NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
630291 |
5yi9   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5yi9
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 2352
_Distance_constraint_stats_list.Viol_count 6172
_Distance_constraint_stats_list.Viol_total 261652.188
_Distance_constraint_stats_list.Viol_max 16.988
_Distance_constraint_stats_list.Viol_rms 0.7484
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0695
_Distance_constraint_stats_list.Viol_average_violations_only 1.0598
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 3 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 4 ALA 0.074 0.029 18 0 "[ . 1 . 2 . 3 . 4]"
1 5 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 6 TRP 0.513 0.040 13 0 "[ . 1 . 2 . 3 . 4]"
1 7 GLU 1.679 0.075 17 0 "[ . 1 . 2 . 3 . 4]"
1 8 THR 1.353 0.075 17 0 "[ . 1 . 2 . 3 . 4]"
1 10 MET 9.343 0.391 26 0 "[ . 1 . 2 . 3 . 4]"
1 11 ASP 0.184 0.033 2 0 "[ . 1 . 2 . 3 . 4]"
1 12 SER 0.116 0.033 2 0 "[ . 1 . 2 . 3 . 4]"
1 13 ARG 1.502 0.116 8 0 "[ . 1 . 2 . 3 . 4]"
1 14 LEU 9.575 0.234 30 0 "[ . 1 . 2 . 3 . 4]"
1 15 GLN 1.134 0.039 14 0 "[ . 1 . 2 . 3 . 4]"
1 16 ARG 0.024 0.013 24 0 "[ . 1 . 2 . 3 . 4]"
1 17 ILE 0.950 0.053 30 0 "[ . 1 . 2 . 3 . 4]"
1 18 HIS 1.497 0.051 18 0 "[ . 1 . 2 . 3 . 4]"
1 19 ALA 1.231 0.096 21 0 "[ . 1 . 2 . 3 . 4]"
1 20 GLU 0.428 0.044 6 0 "[ . 1 . 2 . 3 . 4]"
1 21 ILE 6.588 0.198 30 0 "[ . 1 . 2 . 3 . 4]"
1 22 LYS 0.936 0.096 21 0 "[ . 1 . 2 . 3 . 4]"
1 23 ASN 0.579 0.065 35 0 "[ . 1 . 2 . 3 . 4]"
1 24 SER 0.344 0.034 3 0 "[ . 1 . 2 . 3 . 4]"
1 25 LEU 7.123 0.156 18 0 "[ . 1 . 2 . 3 . 4]"
1 26 LYS 2.131 0.063 37 0 "[ . 1 . 2 . 3 . 4]"
1 27 ILE 1.465 0.063 37 0 "[ . 1 . 2 . 3 . 4]"
1 28 ASP 0.028 0.019 39 0 "[ . 1 . 2 . 3 . 4]"
1 29 ASN 0.087 0.023 15 0 "[ . 1 . 2 . 3 . 4]"
1 30 LEU 4.496 0.100 38 0 "[ . 1 . 2 . 3 . 4]"
1 31 ASP 3.952 0.100 38 0 "[ . 1 . 2 . 3 . 4]"
1 32 VAL 7.437 0.216 38 0 "[ . 1 . 2 . 3 . 4]"
1 33 ASN 2.002 0.112 28 0 "[ . 1 . 2 . 3 . 4]"
1 34 ARG 1.661 0.112 28 0 "[ . 1 . 2 . 3 . 4]"
1 35 CYS 0.142 0.024 22 0 "[ . 1 . 2 . 3 . 4]"
1 36 ILE 2.252 0.057 28 0 "[ . 1 . 2 . 3 . 4]"
1 37 GLU 1.321 0.059 33 0 "[ . 1 . 2 . 3 . 4]"
1 38 ALA 8.021 0.198 30 0 "[ . 1 . 2 . 3 . 4]"
1 39 LEU 3.919 0.094 2 0 "[ . 1 . 2 . 3 . 4]"
1 40 ASP 3.012 0.094 2 0 "[ . 1 . 2 . 3 . 4]"
1 41 GLU 0.665 0.041 31 0 "[ . 1 . 2 . 3 . 4]"
1 42 LEU 11.208 0.391 26 0 "[ . 1 . 2 . 3 . 4]"
1 43 ALA 1.556 0.050 38 0 "[ . 1 . 2 . 3 . 4]"
1 44 SER 1.126 0.107 22 0 "[ . 1 . 2 . 3 . 4]"
1 45 LEU 5.748 0.153 13 0 "[ . 1 . 2 . 3 . 4]"
1 46 GLN 2.125 0.131 12 0 "[ . 1 . 2 . 3 . 4]"
1 47 VAL 4.941 0.200 32 0 "[ . 1 . 2 . 3 . 4]"
1 48 THR 2.601 0.117 11 0 "[ . 1 . 2 . 3 . 4]"
1 49 MET 2.605 0.086 8 0 "[ . 1 . 2 . 3 . 4]"
1 50 GLN 0.388 0.053 18 0 "[ . 1 . 2 . 3 . 4]"
1 51 GLN 1.464 0.068 15 0 "[ . 1 . 2 . 3 . 4]"
1 52 ALA 1.527 0.127 34 0 "[ . 1 . 2 . 3 . 4]"
1 53 GLN 1.666 0.086 8 0 "[ . 1 . 2 . 3 . 4]"
1 54 LYS 0.157 0.014 36 0 "[ . 1 . 2 . 3 . 4]"
1 55 HIS 0.315 0.035 31 0 "[ . 1 . 2 . 3 . 4]"
1 56 THR 1401.922 15.337 3 40 [**+*******************************-*****]
1 57 GLU 0.162 0.048 31 0 "[ . 1 . 2 . 3 . 4]"
1 58 MET 6.267 0.147 6 0 "[ . 1 . 2 . 3 . 4]"
1 59 ILE 350.240 8.996 19 40 [************-*****+*********************]
1 60 THR 0.257 0.034 17 0 "[ . 1 . 2 . 3 . 4]"
1 61 THR 2.156 0.154 18 0 "[ . 1 . 2 . 3 . 4]"
1 62 LEU 1.891 0.081 6 0 "[ . 1 . 2 . 3 . 4]"
1 63 LYS 0.038 0.032 34 0 "[ . 1 . 2 . 3 . 4]"
1 64 LYS 0.251 0.034 17 0 "[ . 1 . 2 . 3 . 4]"
1 65 ILE 5.436 0.156 18 0 "[ . 1 . 2 . 3 . 4]"
1 66 ARG 0.162 0.048 34 0 "[ . 1 . 2 . 3 . 4]"
1 67 ARG 1.745 0.062 7 0 "[ . 1 . 2 . 3 . 4]"
1 68 PHE 2.380 0.216 38 0 "[ . 1 . 2 . 3 . 4]"
1 69 LYS 3.006 0.160 34 0 "[ . 1 . 2 . 3 . 4]"
1 70 VAL 11.716 0.320 29 0 "[ . 1 . 2 . 3 . 4]"
1 71 SER 2.982 0.123 6 0 "[ . 1 . 2 . 3 . 4]"
1 72 GLN 1.128 0.043 36 0 "[ . 1 . 2 . 3 . 4]"
1 73 VAL 1.917 0.046 6 0 "[ . 1 . 2 . 3 . 4]"
1 74 ILE 10.870 0.320 29 0 "[ . 1 . 2 . 3 . 4]"
1 75 MET 3.933 0.160 34 0 "[ . 1 . 2 . 3 . 4]"
1 76 GLU 0.570 0.056 21 0 "[ . 1 . 2 . 3 . 4]"
1 77 LYS 1.548 0.046 6 0 "[ . 1 . 2 . 3 . 4]"
1 78 SER 1.299 0.077 37 0 "[ . 1 . 2 . 3 . 4]"
1 79 THR 1.246 0.135 7 0 "[ . 1 . 2 . 3 . 4]"
1 80 MET 4.794 0.188 13 0 "[ . 1 . 2 . 3 . 4]"
1 81 LEU 2.873 0.188 13 0 "[ . 1 . 2 . 3 . 4]"
1 82 TYR 0.424 0.054 6 0 "[ . 1 . 2 . 3 . 4]"
1 83 ASN 0.020 0.006 23 0 "[ . 1 . 2 . 3 . 4]"
1 84 LYS 1.444 0.072 21 0 "[ . 1 . 2 . 3 . 4]"
1 85 PHE 2.429 0.098 15 0 "[ . 1 . 2 . 3 . 4]"
1 86 LYS 2.452 0.106 17 0 "[ . 1 . 2 . 3 . 4]"
1 87 ASN 4.725 0.239 2 0 "[ . 1 . 2 . 3 . 4]"
1 88 MET 2.987 0.072 21 0 "[ . 1 . 2 . 3 . 4]"
1 89 PHE 1188.455 16.988 27 40 [**************************+**-**********]
1 90 LEU 5.404 0.134 37 0 "[ . 1 . 2 . 3 . 4]"
1 91 VAL 7.818 0.239 2 0 "[ . 1 . 2 . 3 . 4]"
1 92 GLY 0.601 0.037 30 0 "[ . 1 . 2 . 3 . 4]"
1 93 GLU 0.480 0.166 10 0 "[ . 1 . 2 . 3 . 4]"
1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 95 ASP 0.031 0.025 24 0 "[ . 1 . 2 . 3 . 4]"
1 96 SER 1.548 0.454 29 0 "[ . 1 . 2 . 3 . 4]"
1 97 VAL 1.985 0.454 29 0 "[ . 1 . 2 . 3 . 4]"
1 98 ILE 1.700 0.106 7 0 "[ . 1 . 2 . 3 . 4]"
1 99 THR 1.860 0.111 12 0 "[ . 1 . 2 . 3 . 4]"
1 100 GLN 1.343 0.300 21 0 "[ . 1 . 2 . 3 . 4]"
1 101 VAL 2.555 0.300 21 0 "[ . 1 . 2 . 3 . 4]"
1 102 LEU 1.705 0.192 23 0 "[ . 1 . 2 . 3 . 4]"
1 103 ASN 0.027 0.011 38 0 "[ . 1 . 2 . 3 . 4]"
1 104 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 118 LEU 12.702 0.549 11 1 "[ . 1+ . 2 . 3 . 4]"
1 119 ARG 100.185 1.607 6 40 [*****+***-******************************]
1 120 ARG 969.372 7.311 40 40 [*********-*****************************+]
1 121 ILE 259.530 2.143 12 40 [***********+*******************-********]
1 122 PHE 700.755 7.311 40 40 [*******************************-*******+]
1 124 GLU 10.525 1.539 30 9 "[ **. *1 . 2 * . + - . ** *]"
1 125 ASP 0.073 0.073 14 0 "[ . 1 . 2 . 3 . 4]"
1 126 THR 658.352 16.988 27 40 [**************************+*****-*******]
1 127 ASP 29.732 1.095 7 30 "[** .*+* ************ *******3-* *** *4]"
1 128 SER 254.711 6.147 33 40 [********************************+*-*****]
1 129 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 130 THR 477.983 13.505 9 40 [********+***************************-***]
1 131 GLU 2245.196 16.094 40 40 [*******************************-*******+]
1 132 ASP 1027.823 7.395 26 40 [********-****************+**************]
1 133 PHE 691.319 4.884 8 40 [*******+-*******************************]
1 134 ALA 293.839 5.487 25 40 [************************+*******-*******]
1 135 GLY 793.370 8.996 19 40 [******************+****-****************]
1 136 PHE 1290.938 7.395 26 40 [***********************-*+**************]
1 137 THR 13.366 0.383 22 0 "[ . 1 . 2 . 3 . 4]"
1 138 GLN 1.388 0.273 25 0 "[ . 1 . 2 . 3 . 4]"
1 139 SER 7.401 0.529 9 1 "[ . +1 . 2 . 3 . 4]"
1 140 ASP 7.007 0.529 9 1 "[ . +1 . 2 . 3 . 4]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 ALA MB 1 4 ALA H 4.310 . 4.310 2.635 1.813 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2 1 4 ALA H 1 4 ALA MB 3.510 . 3.510 2.464 2.223 2.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
3 1 4 ALA MB 1 5 SER H 4.890 . 4.890 3.050 1.912 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
4 1 4 ALA MB 1 6 TRP HD1 4.610 . 4.610 2.922 1.918 4.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
5 1 4 ALA MB 1 6 TRP HE1 4.920 . 4.920 4.084 2.682 4.949 0.029 18 0 "[ . 1 . 2 . 3 . 4]" 1
6 1 6 TRP H 1 6 TRP QB 3.680 . 3.680 2.671 2.053 3.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
7 1 6 TRP H 1 6 TRP HD1 4.910 . 4.910 3.535 2.144 4.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
8 1 6 TRP H 1 7 GLU H 4.520 . 4.520 3.651 2.046 4.560 0.040 13 0 "[ . 1 . 2 . 3 . 4]" 1
9 1 6 TRP HA 1 6 TRP HE3 4.470 . 4.470 3.846 2.449 4.478 0.008 3 0 "[ . 1 . 2 . 3 . 4]" 1
10 1 6 TRP QB 1 6 TRP HD1 3.600 . 3.600 2.621 2.517 2.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
11 1 6 TRP QB 1 6 TRP HE3 3.450 . 3.450 2.623 2.436 2.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
12 1 6 TRP QB 1 7 GLU H 3.630 . 3.630 2.743 1.675 3.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
13 1 6 TRP HD1 1 7 GLU H 5.500 . 5.500 4.622 3.461 5.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
14 1 6 TRP HE3 1 7 GLU H 4.790 . 4.790 2.691 1.614 4.222 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
15 1 6 TRP HE3 1 7 GLU HA 4.240 . 4.240 3.739 2.798 4.259 0.019 40 0 "[ . 1 . 2 . 3 . 4]" 1
16 1 6 TRP HE3 1 7 GLU QG 4.780 . 4.780 3.691 2.094 4.780 0.000 5 0 "[ . 1 . 2 . 3 . 4]" 1
17 1 6 TRP HZ3 1 7 GLU QG 4.960 . 4.960 4.046 2.654 4.992 0.032 6 0 "[ . 1 . 2 . 3 . 4]" 1
18 1 7 GLU H 1 7 GLU HB2 3.710 . 3.710 2.704 2.267 3.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
19 1 7 GLU H 1 7 GLU QB 3.060 . 3.060 2.308 2.137 2.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
20 1 7 GLU H 1 7 GLU HB3 3.710 . 3.710 2.709 2.399 3.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
21 1 7 GLU H 1 8 THR H 4.400 . 4.400 2.641 2.288 3.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
22 1 7 GLU H 1 8 THR MG 4.410 . 4.410 4.089 3.690 4.442 0.032 28 0 "[ . 1 . 2 . 3 . 4]" 1
23 1 7 GLU HA 1 8 THR MG 4.800 . 4.800 4.809 4.606 4.875 0.075 17 0 "[ . 1 . 2 . 3 . 4]" 1
24 1 7 GLU QB 1 8 THR H 4.110 . 4.110 2.760 2.126 3.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
25 1 7 GLU HB2 1 8 THR H 4.670 . 4.670 3.645 2.545 4.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
26 1 7 GLU HB3 1 8 THR H 4.670 . 4.670 3.096 2.141 4.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
27 1 7 GLU QG 1 8 THR H 4.890 . 4.890 3.499 2.380 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
28 1 7 GLU QG 1 8 THR MG 4.550 . 4.550 3.410 2.113 4.595 0.045 38 0 "[ . 1 . 2 . 3 . 4]" 1
29 1 8 THR H 1 8 THR MG 3.890 . 3.890 2.279 2.027 2.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
30 1 8 THR H 1 11 ASP QB 5.100 . 5.100 4.813 4.409 5.130 0.030 34 0 "[ . 1 . 2 . 3 . 4]" 1
31 1 8 THR HA 1 11 ASP QB 4.440 . 4.440 2.357 1.998 2.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
32 1 8 THR HB 1 11 ASP QB 4.770 . 4.770 3.235 2.332 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
33 1 10 MET HA 1 13 ARG H 3.930 . 3.930 3.431 3.185 3.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
34 1 10 MET HA 1 13 ARG QB 5.220 . 5.220 3.294 2.658 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
35 1 10 MET HA 1 13 ARG QG 4.260 . 4.260 3.094 2.236 3.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
36 1 10 MET QB 1 11 ASP H 3.700 . 3.700 2.547 2.340 2.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
37 1 10 MET QB 1 12 SER H 5.330 . 5.330 4.785 4.523 4.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
38 1 10 MET QB 1 14 LEU QD 4.500 . 4.500 3.453 2.924 3.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
39 1 10 MET QB 1 51 GLN QE 4.610 . 4.610 2.833 2.040 3.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
40 1 10 MET HB2 1 11 ASP H 4.260 . 4.260 3.841 3.705 3.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
41 1 10 MET HB3 1 11 ASP H 4.260 . 4.260 2.586 2.364 2.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
42 1 10 MET ME 1 10 MET HG2 3.950 . 3.950 2.261 2.083 2.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
43 1 10 MET ME 1 10 MET HG3 3.290 . 3.290 2.938 2.242 3.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
44 1 10 MET ME 1 13 ARG QD 4.650 . 4.650 4.219 3.642 4.690 0.040 17 0 "[ . 1 . 2 . 3 . 4]" 1
45 1 10 MET ME 1 14 LEU MD1 3.700 . 3.700 3.175 2.776 3.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
46 1 10 MET ME 1 14 LEU MD2 3.700 . 3.700 3.730 3.499 3.856 0.156 30 0 "[ . 1 . 2 . 3 . 4]" 1
47 1 10 MET ME 1 42 LEU QD 4.360 . 4.360 4.409 4.249 4.751 0.391 26 0 "[ . 1 . 2 . 3 . 4]" 1
48 1 10 MET ME 1 45 LEU H 5.170 . 5.170 4.941 4.709 5.147 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
49 1 10 MET ME 1 45 LEU HB3 3.360 . 3.360 2.094 1.920 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
50 1 10 MET ME 1 45 LEU MD1 3.190 . 3.190 3.051 2.735 3.316 0.126 10 0 "[ . 1 . 2 . 3 . 4]" 1
51 1 10 MET ME 1 45 LEU MD2 3.230 . 3.230 2.665 2.234 3.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
52 1 10 MET ME 1 46 GLN H 4.090 . 4.090 3.223 2.300 4.221 0.131 12 0 "[ . 1 . 2 . 3 . 4]" 1
53 1 10 MET ME 1 47 VAL H 4.280 . 4.280 3.322 2.886 3.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
54 1 10 MET ME 1 47 VAL HA 3.200 . 3.200 2.269 1.985 2.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
55 1 10 MET ME 1 47 VAL MG1 3.530 . 3.530 3.327 2.664 3.565 0.035 31 0 "[ . 1 . 2 . 3 . 4]" 1
56 1 10 MET ME 1 47 VAL QG 3.020 . 3.020 2.380 1.980 3.128 0.108 10 0 "[ . 1 . 2 . 3 . 4]" 1
57 1 10 MET ME 1 47 VAL MG2 3.530 . 3.530 2.491 2.032 3.554 0.024 27 0 "[ . 1 . 2 . 3 . 4]" 1
58 1 10 MET ME 1 48 THR H 4.310 . 4.310 3.769 3.297 4.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
59 1 10 MET ME 1 51 GLN HE21 3.950 . 3.950 2.876 2.091 3.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
60 1 10 MET ME 1 51 GLN QE 3.450 . 3.450 2.775 2.067 3.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
61 1 10 MET ME 1 51 GLN HE22 3.950 . 3.950 3.704 3.003 4.017 0.067 10 0 "[ . 1 . 2 . 3 . 4]" 1
62 1 10 MET HG2 1 14 LEU MD1 5.140 . 5.140 3.284 2.273 3.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
63 1 10 MET HG2 1 14 LEU QD 3.730 . 3.730 2.938 2.266 3.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
64 1 10 MET HG2 1 14 LEU MD2 5.140 . 5.140 3.968 2.875 5.188 0.048 34 0 "[ . 1 . 2 . 3 . 4]" 1
65 1 10 MET HG2 1 14 LEU HG 5.500 . 5.500 5.127 3.350 5.520 0.020 32 0 "[ . 1 . 2 . 3 . 4]" 1
66 1 10 MET HG2 1 45 LEU MD1 5.500 . 5.500 4.514 3.373 4.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
67 1 10 MET HG2 1 45 LEU MD2 5.500 . 5.500 4.911 4.314 5.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
68 1 10 MET HG2 1 47 VAL MG1 5.110 . 5.110 3.883 2.923 5.146 0.036 27 0 "[ . 1 . 2 . 3 . 4]" 1
69 1 10 MET HG2 1 47 VAL QG 4.080 . 4.080 3.305 2.678 3.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
70 1 10 MET HG2 1 47 VAL MG2 5.110 . 5.110 3.728 2.913 4.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
71 1 10 MET HG2 1 51 GLN HE21 4.270 . 4.270 2.237 1.730 3.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
72 1 10 MET HG2 1 51 GLN HE22 4.270 . 4.270 2.914 1.775 3.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
73 1 10 MET HG3 1 14 LEU MD1 4.400 . 4.400 2.404 2.080 3.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
74 1 10 MET HG3 1 14 LEU QD 3.370 . 3.370 2.180 1.911 3.413 0.043 17 0 "[ . 1 . 2 . 3 . 4]" 1
75 1 10 MET HG3 1 14 LEU MD2 4.400 . 4.400 3.151 1.963 4.457 0.057 33 0 "[ . 1 . 2 . 3 . 4]" 1
76 1 10 MET HG3 1 14 LEU HG 4.730 . 4.730 3.909 3.221 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
77 1 10 MET HG3 1 47 VAL QG 4.950 . 4.950 3.477 3.004 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
78 1 10 MET HG3 1 51 GLN HE21 4.850 . 4.850 3.753 2.958 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
79 1 10 MET HG3 1 51 GLN QE 4.240 . 4.240 3.340 2.646 4.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
80 1 10 MET HG3 1 51 GLN HE22 4.850 . 4.850 4.075 2.884 4.861 0.011 32 0 "[ . 1 . 2 . 3 . 4]" 1
81 1 11 ASP H 1 11 ASP QB 3.380 . 3.380 2.233 1.992 2.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
82 1 11 ASP H 1 12 SER H 3.710 . 3.710 2.766 2.559 2.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
83 1 11 ASP HA 1 14 LEU H 4.320 . 4.320 3.424 3.085 3.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
84 1 11 ASP HA 1 14 LEU HB2 4.600 . 4.600 2.585 2.291 2.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
85 1 11 ASP HA 1 14 LEU MD1 5.250 . 5.250 3.171 1.982 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
86 1 11 ASP HA 1 14 LEU QD 3.760 . 3.760 2.374 1.980 2.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
87 1 11 ASP HA 1 14 LEU MD2 5.250 . 5.250 3.641 2.070 4.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
88 1 11 ASP QB 1 12 SER H 3.490 . 3.490 2.555 2.333 3.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
89 1 11 ASP QB 1 12 SER HA 4.820 . 4.820 4.051 3.831 4.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
90 1 11 ASP QB 1 12 SER QB 4.680 . 4.680 4.280 3.742 4.713 0.033 2 0 "[ . 1 . 2 . 3 . 4]" 1
91 1 12 SER H 1 12 SER QB 3.200 . 3.200 2.381 2.159 2.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
92 1 12 SER H 1 13 ARG H 3.580 . 3.580 2.800 2.632 2.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
93 1 12 SER H 1 13 ARG QB 5.500 . 5.500 4.935 4.713 5.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
94 1 12 SER H 1 14 LEU H 4.600 . 4.600 4.243 4.044 4.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
95 1 12 SER HA 1 15 GLN HB2 3.830 . 3.830 2.725 2.464 2.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
96 1 12 SER HA 1 15 GLN HB3 4.470 . 4.470 4.337 4.058 4.478 0.008 20 0 "[ . 1 . 2 . 3 . 4]" 1
97 1 12 SER QB 1 13 ARG H 3.570 . 3.570 2.667 2.513 3.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
98 1 13 ARG H 1 13 ARG QB 3.230 . 3.230 2.497 2.387 2.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
99 1 13 ARG H 1 13 ARG QD 4.370 . 4.370 3.801 3.298 4.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
100 1 13 ARG H 1 13 ARG HG2 4.080 . 4.080 3.327 2.022 3.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
101 1 13 ARG H 1 13 ARG QG 3.540 . 3.540 2.266 1.930 2.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
102 1 13 ARG H 1 13 ARG HG3 4.080 . 4.080 2.478 1.953 3.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
103 1 13 ARG H 1 14 LEU H 3.560 . 3.560 2.563 2.469 2.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
104 1 13 ARG H 1 14 LEU HB2 4.650 . 4.650 4.546 4.391 4.660 0.010 17 0 "[ . 1 . 2 . 3 . 4]" 1
105 1 13 ARG H 1 45 LEU MD1 5.500 . 5.500 4.834 4.583 5.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
106 1 13 ARG H 1 45 LEU MD2 5.500 . 5.500 5.507 5.299 5.616 0.116 8 0 "[ . 1 . 2 . 3 . 4]" 1
107 1 13 ARG HA 1 13 ARG QD 5.040 . 5.040 4.108 3.861 4.445 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
108 1 13 ARG HA 1 13 ARG QG 3.650 . 3.650 2.586 2.367 3.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
109 1 13 ARG HA 1 16 ARG H 4.250 . 4.250 3.374 2.969 3.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
110 1 13 ARG HA 1 16 ARG QB 4.180 . 4.180 2.699 2.332 3.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
111 1 13 ARG HA 1 16 ARG QD 5.340 . 5.340 3.708 2.267 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
112 1 13 ARG HA 1 17 ILE H 5.500 . 5.500 3.990 3.750 4.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
113 1 13 ARG QB 1 14 LEU H 3.630 . 3.630 2.637 2.293 3.641 0.011 20 0 "[ . 1 . 2 . 3 . 4]" 1
114 1 13 ARG QB 1 14 LEU QD 4.810 . 4.810 3.292 2.408 4.874 0.064 3 0 "[ . 1 . 2 . 3 . 4]" 1
115 1 13 ARG QB 1 45 LEU MD1 3.990 . 3.990 2.472 2.154 3.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
116 1 13 ARG QB 1 45 LEU MD2 4.400 . 4.400 3.123 2.643 4.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
117 1 13 ARG QD 1 45 LEU MD1 3.840 . 3.840 2.970 2.375 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
118 1 13 ARG QD 1 45 LEU MD2 3.470 . 3.470 2.191 1.888 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
119 1 13 ARG QG 1 45 LEU MD1 4.320 . 4.320 3.774 2.169 4.337 0.017 5 0 "[ . 1 . 2 . 3 . 4]" 1
120 1 13 ARG QG 1 45 LEU MD2 4.270 . 4.270 3.737 2.692 4.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
121 1 14 LEU H 1 14 LEU HB2 3.730 . 3.730 2.290 2.164 2.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
122 1 14 LEU H 1 14 LEU HB3 3.760 . 3.760 3.553 3.490 3.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
123 1 14 LEU H 1 14 LEU MD1 4.170 . 4.170 2.779 2.264 3.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
124 1 14 LEU H 1 14 LEU QD 3.580 . 3.580 2.674 2.228 3.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
125 1 14 LEU H 1 14 LEU MD2 4.170 . 4.170 3.545 2.964 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
126 1 14 LEU H 1 14 LEU HG 4.300 . 4.300 3.335 2.249 4.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
127 1 14 LEU H 1 15 GLN H 3.490 . 3.490 2.706 2.563 2.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
128 1 14 LEU H 1 15 GLN HB2 4.870 . 4.870 4.746 4.551 4.874 0.004 1 0 "[ . 1 . 2 . 3 . 4]" 1
129 1 14 LEU H 1 45 LEU MD1 4.670 . 4.670 3.853 3.535 4.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
130 1 14 LEU H 1 55 HIS HE1 5.120 . 5.120 5.002 4.737 5.133 0.013 7 0 "[ . 1 . 2 . 3 . 4]" 1
131 1 14 LEU HA 1 14 LEU MD1 3.890 . 3.890 2.977 2.014 3.891 0.001 30 0 "[ . 1 . 2 . 3 . 4]" 1
132 1 14 LEU HA 1 14 LEU QD 2.870 . 2.870 2.147 2.006 2.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
133 1 14 LEU HA 1 14 LEU MD2 3.890 . 3.890 3.034 2.121 3.892 0.002 19 0 "[ . 1 . 2 . 3 . 4]" 1
134 1 14 LEU HA 1 14 LEU HG 4.180 . 4.180 2.794 2.537 3.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
135 1 14 LEU HA 1 17 ILE H 4.260 . 4.260 3.432 3.201 3.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
136 1 14 LEU HA 1 17 ILE HB 3.930 . 3.930 2.659 2.427 2.879 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
137 1 14 LEU HA 1 17 ILE MD 4.390 . 4.390 2.507 2.096 3.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
138 1 14 LEU HA 1 18 HIS H 4.710 . 4.710 3.931 3.830 4.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
139 1 14 LEU HA 1 42 LEU QD 4.250 . 4.250 3.533 3.202 4.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
140 1 14 LEU HA 1 45 LEU MD1 4.730 . 4.730 3.505 3.123 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
141 1 14 LEU HA 1 58 MET ME 4.180 . 4.180 3.566 3.060 4.183 0.003 40 0 "[ . 1 . 2 . 3 . 4]" 1
142 1 14 LEU HB2 1 14 LEU MD1 3.580 . 3.580 2.500 2.174 2.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
143 1 14 LEU HB2 1 14 LEU QD 3.030 . 3.030 2.130 2.060 2.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
144 1 14 LEU HB2 1 14 LEU MD2 3.580 . 3.580 2.658 2.113 3.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
145 1 14 LEU HB2 1 15 GLN H 4.000 . 4.000 2.737 2.652 2.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
146 1 14 LEU HB2 1 58 MET ME 4.580 . 4.580 4.238 4.043 4.590 0.010 3 0 "[ . 1 . 2 . 3 . 4]" 1
147 1 14 LEU HB3 1 14 LEU QD 3.100 . 3.100 2.343 2.128 2.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
148 1 14 LEU HB3 1 15 GLN H 4.220 . 4.220 3.476 3.214 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
149 1 14 LEU HB3 1 55 HIS HE1 5.250 . 5.250 3.874 3.371 4.348 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
150 1 14 LEU HB3 1 58 MET ME 3.570 . 3.570 2.887 2.556 3.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
151 1 14 LEU QD 1 17 ILE H 5.390 . 5.390 4.818 4.621 5.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
152 1 14 LEU QD 1 17 ILE HB 4.300 . 4.300 3.749 3.356 4.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
153 1 14 LEU QD 1 17 ILE HG13 5.250 . 5.250 4.783 4.347 5.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
154 1 14 LEU QD 1 42 LEU HA 4.380 . 4.380 3.897 3.603 4.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
155 1 14 LEU QD 1 42 LEU QD 2.710 . 2.710 2.217 1.900 2.761 0.051 13 0 "[ . 1 . 2 . 3 . 4]" 1
156 1 14 LEU QD 1 45 LEU HB2 5.020 . 5.020 3.533 3.301 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
157 1 14 LEU QD 1 45 LEU MD1 2.730 . 2.730 2.095 1.954 2.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
158 1 14 LEU QD 1 47 VAL HA 5.440 . 5.440 3.673 3.371 3.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
159 1 14 LEU QD 1 47 VAL QG 2.640 . 2.640 1.818 1.745 2.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
160 1 14 LEU QD 1 51 GLN HA 5.280 . 5.280 4.608 4.143 5.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
161 1 14 LEU QD 1 51 GLN HB2 4.900 . 4.900 3.628 3.296 3.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
162 1 14 LEU QD 1 51 GLN HB3 3.800 . 3.800 2.833 2.512 3.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
163 1 14 LEU QD 1 51 GLN QE 4.730 . 4.730 3.318 2.454 4.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
164 1 14 LEU QD 1 51 GLN QG 4.930 . 4.930 4.031 3.719 4.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
165 1 14 LEU QD 1 52 ALA HA 4.780 . 4.780 4.000 3.596 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
166 1 14 LEU QD 1 52 ALA MB 4.780 . 4.780 4.440 4.156 4.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
167 1 14 LEU QD 1 55 HIS H 5.290 . 5.290 4.785 4.298 5.297 0.007 40 0 "[ . 1 . 2 . 3 . 4]" 1
168 1 14 LEU QD 1 55 HIS HB2 4.060 . 4.060 3.477 3.019 3.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
169 1 14 LEU QD 1 55 HIS HB3 5.060 . 5.060 3.943 3.583 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
170 1 14 LEU QD 1 55 HIS HD2 3.610 . 3.610 2.495 2.213 3.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
171 1 14 LEU QD 1 55 HIS HE1 4.750 . 4.750 3.913 3.555 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
172 1 14 LEU QD 1 58 MET ME 2.900 . 2.900 2.319 1.865 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
173 1 14 LEU QD 1 85 PHE HZ 4.260 . 4.260 3.627 2.712 4.331 0.071 12 0 "[ . 1 . 2 . 3 . 4]" 1
174 1 14 LEU MD1 1 15 GLN H 4.840 . 4.840 4.395 4.271 4.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
175 1 14 LEU MD1 1 45 LEU MD1 4.100 . 4.100 2.596 1.960 3.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
176 1 14 LEU MD1 1 47 VAL HB 4.550 . 4.550 4.054 2.314 4.580 0.030 34 0 "[ . 1 . 2 . 3 . 4]" 1
177 1 14 LEU MD1 1 47 VAL MG1 3.410 . 3.410 2.786 2.185 3.490 0.080 14 0 "[ . 1 . 2 . 3 . 4]" 1
178 1 14 LEU MD1 1 47 VAL MG2 3.410 . 3.410 2.313 1.970 3.210 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
179 1 14 LEU MD1 1 55 HIS HB2 5.500 . 5.500 4.752 3.783 5.535 0.035 31 0 "[ . 1 . 2 . 3 . 4]" 1
180 1 14 LEU MD1 1 58 MET ME 3.370 . 3.370 3.195 2.436 3.517 0.147 6 0 "[ . 1 . 2 . 3 . 4]" 1
181 1 14 LEU MD1 1 85 PHE QE 5.290 . 5.290 4.852 4.348 5.293 0.003 28 0 "[ . 1 . 2 . 3 . 4]" 1
182 1 14 LEU MD1 1 85 PHE HZ 5.500 . 5.500 4.607 3.804 5.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
183 1 14 LEU MD2 1 15 GLN H 4.840 . 4.840 4.651 4.362 4.879 0.039 14 0 "[ . 1 . 2 . 3 . 4]" 1
184 1 14 LEU MD2 1 45 LEU MD1 4.100 . 4.100 3.062 2.113 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
185 1 14 LEU MD2 1 47 VAL HB 4.550 . 4.550 3.922 2.419 4.564 0.014 21 0 "[ . 1 . 2 . 3 . 4]" 1
186 1 14 LEU MD2 1 47 VAL MG1 3.410 . 3.410 2.606 2.078 3.610 0.200 32 0 "[ . 1 . 2 . 3 . 4]" 1
187 1 14 LEU MD2 1 47 VAL MG2 3.410 . 3.410 2.253 1.912 2.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
188 1 14 LEU MD2 1 55 HIS HB2 5.500 . 5.500 3.750 3.033 4.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
189 1 14 LEU MD2 1 58 MET ME 3.370 . 3.370 2.620 1.872 3.465 0.095 11 0 "[ . 1 . 2 . 3 . 4]" 1
190 1 14 LEU MD2 1 85 PHE QE 5.290 . 5.290 4.301 3.583 5.053 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
191 1 14 LEU MD2 1 85 PHE HZ 5.500 . 5.500 4.019 2.736 5.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
192 1 14 LEU HG 1 15 GLN H 5.390 . 5.390 4.901 4.457 5.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
193 1 14 LEU HG 1 42 LEU MD1 4.730 . 4.730 4.087 2.889 4.804 0.074 33 0 "[ . 1 . 2 . 3 . 4]" 1
194 1 14 LEU HG 1 42 LEU QD 3.730 . 3.730 3.493 2.847 3.964 0.234 30 0 "[ . 1 . 2 . 3 . 4]" 1
195 1 14 LEU HG 1 42 LEU MD2 4.730 . 4.730 4.203 3.341 4.827 0.097 6 0 "[ . 1 . 2 . 3 . 4]" 1
196 1 14 LEU HG 1 45 LEU MD1 4.590 . 4.590 3.253 2.197 4.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
197 1 15 GLN H 1 15 GLN HB2 3.560 . 3.560 2.353 2.268 2.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
198 1 15 GLN H 1 15 GLN HB3 3.590 . 3.590 3.583 3.552 3.595 0.005 30 0 "[ . 1 . 2 . 3 . 4]" 1
199 1 15 GLN H 1 15 GLN HG2 4.040 . 4.040 3.507 2.336 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
200 1 15 GLN H 1 15 GLN QG 3.380 . 3.380 2.532 2.309 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
201 1 15 GLN H 1 15 GLN HG3 4.040 . 4.040 2.785 2.417 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
202 1 15 GLN H 1 16 ARG H 3.470 . 3.470 2.715 2.591 2.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
203 1 15 GLN H 1 17 ILE H 4.670 . 4.670 4.219 4.141 4.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
204 1 15 GLN H 1 55 HIS HE1 4.220 . 4.220 3.642 3.133 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
205 1 15 GLN HA 1 15 GLN HG2 3.910 . 3.910 2.552 2.348 3.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
206 1 15 GLN HA 1 15 GLN QG 3.380 . 3.380 2.441 2.291 2.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
207 1 15 GLN HA 1 15 GLN HG3 3.910 . 3.910 3.131 2.845 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
208 1 15 GLN HA 1 18 HIS HB3 4.240 . 4.240 2.796 2.295 3.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
209 1 15 GLN HA 1 19 ALA H 5.500 . 5.500 4.146 3.667 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
210 1 15 GLN HA 1 19 ALA MB 5.400 . 5.400 4.774 4.477 5.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
211 1 15 GLN HA 1 55 HIS HE1 5.500 . 5.500 4.302 3.379 4.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
212 1 15 GLN HA 1 58 MET ME 5.500 . 5.500 5.513 5.480 5.531 0.031 31 0 "[ . 1 . 2 . 3 . 4]" 1
213 1 15 GLN HB2 1 16 ARG H 3.860 . 3.860 2.605 2.378 2.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
214 1 15 GLN HB3 1 16 ARG H 3.750 . 3.750 3.417 3.278 3.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
215 1 15 GLN HB3 1 17 ILE H 5.500 . 5.500 5.510 5.502 5.519 0.019 21 0 "[ . 1 . 2 . 3 . 4]" 1
216 1 15 GLN QG 1 55 HIS HE1 3.680 . 3.680 2.251 1.843 2.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
217 1 15 GLN HG2 1 16 ARG H 5.120 . 5.120 4.962 4.405 5.123 0.003 34 0 "[ . 1 . 2 . 3 . 4]" 1
218 1 15 GLN HG2 1 55 HIS HE1 4.400 . 4.400 3.134 1.886 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
219 1 15 GLN HG3 1 16 ARG H 5.120 . 5.120 4.632 4.351 5.133 0.013 24 0 "[ . 1 . 2 . 3 . 4]" 1
220 1 15 GLN HG3 1 55 HIS HE1 4.400 . 4.400 2.530 1.859 4.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
221 1 16 ARG H 1 16 ARG HB2 3.610 . 3.610 2.496 2.163 2.696 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
222 1 16 ARG H 1 16 ARG QB 3.100 . 3.100 2.273 2.142 2.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
223 1 16 ARG H 1 16 ARG HB3 3.610 . 3.610 2.703 2.425 3.611 0.001 25 0 "[ . 1 . 2 . 3 . 4]" 1
224 1 16 ARG H 1 16 ARG QD 4.920 . 4.920 4.459 2.621 4.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
225 1 16 ARG H 1 16 ARG HG2 4.720 . 4.720 4.446 3.782 4.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
226 1 16 ARG H 1 16 ARG QG 4.110 . 4.110 3.892 2.363 4.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
227 1 16 ARG H 1 16 ARG HG3 4.720 . 4.720 4.344 2.388 4.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
228 1 16 ARG H 1 17 ILE H 3.570 . 3.570 2.714 2.619 2.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
229 1 16 ARG H 1 19 ALA MB 5.350 . 5.350 4.937 4.769 5.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
230 1 16 ARG HA 1 16 ARG HG2 3.870 . 3.870 2.905 2.413 3.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
231 1 16 ARG HA 1 16 ARG QG 3.390 . 3.390 2.433 2.254 2.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
232 1 16 ARG HA 1 16 ARG HG3 3.870 . 3.870 2.682 2.278 3.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
233 1 16 ARG HA 1 19 ALA H 4.150 . 4.150 3.515 3.362 3.724 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
234 1 16 ARG HA 1 19 ALA MB 3.220 . 3.220 2.821 2.592 3.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
235 1 16 ARG QB 1 17 ILE H 3.640 . 3.640 2.471 2.331 2.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
236 1 16 ARG QB 1 19 ALA MB 5.130 . 5.130 4.525 4.242 4.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
237 1 16 ARG HB2 1 17 ILE H 4.220 . 4.220 3.686 2.574 3.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
238 1 16 ARG HB3 1 17 ILE H 4.220 . 4.220 2.573 2.357 3.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
239 1 16 ARG QG 1 17 ILE H 4.870 . 4.870 3.751 3.203 4.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
240 1 17 ILE H 1 17 ILE HB 3.490 . 3.490 2.426 2.348 2.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
241 1 17 ILE H 1 17 ILE MD 3.730 . 3.730 3.385 3.239 3.556 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
242 1 17 ILE H 1 17 ILE HG12 4.000 . 4.000 3.704 3.615 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
243 1 17 ILE H 1 17 ILE HG13 3.650 . 3.650 2.302 2.177 2.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
244 1 17 ILE H 1 17 ILE MG 4.000 . 4.000 3.782 3.754 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
245 1 17 ILE HA 1 17 ILE MD 4.020 . 4.020 3.865 3.819 3.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
246 1 17 ILE HA 1 17 ILE HG12 4.030 . 4.030 2.615 2.481 2.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
247 1 17 ILE HA 1 17 ILE HG13 3.980 . 3.980 2.729 2.683 2.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
248 1 17 ILE HA 1 17 ILE MG 3.240 . 3.240 2.493 2.416 2.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
249 1 17 ILE HA 1 20 GLU H 4.130 . 4.130 3.325 3.105 3.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
250 1 17 ILE HA 1 20 GLU HB2 4.490 . 4.490 2.562 2.382 2.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
251 1 17 ILE HA 1 20 GLU QB 3.860 . 3.860 2.540 2.364 2.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
252 1 17 ILE HA 1 20 GLU HB3 4.490 . 4.490 4.196 3.999 4.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
253 1 17 ILE HA 1 20 GLU HG2 4.450 . 4.450 3.641 2.821 4.196 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
254 1 17 ILE HA 1 20 GLU HG3 4.270 . 4.270 3.359 2.639 3.916 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
255 1 17 ILE HA 1 38 ALA MB 3.820 . 3.820 2.995 2.743 3.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
256 1 17 ILE HB 1 17 ILE MD 3.090 . 3.090 2.287 2.179 2.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
257 1 17 ILE HB 1 18 HIS H 3.680 . 3.680 2.663 2.534 2.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
258 1 17 ILE MD 1 17 ILE MG 2.840 . 2.840 2.170 2.106 2.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
259 1 17 ILE MD 1 18 HIS H 4.840 . 4.840 4.515 4.275 4.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
260 1 17 ILE MD 1 38 ALA HA 4.700 . 4.700 4.331 3.978 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
261 1 17 ILE MD 1 41 GLU H 4.810 . 4.810 4.635 4.365 4.842 0.032 31 0 "[ . 1 . 2 . 3 . 4]" 1
262 1 17 ILE MD 1 41 GLU QB 3.950 . 3.950 2.802 2.382 3.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
263 1 17 ILE MD 1 41 GLU HG2 3.820 . 3.820 2.499 2.193 2.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
264 1 17 ILE MD 1 41 GLU QG 3.070 . 3.070 2.259 1.942 2.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
265 1 17 ILE MD 1 41 GLU HG3 3.820 . 3.820 2.938 2.034 3.851 0.031 7 0 "[ . 1 . 2 . 3 . 4]" 1
266 1 17 ILE MD 1 42 LEU H 3.930 . 3.930 2.952 2.741 3.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
267 1 17 ILE MD 1 42 LEU HA 3.370 . 3.370 2.609 2.475 2.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
268 1 17 ILE MD 1 42 LEU HB2 4.290 . 4.290 2.554 2.169 2.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
269 1 17 ILE MD 1 42 LEU HB3 4.540 . 4.540 3.915 3.662 4.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
270 1 17 ILE MD 1 42 LEU HG 4.750 . 4.750 3.241 2.114 4.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
271 1 17 ILE HG12 1 17 ILE MG 3.730 . 3.730 2.309 2.245 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
272 1 17 ILE HG12 1 38 ALA MB 4.660 . 4.660 3.409 3.164 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
273 1 17 ILE HG12 1 41 GLU H 5.500 . 5.500 5.171 4.717 5.502 0.002 28 0 "[ . 1 . 2 . 3 . 4]" 1
274 1 17 ILE HG12 1 41 GLU QG 4.720 . 4.720 3.461 2.414 4.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
275 1 17 ILE HG12 1 42 LEU H 5.000 . 5.000 4.252 3.939 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
276 1 17 ILE MG 1 18 HIS H 3.980 . 3.980 3.314 3.178 3.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
277 1 17 ILE MG 1 20 GLU HG3 5.470 . 5.470 4.991 4.409 5.481 0.011 30 0 "[ . 1 . 2 . 3 . 4]" 1
278 1 17 ILE MG 1 21 ILE H 4.090 . 4.090 3.890 3.765 4.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
279 1 17 ILE MG 1 38 ALA HA 3.950 . 3.950 3.297 3.042 3.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
280 1 17 ILE MG 1 38 ALA MB 3.010 . 3.010 2.108 2.035 2.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
281 1 17 ILE MG 1 41 GLU QG 5.340 . 5.340 4.422 3.631 5.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
282 1 17 ILE MG 1 42 LEU H 3.830 . 3.830 3.503 3.234 3.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
283 1 17 ILE MG 1 42 LEU HA 4.060 . 4.060 3.980 3.799 4.113 0.053 30 0 "[ . 1 . 2 . 3 . 4]" 1
284 1 17 ILE MG 1 42 LEU HB2 3.880 . 3.880 2.271 2.006 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
285 1 17 ILE MG 1 42 LEU HB3 3.930 . 3.930 3.674 3.359 3.941 0.011 23 0 "[ . 1 . 2 . 3 . 4]" 1
286 1 18 HIS H 1 18 HIS HB2 3.570 . 3.570 2.453 2.361 2.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
287 1 18 HIS H 1 18 HIS HB3 3.600 . 3.600 2.545 2.399 2.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
288 1 18 HIS H 1 19 ALA H 3.500 . 3.500 2.795 2.746 2.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
289 1 18 HIS H 1 19 ALA MB 4.470 . 4.470 4.462 4.422 4.490 0.020 6 0 "[ . 1 . 2 . 3 . 4]" 1
290 1 18 HIS HA 1 18 HIS HD2 4.340 . 4.340 2.400 2.214 2.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
291 1 18 HIS HA 1 19 ALA MB 5.500 . 5.500 5.048 5.030 5.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
292 1 18 HIS HA 1 20 GLU H 4.820 . 4.820 4.596 4.480 4.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
293 1 18 HIS HA 1 21 ILE MD 3.500 . 3.500 2.732 2.416 2.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
294 1 18 HIS HA 1 21 ILE MG 4.900 . 4.900 4.506 4.264 4.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
295 1 18 HIS HA 1 58 MET ME 5.500 . 5.500 5.028 4.822 5.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
296 1 18 HIS HA 1 61 THR MG 4.920 . 4.920 3.898 3.606 4.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
297 1 18 HIS HB2 1 19 ALA H 4.120 . 4.120 3.822 3.767 3.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
298 1 18 HIS HB2 1 58 MET QB 4.960 . 4.960 2.555 2.305 3.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
299 1 18 HIS HB2 1 58 MET ME 4.210 . 4.210 4.079 3.895 4.223 0.013 36 0 "[ . 1 . 2 . 3 . 4]" 1
300 1 18 HIS HB2 1 58 MET HG2 5.200 . 5.200 4.267 4.101 4.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
301 1 18 HIS HB2 1 58 MET QG 4.340 . 4.340 2.804 2.562 3.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
302 1 18 HIS HB2 1 58 MET HG3 5.200 . 5.200 2.844 2.588 3.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
303 1 18 HIS HB3 1 19 ALA H 3.630 . 3.630 2.493 2.416 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
304 1 18 HIS HB3 1 19 ALA MB 4.370 . 4.370 3.833 3.730 3.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
305 1 18 HIS HD2 1 21 ILE H 5.500 . 5.500 5.298 4.883 5.510 0.010 12 0 "[ . 1 . 2 . 3 . 4]" 1
306 1 18 HIS HD2 1 21 ILE HB 4.570 . 4.570 3.793 3.227 4.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
307 1 18 HIS HD2 1 21 ILE MD 4.300 . 4.300 3.841 3.426 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
308 1 18 HIS HD2 1 22 LYS H 5.040 . 5.040 4.537 4.058 4.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
309 1 18 HIS HD2 1 58 MET ME 5.500 . 5.500 5.530 5.507 5.551 0.051 18 0 "[ . 1 . 2 . 3 . 4]" 1
310 1 18 HIS HD2 1 58 MET QG 4.480 . 4.480 2.705 2.592 2.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
311 1 18 HIS HD2 1 61 THR MG 3.340 . 3.340 2.553 2.322 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
312 1 18 HIS HE1 1 22 LYS QD 4.910 . 4.910 4.339 3.151 4.921 0.011 2 0 "[ . 1 . 2 . 3 . 4]" 1
313 1 18 HIS HE1 1 22 LYS QE 4.950 . 4.950 3.642 2.955 4.950 0.000 27 0 "[ . 1 . 2 . 3 . 4]" 1
314 1 18 HIS HE1 1 57 GLU HA 5.500 . 5.500 4.639 4.124 5.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
315 1 18 HIS HE1 1 57 GLU QB 3.370 . 3.370 2.280 1.980 2.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
316 1 18 HIS HE1 1 57 GLU QG 4.170 . 4.170 3.586 2.142 4.179 0.009 29 0 "[ . 1 . 2 . 3 . 4]" 1
317 1 19 ALA H 1 19 ALA MB 2.800 . 2.800 2.230 2.214 2.251 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
318 1 19 ALA H 1 20 GLU H 3.500 . 3.500 2.683 2.635 2.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
319 1 19 ALA H 1 21 ILE H 4.660 . 4.660 4.297 4.220 4.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
320 1 19 ALA HA 1 22 LYS H 4.260 . 4.260 3.519 3.343 3.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
321 1 19 ALA HA 1 22 LYS HB2 4.670 . 4.670 2.889 2.370 2.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
322 1 19 ALA HA 1 22 LYS QB 3.860 . 3.860 2.859 2.352 2.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
323 1 19 ALA HA 1 22 LYS HB3 4.670 . 4.670 4.571 3.941 4.680 0.010 15 0 "[ . 1 . 2 . 3 . 4]" 1
324 1 19 ALA HA 1 22 LYS QE 4.630 . 4.630 4.205 3.021 4.726 0.096 21 0 "[ . 1 . 2 . 3 . 4]" 1
325 1 19 ALA HA 1 23 ASN H 4.490 . 4.490 3.978 3.814 4.210 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
326 1 19 ALA MB 1 20 GLU H 3.200 . 3.200 2.577 2.509 2.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
327 1 19 ALA MB 1 20 GLU HA 4.260 . 4.260 3.851 3.761 3.916 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
328 1 19 ALA MB 1 20 GLU HG2 4.170 . 4.170 3.504 3.305 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
329 1 19 ALA MB 1 21 ILE H 4.850 . 4.850 4.635 4.581 4.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
330 1 19 ALA MB 1 22 LYS H 4.820 . 4.820 4.702 4.549 4.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
331 1 19 ALA MB 1 23 ASN H 4.560 . 4.560 4.439 4.333 4.565 0.005 24 0 "[ . 1 . 2 . 3 . 4]" 1
332 1 19 ALA MB 1 23 ASN HD21 3.970 . 3.970 3.442 2.704 4.035 0.065 35 0 "[ . 1 . 2 . 3 . 4]" 1
333 1 19 ALA MB 1 23 ASN HD22 3.970 . 3.970 3.006 2.700 3.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
334 1 20 GLU H 1 20 GLU HB2 3.850 . 3.850 2.445 2.339 2.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
335 1 20 GLU H 1 20 GLU QB 3.350 . 3.350 2.408 2.311 2.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
336 1 20 GLU H 1 20 GLU HB3 3.850 . 3.850 3.622 3.584 3.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
337 1 20 GLU H 1 20 GLU HG2 3.290 . 3.290 2.453 2.260 2.734 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
338 1 20 GLU H 1 20 GLU HG3 3.960 . 3.960 3.627 2.905 3.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
339 1 20 GLU H 1 21 ILE H 3.660 . 3.660 2.760 2.695 2.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
340 1 20 GLU HA 1 23 ASN H 4.180 . 4.180 3.519 3.289 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
341 1 20 GLU HA 1 23 ASN QB 4.560 . 4.560 3.210 2.396 4.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
342 1 20 GLU QB 1 21 ILE H 3.930 . 3.930 2.557 2.429 2.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
343 1 20 GLU QB 1 21 ILE HA 4.780 . 4.780 3.846 3.764 3.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
344 1 20 GLU HB2 1 38 ALA MB 3.380 . 3.380 2.642 2.376 2.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
345 1 20 GLU HB3 1 38 ALA MB 3.380 . 3.380 2.765 2.566 3.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
346 1 20 GLU HG2 1 21 ILE H 4.960 . 4.960 4.522 4.287 4.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
347 1 20 GLU HG2 1 38 ALA MB 4.640 . 4.640 4.582 4.101 4.684 0.044 6 0 "[ . 1 . 2 . 3 . 4]" 1
348 1 20 GLU HG3 1 38 ALA MB 3.840 . 3.840 3.713 3.404 3.858 0.018 12 0 "[ . 1 . 2 . 3 . 4]" 1
349 1 21 ILE H 1 21 ILE HB 3.630 . 3.630 2.484 2.450 2.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
350 1 21 ILE H 1 21 ILE MD 3.640 . 3.640 3.460 3.375 3.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
351 1 21 ILE H 1 21 ILE HG12 4.280 . 4.280 3.644 3.564 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
352 1 21 ILE H 1 21 ILE QG 3.610 . 3.610 2.238 2.150 2.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
353 1 21 ILE H 1 21 ILE HG13 4.280 . 4.280 2.258 2.167 2.323 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
354 1 21 ILE H 1 21 ILE MG 3.780 . 3.780 3.796 3.786 3.807 0.027 16 0 "[ . 1 . 2 . 3 . 4]" 1
355 1 21 ILE H 1 22 LYS H 3.740 . 3.740 2.762 2.672 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
356 1 21 ILE H 1 23 ASN H 4.670 . 4.670 4.241 4.062 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
357 1 21 ILE H 1 38 ALA MB 3.890 . 3.890 3.403 3.262 3.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
358 1 21 ILE HA 1 21 ILE MD 3.930 . 3.930 3.911 3.893 3.930 0.000 40 0 "[ . 1 . 2 . 3 . 4]" 1
359 1 21 ILE HA 1 21 ILE HG12 3.980 . 3.980 2.620 2.552 2.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
360 1 21 ILE HA 1 21 ILE QG 3.390 . 3.390 2.413 2.376 2.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
361 1 21 ILE HA 1 21 ILE HG13 3.980 . 3.980 2.825 2.773 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
362 1 21 ILE HA 1 21 ILE MG 3.260 . 3.260 2.472 2.441 2.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
363 1 21 ILE HA 1 24 SER H 4.550 . 4.550 3.682 3.387 3.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
364 1 21 ILE HA 1 35 CYS HA 4.160 . 4.160 3.081 2.923 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
365 1 21 ILE HA 1 35 CYS HG 4.340 . 4.340 4.223 2.915 4.344 0.004 23 0 "[ . 1 . 2 . 3 . 4]" 1
366 1 21 ILE HA 1 38 ALA MB 4.130 . 4.130 3.404 3.215 3.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
367 1 21 ILE HB 1 21 ILE MD 3.530 . 3.530 2.374 2.351 2.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
368 1 21 ILE HB 1 22 LYS H 3.380 . 3.380 2.582 2.481 2.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
369 1 21 ILE HB 1 61 THR MG 3.760 . 3.760 2.997 2.729 3.228 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
370 1 21 ILE MD 1 22 LYS H 4.820 . 4.820 4.509 4.394 4.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
371 1 21 ILE MD 1 35 CYS HG 4.280 . 4.280 4.188 3.732 4.289 0.009 26 0 "[ . 1 . 2 . 3 . 4]" 1
372 1 21 ILE MD 1 38 ALA MB 3.300 . 3.300 2.972 2.792 3.161 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
373 1 21 ILE MD 1 39 LEU H 4.530 . 4.530 4.252 4.041 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
374 1 21 ILE MD 1 39 LEU HA 3.950 . 3.950 3.331 3.072 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
375 1 21 ILE MD 1 42 LEU QD 3.520 . 3.520 2.938 2.655 3.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
376 1 21 ILE MD 1 61 THR MG 3.880 . 3.880 3.185 2.738 3.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
377 1 21 ILE MD 1 81 LEU QD 4.450 . 4.450 3.774 3.524 4.008 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
378 1 21 ILE QG 1 22 LYS H 5.340 . 5.340 4.145 4.087 4.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
379 1 21 ILE QG 1 38 ALA H 5.340 . 5.340 4.635 4.466 4.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
380 1 21 ILE QG 1 38 ALA MB 3.150 . 3.150 2.105 2.047 2.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
381 1 21 ILE QG 1 39 LEU H 4.040 . 4.040 3.976 3.832 4.051 0.011 20 0 "[ . 1 . 2 . 3 . 4]" 1
382 1 21 ILE MG 1 22 LYS H 3.750 . 3.750 3.304 3.188 3.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
383 1 21 ILE MG 1 22 LYS QG 4.500 . 4.500 3.300 2.942 3.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
384 1 21 ILE MG 1 25 LEU H 4.700 . 4.700 4.452 4.119 4.712 0.012 28 0 "[ . 1 . 2 . 3 . 4]" 1
385 1 21 ILE MG 1 25 LEU QD 3.130 . 3.130 2.413 2.110 2.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
386 1 21 ILE MG 1 25 LEU HG 4.850 . 4.850 3.852 3.156 4.897 0.047 32 0 "[ . 1 . 2 . 3 . 4]" 1
387 1 21 ILE MG 1 35 CYS HA 4.510 . 4.510 4.030 3.800 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
388 1 21 ILE MG 1 38 ALA MB 3.870 . 3.870 4.012 3.940 4.068 0.198 30 0 "[ . 1 . 2 . 3 . 4]" 1
389 1 21 ILE MG 1 61 THR MG 2.800 . 2.800 2.340 2.186 2.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
390 1 21 ILE MG 1 62 LEU HA 4.990 . 4.990 4.345 4.061 4.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
391 1 22 LYS H 1 22 LYS HB2 3.870 . 3.870 2.420 2.276 2.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
392 1 22 LYS H 1 22 LYS QB 3.340 . 3.340 2.385 2.251 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
393 1 22 LYS H 1 22 LYS HB3 3.870 . 3.870 3.614 3.556 3.639 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
394 1 22 LYS H 1 22 LYS HD2 5.500 . 5.500 4.809 4.191 5.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
395 1 22 LYS H 1 22 LYS QD 4.690 . 4.690 4.259 3.741 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
396 1 22 LYS H 1 22 LYS HD3 5.500 . 5.500 4.801 3.951 5.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
397 1 22 LYS H 1 22 LYS HG2 4.080 . 4.080 3.116 2.448 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
398 1 22 LYS H 1 22 LYS QG 3.340 . 3.340 2.502 2.357 2.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
399 1 22 LYS H 1 22 LYS HG3 4.080 . 4.080 2.779 2.387 3.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
400 1 22 LYS H 1 23 ASN H 3.560 . 3.560 2.739 2.631 2.853 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
401 1 22 LYS H 1 24 SER H 4.760 . 4.760 4.191 4.020 4.302 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
402 1 22 LYS H 1 61 THR MG 4.230 . 4.230 3.896 3.700 4.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
403 1 22 LYS HA 1 22 LYS QD 4.510 . 4.510 3.457 2.274 4.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
404 1 22 LYS HA 1 22 LYS HG2 4.050 . 4.050 2.369 2.185 2.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
405 1 22 LYS HA 1 22 LYS QG 3.500 . 3.500 2.317 2.158 2.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
406 1 22 LYS HA 1 22 LYS HG3 4.050 . 4.050 3.366 2.846 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
407 1 22 LYS HA 1 25 LEU H 4.550 . 4.550 3.646 3.422 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
408 1 22 LYS HA 1 25 LEU QD 4.460 . 4.460 4.136 3.659 4.468 0.008 14 0 "[ . 1 . 2 . 3 . 4]" 1
409 1 22 LYS HA 1 61 THR MG 4.280 . 4.280 3.894 3.517 4.288 0.008 33 0 "[ . 1 . 2 . 3 . 4]" 1
410 1 22 LYS HA 1 65 ILE MG 5.060 . 5.060 4.859 4.608 5.101 0.041 14 0 "[ . 1 . 2 . 3 . 4]" 1
411 1 22 LYS QB 1 22 LYS QE 3.670 . 3.670 2.387 2.005 3.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
412 1 22 LYS QB 1 23 ASN H 3.500 . 3.500 2.716 2.498 2.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
413 1 22 LYS HB2 1 22 LYS HE2 4.930 . 4.930 3.741 3.037 4.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
414 1 22 LYS HB2 1 22 LYS HE3 4.930 . 4.930 3.155 2.440 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
415 1 22 LYS HB2 1 23 ASN H 4.050 . 4.050 2.802 2.559 3.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
416 1 22 LYS HB3 1 22 LYS HE2 4.930 . 4.930 3.702 2.525 4.356 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
417 1 22 LYS HB3 1 22 LYS HE3 4.930 . 4.930 2.704 2.040 4.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
418 1 22 LYS HB3 1 23 ASN H 4.050 . 4.050 3.658 3.450 3.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
419 1 22 LYS QD 1 61 THR HG1 5.340 . 5.340 3.410 2.490 5.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
420 1 22 LYS QE 1 61 THR MG 5.340 . 5.340 4.123 2.444 5.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
421 1 22 LYS QG 1 23 ASN H 4.710 . 4.710 4.252 4.106 4.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
422 1 22 LYS QG 1 61 THR MG 3.740 . 3.740 2.375 2.065 2.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
423 1 23 ASN H 1 23 ASN HB2 3.670 . 3.670 2.769 2.201 3.689 0.019 34 0 "[ . 1 . 2 . 3 . 4]" 1
424 1 23 ASN H 1 23 ASN QB 3.100 . 3.100 2.355 2.180 2.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
425 1 23 ASN H 1 23 ASN HB3 3.670 . 3.670 3.225 2.499 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
426 1 23 ASN H 1 23 ASN HD21 4.700 . 4.700 4.183 3.777 4.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
427 1 23 ASN H 1 23 ASN QD 4.070 . 4.070 3.116 2.570 3.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
428 1 23 ASN H 1 23 ASN HD22 4.700 . 4.700 3.230 2.616 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
429 1 23 ASN H 1 24 SER H 3.570 . 3.570 2.585 2.439 2.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
430 1 23 ASN H 1 25 LEU H 4.550 . 4.550 4.080 3.962 4.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
431 1 23 ASN H 1 26 LYS QG 5.060 . 5.060 4.678 4.409 5.070 0.010 15 0 "[ . 1 . 2 . 3 . 4]" 1
432 1 23 ASN HA 1 26 LYS H 4.860 . 4.860 4.173 3.781 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
433 1 23 ASN HA 1 26 LYS QD 4.050 . 4.050 3.316 2.879 4.084 0.034 31 0 "[ . 1 . 2 . 3 . 4]" 1
434 1 23 ASN HA 1 26 LYS HG2 4.250 . 4.250 3.598 2.152 4.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
435 1 23 ASN HA 1 26 LYS QG 3.640 . 3.640 2.289 2.077 2.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
436 1 23 ASN HA 1 26 LYS HG3 4.250 . 4.250 2.411 2.098 3.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
437 1 23 ASN HB2 1 24 SER H 4.170 . 4.170 3.317 2.708 4.186 0.016 35 0 "[ . 1 . 2 . 3 . 4]" 1
438 1 23 ASN HB3 1 24 SER H 4.170 . 4.170 3.721 3.384 4.177 0.007 12 0 "[ . 1 . 2 . 3 . 4]" 1
439 1 24 SER H 1 24 SER QB 3.630 . 3.630 2.504 2.066 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
440 1 24 SER H 1 25 LEU H 3.540 . 3.540 2.595 2.494 2.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
441 1 24 SER H 1 26 LYS H 5.000 . 5.000 4.625 4.368 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
442 1 24 SER H 1 26 LYS QG 5.340 . 5.340 4.786 4.594 5.350 0.010 12 0 "[ . 1 . 2 . 3 . 4]" 1
443 1 24 SER H 1 34 ARG QB 5.500 . 5.500 4.953 4.458 5.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
444 1 24 SER HA 1 25 LEU QD 4.530 . 4.530 4.360 3.955 4.564 0.034 3 0 "[ . 1 . 2 . 3 . 4]" 1
445 1 24 SER QB 1 25 LEU QD 4.630 . 4.630 3.170 2.307 3.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
446 1 24 SER QB 1 35 CYS H 4.200 . 4.200 3.044 2.562 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
447 1 25 LEU H 1 25 LEU HB2 3.720 . 3.720 2.502 2.280 2.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
448 1 25 LEU H 1 25 LEU HB3 3.960 . 3.960 3.700 3.536 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
449 1 25 LEU H 1 25 LEU MD1 4.120 . 4.120 3.718 2.918 4.124 0.004 2 0 "[ . 1 . 2 . 3 . 4]" 1
450 1 25 LEU H 1 25 LEU MD2 4.120 . 4.120 3.545 2.800 3.969 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
451 1 25 LEU H 1 25 LEU HG 4.480 . 4.480 3.515 2.855 4.510 0.030 12 0 "[ . 1 . 2 . 3 . 4]" 1
452 1 25 LEU H 1 26 LYS H 3.450 . 3.450 2.970 2.709 3.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
453 1 25 LEU H 1 30 LEU MD2 4.530 . 4.530 4.501 4.418 4.534 0.004 5 0 "[ . 1 . 2 . 3 . 4]" 1
454 1 25 LEU HA 1 25 LEU MD1 3.990 . 3.990 3.224 2.067 3.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
455 1 25 LEU HA 1 25 LEU QD 2.980 . 2.980 2.128 2.057 2.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
456 1 25 LEU HA 1 25 LEU MD2 3.990 . 3.990 2.704 2.117 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
457 1 25 LEU HA 1 30 LEU MD1 4.520 . 4.520 4.507 4.381 4.542 0.022 39 0 "[ . 1 . 2 . 3 . 4]" 1
458 1 25 LEU HA 1 30 LEU MD2 3.190 . 3.190 2.126 2.061 2.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
459 1 25 LEU HA 1 31 ASP H 4.610 . 4.610 3.034 2.771 3.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
460 1 25 LEU HB2 1 25 LEU MD1 3.510 . 3.510 2.555 2.305 3.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
461 1 25 LEU HB2 1 25 LEU QD 3.040 . 3.040 2.204 2.028 2.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
462 1 25 LEU HB2 1 25 LEU MD2 3.510 . 3.510 2.835 2.055 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
463 1 25 LEU HB3 1 25 LEU MD1 3.420 . 3.420 2.529 2.222 3.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
464 1 25 LEU HB3 1 25 LEU QD 3.000 . 3.000 2.229 2.052 2.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
465 1 25 LEU HB3 1 25 LEU MD2 3.420 . 3.420 2.523 2.336 2.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
466 1 25 LEU HB3 1 30 LEU MD2 4.490 . 4.490 2.911 2.606 3.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
467 1 25 LEU HB3 1 65 ILE MG 5.060 . 5.060 3.930 3.752 4.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
468 1 25 LEU HB3 1 68 PHE HZ 4.910 . 4.910 4.042 3.784 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
469 1 25 LEU HB3 1 70 VAL QG 5.440 . 5.440 5.474 5.414 5.568 0.128 22 0 "[ . 1 . 2 . 3 . 4]" 1
470 1 25 LEU QD 1 26 LYS H 4.440 . 4.440 4.294 4.100 4.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
471 1 25 LEU QD 1 30 LEU HA 4.680 . 4.680 3.497 3.254 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
472 1 25 LEU QD 1 30 LEU HB3 4.790 . 4.790 3.702 3.387 4.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
473 1 25 LEU QD 1 30 LEU MD1 4.320 . 4.320 3.800 3.548 4.409 0.089 32 0 "[ . 1 . 2 . 3 . 4]" 1
474 1 25 LEU QD 1 30 LEU MD2 3.080 . 3.080 2.390 2.187 2.979 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
475 1 25 LEU QD 1 31 ASP H 4.070 . 4.070 2.760 2.426 3.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
476 1 25 LEU QD 1 32 VAL H 4.760 . 4.760 4.245 3.768 4.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
477 1 25 LEU QD 1 32 VAL HA 3.580 . 3.580 2.828 2.137 3.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
478 1 25 LEU QD 1 32 VAL QG 4.190 . 4.190 3.240 2.475 3.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
479 1 25 LEU QD 1 35 CYS H 4.240 . 4.240 3.729 3.529 3.916 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
480 1 25 LEU QD 1 35 CYS HA 4.580 . 4.580 3.993 3.572 4.225 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
481 1 25 LEU QD 1 35 CYS QB 3.360 . 3.360 2.169 1.908 2.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
482 1 25 LEU QD 1 36 ILE H 5.280 . 5.280 4.738 4.604 4.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
483 1 25 LEU QD 1 61 THR MG 4.340 . 4.340 4.170 3.729 4.434 0.094 36 0 "[ . 1 . 2 . 3 . 4]" 1
484 1 25 LEU QD 1 65 ILE HA 4.420 . 4.420 4.292 3.839 4.528 0.108 23 0 "[ . 1 . 2 . 3 . 4]" 1
485 1 25 LEU QD 1 65 ILE HB 3.720 . 3.720 3.112 2.704 3.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
486 1 25 LEU QD 1 65 ILE MG 2.830 . 2.830 1.987 1.913 2.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
487 1 25 LEU QD 1 68 PHE HB2 4.590 . 4.590 3.966 3.512 4.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
488 1 25 LEU QD 1 68 PHE QD 3.790 . 3.790 3.320 3.077 3.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
489 1 25 LEU QD 1 68 PHE QE 3.410 . 3.410 2.733 2.515 3.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
490 1 25 LEU QD 1 68 PHE HZ 3.310 . 3.310 2.417 2.158 3.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
491 1 25 LEU QD 1 74 ILE MD 2.930 . 2.930 1.992 1.878 2.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
492 1 25 LEU QD 1 74 ILE MG 3.250 . 3.250 2.504 2.382 2.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
493 1 25 LEU QD 1 78 SER HG 5.440 . 5.440 5.290 5.028 5.508 0.068 25 0 "[ . 1 . 2 . 3 . 4]" 1
494 1 25 LEU MD1 1 35 CYS H 5.500 . 5.500 4.717 3.597 5.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
495 1 25 LEU MD1 1 65 ILE MG 4.070 . 4.070 2.738 1.958 4.185 0.115 12 0 "[ . 1 . 2 . 3 . 4]" 1
496 1 25 LEU MD1 1 68 PHE HB2 5.500 . 5.500 4.460 3.689 5.543 0.043 35 0 "[ . 1 . 2 . 3 . 4]" 1
497 1 25 LEU MD1 1 68 PHE QD 4.320 . 4.320 3.616 3.233 4.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
498 1 25 LEU MD1 1 74 ILE MD 3.600 . 3.600 2.314 2.007 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
499 1 25 LEU MD1 1 74 ILE MG 3.920 . 3.920 2.797 2.444 3.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
500 1 25 LEU MD2 1 35 CYS H 5.500 . 5.500 4.274 3.704 5.524 0.024 22 0 "[ . 1 . 2 . 3 . 4]" 1
501 1 25 LEU MD2 1 65 ILE MG 4.070 . 4.070 3.397 1.916 4.226 0.156 18 0 "[ . 1 . 2 . 3 . 4]" 1
502 1 25 LEU MD2 1 68 PHE HB2 5.500 . 5.500 4.998 3.552 5.517 0.017 13 0 "[ . 1 . 2 . 3 . 4]" 1
503 1 25 LEU MD2 1 68 PHE QD 4.320 . 4.320 3.976 3.154 4.325 0.005 4 0 "[ . 1 . 2 . 3 . 4]" 1
504 1 25 LEU MD2 1 74 ILE MD 3.600 . 3.600 2.367 2.004 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
505 1 25 LEU MD2 1 74 ILE MG 3.920 . 3.920 3.215 2.430 3.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
506 1 25 LEU HG 1 35 CYS QB 4.820 . 4.820 3.115 2.288 4.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
507 1 25 LEU HG 1 65 ILE MG 4.620 . 4.620 3.985 2.960 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
508 1 25 LEU HG 1 68 PHE HZ 5.390 . 5.390 4.568 2.565 5.396 0.006 3 0 "[ . 1 . 2 . 3 . 4]" 1
509 1 25 LEU HG 1 74 ILE MD 4.070 . 4.070 3.815 3.390 4.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
510 1 25 LEU HG 1 74 ILE MG 5.000 . 5.000 4.473 3.746 4.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
511 1 26 LYS H 1 26 LYS HB2 3.520 . 3.520 2.213 2.037 2.287 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
512 1 26 LYS H 1 26 LYS HB3 3.520 . 3.520 3.512 3.269 3.548 0.028 7 0 "[ . 1 . 2 . 3 . 4]" 1
513 1 26 LYS H 1 26 LYS QD 4.990 . 4.990 4.149 3.881 4.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
514 1 26 LYS H 1 26 LYS HG2 4.380 . 4.380 3.828 2.693 4.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
515 1 26 LYS H 1 26 LYS QG 3.730 . 3.730 2.838 2.542 3.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
516 1 26 LYS H 1 26 LYS HG3 4.380 . 4.380 3.016 2.589 4.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
517 1 26 LYS H 1 27 ILE H 4.620 . 4.620 4.626 4.589 4.633 0.013 2 0 "[ . 1 . 2 . 3 . 4]" 1
518 1 26 LYS H 1 29 ASN QB 4.410 . 4.410 3.671 3.346 3.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
519 1 26 LYS H 1 30 LEU H 5.180 . 5.180 5.181 5.138 5.191 0.011 17 0 "[ . 1 . 2 . 3 . 4]" 1
520 1 26 LYS H 1 30 LEU HA 4.270 . 4.270 3.399 3.222 3.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
521 1 26 LYS H 1 30 LEU MD2 3.890 . 3.890 3.356 3.187 3.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
522 1 26 LYS H 1 31 ASP QB 5.340 . 5.340 5.324 5.165 5.373 0.033 21 0 "[ . 1 . 2 . 3 . 4]" 1
523 1 26 LYS HA 1 26 LYS QD 3.880 . 3.880 3.684 1.932 3.903 0.023 12 0 "[ . 1 . 2 . 3 . 4]" 1
524 1 26 LYS HA 1 26 LYS HG2 4.180 . 4.180 2.355 2.200 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
525 1 26 LYS HA 1 26 LYS QG 3.600 . 3.600 2.258 2.128 2.738 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
526 1 26 LYS HA 1 26 LYS HG3 4.180 . 4.180 2.931 2.579 3.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
527 1 26 LYS HA 1 27 ILE H 3.180 . 3.180 2.243 2.215 2.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
528 1 26 LYS HA 1 27 ILE HA 4.770 . 4.770 4.319 4.211 4.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
529 1 26 LYS HA 1 27 ILE HG12 4.370 . 4.370 3.932 3.819 4.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
530 1 26 LYS QB 1 26 LYS QE 4.400 . 4.400 3.156 2.040 3.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
531 1 26 LYS QB 1 27 ILE H 3.900 . 3.900 2.906 2.694 3.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
532 1 26 LYS QB 1 29 ASN QB 3.360 . 3.360 2.155 2.028 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
533 1 26 LYS HB2 1 26 LYS QE 5.140 . 5.140 3.593 2.070 4.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
534 1 26 LYS HB3 1 26 LYS QE 5.140 . 5.140 3.612 2.098 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
535 1 26 LYS QD 1 27 ILE H 4.650 . 4.650 4.448 2.733 4.681 0.031 10 0 "[ . 1 . 2 . 3 . 4]" 1
536 1 26 LYS QG 1 27 ILE H 4.170 . 4.170 3.629 3.138 4.233 0.063 37 0 "[ . 1 . 2 . 3 . 4]" 1
537 1 26 LYS QG 1 29 ASN QB 4.560 . 4.560 3.934 3.394 4.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
538 1 27 ILE H 1 27 ILE HB 3.170 . 3.170 2.412 2.360 2.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
539 1 27 ILE H 1 27 ILE MD 3.830 . 3.830 3.820 3.712 3.863 0.033 29 0 "[ . 1 . 2 . 3 . 4]" 1
540 1 27 ILE H 1 27 ILE HG12 3.560 . 3.560 2.260 2.168 2.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
541 1 27 ILE H 1 27 ILE HG13 3.950 . 3.950 3.234 2.729 3.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
542 1 27 ILE H 1 27 ILE MG 3.790 . 3.790 3.767 3.750 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
543 1 27 ILE H 1 30 LEU MD2 4.890 . 4.890 4.381 4.164 4.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
544 1 27 ILE HA 1 27 ILE MD 3.660 . 3.660 2.494 2.297 2.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
545 1 27 ILE HA 1 27 ILE HG12 3.700 . 3.700 2.586 2.357 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
546 1 27 ILE HA 1 27 ILE HG13 3.900 . 3.900 3.707 3.611 3.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
547 1 27 ILE HA 1 27 ILE MG 3.180 . 3.180 2.544 2.489 2.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
548 1 27 ILE HA 1 28 ASP HA 5.240 . 5.240 4.665 4.620 4.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
549 1 27 ILE HA 1 29 ASN H 4.380 . 4.380 3.926 3.861 4.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
550 1 27 ILE HA 1 30 LEU H 5.500 . 5.500 5.419 4.979 5.515 0.015 33 0 "[ . 1 . 2 . 3 . 4]" 1
551 1 27 ILE HA 1 30 LEU MD1 4.280 . 4.280 4.193 3.888 4.302 0.022 22 0 "[ . 1 . 2 . 3 . 4]" 1
552 1 27 ILE HA 1 30 LEU MD2 3.850 . 3.850 3.219 2.921 3.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
553 1 27 ILE HA 1 30 LEU HG 4.250 . 4.250 3.510 3.158 3.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
554 1 27 ILE HB 1 27 ILE MD 3.280 . 3.280 3.242 3.107 3.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
555 1 27 ILE MD 1 27 ILE MG 2.850 . 2.850 1.974 1.914 2.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
556 1 27 ILE MD 1 28 ASP H 4.980 . 4.980 4.893 4.808 4.988 0.008 27 0 "[ . 1 . 2 . 3 . 4]" 1
557 1 27 ILE MD 1 30 LEU MD2 4.570 . 4.570 4.172 3.944 4.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
558 1 27 ILE HG12 1 27 ILE MG 3.360 . 3.360 3.162 3.064 3.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
559 1 27 ILE MG 1 28 ASP H 4.340 . 4.340 3.092 2.975 3.228 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
560 1 27 ILE MG 1 28 ASP HB2 4.990 . 4.990 4.026 3.176 5.009 0.019 39 0 "[ . 1 . 2 . 3 . 4]" 1
561 1 27 ILE MG 1 28 ASP QB 4.210 . 4.210 3.631 3.117 4.211 0.001 29 0 "[ . 1 . 2 . 3 . 4]" 1
562 1 27 ILE MG 1 28 ASP HB3 4.990 . 4.990 4.480 3.476 4.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
563 1 27 ILE MG 1 29 ASN H 4.570 . 4.570 4.552 4.509 4.593 0.023 15 0 "[ . 1 . 2 . 3 . 4]" 1
564 1 29 ASN H 1 29 ASN HB2 4.110 . 4.110 3.273 3.135 3.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
565 1 29 ASN H 1 29 ASN HB3 4.110 . 4.110 3.053 2.958 3.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
566 1 29 ASN H 1 30 LEU MD1 5.480 . 5.480 5.267 5.079 5.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
567 1 29 ASN H 1 30 LEU MD2 4.410 . 4.410 3.985 3.895 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
568 1 29 ASN HA 1 30 LEU H 3.330 . 3.330 2.482 2.373 2.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
569 1 29 ASN HA 1 30 LEU HB2 5.330 . 5.330 4.788 4.710 4.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
570 1 29 ASN HA 1 30 LEU HG 5.220 . 5.220 5.070 4.904 5.223 0.003 29 0 "[ . 1 . 2 . 3 . 4]" 1
571 1 29 ASN QB 1 30 LEU H 4.120 . 4.120 4.067 4.029 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
572 1 29 ASN HB2 1 30 LEU H 4.820 . 4.820 4.686 4.668 4.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
573 1 29 ASN HB3 1 30 LEU H 4.820 . 4.820 4.463 4.391 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
574 1 30 LEU H 1 30 LEU HB2 3.090 . 3.090 2.370 2.324 2.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
575 1 30 LEU H 1 30 LEU HB3 3.640 . 3.640 3.599 3.579 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
576 1 30 LEU H 1 30 LEU MD1 4.080 . 4.080 3.889 3.759 4.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
577 1 30 LEU H 1 30 LEU MD2 4.430 . 4.430 3.698 3.497 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
578 1 30 LEU H 1 30 LEU HG 3.330 . 3.330 2.867 2.610 3.067 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
579 1 30 LEU H 1 31 ASP H 4.610 . 4.610 4.545 4.501 4.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
580 1 30 LEU HA 1 30 LEU MD1 3.990 . 3.990 3.796 3.766 3.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
581 1 30 LEU HA 1 30 LEU MD2 2.960 . 2.960 2.167 2.116 2.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
582 1 30 LEU HA 1 30 LEU HG 4.180 . 4.180 3.210 3.160 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
583 1 30 LEU HA 1 31 ASP H 3.150 . 3.150 2.088 2.042 2.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
584 1 30 LEU HA 1 31 ASP QB 4.490 . 4.490 4.069 3.995 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
585 1 30 LEU HB2 1 30 LEU MD1 3.080 . 3.080 2.267 2.222 2.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
586 1 30 LEU HB2 1 30 LEU MD2 3.430 . 3.430 3.239 3.232 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
587 1 30 LEU HB2 1 31 ASP H 4.500 . 4.500 4.132 3.994 4.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
588 1 30 LEU HB2 1 31 ASP HA 5.500 . 5.500 4.745 4.554 4.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
589 1 30 LEU HB2 1 32 VAL H 5.500 . 5.500 5.190 4.773 5.502 0.002 10 0 "[ . 1 . 2 . 3 . 4]" 1
590 1 30 LEU HB2 1 70 VAL QG 5.060 . 5.060 4.269 3.972 4.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
591 1 30 LEU HB3 1 30 LEU MD1 3.150 . 3.150 2.186 2.154 2.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
592 1 30 LEU HB3 1 30 LEU MD2 3.540 . 3.540 2.436 2.404 2.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
593 1 30 LEU HB3 1 31 ASP H 4.260 . 4.260 3.036 2.893 3.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
594 1 30 LEU HB3 1 31 ASP HA 5.060 . 5.060 4.064 4.018 4.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
595 1 30 LEU HB3 1 68 PHE HZ 4.980 . 4.980 3.704 3.398 4.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
596 1 30 LEU MD1 1 31 ASP H 4.550 . 4.550 4.613 4.587 4.650 0.100 38 0 "[ . 1 . 2 . 3 . 4]" 1
597 1 30 LEU MD1 1 31 ASP HA 5.500 . 5.500 5.528 5.503 5.557 0.057 22 0 "[ . 1 . 2 . 3 . 4]" 1
598 1 30 LEU MD1 1 32 VAL H 5.490 . 5.490 5.115 4.716 5.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
599 1 30 LEU MD1 1 68 PHE QD 5.500 . 5.500 5.116 4.836 5.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
600 1 30 LEU MD1 1 68 PHE QE 3.890 . 3.890 3.439 3.134 3.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
601 1 30 LEU MD1 1 68 PHE HZ 3.390 . 3.390 2.594 2.316 3.013 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
602 1 30 LEU MD1 1 70 VAL HA 5.500 . 5.500 5.124 4.889 5.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
603 1 30 LEU MD1 1 70 VAL MG1 3.190 . 3.190 2.218 2.079 2.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
604 1 30 LEU MD1 1 70 VAL MG2 3.190 . 3.190 2.399 2.145 2.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
605 1 30 LEU MD2 1 31 ASP H 3.630 . 3.630 3.340 3.242 3.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
606 1 30 LEU MD2 1 32 VAL H 5.450 . 5.450 5.243 4.639 5.460 0.010 10 0 "[ . 1 . 2 . 3 . 4]" 1
607 1 30 LEU MD2 1 68 PHE QD 5.130 . 5.130 4.656 4.484 4.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
608 1 30 LEU MD2 1 68 PHE QE 3.290 . 3.290 2.766 2.558 3.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
609 1 30 LEU MD2 1 68 PHE HZ 3.250 . 3.250 2.207 2.046 2.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
610 1 30 LEU MD2 1 70 VAL MG1 4.200 . 4.200 3.942 3.692 4.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
611 1 30 LEU MD2 1 70 VAL QG 3.540 . 3.540 3.293 3.009 3.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
612 1 30 LEU MD2 1 70 VAL MG2 4.200 . 4.200 3.535 3.176 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
613 1 31 ASP H 1 31 ASP HB2 3.950 . 3.950 3.269 3.134 3.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
614 1 31 ASP H 1 31 ASP HB3 3.950 . 3.950 2.872 2.820 3.083 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
615 1 31 ASP H 1 32 VAL H 4.480 . 4.480 3.707 3.426 3.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
616 1 31 ASP H 1 32 VAL QG 4.520 . 4.520 4.207 3.642 4.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
617 1 31 ASP HA 1 32 VAL H 3.330 . 3.330 2.163 2.109 2.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
618 1 31 ASP HA 1 32 VAL HA 4.790 . 4.790 4.462 4.414 4.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
619 1 31 ASP HA 1 32 VAL QG 4.000 . 4.000 3.639 3.398 3.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
620 1 31 ASP HA 1 33 ASN H 4.400 . 4.400 3.763 3.581 3.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
621 1 31 ASP QB 1 34 ARG H 4.940 . 4.940 3.459 3.338 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
622 1 31 ASP QB 1 34 ARG QB 4.360 . 4.360 2.507 2.300 2.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
623 1 32 VAL H 1 32 VAL HB 3.400 . 3.400 2.469 2.348 3.445 0.045 38 0 "[ . 1 . 2 . 3 . 4]" 1
624 1 32 VAL H 1 32 VAL QG 2.890 . 2.890 1.999 1.802 2.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
625 1 32 VAL H 1 33 ASN H 3.520 . 3.520 2.735 2.552 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
626 1 32 VAL H 1 36 ILE MD 5.500 . 5.500 5.536 5.481 5.557 0.057 28 0 "[ . 1 . 2 . 3 . 4]" 1
627 1 32 VAL H 1 74 ILE MD 4.400 . 4.400 4.446 4.405 4.484 0.084 28 0 "[ . 1 . 2 . 3 . 4]" 1
628 1 32 VAL HA 1 32 VAL MG1 3.060 . 3.060 2.475 2.407 2.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
629 1 32 VAL HA 1 32 VAL MG2 3.060 . 3.060 2.409 2.326 3.180 0.120 38 0 "[ . 1 . 2 . 3 . 4]" 1
630 1 32 VAL HA 1 35 CYS H 4.060 . 4.060 3.743 3.375 3.868 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
631 1 32 VAL HA 1 35 CYS HB2 4.350 . 4.350 3.936 3.593 4.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
632 1 32 VAL HA 1 35 CYS HB3 4.350 . 4.350 3.257 2.895 3.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
633 1 32 VAL HA 1 36 ILE H 4.830 . 4.830 4.442 4.296 4.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
634 1 32 VAL HA 1 36 ILE MD 4.720 . 4.720 4.400 4.339 4.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
635 1 32 VAL HA 1 68 PHE QE 4.680 . 4.680 3.658 3.308 4.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
636 1 32 VAL HA 1 74 ILE MD 3.160 . 3.160 2.062 2.000 2.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
637 1 32 VAL HB 1 33 ASN H 3.690 . 3.690 2.595 2.438 3.785 0.095 8 0 "[ . 1 . 2 . 3 . 4]" 1
638 1 32 VAL HB 1 36 ILE MD 4.140 . 4.140 3.977 3.623 4.083 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
639 1 32 VAL HB 1 70 VAL QG 5.360 . 5.360 5.073 4.341 5.392 0.032 36 0 "[ . 1 . 2 . 3 . 4]" 1
640 1 32 VAL HB 1 74 ILE MD 4.230 . 4.230 3.989 2.038 4.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
641 1 32 VAL QG 1 33 ASN H 3.200 . 3.200 3.030 2.169 3.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
642 1 32 VAL QG 1 33 ASN HA 3.990 . 3.990 3.172 3.045 3.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
643 1 32 VAL QG 1 33 ASN QB 5.280 . 5.280 4.244 3.112 4.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
644 1 32 VAL QG 1 34 ARG H 4.730 . 4.730 4.640 4.250 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
645 1 32 VAL QG 1 35 CYS QB 4.530 . 4.530 3.783 3.706 4.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
646 1 32 VAL QG 1 36 ILE H 4.570 . 4.570 4.119 3.978 4.578 0.008 29 0 "[ . 1 . 2 . 3 . 4]" 1
647 1 32 VAL QG 1 36 ILE MD 3.000 . 3.000 2.088 2.004 2.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
648 1 32 VAL QG 1 36 ILE HG13 4.020 . 4.020 3.014 2.842 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
649 1 32 VAL QG 1 68 PHE QD 4.010 . 4.010 3.910 3.695 4.051 0.041 34 0 "[ . 1 . 2 . 3 . 4]" 1
650 1 32 VAL QG 1 68 PHE QE 3.180 . 3.180 2.390 1.948 2.624 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
651 1 32 VAL QG 1 68 PHE HZ 4.410 . 4.410 3.452 2.311 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
652 1 32 VAL QG 1 70 VAL QG 3.020 . 3.020 2.658 2.242 2.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
653 1 32 VAL QG 1 71 SER H 4.580 . 4.580 4.322 4.023 4.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
654 1 32 VAL QG 1 71 SER HA 4.650 . 4.650 3.728 3.579 3.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
655 1 32 VAL QG 1 71 SER QB 3.450 . 3.450 2.084 1.990 2.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
656 1 32 VAL QG 1 71 SER HG 3.890 . 3.890 1.905 1.758 2.639 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
657 1 32 VAL QG 1 74 ILE H 4.490 . 4.490 3.904 3.662 4.657 0.167 8 0 "[ . 1 . 2 . 3 . 4]" 1
658 1 32 VAL QG 1 74 ILE HB 4.760 . 4.760 3.983 3.855 4.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
659 1 32 VAL QG 1 74 ILE MD 2.880 . 2.880 2.101 2.009 2.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
660 1 32 VAL QG 1 74 ILE QG 4.100 . 4.100 2.654 2.450 3.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
661 1 32 VAL MG1 1 33 ASN H 3.810 . 3.810 3.303 3.193 3.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
662 1 32 VAL MG1 1 34 ARG H 5.500 . 5.500 5.056 4.942 5.445 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
663 1 32 VAL MG1 1 68 PHE QD 4.760 . 4.760 4.388 3.810 4.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
664 1 32 VAL MG1 1 68 PHE QE 3.940 . 3.940 3.410 1.954 3.707 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
665 1 32 VAL MG1 1 71 SER H 5.250 . 5.250 4.980 4.186 5.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
666 1 32 VAL MG2 1 33 ASN H 3.810 . 3.810 3.710 2.184 3.850 0.040 17 0 "[ . 1 . 2 . 3 . 4]" 1
667 1 32 VAL MG2 1 34 ARG H 5.500 . 5.500 5.457 4.464 5.585 0.085 13 0 "[ . 1 . 2 . 3 . 4]" 1
668 1 32 VAL MG2 1 68 PHE QD 4.760 . 4.760 4.428 4.131 4.976 0.216 38 0 "[ . 1 . 2 . 3 . 4]" 1
669 1 32 VAL MG2 1 68 PHE QE 3.940 . 3.940 2.566 2.193 3.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
670 1 32 VAL MG2 1 71 SER H 5.250 . 5.250 4.778 4.490 5.252 0.002 38 0 "[ . 1 . 2 . 3 . 4]" 1
671 1 33 ASN H 1 33 ASN HB2 3.610 . 3.610 2.518 2.308 3.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
672 1 33 ASN H 1 33 ASN QB 3.130 . 3.130 2.419 1.966 2.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
673 1 33 ASN H 1 33 ASN HB3 3.610 . 3.610 3.523 1.989 3.617 0.007 38 0 "[ . 1 . 2 . 3 . 4]" 1
674 1 33 ASN H 1 33 ASN HD21 4.840 . 4.840 4.129 3.572 4.881 0.041 8 0 "[ . 1 . 2 . 3 . 4]" 1
675 1 33 ASN H 1 33 ASN QD 4.010 . 4.010 3.454 2.836 4.082 0.072 28 0 "[ . 1 . 2 . 3 . 4]" 1
676 1 33 ASN H 1 33 ASN HD22 4.840 . 4.840 3.720 2.976 4.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
677 1 33 ASN H 1 34 ARG H 3.410 . 3.410 2.762 2.607 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
678 1 33 ASN H 1 34 ARG HA 5.500 . 5.500 5.367 5.237 5.456 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
679 1 33 ASN H 1 34 ARG QB 4.910 . 4.910 4.581 4.395 4.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
680 1 33 ASN H 1 35 CYS H 4.600 . 4.600 4.250 4.110 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
681 1 33 ASN H 1 36 ILE MD 4.550 . 4.550 3.997 3.875 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
682 1 33 ASN H 1 36 ILE HG13 5.040 . 5.040 5.051 4.998 5.058 0.018 26 0 "[ . 1 . 2 . 3 . 4]" 1
683 1 33 ASN H 1 74 ILE MD 4.910 . 4.910 4.721 4.501 4.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
684 1 33 ASN HA 1 36 ILE H 4.200 . 4.200 3.338 3.207 3.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
685 1 33 ASN HA 1 36 ILE HA 5.500 . 5.500 5.357 5.164 5.505 0.005 40 0 "[ . 1 . 2 . 3 . 4]" 1
686 1 33 ASN HA 1 36 ILE HB 3.710 . 3.710 2.759 2.502 2.982 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
687 1 33 ASN HA 1 36 ILE MD 3.270 . 3.270 2.081 1.939 2.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
688 1 33 ASN HA 1 36 ILE MG 4.420 . 4.420 4.141 3.954 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
689 1 33 ASN QB 1 36 ILE HB 5.340 . 5.340 4.243 3.943 4.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
690 1 33 ASN QB 1 36 ILE MD 4.880 . 4.880 3.889 3.414 4.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
691 1 33 ASN HB2 1 34 ARG H 3.940 . 3.940 2.689 2.523 3.976 0.036 8 0 "[ . 1 . 2 . 3 . 4]" 1
692 1 33 ASN HB2 1 34 ARG QB 5.500 . 5.500 4.278 3.913 5.507 0.007 28 0 "[ . 1 . 2 . 3 . 4]" 1
693 1 33 ASN HB3 1 34 ARG H 3.940 . 3.940 3.614 2.928 3.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
694 1 33 ASN HB3 1 34 ARG QB 5.500 . 5.500 5.032 4.544 5.612 0.112 28 0 "[ . 1 . 2 . 3 . 4]" 1
695 1 34 ARG H 1 34 ARG QB 3.150 . 3.150 2.245 2.071 2.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
696 1 34 ARG H 1 34 ARG HD2 4.690 . 4.690 4.467 3.028 4.709 0.019 13 0 "[ . 1 . 2 . 3 . 4]" 1
697 1 34 ARG H 1 34 ARG HD3 4.690 . 4.690 4.249 2.834 4.700 0.010 10 0 "[ . 1 . 2 . 3 . 4]" 1
698 1 34 ARG H 1 34 ARG HG2 4.710 . 4.710 4.066 2.335 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
699 1 34 ARG H 1 34 ARG QG 4.100 . 4.100 3.587 2.310 4.108 0.008 40 0 "[ . 1 . 2 . 3 . 4]" 1
700 1 34 ARG H 1 34 ARG HG3 4.710 . 4.710 4.191 2.462 4.571 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
701 1 34 ARG H 1 35 CYS H 3.460 . 3.460 2.695 2.578 2.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
702 1 34 ARG H 1 36 ILE H 4.720 . 4.720 4.139 4.015 4.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
703 1 34 ARG H 1 37 GLU QG 5.340 . 5.340 4.631 4.508 4.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
704 1 34 ARG HA 1 34 ARG QD 4.500 . 4.500 2.408 1.961 4.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
705 1 34 ARG HA 1 34 ARG HG2 3.990 . 3.990 3.436 2.360 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
706 1 34 ARG HA 1 34 ARG QG 3.390 . 3.390 2.746 2.280 2.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
707 1 34 ARG HA 1 34 ARG HG3 3.990 . 3.990 3.039 2.344 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
708 1 34 ARG HA 1 37 GLU H 4.670 . 4.670 3.450 3.277 3.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
709 1 34 ARG HA 1 37 GLU QG 4.060 . 4.060 2.525 2.057 3.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
710 1 34 ARG QB 1 34 ARG HD2 3.870 . 3.870 2.779 2.248 3.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
711 1 34 ARG QB 1 34 ARG QD 3.370 . 3.370 2.262 2.017 2.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
712 1 34 ARG QB 1 34 ARG HD3 3.870 . 3.870 2.495 2.126 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
713 1 34 ARG QB 1 35 CYS H 3.630 . 3.630 2.673 2.523 2.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
714 1 34 ARG HE 1 34 ARG HG2 3.990 . 3.990 2.666 2.406 3.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
715 1 34 ARG HE 1 34 ARG HG3 3.990 . 3.990 2.664 2.354 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
716 1 34 ARG QG 1 35 CYS H 5.260 . 5.260 4.031 3.717 4.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
717 1 35 CYS H 1 35 CYS HB2 3.590 . 3.590 2.542 2.443 2.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
718 1 35 CYS H 1 35 CYS HB3 3.590 . 3.590 2.538 2.450 2.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
719 1 35 CYS H 1 35 CYS HG 5.500 . 5.500 4.565 4.520 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
720 1 35 CYS H 1 36 ILE H 3.750 . 3.750 2.649 2.534 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
721 1 35 CYS H 1 36 ILE HB 5.260 . 5.260 4.885 4.750 4.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
722 1 35 CYS H 1 36 ILE MD 5.430 . 5.430 5.043 4.917 5.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
723 1 35 CYS H 1 36 ILE HG13 5.500 . 5.500 4.377 4.214 4.525 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
724 1 35 CYS H 1 38 ALA MB 5.130 . 5.130 4.837 4.701 4.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
725 1 35 CYS H 1 74 ILE MD 4.100 . 4.100 3.841 3.736 3.938 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
726 1 35 CYS HA 1 37 GLU H 4.880 . 4.880 4.454 4.291 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
727 1 35 CYS HA 1 38 ALA H 4.090 . 4.090 3.475 3.303 3.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
728 1 35 CYS HA 1 38 ALA MB 3.340 . 3.340 2.654 2.533 2.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
729 1 35 CYS QB 1 36 ILE H 4.070 . 4.070 2.598 2.508 2.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
730 1 35 CYS QB 1 74 ILE MD 3.300 . 3.300 2.101 2.049 2.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
731 1 35 CYS HB2 1 74 ILE MD 3.820 . 3.820 3.122 2.974 3.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
732 1 35 CYS HB3 1 74 ILE MD 3.820 . 3.820 2.136 2.079 2.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
733 1 35 CYS HG 1 36 ILE H 4.710 . 4.710 3.943 3.804 4.713 0.003 28 0 "[ . 1 . 2 . 3 . 4]" 1
734 1 35 CYS HG 1 39 LEU HG 4.120 . 4.120 2.175 1.894 3.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
735 1 35 CYS HG 1 74 ILE MD 4.100 . 4.100 3.802 3.612 4.111 0.011 28 0 "[ . 1 . 2 . 3 . 4]" 1
736 1 35 CYS HG 1 74 ILE MG 4.200 . 4.200 3.381 3.199 3.821 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
737 1 36 ILE H 1 36 ILE HB 3.600 . 3.600 2.519 2.432 2.571 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
738 1 36 ILE H 1 36 ILE MD 3.530 . 3.530 3.433 3.383 3.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
739 1 36 ILE H 1 36 ILE HG12 4.040 . 4.040 3.613 3.512 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
740 1 36 ILE H 1 36 ILE HG13 3.820 . 3.820 2.213 2.095 2.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
741 1 36 ILE H 1 36 ILE MG 3.910 . 3.910 3.824 3.796 3.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
742 1 36 ILE H 1 37 GLU H 3.790 . 3.790 2.789 2.713 2.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
743 1 36 ILE H 1 37 GLU QG 4.890 . 4.890 4.206 4.014 4.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
744 1 36 ILE H 1 74 ILE MD 3.960 . 3.960 3.602 3.485 3.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
745 1 36 ILE HA 1 36 ILE MD 4.030 . 4.030 3.913 3.874 3.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
746 1 36 ILE HA 1 36 ILE HG12 4.010 . 4.010 2.624 2.587 2.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
747 1 36 ILE HA 1 36 ILE HG13 4.150 . 4.150 2.823 2.691 2.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
748 1 36 ILE HA 1 36 ILE MG 3.210 . 3.210 2.481 2.446 2.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
749 1 36 ILE HA 1 38 ALA H 4.960 . 4.960 4.449 4.306 4.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
750 1 36 ILE HA 1 39 LEU HB2 4.510 . 4.510 2.817 2.662 2.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
751 1 36 ILE HA 1 39 LEU QB 3.870 . 3.870 2.788 2.638 2.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
752 1 36 ILE HA 1 39 LEU HB3 4.510 . 4.510 4.442 4.301 4.516 0.006 4 0 "[ . 1 . 2 . 3 . 4]" 1
753 1 36 ILE HA 1 39 LEU MD1 3.510 . 3.510 2.489 2.288 2.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
754 1 36 ILE HA 1 39 LEU MD2 5.140 . 5.140 4.814 4.688 5.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
755 1 36 ILE HA 1 39 LEU HG 4.460 . 4.460 3.616 3.384 3.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
756 1 36 ILE HA 1 40 ASP H 4.640 . 4.640 4.143 3.983 4.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
757 1 36 ILE HA 1 73 VAL QG 4.850 . 4.850 4.192 3.931 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
758 1 36 ILE HA 1 74 ILE MD 4.910 . 4.910 4.592 4.449 4.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
759 1 36 ILE HB 1 36 ILE MD 3.170 . 3.170 2.403 2.351 2.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
760 1 36 ILE HB 1 37 GLU H 3.540 . 3.540 2.725 2.631 2.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
761 1 36 ILE MD 1 37 GLU H 4.650 . 4.650 4.623 4.548 4.664 0.014 19 0 "[ . 1 . 2 . 3 . 4]" 1
762 1 36 ILE MD 1 73 VAL H 4.950 . 4.950 4.649 4.232 4.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
763 1 36 ILE MD 1 73 VAL HA 5.500 . 5.500 4.970 4.706 5.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
764 1 36 ILE MD 1 73 VAL HB 3.630 . 3.630 2.542 2.241 2.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
765 1 36 ILE MD 1 74 ILE H 4.350 . 4.350 3.975 3.525 4.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
766 1 36 ILE MD 1 74 ILE HA 5.240 . 5.240 4.639 4.457 4.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
767 1 36 ILE MD 1 74 ILE MD 4.130 . 4.130 3.607 3.503 3.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
768 1 36 ILE MD 1 77 LYS QE 4.270 . 4.270 4.124 3.860 4.291 0.021 21 0 "[ . 1 . 2 . 3 . 4]" 1
769 1 36 ILE HG12 1 73 VAL QG 4.050 . 4.050 2.387 2.295 2.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
770 1 36 ILE HG12 1 74 ILE MD 4.750 . 4.750 4.009 3.853 4.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
771 1 36 ILE HG12 1 74 ILE QG 4.750 . 4.750 2.684 2.530 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
772 1 36 ILE HG13 1 39 LEU MD1 4.850 . 4.850 4.091 3.785 4.420 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
773 1 36 ILE MG 1 37 GLU H 3.560 . 3.560 3.428 3.266 3.565 0.005 15 0 "[ . 1 . 2 . 3 . 4]" 1
774 1 36 ILE MG 1 37 GLU HA 3.720 . 3.720 3.404 3.176 3.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
775 1 36 ILE MG 1 37 GLU QG 4.930 . 4.930 4.030 3.389 4.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
776 1 36 ILE MG 1 40 ASP H 4.180 . 4.180 4.025 3.870 4.190 0.010 4 0 "[ . 1 . 2 . 3 . 4]" 1
777 1 36 ILE MG 1 77 LYS QD 3.910 . 3.910 2.819 2.266 3.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
778 1 36 ILE MG 1 77 LYS HE2 3.750 . 3.750 3.582 3.424 3.755 0.005 15 0 "[ . 1 . 2 . 3 . 4]" 1
779 1 36 ILE MG 1 77 LYS QE 3.100 . 3.100 2.176 1.997 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
780 1 36 ILE MG 1 77 LYS HE3 3.750 . 3.750 2.195 2.009 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
781 1 36 ILE MG 1 77 LYS QG 4.900 . 4.900 3.596 2.289 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
782 1 37 GLU H 1 37 GLU HB2 3.760 . 3.760 2.873 2.464 3.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
783 1 37 GLU H 1 37 GLU HB3 3.760 . 3.760 3.368 2.541 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
784 1 37 GLU H 1 37 GLU HG2 3.670 . 3.670 2.681 2.091 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
785 1 37 GLU H 1 37 GLU QG 3.160 . 3.160 2.112 1.999 2.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
786 1 37 GLU H 1 37 GLU HG3 3.670 . 3.670 2.546 2.035 3.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
787 1 37 GLU H 1 38 ALA H 3.470 . 3.470 2.652 2.591 2.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
788 1 37 GLU H 1 38 ALA MB 4.590 . 4.590 4.321 4.239 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
789 1 37 GLU HA 1 40 ASP H 4.120 . 4.120 3.453 3.131 3.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
790 1 37 GLU HA 1 40 ASP HB2 4.450 . 4.450 2.888 2.336 3.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
791 1 37 GLU HA 1 40 ASP QB 3.720 . 3.720 2.763 2.286 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
792 1 37 GLU HA 1 40 ASP HB3 4.450 . 4.450 3.756 3.094 4.459 0.009 39 0 "[ . 1 . 2 . 3 . 4]" 1
793 1 37 GLU QB 1 38 ALA H 3.530 . 3.530 2.639 2.211 3.571 0.041 21 0 "[ . 1 . 2 . 3 . 4]" 1
794 1 37 GLU HB2 1 38 ALA H 4.130 . 4.130 2.755 2.244 3.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
795 1 37 GLU HB3 1 38 ALA H 4.130 . 4.130 3.686 3.333 4.130 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
796 1 37 GLU QG 1 38 ALA H 3.980 . 3.980 3.395 2.292 3.978 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
797 1 37 GLU HG2 1 38 ALA H 4.550 . 4.550 4.096 2.497 4.609 0.059 33 0 "[ . 1 . 2 . 3 . 4]" 1
798 1 37 GLU HG3 1 38 ALA H 4.550 . 4.550 3.652 2.533 4.558 0.008 7 0 "[ . 1 . 2 . 3 . 4]" 1
799 1 38 ALA H 1 38 ALA MB 2.840 . 2.840 2.241 2.223 2.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
800 1 38 ALA H 1 39 LEU H 3.400 . 3.400 2.713 2.572 2.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
801 1 38 ALA H 1 39 LEU MD1 5.500 . 5.500 5.304 5.079 5.505 0.005 11 0 "[ . 1 . 2 . 3 . 4]" 1
802 1 38 ALA H 1 39 LEU MD2 5.500 . 5.500 5.517 5.441 5.544 0.044 33 0 "[ . 1 . 2 . 3 . 4]" 1
803 1 38 ALA H 1 39 LEU HG 4.740 . 4.740 4.545 4.396 4.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
804 1 38 ALA H 1 40 ASP H 4.410 . 4.410 4.144 3.979 4.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
805 1 38 ALA H 1 41 GLU H 5.280 . 5.280 4.862 4.759 4.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
806 1 38 ALA HA 1 41 GLU H 3.940 . 3.940 3.649 3.435 3.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
807 1 38 ALA HA 1 42 LEU H 4.640 . 4.640 4.377 4.231 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
808 1 38 ALA MB 1 39 LEU H 3.270 . 3.270 2.556 2.473 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
809 1 38 ALA MB 1 39 LEU MD1 5.260 . 5.260 4.447 4.306 4.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
810 1 38 ALA MB 1 39 LEU MD2 3.890 . 3.890 3.727 3.596 3.898 0.008 21 0 "[ . 1 . 2 . 3 . 4]" 1
811 1 38 ALA MB 1 39 LEU HG 4.420 . 4.420 3.235 3.105 3.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
812 1 38 ALA MB 1 40 ASP H 5.230 . 5.230 4.543 4.446 4.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
813 1 38 ALA MB 1 41 GLU H 5.120 . 5.120 4.790 4.653 4.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
814 1 39 LEU H 1 39 LEU HB2 4.110 . 4.110 2.432 2.394 2.462 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
815 1 39 LEU H 1 39 LEU HB3 4.110 . 4.110 3.601 3.587 3.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
816 1 39 LEU H 1 39 LEU MD1 3.870 . 3.870 3.557 3.460 3.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
817 1 39 LEU H 1 39 LEU MD2 3.600 . 3.600 3.483 3.391 3.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
818 1 39 LEU H 1 39 LEU HG 3.330 . 3.330 2.349 2.293 2.495 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
819 1 39 LEU H 1 40 ASP H 3.620 . 3.620 2.608 2.543 2.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
820 1 39 LEU H 1 41 GLU H 4.800 . 4.800 4.211 4.113 4.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
821 1 39 LEU H 1 81 LEU QD 5.370 . 5.370 4.738 4.629 4.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
822 1 39 LEU HA 1 39 LEU MD1 4.140 . 4.140 3.901 3.870 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
823 1 39 LEU HA 1 39 LEU MD2 2.980 . 2.980 2.035 2.003 2.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
824 1 39 LEU HA 1 39 LEU HG 4.190 . 4.190 3.028 2.954 3.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
825 1 39 LEU HA 1 42 LEU H 4.110 . 4.110 3.471 3.376 3.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
826 1 39 LEU HA 1 42 LEU HB2 4.510 . 4.510 3.156 2.668 3.688 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
827 1 39 LEU HA 1 42 LEU HB3 4.210 . 4.210 3.221 2.736 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
828 1 39 LEU HA 1 42 LEU QD 4.310 . 4.310 3.471 3.102 3.750 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
829 1 39 LEU HA 1 81 LEU QD 3.680 . 3.680 2.631 2.450 2.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
830 1 39 LEU QB 1 39 LEU MD1 2.930 . 2.930 2.116 2.092 2.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
831 1 39 LEU QB 1 39 LEU MD2 3.050 . 3.050 2.298 2.256 2.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
832 1 39 LEU QB 1 40 ASP H 3.490 . 3.490 2.600 2.519 2.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
833 1 39 LEU QB 1 77 LYS QB 4.630 . 4.630 2.290 2.125 2.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
834 1 39 LEU QB 1 81 LEU QD 3.720 . 3.720 2.447 2.295 2.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
835 1 39 LEU HB2 1 39 LEU MD1 3.350 . 3.350 2.302 2.268 2.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
836 1 39 LEU HB2 1 39 LEU MD2 3.500 . 3.500 3.201 3.182 3.217 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
837 1 39 LEU HB2 1 40 ASP H 4.240 . 4.240 2.661 2.574 2.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
838 1 39 LEU HB3 1 39 LEU MD1 3.350 . 3.350 2.470 2.401 2.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
839 1 39 LEU HB3 1 39 LEU MD2 3.500 . 3.500 2.355 2.308 2.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
840 1 39 LEU HB3 1 40 ASP H 4.240 . 4.240 3.654 3.581 3.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
841 1 39 LEU MD1 1 40 ASP H 4.640 . 4.640 4.533 4.419 4.643 0.003 16 0 "[ . 1 . 2 . 3 . 4]" 1
842 1 39 LEU MD1 1 65 ILE MD 3.230 . 3.230 2.534 2.311 2.909 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
843 1 39 LEU MD1 1 74 ILE H 4.960 . 4.960 4.847 4.689 4.987 0.027 33 0 "[ . 1 . 2 . 3 . 4]" 1
844 1 39 LEU MD1 1 74 ILE HA 3.380 . 3.380 2.542 2.375 2.683 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
845 1 39 LEU MD1 1 74 ILE HB 4.610 . 4.610 4.393 4.263 4.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
846 1 39 LEU MD1 1 74 ILE MD 4.610 . 4.610 3.810 3.642 3.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
847 1 39 LEU MD1 1 74 ILE QG 3.810 . 3.810 2.719 2.505 2.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
848 1 39 LEU MD1 1 77 LYS H 4.280 . 4.280 4.001 3.890 4.087 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
849 1 39 LEU MD1 1 77 LYS HA 4.900 . 4.900 4.335 4.205 4.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
850 1 39 LEU MD1 1 77 LYS QB 3.330 . 3.330 2.090 2.013 2.251 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
851 1 39 LEU MD1 1 77 LYS QG 5.280 . 5.280 3.621 3.148 4.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
852 1 39 LEU MD1 1 78 SER H 3.970 . 3.970 3.070 2.845 3.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
853 1 39 LEU MD1 1 78 SER HA 4.210 . 4.210 3.371 3.121 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
854 1 39 LEU MD1 1 78 SER QB 4.040 . 4.040 3.645 2.584 3.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
855 1 39 LEU MD1 1 78 SER HG 4.130 . 4.130 2.786 2.458 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
856 1 39 LEU MD2 1 40 ASP H 4.640 . 4.640 4.714 4.689 4.734 0.094 2 0 "[ . 1 . 2 . 3 . 4]" 1
857 1 39 LEU MD2 1 42 LEU HB3 4.820 . 4.820 4.093 3.726 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
858 1 39 LEU MD2 1 74 ILE HA 5.110 . 5.110 4.891 4.647 5.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
859 1 39 LEU MD2 1 77 LYS QB 4.040 . 4.040 3.390 3.141 3.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
860 1 39 LEU MD2 1 78 SER H 4.700 . 4.700 4.236 3.994 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
861 1 39 LEU MD2 1 78 SER HA 3.770 . 3.770 2.838 2.537 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
862 1 39 LEU MD2 1 78 SER QB 4.130 . 4.130 3.691 2.763 4.008 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
863 1 39 LEU MD2 1 81 LEU QD 3.160 . 3.160 2.047 1.972 2.135 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
864 1 39 LEU HG 1 40 ASP H 4.940 . 4.940 4.408 4.346 4.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
865 1 39 LEU HG 1 74 ILE QG 5.200 . 5.200 4.546 4.242 4.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
866 1 39 LEU HG 1 74 ILE MG 4.510 . 4.510 4.226 4.042 4.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
867 1 39 LEU HG 1 81 LEU QD 5.440 . 5.440 4.179 4.094 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
868 1 40 ASP H 1 40 ASP HB2 3.660 . 3.660 2.172 2.096 2.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
869 1 40 ASP H 1 40 ASP QB 3.190 . 3.190 2.137 2.069 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
870 1 40 ASP H 1 40 ASP HB3 3.660 . 3.660 3.251 2.767 3.581 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
871 1 40 ASP H 1 41 GLU H 3.490 . 3.490 2.667 2.575 2.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
872 1 40 ASP H 1 41 GLU QB 4.950 . 4.950 4.409 4.228 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
873 1 40 ASP H 1 43 ALA MB 5.030 . 5.030 4.703 4.534 4.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
874 1 40 ASP HA 1 43 ALA H 3.950 . 3.950 3.179 2.983 3.405 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
875 1 40 ASP HA 1 43 ALA MB 2.960 . 2.960 2.499 2.291 2.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
876 1 40 ASP HA 1 80 MET ME 4.740 . 4.740 3.937 2.984 4.756 0.016 22 0 "[ . 1 . 2 . 3 . 4]" 1
877 1 40 ASP HA 1 81 LEU QD 4.850 . 4.850 4.182 4.006 4.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
878 1 40 ASP QB 1 41 GLU H 3.630 . 3.630 2.754 2.554 2.941 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
879 1 40 ASP QB 1 43 ALA MB 4.530 . 4.530 4.127 3.788 4.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
880 1 40 ASP HB2 1 41 GLU H 4.330 . 4.330 3.307 2.956 3.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
881 1 40 ASP HB3 1 41 GLU H 4.330 . 4.330 3.036 2.602 3.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
882 1 41 GLU H 1 41 GLU QB 3.220 . 3.220 2.240 2.082 2.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
883 1 41 GLU H 1 41 GLU HG2 4.660 . 4.660 4.532 4.350 4.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
884 1 41 GLU H 1 41 GLU HG3 4.660 . 4.660 4.433 4.165 4.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
885 1 41 GLU H 1 42 LEU H 3.410 . 3.410 2.686 2.598 2.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
886 1 41 GLU H 1 43 ALA H 4.310 . 4.310 4.106 3.997 4.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
887 1 41 GLU H 1 43 ALA MB 5.490 . 5.490 4.800 4.697 4.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
888 1 41 GLU H 1 44 SER H 5.500 . 5.500 4.900 4.758 5.000 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
889 1 41 GLU H 1 81 LEU QD 5.440 . 5.440 5.239 5.101 5.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
890 1 41 GLU HA 1 41 GLU HG2 3.910 . 3.910 3.492 2.872 3.951 0.041 31 0 "[ . 1 . 2 . 3 . 4]" 1
891 1 41 GLU HA 1 41 GLU HG3 3.910 . 3.910 2.909 2.509 3.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
892 1 41 GLU QB 1 42 LEU H 3.690 . 3.690 2.521 2.438 2.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
893 1 41 GLU QB 1 43 ALA H 5.230 . 5.230 4.697 4.595 4.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
894 1 41 GLU QG 1 42 LEU H 4.870 . 4.870 3.508 2.992 3.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
895 1 41 GLU QG 1 45 LEU MD1 4.470 . 4.470 2.971 2.616 3.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
896 1 41 GLU QG 1 45 LEU MD2 4.310 . 4.310 3.166 2.665 3.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
897 1 42 LEU H 1 42 LEU HB2 3.550 . 3.550 2.221 2.025 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
898 1 42 LEU H 1 42 LEU HB3 3.680 . 3.680 2.843 2.471 3.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
899 1 42 LEU H 1 42 LEU MD1 4.370 . 4.370 4.071 3.987 4.219 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
900 1 42 LEU H 1 42 LEU MD2 4.370 . 4.370 4.238 4.016 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
901 1 42 LEU H 1 42 LEU HG 4.540 . 4.540 4.139 3.687 4.553 0.013 9 0 "[ . 1 . 2 . 3 . 4]" 1
902 1 42 LEU H 1 43 ALA H 3.670 . 3.670 2.662 2.575 2.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
903 1 42 LEU H 1 43 ALA MB 4.330 . 4.330 4.333 4.271 4.362 0.032 22 0 "[ . 1 . 2 . 3 . 4]" 1
904 1 42 LEU H 1 44 SER H 4.830 . 4.830 4.102 4.023 4.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
905 1 42 LEU H 1 45 LEU MD1 4.790 . 4.790 4.481 4.237 4.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
906 1 42 LEU H 1 45 LEU HG 5.500 . 5.500 4.560 4.330 4.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
907 1 42 LEU H 1 81 LEU QD 4.810 . 4.810 3.897 3.698 4.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
908 1 42 LEU HA 1 42 LEU MD1 3.950 . 3.950 2.984 2.061 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
909 1 42 LEU HA 1 42 LEU QD 2.880 . 2.880 2.189 2.053 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
910 1 42 LEU HA 1 42 LEU MD2 3.950 . 3.950 2.932 2.161 3.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
911 1 42 LEU HA 1 45 LEU H 4.740 . 4.740 3.169 2.972 3.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
912 1 42 LEU HA 1 45 LEU HB2 4.770 . 4.770 2.764 2.476 3.147 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
913 1 42 LEU HA 1 45 LEU HB3 5.120 . 5.120 4.240 4.033 4.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
914 1 42 LEU HA 1 45 LEU MD1 3.390 . 3.390 2.322 2.048 2.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
915 1 42 LEU HA 1 45 LEU MD2 4.190 . 4.190 4.172 3.899 4.263 0.073 31 0 "[ . 1 . 2 . 3 . 4]" 1
916 1 42 LEU HA 1 45 LEU HG 4.230 . 4.230 2.617 2.233 2.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
917 1 42 LEU HB2 1 42 LEU MD1 3.610 . 3.610 2.400 2.212 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
918 1 42 LEU HB2 1 42 LEU QD 3.030 . 3.030 2.168 2.039 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
919 1 42 LEU HB2 1 42 LEU MD2 3.610 . 3.610 2.807 2.090 3.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
920 1 42 LEU HB2 1 43 ALA H 4.300 . 4.300 3.587 3.195 3.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
921 1 42 LEU HB2 1 81 LEU QD 4.480 . 4.480 3.243 2.912 3.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
922 1 42 LEU HB3 1 42 LEU MD1 3.630 . 3.630 2.797 2.290 3.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
923 1 42 LEU HB3 1 42 LEU QD 3.110 . 3.110 2.251 2.122 2.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
924 1 42 LEU HB3 1 42 LEU MD2 3.630 . 3.630 2.429 2.317 2.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
925 1 42 LEU HB3 1 43 ALA H 3.970 . 3.970 2.732 2.500 2.956 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
926 1 42 LEU HB3 1 43 ALA MB 4.320 . 4.320 4.016 3.795 4.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
927 1 42 LEU HB3 1 81 LEU MD1 3.830 . 3.830 2.417 2.160 2.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
928 1 42 LEU HB3 1 81 LEU QD 3.290 . 3.290 2.194 1.936 2.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
929 1 42 LEU HB3 1 81 LEU MD2 3.830 . 3.830 2.580 2.153 3.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
930 1 42 LEU QD 1 43 ALA H 4.110 . 4.110 3.955 3.714 4.125 0.015 19 0 "[ . 1 . 2 . 3 . 4]" 1
931 1 42 LEU QD 1 43 ALA HA 5.010 . 5.010 4.089 3.739 4.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
932 1 42 LEU QD 1 44 SER H 4.910 . 4.910 4.905 4.785 5.017 0.107 22 0 "[ . 1 . 2 . 3 . 4]" 1
933 1 42 LEU QD 1 45 LEU H 4.260 . 4.260 3.860 3.593 4.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
934 1 42 LEU QD 1 45 LEU HA 5.210 . 5.210 5.095 4.834 5.309 0.099 20 0 "[ . 1 . 2 . 3 . 4]" 1
935 1 42 LEU QD 1 45 LEU HB2 4.370 . 4.370 2.492 2.185 2.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
936 1 42 LEU QD 1 45 LEU HB3 4.850 . 4.850 3.631 3.363 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
937 1 42 LEU QD 1 45 LEU MD1 3.190 . 3.190 2.287 2.066 2.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
938 1 42 LEU QD 1 45 LEU MD2 4.400 . 4.400 4.369 4.214 4.553 0.153 13 0 "[ . 1 . 2 . 3 . 4]" 1
939 1 42 LEU QD 1 45 LEU HG 4.580 . 4.580 3.711 3.510 3.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
940 1 42 LEU QD 1 58 MET ME 2.920 . 2.920 2.027 1.930 2.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
941 1 42 LEU QD 1 81 LEU QD 2.900 . 2.900 2.116 1.904 2.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
942 1 42 LEU QD 1 85 PHE QD 5.190 . 5.190 4.216 3.904 4.525 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
943 1 42 LEU QD 1 85 PHE HZ 3.270 . 3.270 2.140 1.962 2.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
944 1 42 LEU MD1 1 43 ALA H 4.970 . 4.970 4.584 4.196 4.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
945 1 42 LEU MD1 1 85 PHE QE 3.560 . 3.560 3.065 2.489 3.561 0.001 4 0 "[ . 1 . 2 . 3 . 4]" 1
946 1 42 LEU MD1 1 85 PHE HZ 3.840 . 3.840 2.839 1.997 3.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
947 1 42 LEU MD2 1 43 ALA H 4.970 . 4.970 4.379 4.010 4.971 0.001 9 0 "[ . 1 . 2 . 3 . 4]" 1
948 1 42 LEU MD2 1 85 PHE QE 3.560 . 3.560 2.741 2.202 3.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
949 1 42 LEU MD2 1 85 PHE HZ 3.840 . 3.840 2.496 2.038 3.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
950 1 42 LEU HG 1 43 ALA H 4.920 . 4.920 4.582 3.926 4.966 0.046 32 0 "[ . 1 . 2 . 3 . 4]" 1
951 1 42 LEU HG 1 45 LEU MD1 5.130 . 5.130 3.530 2.315 4.910 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
952 1 42 LEU HG 1 81 LEU QD 4.620 . 4.620 3.170 2.013 4.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
953 1 42 LEU HG 1 85 PHE HZ 4.750 . 4.750 4.104 2.962 4.775 0.025 33 0 "[ . 1 . 2 . 3 . 4]" 1
954 1 43 ALA H 1 43 ALA MB 2.790 . 2.790 2.234 2.204 2.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
955 1 43 ALA H 1 44 SER H 3.560 . 3.560 2.623 2.536 2.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
956 1 43 ALA H 1 45 LEU H 4.650 . 4.650 4.009 3.950 4.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
957 1 43 ALA H 1 80 MET ME 5.500 . 5.500 4.662 4.136 5.518 0.018 29 0 "[ . 1 . 2 . 3 . 4]" 1
958 1 43 ALA H 1 81 LEU MD1 3.960 . 3.960 3.336 3.139 3.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
959 1 43 ALA H 1 81 LEU QD 3.410 . 3.410 2.833 2.699 2.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
960 1 43 ALA H 1 81 LEU MD2 3.960 . 3.960 3.082 2.810 3.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
961 1 43 ALA HA 1 45 LEU H 5.200 . 5.200 4.122 3.855 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
962 1 43 ALA HA 1 81 LEU QD 2.960 . 2.960 2.193 2.091 2.326 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
963 1 43 ALA MB 1 44 SER H 3.150 . 3.150 2.649 2.578 2.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
964 1 43 ALA MB 1 45 LEU H 4.530 . 4.530 4.421 4.327 4.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
965 1 43 ALA MB 1 80 MET ME 3.100 . 3.100 2.374 1.944 3.125 0.025 13 0 "[ . 1 . 2 . 3 . 4]" 1
966 1 43 ALA MB 1 81 LEU MD1 3.390 . 3.390 3.175 2.817 3.412 0.022 27 0 "[ . 1 . 2 . 3 . 4]" 1
967 1 43 ALA MB 1 81 LEU QD 2.950 . 2.950 2.587 2.263 2.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
968 1 43 ALA MB 1 81 LEU MD2 3.390 . 3.390 2.755 2.323 3.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
969 1 43 ALA MB 1 84 LYS QE 5.500 . 5.500 5.357 4.787 5.550 0.050 38 0 "[ . 1 . 2 . 3 . 4]" 1
970 1 44 SER H 1 44 SER HB2 3.970 . 3.970 2.495 2.469 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
971 1 44 SER H 1 44 SER QB 3.350 . 3.350 2.451 2.428 2.467 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
972 1 44 SER H 1 44 SER HB3 3.970 . 3.970 3.598 3.580 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
973 1 44 SER H 1 45 LEU H 3.250 . 3.250 2.514 2.406 2.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
974 1 44 SER H 1 45 LEU HB2 4.900 . 4.900 4.710 4.470 4.901 0.001 26 0 "[ . 1 . 2 . 3 . 4]" 1
975 1 44 SER H 1 45 LEU MD1 5.500 . 5.500 5.308 4.906 5.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
976 1 44 SER H 1 45 LEU MD2 5.200 . 5.200 5.089 4.915 5.228 0.028 40 0 "[ . 1 . 2 . 3 . 4]" 1
977 1 44 SER H 1 45 LEU HG 4.310 . 4.310 4.270 4.018 4.322 0.012 38 0 "[ . 1 . 2 . 3 . 4]" 1
978 1 45 LEU H 1 45 LEU HB2 3.460 . 3.460 2.407 2.297 2.497 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
979 1 45 LEU H 1 45 LEU HB3 3.710 . 3.710 3.601 3.548 3.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
980 1 45 LEU H 1 45 LEU MD1 4.300 . 4.300 3.792 3.603 3.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
981 1 45 LEU H 1 45 LEU MD2 4.240 . 4.240 3.517 3.307 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
982 1 45 LEU H 1 45 LEU HG 3.540 . 3.540 2.605 2.435 2.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
983 1 45 LEU H 1 46 GLN H 4.810 . 4.810 3.744 2.582 4.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
984 1 45 LEU H 1 47 VAL QG 4.940 . 4.940 4.399 4.136 4.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
985 1 45 LEU HA 1 45 LEU MD1 3.960 . 3.960 3.828 3.790 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
986 1 45 LEU HA 1 45 LEU MD2 2.890 . 2.890 2.089 1.986 2.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
987 1 45 LEU HA 1 46 GLN H 3.540 . 3.540 2.689 2.037 3.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
988 1 45 LEU HB2 1 45 LEU MD1 3.290 . 3.290 2.325 2.226 2.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
989 1 45 LEU HB2 1 45 LEU MD2 3.450 . 3.450 3.234 3.203 3.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
990 1 45 LEU HB2 1 46 GLN H 5.030 . 5.030 3.615 2.585 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
991 1 45 LEU HB2 1 47 VAL QG 3.830 . 3.830 2.660 2.369 3.177 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
992 1 45 LEU HB3 1 45 LEU MD1 3.370 . 3.370 2.304 2.227 2.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
993 1 45 LEU HB3 1 45 LEU MD2 3.280 . 3.280 2.447 2.367 2.540 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
994 1 45 LEU HB3 1 46 GLN H 4.740 . 4.740 3.397 3.141 3.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
995 1 45 LEU HB3 1 47 VAL H 4.560 . 4.560 3.570 3.061 3.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
996 1 45 LEU HB3 1 47 VAL QG 3.790 . 3.790 2.675 2.316 3.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
997 1 45 LEU MD1 1 46 GLN H 4.910 . 4.910 4.818 4.533 4.948 0.038 8 0 "[ . 1 . 2 . 3 . 4]" 1
998 1 45 LEU MD1 1 47 VAL H 5.500 . 5.500 4.810 4.333 5.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
999 1 45 LEU MD1 1 47 VAL QG 3.940 . 3.940 2.963 2.621 3.784 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1000 1 45 LEU MD1 1 58 MET ME 4.470 . 4.470 4.364 4.147 4.545 0.075 30 0 "[ . 1 . 2 . 3 . 4]" 1
1001 1 45 LEU MD2 1 46 GLN H 4.890 . 4.890 4.011 3.376 4.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1002 1 45 LEU MD2 1 47 VAL H 5.500 . 5.500 5.350 4.926 5.544 0.044 33 0 "[ . 1 . 2 . 3 . 4]" 1
1003 1 46 GLN H 1 46 GLN HB2 4.040 . 4.040 2.925 2.404 3.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1004 1 46 GLN H 1 46 GLN HB3 4.040 . 4.040 3.802 3.604 4.054 0.014 13 0 "[ . 1 . 2 . 3 . 4]" 1
1005 1 46 GLN H 1 46 GLN HG2 4.330 . 4.330 3.527 2.988 3.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1006 1 46 GLN H 1 46 GLN QG 3.780 . 3.780 2.544 2.337 2.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1007 1 46 GLN H 1 46 GLN HG3 4.330 . 4.330 2.630 2.371 3.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1008 1 46 GLN H 1 47 VAL H 4.380 . 4.380 3.307 2.752 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1009 1 46 GLN H 1 47 VAL QG 4.550 . 4.550 3.934 3.363 4.583 0.033 8 0 "[ . 1 . 2 . 3 . 4]" 1
1010 1 46 GLN HA 1 46 GLN HG2 3.910 . 3.910 2.540 2.361 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1011 1 46 GLN HA 1 46 GLN HG3 3.910 . 3.910 3.115 2.978 3.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1012 1 46 GLN HA 1 47 VAL H 3.040 . 3.040 2.517 2.336 2.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1013 1 46 GLN HB2 1 47 VAL H 4.760 . 4.760 4.434 4.362 4.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1014 1 46 GLN HB3 1 47 VAL H 4.760 . 4.760 4.355 4.204 4.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1015 1 46 GLN QG 1 47 VAL H 4.570 . 4.570 4.487 4.390 4.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1016 1 47 VAL H 1 47 VAL HB 3.150 . 3.150 2.653 2.533 2.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1017 1 47 VAL H 1 47 VAL MG1 3.970 . 3.970 3.378 1.680 3.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1018 1 47 VAL H 1 47 VAL QG 2.930 . 2.930 1.895 1.677 2.102 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1019 1 47 VAL H 1 47 VAL MG2 3.970 . 3.970 2.294 1.722 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1020 1 47 VAL H 1 48 THR H 4.690 . 4.690 4.614 4.566 4.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1021 1 47 VAL H 1 88 MET ME 4.800 . 4.800 4.613 3.998 4.835 0.035 22 0 "[ . 1 . 2 . 3 . 4]" 1
1022 1 47 VAL HA 1 47 VAL MG1 3.350 . 3.350 2.529 2.317 3.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1023 1 47 VAL HA 1 47 VAL QG 2.840 . 2.840 2.198 2.115 2.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1024 1 47 VAL HA 1 47 VAL MG2 3.350 . 3.350 2.464 2.397 2.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1025 1 47 VAL HA 1 48 THR H 3.080 . 3.080 2.187 2.137 2.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1026 1 47 VAL HA 1 51 GLN HB2 4.720 . 4.720 4.088 3.809 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1027 1 47 VAL HB 1 48 THR H 4.250 . 4.250 4.016 3.658 4.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1028 1 47 VAL HB 1 85 PHE QE 4.380 . 4.380 2.737 2.030 4.416 0.036 17 0 "[ . 1 . 2 . 3 . 4]" 1
1029 1 47 VAL HB 1 85 PHE HZ 4.760 . 4.760 3.680 2.777 4.757 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1030 1 47 VAL QG 1 48 THR H 3.110 . 3.110 2.513 2.370 2.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1031 1 47 VAL QG 1 51 GLN H 3.980 . 3.980 3.781 3.616 3.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1032 1 47 VAL QG 1 51 GLN HA 4.620 . 4.620 4.405 4.114 4.633 0.013 37 0 "[ . 1 . 2 . 3 . 4]" 1
1033 1 47 VAL QG 1 51 GLN HB2 3.380 . 3.380 2.263 2.046 2.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1034 1 47 VAL QG 1 51 GLN HB3 3.490 . 3.490 2.774 2.449 3.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1035 1 47 VAL QG 1 51 GLN QG 4.170 . 4.170 3.813 3.507 4.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1036 1 47 VAL QG 1 52 ALA H 3.470 . 3.470 2.841 2.683 3.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1037 1 47 VAL QG 1 52 ALA HA 3.780 . 3.780 3.090 2.766 3.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1038 1 47 VAL QG 1 52 ALA MB 3.090 . 3.090 2.596 2.410 2.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1039 1 47 VAL QG 1 55 HIS HD2 4.660 . 4.660 3.810 3.081 4.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1040 1 47 VAL QG 1 58 MET ME 4.370 . 4.370 3.180 2.918 3.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1041 1 47 VAL QG 1 85 PHE QD 4.280 . 4.280 3.845 3.514 4.288 0.008 39 0 "[ . 1 . 2 . 3 . 4]" 1
1042 1 47 VAL QG 1 85 PHE QE 3.090 . 3.090 2.263 1.966 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1043 1 47 VAL QG 1 85 PHE HZ 3.450 . 3.450 2.531 2.083 2.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1044 1 47 VAL QG 1 88 MET ME 3.210 . 3.210 2.773 2.277 3.241 0.031 29 0 "[ . 1 . 2 . 3 . 4]" 1
1045 1 47 VAL MG1 1 48 THR H 4.040 . 4.040 2.856 2.386 4.157 0.117 11 0 "[ . 1 . 2 . 3 . 4]" 1
1046 1 47 VAL MG1 1 52 ALA MB 4.450 . 4.450 2.819 2.421 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1047 1 47 VAL MG1 1 85 PHE QD 5.500 . 5.500 4.053 3.692 4.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1048 1 47 VAL MG1 1 85 PHE QE 3.530 . 3.530 2.354 2.023 3.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1049 1 47 VAL MG1 1 85 PHE HZ 4.730 . 4.730 3.164 2.096 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1050 1 47 VAL MG1 1 88 MET ME 4.630 . 4.630 2.874 2.477 3.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1051 1 47 VAL MG2 1 48 THR H 4.040 . 4.040 3.759 2.385 4.099 0.059 34 0 "[ . 1 . 2 . 3 . 4]" 1
1052 1 47 VAL MG2 1 52 ALA MB 4.450 . 4.450 4.118 2.536 4.577 0.127 34 0 "[ . 1 . 2 . 3 . 4]" 1
1053 1 47 VAL MG2 1 85 PHE QD 5.500 . 5.500 4.839 3.984 5.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1054 1 47 VAL MG2 1 85 PHE QE 3.530 . 3.530 3.002 2.299 3.421 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1055 1 47 VAL MG2 1 85 PHE HZ 4.730 . 4.730 2.881 2.425 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1056 1 47 VAL MG2 1 88 MET ME 4.630 . 4.630 3.955 2.575 4.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1057 1 48 THR H 1 48 THR HG1 4.750 . 4.750 3.095 2.731 3.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1058 1 48 THR H 1 48 THR MG 2.950 . 2.950 2.266 1.977 2.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1059 1 48 THR H 1 51 GLN H 4.390 . 4.390 3.955 3.724 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1060 1 48 THR H 1 51 GLN HB2 3.930 . 3.930 2.870 2.554 3.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1061 1 48 THR H 1 51 GLN HB3 4.570 . 4.570 4.348 3.958 4.573 0.003 25 0 "[ . 1 . 2 . 3 . 4]" 1
1062 1 48 THR H 1 51 GLN QG 5.310 . 5.310 3.934 3.297 4.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1063 1 48 THR H 1 52 ALA H 4.780 . 4.780 4.478 4.246 4.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1064 1 48 THR H 1 88 MET ME 4.540 . 4.540 4.181 3.899 4.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1065 1 48 THR HA 1 50 GLN H 4.750 . 4.750 4.407 4.193 4.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1066 1 48 THR HA 1 88 MET ME 3.600 . 3.600 3.254 2.909 3.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1067 1 48 THR HB 1 49 MET H 3.960 . 3.960 2.519 2.349 2.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1068 1 48 THR HB 1 50 GLN H 4.010 . 4.010 2.993 2.666 3.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1069 1 48 THR HB 1 50 GLN QB 4.870 . 4.870 4.025 3.600 4.456 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1070 1 48 THR HB 1 88 MET ME 4.930 . 4.930 4.882 4.536 4.964 0.034 7 0 "[ . 1 . 2 . 3 . 4]" 1
1071 1 48 THR HG1 1 48 THR MG 3.410 . 3.410 2.121 2.008 2.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1072 1 48 THR HG1 1 50 GLN H 4.560 . 4.560 3.735 3.222 3.969 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1073 1 48 THR HG1 1 50 GLN QB 4.720 . 4.720 3.396 2.763 3.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1074 1 48 THR HG1 1 51 GLN H 4.350 . 4.350 3.073 2.571 3.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1075 1 48 THR HG1 1 51 GLN QG 4.630 . 4.630 2.683 2.310 3.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1076 1 48 THR MG 1 49 MET H 4.000 . 4.000 3.846 3.733 4.011 0.011 15 0 "[ . 1 . 2 . 3 . 4]" 1
1077 1 48 THR MG 1 50 GLN H 4.690 . 4.690 4.420 4.239 4.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1078 1 48 THR MG 1 51 GLN H 4.500 . 4.500 4.361 3.977 4.531 0.031 13 0 "[ . 1 . 2 . 3 . 4]" 1
1079 1 48 THR MG 1 51 GLN HB2 4.600 . 4.600 4.238 3.604 4.605 0.005 3 0 "[ . 1 . 2 . 3 . 4]" 1
1080 1 48 THR MG 1 51 GLN HE21 4.280 . 4.280 3.305 2.769 3.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1081 1 48 THR MG 1 51 GLN HE22 4.280 . 4.280 3.501 2.551 4.348 0.068 15 0 "[ . 1 . 2 . 3 . 4]" 1
1082 1 48 THR MG 1 51 GLN QG 4.730 . 4.730 3.984 3.675 4.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1083 1 48 THR MG 1 88 MET ME 4.880 . 4.880 4.761 4.530 4.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1084 1 49 MET H 1 49 MET ME 5.500 . 5.500 4.762 4.331 5.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1085 1 49 MET H 1 49 MET HG2 4.480 . 4.480 3.184 2.348 4.430 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1086 1 49 MET H 1 49 MET QG 3.850 . 3.850 2.950 2.310 3.887 0.037 18 0 "[ . 1 . 2 . 3 . 4]" 1
1087 1 49 MET H 1 49 MET HG3 4.480 . 4.480 3.768 2.822 4.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1088 1 49 MET H 1 50 GLN H 3.890 . 3.890 2.829 2.686 3.001 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1089 1 49 MET H 1 88 MET QB 4.750 . 4.750 3.964 3.651 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1090 1 49 MET H 1 88 MET ME 4.130 . 4.130 3.400 2.869 3.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1091 1 49 MET HA 1 49 MET ME 4.300 . 4.300 4.067 3.567 4.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1092 1 49 MET HA 1 49 MET QG 3.660 . 3.660 3.000 2.334 3.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1093 1 49 MET HA 1 51 GLN H 4.760 . 4.760 4.328 4.128 4.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1094 1 49 MET HA 1 52 ALA H 4.010 . 4.010 3.308 3.124 3.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1095 1 49 MET HA 1 52 ALA MB 3.150 . 3.150 2.384 2.207 2.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1096 1 49 MET HA 1 88 MET ME 3.290 . 3.290 2.304 2.063 2.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1097 1 49 MET HA 1 89 PHE QE 4.740 . 4.740 3.823 3.294 4.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1098 1 49 MET QB 1 50 GLN H 3.720 . 3.720 3.217 2.435 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1099 1 49 MET QB 1 89 PHE QE 4.790 . 4.790 3.755 2.947 4.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1100 1 49 MET HB2 1 50 GLN H 4.250 . 4.250 3.955 3.741 4.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1101 1 49 MET HB2 1 89 PHE QE 5.500 . 5.500 4.077 2.983 5.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1102 1 49 MET HB3 1 50 GLN H 4.250 . 4.250 3.516 2.465 4.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1103 1 49 MET HB3 1 89 PHE QE 5.500 . 5.500 4.804 4.574 5.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1104 1 49 MET ME 1 49 MET QG 3.270 . 3.270 2.300 2.136 2.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1105 1 49 MET ME 1 50 GLN H 4.810 . 4.810 4.069 3.051 4.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1106 1 49 MET ME 1 50 GLN HA 4.020 . 4.020 3.524 2.210 4.057 0.037 3 0 "[ . 1 . 2 . 3 . 4]" 1
1107 1 49 MET ME 1 52 ALA MB 4.790 . 4.790 4.698 4.125 4.824 0.034 31 0 "[ . 1 . 2 . 3 . 4]" 1
1108 1 49 MET ME 1 53 GLN HB2 4.040 . 4.040 3.799 3.091 4.126 0.086 8 0 "[ . 1 . 2 . 3 . 4]" 1
1109 1 49 MET ME 1 53 GLN QG 4.520 . 4.520 4.360 3.502 4.592 0.072 7 0 "[ . 1 . 2 . 3 . 4]" 1
1110 1 49 MET ME 1 89 PHE HA 4.040 . 4.040 3.234 2.130 4.077 0.037 4 0 "[ . 1 . 2 . 3 . 4]" 1
1111 1 49 MET ME 1 89 PHE QD 3.630 . 3.630 2.562 2.093 3.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1112 1 49 MET ME 1 89 PHE QE 3.700 . 3.700 2.482 2.124 2.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1113 1 49 MET QG 1 50 GLN H 4.630 . 4.630 2.989 2.099 4.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1114 1 49 MET QG 1 89 PHE QE 5.240 . 5.240 3.636 2.452 4.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1115 1 49 MET QG 1 89 PHE HZ 5.340 . 5.340 4.280 3.042 5.344 0.004 11 0 "[ . 1 . 2 . 3 . 4]" 1
1116 1 50 GLN H 1 50 GLN QB 3.070 . 3.070 2.420 2.340 2.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1117 1 50 GLN H 1 50 GLN HG2 4.390 . 4.390 3.479 2.518 3.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1118 1 50 GLN H 1 50 GLN QG 3.830 . 3.830 2.423 2.185 3.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1119 1 50 GLN H 1 50 GLN HG3 4.390 . 4.390 2.504 2.222 3.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1120 1 50 GLN H 1 51 GLN H 3.570 . 3.570 2.622 2.528 2.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1121 1 50 GLN H 1 51 GLN QG 5.240 . 5.240 4.495 4.202 4.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1122 1 50 GLN H 1 52 ALA H 4.410 . 4.410 3.982 3.790 4.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1123 1 50 GLN H 1 88 MET ME 4.990 . 4.990 4.908 4.600 5.043 0.053 18 0 "[ . 1 . 2 . 3 . 4]" 1
1124 1 50 GLN HA 1 50 GLN HG2 4.000 . 4.000 2.633 2.338 3.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1125 1 50 GLN HA 1 50 GLN QG 3.500 . 3.500 2.381 2.295 2.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1126 1 50 GLN HA 1 50 GLN HG3 4.000 . 4.000 3.039 2.439 3.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1127 1 50 GLN HA 1 53 GLN H 4.430 . 4.430 3.406 3.255 3.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1128 1 50 GLN HA 1 53 GLN HB2 4.650 . 4.650 2.916 2.683 3.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1129 1 50 GLN HA 1 53 GLN HB3 4.690 . 4.690 3.210 2.727 3.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1130 1 50 GLN HA 1 53 GLN HG2 5.500 . 5.500 5.293 4.813 5.514 0.014 25 0 "[ . 1 . 2 . 3 . 4]" 1
1131 1 50 GLN HA 1 53 GLN QG 4.840 . 4.840 4.539 4.072 4.846 0.006 28 0 "[ . 1 . 2 . 3 . 4]" 1
1132 1 50 GLN HA 1 53 GLN HG3 5.500 . 5.500 4.951 4.380 5.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1133 1 50 GLN QB 1 51 GLN H 3.640 . 3.640 2.738 2.554 2.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1134 1 51 GLN H 1 51 GLN HB2 3.590 . 3.590 2.365 2.242 2.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1135 1 51 GLN H 1 51 GLN HB3 3.760 . 3.760 3.596 3.542 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1136 1 51 GLN H 1 51 GLN HG2 3.980 . 3.980 3.776 3.480 3.996 0.016 8 0 "[ . 1 . 2 . 3 . 4]" 1
1137 1 51 GLN H 1 51 GLN QG 3.460 . 3.460 2.498 2.297 2.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1138 1 51 GLN H 1 51 GLN HG3 3.980 . 3.980 2.536 2.327 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1139 1 51 GLN H 1 52 ALA H 3.440 . 3.440 2.456 2.377 2.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1140 1 51 GLN H 1 52 ALA MB 4.540 . 4.540 4.140 4.059 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1141 1 51 GLN H 1 53 GLN H 4.800 . 4.800 3.932 3.784 4.095 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1142 1 51 GLN HA 1 51 GLN QG 3.730 . 3.730 2.386 2.296 2.462 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1143 1 51 GLN HA 1 52 ALA MB 5.300 . 5.300 5.026 5.007 5.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1144 1 51 GLN HA 1 53 GLN H 4.780 . 4.780 4.106 3.920 4.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1145 1 51 GLN HA 1 55 HIS HD2 5.030 . 5.030 3.766 3.189 4.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1146 1 51 GLN HB2 1 52 ALA H 3.720 . 3.720 2.743 2.570 2.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1147 1 51 GLN HB2 1 52 ALA MB 4.290 . 4.290 4.148 3.989 4.305 0.015 19 0 "[ . 1 . 2 . 3 . 4]" 1
1148 1 51 GLN HB3 1 52 ALA H 4.080 . 4.080 3.702 3.535 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1149 1 52 ALA H 1 52 ALA MB 2.940 . 2.940 2.224 2.212 2.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1150 1 52 ALA H 1 53 GLN H 3.640 . 3.640 2.644 2.566 2.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1151 1 52 ALA H 1 54 LYS H 4.850 . 4.850 4.150 3.987 4.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1152 1 52 ALA H 1 88 MET ME 4.090 . 4.090 3.741 3.520 4.098 0.008 5 0 "[ . 1 . 2 . 3 . 4]" 1
1153 1 52 ALA HA 1 54 LYS H 4.780 . 4.780 3.990 3.825 4.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1154 1 52 ALA HA 1 55 HIS H 4.200 . 4.200 3.264 3.069 3.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1155 1 52 ALA HA 1 55 HIS HB2 4.590 . 4.590 2.895 2.576 3.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1156 1 52 ALA HA 1 55 HIS HD2 5.100 . 5.100 3.631 2.675 4.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1157 1 52 ALA HA 1 58 MET ME 5.080 . 5.080 4.256 3.919 4.614 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1158 1 52 ALA HA 1 59 ILE MD 4.020 . 4.020 3.196 2.802 3.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1159 1 52 ALA HA 1 88 MET ME 5.500 . 5.500 4.485 4.265 4.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1160 1 52 ALA MB 1 53 GLN H 3.360 . 3.360 2.656 2.578 2.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1161 1 52 ALA MB 1 53 GLN HB2 4.540 . 4.540 4.077 3.945 4.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1162 1 52 ALA MB 1 54 LYS H 4.720 . 4.720 4.441 4.317 4.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1163 1 52 ALA MB 1 55 HIS H 4.660 . 4.660 4.454 4.324 4.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1164 1 52 ALA MB 1 55 HIS HB2 4.620 . 4.620 4.370 4.088 4.627 0.007 35 0 "[ . 1 . 2 . 3 . 4]" 1
1165 1 52 ALA MB 1 59 ILE MD 3.110 . 3.110 2.172 2.072 2.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1166 1 52 ALA MB 1 85 PHE QD 3.470 . 3.470 2.271 2.127 2.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1167 1 52 ALA MB 1 85 PHE QE 3.610 . 3.610 2.465 2.190 3.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1168 1 52 ALA MB 1 88 MET ME 3.040 . 3.040 2.287 2.129 2.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1169 1 52 ALA MB 1 89 PHE QD 4.840 . 4.840 4.156 3.943 4.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1170 1 52 ALA MB 1 89 PHE QE 3.250 . 3.250 2.330 2.070 2.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1171 1 52 ALA MB 1 89 PHE HZ 3.300 . 3.300 2.349 2.019 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1172 1 53 GLN H 1 53 GLN HB2 3.500 . 3.500 2.265 2.097 2.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1173 1 53 GLN H 1 53 GLN HB3 3.530 . 3.530 2.679 2.545 3.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1174 1 53 GLN H 1 53 GLN HG2 4.610 . 4.610 4.452 3.926 4.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1175 1 53 GLN H 1 53 GLN HG3 4.610 . 4.610 4.339 4.158 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1176 1 53 GLN H 1 54 LYS H 3.590 . 3.590 2.703 2.636 2.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1177 1 53 GLN H 1 55 HIS H 4.590 . 4.590 4.168 4.012 4.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1178 1 53 GLN H 1 56 THR MG 5.500 . 5.500 4.944 4.490 5.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1179 1 53 GLN H 1 59 ILE MD 5.020 . 5.020 4.585 4.412 4.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1180 1 53 GLN H 1 89 PHE QE 5.050 . 5.050 3.753 3.473 3.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1181 1 53 GLN H 1 89 PHE HZ 4.410 . 4.410 2.567 2.406 2.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1182 1 53 GLN HA 1 53 GLN HG2 4.190 . 4.190 2.839 2.397 3.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1183 1 53 GLN HA 1 53 GLN QG 3.530 . 3.530 2.432 2.326 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1184 1 53 GLN HA 1 53 GLN HG3 4.190 . 4.190 2.759 2.460 3.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1185 1 53 GLN HA 1 55 HIS H 4.800 . 4.800 4.352 3.761 4.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1186 1 53 GLN HA 1 59 ILE MD 4.590 . 4.590 3.926 3.715 4.161 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1187 1 53 GLN HA 1 89 PHE QE 5.090 . 5.090 3.548 3.173 3.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1188 1 53 GLN HA 1 89 PHE HZ 4.380 . 4.380 2.679 2.413 2.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1189 1 53 GLN HB2 1 54 LYS H 4.080 . 4.080 3.877 3.483 3.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1190 1 53 GLN HB3 1 54 LYS H 4.220 . 4.220 2.855 2.620 3.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1191 1 53 GLN HB3 1 89 PHE QE 4.940 . 4.940 4.218 3.863 4.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1192 1 53 GLN QG 1 89 PHE QE 4.940 . 4.940 2.892 2.370 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1193 1 53 GLN HG2 1 54 LYS H 5.290 . 5.290 4.469 4.162 5.269 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1194 1 53 GLN HG3 1 54 LYS H 5.290 . 5.290 5.159 5.002 5.293 0.003 40 0 "[ . 1 . 2 . 3 . 4]" 1
1195 1 54 LYS H 1 54 LYS HB2 3.620 . 3.620 2.438 2.268 2.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1196 1 54 LYS H 1 54 LYS QB 3.030 . 3.030 2.401 2.244 2.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1197 1 54 LYS H 1 54 LYS HB3 3.620 . 3.620 3.614 3.563 3.634 0.014 36 0 "[ . 1 . 2 . 3 . 4]" 1
1198 1 54 LYS H 1 54 LYS HG2 3.970 . 3.970 2.494 2.147 2.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1199 1 54 LYS H 1 54 LYS HG3 3.970 . 3.970 3.732 3.078 3.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1200 1 54 LYS H 1 55 HIS H 2.950 . 2.950 2.432 2.253 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1201 1 54 LYS HA 1 54 LYS HD2 3.670 . 3.670 3.062 2.887 3.674 0.004 19 0 "[ . 1 . 2 . 3 . 4]" 1
1202 1 54 LYS HA 1 54 LYS HD3 3.670 . 3.670 2.296 2.094 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1203 1 54 LYS HA 1 54 LYS QG 3.410 . 3.410 2.939 2.641 3.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1204 1 54 LYS HA 1 56 THR H 4.810 . 4.810 3.878 3.631 4.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1205 1 54 LYS QB 1 55 HIS H 3.460 . 3.460 2.781 2.380 3.401 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1206 1 54 LYS QB 1 55 HIS HD2 4.310 . 4.310 3.001 2.062 4.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1207 1 54 LYS HB2 1 55 HIS H 4.180 . 4.180 2.864 2.433 3.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1208 1 54 LYS HB3 1 55 HIS H 4.180 . 4.180 3.812 3.329 4.187 0.007 32 0 "[ . 1 . 2 . 3 . 4]" 1
1209 1 54 LYS QG 1 55 HIS H 4.790 . 4.790 4.173 3.845 4.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1210 1 55 HIS H 1 55 HIS HB2 3.570 . 3.570 2.495 2.353 2.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1211 1 55 HIS H 1 55 HIS HB3 3.730 . 3.730 3.676 3.606 3.749 0.019 11 0 "[ . 1 . 2 . 3 . 4]" 1
1212 1 55 HIS H 1 55 HIS HD2 3.390 . 3.390 3.108 2.680 3.398 0.008 1 0 "[ . 1 . 2 . 3 . 4]" 1
1213 1 55 HIS H 1 56 THR H 3.600 . 3.600 3.099 2.674 3.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1214 1 55 HIS H 1 56 THR MG 4.510 . 4.510 4.133 3.559 4.512 0.002 25 0 "[ . 1 . 2 . 3 . 4]" 1
1215 1 55 HIS H 1 59 ILE MD 5.340 . 5.340 4.364 4.014 4.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1216 1 55 HIS HA 1 56 THR MG 5.350 . 5.350 4.955 4.592 5.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1217 1 55 HIS HA 1 58 MET QB 4.550 . 4.550 4.106 3.725 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1218 1 55 HIS HA 1 58 MET ME 5.370 . 5.370 4.757 4.465 5.053 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1219 1 55 HIS HB2 1 58 MET ME 3.770 . 3.770 2.910 2.524 3.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1220 1 55 HIS HB3 1 56 THR H 5.450 . 5.450 4.477 4.422 4.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1221 1 55 HIS HB3 1 58 MET H 4.610 . 4.610 3.303 3.048 3.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1222 1 55 HIS HB3 1 58 MET HB2 4.880 . 4.880 3.046 2.797 3.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1223 1 55 HIS HB3 1 58 MET HB3 4.880 . 4.880 2.751 2.428 3.079 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1224 1 55 HIS HB3 1 58 MET ME 3.600 . 3.600 2.538 2.211 2.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1225 1 56 THR H 1 56 THR HB 3.800 . 3.800 3.474 3.376 3.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1226 1 56 THR H 1 56 THR MG 3.040 . 3.040 2.630 2.179 2.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1227 1 56 THR H 1 57 GLU H 3.790 . 3.790 2.652 2.465 2.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1228 1 56 THR H 1 57 GLU QB 5.070 . 5.070 4.858 4.293 5.073 0.003 38 0 "[ . 1 . 2 . 3 . 4]" 1
1229 1 56 THR H 1 57 GLU QG 4.190 . 4.190 3.842 3.378 4.238 0.048 31 0 "[ . 1 . 2 . 3 . 4]" 1
1230 1 56 THR HA 1 56 THR MG 3.070 . 3.070 2.220 2.150 2.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1231 1 56 THR HA 1 58 MET H 4.440 . 4.440 4.048 3.918 4.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1232 1 56 THR HA 1 59 ILE H 4.130 . 4.130 3.118 2.999 3.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1233 1 56 THR HA 1 59 ILE HB 3.720 . 3.720 2.739 2.566 2.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1234 1 56 THR HA 1 59 ILE MD 3.410 . 3.410 2.315 2.214 2.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1235 1 56 THR HA 1 59 ILE QG 4.050 . 4.050 2.841 2.506 3.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1236 1 56 THR HA 1 60 THR H 4.590 . 4.590 4.138 4.006 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1237 1 56 THR HB 1 57 GLU H 5.080 . 5.080 3.481 3.303 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1238 1 56 THR HB 1 59 ILE MD 4.710 . 4.710 4.352 3.896 4.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1239 1 56 THR MG 1 57 GLU H 4.520 . 4.520 4.155 4.034 4.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1240 1 56 THR MG 1 59 ILE H 5.030 . 5.030 4.795 4.628 4.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1241 1 56 THR MG 1 59 ILE MD 3.620 . 3.620 2.742 2.280 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1242 1 56 THR MG 1 60 THR H 5.500 . 5.500 5.133 4.903 5.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1243 1 56 THR MG 1 89 PHE QE 4.750 . 4.750 4.679 4.284 4.966 0.216 34 0 "[ . 1 . 2 . 3 . 4]" 1
1244 1 56 THR MG 1 130 THR HG1 4.010 . 4.010 12.417 9.883 17.515 13.505 9 40 [********+*************************-*****] 1
1245 1 56 THR MG 1 131 GLU HA 4.510 . 4.510 18.423 16.988 19.847 15.337 3 40 [**+***********************-*************] 1
1246 1 56 THR MG 1 131 GLU QG 4.190 . 4.190 16.867 14.875 18.550 14.360 22 40 [*********************+************-*****] 1
1247 1 57 GLU H 1 57 GLU QB 3.470 . 3.470 2.584 2.238 2.787 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1248 1 57 GLU H 1 57 GLU HG2 4.330 . 4.330 2.312 1.858 3.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1249 1 57 GLU H 1 57 GLU QG 3.760 . 3.760 2.029 1.850 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1250 1 57 GLU H 1 57 GLU HG3 4.330 . 4.330 2.946 1.933 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1251 1 57 GLU H 1 58 MET H 3.800 . 3.800 2.729 2.607 2.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1252 1 57 GLU HA 1 57 GLU QG 3.520 . 3.520 3.154 2.471 3.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1253 1 57 GLU HA 1 59 ILE H 5.500 . 5.500 4.332 4.116 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1254 1 57 GLU HA 1 60 THR H 4.150 . 4.150 3.526 3.139 3.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1255 1 57 GLU HA 1 60 THR HB 4.250 . 4.250 3.867 3.306 4.255 0.005 36 0 "[ . 1 . 2 . 3 . 4]" 1
1256 1 57 GLU HA 1 60 THR MG 3.920 . 3.920 2.417 2.160 3.008 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1257 1 57 GLU HA 1 61 THR H 5.150 . 5.150 4.302 4.050 4.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1258 1 57 GLU QB 1 58 MET H 3.710 . 3.710 2.995 2.400 3.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1259 1 57 GLU QB 1 60 THR H 5.500 . 5.500 4.948 4.712 5.208 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1260 1 57 GLU QB 1 61 THR H 5.500 . 5.500 4.949 4.709 5.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1261 1 57 GLU QG 1 58 MET H 4.300 . 4.300 3.107 1.883 4.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1262 1 58 MET H 1 58 MET HB2 3.590 . 3.590 2.527 2.436 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1263 1 58 MET H 1 58 MET HB3 3.590 . 3.590 2.499 2.415 2.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1264 1 58 MET H 1 58 MET ME 4.520 . 4.520 4.147 4.031 4.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1265 1 58 MET H 1 58 MET HG2 5.260 . 5.260 4.478 4.429 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1266 1 58 MET H 1 58 MET QG 4.510 . 4.510 3.988 3.953 4.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1267 1 58 MET H 1 58 MET HG3 5.260 . 5.260 4.474 4.426 4.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1268 1 58 MET H 1 59 ILE H 3.680 . 3.680 2.428 2.391 2.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1269 1 58 MET H 1 59 ILE HB 4.810 . 4.810 4.816 4.810 4.822 0.012 33 0 "[ . 1 . 2 . 3 . 4]" 1
1270 1 58 MET H 1 59 ILE MD 5.500 . 5.500 5.007 4.918 5.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1271 1 58 MET H 1 60 THR H 4.820 . 4.820 4.082 3.986 4.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1272 1 58 MET HA 1 58 MET ME 4.910 . 4.910 4.427 4.357 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1273 1 58 MET HA 1 58 MET QG 3.630 . 3.630 2.399 2.335 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1274 1 58 MET HA 1 61 THR H 4.240 . 4.240 3.212 3.125 3.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1275 1 58 MET HA 1 61 THR MG 4.260 . 4.260 3.656 3.429 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1276 1 58 MET HA 1 62 LEU H 5.030 . 5.030 4.096 3.989 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1277 1 58 MET QB 1 59 ILE H 3.950 . 3.950 2.734 2.630 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1278 1 58 MET HB2 1 58 MET ME 3.360 . 3.360 2.981 2.777 3.137 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1279 1 58 MET HB2 1 59 ILE H 4.610 . 4.610 3.944 3.876 4.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1280 1 58 MET HB3 1 58 MET ME 3.360 . 3.360 2.145 2.036 2.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1281 1 58 MET HB3 1 59 ILE H 4.610 . 4.610 2.789 2.676 2.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1282 1 58 MET ME 1 58 MET HG2 3.640 . 3.640 2.391 2.291 2.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1283 1 58 MET ME 1 58 MET QG 2.950 . 2.950 2.344 2.255 2.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1284 1 58 MET ME 1 58 MET HG3 3.640 . 3.640 3.385 3.351 3.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1285 1 58 MET ME 1 59 ILE H 4.260 . 4.260 4.138 3.860 4.279 0.019 11 0 "[ . 1 . 2 . 3 . 4]" 1
1286 1 58 MET ME 1 59 ILE HA 5.060 . 5.060 4.409 3.963 4.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1287 1 58 MET ME 1 59 ILE QG 4.570 . 4.570 3.407 3.049 3.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1288 1 58 MET ME 1 62 LEU MD1 4.540 . 4.540 3.351 3.071 4.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1289 1 58 MET ME 1 62 LEU QD 3.670 . 3.670 3.240 3.026 3.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1290 1 58 MET ME 1 62 LEU MD2 4.540 . 4.540 4.513 3.607 4.621 0.081 6 0 "[ . 1 . 2 . 3 . 4]" 1
1291 1 58 MET ME 1 81 LEU QD 4.950 . 4.950 4.306 4.043 4.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1292 1 58 MET ME 1 85 PHE QE 3.470 . 3.470 3.112 2.641 3.475 0.005 29 0 "[ . 1 . 2 . 3 . 4]" 1
1293 1 58 MET ME 1 85 PHE HZ 3.490 . 3.490 2.829 2.450 3.161 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1294 1 58 MET QG 1 59 ILE H 4.370 . 4.370 3.932 3.823 3.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1295 1 58 MET HG2 1 59 ILE H 5.080 . 5.080 4.128 3.988 4.198 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1296 1 58 MET HG2 1 61 THR H 5.500 . 5.500 5.155 4.932 5.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1297 1 58 MET HG3 1 59 ILE H 5.080 . 5.080 4.945 4.856 5.003 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1298 1 58 MET HG3 1 61 THR H 5.500 . 5.500 5.246 5.093 5.502 0.002 40 0 "[ . 1 . 2 . 3 . 4]" 1
1299 1 59 ILE H 1 59 ILE HB 3.580 . 3.580 2.610 2.563 2.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1300 1 59 ILE H 1 59 ILE MD 3.630 . 3.630 3.579 3.529 3.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1301 1 59 ILE H 1 59 ILE HG12 4.080 . 4.080 3.387 3.256 3.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1302 1 59 ILE H 1 59 ILE QG 3.360 . 3.360 2.076 1.966 2.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1303 1 59 ILE H 1 59 ILE HG13 4.080 . 4.080 2.095 1.982 2.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1304 1 59 ILE H 1 59 ILE MG 3.880 . 3.880 3.835 3.819 3.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1305 1 59 ILE H 1 60 THR H 3.630 . 3.630 2.644 2.554 2.742 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1306 1 59 ILE H 1 60 THR HB 5.300 . 5.300 4.983 4.740 5.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1307 1 59 ILE H 1 60 THR MG 4.610 . 4.610 4.444 4.215 4.639 0.029 35 0 "[ . 1 . 2 . 3 . 4]" 1
1308 1 59 ILE H 1 61 THR H 4.670 . 4.670 3.862 3.779 4.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1309 1 59 ILE HA 1 59 ILE MD 3.860 . 3.860 3.885 3.871 3.899 0.039 31 0 "[ . 1 . 2 . 3 . 4]" 1
1310 1 59 ILE HA 1 59 ILE HG12 4.040 . 4.040 2.576 2.543 2.612 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1311 1 59 ILE HA 1 59 ILE HG13 4.040 . 4.040 3.047 2.989 3.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1312 1 59 ILE HA 1 59 ILE MG 3.260 . 3.260 2.397 2.314 2.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1313 1 59 ILE HA 1 61 THR H 4.800 . 4.800 4.148 4.064 4.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1314 1 59 ILE HA 1 62 LEU H 4.300 . 4.300 3.205 3.049 3.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1315 1 59 ILE HA 1 62 LEU QB 4.070 . 4.070 2.625 2.393 2.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1316 1 59 ILE HA 1 62 LEU MD1 4.610 . 4.610 2.242 2.065 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1317 1 59 ILE HA 1 62 LEU QD 3.460 . 3.460 2.148 2.062 2.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1318 1 59 ILE HA 1 62 LEU MD2 4.610 . 4.610 4.414 2.391 4.628 0.018 19 0 "[ . 1 . 2 . 3 . 4]" 1
1319 1 59 ILE HA 1 62 LEU HG 5.150 . 5.150 3.444 3.014 4.973 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1320 1 59 ILE HB 1 59 ILE MD 3.340 . 3.340 2.403 2.374 2.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1321 1 59 ILE HB 1 60 THR H 3.830 . 3.830 2.783 2.703 2.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1322 1 59 ILE MD 1 59 ILE MG 2.800 . 2.800 2.123 2.090 2.142 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1323 1 59 ILE MD 1 60 THR H 5.360 . 5.360 4.678 4.603 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1324 1 59 ILE MD 1 85 PHE HA 5.310 . 5.310 4.487 4.355 4.688 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1325 1 59 ILE MD 1 85 PHE QB 3.760 . 3.760 2.412 2.243 2.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1326 1 59 ILE MD 1 85 PHE QD 3.860 . 3.860 3.352 3.012 3.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1327 1 59 ILE MD 1 85 PHE QE 4.820 . 4.820 4.195 3.751 4.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1328 1 59 ILE MD 1 88 MET ME 5.060 . 5.060 4.459 4.208 4.956 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1329 1 59 ILE MD 1 89 PHE QD 4.430 . 4.430 4.100 3.581 4.500 0.070 18 0 "[ . 1 . 2 . 3 . 4]" 1
1330 1 59 ILE MD 1 89 PHE QE 3.860 . 3.860 2.790 2.230 3.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1331 1 59 ILE QG 1 59 ILE MG 3.190 . 3.190 2.263 2.221 2.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1332 1 59 ILE QG 1 60 THR H 4.300 . 4.300 4.048 3.964 4.112 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1333 1 59 ILE HG12 1 59 ILE MG 3.730 . 3.730 2.312 2.265 2.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1334 1 59 ILE HG12 1 60 THR H 5.150 . 5.150 5.081 5.021 5.143 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1335 1 59 ILE HG13 1 59 ILE MG 3.730 . 3.730 3.224 3.208 3.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1336 1 59 ILE HG13 1 60 THR H 5.150 . 5.150 4.252 4.151 4.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1337 1 59 ILE MG 1 60 THR H 3.900 . 3.900 3.711 3.625 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1338 1 59 ILE MG 1 60 THR HA 4.390 . 4.390 3.670 3.562 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1339 1 59 ILE MG 1 61 THR H 4.990 . 4.990 5.002 4.963 5.021 0.031 8 0 "[ . 1 . 2 . 3 . 4]" 1
1340 1 59 ILE MG 1 62 LEU H 5.280 . 5.280 4.510 4.347 4.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1341 1 59 ILE MG 1 63 LYS H 4.730 . 4.730 4.017 3.862 4.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1342 1 59 ILE MG 1 82 TYR HA 4.590 . 4.590 3.315 3.085 3.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1343 1 59 ILE MG 1 82 TYR QB 5.060 . 5.060 4.287 4.065 4.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1344 1 59 ILE MG 1 82 TYR QD 3.440 . 3.440 2.695 2.405 3.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1345 1 59 ILE MG 1 82 TYR QE 3.770 . 3.770 2.931 2.353 3.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1346 1 59 ILE MG 1 85 PHE QB 4.150 . 4.150 2.620 2.370 2.954 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1347 1 59 ILE MG 1 85 PHE QD 4.290 . 4.290 3.193 2.868 3.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1348 1 59 ILE MG 1 135 GLY H 5.500 . 5.500 14.198 13.806 14.496 8.996 19 40 [************-*****+*********************] 1
1349 1 60 THR H 1 60 THR HB 3.490 . 3.490 2.475 2.352 2.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1350 1 60 THR H 1 60 THR MG 3.500 . 3.500 2.571 2.335 2.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1351 1 60 THR H 1 61 THR H 3.630 . 3.630 2.536 2.492 2.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1352 1 60 THR HA 1 60 THR MG 3.360 . 3.360 3.212 3.168 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1353 1 60 THR HA 1 63 LYS H 4.120 . 4.120 2.954 2.813 3.104 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1354 1 60 THR HA 1 63 LYS QB 4.210 . 4.210 2.339 2.169 2.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1355 1 60 THR HA 1 64 LYS H 4.870 . 4.870 4.236 4.053 4.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1356 1 60 THR HB 1 61 THR H 4.170 . 4.170 3.990 3.845 4.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1357 1 60 THR MG 1 61 THR H 3.760 . 3.760 2.544 2.473 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1358 1 60 THR MG 1 63 LYS H 5.500 . 5.500 4.814 4.686 4.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1359 1 60 THR MG 1 64 LYS HE2 4.000 . 4.000 3.507 2.454 4.020 0.020 25 0 "[ . 1 . 2 . 3 . 4]" 1
1360 1 60 THR MG 1 64 LYS QE 3.280 . 3.280 2.860 2.257 3.314 0.034 17 0 "[ . 1 . 2 . 3 . 4]" 1
1361 1 60 THR MG 1 64 LYS HE3 4.000 . 4.000 3.210 2.274 4.022 0.022 30 0 "[ . 1 . 2 . 3 . 4]" 1
1362 1 61 THR H 1 61 THR HB 3.510 . 3.510 2.405 2.186 2.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1363 1 61 THR H 1 61 THR MG 4.100 . 4.100 3.741 3.633 3.807 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1364 1 61 THR HA 1 61 THR MG 3.130 . 3.130 2.532 2.415 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1365 1 61 THR HA 1 64 LYS H 3.930 . 3.930 3.396 3.178 3.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1366 1 61 THR HA 1 64 LYS QB 3.400 . 3.400 3.063 2.796 3.405 0.005 14 0 "[ . 1 . 2 . 3 . 4]" 1
1367 1 61 THR HA 1 64 LYS QD 3.980 . 3.980 2.600 2.141 3.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1368 1 61 THR HA 1 64 LYS HE2 4.770 . 4.770 4.473 3.546 4.786 0.016 31 0 "[ . 1 . 2 . 3 . 4]" 1
1369 1 61 THR HA 1 64 LYS HE3 4.770 . 4.770 3.828 3.175 4.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1370 1 61 THR HA 1 65 ILE MG 4.890 . 4.890 4.272 3.912 4.459 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1371 1 61 THR HB 1 62 LEU H 4.060 . 4.060 2.664 2.497 2.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1372 1 61 THR MG 1 62 LEU H 4.020 . 4.020 3.298 2.892 3.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1373 1 61 THR MG 1 62 LEU HA 3.910 . 3.910 3.499 3.258 3.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1374 1 61 THR MG 1 62 LEU QB 5.340 . 5.340 4.644 4.119 4.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1375 1 61 THR MG 1 65 ILE H 4.380 . 4.380 4.027 3.801 4.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1376 1 61 THR MG 1 65 ILE MD 3.450 . 3.450 3.074 2.656 3.462 0.012 25 0 "[ . 1 . 2 . 3 . 4]" 1
1377 1 61 THR MG 1 65 ILE MG 3.010 . 3.010 2.983 2.644 3.164 0.154 18 0 "[ . 1 . 2 . 3 . 4]" 1
1378 1 62 LEU H 1 62 LEU HB2 4.040 . 4.040 2.401 1.986 2.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1379 1 62 LEU H 1 62 LEU QB 3.500 . 3.500 2.367 1.972 2.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1380 1 62 LEU H 1 62 LEU HB3 4.040 . 4.040 3.595 3.333 3.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1381 1 62 LEU H 1 62 LEU MD1 3.820 . 3.820 3.448 2.513 3.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1382 1 62 LEU H 1 62 LEU QD 3.300 . 3.300 3.150 2.448 3.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1383 1 62 LEU H 1 62 LEU MD2 3.820 . 3.820 3.673 3.378 3.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1384 1 62 LEU H 1 62 LEU HG 4.160 . 4.160 2.605 2.358 4.184 0.024 29 0 "[ . 1 . 2 . 3 . 4]" 1
1385 1 62 LEU H 1 65 ILE MG 5.500 . 5.500 5.389 5.027 5.518 0.018 11 0 "[ . 1 . 2 . 3 . 4]" 1
1386 1 62 LEU HA 1 62 LEU QD 4.080 . 4.080 2.179 2.128 2.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1387 1 62 LEU HA 1 65 ILE MD 3.450 . 3.450 2.688 2.517 2.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1388 1 62 LEU HA 1 65 ILE QG 3.820 . 3.820 2.101 2.019 2.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1389 1 62 LEU QB 1 63 LYS H 3.690 . 3.690 2.626 2.546 2.706 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1390 1 62 LEU QB 1 63 LYS HA 5.040 . 5.040 3.869 3.727 3.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1391 1 62 LEU QB 1 65 ILE H 5.340 . 5.340 5.002 4.913 5.090 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1392 1 62 LEU QB 1 82 TYR H 5.340 . 5.340 3.686 3.455 4.115 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1393 1 62 LEU QB 1 82 TYR QB 4.210 . 4.210 2.488 2.287 2.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1394 1 62 LEU HB2 1 63 LYS H 4.250 . 4.250 2.708 2.605 2.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1395 1 62 LEU HB2 1 82 TYR QD 4.740 . 4.740 3.064 2.468 3.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1396 1 62 LEU HB3 1 63 LYS H 4.250 . 4.250 3.574 3.058 3.689 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1397 1 62 LEU HB3 1 82 TYR QD 4.740 . 4.740 3.473 2.784 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1398 1 62 LEU QD 1 63 LYS H 4.410 . 4.410 4.124 4.025 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1399 1 62 LEU QD 1 65 ILE H 5.270 . 5.270 4.919 4.801 5.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1400 1 62 LEU QD 1 65 ILE QG 4.180 . 4.180 3.059 2.882 3.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1401 1 62 LEU QD 1 78 SER HA 5.030 . 5.030 2.474 2.220 3.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1402 1 62 LEU QD 1 78 SER QB 4.220 . 4.220 2.945 2.516 3.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1403 1 62 LEU QD 1 81 LEU HA 4.270 . 4.270 3.996 3.817 4.134 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1404 1 62 LEU QD 1 81 LEU QB 3.420 . 3.420 2.013 1.922 2.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1405 1 62 LEU QD 1 82 TYR H 4.100 . 4.100 3.139 2.926 3.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1406 1 62 LEU QD 1 82 TYR HA 4.060 . 4.060 2.802 2.594 3.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1407 1 62 LEU QD 1 82 TYR QB 4.190 . 4.190 3.175 2.963 3.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1408 1 62 LEU QD 1 82 TYR QD 4.100 . 4.100 3.689 3.312 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1409 1 62 LEU QD 1 84 LYS H 5.440 . 5.440 5.300 5.100 5.469 0.029 1 0 "[ . 1 . 2 . 3 . 4]" 1
1410 1 62 LEU QD 1 85 PHE H 5.440 . 5.440 4.530 4.289 4.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1411 1 62 LEU QD 1 85 PHE QD 3.370 . 3.370 2.354 2.205 2.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1412 1 62 LEU QD 1 85 PHE QE 3.450 . 3.450 2.149 2.033 2.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1413 1 62 LEU QD 1 85 PHE HZ 5.110 . 5.110 4.049 3.886 4.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1414 1 62 LEU MD1 1 63 LYS H 5.130 . 5.130 4.488 4.383 4.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1415 1 62 LEU MD1 1 81 LEU HB2 5.820 . 5.820 3.032 2.665 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1416 1 62 LEU MD1 1 81 LEU HB3 5.820 . 5.820 2.365 2.149 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1417 1 62 LEU MD1 1 82 TYR H 5.130 . 5.130 3.505 3.096 5.178 0.048 29 0 "[ . 1 . 2 . 3 . 4]" 1
1418 1 62 LEU MD1 1 82 TYR QD 5.500 . 5.500 3.910 3.365 5.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1419 1 62 LEU MD2 1 63 LYS H 5.130 . 5.130 4.813 4.558 4.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1420 1 62 LEU MD2 1 81 LEU HB2 5.820 . 5.820 2.560 2.329 3.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1421 1 62 LEU MD2 1 81 LEU HB3 5.820 . 5.820 2.874 2.057 3.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1422 1 62 LEU MD2 1 82 TYR H 5.130 . 5.130 3.743 2.943 4.177 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1423 1 62 LEU MD2 1 82 TYR QD 5.500 . 5.500 4.975 3.723 5.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1424 1 63 LYS H 1 63 LYS HB2 3.690 . 3.690 2.379 2.284 2.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1425 1 63 LYS H 1 63 LYS HB3 3.690 . 3.690 2.676 2.564 2.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1426 1 63 LYS H 1 63 LYS HG2 4.980 . 4.980 4.563 4.519 4.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1427 1 63 LYS H 1 63 LYS QG 4.280 . 4.280 3.985 3.940 4.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1428 1 63 LYS H 1 63 LYS HG3 4.980 . 4.980 4.396 4.311 4.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1429 1 63 LYS H 1 64 LYS H 3.700 . 3.700 2.769 2.668 2.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1430 1 63 LYS H 1 64 LYS QG 5.340 . 5.340 4.551 4.331 4.821 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1431 1 63 LYS H 1 82 TYR QD 4.220 . 4.220 3.496 3.147 4.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1432 1 63 LYS H 1 82 TYR QE 4.870 . 4.870 4.330 3.571 4.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1433 1 63 LYS HA 1 66 ARG H 4.180 . 4.180 3.744 3.413 4.088 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1434 1 63 LYS HA 1 66 ARG QG 5.300 . 5.300 3.518 2.219 4.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1435 1 63 LYS HA 1 82 TYR QD 4.230 . 4.230 3.445 2.830 4.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1436 1 63 LYS QB 1 64 LYS H 3.860 . 3.860 2.623 2.432 2.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1437 1 63 LYS QB 1 82 TYR QD 4.410 . 4.410 3.189 2.928 3.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1438 1 63 LYS QB 1 82 TYR QE 4.130 . 4.130 2.575 2.203 3.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1439 1 63 LYS HB2 1 64 LYS H 4.580 . 4.580 3.853 3.713 4.140 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1440 1 63 LYS HB2 1 82 TYR QD 5.070 . 5.070 3.237 2.964 3.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1441 1 63 LYS HB2 1 82 TYR QE 4.910 . 4.910 2.598 2.215 3.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1442 1 63 LYS HB3 1 64 LYS H 4.580 . 4.580 2.670 2.462 3.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1443 1 63 LYS HB3 1 82 TYR QD 5.070 . 5.070 4.816 4.558 5.102 0.032 34 0 "[ . 1 . 2 . 3 . 4]" 1
1444 1 63 LYS HB3 1 82 TYR QE 4.910 . 4.910 4.250 3.941 4.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1445 1 63 LYS QG 1 82 TYR QD 4.830 . 4.830 4.043 3.746 4.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1446 1 64 LYS H 1 64 LYS HB2 3.830 . 3.830 2.446 2.330 2.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1447 1 64 LYS H 1 64 LYS QB 3.140 . 3.140 2.409 2.302 2.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1448 1 64 LYS H 1 64 LYS HB3 3.830 . 3.830 3.616 3.576 3.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1449 1 64 LYS H 1 64 LYS QD 4.540 . 4.540 3.696 3.291 4.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1450 1 64 LYS H 1 64 LYS HG2 4.280 . 4.280 3.654 3.242 3.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1451 1 64 LYS H 1 64 LYS QG 3.430 . 3.430 2.366 2.192 2.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1452 1 64 LYS H 1 64 LYS HG3 4.280 . 4.280 2.397 2.226 2.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1453 1 64 LYS H 1 65 ILE H 3.630 . 3.630 2.762 2.653 2.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1454 1 64 LYS H 1 65 ILE MG 4.610 . 4.610 4.338 4.117 4.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1455 1 64 LYS H 1 66 ARG H 4.750 . 4.750 3.949 3.759 4.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1456 1 64 LYS HA 1 64 LYS QD 4.440 . 4.440 4.041 3.861 4.130 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1457 1 64 LYS HA 1 64 LYS HG2 4.190 . 4.190 2.645 2.500 2.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1458 1 64 LYS HA 1 64 LYS QG 3.440 . 3.440 2.467 2.379 2.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1459 1 64 LYS HA 1 64 LYS HG3 4.190 . 4.190 2.992 2.766 3.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1460 1 64 LYS HA 1 66 ARG H 4.700 . 4.700 3.847 3.630 3.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1461 1 64 LYS QB 1 64 LYS QD 3.310 . 3.310 2.107 2.071 2.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1462 1 64 LYS QB 1 64 LYS QE 4.560 . 4.560 3.589 3.496 3.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1463 1 64 LYS HB2 1 65 ILE H 4.080 . 4.080 2.390 2.262 2.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1464 1 64 LYS HB2 1 65 ILE MG 4.380 . 4.380 2.887 2.664 3.063 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1465 1 64 LYS HB3 1 65 ILE H 4.080 . 4.080 3.372 3.207 3.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1466 1 64 LYS HB3 1 65 ILE MG 4.380 . 4.380 3.510 3.330 3.743 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1467 1 64 LYS QE 1 64 LYS QG 3.330 . 3.330 2.208 2.083 2.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1468 1 64 LYS QG 1 65 ILE H 5.100 . 5.100 4.098 3.921 4.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1469 1 65 ILE H 1 65 ILE MD 3.860 . 3.860 3.770 3.665 3.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1470 1 65 ILE H 1 65 ILE QG 3.440 . 3.440 2.090 1.989 2.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1471 1 65 ILE H 1 65 ILE MG 3.090 . 3.090 2.255 2.101 2.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1472 1 65 ILE H 1 66 ARG H 3.720 . 3.720 2.753 2.660 2.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1473 1 65 ILE H 1 67 ARG H 4.900 . 4.900 4.422 4.192 4.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1474 1 65 ILE H 1 74 ILE MG 5.500 . 5.500 5.385 5.115 5.566 0.066 34 0 "[ . 1 . 2 . 3 . 4]" 1
1475 1 65 ILE HA 1 65 ILE MG 3.050 . 3.050 2.342 2.300 2.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1476 1 65 ILE HA 1 67 ARG H 3.880 . 3.880 3.060 2.853 3.269 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1477 1 65 ILE HA 1 68 PHE H 4.120 . 4.120 3.235 2.988 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1478 1 65 ILE HA 1 68 PHE HB2 4.190 . 4.190 2.402 2.110 2.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1479 1 65 ILE HA 1 68 PHE HB3 5.500 . 5.500 4.058 3.739 4.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1480 1 65 ILE HA 1 68 PHE QD 4.460 . 4.460 3.545 3.124 3.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1481 1 65 ILE HA 1 74 ILE MG 4.820 . 4.820 4.132 3.900 4.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1482 1 65 ILE HB 1 65 ILE MD 3.190 . 3.190 2.361 2.332 2.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1483 1 65 ILE HB 1 66 ARG H 4.840 . 4.840 4.397 4.331 4.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1484 1 65 ILE HB 1 68 PHE H 4.800 . 4.800 4.220 4.038 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1485 1 65 ILE HB 1 68 PHE HB2 4.550 . 4.550 2.649 2.437 2.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1486 1 65 ILE HB 1 68 PHE HB3 4.950 . 4.950 3.716 3.570 3.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1487 1 65 ILE HB 1 68 PHE QE 5.500 . 5.500 5.437 5.221 5.518 0.018 33 0 "[ . 1 . 2 . 3 . 4]" 1
1488 1 65 ILE HB 1 74 ILE MG 3.470 . 3.470 2.470 2.256 2.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1489 1 65 ILE MD 1 68 PHE HB2 5.120 . 5.120 4.527 4.302 4.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1490 1 65 ILE MD 1 74 ILE HA 5.070 . 5.070 4.681 4.416 4.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1491 1 65 ILE MD 1 74 ILE MG 3.050 . 3.050 2.311 2.144 2.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1492 1 65 ILE MD 1 78 SER H 5.090 . 5.090 4.565 4.236 4.775 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1493 1 65 ILE MD 1 78 SER HA 5.360 . 5.360 3.749 3.630 3.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1494 1 65 ILE MD 1 78 SER QB 4.210 . 4.210 2.894 2.069 3.210 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1495 1 65 ILE MD 1 78 SER HG 4.050 . 4.050 2.990 2.818 3.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1496 1 65 ILE QG 1 65 ILE MG 3.270 . 3.270 2.271 2.215 2.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1497 1 65 ILE QG 1 66 ARG H 3.670 . 3.670 3.123 2.952 3.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1498 1 65 ILE QG 1 66 ARG HA 5.010 . 5.010 3.778 3.555 4.041 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1499 1 65 ILE QG 1 67 ARG H 5.500 . 5.500 4.667 4.488 4.860 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1500 1 65 ILE QG 1 74 ILE MG 4.060 . 4.060 3.412 3.027 3.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1501 1 65 ILE QG 1 78 SER HB2 4.570 . 4.570 3.038 2.109 3.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1502 1 65 ILE QG 1 78 SER QB 3.720 . 3.720 2.193 2.024 2.430 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1503 1 65 ILE QG 1 78 SER HB3 4.570 . 4.570 2.304 2.055 2.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1504 1 65 ILE QG 1 78 SER HG 4.500 . 4.500 3.223 2.771 3.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1505 1 65 ILE MG 1 66 ARG H 4.480 . 4.480 4.275 4.167 4.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1506 1 65 ILE MG 1 67 ARG H 5.500 . 5.500 4.874 4.715 5.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1507 1 65 ILE MG 1 68 PHE H 5.360 . 5.360 4.876 4.668 5.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1508 1 65 ILE MG 1 68 PHE HA 5.500 . 5.500 4.804 4.457 5.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1509 1 65 ILE MG 1 68 PHE HB2 4.470 . 4.470 3.344 3.131 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1510 1 65 ILE MG 1 68 PHE HB3 5.500 . 5.500 4.666 4.463 5.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1511 1 65 ILE MG 1 68 PHE QD 4.270 . 4.270 3.376 2.684 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1512 1 65 ILE MG 1 74 ILE MG 3.910 . 3.910 3.432 3.287 3.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1513 1 66 ARG H 1 66 ARG QB 3.450 . 3.450 2.222 2.036 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1514 1 66 ARG H 1 66 ARG QD 5.050 . 5.050 4.403 3.955 4.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1515 1 66 ARG H 1 66 ARG QG 4.360 . 4.360 3.403 2.364 4.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1516 1 66 ARG H 1 67 ARG H 3.530 . 3.530 2.538 2.410 2.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1517 1 66 ARG H 1 68 PHE H 5.120 . 5.120 4.217 4.020 4.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1518 1 66 ARG HA 1 68 PHE H 4.750 . 4.750 3.820 3.591 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1519 1 66 ARG QB 1 67 ARG H 3.510 . 3.510 3.067 2.805 3.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1520 1 66 ARG QB 1 68 PHE H 5.340 . 5.340 4.670 4.455 4.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1521 1 66 ARG HB2 1 67 ARG H 4.180 . 4.180 3.647 2.894 4.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1522 1 66 ARG HB3 1 67 ARG H 4.180 . 4.180 3.487 2.901 4.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1523 1 66 ARG QD 1 79 THR MG 5.020 . 5.020 3.077 2.419 4.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1524 1 66 ARG QG 1 79 THR H 5.330 . 5.330 3.486 2.984 5.378 0.048 34 0 "[ . 1 . 2 . 3 . 4]" 1
1525 1 66 ARG QG 1 79 THR HA 4.400 . 4.400 2.389 2.114 4.424 0.024 34 0 "[ . 1 . 2 . 3 . 4]" 1
1526 1 66 ARG QG 1 79 THR MG 4.770 . 4.770 3.349 2.814 4.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1527 1 66 ARG HG2 1 67 ARG H 5.500 . 5.500 4.960 4.305 5.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1528 1 66 ARG HG2 1 82 TYR QD 5.500 . 5.500 4.968 4.090 5.526 0.026 34 0 "[ . 1 . 2 . 3 . 4]" 1
1529 1 66 ARG HG3 1 67 ARG H 5.500 . 5.500 5.092 4.412 5.510 0.010 25 0 "[ . 1 . 2 . 3 . 4]" 1
1530 1 66 ARG HG3 1 82 TYR QD 5.500 . 5.500 4.356 3.322 5.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1531 1 67 ARG H 1 67 ARG HB2 4.150 . 4.150 2.634 2.522 2.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1532 1 67 ARG H 1 67 ARG QB 3.440 . 3.440 2.584 2.483 2.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1533 1 67 ARG H 1 67 ARG HB3 4.150 . 4.150 3.755 3.700 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1534 1 67 ARG H 1 67 ARG QD 4.450 . 4.450 4.232 3.324 4.512 0.062 7 0 "[ . 1 . 2 . 3 . 4]" 1
1535 1 67 ARG H 1 67 ARG HG2 4.070 . 4.070 3.542 2.338 4.079 0.009 5 0 "[ . 1 . 2 . 3 . 4]" 1
1536 1 67 ARG H 1 67 ARG QG 3.540 . 3.540 2.712 2.296 3.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1537 1 67 ARG H 1 67 ARG HG3 4.070 . 4.070 2.976 2.382 3.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1538 1 67 ARG H 1 68 PHE H 3.510 . 3.510 2.414 2.156 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1539 1 67 ARG H 1 68 PHE HB2 4.650 . 4.650 3.952 3.746 4.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1540 1 67 ARG H 1 68 PHE HB3 5.500 . 5.500 4.861 4.576 5.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1541 1 67 ARG H 1 68 PHE QD 5.370 . 5.370 5.376 5.234 5.429 0.059 2 0 "[ . 1 . 2 . 3 . 4]" 1
1542 1 67 ARG H 1 75 MET ME 5.500 . 5.500 5.359 5.074 5.552 0.052 10 0 "[ . 1 . 2 . 3 . 4]" 1
1543 1 67 ARG HA 1 67 ARG QD 4.350 . 4.350 3.808 2.335 4.257 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1544 1 67 ARG HA 1 67 ARG HG2 4.170 . 4.170 2.648 2.374 3.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1545 1 67 ARG HA 1 67 ARG QG 3.590 . 3.590 2.550 2.300 3.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1546 1 67 ARG HA 1 67 ARG HG3 4.170 . 4.170 3.376 3.005 3.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1547 1 67 ARG HA 1 75 MET ME 3.710 . 3.710 3.483 3.021 3.766 0.056 32 0 "[ . 1 . 2 . 3 . 4]" 1
1548 1 67 ARG QB 1 69 LYS QG 5.100 . 5.100 3.893 3.510 4.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1549 1 67 ARG QG 1 68 PHE H 4.710 . 4.710 4.399 4.179 4.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1550 1 67 ARG HG2 1 68 PHE H 5.500 . 5.500 4.983 4.431 5.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1551 1 67 ARG HG3 1 68 PHE H 5.500 . 5.500 4.967 4.612 5.539 0.039 36 0 "[ . 1 . 2 . 3 . 4]" 1
1552 1 68 PHE H 1 68 PHE HB2 3.540 . 3.540 2.377 2.262 2.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1553 1 68 PHE H 1 68 PHE HB3 3.620 . 3.620 2.625 2.501 2.720 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1554 1 68 PHE H 1 68 PHE QD 4.150 . 4.150 4.129 4.041 4.158 0.008 8 0 "[ . 1 . 2 . 3 . 4]" 1
1555 1 68 PHE H 1 74 ILE MG 4.370 . 4.370 4.109 3.947 4.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1556 1 68 PHE H 1 75 MET HA 4.790 . 4.790 3.460 3.025 4.141 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1557 1 68 PHE H 1 75 MET ME 4.420 . 4.420 3.831 3.538 4.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1558 1 68 PHE H 1 75 MET QG 4.720 . 4.720 2.639 1.938 4.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1559 1 68 PHE HA 1 68 PHE QD 3.610 . 3.610 2.403 2.195 2.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1560 1 68 PHE HA 1 69 LYS H 3.170 . 3.170 2.217 2.157 2.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1561 1 68 PHE HA 1 69 LYS QB 4.760 . 4.760 4.399 4.236 4.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1562 1 68 PHE HA 1 69 LYS QG 4.760 . 4.760 4.099 3.802 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1563 1 68 PHE HA 1 70 VAL H 4.330 . 4.330 3.575 3.292 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1564 1 68 PHE HA 1 70 VAL QG 4.730 . 4.730 3.925 3.582 4.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1565 1 68 PHE HA 1 74 ILE MG 5.250 . 5.250 4.915 4.706 5.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1566 1 68 PHE HB2 1 69 LYS H 5.090 . 5.090 4.575 4.509 4.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1567 1 68 PHE HB2 1 71 SER H 5.080 . 5.080 5.071 4.970 5.097 0.017 34 0 "[ . 1 . 2 . 3 . 4]" 1
1568 1 68 PHE HB2 1 74 ILE MG 4.030 . 4.030 2.989 2.715 3.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1569 1 68 PHE HB3 1 69 LYS H 4.470 . 4.470 4.447 4.384 4.476 0.006 32 0 "[ . 1 . 2 . 3 . 4]" 1
1570 1 68 PHE HB3 1 71 SER H 3.940 . 3.940 3.710 3.569 3.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1571 1 68 PHE HB3 1 71 SER QB 5.340 . 5.340 4.159 3.917 4.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1572 1 68 PHE HB3 1 74 ILE HB 4.570 . 4.570 3.080 2.856 3.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1573 1 68 PHE HB3 1 74 ILE MG 3.560 . 3.560 2.648 2.520 2.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1574 1 68 PHE HB3 1 75 MET ME 4.730 . 4.730 4.142 4.001 4.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1575 1 68 PHE QD 1 69 LYS H 4.310 . 4.310 4.036 3.637 4.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1576 1 68 PHE QD 1 70 VAL H 4.910 . 4.910 3.750 3.655 3.883 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1577 1 68 PHE QD 1 70 VAL HB 5.100 . 5.100 3.483 3.354 3.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1578 1 68 PHE QD 1 70 VAL MG1 5.340 . 5.340 4.638 4.453 4.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1579 1 68 PHE QD 1 70 VAL QG 3.950 . 3.950 3.444 3.235 3.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1580 1 68 PHE QD 1 70 VAL MG2 5.340 . 5.340 3.553 3.314 3.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1581 1 68 PHE QD 1 71 SER QB 3.840 . 3.840 2.209 2.058 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1582 1 68 PHE QD 1 71 SER HG 5.180 . 5.180 4.595 4.388 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1583 1 68 PHE QD 1 74 ILE H 4.450 . 4.450 4.102 3.982 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1584 1 68 PHE QD 1 74 ILE HB 3.950 . 3.950 2.179 2.087 2.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1585 1 68 PHE QD 1 74 ILE MD 3.400 . 3.400 2.540 2.287 2.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1586 1 68 PHE QD 1 74 ILE QG 4.900 . 4.900 3.833 3.734 3.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1587 1 68 PHE QD 1 74 ILE MG 3.310 . 3.310 2.811 2.610 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1588 1 68 PHE QD 1 75 MET H 4.540 . 4.540 3.927 3.664 4.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1589 1 68 PHE QE 1 69 LYS H 5.500 . 5.500 5.397 5.070 5.555 0.055 34 0 "[ . 1 . 2 . 3 . 4]" 1
1590 1 68 PHE QE 1 70 VAL H 5.080 . 5.080 4.190 4.032 4.376 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1591 1 68 PHE QE 1 70 VAL HB 5.100 . 5.100 2.491 2.298 2.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1592 1 68 PHE QE 1 70 VAL MG1 3.570 . 3.570 3.386 3.206 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1593 1 68 PHE QE 1 70 VAL QG 3.120 . 3.120 2.808 2.629 2.944 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1594 1 68 PHE QE 1 70 VAL MG2 3.570 . 3.570 3.007 2.744 3.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1595 1 68 PHE QE 1 71 SER H 4.440 . 4.440 3.582 3.172 3.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1596 1 68 PHE QE 1 71 SER HB2 4.700 . 4.700 3.068 2.732 3.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1597 1 68 PHE QE 1 71 SER QB 4.030 . 4.030 2.546 2.315 2.854 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1598 1 68 PHE QE 1 71 SER HB3 4.700 . 4.700 2.720 2.499 3.042 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1599 1 68 PHE QE 1 71 SER HG 5.500 . 5.500 4.483 4.256 4.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1600 1 68 PHE QE 1 74 ILE HB 4.850 . 4.850 3.875 3.719 4.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1601 1 68 PHE QE 1 74 ILE MD 3.390 . 3.390 2.089 2.025 2.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1602 1 68 PHE QE 1 74 ILE MG 4.100 . 4.100 3.885 3.737 4.105 0.005 38 0 "[ . 1 . 2 . 3 . 4]" 1
1603 1 68 PHE HZ 1 70 VAL HB 5.440 . 5.440 2.987 2.805 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1604 1 68 PHE HZ 1 70 VAL MG1 4.140 . 4.140 3.357 3.138 3.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1605 1 68 PHE HZ 1 70 VAL QG 3.430 . 3.430 2.815 2.689 2.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1606 1 68 PHE HZ 1 70 VAL MG2 4.140 . 4.140 3.040 2.784 3.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1607 1 69 LYS H 1 69 LYS QB 3.090 . 3.090 2.396 2.216 2.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1608 1 69 LYS H 1 69 LYS QD 4.350 . 4.350 4.041 3.383 4.367 0.017 3 0 "[ . 1 . 2 . 3 . 4]" 1
1609 1 69 LYS H 1 69 LYS QE 5.340 . 5.340 4.402 3.837 4.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1610 1 69 LYS H 1 69 LYS HG2 3.700 . 3.700 2.687 1.963 3.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1611 1 69 LYS H 1 69 LYS HG3 3.700 . 3.700 3.019 2.279 3.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1612 1 69 LYS H 1 70 VAL H 3.570 . 3.570 2.694 2.463 2.865 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1613 1 69 LYS H 1 70 VAL HB 5.340 . 5.340 5.246 4.917 5.347 0.007 35 0 "[ . 1 . 2 . 3 . 4]" 1
1614 1 69 LYS H 1 70 VAL QG 4.090 . 4.090 3.556 3.343 3.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1615 1 69 LYS H 1 71 SER H 4.480 . 4.480 4.433 4.303 4.484 0.004 6 0 "[ . 1 . 2 . 3 . 4]" 1
1616 1 69 LYS H 1 75 MET ME 4.140 . 4.140 3.704 3.482 3.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1617 1 69 LYS HA 1 69 LYS QD 3.640 . 3.640 2.901 2.099 3.709 0.069 36 0 "[ . 1 . 2 . 3 . 4]" 1
1618 1 69 LYS HA 1 69 LYS HG2 3.930 . 3.930 2.600 2.295 3.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1619 1 69 LYS HA 1 69 LYS QG 3.440 . 3.440 2.538 2.264 3.008 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1620 1 69 LYS HA 1 69 LYS HG3 3.930 . 3.930 3.578 3.139 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1621 1 69 LYS HA 1 70 VAL HA 5.070 . 5.070 4.794 4.753 4.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1622 1 69 LYS HA 1 71 SER H 4.080 . 4.080 3.879 3.680 4.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1623 1 69 LYS HA 1 75 MET ME 2.920 . 2.920 2.187 1.945 2.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1624 1 69 LYS QB 1 70 VAL H 3.720 . 3.720 2.926 2.728 3.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1625 1 69 LYS QB 1 70 VAL HA 4.710 . 4.710 3.882 3.706 4.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1626 1 69 LYS QB 1 70 VAL HB 5.350 . 5.350 5.233 5.060 5.384 0.034 3 0 "[ . 1 . 2 . 3 . 4]" 1
1627 1 69 LYS QB 1 70 VAL MG1 5.280 . 5.280 5.051 4.835 5.326 0.046 36 0 "[ . 1 . 2 . 3 . 4]" 1
1628 1 69 LYS QB 1 70 VAL QG 4.030 . 4.030 3.350 3.124 3.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1629 1 69 LYS QB 1 70 VAL MG2 5.280 . 5.280 3.400 3.160 3.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1630 1 69 LYS QB 1 71 SER H 4.950 . 4.950 4.671 4.589 4.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1631 1 69 LYS QB 1 75 MET ME 4.150 . 4.150 3.767 3.410 4.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1632 1 69 LYS QD 1 75 MET ME 3.560 . 3.560 3.150 2.107 3.720 0.160 34 0 "[ . 1 . 2 . 3 . 4]" 1
1633 1 69 LYS QG 1 70 VAL H 4.420 . 4.420 4.243 4.075 4.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1634 1 69 LYS QG 1 70 VAL QG 5.230 . 5.230 4.626 4.432 4.873 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1635 1 69 LYS QG 1 75 MET ME 3.800 . 3.800 3.065 2.254 3.880 0.080 5 0 "[ . 1 . 2 . 3 . 4]" 1
1636 1 69 LYS HG2 1 70 VAL H 5.040 . 5.040 4.718 4.299 5.043 0.003 20 0 "[ . 1 . 2 . 3 . 4]" 1
1637 1 69 LYS HG3 1 70 VAL H 5.040 . 5.040 4.872 4.438 5.064 0.024 26 0 "[ . 1 . 2 . 3 . 4]" 1
1638 1 70 VAL H 1 70 VAL HB 2.980 . 2.980 2.720 2.586 2.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1639 1 70 VAL H 1 70 VAL MG1 3.890 . 3.890 3.760 3.734 3.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1640 1 70 VAL H 1 70 VAL QG 2.630 . 2.630 1.851 1.790 1.934 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1641 1 70 VAL H 1 70 VAL MG2 3.890 . 3.890 1.855 1.793 1.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1642 1 70 VAL H 1 71 SER H 3.220 . 3.220 2.652 2.552 2.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1643 1 70 VAL H 1 75 MET ME 4.960 . 4.960 4.566 4.373 4.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1644 1 70 VAL HA 1 70 VAL MG1 3.200 . 3.200 2.317 2.264 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1645 1 70 VAL HA 1 70 VAL QG 2.740 . 2.740 2.150 2.128 2.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1646 1 70 VAL HA 1 70 VAL MG2 3.200 . 3.200 2.551 2.492 2.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1647 1 70 VAL HB 1 71 SER H 3.770 . 3.770 2.913 2.783 3.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1648 1 70 VAL QG 1 71 SER H 3.340 . 3.340 3.404 3.358 3.463 0.123 6 0 "[ . 1 . 2 . 3 . 4]" 1
1649 1 70 VAL QG 1 71 SER HA 4.510 . 4.510 4.183 4.087 4.266 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1650 1 70 VAL QG 1 71 SER QB 3.670 . 3.670 3.354 3.203 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1651 1 70 VAL QG 1 74 ILE MD 4.110 . 4.110 4.247 4.115 4.430 0.320 29 0 "[ . 1 . 2 . 3 . 4]" 1
1652 1 70 VAL MG1 1 71 SER H 3.990 . 3.990 3.951 3.806 4.023 0.033 12 0 "[ . 1 . 2 . 3 . 4]" 1
1653 1 70 VAL MG1 1 74 ILE MD 5.010 . 5.010 4.584 4.406 4.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1654 1 70 VAL MG2 1 71 SER H 3.990 . 3.990 3.718 3.604 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1655 1 70 VAL MG2 1 74 ILE MD 5.010 . 5.010 5.029 4.781 5.143 0.133 36 0 "[ . 1 . 2 . 3 . 4]" 1
1656 1 71 SER H 1 71 SER HB2 3.850 . 3.850 3.368 3.347 3.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1657 1 71 SER H 1 71 SER HB3 3.850 . 3.850 2.848 2.805 2.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1658 1 71 SER H 1 73 VAL H 5.500 . 5.500 5.414 5.276 5.503 0.003 6 0 "[ . 1 . 2 . 3 . 4]" 1
1659 1 71 SER H 1 74 ILE H 5.500 . 5.500 4.892 4.814 5.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1660 1 71 SER H 1 74 ILE HB 4.510 . 4.510 4.037 3.923 4.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1661 1 71 SER H 1 74 ILE MD 4.630 . 4.630 4.225 4.130 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1662 1 71 SER H 1 74 ILE MG 5.500 . 5.500 4.905 4.788 5.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1663 1 71 SER H 1 75 MET ME 4.470 . 4.470 4.004 3.602 4.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1664 1 71 SER HA 1 72 GLN HB2 4.950 . 4.950 4.433 4.378 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1665 1 71 SER HA 1 72 GLN HB3 4.810 . 4.810 4.564 4.406 4.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1666 1 71 SER HA 1 73 VAL H 4.310 . 4.310 3.521 3.387 3.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1667 1 71 SER QB 1 74 ILE H 4.290 . 4.290 2.843 2.742 2.933 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1668 1 71 SER QB 1 74 ILE HB 3.860 . 3.860 2.332 2.255 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1669 1 71 SER QB 1 74 ILE MD 3.370 . 3.370 2.064 2.014 2.135 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1670 1 71 SER QB 1 74 ILE MG 4.630 . 4.630 3.743 3.665 3.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1671 1 71 SER HB2 1 74 ILE H 5.040 . 5.040 4.081 4.003 4.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1672 1 71 SER HB2 1 74 ILE HB 4.700 . 4.700 4.096 3.996 4.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1673 1 71 SER HB2 1 74 ILE MD 3.850 . 3.850 2.973 2.877 3.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1674 1 71 SER HB2 1 74 ILE MG 5.490 . 5.490 5.224 5.132 5.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1675 1 71 SER HB3 1 74 ILE H 5.040 . 5.040 2.901 2.790 2.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1676 1 71 SER HB3 1 74 ILE HB 4.700 . 4.700 2.346 2.267 2.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1677 1 71 SER HB3 1 74 ILE MD 3.850 . 3.850 2.106 2.051 2.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1678 1 71 SER HB3 1 74 ILE MG 5.490 . 5.490 3.835 3.753 3.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1679 1 71 SER HG 1 73 VAL H 3.970 . 3.970 3.512 3.343 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1680 1 71 SER HG 1 73 VAL HB 5.020 . 5.020 2.737 2.603 2.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1681 1 71 SER HG 1 73 VAL MG1 4.530 . 4.530 4.210 4.081 4.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1682 1 71 SER HG 1 73 VAL QG 3.880 . 3.880 3.452 3.302 3.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1683 1 71 SER HG 1 73 VAL MG2 4.530 . 4.530 3.670 3.476 3.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1684 1 71 SER HG 1 74 ILE H 4.220 . 4.220 2.874 2.740 3.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1685 1 71 SER HG 1 74 ILE HB 4.830 . 4.830 3.885 3.725 4.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1686 1 71 SER HG 1 74 ILE MD 4.330 . 4.330 3.097 2.998 3.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1687 1 72 GLN H 1 72 GLN QG 5.130 . 5.130 4.044 4.003 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1688 1 72 GLN H 1 73 VAL H 4.700 . 4.700 2.682 2.632 2.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1689 1 72 GLN H 1 75 MET ME 5.070 . 5.070 4.145 3.667 4.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1690 1 72 GLN HA 1 74 ILE H 4.620 . 4.620 4.383 4.296 4.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1691 1 72 GLN HA 1 75 MET H 4.590 . 4.590 3.158 3.026 3.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1692 1 72 GLN HA 1 75 MET ME 2.820 . 2.820 2.412 2.013 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1693 1 72 GLN HA 1 75 MET QG 4.100 . 4.100 3.712 2.543 4.143 0.043 36 0 "[ . 1 . 2 . 3 . 4]" 1
1694 1 72 GLN HB2 1 72 GLN HE22 4.630 . 4.630 4.425 4.343 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1695 1 72 GLN HB2 1 73 VAL H 4.110 . 4.110 3.946 3.847 4.029 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1696 1 72 GLN HB2 1 73 VAL QG 4.870 . 4.870 4.694 4.563 4.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1697 1 72 GLN HB3 1 73 VAL H 3.690 . 3.690 2.818 2.603 2.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1698 1 72 GLN HB3 1 73 VAL QG 4.010 . 4.010 3.385 3.183 3.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1699 1 72 GLN HE21 1 75 MET ME 4.390 . 4.390 3.403 2.982 3.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1700 1 72 GLN HE22 1 75 MET ME 4.320 . 4.320 4.282 3.801 4.342 0.022 17 0 "[ . 1 . 2 . 3 . 4]" 1
1701 1 72 GLN HE22 1 76 GLU H 5.500 . 5.500 3.868 3.464 4.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1702 1 72 GLN HE22 1 76 GLU HB2 5.500 . 5.500 4.608 3.821 5.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1703 1 72 GLN HE22 1 76 GLU HG2 5.100 . 5.100 2.769 1.871 3.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1704 1 72 GLN HE22 1 76 GLU QG 4.280 . 4.280 2.156 1.814 2.873 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1705 1 72 GLN HE22 1 76 GLU HG3 5.100 . 5.100 2.688 1.837 4.120 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1706 1 72 GLN QG 1 73 VAL H 4.350 . 4.350 3.996 3.778 4.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1707 1 72 GLN QG 1 73 VAL QG 4.310 . 4.310 4.125 3.888 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1708 1 72 GLN QG 1 76 GLU H 4.570 . 4.570 3.892 3.667 4.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1709 1 73 VAL H 1 73 VAL HB 3.630 . 3.630 2.590 2.560 2.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1710 1 73 VAL H 1 73 VAL MG1 3.850 . 3.850 3.793 3.763 3.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1711 1 73 VAL H 1 73 VAL QG 2.760 . 2.760 2.028 1.962 2.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1712 1 73 VAL H 1 73 VAL MG2 3.850 . 3.850 2.036 1.969 2.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1713 1 73 VAL H 1 74 ILE H 3.510 . 3.510 2.697 2.618 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1714 1 73 VAL H 1 75 MET H 4.680 . 4.680 4.014 3.874 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1715 1 73 VAL H 1 76 GLU H 5.500 . 5.500 4.738 4.665 4.857 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1716 1 73 VAL H 1 76 GLU HB2 5.500 . 5.500 5.354 5.199 5.503 0.003 35 0 "[ . 1 . 2 . 3 . 4]" 1
1717 1 73 VAL HA 1 73 VAL MG1 3.230 . 3.230 2.374 2.326 2.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1718 1 73 VAL HA 1 73 VAL QG 2.630 . 2.630 2.137 2.118 2.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1719 1 73 VAL HA 1 73 VAL MG2 3.230 . 3.230 2.426 2.404 2.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1720 1 73 VAL HA 1 76 GLU H 3.940 . 3.940 3.564 3.384 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1721 1 73 VAL HA 1 76 GLU HB2 3.790 . 3.790 2.970 2.707 3.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1722 1 73 VAL HA 1 76 GLU HB3 4.660 . 4.660 4.610 4.319 4.676 0.016 11 0 "[ . 1 . 2 . 3 . 4]" 1
1723 1 73 VAL HA 1 76 GLU QG 4.570 . 4.570 3.821 3.124 4.574 0.004 12 0 "[ . 1 . 2 . 3 . 4]" 1
1724 1 73 VAL HA 1 77 LYS H 4.710 . 4.710 4.005 3.950 4.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1725 1 73 VAL HA 1 77 LYS QD 4.160 . 4.160 3.978 3.579 4.206 0.046 6 0 "[ . 1 . 2 . 3 . 4]" 1
1726 1 73 VAL HB 1 74 ILE H 3.950 . 3.950 2.574 2.549 2.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1727 1 73 VAL HB 1 74 ILE HB 5.500 . 5.500 4.768 4.698 4.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1728 1 73 VAL QG 1 74 ILE H 3.230 . 3.230 3.247 3.230 3.274 0.044 38 0 "[ . 1 . 2 . 3 . 4]" 1
1729 1 73 VAL QG 1 74 ILE HA 4.370 . 4.370 3.581 3.484 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1730 1 73 VAL QG 1 76 GLU HB2 4.430 . 4.430 3.902 3.626 4.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1731 1 73 VAL QG 1 76 GLU HB3 5.440 . 5.440 4.989 4.661 5.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1732 1 73 VAL QG 1 76 GLU QG 5.280 . 5.280 4.526 3.920 5.013 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1733 1 73 VAL QG 1 77 LYS H 4.680 . 4.680 4.028 3.806 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1734 1 73 VAL QG 1 77 LYS QB 4.670 . 4.670 3.700 3.512 3.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1735 1 73 VAL QG 1 77 LYS QD 3.150 . 3.150 2.224 2.087 2.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1736 1 73 VAL QG 1 77 LYS QE 2.890 . 2.890 2.399 2.183 2.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1737 1 73 VAL MG1 1 74 ILE H 3.820 . 3.820 3.532 3.497 3.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1738 1 73 VAL MG1 1 76 GLU HB2 5.130 . 5.130 4.118 3.796 4.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1739 1 73 VAL MG1 1 77 LYS HE2 5.220 . 5.220 2.640 2.332 3.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1740 1 73 VAL MG1 1 77 LYS HE3 5.220 . 5.220 2.796 2.608 2.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1741 1 73 VAL MG2 1 74 ILE H 3.820 . 3.820 3.790 3.738 3.822 0.002 32 0 "[ . 1 . 2 . 3 . 4]" 1
1742 1 73 VAL MG2 1 76 GLU HB2 5.130 . 5.130 4.843 4.596 5.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1743 1 73 VAL MG2 1 77 LYS HE2 5.220 . 5.220 4.779 4.526 5.221 0.001 16 0 "[ . 1 . 2 . 3 . 4]" 1
1744 1 73 VAL MG2 1 77 LYS HE3 5.220 . 5.220 5.165 4.932 5.247 0.027 33 0 "[ . 1 . 2 . 3 . 4]" 1
1745 1 74 ILE H 1 74 ILE HB 3.660 . 3.660 2.392 2.355 2.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1746 1 74 ILE H 1 74 ILE MD 3.810 . 3.810 3.616 3.557 3.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1747 1 74 ILE H 1 74 ILE HG12 4.350 . 4.350 3.723 3.649 3.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1748 1 74 ILE H 1 74 ILE QG 3.600 . 3.600 2.391 2.333 2.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1749 1 74 ILE H 1 74 ILE HG13 4.350 . 4.350 2.420 2.360 2.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1750 1 74 ILE H 1 74 ILE MG 3.840 . 3.840 3.797 3.778 3.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1751 1 74 ILE H 1 75 MET H 3.740 . 3.740 2.609 2.539 2.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1752 1 74 ILE H 1 76 GLU H 4.730 . 4.730 4.292 4.182 4.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1753 1 74 ILE HA 1 74 ILE HG12 4.010 . 4.010 2.479 2.428 2.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1754 1 74 ILE HA 1 74 ILE QG 3.480 . 3.480 2.322 2.269 2.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1755 1 74 ILE HA 1 74 ILE HG13 4.010 . 4.010 2.801 2.705 2.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1756 1 74 ILE HA 1 74 ILE MG 3.410 . 3.410 2.568 2.540 2.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1757 1 74 ILE HA 1 77 LYS H 4.590 . 4.590 3.558 3.420 3.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1758 1 74 ILE HA 1 77 LYS QB 4.070 . 4.070 2.694 2.551 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1759 1 74 ILE HA 1 78 SER H 4.650 . 4.650 3.835 3.603 3.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1760 1 74 ILE HA 1 78 SER HG 4.450 . 4.450 3.553 3.265 4.450 0.000 29 0 "[ . 1 . 2 . 3 . 4]" 1
1761 1 74 ILE HB 1 74 ILE MD 3.500 . 3.500 2.449 2.398 2.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1762 1 74 ILE HB 1 75 MET H 3.640 . 3.640 2.663 2.564 2.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1763 1 74 ILE HB 1 77 LYS QB 5.500 . 5.500 5.469 5.323 5.529 0.029 6 0 "[ . 1 . 2 . 3 . 4]" 1
1764 1 74 ILE MD 1 74 ILE MG 2.810 . 2.810 2.057 2.007 2.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1765 1 74 ILE MD 1 75 MET H 5.260 . 5.260 4.670 4.577 4.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1766 1 74 ILE MD 1 78 SER HG 5.500 . 5.500 5.305 4.997 5.577 0.077 37 0 "[ . 1 . 2 . 3 . 4]" 1
1767 1 74 ILE MG 1 75 MET H 3.920 . 3.920 3.270 3.174 3.350 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1768 1 74 ILE MG 1 75 MET HA 4.030 . 4.030 3.238 3.083 3.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1769 1 74 ILE MG 1 77 LYS QB 5.160 . 5.160 4.056 3.898 4.158 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1770 1 74 ILE MG 1 78 SER H 4.390 . 4.390 3.877 3.639 4.000 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1771 1 74 ILE MG 1 78 SER HB2 5.260 . 5.260 3.842 3.565 4.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1772 1 74 ILE MG 1 78 SER HB3 5.260 . 5.260 4.083 2.882 4.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1773 1 74 ILE MG 1 78 SER HG 3.640 . 3.640 2.373 2.159 2.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1774 1 75 MET H 1 75 MET HB2 4.110 . 4.110 2.315 2.156 3.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1775 1 75 MET H 1 75 MET QB 3.510 . 3.510 2.222 1.996 2.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1776 1 75 MET H 1 75 MET HB3 4.110 . 4.110 3.015 2.021 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1777 1 75 MET H 1 75 MET ME 4.030 . 4.030 4.003 3.866 4.054 0.024 7 0 "[ . 1 . 2 . 3 . 4]" 1
1778 1 75 MET H 1 75 MET QG 4.450 . 4.450 3.424 2.294 3.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1779 1 75 MET H 1 76 GLU H 3.630 . 3.630 2.894 2.760 2.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1780 1 75 MET HA 1 75 MET ME 4.860 . 4.860 4.325 4.101 4.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1781 1 75 MET QB 1 76 GLU H 3.640 . 3.640 2.418 2.265 3.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1782 1 75 MET HB2 1 76 GLU H 4.180 . 4.180 3.319 2.306 4.182 0.002 23 0 "[ . 1 . 2 . 3 . 4]" 1
1783 1 75 MET HB3 1 76 GLU H 4.180 . 4.180 2.726 2.333 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1784 1 75 MET ME 1 75 MET QG 3.420 . 3.420 2.373 2.124 2.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1785 1 75 MET ME 1 76 GLU H 5.020 . 5.020 4.983 4.568 5.076 0.056 21 0 "[ . 1 . 2 . 3 . 4]" 1
1786 1 75 MET QG 1 76 GLU H 4.380 . 4.380 3.916 2.721 4.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1787 1 76 GLU H 1 76 GLU HB2 3.200 . 3.200 2.343 2.135 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1788 1 76 GLU H 1 76 GLU HB3 3.600 . 3.600 3.567 3.467 3.612 0.012 21 0 "[ . 1 . 2 . 3 . 4]" 1
1789 1 76 GLU H 1 76 GLU HG2 4.160 . 4.160 3.210 2.322 3.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1790 1 76 GLU H 1 76 GLU QG 3.610 . 3.610 2.387 2.248 2.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1791 1 76 GLU H 1 76 GLU HG3 4.160 . 4.160 2.928 2.269 4.062 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1792 1 76 GLU H 1 77 LYS H 3.610 . 3.610 2.761 2.693 2.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1793 1 76 GLU H 1 78 SER H 4.770 . 4.770 4.096 3.995 4.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1794 1 76 GLU HA 1 76 GLU HG2 3.830 . 3.830 2.754 2.478 3.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1795 1 76 GLU HA 1 76 GLU QG 3.080 . 3.080 2.588 2.337 3.052 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1796 1 76 GLU HA 1 76 GLU HG3 3.830 . 3.830 3.190 2.750 3.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1797 1 76 GLU HA 1 79 THR H 3.920 . 3.920 3.448 3.227 3.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1798 1 76 GLU HA 1 79 THR HB 4.310 . 4.310 2.756 2.432 3.007 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1799 1 76 GLU HA 1 79 THR HG1 4.770 . 4.770 3.084 2.805 3.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1800 1 76 GLU HA 1 79 THR MG 4.440 . 4.440 4.108 3.794 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1801 1 76 GLU HB2 1 77 LYS H 3.710 . 3.710 2.483 2.365 2.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1802 1 76 GLU HB2 1 78 SER H 5.500 . 5.500 4.864 4.768 5.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1803 1 76 GLU HB3 1 77 LYS H 3.900 . 3.900 3.372 3.135 3.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1804 1 76 GLU QG 1 77 LYS H 4.620 . 4.620 4.149 4.023 4.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1805 1 76 GLU HG2 1 77 LYS H 5.250 . 5.250 4.795 4.315 5.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1806 1 76 GLU HG3 1 77 LYS H 5.250 . 5.250 4.620 4.379 5.109 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1807 1 77 LYS H 1 77 LYS QB 3.430 . 3.430 2.209 2.113 2.281 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1808 1 77 LYS H 1 77 LYS HD2 4.670 . 4.670 3.484 3.046 3.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1809 1 77 LYS H 1 77 LYS HD3 4.670 . 4.670 3.890 2.657 4.675 0.005 18 0 "[ . 1 . 2 . 3 . 4]" 1
1810 1 77 LYS H 1 77 LYS HG2 4.440 . 4.440 3.968 3.765 4.220 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1811 1 77 LYS H 1 77 LYS QG 3.820 . 3.820 2.987 2.426 3.759 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1812 1 77 LYS H 1 77 LYS HG3 4.440 . 4.440 3.188 2.456 4.222 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1813 1 77 LYS HA 1 77 LYS HD2 5.090 . 5.090 3.777 2.552 4.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1814 1 77 LYS HA 1 77 LYS QD 4.390 . 4.390 3.422 2.492 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1815 1 77 LYS HA 1 77 LYS HD3 5.090 . 5.090 4.089 3.475 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1816 1 77 LYS HA 1 77 LYS HG2 4.040 . 4.040 2.990 2.503 3.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1817 1 77 LYS HA 1 77 LYS QG 3.380 . 3.380 2.382 2.313 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1818 1 77 LYS HA 1 77 LYS HG3 4.040 . 4.040 2.634 2.465 2.762 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1819 1 77 LYS HA 1 80 MET ME 3.640 . 3.640 2.364 1.983 2.654 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1820 1 77 LYS HA 1 80 MET HG2 4.530 . 4.530 2.958 2.207 4.538 0.008 26 0 "[ . 1 . 2 . 3 . 4]" 1
1821 1 77 LYS HA 1 80 MET QG 3.900 . 3.900 2.507 2.193 2.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1822 1 77 LYS HA 1 80 MET HG3 4.530 . 4.530 3.706 2.592 4.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1823 1 77 LYS HA 1 81 LEU QD 5.380 . 5.380 4.365 4.186 4.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1824 1 77 LYS QB 1 77 LYS HE2 5.080 . 5.080 4.229 4.028 4.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1825 1 77 LYS QB 1 77 LYS QE 4.340 . 4.340 3.694 3.654 3.721 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1826 1 77 LYS QB 1 77 LYS HE3 5.080 . 5.080 4.139 3.870 4.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1827 1 77 LYS QB 1 78 SER H 3.860 . 3.860 2.768 2.629 2.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1828 1 77 LYS QB 1 80 MET ME 4.840 . 4.840 3.050 2.660 3.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1829 1 77 LYS QB 1 81 LEU QD 4.900 . 4.900 3.341 3.093 3.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1830 1 77 LYS QD 1 80 MET ME 5.340 . 5.340 3.512 2.470 4.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1831 1 77 LYS QG 1 80 MET ME 3.930 . 3.930 2.275 2.098 2.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1832 1 78 SER H 1 78 SER HB2 4.090 . 4.090 2.693 2.501 3.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1833 1 78 SER H 1 78 SER QB 3.590 . 3.590 2.511 2.457 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1834 1 78 SER H 1 78 SER HB3 4.090 . 4.090 3.483 2.630 3.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1835 1 78 SER H 1 78 SER HG 3.440 . 3.440 2.197 2.069 2.798 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1836 1 78 SER H 1 79 THR H 3.670 . 3.670 2.533 2.486 2.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1837 1 78 SER H 1 79 THR HB 5.130 . 5.130 4.775 4.636 4.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1838 1 78 SER H 1 80 MET H 4.670 . 4.670 4.119 4.024 4.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1839 1 78 SER H 1 80 MET QB 5.500 . 5.500 5.455 5.141 5.543 0.043 34 0 "[ . 1 . 2 . 3 . 4]" 1
1840 1 78 SER H 1 81 LEU QB 5.340 . 5.340 5.026 4.868 5.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1841 1 78 SER HA 1 81 LEU HB2 4.700 . 4.700 2.691 2.494 2.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1842 1 78 SER HA 1 81 LEU QB 4.050 . 4.050 2.663 2.471 2.891 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1843 1 78 SER HA 1 81 LEU HB3 4.700 . 4.700 4.267 4.036 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1844 1 78 SER HA 1 81 LEU QD 3.690 . 3.690 2.882 2.406 3.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1845 1 78 SER HA 1 82 TYR H 4.670 . 4.670 3.853 3.702 4.002 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1846 1 78 SER QB 1 80 MET H 5.340 . 5.340 4.844 4.671 5.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1847 1 78 SER QB 1 81 LEU QD 5.280 . 5.280 4.418 3.749 4.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1848 1 78 SER HG 1 79 THR H 4.410 . 4.410 3.913 3.267 4.120 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1849 1 79 THR H 1 79 THR HB 3.470 . 3.470 2.535 2.398 2.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1850 1 79 THR H 1 79 THR HG1 3.380 . 3.380 2.221 2.089 2.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1851 1 79 THR H 1 79 THR MG 3.930 . 3.930 3.776 3.751 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1852 1 79 THR H 1 80 MET H 3.470 . 3.470 2.713 2.639 2.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1853 1 79 THR H 1 80 MET QB 5.500 . 5.500 4.718 4.607 4.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1854 1 79 THR HA 1 79 THR MG 3.220 . 3.220 2.384 2.346 2.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1855 1 79 THR HA 1 82 TYR H 4.690 . 4.690 3.444 3.230 3.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1856 1 79 THR HA 1 82 TYR HB2 4.570 . 4.570 3.642 3.240 3.961 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1857 1 79 THR HA 1 82 TYR QB 3.970 . 3.970 2.543 2.346 2.770 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1858 1 79 THR HA 1 82 TYR HB3 4.570 . 4.570 2.596 2.407 2.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1859 1 79 THR HA 1 82 TYR QD 4.610 . 4.610 3.939 3.622 4.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1860 1 79 THR HA 1 83 ASN H 4.660 . 4.660 3.802 3.630 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1861 1 79 THR HB 1 80 MET H 3.630 . 3.630 2.641 2.545 2.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1862 1 79 THR HG1 1 79 THR MG 3.360 . 3.360 2.991 2.949 3.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1863 1 79 THR HG1 1 80 MET H 4.700 . 4.700 4.169 4.023 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1864 1 79 THR MG 1 80 MET H 3.730 . 3.730 3.505 3.254 3.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1865 1 79 THR MG 1 80 MET HA 3.740 . 3.740 3.490 3.307 3.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1866 1 79 THR MG 1 80 MET QB 4.560 . 4.560 4.371 4.143 4.695 0.135 7 0 "[ . 1 . 2 . 3 . 4]" 1
1867 1 79 THR MG 1 82 TYR H 5.180 . 5.180 4.803 4.616 4.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1868 1 79 THR MG 1 82 TYR QB 5.200 . 5.200 3.746 3.388 3.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1869 1 79 THR MG 1 82 TYR QD 4.780 . 4.780 3.899 3.517 4.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1870 1 79 THR MG 1 83 ASN H 4.400 . 4.400 3.956 3.806 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1871 1 79 THR MG 1 83 ASN HB2 4.200 . 4.200 3.945 3.740 4.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1872 1 79 THR MG 1 83 ASN HD21 3.320 . 3.320 2.496 2.197 2.696 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1873 1 79 THR MG 1 83 ASN QD 2.910 . 2.910 2.322 2.112 2.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1874 1 79 THR MG 1 83 ASN HD22 3.320 . 3.320 2.819 2.305 3.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1875 1 80 MET H 1 80 MET QB 3.060 . 3.060 2.330 2.199 2.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1876 1 80 MET H 1 80 MET ME 4.610 . 4.610 4.446 3.874 4.641 0.031 38 0 "[ . 1 . 2 . 3 . 4]" 1
1877 1 80 MET H 1 80 MET HG2 4.600 . 4.600 2.826 2.516 3.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1878 1 80 MET H 1 80 MET QG 3.970 . 3.970 2.557 2.128 2.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1879 1 80 MET H 1 80 MET HG3 4.600 . 4.600 3.512 2.169 4.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1880 1 80 MET H 1 81 LEU H 3.570 . 3.570 2.717 2.653 2.794 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1881 1 80 MET H 1 81 LEU HA 5.500 . 5.500 5.351 5.307 5.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1882 1 80 MET H 1 81 LEU QD 5.430 . 5.430 4.981 4.751 5.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1883 1 80 MET H 1 81 LEU HG 5.500 . 5.500 5.023 4.610 5.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1884 1 80 MET H 1 82 TYR H 4.840 . 4.840 4.218 4.085 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1885 1 80 MET HA 1 83 ASN H 4.040 . 4.040 3.649 3.394 3.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1886 1 80 MET HA 1 83 ASN HB2 4.840 . 4.840 2.872 2.486 3.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1887 1 80 MET HA 1 83 ASN QD 4.710 . 4.710 3.356 2.737 3.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1888 1 80 MET QB 1 81 LEU H 3.570 . 3.570 3.219 2.244 3.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1889 1 80 MET QB 1 81 LEU QB 5.090 . 5.090 4.857 4.022 5.141 0.051 18 0 "[ . 1 . 2 . 3 . 4]" 1
1890 1 80 MET QB 1 82 TYR H 5.500 . 5.500 5.118 4.567 5.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1891 1 80 MET QB 1 83 ASN HB2 5.040 . 5.040 4.538 4.162 5.043 0.003 22 0 "[ . 1 . 2 . 3 . 4]" 1
1892 1 80 MET ME 1 80 MET HG2 3.650 . 3.650 2.703 2.366 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1893 1 80 MET ME 1 80 MET QG 3.140 . 3.140 2.280 2.172 2.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1894 1 80 MET ME 1 80 MET HG3 3.650 . 3.650 2.520 2.408 2.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1895 1 80 MET ME 1 81 LEU H 4.100 . 4.100 4.019 3.835 4.107 0.007 34 0 "[ . 1 . 2 . 3 . 4]" 1
1896 1 80 MET ME 1 81 LEU QB 5.340 . 5.340 4.552 4.288 5.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1897 1 80 MET ME 1 81 LEU MD1 4.110 . 4.110 3.560 3.069 4.150 0.040 30 0 "[ . 1 . 2 . 3 . 4]" 1
1898 1 80 MET ME 1 81 LEU QD 3.490 . 3.490 3.217 2.864 3.678 0.188 13 0 "[ . 1 . 2 . 3 . 4]" 1
1899 1 80 MET ME 1 81 LEU MD2 4.110 . 4.110 3.686 3.225 4.140 0.030 34 0 "[ . 1 . 2 . 3 . 4]" 1
1900 1 81 LEU H 1 81 LEU HB2 3.730 . 3.730 2.234 2.121 2.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1901 1 81 LEU H 1 81 LEU QB 3.240 . 3.240 2.211 2.103 2.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1902 1 81 LEU H 1 81 LEU HB3 3.730 . 3.730 3.529 3.452 3.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1903 1 81 LEU H 1 81 LEU MD1 4.190 . 4.190 3.517 3.267 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1904 1 81 LEU H 1 81 LEU QD 3.570 . 3.570 3.268 3.070 3.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1905 1 81 LEU H 1 81 LEU MD2 4.190 . 4.190 3.888 3.552 4.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1906 1 81 LEU H 1 81 LEU HG 3.900 . 3.900 2.751 2.327 3.135 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1907 1 81 LEU H 1 82 TYR H 3.760 . 3.760 2.615 2.545 2.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1908 1 81 LEU H 1 83 ASN H 4.680 . 4.680 4.134 4.015 4.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1909 1 81 LEU HA 1 81 LEU MD1 4.040 . 4.040 3.824 3.785 3.863 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1910 1 81 LEU HA 1 81 LEU QD 2.720 . 2.720 2.115 2.051 2.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1911 1 81 LEU HA 1 81 LEU MD2 4.040 . 4.040 2.125 2.060 2.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1912 1 81 LEU HA 1 81 LEU HG 3.950 . 3.950 2.769 2.619 2.952 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1913 1 81 LEU HA 1 83 ASN H 4.670 . 4.670 4.458 4.344 4.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1914 1 81 LEU HA 1 84 LYS H 4.170 . 4.170 3.232 3.073 3.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1915 1 81 LEU HA 1 84 LYS QB 3.430 . 3.430 2.367 2.204 2.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1916 1 81 LEU HA 1 84 LYS QD 3.810 . 3.810 3.172 2.749 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1917 1 81 LEU HA 1 84 LYS QE 5.500 . 5.500 5.074 4.734 5.507 0.007 25 0 "[ . 1 . 2 . 3 . 4]" 1
1918 1 81 LEU HA 1 85 PHE QD 4.740 . 4.740 4.380 4.154 4.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1919 1 81 LEU QB 1 81 LEU QD 2.740 . 2.740 1.907 1.882 1.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1920 1 81 LEU QB 1 85 PHE QE 5.340 . 5.340 2.911 2.504 3.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1921 1 81 LEU HB2 1 82 TYR H 4.180 . 4.180 2.690 2.487 2.836 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1922 1 81 LEU HB3 1 82 TYR H 4.180 . 4.180 3.393 3.174 3.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1923 1 81 LEU QD 1 82 TYR H 4.360 . 4.360 4.110 3.973 4.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1924 1 81 LEU QD 1 84 LYS H 5.410 . 5.410 4.657 4.474 4.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1925 1 81 LEU QD 1 84 LYS QB 4.080 . 4.080 3.131 2.931 3.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1926 1 81 LEU QD 1 84 LYS QD 3.600 . 3.600 2.490 2.059 3.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1927 1 81 LEU QD 1 84 LYS QE 4.210 . 4.210 3.712 3.237 4.214 0.004 25 0 "[ . 1 . 2 . 3 . 4]" 1
1928 1 81 LEU QD 1 85 PHE QD 3.980 . 3.980 3.915 3.597 4.078 0.098 15 0 "[ . 1 . 2 . 3 . 4]" 1
1929 1 81 LEU QD 1 85 PHE QE 3.560 . 3.560 2.790 2.360 3.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1930 1 81 LEU QD 1 85 PHE HZ 4.630 . 4.630 3.735 3.218 4.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1931 1 81 LEU MD1 1 82 TYR H 5.420 . 5.420 4.503 4.266 4.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1932 1 81 LEU MD1 1 85 PHE QD 5.500 . 5.500 4.996 4.703 5.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1933 1 81 LEU MD1 1 85 PHE QE 4.800 . 4.800 3.773 3.295 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1934 1 81 LEU MD2 1 82 TYR H 5.420 . 5.420 4.748 4.660 4.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1935 1 81 LEU MD2 1 85 PHE QD 5.500 . 5.500 4.095 3.724 4.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1936 1 81 LEU MD2 1 85 PHE QE 4.800 . 4.800 2.883 2.397 3.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1937 1 82 TYR H 1 82 TYR HB2 3.710 . 3.710 2.565 2.441 2.639 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1938 1 82 TYR H 1 82 TYR HB3 3.710 . 3.710 2.429 2.355 2.568 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1939 1 82 TYR H 1 82 TYR QD 4.360 . 4.360 4.209 4.174 4.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1940 1 82 TYR H 1 83 ASN H 3.690 . 3.690 2.710 2.607 2.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1941 1 82 TYR H 1 84 LYS H 4.930 . 4.930 4.024 3.910 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1942 1 82 TYR HA 1 82 TYR QD 3.780 . 3.780 2.805 2.572 2.959 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1943 1 82 TYR HA 1 84 LYS H 5.500 . 5.500 4.399 4.304 4.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1944 1 82 TYR HA 1 85 PHE H 5.500 . 5.500 3.591 3.403 3.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1945 1 82 TYR HA 1 85 PHE QB 5.320 . 5.320 2.999 2.726 3.231 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1946 1 82 TYR HA 1 85 PHE QD 4.110 . 4.110 2.818 2.484 3.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1947 1 82 TYR QB 1 83 ASN H 3.780 . 3.780 2.512 2.416 2.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1948 1 82 TYR QD 1 83 ASN H 4.140 . 4.140 3.366 3.145 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1949 1 82 TYR QD 1 83 ASN HA 4.600 . 4.600 3.498 3.108 3.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1950 1 82 TYR QD 1 86 LYS H 5.240 . 5.240 4.911 4.681 5.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1951 1 82 TYR QD 1 86 LYS QD 5.340 . 5.340 3.709 3.147 4.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1952 1 82 TYR QE 1 86 LYS HB2 5.460 . 5.460 4.189 3.498 5.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1953 1 82 TYR QE 1 86 LYS HB3 5.460 . 5.460 5.119 4.548 5.469 0.009 33 0 "[ . 1 . 2 . 3 . 4]" 1
1954 1 82 TYR QE 1 86 LYS HD2 4.810 . 4.810 3.389 2.339 4.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1955 1 82 TYR QE 1 86 LYS QD 4.200 . 4.200 2.692 2.276 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1956 1 82 TYR QE 1 86 LYS HD3 4.810 . 4.810 3.095 2.327 4.816 0.006 38 0 "[ . 1 . 2 . 3 . 4]" 1
1957 1 82 TYR QE 1 86 LYS QE 4.350 . 4.350 3.630 2.157 4.404 0.054 6 0 "[ . 1 . 2 . 3 . 4]" 1
1958 1 83 ASN H 1 83 ASN HB2 3.370 . 3.370 2.374 2.229 2.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1959 1 83 ASN H 1 83 ASN HB3 3.760 . 3.760 3.600 3.540 3.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1960 1 83 ASN H 1 83 ASN HD21 4.930 . 4.930 4.457 4.273 4.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1961 1 83 ASN H 1 83 ASN QD 4.140 . 4.140 3.710 3.197 4.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1962 1 83 ASN H 1 83 ASN HD22 4.930 . 4.930 3.980 3.288 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1963 1 83 ASN H 1 84 LYS H 3.530 . 3.530 2.656 2.605 2.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1964 1 83 ASN H 1 84 LYS QB 4.670 . 4.670 4.395 4.254 4.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1965 1 83 ASN HA 1 86 LYS H 4.240 . 4.240 3.132 2.996 3.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1966 1 83 ASN HA 1 86 LYS HB2 4.390 . 4.390 2.691 2.164 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1967 1 83 ASN HA 1 86 LYS QB 3.720 . 3.720 2.237 2.073 2.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1968 1 83 ASN HA 1 86 LYS HB3 4.390 . 4.390 2.580 2.175 3.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1969 1 83 ASN HA 1 86 LYS QG 5.220 . 5.220 3.934 2.373 4.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1970 1 83 ASN HA 1 87 ASN H 4.300 . 4.300 3.820 3.605 4.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1971 1 83 ASN HB2 1 84 LYS H 4.000 . 4.000 2.848 2.690 3.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1972 1 83 ASN HB2 1 86 LYS H 5.500 . 5.500 5.416 5.321 5.506 0.006 23 0 "[ . 1 . 2 . 3 . 4]" 1
1973 1 83 ASN HB2 1 86 LYS QB 5.340 . 5.340 4.842 4.660 5.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1974 1 83 ASN HB3 1 84 LYS H 4.170 . 4.170 3.676 3.431 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1975 1 84 LYS H 1 84 LYS QB 3.110 . 3.110 2.237 2.183 2.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1976 1 84 LYS H 1 84 LYS HD2 5.500 . 5.500 4.961 4.577 5.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1977 1 84 LYS H 1 84 LYS QD 4.740 . 4.740 4.315 4.203 4.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1978 1 84 LYS H 1 84 LYS HD3 5.500 . 5.500 4.755 4.644 4.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1979 1 84 LYS H 1 84 LYS HG2 4.760 . 4.760 4.455 4.380 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1980 1 84 LYS H 1 84 LYS QG 4.190 . 4.190 4.022 3.985 4.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1981 1 84 LYS H 1 84 LYS HG3 4.760 . 4.760 4.580 4.511 4.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1982 1 84 LYS H 1 86 LYS QB 5.340 . 5.340 4.714 4.525 4.984 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1983 1 84 LYS H 1 87 ASN H 5.290 . 5.290 4.899 4.747 5.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1984 1 84 LYS HA 1 84 LYS QE 5.500 . 5.500 5.042 4.828 5.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1985 1 84 LYS HA 1 84 LYS HG2 3.860 . 3.860 3.098 2.486 3.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1986 1 84 LYS HA 1 84 LYS QG 3.280 . 3.280 2.584 2.436 2.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1987 1 84 LYS HA 1 84 LYS HG3 3.860 . 3.860 2.889 2.644 3.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1988 1 84 LYS HA 1 87 ASN H 4.450 . 4.450 3.807 3.517 4.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1989 1 84 LYS HA 1 87 ASN QB 4.360 . 4.360 3.638 2.870 4.374 0.014 24 0 "[ . 1 . 2 . 3 . 4]" 1
1990 1 84 LYS QB 1 84 LYS HD2 3.500 . 3.500 2.416 2.123 2.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1991 1 84 LYS QB 1 84 LYS HD3 3.500 . 3.500 2.353 2.227 2.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1992 1 84 LYS QB 1 84 LYS QE 3.670 . 3.670 3.569 3.484 3.676 0.006 22 0 "[ . 1 . 2 . 3 . 4]" 1
1993 1 84 LYS QB 1 85 PHE H 3.440 . 3.440 2.424 2.311 2.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1994 1 84 LYS QB 1 86 LYS H 4.910 . 4.910 4.635 4.497 4.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1995 1 84 LYS QD 1 85 PHE QD 5.330 . 5.330 4.366 3.164 4.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1996 1 84 LYS QD 1 85 PHE QE 4.770 . 4.770 4.205 3.304 4.771 0.001 25 0 "[ . 1 . 2 . 3 . 4]" 1
1997 1 84 LYS HD2 1 85 PHE H 5.500 . 5.500 5.076 3.683 5.504 0.004 33 0 "[ . 1 . 2 . 3 . 4]" 1
1998 1 84 LYS HD3 1 85 PHE H 5.500 . 5.500 4.131 3.192 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1999 1 84 LYS QE 1 84 LYS HG2 3.290 . 3.290 2.500 2.317 3.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2000 1 84 LYS QE 1 84 LYS QG 2.860 . 2.860 2.245 2.145 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2001 1 84 LYS QE 1 84 LYS HG3 3.290 . 3.290 2.693 2.371 3.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2002 1 84 LYS QE 1 85 PHE H 5.150 . 5.150 5.148 4.986 5.196 0.046 2 0 "[ . 1 . 2 . 3 . 4]" 1
2003 1 84 LYS QE 1 85 PHE QE 4.420 . 4.420 4.031 3.196 4.441 0.021 29 0 "[ . 1 . 2 . 3 . 4]" 1
2004 1 84 LYS QE 1 88 MET ME 3.690 . 3.690 3.237 2.397 3.762 0.072 21 0 "[ . 1 . 2 . 3 . 4]" 1
2005 1 84 LYS QG 1 85 PHE H 4.010 . 4.010 3.470 3.138 4.038 0.028 11 0 "[ . 1 . 2 . 3 . 4]" 1
2006 1 84 LYS QG 1 85 PHE QD 5.340 . 5.340 4.315 3.688 5.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2007 1 84 LYS QG 1 88 MET ME 4.530 . 4.530 3.336 2.385 4.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2008 1 85 PHE H 1 85 PHE QB 3.460 . 3.460 2.352 2.300 2.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2009 1 85 PHE H 1 85 PHE QD 3.820 . 3.820 3.030 2.885 3.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2010 1 85 PHE H 1 85 PHE QE 4.820 . 4.820 4.691 4.565 4.822 0.002 22 0 "[ . 1 . 2 . 3 . 4]" 1
2011 1 85 PHE H 1 86 LYS H 3.610 . 3.610 2.680 2.534 2.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2012 1 85 PHE H 1 86 LYS HA 5.360 . 5.360 5.276 5.147 5.365 0.005 25 0 "[ . 1 . 2 . 3 . 4]" 1
2013 1 85 PHE H 1 87 ASN H 5.500 . 5.500 4.493 4.319 4.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2014 1 85 PHE H 1 88 MET ME 5.390 . 5.390 4.625 4.202 5.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2015 1 85 PHE HA 1 85 PHE QD 3.490 . 3.490 2.301 2.161 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2016 1 85 PHE HA 1 85 PHE QE 4.860 . 4.860 4.365 4.317 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2017 1 85 PHE HA 1 87 ASN H 5.080 . 5.080 4.580 4.422 4.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2018 1 85 PHE HA 1 88 MET H 4.140 . 4.140 3.442 3.233 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2019 1 85 PHE HA 1 88 MET QB 4.180 . 4.180 2.858 2.414 3.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2020 1 85 PHE HA 1 88 MET ME 3.230 . 3.230 2.622 2.204 3.236 0.006 18 0 "[ . 1 . 2 . 3 . 4]" 1
2021 1 85 PHE HA 1 88 MET HG2 4.730 . 4.730 4.396 3.987 4.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2022 1 85 PHE HA 1 88 MET QG 4.040 . 4.040 2.757 2.505 3.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2023 1 85 PHE HA 1 88 MET HG3 4.730 . 4.730 2.793 2.523 3.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2024 1 85 PHE QB 1 86 LYS H 4.040 . 4.040 2.708 2.566 2.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2025 1 85 PHE QB 1 88 MET ME 4.440 . 4.440 3.848 3.577 4.472 0.032 18 0 "[ . 1 . 2 . 3 . 4]" 1
2026 1 85 PHE QB 1 89 PHE QD 4.380 . 4.380 3.714 3.362 4.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2027 1 85 PHE QB 1 89 PHE QE 4.890 . 4.890 3.215 2.736 3.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2028 1 85 PHE QD 1 86 LYS H 4.690 . 4.690 4.496 4.380 4.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2029 1 85 PHE QD 1 88 MET ME 3.240 . 3.240 2.133 1.989 2.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2030 1 85 PHE QD 1 88 MET HG2 5.500 . 5.500 5.450 4.825 5.549 0.049 11 0 "[ . 1 . 2 . 3 . 4]" 1
2031 1 85 PHE QD 1 88 MET HG3 5.500 . 5.500 4.144 3.930 5.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2032 1 85 PHE QE 1 88 MET ME 3.450 . 3.450 2.706 2.449 3.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2033 1 86 LYS H 1 86 LYS HB2 3.750 . 3.750 2.312 2.143 2.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2034 1 86 LYS H 1 86 LYS HB3 3.750 . 3.750 2.787 2.505 3.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2035 1 86 LYS H 1 86 LYS QE 5.500 . 5.500 5.146 4.504 5.582 0.082 30 0 "[ . 1 . 2 . 3 . 4]" 1
2036 1 86 LYS H 1 86 LYS QG 4.270 . 4.270 3.757 2.444 4.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2037 1 86 LYS H 1 87 ASN H 3.710 . 3.710 2.879 2.750 3.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2038 1 86 LYS H 1 88 MET H 4.840 . 4.840 4.170 4.025 4.373 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2039 1 86 LYS HA 1 86 LYS HD2 5.390 . 5.390 3.994 2.181 4.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2040 1 86 LYS HA 1 86 LYS QD 4.540 . 4.540 3.621 2.155 4.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2041 1 86 LYS HA 1 86 LYS HD3 5.390 . 5.390 4.311 3.176 4.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2042 1 86 LYS HA 1 86 LYS QE 4.930 . 4.930 4.323 3.784 4.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2043 1 86 LYS HA 1 86 LYS QG 3.630 . 3.630 2.299 2.118 2.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2044 1 86 LYS HA 1 89 PHE H 4.620 . 4.620 3.788 3.623 4.140 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2045 1 86 LYS HA 1 89 PHE QD 4.560 . 4.560 3.461 2.904 3.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2046 1 86 LYS HA 1 89 PHE QE 5.500 . 5.500 5.306 4.694 5.522 0.022 21 0 "[ . 1 . 2 . 3 . 4]" 1
2047 1 86 LYS HA 1 90 LEU QD 4.650 . 4.650 3.851 3.476 4.100 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2048 1 86 LYS HA 1 90 LEU HG 5.500 . 5.500 3.717 3.081 4.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2049 1 86 LYS QB 1 86 LYS QD 3.210 . 3.210 2.137 2.017 2.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2050 1 86 LYS QB 1 87 ASN H 3.580 . 3.580 2.436 2.282 2.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2051 1 86 LYS QB 1 90 LEU QD 4.760 . 4.760 3.519 2.096 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2052 1 86 LYS HB2 1 87 ASN H 4.250 . 4.250 3.579 2.495 3.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2053 1 86 LYS HB3 1 87 ASN H 4.250 . 4.250 2.577 2.304 3.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2054 1 86 LYS QD 1 90 LEU QD 3.960 . 3.960 3.006 2.127 3.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2055 1 86 LYS QE 1 90 LEU MD1 4.730 . 4.730 2.474 2.113 3.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2056 1 86 LYS QE 1 90 LEU QD 3.540 . 3.540 2.459 2.106 3.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2057 1 86 LYS QE 1 90 LEU MD2 4.730 . 4.730 4.482 3.758 4.836 0.106 17 0 "[ . 1 . 2 . 3 . 4]" 1
2058 1 86 LYS QG 1 87 ASN H 4.140 . 4.140 3.779 3.349 4.163 0.023 34 0 "[ . 1 . 2 . 3 . 4]" 1
2059 1 86 LYS QG 1 90 LEU QD 4.160 . 4.160 2.238 1.960 3.781 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2060 1 86 LYS QG 1 90 LEU HG 4.610 . 4.610 3.075 2.162 4.638 0.028 13 0 "[ . 1 . 2 . 3 . 4]" 1
2061 1 86 LYS HG2 1 87 ASN H 4.720 . 4.720 4.046 3.449 4.726 0.006 18 0 "[ . 1 . 2 . 3 . 4]" 1
2062 1 86 LYS HG3 1 87 ASN H 4.720 . 4.720 4.627 4.243 4.734 0.014 36 0 "[ . 1 . 2 . 3 . 4]" 1
2063 1 87 ASN H 1 87 ASN HB2 3.700 . 3.700 2.861 2.114 3.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2064 1 87 ASN H 1 87 ASN QB 3.140 . 3.140 2.366 1.956 2.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2065 1 87 ASN H 1 87 ASN HB3 3.700 . 3.700 3.127 1.974 3.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2066 1 87 ASN H 1 87 ASN HD21 4.690 . 4.690 4.284 3.760 4.706 0.016 5 0 "[ . 1 . 2 . 3 . 4]" 1
2067 1 87 ASN H 1 87 ASN HD22 4.690 . 4.690 3.709 2.891 4.692 0.002 15 0 "[ . 1 . 2 . 3 . 4]" 1
2068 1 87 ASN H 1 88 MET H 3.570 . 3.570 2.728 2.591 2.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2069 1 87 ASN HA 1 90 LEU H 4.070 . 4.070 3.108 2.802 3.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2070 1 87 ASN HA 1 90 LEU HB2 4.940 . 4.940 2.672 2.380 2.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2071 1 87 ASN HA 1 90 LEU HB3 4.280 . 4.280 4.284 4.098 4.306 0.026 5 0 "[ . 1 . 2 . 3 . 4]" 1
2072 1 87 ASN HA 1 90 LEU QD 4.190 . 4.190 3.812 3.191 4.130 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2073 1 87 ASN HA 1 91 VAL H 4.100 . 4.100 2.548 1.862 3.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2074 1 87 ASN HA 1 91 VAL HB 4.320 . 4.320 4.068 3.302 4.341 0.021 21 0 "[ . 1 . 2 . 3 . 4]" 1
2075 1 87 ASN HA 1 91 VAL QG 4.190 . 4.190 3.584 2.285 4.429 0.239 2 0 "[ . 1 . 2 . 3 . 4]" 1
2076 1 87 ASN HA 1 92 GLY H 4.950 . 4.950 4.437 3.483 4.962 0.012 37 0 "[ . 1 . 2 . 3 . 4]" 1
2077 1 87 ASN QB 1 88 MET HA 5.340 . 5.340 4.190 3.891 4.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2078 1 87 ASN QB 1 90 LEU QD 5.280 . 5.280 5.026 4.490 5.371 0.091 27 0 "[ . 1 . 2 . 3 . 4]" 1
2079 1 87 ASN QB 1 91 VAL QG 4.430 . 4.430 3.237 2.240 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2080 1 87 ASN HB2 1 88 MET H 4.000 . 4.000 3.456 2.861 4.055 0.055 4 0 "[ . 1 . 2 . 3 . 4]" 1
2081 1 87 ASN HB3 1 88 MET H 4.000 . 4.000 3.874 3.201 4.039 0.039 11 0 "[ . 1 . 2 . 3 . 4]" 1
2082 1 88 MET H 1 88 MET HB2 3.600 . 3.600 2.468 2.312 2.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2083 1 88 MET H 1 88 MET QB 3.140 . 3.140 2.427 2.285 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2084 1 88 MET H 1 88 MET HB3 3.600 . 3.600 3.606 3.568 3.621 0.021 17 0 "[ . 1 . 2 . 3 . 4]" 1
2085 1 88 MET H 1 88 MET ME 4.530 . 4.530 4.254 4.120 4.565 0.035 18 0 "[ . 1 . 2 . 3 . 4]" 1
2086 1 88 MET H 1 88 MET HG2 3.880 . 3.880 3.237 2.880 3.888 0.008 20 0 "[ . 1 . 2 . 3 . 4]" 1
2087 1 88 MET H 1 88 MET QG 3.350 . 3.350 2.486 2.054 2.743 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2088 1 88 MET H 1 88 MET HG3 3.880 . 3.880 2.602 2.070 2.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2089 1 88 MET H 1 89 PHE H 3.470 . 3.470 2.744 2.586 3.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2090 1 88 MET H 1 90 LEU H 4.950 . 4.950 4.165 4.013 4.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2091 1 88 MET HA 1 88 MET ME 4.590 . 4.590 4.504 4.204 4.609 0.019 5 0 "[ . 1 . 2 . 3 . 4]" 1
2092 1 88 MET HA 1 88 MET HG2 3.840 . 3.840 2.374 2.199 2.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2093 1 88 MET HA 1 88 MET QG 3.330 . 3.330 2.300 2.169 2.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2094 1 88 MET HA 1 88 MET HG3 3.840 . 3.840 3.293 2.577 3.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2095 1 88 MET QB 1 89 PHE QE 5.340 . 5.340 3.664 2.954 4.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2096 1 88 MET HB2 1 89 PHE H 4.290 . 4.290 3.012 2.527 3.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2097 1 88 MET HB3 1 89 PHE H 4.290 . 4.290 3.839 3.540 4.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2098 1 88 MET ME 1 88 MET HG2 3.580 . 3.580 3.216 2.267 3.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2099 1 88 MET ME 1 88 MET HG3 3.580 . 3.580 2.539 2.368 3.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2100 1 88 MET ME 1 89 PHE QE 4.360 . 4.360 3.692 3.242 4.429 0.069 18 0 "[ . 1 . 2 . 3 . 4]" 1
2101 1 88 MET ME 1 89 PHE HZ 5.500 . 5.500 4.581 4.056 5.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2102 1 88 MET QG 1 89 PHE H 4.800 . 4.800 4.312 4.072 4.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2103 1 88 MET HG2 1 89 PHE H 5.500 . 5.500 5.010 4.871 5.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2104 1 88 MET HG3 1 89 PHE H 5.500 . 5.500 4.714 4.290 4.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2105 1 89 PHE H 1 89 PHE HB2 4.120 . 4.120 2.475 2.345 2.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2106 1 89 PHE H 1 89 PHE QB 3.510 . 3.510 2.439 2.317 2.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2107 1 89 PHE H 1 89 PHE HB3 4.120 . 4.120 3.684 3.610 3.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2108 1 89 PHE H 1 90 LEU H 3.560 . 3.560 2.204 2.081 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2109 1 89 PHE H 1 90 LEU HB2 4.930 . 4.930 4.354 4.189 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2110 1 89 PHE H 1 90 LEU HG 5.350 . 5.350 4.124 3.776 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2111 1 89 PHE HA 1 89 PHE QD 3.730 . 3.730 2.793 2.465 3.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2112 1 89 PHE HA 1 89 PHE QE 4.950 . 4.950 4.597 4.459 4.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2113 1 89 PHE QB 1 90 LEU H 3.970 . 3.970 2.786 2.521 3.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2114 1 89 PHE QB 1 90 LEU QD 4.410 . 4.410 3.233 2.663 3.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2115 1 89 PHE HB2 1 90 LEU H 4.650 . 4.650 2.870 2.576 3.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2116 1 89 PHE HB3 1 90 LEU H 4.650 . 4.650 3.783 3.502 4.242 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2117 1 89 PHE QD 1 90 LEU H 5.030 . 5.030 4.295 4.062 4.658 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2118 1 89 PHE QD 1 90 LEU QD 5.100 . 5.100 4.786 4.332 5.151 0.051 31 0 "[ . 1 . 2 . 3 . 4]" 1
2119 1 89 PHE QD 1 131 GLU QG 5.390 . 5.390 19.745 18.210 21.484 16.094 40 40 [**********************************-****+] 1
2120 1 89 PHE QE 1 126 THR HB 4.410 . 4.410 19.695 14.031 21.398 16.988 27 40 [**************************+**-**********] 1
2121 1 90 LEU H 1 90 LEU HB2 3.630 . 3.630 2.406 2.297 2.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2122 1 90 LEU H 1 90 LEU HB3 3.880 . 3.880 3.603 3.547 3.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2123 1 90 LEU H 1 90 LEU MD1 3.840 . 3.840 3.844 3.644 3.929 0.089 19 0 "[ . 1 . 2 . 3 . 4]" 1
2124 1 90 LEU H 1 90 LEU MD2 3.840 . 3.840 3.490 2.955 3.856 0.016 2 0 "[ . 1 . 2 . 3 . 4]" 1
2125 1 90 LEU H 1 90 LEU HG 4.100 . 4.100 2.645 2.408 2.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2126 1 90 LEU HA 1 90 LEU MD1 3.880 . 3.880 3.810 3.644 3.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2127 1 90 LEU HA 1 90 LEU QD 2.900 . 2.900 2.134 2.054 2.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2128 1 90 LEU HA 1 90 LEU MD2 3.880 . 3.880 2.146 2.063 2.231 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2129 1 90 LEU HA 1 92 GLY H 5.220 . 5.220 4.621 3.658 5.229 0.009 27 0 "[ . 1 . 2 . 3 . 4]" 1
2130 1 90 LEU HB2 1 90 LEU MD1 3.320 . 3.320 2.320 2.236 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2131 1 90 LEU HB2 1 90 LEU QD 2.830 . 2.830 2.272 2.197 2.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2132 1 90 LEU HB2 1 90 LEU MD2 3.320 . 3.320 3.248 3.216 3.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2133 1 90 LEU HB2 1 91 VAL H 3.820 . 3.820 2.578 2.074 3.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2134 1 90 LEU HB2 1 91 VAL QG 4.570 . 4.570 3.979 2.566 4.669 0.099 21 0 "[ . 1 . 2 . 3 . 4]" 1
2135 1 90 LEU HB3 1 90 LEU MD1 3.280 . 3.280 2.311 2.153 2.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2136 1 90 LEU HB3 1 90 LEU QD 2.850 . 2.850 2.126 2.077 2.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2137 1 90 LEU HB3 1 90 LEU MD2 3.280 . 3.280 2.496 2.378 2.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2138 1 90 LEU HB3 1 91 VAL H 3.940 . 3.940 3.516 3.069 3.943 0.003 29 0 "[ . 1 . 2 . 3 . 4]" 1
2139 1 90 LEU HB3 1 91 VAL QG 4.540 . 4.540 4.251 2.869 4.674 0.134 37 0 "[ . 1 . 2 . 3 . 4]" 1
2140 1 90 LEU QD 1 91 VAL H 4.560 . 4.560 4.083 3.751 4.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2141 1 91 VAL H 1 91 VAL HB 3.710 . 3.710 2.688 2.501 3.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2142 1 91 VAL H 1 91 VAL QG 2.940 . 2.940 2.773 2.223 3.161 0.221 21 0 "[ . 1 . 2 . 3 . 4]" 1
2143 1 91 VAL H 1 92 GLY H 3.490 . 3.490 2.806 1.953 3.509 0.019 2 0 "[ . 1 . 2 . 3 . 4]" 1
2144 1 91 VAL HB 1 92 GLY H 4.480 . 4.480 3.876 2.389 4.513 0.033 32 0 "[ . 1 . 2 . 3 . 4]" 1
2145 1 91 VAL QG 1 92 GLY H 3.640 . 3.640 3.401 2.768 3.677 0.037 30 0 "[ . 1 . 2 . 3 . 4]" 1
2146 1 91 VAL QG 1 93 GLU H 4.370 . 4.370 3.639 1.926 4.536 0.166 10 0 "[ . 1 . 2 . 3 . 4]" 1
2147 1 93 GLU H 1 93 GLU HB2 3.880 . 3.880 2.966 2.282 3.891 0.011 19 0 "[ . 1 . 2 . 3 . 4]" 1
2148 1 93 GLU H 1 93 GLU QB 3.160 . 3.160 2.695 2.173 3.184 0.024 16 0 "[ . 1 . 2 . 3 . 4]" 1
2149 1 93 GLU H 1 93 GLU HB3 3.880 . 3.880 3.412 2.515 3.883 0.003 15 0 "[ . 1 . 2 . 3 . 4]" 1
2150 1 93 GLU H 1 93 GLU QG 4.270 . 4.270 3.387 1.838 4.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2151 1 93 GLU H 1 94 GLY H 5.020 . 5.020 3.886 2.209 4.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2152 1 93 GLU HA 1 93 GLU QG 3.420 . 3.420 2.562 2.157 3.467 0.047 8 0 "[ . 1 . 2 . 3 . 4]" 1
2153 1 93 GLU QB 1 94 GLY H 4.050 . 4.050 3.003 1.852 3.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2154 1 93 GLU HB2 1 94 GLY H 4.610 . 4.610 3.787 2.368 4.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2155 1 93 GLU HB3 1 94 GLY H 4.610 . 4.610 3.373 1.860 4.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2156 1 93 GLU QG 1 94 GLY H 4.750 . 4.750 3.574 1.790 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2157 1 94 GLY H 1 95 ASP H 5.340 . 5.340 3.459 1.886 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2158 1 94 GLY QA 1 95 ASP H 3.100 . 3.100 2.544 2.063 2.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2159 1 95 ASP H 1 95 ASP QB 3.470 . 3.470 2.602 2.103 3.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2160 1 95 ASP HA 1 96 SER H 3.190 . 3.190 2.514 2.115 3.215 0.025 24 0 "[ . 1 . 2 . 3 . 4]" 1
2161 1 95 ASP QB 1 96 SER H 4.310 . 4.310 3.314 2.197 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2162 1 96 SER H 1 96 SER QB 3.630 . 3.630 2.814 2.264 3.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2163 1 96 SER H 1 97 VAL H 4.190 . 4.190 3.095 2.164 4.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2164 1 96 SER H 1 97 VAL QG 4.310 . 4.310 3.727 2.566 4.764 0.454 29 0 "[ . 1 . 2 . 3 . 4]" 1
2165 1 96 SER HA 1 97 VAL H 3.060 . 3.060 2.827 2.441 3.123 0.063 11 0 "[ . 1 . 2 . 3 . 4]" 1
2166 1 96 SER QB 1 97 VAL H 4.020 . 4.020 3.698 1.774 4.027 0.007 27 0 "[ . 1 . 2 . 3 . 4]" 1
2167 1 97 VAL H 1 97 VAL HB 3.240 . 3.240 2.612 2.450 3.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2168 1 97 VAL H 1 97 VAL QG 3.060 . 3.060 2.223 1.733 2.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2169 1 97 VAL HA 1 97 VAL QG 2.960 . 2.960 2.193 2.076 2.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2170 1 97 VAL HA 1 98 ILE H 2.970 . 2.970 2.158 2.094 2.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2171 1 97 VAL HB 1 98 ILE H 4.390 . 4.390 4.267 4.103 4.410 0.020 30 0 "[ . 1 . 2 . 3 . 4]" 1
2172 1 97 VAL QG 1 98 ILE H 3.990 . 3.990 2.812 2.295 3.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2173 1 97 VAL QG 1 99 THR H 4.100 . 4.100 3.482 1.968 4.211 0.111 12 0 "[ . 1 . 2 . 3 . 4]" 1
2174 1 98 ILE H 1 98 ILE HB 3.210 . 3.210 2.580 2.486 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2175 1 98 ILE H 1 98 ILE MD 4.320 . 4.320 2.862 1.878 4.112 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2176 1 98 ILE H 1 98 ILE QG 3.480 . 3.480 2.635 2.006 3.485 0.005 6 0 "[ . 1 . 2 . 3 . 4]" 1
2177 1 98 ILE H 1 98 ILE MG 4.130 . 4.130 3.847 3.783 3.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2178 1 98 ILE H 1 99 THR H 4.460 . 4.460 3.657 2.093 4.467 0.007 38 0 "[ . 1 . 2 . 3 . 4]" 1
2179 1 98 ILE H 1 99 THR MG 5.010 . 5.010 4.484 3.440 5.097 0.087 17 0 "[ . 1 . 2 . 3 . 4]" 1
2180 1 98 ILE HA 1 98 ILE MD 3.870 . 3.870 2.983 2.174 3.911 0.041 12 0 "[ . 1 . 2 . 3 . 4]" 1
2181 1 98 ILE HA 1 98 ILE HG12 4.020 . 4.020 3.274 2.580 3.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2182 1 98 ILE HA 1 98 ILE HG13 4.020 . 4.020 3.105 2.362 3.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2183 1 98 ILE HA 1 98 ILE MG 3.140 . 3.140 2.406 2.318 2.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2184 1 98 ILE HA 1 99 THR H 3.510 . 3.510 2.638 1.993 3.536 0.026 2 0 "[ . 1 . 2 . 3 . 4]" 1
2185 1 98 ILE HB 1 98 ILE MD 3.400 . 3.400 2.747 2.191 3.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2186 1 98 ILE HB 1 99 THR H 4.240 . 4.240 3.645 2.357 4.269 0.029 40 0 "[ . 1 . 2 . 3 . 4]" 1
2187 1 98 ILE MD 1 99 THR H 4.970 . 4.970 4.325 3.609 5.076 0.106 7 0 "[ . 1 . 2 . 3 . 4]" 1
2188 1 98 ILE QG 1 98 ILE MG 2.920 . 2.920 2.189 2.030 2.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2189 1 98 ILE HG12 1 98 ILE MG 3.390 . 3.390 2.653 2.086 3.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2190 1 98 ILE HG13 1 98 ILE MG 3.390 . 3.390 2.627 2.312 3.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2191 1 98 ILE MG 1 99 THR H 4.320 . 4.320 3.131 2.342 3.913 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2192 1 98 ILE MG 1 99 THR HA 4.700 . 4.700 3.859 3.325 4.515 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2193 1 98 ILE MG 1 100 GLN H 5.500 . 5.500 4.605 1.900 5.524 0.024 16 0 "[ . 1 . 2 . 3 . 4]" 1
2194 1 99 THR H 1 99 THR MG 3.860 . 3.860 2.605 2.105 3.693 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2195 1 99 THR HB 1 100 GLN H 4.170 . 4.170 3.277 1.872 4.209 0.039 13 0 "[ . 1 . 2 . 3 . 4]" 1
2196 1 99 THR MG 1 100 GLN H 4.600 . 4.600 3.756 2.824 4.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2197 1 100 GLN H 1 100 GLN HB2 4.080 . 4.080 3.090 2.410 4.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2198 1 100 GLN H 1 100 GLN QB 3.480 . 3.480 2.784 2.225 3.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2199 1 100 GLN H 1 100 GLN HB3 4.080 . 4.080 3.552 2.545 4.081 0.001 34 0 "[ . 1 . 2 . 3 . 4]" 1
2200 1 100 GLN H 1 100 GLN QG 4.160 . 4.160 2.855 1.942 4.175 0.015 7 0 "[ . 1 . 2 . 3 . 4]" 1
2201 1 100 GLN H 1 101 VAL QG 4.610 . 4.610 4.334 2.944 4.910 0.300 21 0 "[ . 1 . 2 . 3 . 4]" 1
2202 1 100 GLN HA 1 101 VAL H 3.030 . 3.030 2.432 2.116 3.068 0.038 18 0 "[ . 1 . 2 . 3 . 4]" 1
2203 1 100 GLN QB 1 101 VAL H 3.960 . 3.960 3.128 2.232 3.993 0.033 38 0 "[ . 1 . 2 . 3 . 4]" 1
2204 1 100 GLN QB 1 101 VAL QG 4.560 . 4.560 3.854 2.295 4.692 0.132 7 0 "[ . 1 . 2 . 3 . 4]" 1
2205 1 100 GLN HB2 1 101 VAL H 4.610 . 4.610 3.786 2.444 4.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2206 1 100 GLN HB3 1 101 VAL H 4.610 . 4.610 3.617 2.270 4.615 0.005 38 0 "[ . 1 . 2 . 3 . 4]" 1
2207 1 100 GLN QG 1 101 VAL H 4.810 . 4.810 3.980 2.098 4.776 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2208 1 101 VAL H 1 101 VAL HB 3.710 . 3.710 3.157 2.521 3.729 0.019 30 0 "[ . 1 . 2 . 3 . 4]" 1
2209 1 101 VAL H 1 101 VAL QG 3.100 . 3.100 2.453 1.798 2.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2210 1 101 VAL H 1 102 LEU H 4.330 . 4.330 3.834 2.215 4.346 0.016 22 0 "[ . 1 . 2 . 3 . 4]" 1
2211 1 101 VAL HA 1 101 VAL QG 2.960 . 2.960 2.179 2.079 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2212 1 101 VAL HA 1 102 LEU H 3.010 . 3.010 2.304 2.075 3.043 0.033 5 0 "[ . 1 . 2 . 3 . 4]" 1
2213 1 101 VAL HA 1 102 LEU QB 4.830 . 4.830 4.283 3.616 4.846 0.016 35 0 "[ . 1 . 2 . 3 . 4]" 1
2214 1 101 VAL HB 1 102 LEU H 4.490 . 4.490 4.255 2.921 4.498 0.008 15 0 "[ . 1 . 2 . 3 . 4]" 1
2215 1 101 VAL QG 1 102 LEU H 3.510 . 3.510 3.025 2.028 3.702 0.192 23 0 "[ . 1 . 2 . 3 . 4]" 1
2216 1 101 VAL QG 1 102 LEU HA 4.380 . 4.380 4.137 3.667 4.514 0.134 21 0 "[ . 1 . 2 . 3 . 4]" 1
2217 1 101 VAL QG 1 103 ASN H 5.170 . 5.170 3.861 1.991 5.176 0.006 26 0 "[ . 1 . 2 . 3 . 4]" 1
2218 1 102 LEU H 1 102 LEU HB2 3.700 . 3.700 2.410 2.028 3.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2219 1 102 LEU H 1 102 LEU QB 3.050 . 3.050 2.351 2.010 3.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2220 1 102 LEU H 1 102 LEU HB3 3.700 . 3.700 3.487 2.454 3.803 0.103 22 0 "[ . 1 . 2 . 3 . 4]" 1
2221 1 102 LEU H 1 102 LEU MD1 4.440 . 4.440 3.566 2.299 4.459 0.019 21 0 "[ . 1 . 2 . 3 . 4]" 1
2222 1 102 LEU H 1 102 LEU MD2 4.440 . 4.440 3.700 2.242 4.527 0.087 4 0 "[ . 1 . 2 . 3 . 4]" 1
2223 1 102 LEU H 1 102 LEU HG 4.480 . 4.480 3.388 2.124 4.508 0.028 4 0 "[ . 1 . 2 . 3 . 4]" 1
2224 1 102 LEU HA 1 102 LEU MD1 4.190 . 4.190 3.233 2.076 3.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2225 1 102 LEU HA 1 102 LEU QD 2.940 . 2.940 2.262 2.002 2.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2226 1 102 LEU HA 1 102 LEU MD2 4.190 . 4.190 2.761 2.171 3.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2227 1 102 LEU HA 1 102 LEU HG 3.880 . 3.880 2.972 2.402 3.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2228 1 102 LEU QB 1 102 LEU QD 2.710 . 2.710 1.958 1.889 2.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2229 1 102 LEU HB2 1 103 ASN H 4.370 . 4.370 3.694 2.453 4.381 0.011 38 0 "[ . 1 . 2 . 3 . 4]" 1
2230 1 102 LEU HB3 1 103 ASN H 4.370 . 4.370 3.212 1.685 4.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2231 1 102 LEU QD 1 103 ASN H 5.440 . 5.440 3.804 2.211 4.419 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2232 1 103 ASN H 1 103 ASN HB2 4.150 . 4.150 2.867 2.340 3.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2233 1 103 ASN H 1 103 ASN QB 3.550 . 3.550 2.589 2.239 3.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2234 1 103 ASN H 1 103 ASN HB3 4.150 . 4.150 3.300 2.454 4.066 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2235 1 103 ASN HB2 1 104 LYS H 4.850 . 4.850 3.916 2.619 4.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2236 1 103 ASN HB3 1 104 LYS H 4.850 . 4.850 3.570 2.104 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2237 1 104 LYS HA 1 104 LYS QG 3.540 . 3.540 2.627 2.310 3.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2238 1 104 LYS QE 1 104 LYS QG 3.420 . 3.420 2.263 2.044 2.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2239 1 118 LEU HA 1 119 ARG H 3.280 . 3.280 3.510 3.489 3.538 0.258 33 0 "[ . 1 . 2 . 3 . 4]" 1
2240 1 118 LEU QB 1 119 ARG H 4.460 . 4.460 2.751 2.624 2.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2241 1 118 LEU HG 1 119 ARG H 4.930 . 4.930 4.707 4.341 5.479 0.549 11 1 "[ . 1+ . 2 . 3 . 4]" 1
2242 1 119 ARG H 1 119 ARG HB2 3.940 . 3.940 2.465 2.350 2.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2243 1 119 ARG H 1 119 ARG QB 3.340 . 3.340 2.219 2.156 2.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2244 1 119 ARG H 1 119 ARG HB3 3.940 . 3.940 2.529 2.368 2.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2245 1 119 ARG H 1 120 ARG H 4.620 . 4.620 2.774 2.565 3.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2246 1 119 ARG H 1 120 ARG QG 4.300 . 4.300 4.656 4.332 5.358 1.058 12 8 "[ .* - + *. 2 .* 3 * **]" 1
2247 1 119 ARG HA 1 120 ARG H 2.940 . 2.940 3.607 3.576 3.650 0.710 40 40 [**********************-****************+] 1
2248 1 119 ARG HA 1 120 ARG QG 4.060 . 4.060 5.224 4.940 5.667 1.607 6 40 [*****+******************************-***] 1
2249 1 119 ARG QB 1 120 ARG H 4.020 . 4.020 2.379 2.281 2.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2250 1 119 ARG QB 1 120 ARG QG 4.850 . 4.850 3.268 2.937 4.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2251 1 119 ARG HB2 1 120 ARG H 4.570 . 4.570 3.771 3.702 3.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2252 1 119 ARG HB3 1 120 ARG H 4.570 . 4.570 2.405 2.301 2.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2253 1 120 ARG H 1 120 ARG QG . . 3.040 2.429 2.160 2.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2254 1 120 ARG H 1 121 ILE H 4.460 . 4.460 2.625 2.564 2.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2255 1 120 ARG HA 1 120 ARG QG 3.100 . 3.100 2.481 2.203 3.368 0.268 25 0 "[ . 1 . 2 . 3 . 4]" 1
2256 1 120 ARG HA 1 121 ILE H 3.150 . 3.150 3.522 3.474 3.561 0.411 29 0 "[ . 1 . 2 . 3 . 4]" 1
2257 1 120 ARG HA 1 121 ILE HB 4.620 . 4.620 5.828 5.729 5.904 1.284 31 40 [***************-**************+*********] 1
2258 1 120 ARG QB 1 121 ILE H 4.100 . 4.100 2.883 2.527 3.738 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2259 1 120 ARG QG 1 121 ILE H . . 3.440 4.200 2.505 4.637 1.197 12 38 "[***********+*** ****-***.***************]" 1
2260 1 120 ARG QG 1 121 ILE HA 3.760 . 3.760 5.669 3.460 5.903 2.143 12 38 "[***********+*** ********.************-**]" 1
2261 1 120 ARG QG 1 121 ILE HB 5.170 . 5.170 6.313 4.108 6.761 1.591 12 38 "[***********+*** ****-***.***************]" 1
2262 1 120 ARG QG 1 122 PHE H 4.590 . 4.590 5.841 4.793 6.353 1.763 35 38 "[*************** ********.********-+*****]" 1
2263 1 120 ARG QG 1 122 PHE QD 4.260 . 4.260 7.746 6.805 8.232 3.972 6 40 [*****+*********-************************] 1
2264 1 120 ARG QG 1 122 PHE QE . . 3.980 9.096 7.642 9.523 5.543 6 40 [*****+*********-************************] 1
2265 1 120 ARG QG 1 122 PHE HZ . . 4.360 11.040 9.027 11.671 7.311 40 40 [************************-**************+] 1
2266 1 121 ILE H 1 121 ILE HB 3.450 . 3.450 2.447 2.357 2.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2267 1 121 ILE H 1 121 ILE QG 3.740 . 3.740 2.301 2.150 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2268 1 121 ILE H 1 122 PHE H 3.850 . 3.850 2.599 2.432 2.804 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2269 1 121 ILE H 1 122 PHE HA 5.000 . 5.000 5.240 5.122 5.367 0.367 1 0 "[ . 1 . 2 . 3 . 4]" 1
2270 1 121 ILE HA 1 122 PHE H 3.340 . 3.340 3.594 3.552 3.635 0.295 5 0 "[ . 1 . 2 . 3 . 4]" 1
2271 1 121 ILE HA 1 122 PHE QD 4.710 . 4.710 5.126 4.375 5.625 0.915 24 26 "[* * ** *** * **** ** **+****** - . ** 4]" 1
2272 1 121 ILE HB 1 121 ILE MD 3.530 . 3.530 2.320 2.273 2.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2273 1 121 ILE HB 1 122 PHE H 4.030 . 4.030 2.802 2.701 2.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2274 1 121 ILE QG 1 122 PHE H 5.080 . 5.080 3.358 3.239 3.432 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2275 1 122 PHE H 1 122 PHE HB2 4.030 . 4.030 2.368 2.208 2.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2276 1 122 PHE H 1 122 PHE QB 3.390 . 3.390 2.338 2.186 2.472 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2277 1 122 PHE H 1 122 PHE HB3 4.030 . 4.030 3.623 3.514 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2278 1 122 PHE H 1 122 PHE QD 4.040 . 4.040 3.216 2.482 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2279 1 122 PHE HA 1 122 PHE QD 3.880 . 3.880 2.255 1.938 2.911 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2280 1 124 GLU QB 1 126 THR H 4.920 . 4.920 4.698 2.587 6.459 1.539 30 9 "[ **. *1 . 2 * . + - . ** *]" 1
2281 1 125 ASP HB2 1 126 THR H 4.490 . 4.490 3.743 1.901 4.563 0.073 14 0 "[ . 1 . 2 . 3 . 4]" 1
2282 1 125 ASP HB3 1 126 THR H 4.490 . 4.490 2.786 1.765 4.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2283 1 126 THR H 1 126 THR HB 3.470 . 3.470 3.487 2.608 3.934 0.464 30 0 "[ . 1 . 2 . 3 . 4]" 1
2284 1 126 THR H 1 127 ASP H 3.560 . 3.560 4.072 2.107 4.655 1.095 7 30 "[** .*+* ************ *******3-* *** *4]" 1
2285 1 126 THR HB 1 127 ASP H 4.270 . 4.270 3.412 2.453 4.687 0.417 5 0 "[ . 1 . 2 . 3 . 4]" 1
2286 1 127 ASP H 1 127 ASP HB2 3.620 . 3.620 2.473 2.051 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2287 1 127 ASP H 1 127 ASP HB3 3.620 . 3.620 2.886 2.054 3.633 0.013 4 0 "[ . 1 . 2 . 3 . 4]" 1
2288 1 127 ASP H 1 128 SER H 4.680 . 4.680 2.624 2.316 2.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2289 1 128 SER H 1 131 GLU QB . . 3.980 5.777 3.901 7.852 3.872 22 39 "[*********************+****** *****-*****]" 1
2290 1 128 SER H 1 132 ASP HA 5.500 . 5.500 10.068 7.973 11.647 6.147 33 40 [**-*****************************+*******] 1
2291 1 128 SER QB 1 129 GLU H 4.190 . 4.190 3.279 2.699 3.877 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2292 1 129 GLU H 1 129 GLU HB2 4.120 . 4.120 2.563 2.316 3.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2293 1 129 GLU H 1 129 GLU QB 3.590 . 3.590 2.236 2.128 2.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2294 1 129 GLU H 1 129 GLU HB3 4.120 . 4.120 2.487 2.225 2.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2295 1 129 GLU H 1 129 GLU QG 4.150 . 4.150 3.958 2.383 4.054 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2296 1 129 GLU H 1 130 THR H 4.060 . 4.060 2.440 2.010 2.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2297 1 129 GLU HA 1 129 GLU QG 3.500 . 3.500 2.649 2.330 3.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2298 1 129 GLU QB 1 130 THR H 3.820 . 3.820 2.879 2.637 3.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2299 1 129 GLU QG 1 130 THR H 4.420 . 4.420 3.957 2.708 4.179 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2300 1 130 THR H 1 130 THR HB 3.070 . 3.070 3.680 3.240 3.813 0.743 6 38 "[*****+********************** **** **-***]" 1
2301 1 130 THR H 1 130 THR HG1 4.020 . 4.020 2.073 1.833 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2302 1 130 THR H 1 131 GLU H 3.830 . 3.830 2.519 2.130 3.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2303 1 130 THR HA 1 132 ASP H 4.040 . 4.040 6.372 3.412 6.921 2.881 30 39 [****.****************-*******+**********] 1
2304 1 130 THR HB 1 131 GLU H 3.730 . 3.730 4.304 3.359 4.697 0.967 34 25 "[** ** 1* * * * ** ***.*** 3*-*+** ***]" 1
2305 1 131 GLU H 1 131 GLU QB . . 3.580 2.355 1.992 2.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2306 1 131 GLU H 1 131 GLU QG 4.670 . 4.670 3.009 2.072 4.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2307 1 131 GLU H 1 132 ASP H 3.710 . 3.710 4.561 2.515 4.694 0.984 20 39 [****.**************+*********-**********] 1
2308 1 131 GLU HA 1 134 ALA H 4.160 . 4.160 8.901 7.754 9.647 5.487 25 40 [************************+**-************] 1
2309 1 131 GLU HA 1 135 GLY H 4.860 . 4.860 12.038 10.481 12.719 7.859 10 40 [*********+*****************-************] 1
2310 1 131 GLU QB 1 132 ASP H 4.530 . 4.530 2.445 1.722 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2311 1 132 ASP H 1 132 ASP HB2 3.650 . 3.650 3.411 2.263 3.877 0.227 5 0 "[ . 1 . 2 . 3 . 4]" 1
2312 1 132 ASP H 1 132 ASP QB 3.170 . 3.170 2.658 2.063 3.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2313 1 132 ASP H 1 132 ASP HB3 3.650 . 3.650 2.990 2.081 3.860 0.210 38 0 "[ . 1 . 2 . 3 . 4]" 1
2314 1 132 ASP H 1 133 PHE H 3.790 . 3.790 4.417 2.753 4.630 0.840 30 33 "[****.***-* **************** *+ * *** **]" 1
2315 1 132 ASP HA 1 133 PHE HA 4.880 . 4.880 4.382 4.196 4.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2316 1 132 ASP HA 1 135 GLY H 5.240 . 5.240 8.521 7.628 8.861 3.621 40 40 [***************************-***********+] 1
2317 1 132 ASP HA 1 136 PHE H 5.160 . 5.160 12.182 11.625 12.555 7.395 26 40 [*************************+*-************] 1
2318 1 132 ASP HA 1 136 PHE QD 4.360 . 4.360 11.210 10.865 11.465 7.105 32 40 [******************-************+********] 1
2319 1 132 ASP QB 1 133 PHE H 3.960 . 3.960 2.818 2.138 3.757 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2320 1 133 PHE H 1 133 PHE QB 3.180 . 3.180 2.422 2.204 2.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2321 1 133 PHE H 1 133 PHE QD 4.470 . 4.470 4.245 4.083 4.308 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2322 1 133 PHE H 1 134 ALA H 3.700 . 3.700 4.332 3.821 4.588 0.888 2 33 "[*+ ***** ******************* * *- * * **]" 1
2323 1 133 PHE H 1 136 PHE QD 4.850 . 4.850 9.545 9.389 9.734 4.884 8 40 [*******+**********************-*********] 1
2324 1 133 PHE HA 1 136 PHE H 4.720 . 4.720 8.183 7.924 8.575 3.855 26 40 [**-**********************+**************] 1
2325 1 133 PHE HA 1 136 PHE QB 4.560 . 4.560 8.645 8.451 8.974 4.414 26 40 [**********************-**+**************] 1
2326 1 133 PHE HA 1 136 PHE QD 4.210 . 4.210 7.927 7.749 8.122 3.912 26 40 [*************************+*************-] 1
2327 1 133 PHE QB 1 134 ALA H 3.810 . 3.810 3.802 3.619 4.006 0.196 3 0 "[ . 1 . 2 . 3 . 4]" 1
2328 1 134 ALA H 1 135 GLY H 3.650 . 3.650 3.721 3.566 3.966 0.316 3 0 "[ . 1 . 2 . 3 . 4]" 1
2329 1 134 ALA H 1 136 PHE H 4.860 . 4.860 6.710 6.476 7.111 2.251 3 40 [**+***************-*********************] 1
2330 1 135 GLY H 1 136 PHE H 3.690 . 3.690 4.283 4.202 4.396 0.706 29 40 [***********************-****+***********] 1
2331 1 136 PHE H 1 136 PHE QB 3.350 . 3.350 2.359 2.286 2.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2332 1 136 PHE H 1 136 PHE QD 4.540 . 4.540 2.869 2.616 3.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2333 1 136 PHE H 1 137 THR H 4.550 . 4.550 4.406 4.329 4.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2334 1 136 PHE HA 1 136 PHE QD 3.880 . 3.880 2.884 2.351 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2335 1 136 PHE HA 1 137 THR H 3.340 . 3.340 2.154 2.096 2.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2336 1 136 PHE QB 1 137 THR H 4.450 . 4.450 3.339 3.182 3.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2337 1 136 PHE QD 1 137 THR H 5.430 . 5.430 4.098 3.770 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2338 1 137 THR H 1 137 THR HB 3.300 . 3.300 3.634 3.587 3.683 0.383 22 0 "[ . 1 . 2 . 3 . 4]" 1
2339 1 137 THR H 1 137 THR HG1 4.020 . 4.020 2.257 1.865 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2340 1 137 THR H 1 138 GLN H 4.680 . 4.680 4.538 4.375 4.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2341 1 137 THR HA 1 138 GLN H 3.170 . 3.170 2.512 2.108 2.742 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2342 1 137 THR HB 1 138 GLN H 3.770 . 3.770 2.306 1.936 3.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2343 1 137 THR HG1 1 138 GLN H 4.830 . 4.830 3.443 3.151 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2344 1 138 GLN H 1 138 GLN HB2 3.790 . 3.790 2.595 2.226 3.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2345 1 138 GLN H 1 138 GLN HB3 3.790 . 3.790 2.942 2.530 4.063 0.273 25 0 "[ . 1 . 2 . 3 . 4]" 1
2346 1 138 GLN H 1 139 SER H 4.610 . 4.610 2.978 2.416 4.647 0.037 37 0 "[ . 1 . 2 . 3 . 4]" 1
2347 1 138 GLN QB 1 139 SER H 3.870 . 3.870 3.415 1.809 4.004 0.134 13 0 "[ . 1 . 2 . 3 . 4]" 1
2348 1 138 GLN HB2 1 139 SER H 4.560 . 4.560 4.107 1.882 4.580 0.020 39 0 "[ . 1 . 2 . 3 . 4]" 1
2349 1 138 GLN HB3 1 139 SER H 4.560 . 4.560 3.744 1.868 4.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2350 1 139 SER H 1 140 ASP H 5.080 . 5.080 2.520 2.148 3.018 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2351 1 139 SER HA 1 140 ASP H 2.880 . 2.880 3.051 2.796 3.409 0.529 9 1 "[ . +1 . 2 . 3 . 4]" 1
2352 1 140 ASP H 1 140 ASP QB 3.190 . 3.190 2.438 2.096 2.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
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