
1588 1 59 PHE HA 1 59 PHE QD . . 3.120 2.305 2.132 2.599 . 0 0 "[ . 1 . 2]" 1
1589 1 59 PHE HA 1 60 ILE H . . 3.080 2.213 2.101 2.345 . 0 0 "[ . 1 . 2]" 1
1590 1 59 PHE HA 1 60 ILE HA . . 5.390 4.384 4.295 4.462 . 0 0 "[ . 1 . 2]" 1
1591 1 59 PHE HA 1 60 ILE HB . . 5.500 5.590 5.586 5.602 0.102 14 0 "[ . 1 . 2]" 1
1592 1 59 PHE HA 1 60 ILE HG12 . . 4.890 3.982 3.816 4.163 . 0 0 "[ . 1 . 2]" 1
1593 1 59 PHE HA 1 60 ILE MG . . 4.940 3.494 3.304 3.804 . 0 0 "[ . 1 . 2]" 1
1594 1 59 PHE HA 1 92 THR MG . . 5.110 3.493 3.206 3.658 . 0 0 "[ . 1 . 2]" 1
1595 1 59 PHE HA 1 94 GLY H . . 4.900 4.462 4.342 4.723 . 0 0 "[ . 1 . 2]" 1
1596 1 59 PHE HA 1 95 VAL H . . 5.370 4.748 4.605 4.867 . 0 0 "[ . 1 . 2]" 1
1597 1 59 PHE HA 1 95 VAL HA . . 3.220 2.241 2.086 2.393 . 0 0 "[ . 1 . 2]" 1
1598 1 59 PHE HA 1 95 VAL QG . . 4.360 2.917 2.398 3.331 . 0 0 "[ . 1 . 2]" 1
1599 1 59 PHE HA 1 96 LEU H . . 3.960 3.682 3.426 3.838 . 0 0 "[ . 1 . 2]" 1
1600 1 59 PHE HB2 1 60 ILE H . . 4.180 3.565 3.373 3.684 . 0 0 "[ . 1 . 2]" 1
1601 1 59 PHE HB2 1 78 VAL H . . 4.910 3.974 3.638 4.397 . 0 0 "[ . 1 . 2]" 1
1602 1 59 PHE HB2 1 78 VAL QG . . 3.940 2.965 1.838 3.315 . 0 0 "[ . 1 . 2]" 1
1603 1 59 PHE HB2 1 92 THR MG . . 3.970 3.280 3.044 3.493 . 0 0 "[ . 1 . 2]" 1
1604 1 59 PHE HB2 1 95 VAL HA . . 5.370 5.224 5.024 5.398 0.028 1 0 "[ . 1 . 2]" 1
1605 1 59 PHE HB2 1 95 VAL QG . . 5.490 4.539 4.163 4.792 . 0 0 "[ . 1 . 2]" 1
1606 1 59 PHE HB3 1 60 ILE H . . 3.670 2.345 2.153 2.495 . 0 0 "[ . 1 . 2]" 1
1607 1 59 PHE HB3 1 60 ILE HG13 . . 5.230 5.232 4.964 5.307 0.077 3 0 "[ . 1 . 2]" 1
1608 1 59 PHE HB3 1 78 VAL H . . 5.500 5.068 4.703 5.534 0.034 13 0 "[ . 1 . 2]" 1
1609 1 59 PHE HB3 1 78 VAL HB . . 5.040 4.015 3.406 4.920 . 0 0 "[ . 1 . 2]" 1
1610 1 59 PHE HB3 1 78 VAL QG . . 4.690 3.798 2.307 4.165 . 0 0 "[ . 1 . 2]" 1
1611 1 59 PHE HB3 1 86 TYR HB3 . . 4.460 3.827 3.096 4.527 0.067 3 0 "[ . 1 . 2]" 1
1612 1 59 PHE HB3 1 92 THR HB . . 4.850 4.712 4.466 4.919 0.069 1 0 "[ . 1 . 2]" 1
1613 1 59 PHE HB3 1 92 THR MG . . 3.630 2.011 1.936 2.110 . 0 0 "[ . 1 . 2]" 1
1614 1 59 PHE HB3 1 94 GLY H . . 5.150 4.632 4.406 4.989 . 0 0 "[ . 1 . 2]" 1
1615 1 59 PHE HB3 1 95 VAL QG . . 5.440 4.165 3.755 4.394 . 0 0 "[ . 1 . 2]" 1
1616 1 59 PHE QD 1 60 ILE H . . 4.510 3.571 3.388 3.688 . 0 0 "[ . 1 . 2]" 1
1617 1 59 PHE QD 1 78 VAL H . . 5.500 5.461 5.084 5.596 0.096 8 0 "[ . 1 . 2]" 1
1618 1 59 PHE QD 1 78 VAL HB . . 4.390 3.584 3.074 4.497 0.107 14 0 "[ . 1 . 2]" 1
1619 1 59 PHE QD 1 78 VAL QG . . 4.480 3.324 1.932 4.162 . 0 0 "[ . 1 . 2]" 1
1620 1 59 PHE QD 1 79 ALA HA . . 4.470 4.202 3.618 4.572 0.102 12 0 "[ . 1 . 2]" 1
1621 1 59 PHE QD 1 80 GLU H . . 4.800 4.321 3.556 4.802 0.002 7 0 "[ . 1 . 2]" 1
1622 1 59 PHE QD 1 80 GLU HB3 . . 5.350 4.324 3.695 5.353 0.003 5 0 "[ . 1 . 2]" 1
1623 1 59 PHE QD 1 80 GLU QG . . 4.160 3.500 2.756 4.217 0.057 16 0 "[ . 1 . 2]" 1
1624 1 59 PHE QD 1 86 TYR HB3 . . 3.820 3.318 2.423 4.374 0.554 13 1 "[ . 1 + . 2]" 1
1625 1 59 PHE QD 1 92 THR HB . . 5.410 5.109 4.791 5.475 0.065 1 0 "[ . 1 . 2]" 1
1626 1 59 PHE QD 1 92 THR MG . . 3.360 2.869 2.391 3.191 . 0 0 "[ . 1 . 2]" 1
1627 1 59 PHE QD 1 94 GLY H . . 4.840 4.712 4.321 4.922 0.082 14 0 "[ . 1 . 2]" 1
1628 1 59 PHE QD 1 95 VAL H . . 5.500 4.536 4.165 4.852 . 0 0 "[ . 1 . 2]" 1
1629 1 59 PHE QD 1 95 VAL HA . . 3.410 3.014 2.631 3.480 0.070 10 0 "[ . 1 . 2]" 1
1630 1 59 PHE QD 1 95 VAL HB . . 4.290 4.269 2.164 4.393 0.103 8 0 "[ . 1 . 2]" 1
1631 1 59 PHE QD 1 95 VAL QG . . 3.380 2.004 1.905 2.418 . 0 0 "[ . 1 . 2]" 1
1632 1 59 PHE QD 1 96 LEU H . . 5.250 4.936 4.527 5.330 0.080 10 0 "[ . 1 . 2]" 1
1633 1 59 PHE QE 1 80 GLU H . . 4.780 4.427 3.566 4.848 0.068 12 0 "[ . 1 . 2]" 1
1634 1 59 PHE QE 1 80 GLU HB2 . . 3.200 2.383 2.042 2.808 . 0 0 "[ . 1 . 2]" 1
1635 1 59 PHE QE 1 80 GLU HB3 . . 4.040 2.941 2.332 4.106 0.066 5 0 "[ . 1 . 2]" 1
1636 1 59 PHE QE 1 80 GLU QG . . 4.570 3.026 2.210 3.897 . 0 0 "[ . 1 . 2]" 1
1637 1 59 PHE QE 1 83 GLY HA2 . . 3.830 2.172 1.959 2.497 . 0 0 "[ . 1 . 2]" 1
1638 1 59 PHE QE 1 83 GLY HA3 . . 4.420 3.193 2.815 3.650 . 0 0 "[ . 1 . 2]" 1
1639 1 59 PHE QE 1 86 TYR HB3 . . 5.500 4.433 3.056 5.573 0.073 13 0 "[ . 1 . 2]" 1
1640 1 59 PHE QE 1 87 GLY HA2 . . 5.160 3.226 2.676 3.934 . 0 0 "[ . 1 . 2]" 1
1641 1 59 PHE QE 1 87 GLY HA3 . . 4.250 3.226 2.766 3.740 . 0 0 "[ . 1 . 2]" 1
1642 1 59 PHE QE 1 92 THR MG . . 4.360 3.933 3.472 4.201 . 0 0 "[ . 1 . 2]" 1
1643 1 59 PHE QE 1 95 VAL HB . . 4.580 4.590 3.026 4.700 0.120 8 0 "[ . 1 . 2]" 1
1644 1 59 PHE QE 1 95 VAL QG . . 3.130 2.109 1.959 2.735 . 0 0 "[ . 1 . 2]" 1
1645 1 59 PHE HZ 1 83 GLY HA2 . . 3.800 3.101 2.584 3.824 0.024 8 0 "[ . 1 . 2]" 1
1646 1 59 PHE HZ 1 83 GLY HA3 . . 3.920 2.772 2.052 3.467 . 0 0 "[ . 1 . 2]" 1
1647 1 59 PHE HZ 1 87 GLY HA2 . . 5.250 3.283 2.474 4.248 . 0 0 "[ . 1 . 2]" 1
1648 1 59 PHE HZ 1 87 GLY HA3 . . 4.690 2.695 2.206 3.197 . 0 0 "[ . 1 . 2]" 1
1649 1 59 PHE HZ 1 88 ARG H . . 5.000 4.889 4.251 5.091 0.091 14 0 "[ . 1 . 2]" 1
1650 1 60 ILE H 1 60 ILE HB . . 4.060 3.810 3.776 3.853 . 0 0 "[ . 1 . 2]" 1
1651 1 60 ILE H 1 60 ILE MD . . 4.420 4.076 3.968 4.198 . 0 0 "[ . 1 . 2]" 1
1652 1 60 ILE H 1 60 ILE HG12 . . 3.960 2.495 2.358 2.666 . 0 0 "[ . 1 . 2]" 1
1653 1 60 ILE H 1 60 ILE HG13 . . 3.860 3.178 2.915 3.348 . 0 0 "[ . 1 . 2]" 1
1654 1 60 ILE H 1 60 ILE MG . . 3.720 2.893 2.791 3.117 . 0 0 "[ . 1 . 2]" 1
1655 1 60 ILE H 1 61 LYS H . . 4.580 4.233 4.149 4.317 . 0 0 "[ . 1 . 2]" 1
1656 1 60 ILE H 1 92 THR HA . . 5.500 4.490 4.216 4.799 . 0 0 "[ . 1 . 2]" 1
1657 1 60 ILE H 1 92 THR MG . . 4.240 2.584 2.253 2.772 . 0 0 "[ . 1 . 2]" 1
1658 1 60 ILE H 1 93 LEU H . . 5.220 3.702 3.510 3.962 . 0 0 "[ . 1 . 2]" 1
1659 1 60 ILE H 1 94 GLY H . . 4.170 3.015 2.928 3.199 . 0 0 "[ . 1 . 2]" 1
1660 1 60 ILE H 1 95 VAL HA . . 4.160 3.668 3.307 3.892 . 0 0 "[ . 1 . 2]" 1
1661 1 60 ILE HA 1 60 ILE MD . . 4.250 4.194 4.165 4.242 . 0 0 "[ . 1 . 2]" 1
1662 1 60 ILE HA 1 60 ILE HG12 . . 4.170 3.862 3.802 3.925 . 0 0 "[ . 1 . 2]" 1
1663 1 60 ILE HA 1 60 ILE MG . . 3.180 2.249 2.177 2.308 . 0 0 "[ . 1 . 2]" 1
1664 1 60 ILE HA 1 61 LYS H . . 2.870 2.158 2.116 2.226 . 0 0 "[ . 1 . 2]" 1
1665 1 60 ILE HA 1 61 LYS HG3 . . 5.240 4.071 3.546 4.435 . 0 0 "[ . 1 . 2]" 1
1666 1 60 ILE HA 1 75 VAL HB . . 4.900 3.721 3.265 4.127 . 0 0 "[ . 1 . 2]" 1
1667 1 60 ILE HA 1 75 VAL MG1 . . 5.380 4.685 4.049 5.246 . 0 0 "[ . 1 . 2]" 1
1668 1 60 ILE HA 1 76 GLU H . . 4.340 3.587 3.357 3.750 . 0 0 "[ . 1 . 2]" 1
1669 1 60 ILE HA 1 77 LEU MD2 . . 4.620 4.310 3.888 4.709 0.089 8 0 "[ . 1 . 2]" 1
1670 1 60 ILE HA 1 78 VAL H . . 4.480 3.767 3.454 4.184 . 0 0 "[ . 1 . 2]" 1
1671 1 60 ILE HA 1 78 VAL QG . . 5.120 3.221 2.544 4.090 . 0 0 "[ . 1 . 2]" 1
1672 1 60 ILE HB 1 60 ILE MD . . 3.220 2.401 2.325 2.575 . 0 0 "[ . 1 . 2]" 1
1673 1 60 ILE HB 1 61 LYS H . . 4.090 3.370 3.101 3.607 . 0 0 "[ . 1 . 2]" 1
1674 1 60 ILE HB 1 75 VAL HB . . 3.650 2.576 2.272 2.911 . 0 0 "[ . 1 . 2]" 1
1675 1 60 ILE HB 1 76 GLU H . . 4.470 3.693 3.585 3.879 . 0 0 "[ . 1 . 2]" 1
1676 1 60 ILE HB 1 94 GLY H . . 4.890 4.707 4.499 4.916 0.026 8 0 "[ . 1 . 2]" 1
1677 1 60 ILE MD 1 60 ILE MG . . 2.960 2.080 2.018 2.133 . 0 0 "[ . 1 . 2]" 1
1678 1 60 ILE MD 1 75 VAL HB . . 4.270 3.769 3.390 3.992 . 0 0 "[ . 1 . 2]" 1
1679 1 60 ILE MD 1 92 THR MG . . 4.710 4.797 4.603 4.845 0.135 15 0 "[ . 1 . 2]" 1
1680 1 60 ILE MD 1 93 LEU H . . 4.800 3.961 3.717 4.113 . 0 0 "[ . 1 . 2]" 1
1681 1 60 ILE MD 1 93 LEU HB2 . . 4.370 2.230 2.097 2.485 . 0 0 "[ . 1 . 2]" 1
1682 1 60 ILE MD 1 93 LEU HB3 . . 4.480 3.405 3.206 3.567 . 0 0 "[ . 1 . 2]" 1
1683 1 60 ILE MD 1 94 GLY H . . 4.800 3.200 2.921 3.415 . 0 0 "[ . 1 . 2]" 1
1684 1 60 ILE MD 1 95 VAL HA . . 5.050 5.096 4.912 5.149 0.099 8 0 "[ . 1 . 2]" 1
1685 1 60 ILE HG12 1 60 ILE MG . . 3.440 2.364 2.219 2.517 . 0 0 "[ . 1 . 2]" 1
1686 1 60 ILE HG12 1 92 THR HA . . 5.500 5.374 5.027 5.559 0.059 6 0 "[ . 1 . 2]" 1
1687 1 60 ILE HG12 1 92 THR MG . . 5.200 3.922 3.748 4.130 . 0 0 "[ . 1 . 2]" 1
1688 1 60 ILE HG12 1 93 LEU H . . 4.540 3.594 3.151 3.856 . 0 0 "[ . 1 . 2]" 1
1689 1 60 ILE HG12 1 94 GLY H . . 3.820 2.228 2.014 2.378 . 0 0 "[ . 1 . 2]" 1
1690 1 60 ILE HG13 1 61 LYS H . . 4.880 4.417 4.281 4.663 . 0 0 "[ . 1 . 2]" 1
1691 1 60 ILE HG13 1 76 GLU H . . 5.500 5.556 5.357 5.582 0.082 16 0 "[ . 1 . 2]" 1
1692 1 60 ILE HG13 1 92 THR MG . . 4.840 3.874 3.594 4.041 . 0 0 "[ . 1 . 2]" 1
1693 1 60 ILE HG13 1 94 GLY H . . 4.950 2.493 2.199 2.872 . 0 0 "[ . 1 . 2]" 1
1694 1 60 ILE MG 1 61 LYS H . . 4.240 3.990 3.877 4.090 . 0 0 "[ . 1 . 2]" 1
1695 1 60 ILE MG 1 76 GLU H . . 4.290 4.369 4.220 4.398 0.108 20 0 "[ . 1 . 2]" 1
1696 1 60 ILE MG 1 77 LEU HA . . 4.280 2.886 2.654 3.211 . 0 0 "[ . 1 . 2]" 1
1697 1 60 ILE MG 1 78 VAL QG . . 5.130 4.303 3.777 4.964 . 0 0 "[ . 1 . 2]" 1
1698 1 60 ILE MG 1 92 THR MG . . 4.520 4.581 4.318 4.656 0.136 14 0 "[ . 1 . 2]" 1
1699 1 60 ILE MG 1 94 GLY H . . 4.100 4.202 4.175 4.219 0.119 4 0 "[ . 1 . 2]" 1
1700 1 61 LYS H 1 61 LYS HB3 . . 4.200 3.552 3.302 3.778 . 0 0 "[ . 1 . 2]" 1
1701 1 61 LYS H 1 61 LYS QD . . 5.110 4.194 3.635 4.450 . 0 0 "[ . 1 . 2]" 1
1702 1 61 LYS H 1 61 LYS HG2 . . 4.620 2.942 2.578 3.397 . 0 0 "[ . 1 . 2]" 1
1703 1 61 LYS H 1 61 LYS HG3 . . 4.490 2.259 1.885 2.601 . 0 0 "[ . 1 . 2]" 1
1704 1 61 LYS H 1 75 VAL HA . . 5.090 4.394 4.081 4.842 . 0 0 "[ . 1 . 2]" 1
1705 1 61 LYS H 1 75 VAL HB . . 4.460 3.105 2.615 3.558 . 0 0 "[ . 1 . 2]" 1
1706 1 61 LYS H 1 75 VAL MG2 . . 5.300 4.273 3.891 4.751 . 0 0 "[ . 1 . 2]" 1
1707 1 61 LYS H 1 76 GLU H . . 3.590 2.579 2.314 2.992 . 0 0 "[ . 1 . 2]" 1
1708 1 61 LYS H 1 76 GLU QB . . 5.500 4.455 3.559 4.951 . 0 0 "[ . 1 . 2]" 1
1709 1 61 LYS H 1 78 VAL QG . . 5.500 3.000 2.502 3.733 . 0 0 "[ . 1 . 2]" 1
1710 1 61 LYS H 1 92 THR HA . . 5.450 4.543 4.432 4.680 . 0 0 "[ . 1 . 2]" 1
1711 1 61 LYS H 1 92 THR MG . . 5.210 4.208 3.937 4.532 . 0 0 "[ . 1 . 2]" 1
1712 1 61 LYS HA 1 61 LYS QD . . 4.630 4.352 4.082 4.654 0.024 9 0 "[ . 1 . 2]" 1
1713 1 61 LYS HA 1 61 LYS QE . . 4.980 4.813 4.069 5.098 0.118 4 0 "[ . 1 . 2]" 1
1714 1 61 LYS HA 1 62 ARG H . . 3.080 2.265 2.141 2.399 . 0 0 "[ . 1 . 2]" 1
1715 1 61 LYS HA 1 62 ARG HA . . 4.930 4.266 4.095 4.426 . 0 0 "[ . 1 . 2]" 1
1716 1 61 LYS HA 1 75 VAL MG1 . . 4.340 3.719 3.110 4.430 0.090 12 0 "[ . 1 . 2]" 1
1717 1 61 LYS HA 1 92 THR HA . . 3.180 2.101 2.030 2.216 . 0 0 "[ . 1 . 2]" 1
1718 1 61 LYS HA 1 92 THR HB . . 5.060 5.057 4.847 5.145 0.085 14 0 "[ . 1 . 2]" 1
1719 1 61 LYS HA 1 92 THR MG . . 4.330 3.386 3.139 3.695 . 0 0 "[ . 1 . 2]" 1
1720 1 61 LYS HA 1 93 LEU H . . 3.510 3.165 3.004 3.431 . 0 0 "[ . 1 . 2]" 1
1721 1 61 LYS HA 1 93 LEU QD . . 4.490 3.448 1.980 4.148 . 0 0 "[ . 1 . 2]" 1
1722 1 61 LYS HA 1 93 LEU HG . . 4.770 3.634 3.240 4.863 0.093 9 0 "[ . 1 . 2]" 1
1723 1 61 LYS HA 1 94 GLY H . . 5.160 5.209 5.131 5.239 0.079 8 0 "[ . 1 . 2]" 1
1724 1 61 LYS HB2 1 61 LYS QD . . 3.760 2.249 2.063 2.570 . 0 0 "[ . 1 . 2]" 1
1725 1 61 LYS HB2 1 61 LYS QE . . 4.080 3.109 2.167 3.730 . 0 0 "[ . 1 . 2]" 1
1726 1 61 LYS HB2 1 62 ARG H . . 3.770 2.812 2.538 3.117 . 0 0 "[ . 1 . 2]" 1
1727 1 61 LYS HB2 1 63 SER H . . 4.670 4.053 3.406 4.759 0.089 4 0 "[ . 1 . 2]" 1
1728 1 61 LYS HB2 1 76 GLU H . . 5.180 5.188 4.861 5.276 0.096 20 0 "[ . 1 . 2]" 1
1729 1 61 LYS HB2 1 78 VAL QG . . 4.840 4.109 4.004 4.208 . 0 0 "[ . 1 . 2]" 1
1730 1 61 LYS HB2 1 91 ILE HB . . 4.820 4.799 4.422 4.906 0.086 13 0 "[ . 1 . 2]" 1
1731 1 61 LYS HB2 1 91 ILE MD . . 4.570 2.605 2.231 3.032 . 0 0 "[ . 1 . 2]" 1
1732 1 61 LYS HB2 1 91 ILE QG . . 3.850 2.107 2.006 2.242 . 0 0 "[ . 1 . 2]" 1
1733 1 61 LYS HB2 1 91 ILE MG . . 4.440 3.157 2.238 4.016 . 0 0 "[ . 1 . 2]" 1
1734 1 61 LYS HB2 1 92 THR HA . . 4.320 3.895 3.389 4.353 0.033 12 0 "[ . 1 . 2]" 1
1735 1 61 LYS HB3 1 61 LYS QE . . 4.370 3.441 2.015 4.251 . 0 0 "[ . 1 . 2]" 1
1736 1 61 LYS HB3 1 62 ARG H . . 4.200 3.633 3.310 3.901 . 0 0 "[ . 1 . 2]" 1
1737 1 61 LYS HB3 1 78 VAL QG . . 5.010 3.784 3.038 4.012 . 0 0 "[ . 1 . 2]" 1
1738 1 61 LYS HB3 1 92 THR HA . . 4.150 2.769 2.571 3.184 . 0 0 "[ . 1 . 2]" 1
1739 1 61 LYS HB3 1 92 THR MG . . 4.540 3.079 2.495 3.937 . 0 0 "[ . 1 . 2]" 1
1740 1 61 LYS HB3 1 93 LEU H . . 4.930 4.637 4.309 4.992 0.062 17 0 "[ . 1 . 2]" 1
1741 1 61 LYS QD 1 76 GLU QG . . 5.500 4.192 2.214 5.604 0.104 7 0 "[ . 1 . 2]" 1
1742 1 61 LYS QD 1 78 VAL HB . . 4.680 4.436 3.646 4.793 0.113 13 0 "[ . 1 . 2]" 1
1743 1 61 LYS QD 1 78 VAL QG . . 4.100 2.502 1.968 3.204 . 0 0 "[ . 1 . 2]" 1
1744 1 61 LYS QD 1 86 TYR QD . . 4.230 3.085 2.102 4.277 0.047 5 0 "[ . 1 . 2]" 1
1745 1 61 LYS QD 1 86 TYR QE . . 3.450 3.109 2.297 3.585 0.135 9 0 "[ . 1 . 2]" 1
1746 1 61 LYS QD 1 91 ILE MD . . 5.500 2.591 2.184 3.475 . 0 0 "[ . 1 . 2]" 1
1747 1 61 LYS QE 1 61 LYS HG3 . . 3.480 2.511 1.911 3.376 . 0 0 "[ . 1 . 2]" 1
1748 1 61 LYS QE 1 78 VAL HB . . 3.980 3.928 3.082 4.090 0.110 11 0 "[ . 1 . 2]" 1
1749 1 61 LYS QE 1 78 VAL QG . . 3.780 2.025 1.642 3.167 . 0 0 "[ . 1 . 2]" 1
1750 1 61 LYS QE 1 86 TYR QD . . 4.550 3.306 1.980 4.508 . 0 0 "[ . 1 . 2]" 1
1751 1 61 LYS QE 1 86 TYR QE . . 3.600 3.066 1.922 3.717 0.117 7 0 "[ . 1 . 2]" 1
1752 1 61 LYS QE 1 91 ILE MD . . 4.450 3.432 2.084 4.241 . 0 0 "[ . 1 . 2]" 1
1753 1 61 LYS QE 1 91 ILE QG . . 5.310 4.165 2.494 5.173 . 0 0 "[ . 1 . 2]" 1
1754 1 61 LYS QE 1 91 ILE MG . . 4.680 4.113 1.980 4.810 0.130 10 0 "[ . 1 . 2]" 1
1755 1 61 LYS HG2 1 62 ARG H . . 5.500 5.201 5.003 5.360 . 0 0 "[ . 1 . 2]" 1
1756 1 61 LYS HG2 1 78 VAL HB . . 5.420 3.443 2.826 4.298 . 0 0 "[ . 1 . 2]" 1
1757 1 61 LYS HG2 1 78 VAL QG . . 5.240 2.022 1.920 2.178 . 0 0 "[ . 1 . 2]" 1
1758 1 61 LYS HG2 1 92 THR HA . . 4.630 4.557 3.893 4.709 0.079 17 0 "[ . 1 . 2]" 1
1759 1 61 LYS HG2 1 92 THR MG . . 5.040 3.722 3.063 4.454 . 0 0 "[ . 1 . 2]" 1
1760 1 61 LYS HG3 1 62 ARG H . . 5.090 4.619 4.307 4.882 . 0 0 "[ . 1 . 2]" 1
1761 1 61 LYS HG3 1 76 GLU H . . 5.330 3.707 3.299 4.203 . 0 0 "[ . 1 . 2]" 1
1762 1 61 LYS HG3 1 78 VAL HB . . 5.100 4.427 3.698 5.170 0.070 7 0 "[ . 1 . 2]" 1
1763 1 61 LYS HG3 1 78 VAL QG . . 5.340 2.341 2.062 2.721 . 0 0 "[ . 1 . 2]" 1
1764 1 61 LYS HG3 1 92 THR HA . . 5.500 5.186 4.912 5.461 . 0 0 "[ . 1 . 2]" 1
1765 1 62 ARG H 1 62 ARG HB2 . . 3.600 3.544 2.816 3.666 0.066 5 0 "[ . 1 . 2]" 1
1766 1 62 ARG H 1 62 ARG HB3 . . 3.890 2.907 2.419 3.612 . 0 0 "[ . 1 . 2]" 1
1767 1 62 ARG H 1 62 ARG QD . . 5.280 3.922 3.517 4.151 . 0 0 "[ . 1 . 2]" 1
1768 1 62 ARG H 1 62 ARG QG . . 3.480 2.019 1.817 2.767 . 0 0 "[ . 1 . 2]" 1
1769 1 62 ARG H 1 75 VAL HA . . 5.370 4.417 4.226 4.825 . 0 0 "[ . 1 . 2]" 1
1770 1 62 ARG H 1 91 ILE HA . . 5.080 3.880 3.586 4.749 . 0 0 "[ . 1 . 2]" 1
1771 1 62 ARG H 1 91 ILE QG . . 5.260 2.322 1.870 2.732 . 0 0 "[ . 1 . 2]" 1
1772 1 62 ARG H 1 91 ILE MG . . 4.730 4.269 3.754 4.831 0.101 16 0 "[ . 1 . 2]" 1
1773 1 62 ARG H 1 92 THR HA . . 4.670 3.732 3.492 3.954 . 0 0 "[ . 1 . 2]" 1
1774 1 62 ARG H 1 93 LEU H . . 5.220 4.777 4.290 5.179 . 0 0 "[ . 1 . 2]" 1
1775 1 62 ARG H 1 93 LEU QD . . 4.570 3.351 2.361 4.067 . 0 0 "[ . 1 . 2]" 1
1776 1 62 ARG H 1 93 LEU HG . . 5.000 4.058 3.381 5.050 0.050 14 0 "[ . 1 . 2]" 1
1777 1 62 ARG HA 1 62 ARG QD . . 4.680 4.262 3.890 4.454 . 0 0 "[ . 1 . 2]" 1
1778 1 62 ARG HA 1 63 SER H . . 2.950 2.392 1.896 3.004 0.054 7 0 "[ . 1 . 2]" 1
1779 1 62 ARG HA 1 63 SER QB . . 4.540 3.947 3.425 4.408 . 0 0 "[ . 1 . 2]" 1
1780 1 62 ARG HA 1 75 VAL HA . . 3.380 2.105 1.892 2.615 . 0 0 "[ . 1 . 2]" 1
1781 1 62 ARG HA 1 75 VAL MG1 . . 3.490 2.150 1.894 2.651 . 0 0 "[ . 1 . 2]" 1
1782 1 62 ARG HA 1 76 GLU H . . 4.460 4.177 3.935 4.511 0.051 7 0 "[ . 1 . 2]" 1
1783 1 62 ARG HB2 1 63 SER H . . 4.210 4.131 3.656 4.298 0.088 2 0 "[ . 1 . 2]" 1
1784 1 62 ARG HB3 1 62 ARG QD . . 3.490 2.598 2.328 2.933 . 0 0 "[ . 1 . 2]" 1
1785 1 62 ARG HB3 1 91 ILE HA . . 5.500 5.085 4.574 5.568 0.068 14 0 "[ . 1 . 2]" 1
1786 1 62 ARG QD 1 73 LYS QB . . 5.080 4.256 2.379 5.186 0.106 7 0 "[ . 1 . 2]" 1
1787 1 62 ARG QD 1 73 LYS QD . . 5.140 3.625 2.214 5.231 0.091 14 0 "[ . 1 . 2]" 1
1788 1 62 ARG QD 1 73 LYS HG2 . . 5.500 4.198 2.576 5.676 0.176 3 0 "[ . 1 . 2]" 1
1789 1 62 ARG QD 1 75 VAL MG1 . . 4.890 4.551 3.861 4.983 0.093 16 0 "[ . 1 . 2]" 1
1790 1 62 ARG QD 1 91 ILE HA . . 4.540 3.414 2.474 4.618 0.078 10 0 "[ . 1 . 2]" 1
1791 1 62 ARG QD 1 91 ILE HB . . 5.210 4.954 3.995 5.304 0.094 19 0 "[ . 1 . 2]" 1
1792 1 62 ARG QD 1 91 ILE MD . . 5.110 4.688 3.846 5.214 0.104 17 0 "[ . 1 . 2]" 1
1793 1 62 ARG QD 1 93 LEU QD . . 4.280 3.286 2.580 4.007 . 0 0 "[ . 1 . 2]" 1
1794 1 62 ARG QG 1 63 SER H . . 4.910 4.174 3.908 4.498 . 0 0 "[ . 1 . 2]" 1
1795 1 62 ARG QG 1 75 VAL HA . . 5.500 4.928 4.247 5.136 . 0 0 "[ . 1 . 2]" 1
1796 1 62 ARG QG 1 75 VAL MG1 . . 4.360 3.795 2.663 4.226 . 0 0 "[ . 1 . 2]" 1
1797 1 62 ARG QG 1 91 ILE HA . . 4.550 2.751 2.324 3.654 . 0 0 "[ . 1 . 2]" 1
1798 1 62 ARG QG 1 91 ILE HB . . 4.150 3.953 3.682 4.133 . 0 0 "[ . 1 . 2]" 1
1799 1 62 ARG QG 1 91 ILE MD . . 4.990 3.224 2.098 3.887 . 0 0 "[ . 1 . 2]" 1
1800 1 62 ARG QG 1 91 ILE QG . . 5.500 2.090 1.849 2.503 . 0 0 "[ . 1 . 2]" 1
1801 1 62 ARG QG 1 91 ILE MG . . 5.330 4.296 3.964 4.768 . 0 0 "[ . 1 . 2]" 1
1802 1 62 ARG QG 1 93 LEU QD . . 4.260 2.933 2.041 3.919 . 0 0 "[ . 1 . 2]" 1
1803 1 63 SER H 1 63 SER QB . . 3.500 2.833 2.103 3.103 . 0 0 "[ . 1 . 2]" 1
1804 1 63 SER H 1 75 VAL HA . . 3.470 2.353 1.734 3.064 . 0 0 "[ . 1 . 2]" 1
1805 1 63 SER H 1 75 VAL HB . . 5.150 4.021 3.612 4.613 . 0 0 "[ . 1 . 2]" 1
1806 1 63 SER H 1 75 VAL MG1 . . 4.540 3.784 3.425 4.421 . 0 0 "[ . 1 . 2]" 1
1807 1 63 SER H 1 75 VAL MG2 . . 5.500 4.996 4.655 5.581 0.081 16 0 "[ . 1 . 2]" 1
1808 1 63 SER H 1 76 GLU H . . 4.650 3.354 2.929 3.840 . 0 0 "[ . 1 . 2]" 1
1809 1 63 SER H 1 76 GLU QB . . 4.100 3.922 3.131 4.085 . 0 0 "[ . 1 . 2]" 1
1810 1 63 SER HA 1 64 ASP HB2 . . 5.500 4.611 3.704 5.159 . 0 0 "[ . 1 . 2]" 1
1811 1 63 SER HA 1 74 VAL QG . . 4.670 4.284 3.646 4.694 0.024 17 0 "[ . 1 . 2]" 1
1812 1 63 SER HA 1 75 VAL HA . . 5.030 4.206 3.737 4.849 . 0 0 "[ . 1 . 2]" 1
1813 1 63 SER HA 1 76 GLU QB . . 4.470 3.460 2.695 4.435 . 0 0 "[ . 1 . 2]" 1
1814 1 63 SER HA 1 76 GLU QG . . 4.760 2.951 2.180 4.672 . 0 0 "[ . 1 . 2]" 1
1815 1 63 SER QB 1 64 ASP HA . . 4.980 4.470 3.916 4.822 . 0 0 "[ . 1 . 2]" 1
1816 1 63 SER QB 1 65 ALA H . . 5.500 3.677 2.749 5.358 . 0 0 "[ . 1 . 2]" 1
1817 1 63 SER QB 1 65 ALA MB . . 4.980 4.386 3.217 4.919 . 0 0 "[ . 1 . 2]" 1
1818 1 63 SER QB 1 66 LEU H . . 5.500 4.509 2.221 5.385 . 0 0 "[ . 1 . 2]" 1
1819 1 63 SER QB 1 66 LEU HB2 . . 5.330 4.533 2.248 5.872 0.542 13 1 "[ . 1 + . 2]" 1
1820 1 63 SER QB 1 74 VAL HB . . 4.300 3.824 2.806 4.280 . 0 0 "[ . 1 . 2]" 1
1821 1 63 SER QB 1 74 VAL QG . . 3.750 2.331 1.885 2.871 . 0 0 "[ . 1 . 2]" 1
1822 1 63 SER QB 1 75 VAL H . . 4.880 4.603 4.196 4.835 . 0 0 "[ . 1 . 2]" 1
1823 1 63 SER QB 1 75 VAL HA . . 4.540 3.524 3.132 3.827 . 0 0 "[ . 1 . 2]" 1
1824 1 63 SER QB 1 76 GLU H . . 5.270 4.835 4.301 5.141 . 0 0 "[ . 1 . 2]" 1
1825 1 63 SER QB 1 76 GLU QG . . 4.680 3.774 2.370 4.574 . 0 0 "[ . 1 . 2]" 1
1826 1 64 ASP HA 1 65 ALA HA . . 4.640 4.569 4.361 4.714 0.074 20 0 "[ . 1 . 2]" 1
1827 1 64 ASP HA 1 65 ALA MB . . 5.160 4.572 3.702 5.052 . 0 0 "[ . 1 . 2]" 1
1828 1 64 ASP HA 1 66 LEU H . . 5.400 4.236 3.336 5.478 0.078 15 0 "[ . 1 . 2]" 1
1829 1 64 ASP HB2 1 65 ALA H . . 4.900 4.061 3.175 4.683 . 0 0 "[ . 1 . 2]" 1
1830 1 64 ASP HB2 1 65 ALA MB . . 5.500 4.934 3.818 5.576 0.076 5 0 "[ . 1 . 2]" 1
1831 1 64 ASP HB3 1 65 ALA H . . 4.810 3.720 2.231 4.495 . 0 0 "[ . 1 . 2]" 1
1832 1 65 ALA H 1 65 ALA MB . . 3.600 2.525 2.157 2.980 . 0 0 "[ . 1 . 2]" 1
1833 1 65 ALA H 1 66 LEU MD2 . . 5.500 4.954 3.269 6.238 0.738 20 1 "[ . 1 . +]" 1
1834 1 65 ALA HA 1 66 LEU H . . 3.410 2.720 1.969 3.473 0.063 14 0 "[ . 1 . 2]" 1
1835 1 65 ALA HA 1 66 LEU HB2 . . 5.500 5.394 4.795 6.227 0.727 10 2 "[ . + -. 2]" 1
1836 1 65 ALA HA 1 66 LEU MD1 . . 5.500 5.130 3.183 5.609 0.109 2 0 "[ . 1 . 2]" 1
1837 1 65 ALA HA 1 66 LEU HG . . 5.020 4.391 3.170 5.008 . 0 0 "[ . 1 . 2]" 1
1838 1 65 ALA MB 1 66 LEU H . . 4.190 3.557 2.998 3.731 . 0 0 "[ . 1 . 2]" 1
1839 1 65 ALA MB 1 66 LEU HA . . 4.900 4.391 3.928 4.970 0.070 20 0 "[ . 1 . 2]" 1
1840 1 65 ALA MB 1 66 LEU MD2 . . 4.680 4.470 3.679 5.529 0.849 12 3 "[ . 1 +- . *]" 1
1841 1 65 ALA MB 1 66 LEU HG . . 4.470 4.005 2.733 4.596 0.126 15 0 "[ . 1 . 2]" 1
1842 1 66 LEU H 1 66 LEU HB2 . . 3.600 3.065 2.248 3.985 0.385 14 0 "[ . 1 . 2]" 1
1843 1 66 LEU H 1 66 LEU MD2 . . 4.960 3.862 1.916 4.530 . 0 0 "[ . 1 . 2]" 1
1844 1 66 LEU H 1 66 LEU HG . . 3.710 3.136 2.116 3.747 0.037 2 0 "[ . 1 . 2]" 1
1845 1 66 LEU HA 1 66 LEU MD1 . . 4.790 3.839 3.488 4.137 . 0 0 "[ . 1 . 2]" 1
1846 1 66 LEU HA 1 66 LEU MD2 . . 3.380 2.821 2.143 4.084 0.704 13 3 "[ . - + . *]" 1
1847 1 66 LEU HB2 1 66 LEU MD1 . . 3.650 2.258 2.164 2.474 . 0 0 "[ . 1 . 2]" 1
1848 1 66 LEU HB3 1 66 LEU MD1 . . 3.050 2.716 2.293 3.214 0.164 10 0 "[ . 1 . 2]" 1
1849 1 68 THR HA 1 68 THR MG . . 3.380 2.703 2.177 3.290 . 0 0 "[ . 1 . 2]" 1
1850 1 68 THR HB 1 69 ASN H . . 5.380 3.489 2.136 4.618 . 0 0 "[ . 1 . 2]" 1
1851 1 68 THR MG 1 69 ASN H . . 4.710 3.322 1.854 4.360 . 0 0 "[ . 1 . 2]" 1
1852 1 70 HIS HA 1 70 HIS HD2 . . 4.090 3.051 2.149 4.175 0.085 2 0 "[ . 1 . 2]" 1
1853 1 70 HIS HB2 1 70 HIS HD2 . . 3.800 3.392 2.613 3.945 0.145 19 0 "[ . 1 . 2]" 1
1854 1 72 HIS H 1 74 VAL QG . . 5.490 4.130 2.950 5.359 . 0 0 "[ . 1 . 2]" 1
1855 1 72 HIS HA 1 72 HIS HD2 . . 4.150 3.852 2.903 4.238 0.088 15 0 "[ . 1 . 2]" 1
1856 1 72 HIS HA 1 73 LYS H . . 3.580 2.394 2.139 2.825 . 0 0 "[ . 1 . 2]" 1
1857 1 72 HIS HA 1 73 LYS HA . . 4.370 4.406 4.140 4.458 0.088 2 0 "[ . 1 . 2]" 1
1858 1 72 HIS HA 1 73 LYS QB . . 4.840 4.478 4.158 4.901 0.061 8 0 "[ . 1 . 2]" 1
1859 1 72 HIS HA 1 74 VAL H . . 5.120 5.031 4.206 5.201 0.081 9 0 "[ . 1 . 2]" 1
1860 1 72 HIS HA 1 111 LEU MD2 . . 5.500 4.388 3.809 5.144 . 0 0 "[ . 1 . 2]" 1
1861 1 72 HIS QB 1 72 HIS HD2 . . 3.460 2.563 2.423 2.910 . 0 0 "[ . 1 . 2]" 1
1862 1 72 HIS QB 1 73 LYS H . . 4.320 2.601 1.693 3.803 . 0 0 "[ . 1 . 2]" 1
1863 1 72 HIS QB 1 73 LYS QB . . 5.420 4.139 3.279 4.773 . 0 0 "[ . 1 . 2]" 1
1864 1 72 HIS QB 1 73 LYS HG3 . . 5.500 5.234 4.635 5.985 0.485 3 0 "[ . 1 . 2]" 1
1865 1 72 HIS QB 1 74 VAL QG . . 4.300 3.406 2.370 4.351 0.051 14 0 "[ . 1 . 2]" 1
1866 1 72 HIS QB 1 111 LEU H . . 5.500 4.805 3.090 5.592 0.092 10 0 "[ . 1 . 2]" 1
1867 1 72 HIS QB 1 111 LEU MD2 . . 3.920 2.137 1.950 2.439 . 0 0 "[ . 1 . 2]" 1
1868 1 72 HIS QB 1 111 LEU HG . . 4.350 3.290 2.269 4.438 0.088 6 0 "[ . 1 . 2]" 1
1869 1 72 HIS HD2 1 111 LEU MD2 . . 4.260 3.144 2.233 3.835 . 0 0 "[ . 1 . 2]" 1
1870 1 73 LYS H 1 73 LYS QD . . 5.310 4.176 1.861 4.926 . 0 0 "[ . 1 . 2]" 1
1871 1 73 LYS H 1 73 LYS HG2 . . 5.000 3.789 3.043 4.634 . 0 0 "[ . 1 . 2]" 1
1872 1 73 LYS H 1 73 LYS HG3 . . 5.020 3.207 2.434 4.445 . 0 0 "[ . 1 . 2]" 1
1873 1 73 LYS H 1 74 VAL H . . 4.850 3.824 1.876 4.171 . 0 0 "[ . 1 . 2]" 1
1874 1 73 LYS HA 1 73 LYS QD . . 4.160 3.546 2.322 3.909 . 0 0 "[ . 1 . 2]" 1
1875 1 73 LYS HA 1 73 LYS HG2 . . 4.060 2.702 2.222 3.749 . 0 0 "[ . 1 . 2]" 1
1876 1 73 LYS HA 1 74 VAL H . . 3.060 2.245 2.024 3.135 0.075 2 0 "[ . 1 . 2]" 1
1877 1 73 LYS HA 1 74 VAL HA . . 5.020 4.534 4.439 5.023 0.003 2 0 "[ . 1 . 2]" 1
1878 1 73 LYS HA 1 74 VAL QG . . 4.450 3.719 3.301 4.223 . 0 0 "[ . 1 . 2]" 1
1879 1 73 LYS QB 1 74 VAL H . . 4.140 3.783 3.488 4.094 . 0 0 "[ . 1 . 2]" 1
1880 1 73 LYS QB 1 74 VAL HA . . 5.500 4.674 4.404 5.207 . 0 0 "[ . 1 . 2]" 1
1881 1 73 LYS QB 1 74 VAL QG . . 4.990 4.576 3.922 4.882 . 0 0 "[ . 1 . 2]" 1
1882 1 73 LYS QB 1 111 LEU H . . 5.500 5.060 4.255 5.604 0.104 17 0 "[ . 1 . 2]" 1
1883 1 73 LYS QD 1 74 VAL H . . 5.500 5.369 4.418 5.604 0.104 9 0 "[ . 1 . 2]" 1
1884 1 73 LYS QE 1 73 LYS HG2 . . 3.830 2.935 2.018 3.531 . 0 0 "[ . 1 . 2]" 1
1885 1 73 LYS QE 1 93 LEU QD . . 4.670 3.795 2.000 4.549 . 0 0 "[ . 1 . 2]" 1
1886 1 73 LYS HG2 1 74 VAL H . . 5.440 4.675 4.208 5.515 0.075 20 0 "[ . 1 . 2]" 1
1887 1 73 LYS HG3 1 74 VAL H . . 5.500 4.872 3.742 5.526 0.026 2 0 "[ . 1 . 2]" 1
1888 1 74 VAL H 1 74 VAL HB . . 3.530 2.953 2.228 3.634 0.104 2 0 "[ . 1 . 2]" 1
1889 1 74 VAL H 1 74 VAL QG . . 3.390 2.122 1.851 2.569 . 0 0 "[ . 1 . 2]" 1
1890 1 74 VAL H 1 75 VAL H . . 5.500 4.653 4.446 4.766 . 0 0 "[ . 1 . 2]" 1
1891 1 74 VAL H 1 111 LEU MD2 . . 5.500 4.369 3.949 5.517 0.017 20 0 "[ . 1 . 2]" 1
1892 1 74 VAL HA 1 74 VAL QG . . 3.170 2.311 2.110 2.566 . 0 0 "[ . 1 . 2]" 1
1893 1 74 VAL HA 1 75 VAL H . . 2.940 2.395 2.179 2.613 . 0 0 "[ . 1 . 2]" 1
1894 1 74 VAL HA 1 111 LEU H . . 3.830 2.461 1.873 3.777 . 0 0 "[ . 1 . 2]" 1
1895 1 74 VAL HA 1 111 LEU HA . . 5.500 4.565 4.169 5.359 . 0 0 "[ . 1 . 2]" 1
1896 1 74 VAL HA 1 111 LEU HB2 . . 3.560 2.159 1.981 2.700 . 0 0 "[ . 1 . 2]" 1
1897 1 74 VAL HA 1 111 LEU HB3 . . 4.010 3.472 2.858 4.070 0.060 8 0 "[ . 1 . 2]" 1
1898 1 74 VAL HA 1 111 LEU HG . . 4.340 3.980 2.716 4.382 0.042 2 0 "[ . 1 . 2]" 1
1899 1 74 VAL HB 1 75 VAL H . . 4.150 3.429 2.490 4.201 0.051 14 0 "[ . 1 . 2]" 1
1900 1 74 VAL QG 1 75 VAL H . . 3.450 2.653 2.225 3.339 . 0 0 "[ . 1 . 2]" 1
1901 1 74 VAL QG 1 75 VAL HA . . 4.270 3.278 2.937 3.712 . 0 0 "[ . 1 . 2]" 1
1902 1 74 VAL QG 1 111 LEU H . . 4.700 3.742 3.210 4.527 . 0 0 "[ . 1 . 2]" 1
1903 1 74 VAL QG 1 111 LEU HB3 . . 4.990 2.703 2.182 3.238 . 0 0 "[ . 1 . 2]" 1
1904 1 74 VAL QG 1 111 LEU MD1 . . 4.050 3.576 3.341 3.906 . 0 0 "[ . 1 . 2]" 1
1905 1 74 VAL QG 1 111 LEU HG . . 4.610 2.521 2.058 3.130 . 0 0 "[ . 1 . 2]" 1
1906 1 74 VAL QG 1 113 ARG HA . . 5.100 4.058 3.309 4.783 . 0 0 "[ . 1 . 2]" 1
1907 1 74 VAL QG 1 113 ARG QD . . 4.340 3.779 2.226 4.375 0.035 20 0 "[ . 1 . 2]" 1
1908 1 75 VAL H 1 75 VAL MG1 . . 3.480 3.246 2.913 3.561 0.081 10 0 "[ . 1 . 2]" 1
1909 1 75 VAL H 1 75 VAL MG2 . . 3.080 2.496 2.289 2.726 . 0 0 "[ . 1 . 2]" 1
1910 1 75 VAL H 1 111 LEU H . . 4.350 3.287 2.827 3.788 . 0 0 "[ . 1 . 2]" 1
1911 1 75 VAL H 1 111 LEU HB2 . . 4.320 3.695 2.825 4.386 0.066 2 0 "[ . 1 . 2]" 1
1912 1 75 VAL H 1 111 LEU HB3 . . 4.990 4.413 3.527 4.930 . 0 0 "[ . 1 . 2]" 1
1913 1 75 VAL HA 1 75 VAL MG1 . . 3.350 2.427 2.312 2.649 . 0 0 "[ . 1 . 2]" 1
1914 1 75 VAL HA 1 76 GLU H . . 3.090 2.646 2.597 2.737 . 0 0 "[ . 1 . 2]" 1
1915 1 75 VAL HA 1 76 GLU HA . . 4.490 4.550 4.498 4.573 0.083 2 0 "[ . 1 . 2]" 1
1916 1 75 VAL HA 1 76 GLU QG . . 5.220 3.941 3.442 4.798 . 0 0 "[ . 1 . 2]" 1
1917 1 75 VAL HA 1 93 LEU QD . . 4.660 4.345 3.443 4.633 . 0 0 "[ . 1 . 2]" 1
1918 1 75 VAL HB 1 76 GLU H . . 3.190 2.126 1.924 2.449 . 0 0 "[ . 1 . 2]" 1
1919 1 75 VAL HB 1 93 LEU QD . . 4.430 3.569 2.308 3.971 . 0 0 "[ . 1 . 2]" 1
1920 1 75 VAL MG1 1 111 LEU H . . 4.690 4.105 3.511 4.780 0.090 8 0 "[ . 1 . 2]" 1
1921 1 75 VAL MG2 1 76 GLU HA . . 4.500 3.639 3.355 3.838 . 0 0 "[ . 1 . 2]" 1
1922 1 75 VAL MG2 1 76 GLU QB . . 5.500 4.707 4.485 4.934 . 0 0 "[ . 1 . 2]" 1
1923 1 75 VAL MG2 1 93 LEU QD . . 3.070 3.118 2.634 3.188 0.118 13 0 "[ . 1 . 2]" 1
1924 1 75 VAL MG2 1 111 LEU H . . 3.790 3.379 2.331 3.835 0.045 1 0 "[ . 1 . 2]" 1
1925 1 76 GLU H 1 76 GLU QB . . 3.910 2.994 2.529 3.234 . 0 0 "[ . 1 . 2]" 1
1926 1 76 GLU H 1 76 GLU QG . . 3.840 2.867 2.295 3.928 0.088 16 0 "[ . 1 . 2]" 1
1927 1 76 GLU H 1 77 LEU H . . 5.080 4.309 4.186 4.432 . 0 0 "[ . 1 . 2]" 1
1928 1 76 GLU HA 1 77 LEU H . . 2.910 2.481 2.256 2.765 . 0 0 "[ . 1 . 2]" 1
1929 1 76 GLU HA 1 77 LEU HA . . 4.680 4.499 4.344 4.701 0.021 18 0 "[ . 1 . 2]" 1
1930 1 76 GLU HA 1 77 LEU HG . . 5.410 4.361 3.679 5.494 0.084 10 0 "[ . 1 . 2]" 1
1931 1 76 GLU HA 1 112 LEU HA . . 4.170 4.102 3.586 4.258 0.088 11 0 "[ . 1 . 2]" 1
1932 1 76 GLU HA 1 112 LEU QD . . 3.520 3.005 2.207 3.611 0.091 10 0 "[ . 1 . 2]" 1
1933 1 76 GLU HA 1 113 ARG QD . . 5.100 4.291 2.287 5.206 0.106 5 0 "[ . 1 . 2]" 1
1934 1 76 GLU QB 1 77 LEU H . . 3.730 2.412 2.042 2.707 . 0 0 "[ . 1 . 2]" 1
1935 1 76 GLU QB 1 112 LEU QD . . 5.500 3.953 2.946 4.647 . 0 0 "[ . 1 . 2]" 1
1936 1 76 GLU QB 1 113 ARG QD . . 5.110 3.280 2.083 4.621 . 0 0 "[ . 1 . 2]" 1
1937 1 76 GLU QG 1 77 LEU H . . 5.500 3.511 2.473 4.230 . 0 0 "[ . 1 . 2]" 1
1938 1 76 GLU QG 1 113 ARG QD . . 5.340 3.877 2.201 5.430 0.090 6 0 "[ . 1 . 2]" 1
1939 1 77 LEU H 1 77 LEU HB2 . . 3.130 2.281 1.942 2.514 . 0 0 "[ . 1 . 2]" 1
1940 1 77 LEU H 1 77 LEU HB3 . . 3.870 3.519 3.188 3.691 . 0 0 "[ . 1 . 2]" 1
1941 1 77 LEU H 1 77 LEU MD1 . . 4.040 3.705 2.846 4.146 0.106 10 0 "[ . 1 . 2]" 1
1942 1 77 LEU H 1 77 LEU MD2 . . 4.760 4.009 3.059 4.277 . 0 0 "[ . 1 . 2]" 1
1943 1 77 LEU H 1 77 LEU HG . . 3.800 3.086 2.497 3.888 0.088 10 0 "[ . 1 . 2]" 1
1944 1 77 LEU H 1 78 VAL QG . . 5.500 4.095 3.618 4.678 . 0 0 "[ . 1 . 2]" 1
1945 1 77 LEU H 1 112 LEU QD . . 4.290 3.698 2.874 4.313 0.023 12 0 "[ . 1 . 2]" 1
1946 1 77 LEU HA 1 77 LEU MD1 . . 4.250 3.786 2.196 3.940 . 0 0 "[ . 1 . 2]" 1
1947 1 77 LEU HA 1 77 LEU MD2 . . 3.390 2.190 2.059 2.583 . 0 0 "[ . 1 . 2]" 1
1948 1 77 LEU HA 1 77 LEU HG . . 3.720 2.810 2.460 3.646 . 0 0 "[ . 1 . 2]" 1
1949 1 77 LEU HA 1 78 VAL H . . 2.910 2.200 2.116 2.317 . 0 0 "[ . 1 . 2]" 1
1950 1 77 LEU HA 1 78 VAL HA . . 4.730 4.487 4.391 4.567 . 0 0 "[ . 1 . 2]" 1
1951 1 77 LEU HA 1 78 VAL HB . . 5.170 4.888 4.411 5.256 0.086 18 0 "[ . 1 . 2]" 1
1952 1 77 LEU HA 1 78 VAL QG . . 5.500 3.461 2.900 4.067 . 0 0 "[ . 1 . 2]" 1
1953 1 77 LEU HA 1 96 LEU QD . . 4.040 3.604 3.154 4.038 . 0 0 "[ . 1 . 2]" 1
1954 1 77 LEU HB2 1 78 VAL H . . 4.750 4.261 3.739 4.524 . 0 0 "[ . 1 . 2]" 1
1955 1 77 LEU HB3 1 77 LEU MD1 . . 3.660 2.527 2.214 2.801 . 0 0 "[ . 1 . 2]" 1
1956 1 77 LEU HB3 1 77 LEU MD2 . . 3.590 2.350 2.145 3.295 . 0 0 "[ . 1 . 2]" 1
1957 1 77 LEU HB3 1 78 VAL H . . 4.180 3.212 2.572 3.570 . 0 0 "[ . 1 . 2]" 1
1958 1 77 LEU HB3 1 78 VAL HA . . 4.680 4.198 3.813 4.645 . 0 0 "[ . 1 . 2]" 1
1959 1 77 LEU MD2 1 96 LEU QD . . 4.040 1.942 1.848 2.068 . 0 0 "[ . 1 . 2]" 1
1960 1 77 LEU HG 1 78 VAL H . . 5.060 4.771 4.466 5.149 0.089 10 0 "[ . 1 . 2]" 1
1961 1 78 VAL H 1 78 VAL HB . . 3.880 3.045 2.657 3.804 . 0 0 "[ . 1 . 2]" 1
1962 1 78 VAL H 1 78 VAL QG . . 3.970 2.671 2.272 3.118 . 0 0 "[ . 1 . 2]" 1
1963 1 78 VAL HA 1 79 ALA H . . 2.720 2.512 2.318 2.647 . 0 0 "[ . 1 . 2]" 1
1964 1 78 VAL HA 1 79 ALA HA . . 5.100 4.609 4.521 4.736 . 0 0 "[ . 1 . 2]" 1
1965 1 78 VAL HA 1 79 ALA MB . . 4.660 4.017 3.844 4.179 . 0 0 "[ . 1 . 2]" 1
1966 1 78 VAL HB 1 79 ALA H . . 3.490 3.422 2.698 3.583 0.093 16 0 "[ . 1 . 2]" 1
1967 1 78 VAL HB 1 86 TYR QE . . 4.830 4.675 3.281 4.927 0.097 5 0 "[ . 1 . 2]" 1
1968 1 78 VAL QG 1 79 ALA H . . 3.950 2.263 1.928 3.014 . 0 0 "[ . 1 . 2]" 1
1969 1 78 VAL QG 1 79 ALA HA . . 5.500 3.919 3.281 4.457 . 0 0 "[ . 1 . 2]" 1
1970 1 78 VAL QG 1 80 GLU QG . . 5.500 3.497 2.911 4.266 . 0 0 "[ . 1 . 2]" 1
1971 1 78 VAL QG 1 86 TYR HB3 . . 5.350 3.605 2.907 4.169 . 0 0 "[ . 1 . 2]" 1
1972 1 78 VAL QG 1 86 TYR QD . . 4.440 2.867 2.552 3.420 . 0 0 "[ . 1 . 2]" 1
1973 1 78 VAL QG 1 86 TYR QE . . 4.020 2.608 2.111 3.095 . 0 0 "[ . 1 . 2]" 1
1974 1 79 ALA H 1 79 ALA MB . . 3.300 2.740 2.508 2.863 . 0 0 "[ . 1 . 2]" 1
1975 1 79 ALA H 1 80 GLU H . . 4.830 4.246 3.853 4.545 . 0 0 "[ . 1 . 2]" 1
1976 1 79 ALA H 1 80 GLU QG . . 5.500 4.323 3.622 4.918 . 0 0 "[ . 1 . 2]" 1
1977 1 79 ALA H 1 86 TYR QE . . 5.500 4.875 3.789 5.591 0.091 13 0 "[ . 1 . 2]" 1
1978 1 79 ALA HA 1 80 GLU H . . 2.910 2.277 2.112 2.440 . 0 0 "[ . 1 . 2]" 1
1979 1 79 ALA HA 1 80 GLU HA . . 5.240 4.514 4.410 4.612 . 0 0 "[ . 1 . 2]" 1
1980 1 79 ALA HA 1 80 GLU HB2 . . 4.950 4.005 3.567 4.569 . 0 0 "[ . 1 . 2]" 1
1981 1 79 ALA MB 1 80 GLU H . . 3.590 2.863 2.441 3.272 . 0 0 "[ . 1 . 2]" 1
1982 1 79 ALA MB 1 80 GLU HA . . 5.500 4.134 3.835 4.276 . 0 0 "[ . 1 . 2]" 1
1983 1 80 GLU H 1 80 GLU HB2 . . 3.840 2.742 2.464 2.969 . 0 0 "[ . 1 . 2]" 1
1984 1 80 GLU H 1 80 GLU HB3 . . 3.830 3.522 3.172 3.827 . 0 0 "[ . 1 . 2]" 1
1985 1 80 GLU H 1 80 GLU QG . . 4.540 3.972 3.297 4.225 . 0 0 "[ . 1 . 2]" 1
1986 1 80 GLU HA 1 80 GLU QG . . 3.530 2.584 2.191 2.884 . 0 0 "[ . 1 . 2]" 1
1987 1 80 GLU HA 1 81 MET H . . 3.190 2.268 2.119 2.455 . 0 0 "[ . 1 . 2]" 1
1988 1 80 GLU HA 1 81 MET HA . . 4.770 4.397 4.234 4.492 . 0 0 "[ . 1 . 2]" 1
1989 1 80 GLU HA 1 83 GLY HA2 . . 4.630 4.711 4.696 4.724 0.094 15 0 "[ . 1 . 2]" 1
1990 1 80 GLU HA 1 86 TYR QD . . 5.360 5.104 4.384 5.464 0.104 3 0 "[ . 1 . 2]" 1
1991 1 80 GLU HB2 1 81 MET H . . 5.050 4.407 3.753 4.690 . 0 0 "[ . 1 . 2]" 1
1992 1 80 GLU HB2 1 83 GLY H . . 4.910 3.853 3.123 4.445 . 0 0 "[ . 1 . 2]" 1
1993 1 80 GLU HB2 1 83 GLY HA2 . . 4.590 2.865 2.168 3.452 . 0 0 "[ . 1 . 2]" 1
1994 1 80 GLU HB2 1 83 GLY HA3 . . 4.910 4.531 3.816 4.978 0.068 19 0 "[ . 1 . 2]" 1
1995 1 80 GLU HB3 1 81 MET H . . 4.700 3.431 2.401 4.014 . 0 0 "[ . 1 . 2]" 1
1996 1 80 GLU HB3 1 83 GLY H . . 4.980 2.511 2.202 2.923 . 0 0 "[ . 1 . 2]" 1
1997 1 80 GLU HB3 1 83 GLY HA2 . . 5.230 2.176 1.934 2.541 . 0 0 "[ . 1 . 2]" 1
1998 1 80 GLU HB3 1 83 GLY HA3 . . 5.270 3.763 3.499 4.216 . 0 0 "[ . 1 . 2]" 1
1999 1 80 GLU HB3 1 86 TYR QD . . 5.040 4.359 3.719 5.035 . 0 0 "[ . 1 . 2]" 1
2000 1 80 GLU QG 1 81 MET H . . 4.380 4.151 3.544 4.421 0.041 1 0 "[ . 1 . 2]" 1
2001 1 80 GLU QG 1 83 GLY H . . 4.550 4.105 3.398 4.637 0.087 5 0 "[ . 1 . 2]" 1
2002 1 80 GLU QG 1 84 ILE H . . 4.910 3.403 2.579 4.415 . 0 0 "[ . 1 . 2]" 1
2003 1 80 GLU QG 1 84 ILE MD . . 5.120 4.256 2.908 5.210 0.090 20 0 "[ . 1 . 2]" 1
2004 1 80 GLU QG 1 85 GLN QB . . 5.500 3.722 2.901 5.165 . 0 0 "[ . 1 . 2]" 1
2005 1 80 GLU QG 1 85 GLN HG3 . . 5.500 5.436 4.846 6.023 0.523 12 1 "[ . 1 + . 2]" 1
2006 1 80 GLU QG 1 86 TYR QD . . 4.430 2.257 1.968 2.729 . 0 0 "[ . 1 . 2]" 1
2007 1 80 GLU QG 1 86 TYR QE . . 3.710 2.874 2.045 3.752 0.042 18 0 "[ . 1 . 2]" 1
2008 1 81 MET H 1 81 MET QG . . 4.090 2.731 1.982 3.784 . 0 0 "[ . 1 . 2]" 1
2009 1 81 MET H 1 84 ILE H . . 4.930 4.459 3.447 4.958 0.028 12 0 "[ . 1 . 2]" 1
2010 1 81 MET HB2 1 81 MET ME . . 4.330 2.399 2.103 3.380 . 0 0 "[ . 1 . 2]" 1
2011 1 81 MET QG 1 84 ILE H . . 5.500 5.029 4.113 5.413 . 0 0 "[ . 1 . 2]" 1
2012 1 82 ASP HA 1 83 GLY HA2 . . 5.500 5.103 4.797 5.269 . 0 0 "[ . 1 . 2]" 1
2013 1 82 ASP HA 1 84 ILE H . . 4.850 4.592 4.223 4.898 0.048 7 0 "[ . 1 . 2]" 1
2014 1 82 ASP QB 1 84 ILE H . . 4.660 3.003 2.584 3.459 . 0 0 "[ . 1 . 2]" 1
2015 1 82 ASP QB 1 84 ILE HB . . 5.350 4.383 3.847 5.197 . 0 0 "[ . 1 . 2]" 1
2016 1 82 ASP QB 1 84 ILE MD . . 4.310 2.987 1.892 3.536 . 0 0 "[ . 1 . 2]" 1
2017 1 82 ASP QB 1 84 ILE HG12 . . 4.840 3.150 2.434 4.332 . 0 0 "[ . 1 . 2]" 1
2018 1 82 ASP QB 1 84 ILE HG13 . . 4.980 2.451 1.994 4.066 . 0 0 "[ . 1 . 2]" 1
2019 1 82 ASP QB 1 84 ILE MG . . 5.500 4.620 3.967 5.104 . 0 0 "[ . 1 . 2]" 1
2020 1 84 ILE H 1 84 ILE HB . . 3.040 2.418 2.176 2.744 . 0 0 "[ . 1 . 2]" 1
2021 1 84 ILE H 1 84 ILE MD . . 4.270 3.226 1.881 3.753 . 0 0 "[ . 1 . 2]" 1
2022 1 84 ILE H 1 84 ILE HG12 . . 3.600 3.406 2.182 3.783 0.183 16 0 "[ . 1 . 2]" 1
2023 1 84 ILE H 1 84 ILE HG13 . . 3.710 2.351 1.800 3.553 . 0 0 "[ . 1 . 2]" 1
2024 1 84 ILE H 1 84 ILE MG . . 4.000 3.742 3.643 3.877 . 0 0 "[ . 1 . 2]" 1
2025 1 84 ILE HA 1 84 ILE HG12 . . 4.120 2.652 2.214 3.653 . 0 0 "[ . 1 . 2]" 1
2026 1 84 ILE HA 1 84 ILE HG13 . . 3.800 2.747 2.210 3.795 . 0 0 "[ . 1 . 2]" 1
2027 1 84 ILE HA 1 84 ILE MG . . 3.430 2.648 2.326 2.833 . 0 0 "[ . 1 . 2]" 1
2028 1 84 ILE HB 1 84 ILE MD . . 3.630 2.430 2.165 3.247 . 0 0 "[ . 1 . 2]" 1
2029 1 84 ILE HG13 1 84 ILE MG . . 3.570 3.140 2.472 3.281 . 0 0 "[ . 1 . 2]" 1
2030 1 84 ILE MG 1 85 GLN H . . 4.650 2.843 2.086 3.741 . 0 0 "[ . 1 . 2]" 1
2031 1 84 ILE MG 1 85 GLN HA . . 4.450 3.765 3.223 4.561 0.111 6 0 "[ . 1 . 2]" 1
2032 1 84 ILE MG 1 85 GLN HE21 . . 5.500 4.241 2.700 5.262 . 0 0 "[ . 1 . 2]" 1
2033 1 84 ILE MG 1 85 GLN HE22 . . 5.500 5.087 2.588 5.601 0.101 12 0 "[ . 1 . 2]" 1
2034 1 84 ILE MG 1 85 GLN HG2 . . 4.520 3.241 2.115 4.606 0.086 14 0 "[ . 1 . 2]" 1
2035 1 84 ILE MG 1 85 GLN HG3 . . 5.500 3.176 2.076 5.047 . 0 0 "[ . 1 . 2]" 1
2036 1 84 ILE MG 1 86 TYR H . . 5.320 5.171 3.972 5.436 0.116 8 0 "[ . 1 . 2]" 1
2037 1 84 ILE MG 1 86 TYR QE . . 5.180 5.102 4.050 5.304 0.124 9 0 "[ . 1 . 2]" 1
2038 1 85 GLN HA 1 85 GLN HG2 . . 4.020 2.888 2.155 3.913 . 0 0 "[ . 1 . 2]" 1
2039 1 85 GLN HA 1 87 GLY H . . 5.440 4.321 3.939 4.875 . 0 0 "[ . 1 . 2]" 1
2040 1 85 GLN QB 1 86 TYR H . . 4.480 2.320 1.868 3.214 . 0 0 "[ . 1 . 2]" 1
2041 1 85 GLN QB 1 86 TYR HA . . 5.230 3.959 3.592 4.685 . 0 0 "[ . 1 . 2]" 1
2042 1 85 GLN QB 1 86 TYR QD . . 5.090 3.104 2.341 3.748 . 0 0 "[ . 1 . 2]" 1
2043 1 85 GLN QB 1 86 TYR QE . . 5.280 3.342 2.690 4.630 . 0 0 "[ . 1 . 2]" 1
2044 1 85 GLN QB 1 87 GLY H . . 5.500 4.673 4.441 5.098 . 0 0 "[ . 1 . 2]" 1
2045 1 85 GLN HE21 1 86 TYR H . . 5.500 5.011 4.193 5.579 0.079 20 0 "[ . 1 . 2]" 1
2046 1 85 GLN HG3 1 86 TYR H . . 5.500 4.020 2.046 4.933 . 0 0 "[ . 1 . 2]" 1
2047 1 86 TYR H 1 86 TYR QD . . 4.970 3.081 1.759 3.726 . 0 0 "[ . 1 . 2]" 1
2048 1 86 TYR H 1 87 GLY H . . 4.340 3.527 2.577 4.078 . 0 0 "[ . 1 . 2]" 1
2049 1 86 TYR HA 1 86 TYR QD . . 2.770 2.533 2.024 2.874 0.104 17 0 "[ . 1 . 2]" 1
2050 1 86 TYR HA 1 86 TYR QE . . 4.750 4.667 4.269 4.837 0.087 14 0 "[ . 1 . 2]" 1
2051 1 86 TYR HA 1 91 ILE MD . . 5.200 5.056 4.119 5.309 0.109 17 0 "[ . 1 . 2]" 1
2052 1 86 TYR HA 1 91 ILE MG . . 4.520 3.125 2.647 3.680 . 0 0 "[ . 1 . 2]" 1
2053 1 86 TYR HB2 1 92 THR MG . . 4.650 3.845 3.276 4.749 0.099 6 0 "[ . 1 . 2]" 1
2054 1 86 TYR HB3 1 87 GLY H . . 5.500 3.661 2.706 4.080 . 0 0 "[ . 1 . 2]" 1
2055 1 86 TYR QD 1 91 ILE MG . . 3.510 3.234 2.577 3.630 0.120 17 0 "[ . 1 . 2]" 1
2056 1 86 TYR QD 1 92 THR MG . . 5.500 4.592 4.214 5.326 . 0 0 "[ . 1 . 2]" 1
2057 1 86 TYR QE 1 91 ILE MD . . 4.850 4.406 3.034 4.947 0.097 18 0 "[ . 1 . 2]" 1
2058 1 86 TYR QE 1 91 ILE MG . . 5.310 4.614 3.580 5.215 . 0 0 "[ . 1 . 2]" 1
2059 1 88 ARG H 1 88 ARG HB3 . . 4.160 3.204 2.574 3.852 . 0 0 "[ . 1 . 2]" 1
2060 1 88 ARG H 1 88 ARG QG . . 4.350 3.995 2.458 4.427 0.077 15 0 "[ . 1 . 2]" 1
2061 1 88 ARG HA 1 88 ARG QD . . 3.660 3.398 2.391 3.770 0.110 1 0 "[ . 1 . 2]" 1
2062 1 88 ARG HA 1 88 ARG QG . . 3.430 2.442 2.058 3.514 0.084 17 0 "[ . 1 . 2]" 1
2063 1 88 ARG HB2 1 88 ARG QD . . 3.700 2.723 2.109 3.434 . 0 0 "[ . 1 . 2]" 1
2064 1 88 ARG HB2 1 89 SER H . . 5.500 4.416 3.522 4.717 . 0 0 "[ . 1 . 2]" 1
2065 1 88 ARG HB3 1 88 ARG QD . . 3.880 2.678 2.093 3.429 . 0 0 "[ . 1 . 2]" 1
2066 1 88 ARG QG 1 89 SER HA . . 5.060 4.789 4.042 5.154 0.094 6 0 "[ . 1 . 2]" 1
2067 1 89 SER HA 1 90 GLY HA2 . . 4.620 4.520 4.351 5.325 0.705 14 2 "[ . 1 - +. 2]" 1
2068 1 89 SER QB 1 91 ILE QG . . 5.500 4.815 4.373 5.138 . 0 0 "[ . 1 . 2]" 1
2069 1 89 SER QB 1 91 ILE MG . . 5.500 2.018 1.862 2.425 . 0 0 "[ . 1 . 2]" 1
2070 1 90 GLY HA2 1 91 ILE HA . . 4.770 4.786 4.326 5.001 0.231 12 0 "[ . 1 . 2]" 1
2071 1 91 ILE H 1 91 ILE HB . . 3.870 2.647 2.267 3.805 . 0 0 "[ . 1 . 2]" 1
2072 1 91 ILE H 1 91 ILE MD . . 5.110 4.438 4.208 5.158 0.048 5 0 "[ . 1 . 2]" 1
2073 1 91 ILE H 1 91 ILE QG . . 4.560 3.936 3.831 4.091 . 0 0 "[ . 1 . 2]" 1
2074 1 91 ILE H 1 91 ILE MG . . 4.160 2.109 1.755 2.939 . 0 0 "[ . 1 . 2]" 1
2075 1 91 ILE HA 1 91 ILE MD . . 3.770 3.776 3.641 3.871 0.101 2 0 "[ . 1 . 2]" 1
2076 1 91 ILE HA 1 91 ILE MG . . 3.340 3.281 3.240 3.348 0.008 1 0 "[ . 1 . 2]" 1
2077 1 91 ILE HB 1 91 ILE MD . . 3.540 2.383 2.269 2.533 . 0 0 "[ . 1 . 2]" 1
2078 1 91 ILE HB 1 92 THR HA . . 5.500 5.580 5.561 5.597 0.097 6 0 "[ . 1 . 2]" 1
2079 1 91 ILE MD 1 91 ILE MG . . 3.880 2.090 1.983 2.202 . 0 0 "[ . 1 . 2]" 1
2080 1 91 ILE MG 1 92 THR HA . . 4.750 3.542 3.261 3.972 . 0 0 "[ . 1 . 2]" 1
2081 1 91 ILE MG 1 92 THR HB . . 5.050 3.886 3.606 4.323 . 0 0 "[ . 1 . 2]" 1
2082 1 92 THR H 1 92 THR HB . . 3.840 2.644 2.333 3.835 . 0 0 "[ . 1 . 2]" 1
2083 1 92 THR HA 1 92 THR MG . . 3.410 2.318 2.161 2.506 . 0 0 "[ . 1 . 2]" 1
2084 1 92 THR HA 1 93 LEU H . . 3.080 2.246 2.091 2.363 . 0 0 "[ . 1 . 2]" 1
2085 1 92 THR HA 1 94 GLY H . . 4.380 4.269 3.996 4.462 0.082 6 0 "[ . 1 . 2]" 1
2086 1 92 THR HB 1 93 LEU H . . 4.360 3.998 3.750 4.237 . 0 0 "[ . 1 . 2]" 1
2087 1 92 THR MG 1 93 LEU H . . 3.710 2.567 2.207 2.875 . 0 0 "[ . 1 . 2]" 1
2088 1 92 THR MG 1 93 LEU HA . . 5.270 4.355 4.007 4.673 . 0 0 "[ . 1 . 2]" 1
2089 1 92 THR MG 1 94 GLY H . . 3.320 2.740 2.389 3.158 . 0 0 "[ . 1 . 2]" 1
2090 1 92 THR MG 1 94 GLY HA2 . . 5.140 3.977 3.068 4.598 . 0 0 "[ . 1 . 2]" 1
2091 1 92 THR MG 1 95 VAL H . . 5.500 5.232 4.618 5.600 0.100 9 0 "[ . 1 . 2]" 1
2092 1 92 THR MG 1 95 VAL HA . . 5.500 4.652 4.192 4.891 . 0 0 "[ . 1 . 2]" 1
2093 1 92 THR MG 1 95 VAL QG . . 4.570 3.837 3.399 4.101 . 0 0 "[ . 1 . 2]" 1
2094 1 93 LEU H 1 93 LEU HB2 . . 3.610 2.759 2.600 2.848 . 0 0 "[ . 1 . 2]" 1
2095 1 93 LEU H 1 93 LEU HB3 . . 3.900 3.734 3.650 3.836 . 0 0 "[ . 1 . 2]" 1
2096 1 93 LEU H 1 93 LEU QD . . 3.890 2.843 1.888 3.357 . 0 0 "[ . 1 . 2]" 1
2097 1 93 LEU H 1 93 LEU HG . . 3.960 2.685 2.116 3.996 0.036 14 0 "[ . 1 . 2]" 1
2098 1 93 LEU H 1 94 GLY H . . 3.120 2.352 2.121 2.544 . 0 0 "[ . 1 . 2]" 1
2099 1 93 LEU H 1 94 GLY HA2 . . 5.350 4.840 4.555 4.996 . 0 0 "[ . 1 . 2]" 1
2100 1 93 LEU HA 1 93 LEU QD . . 3.180 2.330 2.197 3.033 . 0 0 "[ . 1 . 2]" 1
2101 1 93 LEU HA 1 93 LEU HG . . 3.680 3.392 2.469 3.764 0.084 1 0 "[ . 1 . 2]" 1
2102 1 93 LEU HA 1 94 GLY H . . 3.610 3.631 3.521 3.679 0.069 3 0 "[ . 1 . 2]" 1
2103 1 93 LEU HB2 1 94 GLY H . . 3.690 2.829 2.403 3.261 . 0 0 "[ . 1 . 2]" 1
2104 1 93 LEU HB3 1 94 GLY H . . 4.520 3.984 3.706 4.232 . 0 0 "[ . 1 . 2]" 1
2105 1 93 LEU QD 1 94 GLY H . . 4.650 4.018 3.498 4.294 . 0 0 "[ . 1 . 2]" 1
2106 1 93 LEU HG 1 94 GLY H . . 5.230 4.325 3.862 5.309 0.079 1 0 "[ . 1 . 2]" 1
2107 1 94 GLY H 1 95 VAL H . . 4.350 4.272 4.154 4.368 0.018 8 0 "[ . 1 . 2]" 1
2108 1 94 GLY H 1 95 VAL HA . . 4.960 4.654 4.490 4.736 . 0 0 "[ . 1 . 2]" 1
2109 1 94 GLY HA2 1 95 VAL H . . 3.310 2.666 2.558 2.810 . 0 0 "[ . 1 . 2]" 1
2110 1 94 GLY HA2 1 95 VAL HB . . 5.080 4.706 4.031 5.154 0.074 1 0 "[ . 1 . 2]" 1
2111 1 94 GLY HA2 1 95 VAL QG . . 4.170 3.586 3.377 4.078 . 0 0 "[ . 1 . 2]" 1
2112 1 94 GLY HA3 1 95 VAL H . . 3.260 2.405 2.248 2.512 . 0 0 "[ . 1 . 2]" 1
2113 1 95 VAL H 1 95 VAL HB . . 3.360 2.612 2.483 2.922 . 0 0 "[ . 1 . 2]" 1
2114 1 95 VAL H 1 95 VAL QG . . 3.330 2.824 2.551 3.017 . 0 0 "[ . 1 . 2]" 1
2115 1 95 VAL H 1 96 LEU HA . . 5.500 4.831 4.693 4.970 . 0 0 "[ . 1 . 2]" 1
2116 1 95 VAL HA 1 95 VAL QG . . 2.980 2.236 2.162 2.303 . 0 0 "[ . 1 . 2]" 1
2117 1 95 VAL HA 1 96 LEU H . . 2.920 2.247 2.128 2.413 . 0 0 "[ . 1 . 2]" 1
2118 1 95 VAL HA 1 96 LEU HA . . 5.050 4.414 4.218 4.550 . 0 0 "[ . 1 . 2]" 1
2119 1 95 VAL HA 1 96 LEU HB3 . . 5.500 5.612 5.471 5.871 0.371 11 0 "[ . 1 . 2]" 1
2120 1 95 VAL HA 1 96 LEU QD . . 5.130 3.747 2.852 4.490 . 0 0 "[ . 1 . 2]" 1
2121 1 95 VAL QG 1 96 LEU H . . 3.230 2.335 2.044 2.700 . 0 0 "[ . 1 . 2]" 1
2122 1 95 VAL QG 1 96 LEU HA . . 5.500 3.959 3.672 4.250 . 0 0 "[ . 1 . 2]" 1
2123 1 95 VAL QG 1 97 VAL QG . . 3.670 2.698 2.232 3.531 . 0 0 "[ . 1 . 2]" 1
2124 1 96 LEU H 1 96 LEU HB2 . . 3.570 2.322 1.998 2.452 . 0 0 "[ . 1 . 2]" 1
2125 1 96 LEU H 1 96 LEU HB3 . . 4.040 3.541 3.257 3.642 . 0 0 "[ . 1 . 2]" 1
2126 1 96 LEU H 1 96 LEU QD . . 4.210 2.922 2.163 3.622 . 0 0 "[ . 1 . 2]" 1
2127 1 96 LEU H 1 96 LEU HG . . 4.190 3.559 2.566 4.274 0.084 6 0 "[ . 1 . 2]" 1
2128 1 96 LEU H 1 97 VAL H . . 4.960 4.509 4.401 4.627 . 0 0 "[ . 1 . 2]" 1
2129 1 96 LEU H 1 97 VAL QG . . 5.000 4.033 3.726 4.338 . 0 0 "[ . 1 . 2]" 1
2130 1 96 LEU HA 1 96 LEU QD . . 3.320 2.100 2.034 2.147 . 0 0 "[ . 1 . 2]" 1
2131 1 96 LEU HA 1 97 VAL H . . 2.840 2.201 2.092 2.347 . 0 0 "[ . 1 . 2]" 1
2132 1 96 LEU HA 1 97 VAL HA . . 4.750 4.509 4.448 4.588 . 0 0 "[ . 1 . 2]" 1
2133 1 96 LEU HA 1 97 VAL QG . . 4.150 3.081 2.895 3.273 . 0 0 "[ . 1 . 2]" 1
2134 1 96 LEU HB2 1 97 VAL H . . 4.500 3.998 3.774 4.253 . 0 0 "[ . 1 . 2]" 1
2135 1 96 LEU HB3 1 97 VAL H . . 3.960 2.837 2.555 3.162 . 0 0 "[ . 1 . 2]" 1
2136 1 96 LEU QD 1 97 VAL H . . 4.060 3.367 2.940 3.689 . 0 0 "[ . 1 . 2]" 1
2137 1 96 LEU HG 1 97 VAL H . . 4.760 4.550 3.517 4.840 0.080 13 0 "[ . 1 . 2]" 1
2138 1 97 VAL H 1 97 VAL QG . . 3.370 2.254 2.163 2.352 . 0 0 "[ . 1 . 2]" 1
2139 1 97 VAL HA 1 97 VAL QG . . 3.270 2.249 2.156 2.322 . 0 0 "[ . 1 . 2]" 1
2140 1 97 VAL HA 1 98 PRO QD . . 3.250 2.145 2.059 2.219 . 0 0 "[ . 1 . 2]" 1
2141 1 97 VAL HA 1 98 PRO HG2 . . 4.650 4.716 4.666 4.734 0.084 15 0 "[ . 1 . 2]" 1
2142 1 97 VAL HA 1 98 PRO HG3 . . 4.990 4.454 4.218 4.663 . 0 0 "[ . 1 . 2]" 1
2143 1 97 VAL HB 1 98 PRO QD . . 3.570 2.265 2.157 2.502 . 0 0 "[ . 1 . 2]" 1
2144 1 97 VAL HB 1 98 PRO HG2 . . 4.950 4.408 4.151 4.729 . 0 0 "[ . 1 . 2]" 1
2145 1 97 VAL QG 1 98 PRO QD . . 4.430 2.970 2.859 3.138 . 0 0 "[ . 1 . 2]" 1
2146 1 98 PRO HA 1 99 HIS H . . 3.060 2.200 2.004 2.344 . 0 0 "[ . 1 . 2]" 1
2147 1 98 PRO HA 1 99 HIS HA . . 5.180 4.494 4.409 4.567 . 0 0 "[ . 1 . 2]" 1
2148 1 98 PRO HB2 1 99 HIS H . . 4.220 3.591 3.366 3.887 . 0 0 "[ . 1 . 2]" 1
2149 1 98 PRO HB2 1 99 HIS HA . . 5.350 4.665 4.097 5.094 . 0 0 "[ . 1 . 2]" 1
2150 1 98 PRO HB3 1 99 HIS H . . 4.580 3.718 3.203 4.137 . 0 0 "[ . 1 . 2]" 1
2151 1 99 HIS H 1 99 HIS HB2 . . 3.750 3.011 2.777 3.279 . 0 0 "[ . 1 . 2]" 1
2152 1 99 HIS H 1 99 HIS HB3 . . 3.620 2.416 2.255 2.609 . 0 0 "[ . 1 . 2]" 1
2153 1 99 HIS HA 1 99 HIS HD2 . . 3.160 2.586 2.223 2.868 . 0 0 "[ . 1 . 2]" 1
2154 1 99 HIS HA 1 100 VAL H . . 3.070 2.192 2.114 2.337 . 0 0 "[ . 1 . 2]" 1
2155 1 99 HIS HA 1 100 VAL HA . . 4.700 4.471 4.426 4.519 . 0 0 "[ . 1 . 2]" 1
2156 1 99 HIS HA 1 100 VAL QG . . 4.260 3.491 3.094 4.064 . 0 0 "[ . 1 . 2]" 1
2157 1 99 HIS HA 1 101 GLY H . . 4.950 3.925 3.606 4.208 . 0 0 "[ . 1 . 2]" 1
2158 1 99 HIS HB2 1 100 VAL H . . 5.040 4.366 4.178 4.633 . 0 0 "[ . 1 . 2]" 1
2159 1 99 HIS HB3 1 100 VAL H . . 5.290 4.447 4.214 4.627 . 0 0 "[ . 1 . 2]" 1
2160 1 99 HIS HD2 1 100 VAL H . . 4.320 3.048 2.468 3.889 . 0 0 "[ . 1 . 2]" 1
2161 1 99 HIS HD2 1 100 VAL HA . . 5.030 4.885 4.153 5.101 0.071 12 0 "[ . 1 . 2]" 1
2162 1 99 HIS HD2 1 101 GLY H . . 4.590 2.871 2.380 3.178 . 0 0 "[ . 1 . 2]" 1
2163 1 99 HIS HD2 1 101 GLY HA2 . . 4.460 3.957 3.565 4.315 . 0 0 "[ . 1 . 2]" 1
2164 1 99 HIS HD2 1 101 GLY HA3 . . 5.110 5.102 4.648 5.197 0.087 3 0 "[ . 1 . 2]" 1
2165 1 99 HIS HD2 1 102 GLU H . . 4.470 2.888 2.313 3.456 . 0 0 "[ . 1 . 2]" 1
2166 1 99 HIS HD2 1 102 GLU HB2 . . 3.940 3.691 2.528 4.019 0.079 16 0 "[ . 1 . 2]" 1
2167 1 100 VAL H 1 100 VAL HB . . 3.970 3.503 2.483 3.864 . 0 0 "[ . 1 . 2]" 1
2168 1 100 VAL H 1 100 VAL QG . . 3.510 2.216 1.832 2.960 . 0 0 "[ . 1 . 2]" 1
2169 1 100 VAL H 1 101 GLY H . . 4.280 2.939 2.458 3.357 . 0 0 "[ . 1 . 2]" 1
2170 1 100 VAL H 1 102 GLU H . . 5.170 3.257 2.889 4.241 . 0 0 "[ . 1 . 2]" 1
2171 1 100 VAL HA 1 100 VAL QG . . 3.170 2.259 2.063 2.378 . 0 0 "[ . 1 . 2]" 1
2172 1 100 VAL HA 1 101 GLY H . . 3.530 2.726 2.471 2.935 . 0 0 "[ . 1 . 2]" 1
2173 1 100 VAL HA 1 101 GLY HA2 . . 5.500 4.609 4.356 4.845 . 0 0 "[ . 1 . 2]" 1
2174 1 100 VAL HA 1 101 GLY HA3 . . 4.950 4.202 3.964 4.400 . 0 0 "[ . 1 . 2]" 1
2175 1 100 VAL HB 1 101 GLY H . . 4.700 4.548 4.434 4.624 . 0 0 "[ . 1 . 2]" 1
2176 1 100 VAL QG 1 101 GLY H . . 4.640 3.707 3.588 3.786 . 0 0 "[ . 1 . 2]" 1
2177 1 100 VAL QG 1 101 GLY HA2 . . 5.180 4.912 4.769 4.984 . 0 0 "[ . 1 . 2]" 1
2178 1 100 VAL QG 1 101 GLY HA3 . . 5.500 4.370 3.921 4.699 . 0 0 "[ . 1 . 2]" 1
2179 1 100 VAL QG 1 102 GLU H . . 5.500 3.626 2.961 4.545 . 0 0 "[ . 1 . 2]" 1
2180 1 100 VAL QG 1 102 GLU HA . . 5.400 4.456 3.225 5.324 . 0 0 "[ . 1 . 2]" 1
2181 1 100 VAL QG 1 102 GLU QG . . 4.990 2.812 2.075 3.912 . 0 0 "[ . 1 . 2]" 1
2182 1 101 GLY H 1 102 GLU H . . 4.170 2.798 2.391 3.077 . 0 0 "[ . 1 . 2]" 1
2183 1 102 GLU H 1 102 GLU QG . . 5.100 2.659 1.833 4.068 . 0 0 "[ . 1 . 2]" 1
2184 1 102 GLU H 1 103 THR H . . 5.480 3.279 2.642 3.927 . 0 0 "[ . 1 . 2]" 1
2185 1 102 GLU HA 1 102 GLU QG . . 3.600 2.659 2.172 3.067 . 0 0 "[ . 1 . 2]" 1
2186 1 102 GLU HA 1 103 THR HA . . 5.380 4.916 4.670 5.162 . 0 0 "[ . 1 . 2]" 1
2187 1 102 GLU HA 1 103 THR MG . . 5.500 5.544 5.315 5.619 0.119 12 0 "[ . 1 . 2]" 1
2188 1 102 GLU HB2 1 103 THR H . . 3.920 3.137 1.879 4.058 0.138 13 0 "[ . 1 . 2]" 1
2189 1 102 GLU HB3 1 103 THR H . . 4.840 3.164 1.907 4.348 . 0 0 "[ . 1 . 2]" 1
2190 1 102 GLU QG 1 103 THR H . . 4.980 3.959 2.286 4.547 . 0 0 "[ . 1 . 2]" 1
2191 1 103 THR H 1 103 THR HB . . 3.300 3.131 2.691 3.397 0.097 1 0 "[ . 1 . 2]" 1
2192 1 103 THR H 1 103 THR MG . . 4.550 3.961 3.184 4.214 . 0 0 "[ . 1 . 2]" 1
2193 1 103 THR H 1 104 PRO HD2 . . 5.480 4.207 3.664 4.846 . 0 0 "[ . 1 . 2]" 1
2194 1 103 THR HA 1 103 THR MG . . 3.280 2.601 2.409 3.175 . 0 0 "[ . 1 . 2]" 1
2195 1 103 THR HA 1 104 PRO HD2 . . 3.200 2.256 2.032 2.840 . 0 0 "[ . 1 . 2]" 1
2196 1 103 THR HA 1 104 PRO HD3 . . 3.040 2.516 1.962 2.802 . 0 0 "[ . 1 . 2]" 1
2197 1 103 THR HA 1 104 PRO HG2 . . 4.500 4.410 4.168 4.579 0.079 8 0 "[ . 1 . 2]" 1
2198 1 103 THR HA 1 104 PRO HG3 . . 4.700 4.564 4.028 4.751 0.051 6 0 "[ . 1 . 2]" 1
2199 1 103 THR HB 1 104 PRO HD2 . . 5.500 4.959 4.766 5.197 . 0 0 "[ . 1 . 2]" 1
2200 1 103 THR HB 1 104 PRO HD3 . . 5.160 5.079 4.827 5.223 0.063 3 0 "[ . 1 . 2]" 1
2201 1 103 THR MG 1 104 PRO HA . . 5.500 4.194 3.926 4.495 . 0 0 "[ . 1 . 2]" 1
2202 1 103 THR MG 1 104 PRO HD2 . . 3.740 3.425 2.813 3.726 . 0 0 "[ . 1 . 2]" 1
2203 1 103 THR MG 1 104 PRO HD3 . . 4.320 4.280 3.519 4.421 0.101 2 0 "[ . 1 . 2]" 1
2204 1 103 THR MG 1 104 PRO HG2 . . 5.300 4.850 4.356 5.385 0.085 9 0 "[ . 1 . 2]" 1
2205 1 103 THR MG 1 105 ILE H . . 5.500 4.914 4.284 5.320 . 0 0 "[ . 1 . 2]" 1
2206 1 103 THR MG 1 105 ILE HA . . 5.130 4.473 3.916 4.883 . 0 0 "[ . 1 . 2]" 1
2207 1 103 THR MG 1 105 ILE MD . . 4.790 4.752 3.846 4.922 0.132 20 0 "[ . 1 . 2]" 1
2208 1 103 THR MG 1 105 ILE MG . . 4.620 3.542 2.821 3.919 . 0 0 "[ . 1 . 2]" 1
2209 1 104 PRO HA 1 105 ILE H . . 2.920 2.216 2.153 2.306 . 0 0 "[ . 1 . 2]" 1
2210 1 104 PRO HA 1 105 ILE HA . . 4.680 4.455 4.412 4.505 . 0 0 "[ . 1 . 2]" 1
2211 1 104 PRO HA 1 105 ILE HG12 . . 5.240 4.512 3.779 4.803 . 0 0 "[ . 1 . 2]" 1
2212 1 104 PRO HA 1 105 ILE MG . . 4.370 3.775 3.187 4.129 . 0 0 "[ . 1 . 2]" 1
2213 1 104 PRO HA 1 106 ALA H . . 3.900 3.799 3.608 3.950 0.050 11 0 "[ . 1 . 2]" 1
2214 1 104 PRO HB2 1 105 ILE H . . 4.070 2.909 2.477 3.392 . 0 0 "[ . 1 . 2]" 1
2215 1 104 PRO HB2 1 105 ILE MD . . 5.500 4.524 3.896 5.584 0.084 6 0 "[ . 1 . 2]" 1
2216 1 104 PRO HB2 1 106 ALA H . . 4.140 2.706 2.388 3.216 . 0 0 "[ . 1 . 2]" 1
2217 1 104 PRO HB2 1 107 TYR QE . . 5.430 3.305 2.881 3.979 . 0 0 "[ . 1 . 2]" 1
2218 1 104 PRO HB3 1 105 ILE H . . 4.150 3.414 3.087 3.683 . 0 0 "[ . 1 . 2]" 1
2219 1 104 PRO HB3 1 106 ALA H . . 3.910 3.784 3.289 3.986 0.076 8 0 "[ . 1 . 2]" 1
2220 1 104 PRO HB3 1 107 TYR QE . . 4.740 4.044 3.250 4.809 0.069 14 0 "[ . 1 . 2]" 1
2221 1 104 PRO HG2 1 107 TYR QD . . 5.490 4.376 3.966 5.508 0.018 14 0 "[ . 1 . 2]" 1
2222 1 104 PRO HG2 1 107 TYR QE . . 3.720 2.685 2.179 3.804 0.084 14 0 "[ . 1 . 2]" 1
2223 1 104 PRO HG3 1 107 TYR QE . . 5.080 3.000 2.297 4.717 . 0 0 "[ . 1 . 2]" 1
2224 1 105 ILE H 1 105 ILE MD . . 4.010 2.051 1.781 3.341 . 0 0 "[ . 1 . 2]" 1
2225 1 105 ILE H 1 105 ILE HG12 . . 3.380 2.453 1.981 2.679 . 0 0 "[ . 1 . 2]" 1
2226 1 105 ILE H 1 105 ILE HG13 . . 3.970 3.730 3.444 3.889 . 0 0 "[ . 1 . 2]" 1
2227 1 105 ILE H 1 105 ILE MG . . 3.650 2.900 2.653 3.057 . 0 0 "[ . 1 . 2]" 1
2228 1 105 ILE H 1 106 ALA H . . 3.040 2.103 1.880 2.335 . 0 0 "[ . 1 . 2]" 1
2229 1 105 ILE H 1 106 ALA HA . . 5.060 4.808 4.557 4.998 . 0 0 "[ . 1 . 2]" 1
2230 1 105 ILE H 1 106 ALA MB . . 4.530 4.182 3.880 4.528 . 0 0 "[ . 1 . 2]" 1
2231 1 105 ILE HA 1 105 ILE HB . . 2.950 2.482 2.425 2.558 . 0 0 "[ . 1 . 2]" 1
2232 1 105 ILE HA 1 105 ILE MD . . 4.420 3.789 3.679 4.240 . 0 0 "[ . 1 . 2]" 1
2233 1 105 ILE HA 1 105 ILE MG . . 3.090 2.279 2.227 2.348 . 0 0 "[ . 1 . 2]" 1
2234 1 105 ILE HA 1 106 ALA MB . . 5.500 4.516 4.397 4.609 . 0 0 "[ . 1 . 2]" 1
2235 1 105 ILE HB 1 105 ILE MD . . 3.220 3.191 2.739 3.259 0.039 20 0 "[ . 1 . 2]" 1
2236 1 105 ILE HB 1 106 ALA H . . 4.350 4.041 3.784 4.262 . 0 0 "[ . 1 . 2]" 1
2237 1 105 ILE HB 1 106 ALA MB . . 4.730 3.847 3.498 4.323 . 0 0 "[ . 1 . 2]" 1
2238 1 105 ILE MD 1 105 ILE MG . . 2.740 2.020 1.986 2.051 . 0 0 "[ . 1 . 2]" 1
2239 1 105 ILE MD 1 106 ALA H . . 4.700 3.514 3.301 4.280 . 0 0 "[ . 1 . 2]" 1
2240 1 105 ILE MD 1 106 ALA MB . . 4.390 4.085 3.712 4.421 0.031 17 0 "[ . 1 . 2]" 1
2241 1 105 ILE HG12 1 106 ALA H . . 3.930 2.553 2.233 2.704 . 0 0 "[ . 1 . 2]" 1
2242 1 105 ILE HG12 1 106 ALA HA . . 5.170 4.553 4.311 4.953 . 0 0 "[ . 1 . 2]" 1
2243 1 105 ILE HG12 1 106 ALA MB . . 4.040 2.908 2.508 3.528 . 0 0 "[ . 1 . 2]" 1
2244 1 105 ILE HG13 1 106 ALA H . . 4.290 4.181 3.512 4.362 0.072 8 0 "[ . 1 . 2]" 1
2245 1 105 ILE HG13 1 106 ALA MB . . 4.290 3.747 3.091 4.142 . 0 0 "[ . 1 . 2]" 1
2246 1 105 ILE MG 1 106 ALA H . . 4.470 4.264 4.128 4.335 . 0 0 "[ . 1 . 2]" 1
2247 1 105 ILE MG 1 106 ALA MB . . 5.260 4.767 4.588 5.020 . 0 0 "[ . 1 . 2]" 1
2248 1 106 ALA H 1 106 ALA MB . . 3.470 2.775 2.635 2.878 . 0 0 "[ . 1 . 2]" 1
2249 1 106 ALA H 1 107 TYR H . . 4.710 4.310 4.250 4.385 . 0 0 "[ . 1 . 2]" 1
2250 1 106 ALA H 1 107 TYR HA . . 5.210 4.590 4.499 4.660 . 0 0 "[ . 1 . 2]" 1
2251 1 106 ALA H 1 107 TYR QD . . 5.500 4.246 3.853 4.828 . 0 0 "[ . 1 . 2]" 1
2252 1 106 ALA HA 1 107 TYR H . . 2.920 2.619 2.470 2.783 . 0 0 "[ . 1 . 2]" 1
2253 1 106 ALA HA 1 107 TYR HA . . 4.960 4.609 4.561 4.661 . 0 0 "[ . 1 . 2]" 1
2254 1 106 ALA HA 1 107 TYR QB . . 4.790 4.300 4.094 4.466 . 0 0 "[ . 1 . 2]" 1
2255 1 106 ALA HA 1 107 TYR QD . . 3.380 3.450 3.360 3.478 0.098 11 0 "[ . 1 . 2]" 1
2256 1 106 ALA HA 1 107 TYR QE . . 5.450 5.260 4.901 5.419 . 0 0 "[ . 1 . 2]" 1
2257 1 106 ALA MB 1 107 TYR H . . 2.910 2.150 1.995 2.260 . 0 0 "[ . 1 . 2]" 1
2258 1 106 ALA MB 1 107 TYR HA . . 4.820 3.948 3.856 4.087 . 0 0 "[ . 1 . 2]" 1
2259 1 106 ALA MB 1 107 TYR QB . . 4.570 4.258 4.091 4.382 . 0 0 "[ . 1 . 2]" 1
2260 1 106 ALA MB 1 107 TYR QD . . 5.150 4.410 4.333 4.537 . 0 0 "[ . 1 . 2]" 1
2261 1 107 TYR H 1 107 TYR QB . . 3.270 2.605 2.467 2.705 . 0 0 "[ . 1 . 2]" 1
2262 1 107 TYR H 1 107 TYR QD . . 3.720 3.386 3.256 3.535 . 0 0 "[ . 1 . 2]" 1
2263 1 107 TYR H 1 108 ARG H . . 4.480 4.345 4.246 4.426 . 0 0 "[ . 1 . 2]" 1
2264 1 107 TYR H 1 108 ARG HA . . 4.850 4.783 4.667 4.892 0.042 8 0 "[ . 1 . 2]" 1
2265 1 107 TYR HA 1 107 TYR QD . . 3.140 3.042 2.881 3.131 . 0 0 "[ . 1 . 2]" 1
2266 1 107 TYR HA 1 107 TYR QE . . 5.170 4.528 4.367 4.635 . 0 0 "[ . 1 . 2]" 1
2267 1 107 TYR HA 1 108 ARG H . . 2.970 2.263 2.121 2.425 . 0 0 "[ . 1 . 2]" 1
2268 1 107 TYR HA 1 108 ARG HA . . 4.700 4.498 4.430 4.548 . 0 0 "[ . 1 . 2]" 1
2269 1 107 TYR HA 1 108 ARG HB2 . . 5.170 4.158 3.999 4.281 . 0 0 "[ . 1 . 2]" 1
2270 1 107 TYR HA 1 108 ARG HB3 . . 5.500 5.140 4.529 5.559 0.059 18 0 "[ . 1 . 2]" 1
2271 1 107 TYR QB 1 108 ARG H . . 3.760 2.816 2.444 3.227 . 0 0 "[ . 1 . 2]" 1
2272 1 107 TYR QD 1 108 ARG H . . 4.700 3.723 3.439 3.999 . 0 0 "[ . 1 . 2]" 1
2273 1 108 ARG H 1 108 ARG HB2 . . 3.850 2.696 2.379 3.070 . 0 0 "[ . 1 . 2]" 1
2274 1 108 ARG H 1 108 ARG HB3 . . 3.960 3.187 2.608 3.707 . 0 0 "[ . 1 . 2]" 1
2275 1 108 ARG H 1 108 ARG HD2 . . 5.310 5.124 4.520 5.566 0.256 8 0 "[ . 1 . 2]" 1
2276 1 108 ARG H 1 108 ARG HD3 . . 5.500 4.910 3.969 5.407 . 0 0 "[ . 1 . 2]" 1
2277 1 108 ARG H 1 108 ARG HG3 . . 4.630 4.529 4.249 4.702 0.072 10 0 "[ . 1 . 2]" 1
2278 1 108 ARG H 1 109 ASN H . . 5.260 4.303 3.886 4.551 . 0 0 "[ . 1 . 2]" 1
2279 1 108 ARG H 1 109 ASN HA . . 5.500 4.812 4.644 5.040 . 0 0 "[ . 1 . 2]" 1
2280 1 108 ARG HA 1 108 ARG HD2 . . 3.190 2.787 2.089 3.638 0.448 8 0 "[ . 1 . 2]" 1
2281 1 108 ARG HA 1 108 ARG HD3 . . 4.140 2.756 2.090 3.634 . 0 0 "[ . 1 . 2]" 1
2282 1 108 ARG HA 1 108 ARG HG2 . . 3.940 3.142 2.389 3.738 . 0 0 "[ . 1 . 2]" 1
2283 1 108 ARG HA 1 108 ARG HG3 . . 3.860 3.102 2.403 3.693 . 0 0 "[ . 1 . 2]" 1
2284 1 108 ARG HA 1 109 ASN H . . 2.870 2.276 1.983 2.493 . 0 0 "[ . 1 . 2]" 1
2285 1 108 ARG HA 1 109 ASN HA . . 5.390 4.493 4.395 4.586 . 0 0 "[ . 1 . 2]" 1
2286 1 108 ARG HB2 1 109 ASN H . . 4.390 4.347 4.006 4.470 0.080 17 0 "[ . 1 . 2]" 1
2287 1 108 ARG HB3 1 108 ARG HD3 . . 3.800 3.326 2.774 3.722 . 0 0 "[ . 1 . 2]" 1
2288 1 108 ARG HB3 1 109 ASN H . . 4.430 3.627 2.654 4.418 . 0 0 "[ . 1 . 2]" 1
2289 1 108 ARG HB3 1 110 VAL MG1 . . 4.190 3.609 2.784 4.102 . 0 0 "[ . 1 . 2]" 1
2290 1 108 ARG HD2 1 109 ASN H . . 4.590 3.750 2.370 4.805 0.215 19 0 "[ . 1 . 2]" 1
2291 1 108 ARG HD3 1 109 ASN H . . 5.260 4.107 2.524 5.014 . 0 0 "[ . 1 . 2]" 1
2292 1 108 ARG HG2 1 109 ASN H . . 5.190 4.385 3.881 5.130 . 0 0 "[ . 1 . 2]" 1
2293 1 108 ARG HG3 1 109 ASN H . . 5.330 3.797 2.239 5.413 0.083 1 0 "[ . 1 . 2]" 1
2294 1 109 ASN H 1 109 ASN HB2 . . 3.470 3.369 2.411 3.802 0.332 18 0 "[ . 1 . 2]" 1
2295 1 109 ASN H 1 109 ASN HB3 . . 3.740 3.174 2.631 3.810 0.070 7 0 "[ . 1 . 2]" 1
2296 1 109 ASN H 1 109 ASN HD21 . . 5.500 4.220 2.836 5.359 . 0 0 "[ . 1 . 2]" 1
2297 1 109 ASN H 1 109 ASN HD22 . . 5.500 4.424 3.124 5.593 0.093 20 0 "[ . 1 . 2]" 1
2298 1 109 ASN HA 1 109 ASN HD22 . . 5.500 5.061 4.023 5.490 . 0 0 "[ . 1 . 2]" 1
2299 1 109 ASN HA 1 110 VAL H . . 2.790 2.233 2.175 2.295 . 0 0 "[ . 1 . 2]" 1
2300 1 109 ASN HA 1 110 VAL MG2 . . 4.170 3.449 3.264 3.622 . 0 0 "[ . 1 . 2]" 1
2301 1 109 ASN HB2 1 110 VAL H . . 4.940 3.294 2.539 4.394 . 0 0 "[ . 1 . 2]" 1
2302 1 109 ASN HB2 1 110 VAL MG2 . . 5.500 5.039 4.498 5.575 0.075 14 0 "[ . 1 . 2]" 1
2303 1 109 ASN HB3 1 110 VAL H . . 4.350 3.754 2.526 4.357 0.007 11 0 "[ . 1 . 2]" 1
2304 1 109 ASN HB3 1 110 VAL MG2 . . 5.500 5.289 4.570 5.601 0.101 14 0 "[ . 1 . 2]" 1
2305 1 110 VAL H 1 110 VAL MG1 . . 4.010 3.291 3.022 3.455 . 0 0 "[ . 1 . 2]" 1
2306 1 110 VAL H 1 110 VAL MG2 . . 3.400 2.382 2.281 2.489 . 0 0 "[ . 1 . 2]" 1
2307 1 110 VAL HA 1 110 VAL MG1 . . 3.180 2.346 2.219 2.433 . 0 0 "[ . 1 . 2]" 1
2308 1 110 VAL HA 1 110 VAL MG2 . . 3.750 3.282 3.262 3.293 . 0 0 "[ . 1 . 2]" 1
2309 1 110 VAL HA 1 111 LEU H . . 3.000 2.558 2.268 2.649 . 0 0 "[ . 1 . 2]" 1
2310 1 110 VAL HA 1 111 LEU HB2 . . 5.390 4.583 4.267 4.957 . 0 0 "[ . 1 . 2]" 1
2311 1 110 VAL HB 1 111 LEU H . . 3.240 2.491 2.218 3.314 0.074 11 0 "[ . 1 . 2]" 1
2312 1 110 VAL MG1 1 111 LEU H . . 4.000 3.722 3.423 3.905 . 0 0 "[ . 1 . 2]" 1
2313 1 110 VAL MG2 1 111 LEU HA . . 5.200 3.905 3.374 4.602 . 0 0 "[ . 1 . 2]" 1
2314 1 111 LEU H 1 111 LEU HB2 . . 3.590 2.300 2.139 2.583 . 0 0 "[ . 1 . 2]" 1
2315 1 111 LEU H 1 111 LEU HB3 . . 3.930 3.534 3.356 3.736 . 0 0 "[ . 1 . 2]" 1
2316 1 111 LEU H 1 111 LEU MD1 . . 4.730 4.311 4.173 4.406 . 0 0 "[ . 1 . 2]" 1
2317 1 111 LEU H 1 111 LEU HG . . 4.170 4.236 4.137 4.258 0.088 20 0 "[ . 1 . 2]" 1
2318 1 111 LEU H 1 112 LEU H . . 5.240 4.430 4.328 4.606 . 0 0 "[ . 1 . 2]" 1
2319 1 111 LEU HA 1 111 LEU MD1 . . 3.880 2.524 2.327 2.683 . 0 0 "[ . 1 . 2]" 1
2320 1 111 LEU HA 1 112 LEU H . . 2.930 2.336 2.218 2.492 . 0 0 "[ . 1 . 2]" 1
2321 1 111 LEU HA 1 112 LEU HB2 . . 5.100 4.163 3.904 4.717 . 0 0 "[ . 1 . 2]" 1
2322 1 111 LEU HA 1 112 LEU HB3 . . 5.150 4.848 4.263 5.232 0.082 9 0 "[ . 1 . 2]" 1
2323 1 111 LEU HB3 1 112 LEU H . . 4.300 2.600 2.178 2.904 . 0 0 "[ . 1 . 2]" 1
2324 1 111 LEU MD1 1 112 LEU H . . 3.780 3.136 2.594 3.515 . 0 0 "[ . 1 . 2]" 1
2325 1 111 LEU HG 1 112 LEU H . . 4.690 4.721 4.481 4.773 0.083 20 0 "[ . 1 . 2]" 1
2326 1 112 LEU H 1 112 LEU HB2 . . 3.570 2.757 2.316 3.041 . 0 0 "[ . 1 . 2]" 1
2327 1 112 LEU H 1 112 LEU HB3 . . 3.500 2.831 2.448 3.162 . 0 0 "[ . 1 . 2]" 1
2328 1 112 LEU H 1 112 LEU QD . . 4.550 3.907 3.724 4.026 . 0 0 "[ . 1 . 2]" 1
2329 1 112 LEU HA 1 112 LEU QD . . 3.270 2.142 2.008 2.326 . 0 0 "[ . 1 . 2]" 1
2330 1 112 LEU HA 1 113 ARG H . . 2.910 2.277 2.107 2.463 . 0 0 "[ . 1 . 2]" 1
2331 1 112 LEU HB2 1 113 ARG H . . 4.530 4.397 4.151 4.586 0.056 1 0 "[ . 1 . 2]" 1
2332 1 112 LEU QD 1 113 ARG H . . 3.550 2.024 1.754 2.507 . 0 0 "[ . 1 . 2]" 1
2333 1 112 LEU QD 1 113 ARG HA . . 4.220 4.001 3.738 4.193 . 0 0 "[ . 1 . 2]" 1
2334 1 112 LEU QD 1 113 ARG HB2 . . 4.520 3.514 2.641 4.572 0.052 5 0 "[ . 1 . 2]" 1
2335 1 112 LEU QD 1 113 ARG HB3 . . 4.180 3.825 3.054 4.474 0.294 10 0 "[ . 1 . 2]" 1
2336 1 112 LEU QD 1 113 ARG QD . . 4.800 3.760 2.094 4.808 0.008 18 0 "[ . 1 . 2]" 1
2337 1 112 LEU QD 1 114 LYS H . . 5.500 4.485 2.556 5.276 . 0 0 "[ . 1 . 2]" 1
2338 1 112 LEU QD 1 114 LYS QG . . 5.030 3.932 2.170 4.893 . 0 0 "[ . 1 . 2]" 1
2339 1 113 ARG H 1 113 ARG HB2 . . 3.500 2.619 2.069 3.579 0.079 14 0 "[ . 1 . 2]" 1
2340 1 113 ARG H 1 113 ARG HB3 . . 3.490 3.027 2.311 3.576 0.086 17 0 "[ . 1 . 2]" 1
2341 1 113 ARG H 1 113 ARG QD . . 4.850 3.294 1.940 4.199 . 0 0 "[ . 1 . 2]" 1
2342 1 113 ARG H 1 113 ARG QG . . 3.810 2.890 2.147 3.899 0.089 16 0 "[ . 1 . 2]" 1
2343 1 113 ARG H 1 114 LYS H . . 5.030 4.380 3.241 4.683 . 0 0 "[ . 1 . 2]" 1
2344 1 113 ARG HA 1 113 ARG QD . . 3.860 3.832 3.348 3.974 0.114 9 0 "[ . 1 . 2]" 1
2345 1 113 ARG HA 1 113 ARG QG . . 3.320 2.586 2.149 3.413 0.093 5 0 "[ . 1 . 2]" 1
2346 1 113 ARG HA 1 114 LYS H . . 3.000 2.270 2.072 2.912 . 0 0 "[ . 1 . 2]" 1
2347 1 113 ARG HB2 1 113 ARG QD . . 3.700 2.402 2.041 3.206 . 0 0 "[ . 1 . 2]" 1
2348 1 113 ARG HB2 1 113 ARG QG . . 2.640 2.428 2.122 2.575 . 0 0 "[ . 1 . 2]" 1
2349 1 113 ARG HB2 1 114 LYS H . . 5.140 3.943 2.555 4.563 . 0 0 "[ . 1 . 2]" 1
2350 1 113 ARG HB3 1 113 ARG QD . . 3.790 2.686 2.029 3.428 . 0 0 "[ . 1 . 2]" 1
2351 1 113 ARG HB3 1 114 LYS H . . 5.000 3.643 2.479 4.352 . 0 0 "[ . 1 . 2]" 1
2352 1 113 ARG QG 1 114 LYS H . . 4.350 3.882 2.446 4.430 0.080 18 0 "[ . 1 . 2]" 1
2353 1 114 LYS H 1 114 LYS HB2 . . 3.770 2.899 2.272 3.892 0.122 8 0 "[ . 1 . 2]" 1
2354 1 114 LYS H 1 114 LYS HB3 . . 4.000 3.647 3.142 4.027 0.027 7 0 "[ . 1 . 2]" 1
2355 1 114 LYS H 1 114 LYS QG . . 4.280 3.542 2.204 4.243 . 0 0 "[ . 1 . 2]" 1
2356 1 114 LYS HA 1 114 LYS QG . . 3.420 2.298 2.046 3.396 . 0 0 "[ . 1 . 2]" 1
2357 1 114 LYS HA 1 115 ASN QD . . 5.500 4.720 3.738 5.401 . 0 0 "[ . 1 . 2]" 1
2358 1 114 LYS HB2 1 114 LYS QE . . 4.590 3.635 2.089 4.284 . 0 0 "[ . 1 . 2]" 1
2359 1 114 LYS HB3 1 114 LYS QE . . 4.460 3.620 2.105 4.331 . 0 0 "[ . 1 . 2]" 1
2360 1 114 LYS QE 1 114 LYS QG . . 3.290 2.205 2.028 2.529 . 0 0 "[ . 1 . 2]" 1
2361 1 115 ASN HB2 1 116 GLY H . . 5.500 2.826 1.855 4.229 . 0 0 "[ . 1 . 2]" 1
2362 1 115 ASN HB2 1 116 GLY QA . . 5.030 4.342 3.819 5.116 0.086 6 0 "[ . 1 . 2]" 1
2363 1 115 ASN HB3 1 116 GLY H . . 5.280 3.252 2.067 4.312 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 1:38:41 AM GMT (wattos1)