NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
439658 |
2k6z   |
15896 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k6z
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 1641
_Distance_constraint_stats_list.Viol_count 4525
_Distance_constraint_stats_list.Viol_total 10274.904
_Distance_constraint_stats_list.Viol_max 1.638
_Distance_constraint_stats_list.Viol_rms 0.0443
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0065
_Distance_constraint_stats_list.Viol_average_violations_only 0.0732
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.174 0.047 7 0 "[ . 1 . 2 . 3 ]"
1 3 PHE 0.288 0.047 7 0 "[ . 1 . 2 . 3 ]"
1 4 THR 0.182 0.047 28 0 "[ . 1 . 2 . 3 ]"
1 5 GLU 1.310 0.277 22 0 "[ . 1 . 2 . 3 ]"
1 6 GLY 0.841 0.089 7 0 "[ . 1 . 2 . 3 ]"
1 7 TRP 6.097 0.531 16 4 "[ . - 1* .+ 2 * . 3 ]"
1 8 VAL 0.133 0.072 6 0 "[ . 1 . 2 . 3 ]"
1 9 ARG 5.318 0.531 16 4 "[ . - 1* .+ 2 * . 3 ]"
1 10 PHE 77.114 1.638 28 28 "[************ *** ****** *-*+***]"
1 11 SER 47.790 1.638 28 25 "[****.** *-** *** ****** * *+***]"
1 12 PRO 11.114 0.705 3 6 "[ + .* 1* * -2 * . 3 ]"
1 13 GLY 27.583 0.677 31 31 [*********************-********+]
1 14 PRO 36.215 0.677 31 31 [******************************+]
1 15 ASN 22.376 0.542 31 3 "[ * . 1 . 2 . - 3+]"
1 16 ALA 0.329 0.036 9 0 "[ . 1 . 2 . 3 ]"
1 17 ALA 2.829 0.112 10 0 "[ . 1 . 2 . 3 ]"
1 18 ALA 0.025 0.010 21 0 "[ . 1 . 2 . 3 ]"
1 19 TYR 0.615 0.106 4 0 "[ . 1 . 2 . 3 ]"
1 20 LEU 0.479 0.059 5 0 "[ . 1 . 2 . 3 ]"
1 21 THR 1.691 0.277 22 0 "[ . 1 . 2 . 3 ]"
1 22 LEU 2.415 0.106 10 0 "[ . 1 . 2 . 3 ]"
1 23 GLU 0.346 0.056 1 0 "[ . 1 . 2 . 3 ]"
1 24 ASN 4.399 0.104 3 0 "[ . 1 . 2 . 3 ]"
1 25 PRO 2.852 0.104 3 0 "[ . 1 . 2 . 3 ]"
1 26 GLY 1.929 0.134 27 0 "[ . 1 . 2 . 3 ]"
1 27 ASP 5.735 0.105 28 0 "[ . 1 . 2 . 3 ]"
1 28 LEU 4.586 0.149 27 0 "[ . 1 . 2 . 3 ]"
1 29 PRO 2.599 0.094 7 0 "[ . 1 . 2 . 3 ]"
1 30 LEU 7.751 0.191 31 0 "[ . 1 . 2 . 3 ]"
1 31 ARG 6.877 0.191 31 0 "[ . 1 . 2 . 3 ]"
1 32 LEU 4.790 0.164 11 0 "[ . 1 . 2 . 3 ]"
1 33 VAL 2.142 0.090 14 0 "[ . 1 . 2 . 3 ]"
1 34 GLY 1.009 0.061 30 0 "[ . 1 . 2 . 3 ]"
1 35 ALA 0.071 0.027 18 0 "[ . 1 . 2 . 3 ]"
1 36 ARG 1.822 0.097 9 0 "[ . 1 . 2 . 3 ]"
1 37 THR 2.552 0.342 29 0 "[ . 1 . 2 . 3 ]"
1 38 PRO 3.855 0.106 27 0 "[ . 1 . 2 . 3 ]"
1 39 VAL 3.747 0.264 22 0 "[ . 1 . 2 . 3 ]"
1 40 ALA 3.499 0.342 29 0 "[ . 1 . 2 . 3 ]"
1 41 GLU 1.143 0.297 6 0 "[ . 1 . 2 . 3 ]"
1 42 ARG 2.233 0.102 27 0 "[ . 1 . 2 . 3 ]"
1 43 VAL 3.258 0.170 12 0 "[ . 1 . 2 . 3 ]"
1 44 GLU 1.158 0.170 12 0 "[ . 1 . 2 . 3 ]"
1 45 LEU 3.527 0.118 28 0 "[ . 1 . 2 . 3 ]"
1 46 HIS 9.611 0.118 20 0 "[ . 1 . 2 . 3 ]"
1 47 GLU 3.218 0.079 30 0 "[ . 1 . 2 . 3 ]"
1 48 THR 2.315 0.083 19 0 "[ . 1 . 2 . 3 ]"
1 49 PHE 4.821 0.136 3 0 "[ . 1 . 2 . 3 ]"
1 50 MET 2.975 0.084 12 0 "[ . 1 . 2 . 3 ]"
1 51 ARG 2.729 0.111 22 0 "[ . 1 . 2 . 3 ]"
1 52 GLU 6.975 0.220 15 0 "[ . 1 . 2 . 3 ]"
1 53 VAL 1.133 0.185 8 0 "[ . 1 . 2 . 3 ]"
1 54 GLU 1.812 0.185 8 0 "[ . 1 . 2 . 3 ]"
1 55 GLY 0.616 0.063 12 0 "[ . 1 . 2 . 3 ]"
1 56 LYS 4.344 0.141 15 0 "[ . 1 . 2 . 3 ]"
1 57 LYS 4.613 0.140 3 0 "[ . 1 . 2 . 3 ]"
1 58 VAL 3.253 0.123 21 0 "[ . 1 . 2 . 3 ]"
1 59 MET 2.320 0.084 20 0 "[ . 1 . 2 . 3 ]"
1 60 GLY 1.508 0.084 20 0 "[ . 1 . 2 . 3 ]"
1 61 MET 5.893 0.110 20 0 "[ . 1 . 2 . 3 ]"
1 62 ARG 2.618 0.136 3 0 "[ . 1 . 2 . 3 ]"
1 63 PRO 1.688 0.088 26 0 "[ . 1 . 2 . 3 ]"
1 64 VAL 0.394 0.118 28 0 "[ . 1 . 2 . 3 ]"
1 65 PRO 2.330 0.054 20 0 "[ . 1 . 2 . 3 ]"
1 66 PHE 6.296 0.090 14 0 "[ . 1 . 2 . 3 ]"
1 67 LEU 5.082 0.073 7 0 "[ . 1 . 2 . 3 ]"
1 68 GLU 4.570 0.219 20 0 "[ . 1 . 2 . 3 ]"
1 69 VAL 3.297 0.219 20 0 "[ . 1 . 2 . 3 ]"
1 70 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 71 PRO 0.605 0.030 12 0 "[ . 1 . 2 . 3 ]"
1 72 LYS 3.386 0.175 17 0 "[ . 1 . 2 . 3 ]"
1 73 GLY 3.250 0.175 17 0 "[ . 1 . 2 . 3 ]"
1 74 ARG 5.887 0.169 27 0 "[ . 1 . 2 . 3 ]"
1 75 VAL 1.111 0.106 10 0 "[ . 1 . 2 . 3 ]"
1 76 GLU 3.067 0.134 31 0 "[ . 1 . 2 . 3 ]"
1 77 LEU 2.150 0.106 4 0 "[ . 1 . 2 . 3 ]"
1 78 LYS 0.885 0.078 29 0 "[ . 1 . 2 . 3 ]"
1 79 PRO 0.040 0.040 4 0 "[ . 1 . 2 . 3 ]"
1 80 GLY 0.024 0.024 10 0 "[ . 1 . 2 . 3 ]"
1 81 GLY 0.625 0.078 29 0 "[ . 1 . 2 . 3 ]"
1 82 TYR 4.417 0.100 31 0 "[ . 1 . 2 . 3 ]"
1 83 HIS 5.130 0.100 31 0 "[ . 1 . 2 . 3 ]"
1 84 PHE 3.625 0.086 17 0 "[ . 1 . 2 . 3 ]"
1 85 MET 12.488 0.425 12 0 "[ . 1 . 2 . 3 ]"
1 86 LEU 7.609 0.425 12 0 "[ . 1 . 2 . 3 ]"
1 87 LEU 0.626 0.058 21 0 "[ . 1 . 2 . 3 ]"
1 88 GLY 0.168 0.058 21 0 "[ . 1 . 2 . 3 ]"
1 89 LEU 12.236 0.341 16 0 "[ . 1 . 2 . 3 ]"
1 90 LYS 12.110 0.297 6 0 "[ . 1 . 2 . 3 ]"
1 91 ARG 6.192 0.340 14 0 "[ . 1 . 2 . 3 ]"
1 92 PRO 0.031 0.031 15 0 "[ . 1 . 2 . 3 ]"
1 93 LEU 12.779 1.066 31 10 "[ * . 1 *** *2-***. 3+]"
1 94 LYS 14.420 0.614 14 9 "[ * . 1 +** *2-***. 3 ]"
1 95 ALA 9.137 0.479 29 0 "[ . 1 . 2 . 3 ]"
1 96 GLY 3.925 0.170 29 0 "[ . 1 . 2 . 3 ]"
1 97 GLU 4.746 0.133 31 0 "[ . 1 . 2 . 3 ]"
1 98 GLU 6.157 0.193 6 0 "[ . 1 . 2 . 3 ]"
1 99 VAL 4.666 0.193 6 0 "[ . 1 . 2 . 3 ]"
1 100 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 ]"
1 101 LEU 2.032 0.084 17 0 "[ . 1 . 2 . 3 ]"
1 102 ASP 1.844 0.097 9 0 "[ . 1 . 2 . 3 ]"
1 103 LEU 1.647 0.096 1 0 "[ . 1 . 2 . 3 ]"
1 104 LEU 0.900 0.048 16 0 "[ . 1 . 2 . 3 ]"
1 105 PHE 5.520 0.164 11 0 "[ . 1 . 2 . 3 ]"
1 106 ALA 0.159 0.017 5 0 "[ . 1 . 2 . 3 ]"
1 108 GLY 0.007 0.007 1 0 "[ . 1 . 2 . 3 ]"
1 109 LYS 3.118 0.084 2 0 "[ . 1 . 2 . 3 ]"
1 110 VAL 3.096 0.084 2 0 "[ . 1 . 2 . 3 ]"
1 111 LEU 0.500 0.064 24 0 "[ . 1 . 2 . 3 ]"
1 112 LYS 0.615 0.093 29 0 "[ . 1 . 2 . 3 ]"
1 113 VAL 1.879 0.134 28 0 "[ . 1 . 2 . 3 ]"
1 114 VAL 1.247 0.134 28 0 "[ . 1 . 2 . 3 ]"
1 115 LEU 1.778 0.089 7 0 "[ . 1 . 2 . 3 ]"
1 116 PRO 0.425 0.052 25 0 "[ . 1 . 2 . 3 ]"
1 117 VAL 8.103 0.582 10 5 "[ * * + . 2 *- 3 ]"
1 118 GLU 1.256 0.483 30 0 "[ . 1 . 2 . 3 ]"
1 119 ALA 10.815 0.879 12 7 "[ * . * + . -* * * ]"
1 120 ARG 9.819 0.757 20 3 "[ - 1 . *+ . 3 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER HA 1 3 PHE QD . . 4.450 4.025 2.845 4.497 0.047 7 0 "[ . 1 . 2 . 3 ]" 1
2 1 2 SER QB 1 3 PHE QD . . 5.120 4.132 2.278 5.133 0.013 1 0 "[ . 1 . 2 . 3 ]" 1
3 1 3 PHE HA 1 3 PHE QD . . 4.130 3.179 2.292 3.803 . 0 0 "[ . 1 . 2 . 3 ]" 1
4 1 3 PHE HA 1 4 THR H . . 3.460 2.605 2.044 3.507 0.047 28 0 "[ . 1 . 2 . 3 ]" 1
5 1 3 PHE QB 1 4 THR H . . 4.290 3.060 1.952 4.073 . 0 0 "[ . 1 . 2 . 3 ]" 1
6 1 3 PHE QB 1 4 THR MG . . 5.550 4.467 2.642 5.596 0.046 22 0 "[ . 1 . 2 . 3 ]" 1
7 1 3 PHE QD 1 5 GLU H . . 6.210 4.787 2.100 6.220 0.010 4 0 "[ . 1 . 2 . 3 ]" 1
8 1 4 THR HA 1 5 GLU H . . 3.520 2.690 2.050 3.535 0.015 6 0 "[ . 1 . 2 . 3 ]" 1
9 1 4 THR HB 1 5 GLU H . . 4.490 4.203 2.979 4.516 0.026 23 0 "[ . 1 . 2 . 3 ]" 1
10 1 4 THR MG 1 5 GLU H . . 5.500 4.005 2.697 4.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
11 1 5 GLU HB2 1 21 THR HB . . 5.500 4.350 2.303 5.599 0.099 8 0 "[ . 1 . 2 . 3 ]" 1
12 1 5 GLU HB3 1 21 THR HB . . 5.500 4.607 2.422 5.556 0.056 18 0 "[ . 1 . 2 . 3 ]" 1
13 1 5 GLU HG2 1 21 THR HB . . 5.500 4.273 2.252 5.637 0.137 6 0 "[ . 1 . 2 . 3 ]" 1
14 1 5 GLU HG3 1 21 THR HB . . 5.500 4.571 2.291 5.777 0.277 22 0 "[ . 1 . 2 . 3 ]" 1
15 1 6 GLY H 1 7 TRP H . . 4.600 4.458 4.334 4.616 0.016 22 0 "[ . 1 . 2 . 3 ]" 1
16 1 6 GLY H 1 115 LEU HA . . 4.500 4.424 3.293 4.589 0.089 7 0 "[ . 1 . 2 . 3 ]" 1
17 1 6 GLY QA 1 20 LEU HA . . 4.100 2.163 1.914 3.798 . 0 0 "[ . 1 . 2 . 3 ]" 1
18 1 7 TRP H 1 7 TRP HE3 . . 5.110 3.034 2.159 5.507 0.397 30 0 "[ . 1 . 2 . 3 ]" 1
19 1 7 TRP H 1 8 VAL MG2 . . 5.500 4.915 4.187 5.572 0.072 6 0 "[ . 1 . 2 . 3 ]" 1
20 1 7 TRP H 1 19 TYR H . . 4.730 3.653 3.071 4.760 0.030 30 0 "[ . 1 . 2 . 3 ]" 1
21 1 7 TRP HA 1 8 VAL H . . 2.990 2.358 2.120 2.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
22 1 7 TRP HA 1 8 VAL MG2 . . 5.460 3.583 3.092 3.948 . 0 0 "[ . 1 . 2 . 3 ]" 1
23 1 7 TRP HA 1 115 LEU HB2 . . 5.480 3.393 2.090 4.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
24 1 7 TRP HA 1 115 LEU HB3 . . 4.480 3.174 2.099 4.487 0.007 3 0 "[ . 1 . 2 . 3 ]" 1
25 1 7 TRP HA 1 116 PRO HG2 . . 5.140 3.129 2.456 4.106 . 0 0 "[ . 1 . 2 . 3 ]" 1
26 1 7 TRP HA 1 116 PRO HG3 . . 5.140 4.682 4.109 5.171 0.031 25 0 "[ . 1 . 2 . 3 ]" 1
27 1 7 TRP HB2 1 8 VAL H . . 4.520 2.545 2.014 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
28 1 7 TRP HB2 1 116 PRO QB . . 5.070 4.290 3.726 4.864 . 0 0 "[ . 1 . 2 . 3 ]" 1
29 1 7 TRP HB2 1 116 PRO QG . . 5.150 3.184 2.430 4.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
30 1 7 TRP HB3 1 8 VAL H . . 5.150 3.808 3.581 4.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
31 1 7 TRP HB3 1 116 PRO QB . . 4.880 4.529 3.968 4.932 0.052 25 0 "[ . 1 . 2 . 3 ]" 1
32 1 7 TRP HD1 1 8 VAL H . . 5.500 3.678 2.521 5.053 . 0 0 "[ . 1 . 2 . 3 ]" 1
33 1 7 TRP HD1 1 9 ARG HA . . 3.940 3.256 2.124 4.020 0.080 23 0 "[ . 1 . 2 . 3 ]" 1
34 1 7 TRP HD1 1 118 GLU H . . 4.440 3.539 2.593 4.923 0.483 30 0 "[ . 1 . 2 . 3 ]" 1
35 1 7 TRP HE1 1 9 ARG HA . . 4.240 4.045 2.625 4.771 0.531 16 4 "[ . - 1* .+ 2 * . 3 ]" 1
36 1 8 VAL H 1 8 VAL MG2 . . 4.270 2.586 2.148 3.029 . 0 0 "[ . 1 . 2 . 3 ]" 1
37 1 8 VAL H 1 115 LEU HB2 . . 5.500 4.298 3.775 5.368 . 0 0 "[ . 1 . 2 . 3 ]" 1
38 1 8 VAL H 1 117 VAL HA . . 4.740 2.655 2.106 3.316 . 0 0 "[ . 1 . 2 . 3 ]" 1
39 1 8 VAL H 1 117 VAL MG2 . . 5.350 3.811 3.023 5.004 . 0 0 "[ . 1 . 2 . 3 ]" 1
40 1 8 VAL H 1 118 GLU H . . 5.340 3.635 2.695 4.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
41 1 8 VAL HA 1 9 ARG H . . 3.020 2.278 2.076 2.475 . 0 0 "[ . 1 . 2 . 3 ]" 1
42 1 8 VAL HA 1 18 ALA HA . . 3.030 2.289 2.061 2.866 . 0 0 "[ . 1 . 2 . 3 ]" 1
43 1 8 VAL HA 1 19 TYR H . . 4.280 3.073 2.520 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
44 1 8 VAL HB 1 117 VAL HA . . 4.240 2.634 2.071 4.014 . 0 0 "[ . 1 . 2 . 3 ]" 1
45 1 8 VAL MG1 1 9 ARG H . . 4.180 2.499 2.104 4.079 . 0 0 "[ . 1 . 2 . 3 ]" 1
46 1 8 VAL MG2 1 18 ALA HA . . 4.030 3.408 2.239 4.040 0.010 21 0 "[ . 1 . 2 . 3 ]" 1
47 1 8 VAL MG2 1 19 TYR H . . 5.500 4.015 3.053 4.706 . 0 0 "[ . 1 . 2 . 3 ]" 1
48 1 9 ARG H 1 9 ARG QD . . 4.920 4.335 3.521 4.882 . 0 0 "[ . 1 . 2 . 3 ]" 1
49 1 9 ARG H 1 9 ARG QG . . 4.150 3.449 2.118 4.122 . 0 0 "[ . 1 . 2 . 3 ]" 1
50 1 9 ARG H 1 18 ALA HA . . 5.030 3.069 2.308 4.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
51 1 9 ARG HA 1 10 PHE H . . 3.460 3.267 2.107 3.646 0.186 25 0 "[ . 1 . 2 . 3 ]" 1
52 1 10 PHE H 1 10 PHE HB2 . . 3.540 3.386 2.607 3.813 0.273 2 0 "[ . 1 . 2 . 3 ]" 1
53 1 10 PHE H 1 10 PHE QB . . 3.020 2.836 2.074 3.285 0.265 4 0 "[ . 1 . 2 . 3 ]" 1
54 1 10 PHE H 1 10 PHE HB3 . . 3.540 3.111 2.126 3.812 0.272 24 0 "[ . 1 . 2 . 3 ]" 1
55 1 10 PHE H 1 10 PHE QD . . 5.210 4.373 3.970 4.548 . 0 0 "[ . 1 . 2 . 3 ]" 1
56 1 10 PHE H 1 11 SER H . . 4.790 4.113 3.474 4.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
57 1 10 PHE HA 1 11 SER H . . 2.640 2.184 2.059 2.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
58 1 10 PHE QB 1 11 SER H . . 4.000 3.673 3.391 3.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
59 1 10 PHE QB 1 117 VAL MG1 . . 3.910 3.211 2.119 3.951 0.041 25 0 "[ . 1 . 2 . 3 ]" 1
60 1 10 PHE QB 1 119 ALA HA . . 3.130 2.498 1.978 3.506 0.376 30 0 "[ . 1 . 2 . 3 ]" 1
61 1 10 PHE QB 1 119 ALA MB . . 3.990 2.785 1.997 4.207 0.217 23 0 "[ . 1 . 2 . 3 ]" 1
62 1 10 PHE HB2 1 117 VAL MG1 . . 4.590 3.287 2.138 4.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
63 1 10 PHE HB2 1 119 ALA HA . . 3.990 2.894 2.073 4.259 0.269 29 0 "[ . 1 . 2 . 3 ]" 1
64 1 10 PHE HB2 1 119 ALA MB . . 4.820 3.092 2.130 4.917 0.097 23 0 "[ . 1 . 2 . 3 ]" 1
65 1 10 PHE HB3 1 117 VAL MG1 . . 4.590 4.584 3.471 5.172 0.582 10 5 "[ * * + . 2 *- 3 ]" 1
66 1 10 PHE HB3 1 119 ALA HA . . 3.990 3.011 2.134 4.640 0.650 30 1 "[ . 1 . 2 . + ]" 1
67 1 10 PHE HB3 1 119 ALA MB . . 4.820 3.369 2.252 5.141 0.321 13 0 "[ . 1 . 2 . 3 ]" 1
68 1 10 PHE QD 1 11 SER H . . 4.130 3.046 2.018 3.825 . 0 0 "[ . 1 . 2 . 3 ]" 1
69 1 10 PHE QD 1 11 SER HA . . 3.780 3.701 2.842 4.276 0.496 15 0 "[ . 1 . 2 . 3 ]" 1
70 1 10 PHE QD 1 95 ALA H . . 5.300 3.562 2.451 4.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
71 1 10 PHE QD 1 95 ALA HA . . 4.620 4.390 3.396 5.099 0.479 29 0 "[ . 1 . 2 . 3 ]" 1
72 1 10 PHE QD 1 119 ALA HA . . 3.930 3.889 2.384 4.751 0.821 3 6 "[ + . * . -* * * ]" 1
73 1 10 PHE QD 1 119 ALA MB . . 3.800 3.023 2.154 4.679 0.879 12 1 "[ . 1 + . 2 . 3 ]" 1
74 1 10 PHE QE 1 11 SER HA . . 3.280 4.130 3.314 4.502 1.222 31 25 "[****.** **** **- ****** * ****+]" 1
75 1 10 PHE QE 1 12 PRO HD2 . . 4.920 4.842 3.674 5.625 0.705 3 6 "[ + .* 1* * -2 * . 3 ]" 1
76 1 10 PHE QE 1 12 PRO QD . . 4.330 3.445 2.485 4.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
77 1 10 PHE QE 1 12 PRO HD3 . . 4.920 3.534 2.527 4.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
78 1 10 PHE QE 1 12 PRO QG . . 5.170 4.831 3.476 5.762 0.592 15 2 "[ - . 1 + 2 . 3 ]" 1
79 1 10 PHE QE 1 95 ALA H . . 3.930 3.757 2.133 4.093 0.163 14 0 "[ . 1 . 2 . 3 ]" 1
80 1 10 PHE QE 1 95 ALA MB . . 6.600 4.288 2.988 4.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
81 1 10 PHE HZ 1 11 SER HA . . 4.990 5.284 4.398 6.628 1.638 28 11 "[* *. *-* *. * 2 * +*3*]" 1
82 1 10 PHE HZ 1 12 PRO QG . . 6.140 5.316 3.965 6.200 0.060 1 0 "[ . 1 . 2 . 3 ]" 1
83 1 10 PHE HZ 1 95 ALA MB . . 6.600 5.774 4.280 6.810 0.210 25 0 "[ . 1 . 2 . 3 ]" 1
84 1 11 SER H 1 11 SER HB2 . . 3.710 3.380 2.800 3.971 0.261 10 0 "[ . 1 . 2 . 3 ]" 1
85 1 11 SER H 1 11 SER QB . . 3.200 3.021 2.737 3.425 0.225 28 0 "[ . 1 . 2 . 3 ]" 1
86 1 11 SER H 1 11 SER HB3 . . 3.710 3.591 3.115 4.053 0.343 24 0 "[ . 1 . 2 . 3 ]" 1
87 1 11 SER H 1 16 ALA MB . . 4.980 4.193 3.446 4.875 . 0 0 "[ . 1 . 2 . 3 ]" 1
88 1 11 SER H 1 93 LEU QD . . 4.290 3.190 1.811 5.356 1.066 31 1 "[ . 1 . 2 . 3+]" 1
89 1 11 SER HA 1 12 PRO HD2 . . 3.490 2.289 2.081 2.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
90 1 11 SER HA 1 12 PRO QD . . 2.940 2.112 2.020 2.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
91 1 11 SER HA 1 12 PRO HD3 . . 3.490 2.513 2.303 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
92 1 11 SER HB2 1 16 ALA MB . . 4.830 2.879 2.126 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
93 1 11 SER HB3 1 16 ALA MB . . 4.830 2.864 2.094 4.001 . 0 0 "[ . 1 . 2 . 3 ]" 1
94 1 12 PRO HA 1 13 GLY H . . 3.450 3.508 3.447 3.587 0.137 24 0 "[ . 1 . 2 . 3 ]" 1
95 1 12 PRO QB 1 13 GLY H . . 4.000 3.313 2.984 3.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
96 1 12 PRO QD 1 13 GLY H . . 4.000 2.419 2.238 2.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
97 1 12 PRO HD2 1 13 GLY H . . 4.720 2.453 2.262 2.660 . 0 0 "[ . 1 . 2 . 3 ]" 1
98 1 12 PRO HD3 1 13 GLY H . . 4.720 3.702 3.571 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
99 1 12 PRO QG 1 13 GLY H . . 4.120 2.291 2.004 2.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
100 1 13 GLY QA 1 14 PRO QD . . 2.980 3.626 3.615 3.657 0.677 31 31 [*********************-********+] 1
101 1 13 GLY QA 1 15 ASN H . . 4.400 2.677 2.501 3.070 . 0 0 "[ . 1 . 2 . 3 ]" 1
102 1 13 GLY HA3 1 14 PRO QD . . 3.870 4.055 3.993 4.189 0.319 31 0 "[ . 1 . 2 . 3 ]" 1
103 1 14 PRO QB 1 15 ASN H . . 3.460 3.797 3.631 4.002 0.542 31 1 "[ . 1 . 2 . 3+]" 1
104 1 14 PRO QD 1 15 ASN H . . 3.740 2.760 2.606 2.888 . 0 0 "[ . 1 . 2 . 3 ]" 1
105 1 14 PRO QG 1 15 ASN H . . 4.110 3.048 2.705 3.495 . 0 0 "[ . 1 . 2 . 3 ]" 1
106 1 14 PRO HG2 1 15 ASN H . . 4.980 3.101 2.737 3.585 . 0 0 "[ . 1 . 2 . 3 ]" 1
107 1 14 PRO HG3 1 15 ASN H . . 4.980 4.498 4.221 4.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
108 1 15 ASN H 1 15 ASN HB2 . . 3.510 3.830 2.863 4.043 0.533 3 2 "[ + . 1 . 2 . - 3 ]" 1
109 1 15 ASN H 1 15 ASN HB3 . . 3.510 3.304 3.073 3.934 0.424 6 0 "[ . 1 . 2 . 3 ]" 1
110 1 15 ASN H 1 16 ALA H . . 4.580 4.341 4.308 4.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
111 1 15 ASN H 1 89 LEU MD2 . . 4.970 4.624 4.242 4.903 . 0 0 "[ . 1 . 2 . 3 ]" 1
112 1 15 ASN HA 1 16 ALA H . . 3.060 2.255 2.083 2.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
113 1 15 ASN HA 1 16 ALA MB . . 5.500 3.760 3.606 4.002 . 0 0 "[ . 1 . 2 . 3 ]" 1
114 1 15 ASN HA 1 87 LEU HA . . 3.800 2.711 2.361 3.155 . 0 0 "[ . 1 . 2 . 3 ]" 1
115 1 15 ASN HA 1 87 LEU MD2 . . 5.190 4.908 4.371 5.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
116 1 15 ASN HA 1 88 GLY H . . 3.850 3.326 3.075 3.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
117 1 15 ASN HA 1 89 LEU H . . 4.470 3.797 3.097 4.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
118 1 15 ASN HA 1 89 LEU MD1 . . 6.600 3.399 2.754 3.999 . 0 0 "[ . 1 . 2 . 3 ]" 1
119 1 15 ASN HA 1 89 LEU MD2 . . 5.340 2.601 2.309 3.101 . 0 0 "[ . 1 . 2 . 3 ]" 1
120 1 15 ASN HA 1 89 LEU HG . . 4.470 2.770 2.155 3.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
121 1 15 ASN QB 1 87 LEU MD2 . . 5.340 3.232 2.580 3.651 . 0 0 "[ . 1 . 2 . 3 ]" 1
122 1 15 ASN HB2 1 16 ALA H . . 3.840 2.396 2.153 3.053 . 0 0 "[ . 1 . 2 . 3 ]" 1
123 1 15 ASN HB3 1 16 ALA H . . 3.840 3.572 2.172 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
124 1 15 ASN HD21 1 87 LEU MD2 . . 5.350 4.039 2.848 5.200 . 0 0 "[ . 1 . 2 . 3 ]" 1
125 1 15 ASN HD22 1 87 LEU MD2 . . 5.350 5.067 4.031 5.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
126 1 16 ALA H 1 85 MET ME . . 4.210 3.870 3.406 4.230 0.020 24 0 "[ . 1 . 2 . 3 ]" 1
127 1 16 ALA H 1 86 LEU H . . 3.890 3.113 2.844 3.325 . 0 0 "[ . 1 . 2 . 3 ]" 1
128 1 16 ALA H 1 86 LEU HB2 . . 4.560 3.066 2.592 3.529 . 0 0 "[ . 1 . 2 . 3 ]" 1
129 1 16 ALA H 1 86 LEU HB3 . . 4.560 3.875 3.450 4.148 . 0 0 "[ . 1 . 2 . 3 ]" 1
130 1 16 ALA H 1 86 LEU QD . . 5.500 4.252 3.951 4.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
131 1 16 ALA H 1 89 LEU MD2 . . 4.990 2.688 2.179 3.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
132 1 16 ALA HA 1 17 ALA H . . 3.010 2.639 2.471 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
133 1 16 ALA HA 1 85 MET ME . . 3.830 3.772 3.424 3.866 0.036 9 0 "[ . 1 . 2 . 3 ]" 1
134 1 16 ALA MB 1 17 ALA H . . 4.200 2.107 2.006 2.269 . 0 0 "[ . 1 . 2 . 3 ]" 1
135 1 16 ALA MB 1 17 ALA HA . . 5.500 4.003 3.911 4.107 . 0 0 "[ . 1 . 2 . 3 ]" 1
136 1 16 ALA MB 1 86 LEU H . . 4.870 3.711 3.364 4.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
137 1 17 ALA H 1 17 ALA MB . . 3.540 2.680 2.558 2.803 . 0 0 "[ . 1 . 2 . 3 ]" 1
138 1 17 ALA HA 1 18 ALA H . . 2.720 2.378 2.231 2.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
139 1 17 ALA HA 1 83 HIS HD2 . . 3.490 3.443 3.046 3.571 0.081 9 0 "[ . 1 . 2 . 3 ]" 1
140 1 17 ALA HA 1 84 PHE QB . . 4.960 4.388 4.029 4.634 . 0 0 "[ . 1 . 2 . 3 ]" 1
141 1 17 ALA HA 1 85 MET H . . 4.600 4.664 4.574 4.712 0.112 10 0 "[ . 1 . 2 . 3 ]" 1
142 1 17 ALA HA 1 85 MET HA . . 3.510 2.392 2.021 2.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
143 1 17 ALA HA 1 85 MET ME . . 3.960 3.586 2.490 3.989 0.029 29 0 "[ . 1 . 2 . 3 ]" 1
144 1 17 ALA HA 1 86 LEU H . . 3.830 2.801 2.499 3.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
145 1 17 ALA HA 1 86 LEU QD . . 5.500 2.794 2.282 3.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
146 1 17 ALA MB 1 18 ALA H . . 4.110 2.761 2.363 3.278 . 0 0 "[ . 1 . 2 . 3 ]" 1
147 1 17 ALA MB 1 19 TYR QE . . 6.600 3.132 2.197 4.300 . 0 0 "[ . 1 . 2 . 3 ]" 1
148 1 17 ALA MB 1 83 HIS HB2 . . 5.500 2.903 2.319 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
149 1 17 ALA MB 1 83 HIS HB3 . . 5.500 4.034 3.414 4.637 . 0 0 "[ . 1 . 2 . 3 ]" 1
150 1 17 ALA MB 1 83 HIS HD2 . . 3.290 2.355 2.184 2.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
151 1 17 ALA MB 1 85 MET HA . . 5.180 3.137 2.683 3.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
152 1 17 ALA MB 1 85 MET ME . . 4.850 2.376 1.976 2.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
153 1 17 ALA MB 1 86 LEU H . . 4.570 4.018 3.722 4.356 . 0 0 "[ . 1 . 2 . 3 ]" 1
154 1 18 ALA H 1 19 TYR H . . 4.890 4.357 4.169 4.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
155 1 18 ALA H 1 83 HIS HD2 . . 4.740 3.657 3.217 4.158 . 0 0 "[ . 1 . 2 . 3 ]" 1
156 1 18 ALA H 1 84 PHE QB . . 4.440 3.157 2.642 3.461 . 0 0 "[ . 1 . 2 . 3 ]" 1
157 1 18 ALA HA 1 19 TYR H . . 2.880 2.129 2.053 2.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
158 1 18 ALA MB 1 19 TYR H . . 4.300 2.798 2.518 3.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
159 1 18 ALA MB 1 84 PHE H . . 5.480 3.487 3.308 3.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
160 1 18 ALA MB 1 84 PHE QB . . 3.300 2.453 2.173 2.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
161 1 19 TYR HA 1 77 LEU HB2 . . 3.250 3.031 2.531 3.356 0.106 4 0 "[ . 1 . 2 . 3 ]" 1
162 1 19 TYR QE 1 79 PRO HA . . 4.840 2.824 2.166 4.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
163 1 19 TYR QE 1 79 PRO HB3 . . 6.600 3.969 2.471 6.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
164 1 19 TYR QE 1 79 PRO HD3 . . 6.600 5.229 3.871 6.640 0.040 4 0 "[ . 1 . 2 . 3 ]" 1
165 1 19 TYR QE 1 83 HIS HB2 . . 4.920 3.301 2.642 4.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
166 1 19 TYR QE 1 83 HIS HB3 . . 4.790 2.556 2.170 3.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
167 1 20 LEU H 1 20 LEU MD1 . . 5.460 3.778 2.497 4.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
168 1 20 LEU H 1 77 LEU H . . 5.130 3.911 2.751 5.009 . 0 0 "[ . 1 . 2 . 3 ]" 1
169 1 20 LEU H 1 77 LEU HB2 . . 4.210 2.536 1.795 3.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
170 1 20 LEU H 1 77 LEU HB3 . . 4.540 3.618 2.978 4.551 0.011 26 0 "[ . 1 . 2 . 3 ]" 1
171 1 20 LEU H 1 77 LEU MD1 . . 5.500 3.608 2.975 4.460 . 0 0 "[ . 1 . 2 . 3 ]" 1
172 1 20 LEU HB2 1 21 THR H . . 4.110 2.652 2.047 4.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
173 1 20 LEU HB3 1 21 THR H . . 5.070 3.840 2.932 4.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
174 1 20 LEU HB3 1 77 LEU MD1 . . 5.250 4.642 2.978 5.265 0.015 18 0 "[ . 1 . 2 . 3 ]" 1
175 1 20 LEU MD1 1 21 THR H . . 4.880 3.579 2.926 4.811 . 0 0 "[ . 1 . 2 . 3 ]" 1
176 1 20 LEU MD1 1 77 LEU MD2 . . 5.500 3.773 2.209 5.155 . 0 0 "[ . 1 . 2 . 3 ]" 1
177 1 20 LEU MD2 1 21 THR H . . 5.370 4.530 2.811 5.091 . 0 0 "[ . 1 . 2 . 3 ]" 1
178 1 20 LEU MD2 1 77 LEU MD1 . . 4.780 2.875 2.101 3.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
179 1 20 LEU MD2 1 77 LEU MD2 . . 5.500 3.051 2.077 3.802 . 0 0 "[ . 1 . 2 . 3 ]" 1
180 1 20 LEU MD2 1 77 LEU HG . . 5.500 5.101 4.348 5.559 0.059 5 0 "[ . 1 . 2 . 3 ]" 1
181 1 20 LEU MD2 1 84 PHE QD . . 4.570 2.567 2.056 3.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
182 1 20 LEU MD2 1 84 PHE QE . . 4.060 2.328 2.043 2.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
183 1 20 LEU MD2 1 84 PHE HZ . . 4.800 4.222 3.527 4.806 0.006 17 0 "[ . 1 . 2 . 3 ]" 1
184 1 21 THR H 1 21 THR HB . . 3.600 2.592 2.165 3.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
185 1 21 THR HA 1 22 LEU H . . 3.230 2.144 2.034 2.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
186 1 21 THR HA 1 76 GLU HA . . 3.700 2.130 1.896 2.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
187 1 21 THR HA 1 76 GLU QB . . 3.280 2.661 2.125 3.385 0.105 7 0 "[ . 1 . 2 . 3 ]" 1
188 1 21 THR HA 1 77 LEU H . . 4.090 3.205 2.455 3.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
189 1 21 THR HB 1 22 LEU H . . 5.320 4.061 3.029 4.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
190 1 21 THR MG 1 22 LEU H . . 4.490 2.655 2.094 3.836 . 0 0 "[ . 1 . 2 . 3 ]" 1
191 1 21 THR MG 1 74 ARG HD2 . . 5.030 3.363 1.827 5.083 0.053 12 0 "[ . 1 . 2 . 3 ]" 1
192 1 21 THR MG 1 74 ARG QD . . 4.420 2.872 1.804 4.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
193 1 21 THR MG 1 74 ARG HD3 . . 5.030 3.496 2.029 5.051 0.021 4 0 "[ . 1 . 2 . 3 ]" 1
194 1 21 THR MG 1 76 GLU QB . . 4.050 3.134 2.034 4.122 0.072 10 0 "[ . 1 . 2 . 3 ]" 1
195 1 21 THR MG 1 76 GLU QG . . 3.750 2.667 2.051 3.781 0.031 21 0 "[ . 1 . 2 . 3 ]" 1
196 1 22 LEU H 1 22 LEU HB2 . . 3.960 2.778 2.286 3.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
197 1 22 LEU H 1 22 LEU HB3 . . 3.990 2.988 2.503 3.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
198 1 22 LEU H 1 22 LEU MD1 . . 5.060 4.400 4.187 4.594 . 0 0 "[ . 1 . 2 . 3 ]" 1
199 1 22 LEU H 1 22 LEU MD2 . . 4.720 4.053 2.947 4.740 0.020 15 0 "[ . 1 . 2 . 3 ]" 1
200 1 22 LEU H 1 75 VAL H . . 4.440 3.383 3.004 3.747 . 0 0 "[ . 1 . 2 . 3 ]" 1
201 1 22 LEU H 1 76 GLU HA . . 4.410 2.680 2.058 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
202 1 22 LEU H 1 76 GLU QB . . 4.080 3.853 2.207 4.147 0.067 20 0 "[ . 1 . 2 . 3 ]" 1
203 1 22 LEU H 1 76 GLU HG2 . . 5.500 4.790 2.325 5.591 0.091 24 0 "[ . 1 . 2 . 3 ]" 1
204 1 22 LEU H 1 76 GLU HG3 . . 5.500 4.449 3.002 5.603 0.103 5 0 "[ . 1 . 2 . 3 ]" 1
205 1 22 LEU HA 1 23 GLU H . . 3.320 2.270 2.062 2.683 . 0 0 "[ . 1 . 2 . 3 ]" 1
206 1 22 LEU HB2 1 23 GLU H . . 4.430 4.263 3.775 4.486 0.056 1 0 "[ . 1 . 2 . 3 ]" 1
207 1 22 LEU HB2 1 75 VAL HB . . 4.810 4.192 2.434 4.916 0.106 10 0 "[ . 1 . 2 . 3 ]" 1
208 1 22 LEU HB3 1 23 GLU H . . 4.600 3.706 2.370 4.576 . 0 0 "[ . 1 . 2 . 3 ]" 1
209 1 22 LEU HB3 1 75 VAL H . . 5.210 3.499 2.810 4.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
210 1 22 LEU HB3 1 75 VAL HB . . 4.010 3.126 2.108 4.019 0.009 13 0 "[ . 1 . 2 . 3 ]" 1
211 1 22 LEU MD1 1 23 GLU H . . 4.590 2.435 1.749 4.622 0.032 3 0 "[ . 1 . 2 . 3 ]" 1
212 1 22 LEU MD1 1 24 ASN H . . 5.500 4.877 3.684 5.523 0.023 31 0 "[ . 1 . 2 . 3 ]" 1
213 1 22 LEU MD1 1 24 ASN HA . . 5.300 4.515 3.459 5.321 0.021 3 0 "[ . 1 . 2 . 3 ]" 1
214 1 23 GLU H 1 23 GLU QB . . 3.610 2.761 2.425 3.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
215 1 23 GLU H 1 23 GLU QG . . 4.970 3.126 2.003 4.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
216 1 23 GLU HA 1 24 ASN H . . 3.410 2.234 2.109 2.466 . 0 0 "[ . 1 . 2 . 3 ]" 1
217 1 23 GLU HA 1 74 ARG HA . . 3.310 2.290 2.061 2.993 . 0 0 "[ . 1 . 2 . 3 ]" 1
218 1 23 GLU HA 1 75 VAL H . . 4.960 3.253 2.010 3.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
219 1 23 GLU QB 1 74 ARG HA . . 4.400 3.774 2.680 4.430 0.030 6 0 "[ . 1 . 2 . 3 ]" 1
220 1 23 GLU HB2 1 24 ASN H . . 4.470 3.625 2.328 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
221 1 23 GLU HB3 1 24 ASN H . . 4.470 3.550 2.413 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
222 1 23 GLU QG 1 74 ARG HA . . 5.320 4.016 2.139 5.339 0.019 9 0 "[ . 1 . 2 . 3 ]" 1
223 1 24 ASN H 1 24 ASN HB2 . . 3.940 2.837 2.546 3.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
224 1 24 ASN H 1 24 ASN HB3 . . 4.080 2.614 2.367 2.963 . 0 0 "[ . 1 . 2 . 3 ]" 1
225 1 24 ASN H 1 25 PRO HD3 . . 5.000 4.014 3.234 4.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
226 1 24 ASN H 1 73 GLY H . . 4.980 4.173 3.333 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
227 1 24 ASN H 1 74 ARG HA . . 3.610 3.320 2.919 3.627 0.017 11 0 "[ . 1 . 2 . 3 ]" 1
228 1 24 ASN HA 1 25 PRO HD2 . . 3.320 2.118 2.059 2.251 . 0 0 "[ . 1 . 2 . 3 ]" 1
229 1 24 ASN HA 1 25 PRO HD3 . . 3.590 2.796 2.479 3.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
230 1 24 ASN HA 1 25 PRO HG2 . . 4.240 4.302 4.262 4.344 0.104 3 0 "[ . 1 . 2 . 3 ]" 1
231 1 24 ASN HA 1 25 PRO HG3 . . 4.980 4.659 4.514 4.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
232 1 24 ASN HA 1 26 GLY H . . 4.160 3.465 3.269 3.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
233 1 24 ASN HA 1 30 LEU MD1 . . 4.690 3.064 2.045 4.718 0.028 4 0 "[ . 1 . 2 . 3 ]" 1
234 1 24 ASN HA 1 30 LEU MD2 . . 4.690 3.758 2.061 4.756 0.066 9 0 "[ . 1 . 2 . 3 ]" 1
235 1 24 ASN HA 1 30 LEU HG . . 5.060 4.547 3.561 5.145 0.085 18 0 "[ . 1 . 2 . 3 ]" 1
236 1 24 ASN HB2 1 69 VAL MG1 . . 4.720 2.595 2.129 3.492 . 0 0 "[ . 1 . 2 . 3 ]" 1
237 1 24 ASN HB2 1 72 LYS H . . 5.060 4.635 4.322 5.093 0.033 4 0 "[ . 1 . 2 . 3 ]" 1
238 1 24 ASN HB2 1 73 GLY H . . 4.400 4.403 4.075 4.453 0.053 13 0 "[ . 1 . 2 . 3 ]" 1
239 1 24 ASN HB3 1 26 GLY H . . 5.500 4.415 4.040 5.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
240 1 24 ASN HB3 1 69 VAL MG1 . . 3.980 2.961 2.400 3.739 . 0 0 "[ . 1 . 2 . 3 ]" 1
241 1 24 ASN HB3 1 71 PRO HA . . 4.080 3.054 2.255 3.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
242 1 24 ASN HB3 1 72 LYS H . . 5.020 3.006 2.582 3.622 . 0 0 "[ . 1 . 2 . 3 ]" 1
243 1 24 ASN HB3 1 73 GLY H . . 4.200 2.834 2.635 3.077 . 0 0 "[ . 1 . 2 . 3 ]" 1
244 1 24 ASN HD21 1 29 PRO HA . . 4.680 3.009 2.319 4.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
245 1 24 ASN HD21 1 30 LEU H . . 4.430 2.943 2.250 4.497 0.067 10 0 "[ . 1 . 2 . 3 ]" 1
246 1 24 ASN HD21 1 30 LEU HB2 . . 4.780 3.463 2.884 4.823 0.043 21 0 "[ . 1 . 2 . 3 ]" 1
247 1 24 ASN HD21 1 30 LEU MD1 . . 6.600 3.600 2.633 5.248 . 0 0 "[ . 1 . 2 . 3 ]" 1
248 1 24 ASN HD21 1 30 LEU QD . . 5.240 3.288 2.616 3.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
249 1 24 ASN HD21 1 30 LEU MD2 . . 6.600 4.359 3.208 5.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
250 1 24 ASN HD21 1 69 VAL MG1 . . 5.500 3.550 2.864 5.183 . 0 0 "[ . 1 . 2 . 3 ]" 1
251 1 24 ASN HD21 1 71 PRO HA . . 4.080 2.667 2.252 3.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
252 1 24 ASN HD21 1 72 LYS H . . 5.200 4.003 2.678 4.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
253 1 24 ASN HD21 1 73 GLY H . . 5.400 4.425 3.221 5.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
254 1 24 ASN HD22 1 29 PRO HA . . 4.160 2.518 1.980 3.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
255 1 24 ASN HD22 1 30 LEU H . . 4.480 3.000 2.536 3.698 . 0 0 "[ . 1 . 2 . 3 ]" 1
256 1 24 ASN HD22 1 30 LEU HB2 . . 5.290 3.717 3.100 4.332 . 0 0 "[ . 1 . 2 . 3 ]" 1
257 1 24 ASN HD22 1 30 LEU QD . . 5.440 2.858 1.948 3.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
258 1 24 ASN HD22 1 69 VAL MG1 . . 5.500 4.838 4.410 5.276 . 0 0 "[ . 1 . 2 . 3 ]" 1
259 1 24 ASN HD22 1 71 PRO HA . . 3.920 2.675 2.291 3.136 . 0 0 "[ . 1 . 2 . 3 ]" 1
260 1 24 ASN HD22 1 72 LYS H . . 5.430 4.304 3.744 4.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
261 1 25 PRO HA 1 72 LYS H . . 4.050 4.079 4.054 4.103 0.053 31 0 "[ . 1 . 2 . 3 ]" 1
262 1 25 PRO HA 1 72 LYS HA . . 3.700 3.414 3.079 3.711 0.011 27 0 "[ . 1 . 2 . 3 ]" 1
263 1 25 PRO HA 1 72 LYS QD . . 4.640 3.408 2.964 4.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
264 1 25 PRO HD2 1 26 GLY H . . 4.300 2.962 2.724 3.203 . 0 0 "[ . 1 . 2 . 3 ]" 1
265 1 25 PRO HD3 1 26 GLY H . . 4.480 4.081 3.926 4.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
266 1 25 PRO QG 1 26 GLY H . . 4.540 2.936 2.624 3.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
267 1 25 PRO HG2 1 26 GLY H . . 4.740 2.979 2.650 3.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
268 1 25 PRO HG3 1 26 GLY H . . 5.100 4.452 4.216 4.727 . 0 0 "[ . 1 . 2 . 3 ]" 1
269 1 26 GLY H 1 27 ASP H . . 4.390 4.409 3.712 4.489 0.099 7 0 "[ . 1 . 2 . 3 ]" 1
270 1 26 GLY H 1 72 LYS H . . 4.680 3.824 2.936 4.373 . 0 0 "[ . 1 . 2 . 3 ]" 1
271 1 26 GLY QA 1 28 LEU H . . 3.890 3.031 2.778 3.274 . 0 0 "[ . 1 . 2 . 3 ]" 1
272 1 26 GLY HA3 1 27 ASP H . . 3.210 2.594 2.422 3.096 . 0 0 "[ . 1 . 2 . 3 ]" 1
273 1 26 GLY HA3 1 28 LEU H . . 4.620 3.216 2.849 4.754 0.134 27 0 "[ . 1 . 2 . 3 ]" 1
274 1 27 ASP H 1 27 ASP HB2 . . 3.530 2.223 2.071 3.496 . 0 0 "[ . 1 . 2 . 3 ]" 1
275 1 27 ASP H 1 27 ASP HB3 . . 3.340 3.388 2.713 3.445 0.105 28 0 "[ . 1 . 2 . 3 ]" 1
276 1 27 ASP H 1 28 LEU H . . 3.150 2.356 1.809 2.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
277 1 27 ASP H 1 28 LEU QB . . 4.320 4.342 4.239 4.379 0.059 14 0 "[ . 1 . 2 . 3 ]" 1
278 1 27 ASP H 1 28 LEU QD . . 5.440 3.848 1.997 4.807 . 0 0 "[ . 1 . 2 . 3 ]" 1
279 1 27 ASP H 1 28 LEU HG . . 4.840 3.962 3.218 4.911 0.071 29 0 "[ . 1 . 2 . 3 ]" 1
280 1 27 ASP HB2 1 28 LEU H . . 4.380 3.493 3.302 3.708 . 0 0 "[ . 1 . 2 . 3 ]" 1
281 1 27 ASP HB3 1 28 LEU H . . 4.120 4.009 2.137 4.162 0.042 22 0 "[ . 1 . 2 . 3 ]" 1
282 1 28 LEU H 1 28 LEU HB2 . . 3.830 3.372 2.588 3.947 0.117 27 0 "[ . 1 . 2 . 3 ]" 1
283 1 28 LEU H 1 28 LEU QB . . 3.030 2.837 2.546 3.179 0.149 27 0 "[ . 1 . 2 . 3 ]" 1
284 1 28 LEU H 1 28 LEU HB3 . . 3.830 3.373 3.010 3.833 0.003 13 0 "[ . 1 . 2 . 3 ]" 1
285 1 28 LEU H 1 28 LEU QD . . 4.180 3.061 1.829 3.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
286 1 28 LEU H 1 28 LEU HG . . 3.880 2.725 2.138 3.917 0.037 28 0 "[ . 1 . 2 . 3 ]" 1
287 1 28 LEU H 1 29 PRO HD2 . . 5.360 5.011 4.841 5.075 . 0 0 "[ . 1 . 2 . 3 ]" 1
288 1 28 LEU H 1 29 PRO HD3 . . 4.970 4.890 4.791 4.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
289 1 28 LEU H 1 71 PRO HB3 . . 4.590 2.946 2.741 4.619 0.029 29 0 "[ . 1 . 2 . 3 ]" 1
290 1 28 LEU H 1 71 PRO HG3 . . 4.600 4.434 3.978 4.615 0.015 27 0 "[ . 1 . 2 . 3 ]" 1
291 1 28 LEU HA 1 28 LEU QD . . 4.010 3.102 2.141 3.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
292 1 28 LEU HA 1 28 LEU HG . . 3.740 3.466 2.521 3.811 0.071 28 0 "[ . 1 . 2 . 3 ]" 1
293 1 28 LEU HA 1 29 PRO HD2 . . 3.350 2.925 2.703 3.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
294 1 28 LEU HA 1 29 PRO HD3 . . 3.430 2.265 2.138 2.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
295 1 28 LEU QB 1 29 PRO HD2 . . 3.740 2.113 1.950 2.257 . 0 0 "[ . 1 . 2 . 3 ]" 1
296 1 28 LEU QB 1 29 PRO HD3 . . 3.330 2.999 2.682 3.196 . 0 0 "[ . 1 . 2 . 3 ]" 1
297 1 28 LEU HB2 1 29 PRO HD2 . . 4.340 2.678 1.958 3.719 . 0 0 "[ . 1 . 2 . 3 ]" 1
298 1 28 LEU HB2 1 29 PRO HD3 . . 4.120 3.580 2.715 4.214 0.094 7 0 "[ . 1 . 2 . 3 ]" 1
299 1 28 LEU HB3 1 29 PRO HD2 . . 4.340 3.085 2.043 3.821 . 0 0 "[ . 1 . 2 . 3 ]" 1
300 1 28 LEU HB3 1 29 PRO HD3 . . 4.120 3.675 2.877 4.171 0.051 9 0 "[ . 1 . 2 . 3 ]" 1
301 1 28 LEU QD 1 29 PRO HD2 . . 5.020 3.129 2.293 3.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
302 1 28 LEU QD 1 29 PRO HD3 . . 4.490 3.800 2.786 4.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
303 1 29 PRO HA 1 30 LEU H . . 3.240 2.242 2.122 2.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
304 1 29 PRO HA 1 70 PRO HA . . 3.840 2.976 2.521 3.426 . 0 0 "[ . 1 . 2 . 3 ]" 1
305 1 29 PRO HA 1 71 PRO HD2 . . 4.070 3.922 3.645 4.079 0.009 14 0 "[ . 1 . 2 . 3 ]" 1
306 1 29 PRO HA 1 71 PRO HD3 . . 4.050 2.387 2.166 2.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
307 1 29 PRO HA 1 71 PRO HG3 . . 4.400 4.367 3.188 4.430 0.030 12 0 "[ . 1 . 2 . 3 ]" 1
308 1 29 PRO HB2 1 30 LEU H . . 3.920 3.047 2.507 3.329 . 0 0 "[ . 1 . 2 . 3 ]" 1
309 1 29 PRO HB3 1 30 LEU H . . 3.840 3.741 3.368 3.885 0.045 29 0 "[ . 1 . 2 . 3 ]" 1
310 1 29 PRO HB3 1 71 PRO HD3 . . 4.170 2.501 2.268 2.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
311 1 29 PRO HD2 1 30 LEU H . . 5.500 5.458 5.146 5.528 0.028 30 0 "[ . 1 . 2 . 3 ]" 1
312 1 29 PRO HG2 1 30 LEU H . . 4.810 4.669 4.317 4.850 0.040 29 0 "[ . 1 . 2 . 3 ]" 1
313 1 30 LEU H 1 30 LEU HB2 . . 3.780 2.430 2.213 2.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
314 1 30 LEU H 1 30 LEU HB3 . . 4.000 3.639 3.507 3.847 . 0 0 "[ . 1 . 2 . 3 ]" 1
315 1 30 LEU H 1 31 ARG H . . 4.680 4.382 4.107 4.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
316 1 30 LEU H 1 68 GLU HA . . 5.500 5.251 4.714 5.527 0.027 10 0 "[ . 1 . 2 . 3 ]" 1
317 1 30 LEU H 1 69 VAL H . . 4.020 3.374 2.837 3.633 . 0 0 "[ . 1 . 2 . 3 ]" 1
318 1 30 LEU H 1 69 VAL MG2 . . 5.060 4.872 4.464 5.080 0.020 23 0 "[ . 1 . 2 . 3 ]" 1
319 1 30 LEU H 1 71 PRO HD3 . . 5.500 4.451 4.088 4.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
320 1 30 LEU HA 1 30 LEU MD1 . . 4.030 3.165 2.237 3.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
321 1 30 LEU HA 1 30 LEU QD . . 3.480 2.190 2.055 2.321 . 0 0 "[ . 1 . 2 . 3 ]" 1
322 1 30 LEU HA 1 30 LEU MD2 . . 4.030 2.790 2.083 3.938 . 0 0 "[ . 1 . 2 . 3 ]" 1
323 1 30 LEU HA 1 31 ARG H . . 2.900 2.097 1.840 2.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
324 1 30 LEU HB2 1 30 LEU QD . . 3.070 2.201 2.111 2.509 . 0 0 "[ . 1 . 2 . 3 ]" 1
325 1 30 LEU HB2 1 31 ARG H . . 3.800 3.868 3.549 3.991 0.191 31 0 "[ . 1 . 2 . 3 ]" 1
326 1 30 LEU HB2 1 69 VAL H . . 4.820 3.931 3.256 4.530 . 0 0 "[ . 1 . 2 . 3 ]" 1
327 1 30 LEU HB2 1 69 VAL HB . . 3.500 2.822 2.333 3.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
328 1 30 LEU HB2 1 69 VAL MG2 . . 4.840 4.037 3.372 4.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
329 1 30 LEU HB2 1 105 PHE QD . . 4.590 4.317 3.953 4.711 0.121 1 0 "[ . 1 . 2 . 3 ]" 1
330 1 30 LEU HB2 1 105 PHE QE . . 4.530 3.911 3.216 4.573 0.043 1 0 "[ . 1 . 2 . 3 ]" 1
331 1 30 LEU HB3 1 31 ARG H . . 4.160 2.634 2.316 2.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
332 1 30 LEU HB3 1 69 VAL H . . 4.820 4.456 4.026 4.843 0.023 1 0 "[ . 1 . 2 . 3 ]" 1
333 1 30 LEU HB3 1 69 VAL HB . . 4.060 3.911 3.388 4.099 0.039 24 0 "[ . 1 . 2 . 3 ]" 1
334 1 30 LEU HB3 1 69 VAL MG2 . . 4.730 4.375 3.642 4.742 0.012 30 0 "[ . 1 . 2 . 3 ]" 1
335 1 30 LEU HB3 1 105 PHE QD . . 3.870 2.612 2.300 3.323 . 0 0 "[ . 1 . 2 . 3 ]" 1
336 1 30 LEU HB3 1 105 PHE QE . . 4.990 2.750 2.381 3.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
337 1 30 LEU QD 1 69 VAL HB . . 4.550 3.795 2.929 4.570 0.020 16 0 "[ . 1 . 2 . 3 ]" 1
338 1 30 LEU QD 1 105 PHE HB3 . . 4.870 3.198 2.400 4.379 . 0 0 "[ . 1 . 2 . 3 ]" 1
339 1 30 LEU QD 1 105 PHE QD . . 4.440 2.982 2.082 3.682 . 0 0 "[ . 1 . 2 . 3 ]" 1
340 1 30 LEU MD1 1 31 ARG H . . 4.740 4.140 2.423 4.750 0.010 27 0 "[ . 1 . 2 . 3 ]" 1
341 1 30 LEU MD1 1 69 VAL HB . . 5.500 4.314 2.947 5.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
342 1 30 LEU MD1 1 105 PHE HB2 . . 5.500 5.090 3.185 5.550 0.050 28 0 "[ . 1 . 2 . 3 ]" 1
343 1 30 LEU MD1 1 105 PHE HB3 . . 5.560 4.434 2.434 5.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
344 1 30 LEU MD1 1 105 PHE QE . . 5.110 3.613 2.164 4.964 . 0 0 "[ . 1 . 2 . 3 ]" 1
345 1 30 LEU MD2 1 31 ARG H . . 4.740 3.635 2.841 4.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
346 1 30 LEU MD2 1 69 VAL HB . . 5.500 4.867 3.067 5.535 0.035 20 0 "[ . 1 . 2 . 3 ]" 1
347 1 30 LEU MD2 1 105 PHE HB2 . . 5.500 4.312 3.231 5.546 0.046 18 0 "[ . 1 . 2 . 3 ]" 1
348 1 30 LEU MD2 1 105 PHE HB3 . . 5.560 3.642 2.410 5.036 . 0 0 "[ . 1 . 2 . 3 ]" 1
349 1 30 LEU MD2 1 105 PHE QE . . 5.110 3.408 2.513 5.124 0.014 4 0 "[ . 1 . 2 . 3 ]" 1
350 1 30 LEU HG 1 31 ARG H . . 4.310 4.095 3.222 4.471 0.161 1 0 "[ . 1 . 2 . 3 ]" 1
351 1 31 ARG H 1 31 ARG HB2 . . 3.790 3.228 2.870 3.389 . 0 0 "[ . 1 . 2 . 3 ]" 1
352 1 31 ARG H 1 31 ARG QB . . 3.270 2.706 2.553 2.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
353 1 31 ARG H 1 31 ARG HB3 . . 3.790 2.913 2.673 3.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
354 1 31 ARG H 1 31 ARG QD . . 5.340 5.239 4.843 5.357 0.017 19 0 "[ . 1 . 2 . 3 ]" 1
355 1 31 ARG H 1 105 PHE HB3 . . 5.500 3.236 2.609 3.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
356 1 31 ARG H 1 105 PHE QD . . 4.480 2.621 2.174 4.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
357 1 31 ARG H 1 105 PHE QE . . 5.760 4.402 3.934 5.220 . 0 0 "[ . 1 . 2 . 3 ]" 1
358 1 31 ARG H 1 106 ALA MB . . 5.280 3.859 3.414 4.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
359 1 31 ARG HA 1 32 LEU H . . 3.110 2.133 2.047 2.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
360 1 31 ARG HA 1 32 LEU HB2 . . 4.570 4.333 4.044 4.667 0.097 23 0 "[ . 1 . 2 . 3 ]" 1
361 1 31 ARG HA 1 32 LEU HB3 . . 5.500 4.464 4.192 4.714 . 0 0 "[ . 1 . 2 . 3 ]" 1
362 1 31 ARG HA 1 66 PHE QD . . 4.360 4.044 3.743 4.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
363 1 31 ARG HA 1 66 PHE QE . . 5.720 5.414 5.159 5.623 . 0 0 "[ . 1 . 2 . 3 ]" 1
364 1 31 ARG HA 1 69 VAL H . . 4.190 3.402 3.126 3.655 . 0 0 "[ . 1 . 2 . 3 ]" 1
365 1 31 ARG HA 1 105 PHE QD . . 5.510 4.153 3.899 5.569 0.059 1 0 "[ . 1 . 2 . 3 ]" 1
366 1 31 ARG QB 1 66 PHE QD . . 4.470 4.462 4.364 4.560 0.090 14 0 "[ . 1 . 2 . 3 ]" 1
367 1 31 ARG QB 1 69 VAL H . . 5.160 4.479 4.006 4.846 . 0 0 "[ . 1 . 2 . 3 ]" 1
368 1 31 ARG QB 1 105 PHE HA . . 4.400 4.442 4.389 4.491 0.091 28 0 "[ . 1 . 2 . 3 ]" 1
369 1 31 ARG HB2 1 32 LEU H . . 5.340 4.429 4.345 4.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
370 1 31 ARG HB3 1 32 LEU H . . 5.340 4.309 4.120 4.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
371 1 31 ARG QD 1 66 PHE HA . . 5.740 5.655 5.206 5.782 0.042 17 0 "[ . 1 . 2 . 3 ]" 1
372 1 31 ARG QD 1 66 PHE QD . . 4.450 2.957 2.053 3.374 . 0 0 "[ . 1 . 2 . 3 ]" 1
373 1 31 ARG QD 1 106 ALA MB . . 4.640 3.534 2.560 4.644 0.004 25 0 "[ . 1 . 2 . 3 ]" 1
374 1 31 ARG HD2 1 33 VAL MG1 . . 5.500 3.656 3.089 4.806 . 0 0 "[ . 1 . 2 . 3 ]" 1
375 1 31 ARG HD2 1 66 PHE QD . . 5.170 3.984 2.422 4.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
376 1 31 ARG HD2 1 106 ALA MB . . 5.300 3.715 2.600 5.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
377 1 31 ARG HD3 1 33 VAL MG1 . . 5.500 3.956 3.235 5.172 . 0 0 "[ . 1 . 2 . 3 ]" 1
378 1 31 ARG HD3 1 66 PHE QD . . 5.170 3.118 2.171 3.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
379 1 31 ARG HD3 1 106 ALA MB . . 5.300 4.669 3.789 5.308 0.008 25 0 "[ . 1 . 2 . 3 ]" 1
380 1 31 ARG QG 1 32 LEU H . . 4.400 3.095 2.801 3.491 . 0 0 "[ . 1 . 2 . 3 ]" 1
381 1 31 ARG QG 1 66 PHE QB . . 3.700 2.532 2.247 2.892 . 0 0 "[ . 1 . 2 . 3 ]" 1
382 1 31 ARG QG 1 66 PHE QD . . 3.980 2.443 2.274 3.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
383 1 31 ARG QG 1 66 PHE QE . . 5.750 3.640 3.350 4.613 . 0 0 "[ . 1 . 2 . 3 ]" 1
384 1 31 ARG QG 1 106 ALA H . . 4.260 3.806 3.387 4.272 0.012 28 0 "[ . 1 . 2 . 3 ]" 1
385 1 31 ARG HG2 1 32 LEU H . . 5.060 3.797 3.058 5.072 0.012 14 0 "[ . 1 . 2 . 3 ]" 1
386 1 31 ARG HG2 1 66 PHE HB2 . . 5.160 2.996 2.586 4.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
387 1 31 ARG HG2 1 66 PHE HB3 . . 5.160 3.823 3.265 5.193 0.033 14 0 "[ . 1 . 2 . 3 ]" 1
388 1 31 ARG HG2 1 66 PHE QD . . 4.750 3.450 2.995 4.413 . 0 0 "[ . 1 . 2 . 3 ]" 1
389 1 31 ARG HG3 1 32 LEU H . . 5.060 3.343 3.027 3.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
390 1 31 ARG HG3 1 66 PHE HB2 . . 5.160 3.096 2.349 3.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
391 1 31 ARG HG3 1 66 PHE HB3 . . 5.160 4.358 3.378 5.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
392 1 31 ARG HG3 1 66 PHE QD . . 4.750 2.504 2.324 3.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
393 1 32 LEU H 1 32 LEU HB2 . . 3.720 2.612 2.330 2.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
394 1 32 LEU H 1 32 LEU HB3 . . 3.790 2.394 2.235 2.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
395 1 32 LEU H 1 32 LEU MD1 . . 5.500 4.205 3.835 4.494 . 0 0 "[ . 1 . 2 . 3 ]" 1
396 1 32 LEU H 1 32 LEU MD2 . . 5.500 4.188 3.886 4.310 . 0 0 "[ . 1 . 2 . 3 ]" 1
397 1 32 LEU H 1 32 LEU HG . . 4.980 4.478 4.324 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
398 1 32 LEU H 1 33 VAL MG1 . . 5.500 4.270 3.940 4.607 . 0 0 "[ . 1 . 2 . 3 ]" 1
399 1 32 LEU H 1 66 PHE QB . . 5.340 3.676 3.355 3.942 . 0 0 "[ . 1 . 2 . 3 ]" 1
400 1 32 LEU H 1 66 PHE QD . . 5.240 4.097 3.810 4.288 . 0 0 "[ . 1 . 2 . 3 ]" 1
401 1 32 LEU H 1 67 LEU H . . 4.200 3.192 3.030 3.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
402 1 32 LEU H 1 105 PHE QD . . 4.840 3.776 3.422 4.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
403 1 32 LEU H 1 105 PHE QE . . 5.190 4.376 3.948 5.213 0.023 1 0 "[ . 1 . 2 . 3 ]" 1
404 1 32 LEU HA 1 32 LEU QD . . 3.480 2.331 2.107 3.131 . 0 0 "[ . 1 . 2 . 3 ]" 1
405 1 32 LEU HA 1 32 LEU HG . . 4.040 3.161 2.346 3.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
406 1 32 LEU HA 1 33 VAL H . . 3.060 2.191 2.140 2.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
407 1 32 LEU HA 1 105 PHE HA . . 3.360 2.444 2.214 2.603 . 0 0 "[ . 1 . 2 . 3 ]" 1
408 1 32 LEU HA 1 105 PHE QD . . 3.490 2.859 2.344 3.108 . 0 0 "[ . 1 . 2 . 3 ]" 1
409 1 32 LEU HA 1 105 PHE QE . . 4.660 3.908 3.645 4.342 . 0 0 "[ . 1 . 2 . 3 ]" 1
410 1 32 LEU HB2 1 33 VAL H . . 4.930 4.474 4.309 4.609 . 0 0 "[ . 1 . 2 . 3 ]" 1
411 1 32 LEU HB2 1 67 LEU H . . 4.620 4.592 4.187 4.693 0.073 7 0 "[ . 1 . 2 . 3 ]" 1
412 1 32 LEU HB2 1 105 PHE HA . . 4.480 4.544 4.491 4.644 0.164 11 0 "[ . 1 . 2 . 3 ]" 1
413 1 32 LEU HB2 1 105 PHE QD . . 5.500 3.218 2.846 3.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
414 1 32 LEU HB2 1 105 PHE QE . . 5.810 2.615 2.288 3.134 . 0 0 "[ . 1 . 2 . 3 ]" 1
415 1 32 LEU HB3 1 34 GLY H . . 5.320 5.293 5.057 5.359 0.039 3 0 "[ . 1 . 2 . 3 ]" 1
416 1 32 LEU HB3 1 67 LEU H . . 4.000 3.046 2.816 3.207 . 0 0 "[ . 1 . 2 . 3 ]" 1
417 1 32 LEU HB3 1 67 LEU HB2 . . 3.920 2.219 2.179 2.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
418 1 32 LEU HB3 1 67 LEU HB3 . . 3.920 3.940 3.919 3.959 0.039 27 0 "[ . 1 . 2 . 3 ]" 1
419 1 32 LEU HB3 1 67 LEU MD1 . . 5.040 3.433 3.128 3.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
420 1 32 LEU HB3 1 67 LEU MD2 . . 4.780 4.808 4.729 4.836 0.056 18 0 "[ . 1 . 2 . 3 ]" 1
421 1 32 LEU HB3 1 67 LEU HG . . 4.210 3.587 3.406 3.690 . 0 0 "[ . 1 . 2 . 3 ]" 1
422 1 32 LEU HB3 1 105 PHE QD . . 4.700 4.627 4.275 4.731 0.031 9 0 "[ . 1 . 2 . 3 ]" 1
423 1 32 LEU QD 1 33 VAL H . . 4.180 2.724 2.294 3.409 . 0 0 "[ . 1 . 2 . 3 ]" 1
424 1 32 LEU QD 1 34 GLY H . . 4.240 2.545 1.992 3.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
425 1 32 LEU QD 1 67 LEU MD1 . . 5.200 2.505 2.185 3.774 . 0 0 "[ . 1 . 2 . 3 ]" 1
426 1 32 LEU QD 1 84 PHE HZ . . 3.680 2.032 1.856 2.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
427 1 32 LEU QD 1 105 PHE HA . . 5.180 3.706 3.092 4.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
428 1 32 LEU QD 1 105 PHE QD . . 5.020 3.610 2.530 4.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
429 1 32 LEU QD 1 105 PHE QE . . 4.450 3.164 2.648 3.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
430 1 32 LEU MD1 1 84 PHE HZ . . 4.190 2.361 1.929 2.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
431 1 32 LEU MD1 1 105 PHE QD . . 5.700 4.427 3.276 5.433 . 0 0 "[ . 1 . 2 . 3 ]" 1
432 1 32 LEU MD1 1 105 PHE QE . . 5.470 3.747 2.836 5.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
433 1 32 LEU MD2 1 84 PHE HZ . . 4.190 2.412 1.955 3.974 . 0 0 "[ . 1 . 2 . 3 ]" 1
434 1 32 LEU MD2 1 105 PHE QD . . 5.700 4.224 2.542 5.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
435 1 32 LEU MD2 1 105 PHE QE . . 5.470 3.820 2.704 5.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
436 1 32 LEU HG 1 33 VAL H . . 5.120 4.299 2.685 5.117 . 0 0 "[ . 1 . 2 . 3 ]" 1
437 1 33 VAL H 1 33 VAL MG1 . . 4.260 2.686 2.514 2.981 . 0 0 "[ . 1 . 2 . 3 ]" 1
438 1 33 VAL H 1 33 VAL MG2 . . 3.620 2.189 1.998 2.315 . 0 0 "[ . 1 . 2 . 3 ]" 1
439 1 33 VAL H 1 34 GLY H . . 3.200 2.150 2.031 2.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
440 1 33 VAL H 1 105 PHE HA . . 4.170 2.927 2.581 3.170 . 0 0 "[ . 1 . 2 . 3 ]" 1
441 1 33 VAL H 1 105 PHE QD . . 4.910 4.602 3.770 4.812 . 0 0 "[ . 1 . 2 . 3 ]" 1
442 1 33 VAL HA 1 33 VAL HB . . 2.840 2.443 2.385 2.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
443 1 33 VAL HA 1 45 LEU MD1 . . 5.350 5.241 3.958 5.388 0.038 5 0 "[ . 1 . 2 . 3 ]" 1
444 1 33 VAL HA 1 45 LEU MD2 . . 5.210 3.345 2.984 3.863 . 0 0 "[ . 1 . 2 . 3 ]" 1
445 1 33 VAL HA 1 66 PHE HB2 . . 4.090 2.729 2.530 3.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
446 1 33 VAL HA 1 66 PHE QB . . 3.520 2.247 2.188 2.352 . 0 0 "[ . 1 . 2 . 3 ]" 1
447 1 33 VAL HA 1 66 PHE HB3 . . 4.090 2.396 2.335 2.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
448 1 33 VAL HA 1 66 PHE QD . . 4.330 4.374 4.345 4.420 0.090 14 0 "[ . 1 . 2 . 3 ]" 1
449 1 33 VAL HA 1 67 LEU H . . 4.380 3.591 3.379 3.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
450 1 33 VAL HB 1 34 GLY H . . 4.520 4.084 3.844 4.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
451 1 33 VAL HB 1 66 PHE QB . . 3.870 3.340 3.052 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
452 1 33 VAL MG1 1 34 GLY H . . 5.470 4.125 3.999 4.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
453 1 33 VAL MG1 1 66 PHE QB . . 3.950 2.089 2.036 2.252 . 0 0 "[ . 1 . 2 . 3 ]" 1
454 1 33 VAL MG1 1 66 PHE QD . . 4.610 3.564 3.150 3.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
455 1 33 VAL MG1 1 67 LEU H . . 5.240 4.336 4.103 4.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
456 1 33 VAL MG1 1 105 PHE HA . . 5.310 3.562 3.151 4.135 . 0 0 "[ . 1 . 2 . 3 ]" 1
457 1 33 VAL MG1 1 106 ALA H . . 4.980 2.663 2.205 3.137 . 0 0 "[ . 1 . 2 . 3 ]" 1
458 1 33 VAL MG1 1 106 ALA HA . . 4.570 3.049 2.342 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
459 1 33 VAL MG1 1 106 ALA MB . . 4.900 2.912 2.080 3.796 . 0 0 "[ . 1 . 2 . 3 ]" 1
460 1 33 VAL MG2 1 34 GLY H . . 3.940 2.616 2.415 2.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
461 1 33 VAL MG2 1 34 GLY HA3 . . 5.500 3.317 3.118 3.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
462 1 33 VAL MG2 1 66 PHE QB . . 5.790 4.213 4.135 4.392 . 0 0 "[ . 1 . 2 . 3 ]" 1
463 1 33 VAL MG2 1 66 PHE QD . . 6.600 5.698 5.584 5.925 . 0 0 "[ . 1 . 2 . 3 ]" 1
464 1 33 VAL MG2 1 104 LEU H . . 4.850 4.572 4.338 4.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
465 1 33 VAL MG2 1 104 LEU HB2 . . 4.580 2.908 2.532 3.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
466 1 33 VAL MG2 1 105 PHE H . . 5.500 4.164 3.793 4.701 . 0 0 "[ . 1 . 2 . 3 ]" 1
467 1 33 VAL MG2 1 105 PHE HA . . 3.990 3.263 2.715 3.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
468 1 33 VAL MG2 1 106 ALA H . . 5.030 3.256 2.311 3.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
469 1 33 VAL MG2 1 106 ALA HA . . 3.610 3.443 2.878 3.627 0.017 5 0 "[ . 1 . 2 . 3 ]" 1
470 1 33 VAL MG2 1 106 ALA MB . . 5.500 3.913 2.820 4.601 . 0 0 "[ . 1 . 2 . 3 ]" 1
471 1 34 GLY H 1 35 ALA H . . 4.530 4.367 4.327 4.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
472 1 34 GLY H 1 45 LEU MD1 . . 6.250 5.372 4.633 5.713 . 0 0 "[ . 1 . 2 . 3 ]" 1
473 1 34 GLY H 1 45 LEU MD2 . . 5.700 4.344 3.756 5.246 . 0 0 "[ . 1 . 2 . 3 ]" 1
474 1 34 GLY H 1 104 LEU H . . 4.310 3.339 3.132 3.493 . 0 0 "[ . 1 . 2 . 3 ]" 1
475 1 34 GLY H 1 104 LEU HB2 . . 3.840 2.499 2.207 2.712 . 0 0 "[ . 1 . 2 . 3 ]" 1
476 1 34 GLY H 1 104 LEU HB3 . . 4.110 3.936 3.544 4.113 0.003 15 0 "[ . 1 . 2 . 3 ]" 1
477 1 34 GLY H 1 104 LEU HG . . 5.400 4.536 4.134 4.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
478 1 34 GLY H 1 105 PHE HA . . 4.880 4.636 4.266 4.913 0.033 8 0 "[ . 1 . 2 . 3 ]" 1
479 1 34 GLY HA3 1 35 ALA H . . 3.170 2.483 2.401 2.605 . 0 0 "[ . 1 . 2 . 3 ]" 1
480 1 34 GLY HA3 1 84 PHE QD . . 6.600 5.706 5.135 6.049 . 0 0 "[ . 1 . 2 . 3 ]" 1
481 1 34 GLY HA3 1 84 PHE QE . . 4.810 4.066 3.794 4.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
482 1 34 GLY HA3 1 84 PHE HZ . . 5.470 5.365 4.647 5.531 0.061 30 0 "[ . 1 . 2 . 3 ]" 1
483 1 34 GLY HA3 1 104 LEU H . . 5.190 4.434 4.230 4.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
484 1 34 GLY HA3 1 104 LEU HB3 . . 5.100 4.236 3.890 4.438 . 0 0 "[ . 1 . 2 . 3 ]" 1
485 1 34 GLY HA3 1 104 LEU QD . . 5.080 2.558 2.326 4.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
486 1 34 GLY HA3 1 104 LEU HG . . 4.910 4.071 3.498 4.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
487 1 35 ALA H 1 43 VAL MG2 . . 4.540 3.678 2.543 4.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
488 1 35 ALA H 1 104 LEU QD . . 4.380 3.042 2.787 3.878 . 0 0 "[ . 1 . 2 . 3 ]" 1
489 1 35 ALA H 1 104 LEU HG . . 4.950 3.865 3.605 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
490 1 35 ALA HA 1 36 ARG H . . 3.090 2.490 2.268 2.631 . 0 0 "[ . 1 . 2 . 3 ]" 1
491 1 35 ALA HA 1 84 PHE QE . . 5.800 4.480 4.180 4.921 . 0 0 "[ . 1 . 2 . 3 ]" 1
492 1 35 ALA HA 1 84 PHE HZ . . 6.600 4.663 4.083 5.323 . 0 0 "[ . 1 . 2 . 3 ]" 1
493 1 35 ALA HA 1 103 LEU HA . . 3.520 2.713 2.292 3.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
494 1 35 ALA HA 1 104 LEU H . . 3.670 2.714 2.495 2.971 . 0 0 "[ . 1 . 2 . 3 ]" 1
495 1 35 ALA HA 1 104 LEU HB3 . . 5.300 5.113 4.936 5.327 0.027 18 0 "[ . 1 . 2 . 3 ]" 1
496 1 35 ALA HA 1 104 LEU QD . . 4.780 3.218 2.190 3.424 . 0 0 "[ . 1 . 2 . 3 ]" 1
497 1 35 ALA HA 1 104 LEU HG . . 3.650 2.473 2.247 3.663 0.013 23 0 "[ . 1 . 2 . 3 ]" 1
498 1 35 ALA MB 1 36 ARG H . . 3.880 2.152 1.992 2.513 . 0 0 "[ . 1 . 2 . 3 ]" 1
499 1 35 ALA MB 1 84 PHE QD . . 4.780 3.022 2.828 3.422 . 0 0 "[ . 1 . 2 . 3 ]" 1
500 1 35 ALA MB 1 84 PHE QE . . 4.090 2.839 2.597 3.218 . 0 0 "[ . 1 . 2 . 3 ]" 1
501 1 35 ALA MB 1 101 LEU MD1 . . 5.500 3.609 2.026 4.732 . 0 0 "[ . 1 . 2 . 3 ]" 1
502 1 35 ALA MB 1 101 LEU QD . . 4.750 2.351 1.941 3.516 . 0 0 "[ . 1 . 2 . 3 ]" 1
503 1 35 ALA MB 1 101 LEU MD2 . . 5.500 2.872 2.105 4.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
504 1 36 ARG H 1 36 ARG QD . . 5.490 4.857 4.404 5.465 . 0 0 "[ . 1 . 2 . 3 ]" 1
505 1 36 ARG H 1 36 ARG QG . . 4.140 3.934 3.094 4.229 0.089 6 0 "[ . 1 . 2 . 3 ]" 1
506 1 36 ARG H 1 37 THR H . . 5.470 4.331 4.241 4.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
507 1 36 ARG H 1 101 LEU QB . . 4.440 4.191 3.535 4.509 0.069 18 0 "[ . 1 . 2 . 3 ]" 1
508 1 36 ARG H 1 101 LEU MD1 . . 5.500 4.744 3.078 5.524 0.024 27 0 "[ . 1 . 2 . 3 ]" 1
509 1 36 ARG H 1 101 LEU QD . . 4.570 3.723 2.816 4.305 . 0 0 "[ . 1 . 2 . 3 ]" 1
510 1 36 ARG H 1 101 LEU MD2 . . 5.500 4.277 2.824 5.504 0.004 17 0 "[ . 1 . 2 . 3 ]" 1
511 1 36 ARG H 1 102 ASP H . . 4.070 2.746 2.358 3.072 . 0 0 "[ . 1 . 2 . 3 ]" 1
512 1 36 ARG H 1 102 ASP HB2 . . 4.280 2.693 2.185 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
513 1 36 ARG H 1 102 ASP HB3 . . 4.640 3.803 3.137 4.646 0.006 13 0 "[ . 1 . 2 . 3 ]" 1
514 1 36 ARG H 1 103 LEU HA . . 5.430 4.193 3.803 4.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
515 1 36 ARG HA 1 37 THR H . . 3.060 2.469 2.310 2.646 . 0 0 "[ . 1 . 2 . 3 ]" 1
516 1 36 ARG HA 1 37 THR MG . . 4.890 3.352 2.917 3.745 . 0 0 "[ . 1 . 2 . 3 ]" 1
517 1 36 ARG HA 1 43 VAL MG1 . . 4.260 2.554 2.145 3.107 . 0 0 "[ . 1 . 2 . 3 ]" 1
518 1 36 ARG HB2 1 37 THR H . . 5.080 3.871 3.192 4.195 . 0 0 "[ . 1 . 2 . 3 ]" 1
519 1 36 ARG HB3 1 37 THR H . . 5.080 3.067 2.209 4.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
520 1 36 ARG QG 1 37 THR H . . 5.500 3.073 1.943 4.332 . 0 0 "[ . 1 . 2 . 3 ]" 1
521 1 36 ARG QG 1 102 ASP HB2 . . 4.150 3.688 2.606 4.168 0.018 24 0 "[ . 1 . 2 . 3 ]" 1
522 1 36 ARG QG 1 102 ASP HB3 . . 4.470 4.420 3.189 4.567 0.097 9 0 "[ . 1 . 2 . 3 ]" 1
523 1 37 THR H 1 37 THR MG . . 3.770 2.731 2.498 2.911 . 0 0 "[ . 1 . 2 . 3 ]" 1
524 1 37 THR H 1 40 ALA H . . 4.980 4.805 4.222 5.322 0.342 29 0 "[ . 1 . 2 . 3 ]" 1
525 1 37 THR H 1 43 VAL MG1 . . 5.370 4.288 3.645 4.544 . 0 0 "[ . 1 . 2 . 3 ]" 1
526 1 37 THR HA 1 37 THR HG1 . . 4.070 2.655 2.380 2.965 . 0 0 "[ . 1 . 2 . 3 ]" 1
527 1 37 THR HA 1 38 PRO HD2 . . 3.210 2.558 2.307 2.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
528 1 37 THR HA 1 38 PRO HD3 . . 3.470 2.343 2.232 2.484 . 0 0 "[ . 1 . 2 . 3 ]" 1
529 1 37 THR HA 1 39 VAL H . . 4.460 4.088 3.905 4.334 . 0 0 "[ . 1 . 2 . 3 ]" 1
530 1 37 THR HA 1 99 VAL MG1 . . 5.500 4.629 4.173 5.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
531 1 37 THR HA 1 101 LEU HA . . 3.760 2.889 2.529 3.233 . 0 0 "[ . 1 . 2 . 3 ]" 1
532 1 37 THR HA 1 101 LEU MD1 . . 5.500 4.215 3.798 5.544 0.044 9 0 "[ . 1 . 2 . 3 ]" 1
533 1 37 THR HA 1 101 LEU QD . . 4.560 3.908 3.169 4.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
534 1 37 THR HA 1 101 LEU MD2 . . 5.500 5.078 3.188 5.545 0.045 22 0 "[ . 1 . 2 . 3 ]" 1
535 1 37 THR HA 1 102 ASP H . . 4.150 3.550 3.229 3.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
536 1 37 THR HB 1 38 PRO HD2 . . 4.150 3.614 3.208 3.895 . 0 0 "[ . 1 . 2 . 3 ]" 1
537 1 37 THR HB 1 38 PRO HD3 . . 4.320 4.357 4.329 4.372 0.052 11 0 "[ . 1 . 2 . 3 ]" 1
538 1 37 THR HB 1 39 VAL H . . 4.670 4.387 4.086 4.703 0.033 22 0 "[ . 1 . 2 . 3 ]" 1
539 1 37 THR HB 1 99 VAL MG1 . . 4.800 4.080 3.368 4.801 0.001 29 0 "[ . 1 . 2 . 3 ]" 1
540 1 37 THR HB 1 101 LEU HA . . 3.470 2.511 2.160 2.837 . 0 0 "[ . 1 . 2 . 3 ]" 1
541 1 37 THR HB 1 101 LEU MD1 . . 5.150 2.548 2.091 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
542 1 37 THR HB 1 101 LEU QD . . 3.770 2.362 1.921 3.005 . 0 0 "[ . 1 . 2 . 3 ]" 1
543 1 37 THR HB 1 101 LEU MD2 . . 5.150 3.499 1.942 4.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
544 1 37 THR HB 1 101 LEU HG . . 4.450 2.867 2.058 4.534 0.084 17 0 "[ . 1 . 2 . 3 ]" 1
545 1 37 THR HB 1 102 ASP H . . 4.310 3.739 3.410 4.095 . 0 0 "[ . 1 . 2 . 3 ]" 1
546 1 37 THR HG1 1 38 PRO HD2 . . 4.110 2.060 1.961 2.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
547 1 37 THR HG1 1 38 PRO HD3 . . 4.970 3.464 3.080 3.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
548 1 37 THR HG1 1 39 VAL H . . 4.440 3.176 2.736 3.645 . 0 0 "[ . 1 . 2 . 3 ]" 1
549 1 37 THR HG1 1 39 VAL MG1 . . 6.400 4.296 3.584 5.062 . 0 0 "[ . 1 . 2 . 3 ]" 1
550 1 37 THR HG1 1 99 VAL MG1 . . 4.870 2.607 2.239 3.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
551 1 37 THR HG1 1 100 GLU H . . 5.240 3.916 3.164 5.020 . 0 0 "[ . 1 . 2 . 3 ]" 1
552 1 37 THR HG1 1 101 LEU HA . . 5.330 3.327 3.003 3.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
553 1 37 THR HG1 1 101 LEU QD . . 6.020 2.712 2.239 4.110 . 0 0 "[ . 1 . 2 . 3 ]" 1
554 1 37 THR HG1 1 102 ASP H . . 5.500 5.059 4.775 5.503 0.003 21 0 "[ . 1 . 2 . 3 ]" 1
555 1 37 THR MG 1 39 VAL H . . 4.820 3.035 2.619 3.572 . 0 0 "[ . 1 . 2 . 3 ]" 1
556 1 38 PRO HA 1 39 VAL MG2 . . 5.060 5.036 4.773 5.104 0.044 13 0 "[ . 1 . 2 . 3 ]" 1
557 1 38 PRO HA 1 40 ALA H . . 4.330 3.949 3.573 4.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
558 1 38 PRO HB2 1 39 VAL H . . 3.960 3.825 3.521 3.984 0.024 12 0 "[ . 1 . 2 . 3 ]" 1
559 1 38 PRO HB3 1 39 VAL H . . 4.320 4.390 4.319 4.426 0.106 27 0 "[ . 1 . 2 . 3 ]" 1
560 1 38 PRO HD2 1 39 VAL H . . 4.230 2.783 2.535 3.115 . 0 0 "[ . 1 . 2 . 3 ]" 1
561 1 38 PRO HD2 1 39 VAL MG1 . . 5.500 3.662 3.026 4.237 . 0 0 "[ . 1 . 2 . 3 ]" 1
562 1 38 PRO HD2 1 99 VAL MG1 . . 5.500 3.102 2.383 4.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
563 1 38 PRO HD2 1 100 GLU H . . 5.220 3.534 2.820 4.535 . 0 0 "[ . 1 . 2 . 3 ]" 1
564 1 38 PRO HD2 1 101 LEU HA . . 4.790 4.275 4.024 4.575 . 0 0 "[ . 1 . 2 . 3 ]" 1
565 1 38 PRO HD3 1 39 VAL H . . 4.580 3.954 3.799 4.139 . 0 0 "[ . 1 . 2 . 3 ]" 1
566 1 38 PRO HD3 1 39 VAL MG1 . . 5.500 4.821 4.401 5.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
567 1 38 PRO HD3 1 101 LEU HA . . 4.900 4.460 3.942 4.910 0.010 10 0 "[ . 1 . 2 . 3 ]" 1
568 1 39 VAL H 1 39 VAL MG1 . . 4.750 2.622 2.309 2.858 . 0 0 "[ . 1 . 2 . 3 ]" 1
569 1 39 VAL H 1 39 VAL MG2 . . 3.640 2.067 1.941 2.271 . 0 0 "[ . 1 . 2 . 3 ]" 1
570 1 39 VAL H 1 40 ALA H . . 3.450 2.820 2.642 3.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
571 1 39 VAL HA 1 39 VAL HB . . 2.630 2.440 2.378 2.498 . 0 0 "[ . 1 . 2 . 3 ]" 1
572 1 39 VAL HA 1 90 LYS QD . . 4.390 4.215 3.031 4.393 0.003 8 0 "[ . 1 . 2 . 3 ]" 1
573 1 39 VAL HA 1 90 LYS QG . . 3.700 2.637 2.052 3.964 0.264 22 0 "[ . 1 . 2 . 3 ]" 1
574 1 39 VAL HB 1 40 ALA H . . 4.790 4.472 4.399 4.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
575 1 39 VAL MG1 1 91 ARG H . . 5.500 3.547 2.738 4.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
576 1 39 VAL MG1 1 100 GLU H . . 5.500 4.499 3.652 5.180 . 0 0 "[ . 1 . 2 . 3 ]" 1
577 1 39 VAL MG2 1 40 ALA H . . 4.240 3.534 3.216 3.593 . 0 0 "[ . 1 . 2 . 3 ]" 1
578 1 40 ALA H 1 41 GLU H . . 4.900 4.331 4.148 4.486 . 0 0 "[ . 1 . 2 . 3 ]" 1
579 1 40 ALA H 1 90 LYS H . . 5.500 4.411 3.774 5.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
580 1 40 ALA H 1 90 LYS QD . . 5.500 4.612 2.421 5.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
581 1 40 ALA H 1 90 LYS QE . . 5.340 3.943 3.357 4.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
582 1 40 ALA H 1 90 LYS QG . . 5.340 3.032 2.604 3.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
583 1 40 ALA HA 1 41 GLU H . . 2.720 2.295 2.140 2.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
584 1 40 ALA HA 1 42 ARG H . . 4.480 4.287 3.836 4.551 0.071 13 0 "[ . 1 . 2 . 3 ]" 1
585 1 40 ALA HA 1 89 LEU H . . 3.530 3.468 2.869 3.675 0.145 9 0 "[ . 1 . 2 . 3 ]" 1
586 1 40 ALA HA 1 89 LEU HA . . 2.980 2.041 1.971 2.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
587 1 40 ALA HA 1 90 LYS H . . 4.120 3.465 3.281 3.560 . 0 0 "[ . 1 . 2 . 3 ]" 1
588 1 40 ALA MB 1 41 GLU H . . 4.000 2.651 2.351 3.156 . 0 0 "[ . 1 . 2 . 3 ]" 1
589 1 40 ALA MB 1 42 ARG H . . 4.100 3.133 2.347 3.896 . 0 0 "[ . 1 . 2 . 3 ]" 1
590 1 41 GLU H 1 41 GLU HB2 . . 3.180 2.427 2.123 2.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
591 1 41 GLU H 1 41 GLU HB3 . . 3.180 2.586 2.271 3.250 0.070 19 0 "[ . 1 . 2 . 3 ]" 1
592 1 41 GLU H 1 41 GLU QG . . 4.460 4.006 3.675 4.059 . 0 0 "[ . 1 . 2 . 3 ]" 1
593 1 41 GLU H 1 88 GLY QA . . 3.580 3.096 2.691 3.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
594 1 41 GLU H 1 90 LYS QG . . 4.570 4.110 3.887 4.209 . 0 0 "[ . 1 . 2 . 3 ]" 1
595 1 41 GLU HA 1 90 LYS HE2 . . 4.120 2.856 2.282 4.169 0.049 19 0 "[ . 1 . 2 . 3 ]" 1
596 1 41 GLU HA 1 90 LYS HE3 . . 4.120 3.629 2.681 4.417 0.297 6 0 "[ . 1 . 2 . 3 ]" 1
597 1 41 GLU QB 1 88 GLY QA . . 3.770 2.408 2.228 2.625 . 0 0 "[ . 1 . 2 . 3 ]" 1
598 1 41 GLU QG 1 42 ARG H . . 4.370 3.885 3.212 4.370 . 0 0 "[ . 1 . 2 . 3 ]" 1
599 1 42 ARG H 1 42 ARG QB . . 3.600 2.632 2.162 3.226 . 0 0 "[ . 1 . 2 . 3 ]" 1
600 1 42 ARG H 1 42 ARG QD . . 5.100 4.379 2.430 5.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
601 1 42 ARG H 1 42 ARG HG2 . . 4.600 3.921 2.109 4.652 0.052 6 0 "[ . 1 . 2 . 3 ]" 1
602 1 42 ARG H 1 42 ARG QG . . 3.810 3.182 2.088 3.904 0.094 18 0 "[ . 1 . 2 . 3 ]" 1
603 1 42 ARG H 1 42 ARG HG3 . . 4.600 3.564 2.299 4.615 0.015 23 0 "[ . 1 . 2 . 3 ]" 1
604 1 42 ARG H 1 43 VAL H . . 4.250 4.231 3.620 4.352 0.102 27 0 "[ . 1 . 2 . 3 ]" 1
605 1 42 ARG H 1 87 LEU H . . 4.140 3.362 3.031 3.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
606 1 42 ARG H 1 87 LEU MD2 . . 5.500 5.046 3.780 5.528 0.028 7 0 "[ . 1 . 2 . 3 ]" 1
607 1 42 ARG H 1 88 GLY QA . . 4.740 3.887 3.171 4.515 . 0 0 "[ . 1 . 2 . 3 ]" 1
608 1 42 ARG HA 1 42 ARG QD . . 4.990 3.914 1.973 4.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
609 1 42 ARG HA 1 43 VAL H . . 2.770 2.278 1.992 2.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
610 1 42 ARG QD 1 87 LEU MD2 . . 5.340 4.120 2.346 5.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
611 1 42 ARG QG 1 43 VAL H . . 4.610 3.715 2.320 4.561 . 0 0 "[ . 1 . 2 . 3 ]" 1
612 1 43 VAL H 1 43 VAL HB . . 3.330 3.225 2.705 3.465 0.135 19 0 "[ . 1 . 2 . 3 ]" 1
613 1 43 VAL H 1 43 VAL MG1 . . 3.680 2.404 1.819 2.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
614 1 43 VAL HA 1 43 VAL MG1 . . 3.670 3.275 3.262 3.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
615 1 43 VAL HA 1 43 VAL MG2 . . 3.590 2.343 2.251 2.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
616 1 43 VAL HA 1 44 GLU H . . 3.080 2.218 1.999 2.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
617 1 43 VAL HA 1 86 LEU HA . . 3.680 2.541 2.390 2.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
618 1 43 VAL HA 1 86 LEU QB . . 4.630 4.612 4.175 4.687 0.057 21 0 "[ . 1 . 2 . 3 ]" 1
619 1 43 VAL HA 1 86 LEU HG . . 4.330 4.194 3.770 4.452 0.122 13 0 "[ . 1 . 2 . 3 ]" 1
620 1 43 VAL HB 1 44 GLU H . . 4.140 4.103 3.956 4.310 0.170 12 0 "[ . 1 . 2 . 3 ]" 1
621 1 43 VAL MG1 1 44 GLU H . . 4.320 3.883 3.513 4.224 . 0 0 "[ . 1 . 2 . 3 ]" 1
622 1 43 VAL MG2 1 44 GLU H . . 3.990 2.522 2.144 3.937 . 0 0 "[ . 1 . 2 . 3 ]" 1
623 1 43 VAL MG2 1 84 PHE HB2 . . 4.580 3.489 3.041 3.894 . 0 0 "[ . 1 . 2 . 3 ]" 1
624 1 43 VAL MG2 1 84 PHE QB . . 3.910 2.197 1.992 2.588 . 0 0 "[ . 1 . 2 . 3 ]" 1
625 1 43 VAL MG2 1 84 PHE HB3 . . 4.580 2.221 2.011 2.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
626 1 43 VAL MG2 1 84 PHE QD . . 3.740 2.382 2.167 2.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
627 1 43 VAL MG2 1 84 PHE QE . . 3.880 3.875 3.708 3.908 0.028 30 0 "[ . 1 . 2 . 3 ]" 1
628 1 43 VAL MG2 1 85 MET H . . 4.310 3.587 2.825 4.245 . 0 0 "[ . 1 . 2 . 3 ]" 1
629 1 44 GLU H 1 44 GLU HB2 . . 4.090 2.668 2.446 3.152 . 0 0 "[ . 1 . 2 . 3 ]" 1
630 1 44 GLU H 1 44 GLU QB . . 3.590 2.530 2.396 2.716 . 0 0 "[ . 1 . 2 . 3 ]" 1
631 1 44 GLU H 1 44 GLU HB3 . . 4.090 3.451 2.581 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
632 1 44 GLU H 1 44 GLU HG2 . . 5.500 4.333 2.556 4.764 . 0 0 "[ . 1 . 2 . 3 ]" 1
633 1 44 GLU H 1 44 GLU QG . . 4.810 3.484 2.528 4.227 . 0 0 "[ . 1 . 2 . 3 ]" 1
634 1 44 GLU H 1 44 GLU HG3 . . 5.500 3.811 2.773 4.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
635 1 44 GLU H 1 84 PHE QD . . 5.830 3.893 3.252 4.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
636 1 44 GLU H 1 85 MET H . . 4.170 3.022 2.830 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
637 1 44 GLU H 1 85 MET QB . . 5.140 3.249 2.940 3.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
638 1 44 GLU H 1 86 LEU HA . . 4.300 3.855 3.651 4.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
639 1 44 GLU HA 1 44 GLU QG . . 3.640 2.423 2.177 3.262 . 0 0 "[ . 1 . 2 . 3 ]" 1
640 1 44 GLU HA 1 45 LEU H . . 2.920 2.305 2.081 2.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
641 1 44 GLU QB 1 45 LEU H . . 4.220 3.017 2.196 3.829 . 0 0 "[ . 1 . 2 . 3 ]" 1
642 1 44 GLU QB 1 46 HIS HD2 . . 3.820 3.276 2.596 3.849 0.029 3 0 "[ . 1 . 2 . 3 ]" 1
643 1 44 GLU QB 1 85 MET H . . 4.970 3.375 2.928 4.186 . 0 0 "[ . 1 . 2 . 3 ]" 1
644 1 44 GLU QG 1 45 LEU H . . 4.110 3.567 2.380 4.192 0.082 18 0 "[ . 1 . 2 . 3 ]" 1
645 1 44 GLU HG2 1 45 LEU H . . 4.850 3.879 2.515 4.881 0.031 22 0 "[ . 1 . 2 . 3 ]" 1
646 1 44 GLU HG3 1 45 LEU H . . 4.850 4.330 2.937 4.905 0.055 14 0 "[ . 1 . 2 . 3 ]" 1
647 1 45 LEU H 1 45 LEU QB . . 3.290 2.381 2.160 3.227 . 0 0 "[ . 1 . 2 . 3 ]" 1
648 1 45 LEU H 1 45 LEU MD1 . . 5.450 4.357 4.071 4.506 . 0 0 "[ . 1 . 2 . 3 ]" 1
649 1 45 LEU H 1 45 LEU MD2 . . 5.060 4.076 1.819 4.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
650 1 45 LEU H 1 45 LEU HG . . 4.470 4.295 3.448 4.473 0.003 29 0 "[ . 1 . 2 . 3 ]" 1
651 1 45 LEU H 1 46 HIS HD2 . . 5.150 3.849 3.142 4.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
652 1 45 LEU H 1 84 PHE QE . . 6.220 4.766 3.695 5.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
653 1 45 LEU HA 1 45 LEU MD1 . . 4.240 2.379 2.152 4.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
654 1 45 LEU HA 1 45 LEU MD2 . . 4.280 3.856 3.654 3.939 . 0 0 "[ . 1 . 2 . 3 ]" 1
655 1 45 LEU HA 1 46 HIS H . . 3.040 2.122 1.985 2.187 . 0 0 "[ . 1 . 2 . 3 ]" 1
656 1 45 LEU HA 1 46 HIS HD2 . . 5.530 4.274 4.026 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
657 1 45 LEU HA 1 64 VAL MG2 . . 5.500 4.333 4.022 4.616 . 0 0 "[ . 1 . 2 . 3 ]" 1
658 1 45 LEU HA 1 83 HIS H . . 5.500 4.900 4.326 5.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
659 1 45 LEU HA 1 84 PHE HA . . 3.930 2.444 2.068 2.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
660 1 45 LEU HA 1 84 PHE QD . . 4.080 2.924 2.408 3.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
661 1 45 LEU HA 1 84 PHE QE . . 5.080 3.918 3.602 4.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
662 1 45 LEU HA 1 85 MET H . . 4.150 3.478 2.979 3.679 . 0 0 "[ . 1 . 2 . 3 ]" 1
663 1 45 LEU QB 1 64 VAL H . . 4.430 3.712 3.441 4.548 0.118 28 0 "[ . 1 . 2 . 3 ]" 1
664 1 45 LEU QB 1 64 VAL MG2 . . 4.460 3.331 2.794 3.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
665 1 45 LEU MD1 1 46 HIS H . . 4.660 2.832 2.268 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
666 1 45 LEU MD1 1 64 VAL MG2 . . 5.450 3.094 2.217 3.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
667 1 45 LEU MD1 1 66 PHE HA . . 4.610 4.189 2.388 4.472 . 0 0 "[ . 1 . 2 . 3 ]" 1
668 1 45 LEU MD1 1 67 LEU H . . 5.500 4.353 3.137 4.629 . 0 0 "[ . 1 . 2 . 3 ]" 1
669 1 45 LEU MD1 1 82 TYR HA . . 5.500 4.848 4.389 5.515 0.015 18 0 "[ . 1 . 2 . 3 ]" 1
670 1 45 LEU MD1 1 83 HIS H . . 5.500 3.718 3.244 4.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
671 1 45 LEU MD1 1 84 PHE HA . . 5.220 3.414 2.987 5.224 0.004 21 0 "[ . 1 . 2 . 3 ]" 1
672 1 45 LEU MD1 1 84 PHE QE . . 5.500 2.755 2.438 3.521 . 0 0 "[ . 1 . 2 . 3 ]" 1
673 1 45 LEU MD2 1 46 HIS H . . 5.160 4.753 4.460 4.983 . 0 0 "[ . 1 . 2 . 3 ]" 1
674 1 45 LEU MD2 1 64 VAL H . . 6.320 4.223 3.427 4.525 . 0 0 "[ . 1 . 2 . 3 ]" 1
675 1 45 LEU MD2 1 64 VAL HB . . 4.990 4.264 3.016 4.910 . 0 0 "[ . 1 . 2 . 3 ]" 1
676 1 45 LEU MD2 1 64 VAL MG2 . . 4.880 2.618 2.221 3.292 . 0 0 "[ . 1 . 2 . 3 ]" 1
677 1 45 LEU MD2 1 66 PHE H . . 5.500 3.179 2.714 3.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
678 1 45 LEU MD2 1 66 PHE HA . . 4.490 2.203 2.007 3.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
679 1 45 LEU MD2 1 66 PHE QD . . 6.600 4.694 4.483 5.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
680 1 45 LEU MD2 1 67 LEU H . . 4.760 3.084 2.661 4.767 0.007 18 0 "[ . 1 . 2 . 3 ]" 1
681 1 45 LEU MD2 1 84 PHE HA . . 5.500 5.497 5.022 5.586 0.086 17 0 "[ . 1 . 2 . 3 ]" 1
682 1 45 LEU MD2 1 84 PHE QD . . 4.870 4.582 4.007 4.897 0.027 19 0 "[ . 1 . 2 . 3 ]" 1
683 1 45 LEU MD2 1 84 PHE QE . . 4.620 3.272 2.861 3.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
684 1 45 LEU MD2 1 84 PHE HZ . . 5.550 3.872 3.215 5.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
685 1 45 LEU HG 1 47 GLU H . . 5.500 5.453 5.164 5.538 0.038 21 0 "[ . 1 . 2 . 3 ]" 1
686 1 45 LEU HG 1 64 VAL MG2 . . 5.500 2.054 1.978 2.151 . 0 0 "[ . 1 . 2 . 3 ]" 1
687 1 45 LEU HG 1 82 TYR QD . . 4.790 4.265 3.314 4.801 0.011 28 0 "[ . 1 . 2 . 3 ]" 1
688 1 45 LEU HG 1 83 HIS H . . 5.440 5.165 4.227 5.522 0.082 28 0 "[ . 1 . 2 . 3 ]" 1
689 1 46 HIS H 1 46 HIS HB2 . . 3.640 2.466 2.412 2.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
690 1 46 HIS H 1 46 HIS HB3 . . 3.870 3.690 3.656 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
691 1 46 HIS H 1 46 HIS HD2 . . 5.340 3.654 3.502 3.748 . 0 0 "[ . 1 . 2 . 3 ]" 1
692 1 46 HIS H 1 47 GLU H . . 4.850 4.443 4.379 4.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
693 1 46 HIS H 1 64 VAL MG2 . . 5.500 3.807 3.547 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
694 1 46 HIS H 1 82 TYR HA . . 5.510 4.998 4.704 5.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
695 1 46 HIS H 1 82 TYR QD . . 5.950 4.897 4.701 5.199 . 0 0 "[ . 1 . 2 . 3 ]" 1
696 1 46 HIS H 1 83 HIS H . . 4.320 3.298 2.965 3.470 . 0 0 "[ . 1 . 2 . 3 ]" 1
697 1 46 HIS H 1 83 HIS HD2 . . 5.500 4.761 4.422 5.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
698 1 46 HIS H 1 83 HIS HE1 . . 5.600 5.481 5.189 5.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
699 1 46 HIS H 1 84 PHE HA . . 4.900 3.028 2.811 3.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
700 1 46 HIS H 1 84 PHE QD . . 5.100 4.632 4.159 5.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
701 1 46 HIS H 1 85 MET H . . 5.350 3.801 3.457 4.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
702 1 46 HIS HA 1 46 HIS HD2 . . 3.610 2.592 2.516 2.678 . 0 0 "[ . 1 . 2 . 3 ]" 1
703 1 46 HIS HA 1 47 GLU H . . 3.120 2.136 2.062 2.234 . 0 0 "[ . 1 . 2 . 3 ]" 1
704 1 46 HIS HA 1 47 GLU QB . . 4.260 4.300 4.262 4.333 0.073 28 0 "[ . 1 . 2 . 3 ]" 1
705 1 46 HIS HA 1 47 GLU QG . . 4.780 3.947 3.701 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
706 1 46 HIS HA 1 62 ARG H . . 5.150 4.392 4.163 4.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
707 1 46 HIS HA 1 63 PRO HB2 . . 4.570 4.624 4.581 4.658 0.088 26 0 "[ . 1 . 2 . 3 ]" 1
708 1 46 HIS HA 1 64 VAL H . . 3.620 2.973 2.827 3.204 . 0 0 "[ . 1 . 2 . 3 ]" 1
709 1 46 HIS HA 1 64 VAL MG1 . . 5.880 3.520 3.029 4.528 . 0 0 "[ . 1 . 2 . 3 ]" 1
710 1 46 HIS HA 1 64 VAL MG2 . . 5.500 2.776 2.380 3.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
711 1 46 HIS HA 1 83 HIS HE1 . . 5.250 5.271 5.226 5.291 0.041 26 0 "[ . 1 . 2 . 3 ]" 1
712 1 46 HIS HB2 1 47 GLU H . . 3.850 3.782 3.643 3.899 0.049 30 0 "[ . 1 . 2 . 3 ]" 1
713 1 46 HIS HB2 1 61 MET HA . . 6.260 6.235 5.846 6.351 0.091 2 0 "[ . 1 . 2 . 3 ]" 1
714 1 46 HIS HB2 1 83 HIS H . . 4.320 3.604 3.502 3.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
715 1 46 HIS HB2 1 83 HIS HD2 . . 4.250 3.548 3.352 3.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
716 1 46 HIS HB2 1 83 HIS HE1 . . 4.200 3.237 2.998 3.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
717 1 46 HIS HB3 1 46 HIS HE1 . . 5.260 4.915 4.840 4.980 . 0 0 "[ . 1 . 2 . 3 ]" 1
718 1 46 HIS HB3 1 47 GLU H . . 3.630 2.571 2.375 2.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
719 1 46 HIS HB3 1 63 PRO HA . . 4.330 3.868 3.705 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
720 1 46 HIS HB3 1 83 HIS H . . 5.500 4.539 4.393 4.800 . 0 0 "[ . 1 . 2 . 3 ]" 1
721 1 46 HIS HB3 1 83 HIS HD2 . . 5.150 4.970 4.776 5.176 0.026 18 0 "[ . 1 . 2 . 3 ]" 1
722 1 46 HIS HB3 1 83 HIS HE1 . . 4.310 2.901 2.803 3.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
723 1 46 HIS HD2 1 47 GLU H . . 4.500 4.516 4.383 4.557 0.057 4 0 "[ . 1 . 2 . 3 ]" 1
724 1 46 HIS HD2 1 63 PRO HA . . 3.460 2.049 1.965 2.143 . 0 0 "[ . 1 . 2 . 3 ]" 1
725 1 46 HIS HD2 1 63 PRO HB2 . . 4.300 3.545 3.453 3.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
726 1 46 HIS HD2 1 63 PRO HB3 . . 4.160 2.450 2.285 2.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
727 1 46 HIS HD2 1 63 PRO HD2 . . 6.170 5.436 5.138 5.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
728 1 46 HIS HD2 1 63 PRO QD . . 5.360 4.181 3.809 4.436 . 0 0 "[ . 1 . 2 . 3 ]" 1
729 1 46 HIS HD2 1 63 PRO HD3 . . 6.170 4.347 3.926 4.648 . 0 0 "[ . 1 . 2 . 3 ]" 1
730 1 46 HIS HD2 1 63 PRO HG2 . . 5.630 5.156 4.980 5.314 . 0 0 "[ . 1 . 2 . 3 ]" 1
731 1 46 HIS HD2 1 63 PRO QG . . 4.930 4.399 4.206 4.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
732 1 46 HIS HD2 1 63 PRO HG3 . . 5.630 4.772 4.534 4.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
733 1 46 HIS HD2 1 64 VAL H . . 4.230 3.504 3.381 3.612 . 0 0 "[ . 1 . 2 . 3 ]" 1
734 1 46 HIS HD2 1 64 VAL MG1 . . 6.600 5.329 5.017 6.000 . 0 0 "[ . 1 . 2 . 3 ]" 1
735 1 46 HIS HD2 1 64 VAL MG2 . . 6.170 4.495 4.168 4.880 . 0 0 "[ . 1 . 2 . 3 ]" 1
736 1 46 HIS HD2 1 85 MET QB . . 6.370 4.037 3.671 4.574 . 0 0 "[ . 1 . 2 . 3 ]" 1
737 1 46 HIS HE1 1 61 MET ME . . 5.100 5.004 2.854 5.164 0.064 31 0 "[ . 1 . 2 . 3 ]" 1
738 1 46 HIS HE1 1 61 MET QG . . 5.810 4.608 4.044 5.839 0.029 23 0 "[ . 1 . 2 . 3 ]" 1
739 1 46 HIS HE1 1 85 MET H . . 5.360 5.072 4.585 5.377 0.017 18 0 "[ . 1 . 2 . 3 ]" 1
740 1 46 HIS HE1 1 85 MET HA . . 4.790 4.874 4.854 4.908 0.118 20 0 "[ . 1 . 2 . 3 ]" 1
741 1 46 HIS HE1 1 85 MET HB2 . . 4.650 2.714 2.222 2.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
742 1 46 HIS HE1 1 85 MET QB . . 4.040 2.551 2.183 2.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
743 1 46 HIS HE1 1 85 MET HB3 . . 4.650 3.147 2.685 3.526 . 0 0 "[ . 1 . 2 . 3 ]" 1
744 1 46 HIS HE1 1 85 MET ME . . 4.760 4.033 3.473 4.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
745 1 46 HIS HE1 1 85 MET QG . . 3.570 2.223 2.027 3.058 . 0 0 "[ . 1 . 2 . 3 ]" 1
746 1 47 GLU H 1 47 GLU QB . . 3.620 2.812 2.618 3.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
747 1 47 GLU H 1 47 GLU QG . . 3.950 2.265 2.077 2.512 . 0 0 "[ . 1 . 2 . 3 ]" 1
748 1 47 GLU H 1 48 THR H . . 4.980 4.497 4.387 4.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
749 1 47 GLU H 1 61 MET HA . . 5.050 4.652 4.347 4.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
750 1 47 GLU H 1 62 ARG H . . 4.110 2.985 2.833 3.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
751 1 47 GLU H 1 63 PRO HA . . 3.840 3.504 3.399 3.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
752 1 47 GLU H 1 64 VAL MG1 . . 5.270 2.973 2.446 3.989 . 0 0 "[ . 1 . 2 . 3 ]" 1
753 1 47 GLU H 1 64 VAL MG2 . . 5.500 3.241 2.499 3.732 . 0 0 "[ . 1 . 2 . 3 ]" 1
754 1 47 GLU H 1 82 TYR QD . . 5.020 4.357 3.934 4.922 . 0 0 "[ . 1 . 2 . 3 ]" 1
755 1 47 GLU H 1 83 HIS HE1 . . 5.420 4.589 4.264 4.996 . 0 0 "[ . 1 . 2 . 3 ]" 1
756 1 47 GLU HA 1 48 THR H . . 3.100 2.422 2.226 2.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
757 1 47 GLU HA 1 48 THR HB . . 4.690 4.605 4.115 4.737 0.047 25 0 "[ . 1 . 2 . 3 ]" 1
758 1 47 GLU HA 1 82 TYR H . . 5.030 4.363 3.922 4.889 . 0 0 "[ . 1 . 2 . 3 ]" 1
759 1 47 GLU HA 1 82 TYR HA . . 3.260 2.113 1.916 2.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
760 1 47 GLU HA 1 82 TYR QB . . 4.840 3.835 3.393 4.100 . 0 0 "[ . 1 . 2 . 3 ]" 1
761 1 47 GLU HA 1 82 TYR QD . . 3.480 2.796 2.382 3.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
762 1 47 GLU HA 1 82 TYR QE . . 4.450 3.834 3.316 4.365 . 0 0 "[ . 1 . 2 . 3 ]" 1
763 1 47 GLU HA 1 83 HIS HE1 . . 5.570 4.581 3.864 5.272 . 0 0 "[ . 1 . 2 . 3 ]" 1
764 1 47 GLU QB 1 48 THR H . . 3.290 2.463 2.102 2.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
765 1 47 GLU QB 1 82 TYR QD . . 3.530 2.889 2.402 3.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
766 1 47 GLU QB 1 82 TYR QE . . 3.220 2.330 2.119 2.703 . 0 0 "[ . 1 . 2 . 3 ]" 1
767 1 47 GLU HB2 1 48 THR H . . 4.170 2.493 2.115 2.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
768 1 47 GLU HB2 1 82 TYR HA . . 4.780 4.149 3.418 4.662 . 0 0 "[ . 1 . 2 . 3 ]" 1
769 1 47 GLU HB2 1 82 TYR QD . . 4.040 3.813 3.222 4.119 0.079 30 0 "[ . 1 . 2 . 3 ]" 1
770 1 47 GLU HB2 1 82 TYR QE . . 3.690 3.349 2.942 3.696 0.006 13 0 "[ . 1 . 2 . 3 ]" 1
771 1 47 GLU HB3 1 48 THR H . . 4.170 3.875 3.627 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
772 1 47 GLU HB3 1 82 TYR HA . . 4.780 4.213 3.643 4.771 . 0 0 "[ . 1 . 2 . 3 ]" 1
773 1 47 GLU HB3 1 82 TYR QD . . 4.040 2.999 2.448 3.482 . 0 0 "[ . 1 . 2 . 3 ]" 1
774 1 47 GLU HB3 1 82 TYR QE . . 3.690 2.380 2.145 2.815 . 0 0 "[ . 1 . 2 . 3 ]" 1
775 1 47 GLU QG 1 48 THR H . . 4.480 3.562 3.034 4.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
776 1 47 GLU QG 1 49 PHE QD . . 4.270 2.953 2.236 4.273 0.003 28 0 "[ . 1 . 2 . 3 ]" 1
777 1 48 THR H 1 48 THR HB . . 3.420 2.766 2.484 3.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
778 1 48 THR H 1 48 THR MG . . 4.400 3.936 3.771 4.037 . 0 0 "[ . 1 . 2 . 3 ]" 1
779 1 48 THR H 1 49 PHE H . . 4.740 4.286 3.920 4.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
780 1 48 THR H 1 49 PHE QD . . 5.610 4.516 3.636 5.415 . 0 0 "[ . 1 . 2 . 3 ]" 1
781 1 48 THR H 1 82 TYR H . . 5.500 4.372 3.937 4.887 . 0 0 "[ . 1 . 2 . 3 ]" 1
782 1 48 THR H 1 82 TYR HA . . 4.200 3.543 3.044 4.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
783 1 48 THR H 1 82 TYR QD . . 4.610 4.551 4.363 4.647 0.037 28 0 "[ . 1 . 2 . 3 ]" 1
784 1 48 THR H 1 82 TYR QE . . 5.150 4.990 4.715 5.178 0.028 27 0 "[ . 1 . 2 . 3 ]" 1
785 1 48 THR HA 1 48 THR MG . . 3.480 2.446 2.297 2.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
786 1 48 THR HA 1 49 PHE H . . 2.950 2.257 2.129 2.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
787 1 48 THR HA 1 49 PHE QD . . 4.060 3.405 2.725 4.069 0.009 15 0 "[ . 1 . 2 . 3 ]" 1
788 1 48 THR HA 1 49 PHE QE . . 5.500 4.777 4.003 5.499 . 0 0 "[ . 1 . 2 . 3 ]" 1
789 1 48 THR HA 1 60 GLY H . . 4.940 4.621 4.385 4.944 0.004 28 0 "[ . 1 . 2 . 3 ]" 1
790 1 48 THR HA 1 61 MET HA . . 3.400 2.266 2.103 2.503 . 0 0 "[ . 1 . 2 . 3 ]" 1
791 1 48 THR HA 1 61 MET HB2 . . 4.520 3.126 3.035 3.542 . 0 0 "[ . 1 . 2 . 3 ]" 1
792 1 48 THR HA 1 61 MET QB . . 3.870 3.004 2.226 3.133 . 0 0 "[ . 1 . 2 . 3 ]" 1
793 1 48 THR HA 1 61 MET HB3 . . 4.520 4.419 2.249 4.603 0.083 19 0 "[ . 1 . 2 . 3 ]" 1
794 1 48 THR HA 1 61 MET ME . . 5.070 4.516 3.962 5.089 0.019 23 0 "[ . 1 . 2 . 3 ]" 1
795 1 48 THR HA 1 62 ARG H . . 5.190 3.835 3.619 4.035 . 0 0 "[ . 1 . 2 . 3 ]" 1
796 1 48 THR HA 1 83 HIS HE1 . . 4.770 3.978 3.453 4.333 . 0 0 "[ . 1 . 2 . 3 ]" 1
797 1 48 THR HB 1 49 PHE H . . 4.760 4.056 3.798 4.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
798 1 48 THR HB 1 61 MET QG . . 5.340 5.267 4.575 5.398 0.058 23 0 "[ . 1 . 2 . 3 ]" 1
799 1 48 THR HB 1 82 TYR H . . 5.050 4.644 3.898 5.089 0.039 21 0 "[ . 1 . 2 . 3 ]" 1
800 1 48 THR HB 1 83 HIS HE1 . . 6.600 4.453 3.815 4.878 . 0 0 "[ . 1 . 2 . 3 ]" 1
801 1 48 THR MG 1 49 PHE H . . 3.610 2.568 2.309 3.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
802 1 48 THR MG 1 49 PHE QD . . 5.610 4.658 4.172 5.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
803 1 48 THR MG 1 49 PHE QE . . 6.600 5.658 5.243 6.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
804 1 48 THR MG 1 59 MET QB . . 4.900 3.239 2.407 4.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
805 1 48 THR MG 1 59 MET QG . . 5.420 4.088 3.483 5.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
806 1 48 THR MG 1 60 GLY H . . 5.060 3.619 3.232 3.967 . 0 0 "[ . 1 . 2 . 3 ]" 1
807 1 48 THR MG 1 61 MET HA . . 5.110 3.822 3.555 4.165 . 0 0 "[ . 1 . 2 . 3 ]" 1
808 1 48 THR MG 1 61 MET ME . . 5.500 3.692 2.855 5.514 0.014 23 0 "[ . 1 . 2 . 3 ]" 1
809 1 48 THR MG 1 61 MET QG . . 4.710 4.165 3.242 4.705 . 0 0 "[ . 1 . 2 . 3 ]" 1
810 1 48 THR MG 1 80 GLY QA . . 3.960 3.268 2.184 3.984 0.024 10 0 "[ . 1 . 2 . 3 ]" 1
811 1 48 THR MG 1 83 HIS HE1 . . 5.350 4.108 3.717 4.455 . 0 0 "[ . 1 . 2 . 3 ]" 1
812 1 49 PHE H 1 49 PHE HB3 . . 3.750 3.294 2.975 3.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
813 1 49 PHE H 1 49 PHE QD . . 3.520 3.002 2.298 3.326 . 0 0 "[ . 1 . 2 . 3 ]" 1
814 1 49 PHE H 1 49 PHE QE . . 4.650 4.413 4.101 4.661 0.011 15 0 "[ . 1 . 2 . 3 ]" 1
815 1 49 PHE H 1 60 GLY H . . 3.770 2.869 2.651 3.182 . 0 0 "[ . 1 . 2 . 3 ]" 1
816 1 49 PHE H 1 61 MET HA . . 3.880 3.431 3.133 3.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
817 1 49 PHE HA 1 49 PHE QD . . 3.990 3.782 3.745 3.814 . 0 0 "[ . 1 . 2 . 3 ]" 1
818 1 49 PHE HA 1 50 MET H . . 2.760 2.449 2.316 2.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
819 1 49 PHE HB2 1 50 MET H . . 3.390 2.160 1.990 2.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
820 1 49 PHE HB3 1 50 MET H . . 3.550 3.592 3.540 3.631 0.081 31 0 "[ . 1 . 2 . 3 ]" 1
821 1 49 PHE QD 1 50 MET H . . 3.810 3.007 2.508 3.384 . 0 0 "[ . 1 . 2 . 3 ]" 1
822 1 49 PHE QD 1 50 MET HA . . 4.970 3.731 2.952 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
823 1 49 PHE QD 1 51 ARG H . . 4.760 4.136 3.468 4.760 . 3 0 "[ . 1 . 2 . 3 ]" 1
824 1 49 PHE QD 1 51 ARG HA . . 5.030 4.219 3.967 4.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
825 1 49 PHE QD 1 51 ARG QB . . 5.490 3.297 2.283 4.744 . 0 0 "[ . 1 . 2 . 3 ]" 1
826 1 49 PHE QD 1 51 ARG QG . . 4.520 3.116 2.401 4.069 . 0 0 "[ . 1 . 2 . 3 ]" 1
827 1 49 PHE QD 1 60 GLY H . . 5.290 3.895 3.116 4.432 . 0 0 "[ . 1 . 2 . 3 ]" 1
828 1 49 PHE QD 1 60 GLY HA3 . . 6.600 3.901 3.641 4.644 . 0 0 "[ . 1 . 2 . 3 ]" 1
829 1 49 PHE QD 1 61 MET H . . 4.830 4.473 4.020 4.850 0.020 13 0 "[ . 1 . 2 . 3 ]" 1
830 1 49 PHE QD 1 61 MET HA . . 3.900 3.153 2.609 3.583 . 0 0 "[ . 1 . 2 . 3 ]" 1
831 1 49 PHE QD 1 62 ARG H . . 4.390 3.829 3.524 4.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
832 1 49 PHE QD 1 62 ARG QB . . 3.920 3.912 3.421 3.979 0.059 17 0 "[ . 1 . 2 . 3 ]" 1
833 1 49 PHE QD 1 62 ARG QD . . 6.090 4.633 3.249 6.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
834 1 49 PHE QD 1 62 ARG QG . . 4.340 3.375 2.307 4.344 0.004 7 0 "[ . 1 . 2 . 3 ]" 1
835 1 49 PHE QE 1 51 ARG H . . 5.180 4.847 3.937 5.195 0.015 21 0 "[ . 1 . 2 . 3 ]" 1
836 1 49 PHE QE 1 51 ARG HA . . 4.670 4.674 4.505 4.729 0.059 18 0 "[ . 1 . 2 . 3 ]" 1
837 1 49 PHE QE 1 51 ARG HB2 . . 5.450 3.245 2.168 4.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
838 1 49 PHE QE 1 51 ARG QB . . 4.580 2.735 2.138 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
839 1 49 PHE QE 1 51 ARG HB3 . . 5.450 3.549 2.277 5.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
840 1 49 PHE QE 1 51 ARG QD . . 4.820 3.144 2.166 4.120 . 0 0 "[ . 1 . 2 . 3 ]" 1
841 1 49 PHE QE 1 51 ARG HG2 . . 4.990 3.138 2.186 3.946 . 0 0 "[ . 1 . 2 . 3 ]" 1
842 1 49 PHE QE 1 51 ARG QG . . 4.240 2.335 1.999 3.230 . 0 0 "[ . 1 . 2 . 3 ]" 1
843 1 49 PHE QE 1 51 ARG HG3 . . 4.990 2.932 2.102 4.669 . 0 0 "[ . 1 . 2 . 3 ]" 1
844 1 49 PHE QE 1 60 GLY H . . 5.980 4.334 3.785 4.840 . 0 0 "[ . 1 . 2 . 3 ]" 1
845 1 49 PHE QE 1 60 GLY HA3 . . 4.610 3.023 2.605 3.666 . 0 0 "[ . 1 . 2 . 3 ]" 1
846 1 49 PHE QE 1 61 MET H . . 4.150 3.248 2.740 3.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
847 1 49 PHE QE 1 61 MET HA . . 4.320 3.334 2.660 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
848 1 49 PHE QE 1 62 ARG H . . 4.400 3.691 3.082 4.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
849 1 49 PHE QE 1 62 ARG QB . . 3.590 2.698 2.235 3.161 . 0 0 "[ . 1 . 2 . 3 ]" 1
850 1 49 PHE QE 1 62 ARG QD . . 4.750 3.477 2.548 4.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
851 1 49 PHE QE 1 62 ARG QG . . 4.470 2.458 2.031 3.402 . 0 0 "[ . 1 . 2 . 3 ]" 1
852 1 49 PHE HZ 1 51 ARG QB . . 6.370 4.843 4.390 5.990 . 0 0 "[ . 1 . 2 . 3 ]" 1
853 1 49 PHE HZ 1 51 ARG QD . . 5.190 4.339 2.871 5.242 0.052 24 0 "[ . 1 . 2 . 3 ]" 1
854 1 49 PHE HZ 1 51 ARG HG2 . . 5.720 5.071 4.014 5.831 0.111 22 0 "[ . 1 . 2 . 3 ]" 1
855 1 49 PHE HZ 1 51 ARG QG . . 5.020 4.086 3.822 4.416 . 0 0 "[ . 1 . 2 . 3 ]" 1
856 1 49 PHE HZ 1 51 ARG HG3 . . 5.720 4.755 3.893 5.774 0.054 17 0 "[ . 1 . 2 . 3 ]" 1
857 1 49 PHE HZ 1 60 GLY HA3 . . 4.530 3.064 2.799 3.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
858 1 49 PHE HZ 1 61 MET H . . 4.920 3.888 3.235 4.924 0.004 3 0 "[ . 1 . 2 . 3 ]" 1
859 1 49 PHE HZ 1 62 ARG QB . . 4.560 4.513 3.841 4.696 0.136 3 0 "[ . 1 . 2 . 3 ]" 1
860 1 49 PHE HZ 1 62 ARG QD . . 6.370 4.153 2.885 6.391 0.021 18 0 "[ . 1 . 2 . 3 ]" 1
861 1 49 PHE HZ 1 62 ARG QG . . 6.370 3.935 2.479 5.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
862 1 50 MET H 1 50 MET HB2 . . 3.720 2.969 2.382 3.792 0.072 22 0 "[ . 1 . 2 . 3 ]" 1
863 1 50 MET H 1 50 MET QB . . 3.180 2.541 2.351 3.011 . 0 0 "[ . 1 . 2 . 3 ]" 1
864 1 50 MET H 1 50 MET HB3 . . 3.720 3.095 2.494 3.757 0.037 11 0 "[ . 1 . 2 . 3 ]" 1
865 1 50 MET H 1 50 MET HG2 . . 4.530 3.834 2.214 4.385 . 0 0 "[ . 1 . 2 . 3 ]" 1
866 1 50 MET H 1 50 MET QG . . 3.890 3.349 2.167 3.974 0.084 12 0 "[ . 1 . 2 . 3 ]" 1
867 1 50 MET H 1 50 MET HG3 . . 4.530 3.869 2.732 4.579 0.049 28 0 "[ . 1 . 2 . 3 ]" 1
868 1 50 MET HA 1 50 MET QG . . 3.420 2.526 2.233 3.470 0.050 22 0 "[ . 1 . 2 . 3 ]" 1
869 1 50 MET HA 1 51 ARG H . . 2.830 2.193 2.095 2.273 . 0 0 "[ . 1 . 2 . 3 ]" 1
870 1 50 MET HA 1 59 MET HA . . 3.390 2.245 2.019 2.497 . 0 0 "[ . 1 . 2 . 3 ]" 1
871 1 50 MET HA 1 59 MET QG . . 3.700 2.620 2.308 2.987 . 0 0 "[ . 1 . 2 . 3 ]" 1
872 1 50 MET HA 1 60 GLY H . . 3.850 3.680 3.181 3.866 0.016 25 0 "[ . 1 . 2 . 3 ]" 1
873 1 50 MET QB 1 51 ARG H . . 3.790 3.210 2.683 3.799 0.009 28 0 "[ . 1 . 2 . 3 ]" 1
874 1 50 MET QG 1 51 ARG H . . 4.010 3.279 2.197 4.022 0.012 8 0 "[ . 1 . 2 . 3 ]" 1
875 1 51 ARG H 1 51 ARG HB2 . . 4.140 3.082 2.275 3.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
876 1 51 ARG H 1 51 ARG QB . . 3.550 2.820 2.246 3.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
877 1 51 ARG H 1 51 ARG HB3 . . 4.140 3.526 3.113 3.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
878 1 51 ARG H 1 51 ARG QD . . 5.500 4.715 4.008 5.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
879 1 51 ARG H 1 51 ARG QG . . 4.300 3.363 2.317 4.372 0.072 25 0 "[ . 1 . 2 . 3 ]" 1
880 1 51 ARG H 1 52 GLU H . . 4.610 4.440 4.338 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
881 1 51 ARG H 1 58 VAL H . . 3.880 3.222 2.988 3.421 . 0 0 "[ . 1 . 2 . 3 ]" 1
882 1 51 ARG H 1 58 VAL QG . . 5.030 3.970 2.766 4.685 . 0 0 "[ . 1 . 2 . 3 ]" 1
883 1 51 ARG H 1 59 MET HA . . 4.250 3.012 2.740 3.194 . 0 0 "[ . 1 . 2 . 3 ]" 1
884 1 51 ARG H 1 59 MET QG . . 4.030 4.011 3.731 4.073 0.043 12 0 "[ . 1 . 2 . 3 ]" 1
885 1 51 ARG HA 1 52 GLU H . . 2.720 2.324 2.227 2.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
886 1 51 ARG QB 1 52 GLU H . . 3.270 2.955 2.455 3.322 0.052 16 0 "[ . 1 . 2 . 3 ]" 1
887 1 51 ARG QD 1 52 GLU H . . 5.350 3.949 2.014 5.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
888 1 51 ARG QD 1 53 VAL QG . . 4.570 3.043 1.998 4.565 . 0 0 "[ . 1 . 2 . 3 ]" 1
889 1 51 ARG QG 1 52 GLU H . . 4.630 3.703 2.589 4.477 . 0 0 "[ . 1 . 2 . 3 ]" 1
890 1 52 GLU H 1 52 GLU QB . . 3.260 2.186 1.965 2.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
891 1 52 GLU H 1 52 GLU HG2 . . 4.330 4.456 3.984 4.550 0.220 15 0 "[ . 1 . 2 . 3 ]" 1
892 1 52 GLU H 1 52 GLU HG3 . . 4.330 4.355 4.261 4.523 0.193 7 0 "[ . 1 . 2 . 3 ]" 1
893 1 52 GLU H 1 53 VAL H . . 5.500 4.442 4.126 4.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
894 1 52 GLU H 1 53 VAL QG . . 4.720 4.301 3.233 4.761 0.041 21 0 "[ . 1 . 2 . 3 ]" 1
895 1 52 GLU HA 1 52 GLU HG2 . . 3.940 3.607 2.269 3.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
896 1 52 GLU HA 1 52 GLU QG . . 3.430 2.589 2.244 2.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
897 1 52 GLU HA 1 52 GLU HG3 . . 3.940 2.726 2.296 3.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
898 1 52 GLU HA 1 53 VAL H . . 2.510 2.247 2.156 2.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
899 1 52 GLU HA 1 53 VAL QG . . 4.370 3.791 3.179 4.098 . 0 0 "[ . 1 . 2 . 3 ]" 1
900 1 52 GLU HA 1 55 GLY H . . 5.410 4.886 4.214 5.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
901 1 52 GLU HA 1 56 LYS H . . 4.080 4.023 3.782 4.133 0.053 9 0 "[ . 1 . 2 . 3 ]" 1
902 1 52 GLU HA 1 57 LYS H . . 5.410 4.409 3.842 4.876 . 0 0 "[ . 1 . 2 . 3 ]" 1
903 1 52 GLU HA 1 57 LYS HA . . 2.920 2.449 2.110 2.935 0.015 7 0 "[ . 1 . 2 . 3 ]" 1
904 1 52 GLU HA 1 58 VAL H . . 4.120 3.325 3.114 3.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
905 1 52 GLU QB 1 53 VAL H . . 4.050 3.683 3.145 3.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
906 1 52 GLU QG 1 53 VAL H . . 4.440 2.751 2.214 3.462 . 0 0 "[ . 1 . 2 . 3 ]" 1
907 1 52 GLU QG 1 55 GLY H . . 3.990 2.607 1.992 3.775 . 0 0 "[ . 1 . 2 . 3 ]" 1
908 1 52 GLU QG 1 55 GLY QA . . 3.950 2.732 2.067 3.831 . 0 0 "[ . 1 . 2 . 3 ]" 1
909 1 52 GLU HG2 1 56 LYS H . . 4.370 4.352 3.681 4.499 0.129 21 0 "[ . 1 . 2 . 3 ]" 1
910 1 52 GLU HG3 1 56 LYS H . . 4.370 2.986 2.723 4.456 0.086 7 0 "[ . 1 . 2 . 3 ]" 1
911 1 53 VAL H 1 53 VAL HB . . 3.870 3.214 2.397 3.946 0.076 7 0 "[ . 1 . 2 . 3 ]" 1
912 1 53 VAL H 1 53 VAL QG . . 3.460 2.742 2.151 3.080 . 0 0 "[ . 1 . 2 . 3 ]" 1
913 1 53 VAL H 1 54 GLU H . . 5.030 3.865 1.793 4.304 . 0 0 "[ . 1 . 2 . 3 ]" 1
914 1 53 VAL H 1 55 GLY H . . 3.930 3.739 3.406 3.986 0.056 15 0 "[ . 1 . 2 . 3 ]" 1
915 1 53 VAL H 1 56 LYS H . . 3.490 2.770 2.515 3.404 . 0 0 "[ . 1 . 2 . 3 ]" 1
916 1 53 VAL H 1 56 LYS QB . . 4.630 3.610 3.033 4.538 . 0 0 "[ . 1 . 2 . 3 ]" 1
917 1 53 VAL HA 1 53 VAL MG1 . . 3.550 2.537 2.289 3.285 . 0 0 "[ . 1 . 2 . 3 ]" 1
918 1 53 VAL HA 1 53 VAL QG . . 3.040 2.230 2.127 2.394 . 0 0 "[ . 1 . 2 . 3 ]" 1
919 1 53 VAL HA 1 53 VAL MG2 . . 3.550 2.667 2.299 3.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
920 1 53 VAL HA 1 54 GLU H . . 3.060 2.368 2.116 3.245 0.185 8 0 "[ . 1 . 2 . 3 ]" 1
921 1 53 VAL HB 1 54 GLU H . . 4.380 4.027 1.810 4.439 0.059 15 0 "[ . 1 . 2 . 3 ]" 1
922 1 53 VAL QG 1 54 GLU H . . 4.200 2.870 2.000 3.584 . 0 0 "[ . 1 . 2 . 3 ]" 1
923 1 53 VAL QG 1 54 GLU HA . . 5.410 4.150 3.533 4.923 . 0 0 "[ . 1 . 2 . 3 ]" 1
924 1 53 VAL QG 1 54 GLU QG . . 4.170 3.058 2.086 4.173 0.003 3 0 "[ . 1 . 2 . 3 ]" 1
925 1 53 VAL QG 1 56 LYS H . . 4.640 4.194 3.745 4.620 . 0 0 "[ . 1 . 2 . 3 ]" 1
926 1 53 VAL MG1 1 54 GLU H . . 4.890 3.345 2.012 4.481 . 0 0 "[ . 1 . 2 . 3 ]" 1
927 1 53 VAL MG2 1 54 GLU H . . 4.890 3.758 2.320 4.334 . 0 0 "[ . 1 . 2 . 3 ]" 1
928 1 54 GLU H 1 54 GLU QB . . 3.490 3.161 2.003 3.491 0.001 27 0 "[ . 1 . 2 . 3 ]" 1
929 1 54 GLU H 1 54 GLU HG2 . . 4.960 4.034 2.826 4.799 . 0 0 "[ . 1 . 2 . 3 ]" 1
930 1 54 GLU H 1 54 GLU QG . . 4.230 3.366 2.713 4.281 0.051 8 0 "[ . 1 . 2 . 3 ]" 1
931 1 54 GLU H 1 54 GLU HG3 . . 4.960 3.755 2.748 4.981 0.021 3 0 "[ . 1 . 2 . 3 ]" 1
932 1 54 GLU H 1 55 GLY H . . 4.230 2.807 1.934 3.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
933 1 54 GLU H 1 56 LYS H . . 5.290 3.988 2.521 4.382 . 0 0 "[ . 1 . 2 . 3 ]" 1
934 1 54 GLU HA 1 54 GLU QB . . 2.600 2.381 2.259 2.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
935 1 54 GLU HA 1 54 GLU HG2 . . 3.860 2.868 2.251 3.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
936 1 54 GLU HA 1 54 GLU QG . . 3.360 2.616 2.167 3.301 . 0 0 "[ . 1 . 2 . 3 ]" 1
937 1 54 GLU HA 1 54 GLU HG3 . . 3.860 3.104 2.566 3.848 . 0 0 "[ . 1 . 2 . 3 ]" 1
938 1 54 GLU HA 1 55 GLY H . . 3.060 3.012 2.743 3.123 0.063 12 0 "[ . 1 . 2 . 3 ]" 1
939 1 54 GLU HA 1 56 LYS H . . 5.120 4.457 3.951 4.676 . 0 0 "[ . 1 . 2 . 3 ]" 1
940 1 54 GLU QB 1 55 GLY H . . 4.480 3.793 3.602 3.975 . 0 0 "[ . 1 . 2 . 3 ]" 1
941 1 54 GLU QB 1 56 LYS H . . 3.570 3.475 2.594 3.711 0.141 15 0 "[ . 1 . 2 . 3 ]" 1
942 1 55 GLY H 1 56 LYS H . . 3.210 2.510 2.261 2.788 . 0 0 "[ . 1 . 2 . 3 ]" 1
943 1 55 GLY QA 1 56 LYS QG . . 4.830 3.753 3.381 4.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
944 1 56 LYS H 1 56 LYS HB2 . . 3.950 2.719 2.398 3.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
945 1 56 LYS H 1 56 LYS HB3 . . 3.950 3.790 3.594 3.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
946 1 56 LYS H 1 56 LYS QE . . 5.180 4.378 3.524 5.201 0.021 3 0 "[ . 1 . 2 . 3 ]" 1
947 1 56 LYS H 1 56 LYS QG . . 3.500 2.838 2.201 3.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
948 1 56 LYS H 1 57 LYS H . . 4.090 4.109 3.450 4.230 0.140 3 0 "[ . 1 . 2 . 3 ]" 1
949 1 56 LYS HA 1 56 LYS QB . . 2.500 2.341 2.209 2.463 . 0 0 "[ . 1 . 2 . 3 ]" 1
950 1 56 LYS HA 1 56 LYS QG . . 3.200 2.724 2.289 3.270 0.070 5 0 "[ . 1 . 2 . 3 ]" 1
951 1 56 LYS HA 1 57 LYS H . . 2.480 2.122 1.947 2.508 0.028 19 0 "[ . 1 . 2 . 3 ]" 1
952 1 57 LYS H 1 57 LYS QB . . 2.710 2.548 2.147 2.820 0.110 29 0 "[ . 1 . 2 . 3 ]" 1
953 1 57 LYS H 1 57 LYS QD . . 4.070 3.197 1.604 4.112 0.042 2 0 "[ . 1 . 2 . 3 ]" 1
954 1 57 LYS H 1 57 LYS QE . . 4.870 3.590 1.795 4.881 0.011 28 0 "[ . 1 . 2 . 3 ]" 1
955 1 57 LYS H 1 57 LYS HG2 . . 3.970 2.820 1.696 4.037 0.067 20 0 "[ . 1 . 2 . 3 ]" 1
956 1 57 LYS H 1 57 LYS HG3 . . 3.970 3.092 2.129 4.018 0.048 21 0 "[ . 1 . 2 . 3 ]" 1
957 1 57 LYS H 1 58 VAL H . . 4.420 4.469 4.442 4.510 0.090 15 0 "[ . 1 . 2 . 3 ]" 1
958 1 57 LYS H 1 58 VAL QG . . 5.440 4.322 3.778 5.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
959 1 57 LYS HA 1 58 VAL H . . 2.560 2.083 2.011 2.188 . 0 0 "[ . 1 . 2 . 3 ]" 1
960 1 57 LYS QB 1 58 VAL H . . 3.560 3.237 2.810 3.456 . 0 0 "[ . 1 . 2 . 3 ]" 1
961 1 57 LYS HB2 1 58 VAL H . . 4.280 3.825 2.919 4.359 0.079 21 0 "[ . 1 . 2 . 3 ]" 1
962 1 57 LYS HB3 1 58 VAL H . . 4.280 3.700 3.190 4.282 0.002 12 0 "[ . 1 . 2 . 3 ]" 1
963 1 57 LYS QG 1 58 VAL H . . 5.070 4.372 3.784 5.028 . 0 0 "[ . 1 . 2 . 3 ]" 1
964 1 58 VAL H 1 58 VAL HB . . 3.640 3.171 2.500 3.763 0.123 21 0 "[ . 1 . 2 . 3 ]" 1
965 1 58 VAL H 1 58 VAL QG . . 3.450 2.581 2.099 3.008 . 0 0 "[ . 1 . 2 . 3 ]" 1
966 1 58 VAL H 1 59 MET H . . 4.390 4.388 4.298 4.434 0.044 26 0 "[ . 1 . 2 . 3 ]" 1
967 1 58 VAL H 1 59 MET QG . . 5.500 5.041 4.748 5.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
968 1 58 VAL HA 1 58 VAL MG1 . . 3.480 2.638 2.316 3.286 . 0 0 "[ . 1 . 2 . 3 ]" 1
969 1 58 VAL HA 1 58 VAL MG2 . . 3.480 2.661 2.281 3.289 . 0 0 "[ . 1 . 2 . 3 ]" 1
970 1 58 VAL HA 1 59 MET H . . 2.750 2.401 2.145 2.694 . 0 0 "[ . 1 . 2 . 3 ]" 1
971 1 58 VAL HA 1 59 MET QG . . 4.410 4.062 3.682 4.447 0.037 18 0 "[ . 1 . 2 . 3 ]" 1
972 1 58 VAL QG 1 59 MET H . . 4.190 2.503 1.771 3.025 . 0 0 "[ . 1 . 2 . 3 ]" 1
973 1 58 VAL QG 1 60 GLY H . . 5.440 4.937 4.283 5.250 . 0 0 "[ . 1 . 2 . 3 ]" 1
974 1 58 VAL MG1 1 59 MET H . . 5.530 3.045 2.110 3.979 . 0 0 "[ . 1 . 2 . 3 ]" 1
975 1 58 VAL MG2 1 59 MET H . . 5.530 3.277 1.785 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
976 1 59 MET H 1 59 MET HB2 . . 4.090 2.498 2.362 2.702 . 0 0 "[ . 1 . 2 . 3 ]" 1
977 1 59 MET H 1 59 MET QB . . 3.430 2.461 2.332 2.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
978 1 59 MET H 1 59 MET HB3 . . 4.090 3.708 3.616 3.828 . 0 0 "[ . 1 . 2 . 3 ]" 1
979 1 59 MET H 1 60 GLY H . . 4.590 4.548 4.424 4.601 0.011 13 0 "[ . 1 . 2 . 3 ]" 1
980 1 59 MET HA 1 59 MET QB . . 2.570 2.380 2.337 2.430 . 0 0 "[ . 1 . 2 . 3 ]" 1
981 1 59 MET HA 1 59 MET QG . . 3.460 2.260 2.157 2.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
982 1 59 MET HA 1 60 GLY H . . 2.930 2.374 2.257 2.480 . 0 0 "[ . 1 . 2 . 3 ]" 1
983 1 59 MET QB 1 60 GLY H . . 4.190 2.218 2.126 2.329 . 0 0 "[ . 1 . 2 . 3 ]" 1
984 1 59 MET QB 1 60 GLY HA3 . . 4.410 4.455 4.415 4.494 0.084 20 0 "[ . 1 . 2 . 3 ]" 1
985 1 59 MET HB2 1 60 GLY H . . 4.850 3.585 3.461 3.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
986 1 59 MET HB3 1 60 GLY H . . 4.850 2.239 2.145 2.357 . 0 0 "[ . 1 . 2 . 3 ]" 1
987 1 59 MET QG 1 60 GLY H . . 4.950 3.577 3.251 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
988 1 60 GLY HA3 1 61 MET H . . 3.180 2.614 2.478 2.770 . 0 0 "[ . 1 . 2 . 3 ]" 1
989 1 60 GLY HA3 1 61 MET HA . . 4.690 4.429 4.161 4.531 . 0 0 "[ . 1 . 2 . 3 ]" 1
990 1 61 MET H 1 61 MET QB . . 3.610 2.654 2.512 3.394 . 0 0 "[ . 1 . 2 . 3 ]" 1
991 1 61 MET H 1 61 MET ME . . 4.530 4.462 3.024 4.576 0.046 27 0 "[ . 1 . 2 . 3 ]" 1
992 1 61 MET H 1 61 MET HG2 . . 4.870 4.252 4.024 4.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
993 1 61 MET H 1 61 MET QG . . 4.020 3.912 2.551 4.077 0.057 13 0 "[ . 1 . 2 . 3 ]" 1
994 1 61 MET H 1 61 MET HG3 . . 4.870 4.712 2.580 4.884 0.014 26 0 "[ . 1 . 2 . 3 ]" 1
995 1 61 MET HA 1 61 MET ME . . 4.550 4.149 3.684 4.428 . 0 0 "[ . 1 . 2 . 3 ]" 1
996 1 61 MET HA 1 62 ARG H . . 3.160 2.219 2.015 2.378 . 0 0 "[ . 1 . 2 . 3 ]" 1
997 1 61 MET HA 1 62 ARG QB . . 5.390 4.154 3.840 4.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
998 1 61 MET HA 1 62 ARG HG2 . . 5.300 4.460 3.496 5.410 0.110 20 0 "[ . 1 . 2 . 3 ]" 1
999 1 61 MET HA 1 62 ARG QG . . 4.630 3.891 3.408 4.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
1000 1 61 MET HA 1 62 ARG HG3 . . 5.300 4.805 3.844 5.333 0.033 3 0 "[ . 1 . 2 . 3 ]" 1
1001 1 61 MET HA 1 83 HIS HE1 . . 4.800 4.310 4.045 4.654 . 0 0 "[ . 1 . 2 . 3 ]" 1
1002 1 61 MET QB 1 61 MET ME . . 3.860 2.050 1.980 2.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1003 1 61 MET QB 1 62 ARG H . . 3.620 3.536 2.384 3.666 0.046 21 0 "[ . 1 . 2 . 3 ]" 1
1004 1 61 MET QB 1 83 HIS HE1 . . 3.880 3.361 2.017 3.897 0.017 13 0 "[ . 1 . 2 . 3 ]" 1
1005 1 61 MET HB2 1 62 ARG H . . 4.320 3.895 2.432 4.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
1006 1 61 MET HB3 1 62 ARG H . . 4.320 4.087 3.432 4.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
1007 1 61 MET ME 1 83 HIS HD2 . . 5.560 5.042 4.664 5.601 0.041 28 0 "[ . 1 . 2 . 3 ]" 1
1008 1 61 MET ME 1 83 HIS HE1 . . 3.810 3.035 2.460 3.832 0.022 23 0 "[ . 1 . 2 . 3 ]" 1
1009 1 61 MET QG 1 62 ARG H . . 5.270 2.622 2.372 4.447 . 0 0 "[ . 1 . 2 . 3 ]" 1
1010 1 61 MET QG 1 83 HIS HE1 . . 4.310 2.139 1.905 3.041 . 0 0 "[ . 1 . 2 . 3 ]" 1
1011 1 62 ARG H 1 62 ARG QB . . 3.580 2.925 2.414 3.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
1012 1 62 ARG H 1 62 ARG HE . . 5.500 4.719 3.913 5.516 0.016 12 0 "[ . 1 . 2 . 3 ]" 1
1013 1 62 ARG H 1 62 ARG HG2 . . 4.400 3.511 2.455 4.422 0.022 20 0 "[ . 1 . 2 . 3 ]" 1
1014 1 62 ARG H 1 62 ARG HG3 . . 4.400 3.651 2.798 4.435 0.035 5 0 "[ . 1 . 2 . 3 ]" 1
1015 1 62 ARG H 1 63 PRO QD . . 5.500 4.392 4.338 4.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
1016 1 62 ARG H 1 83 HIS HE1 . . 5.210 4.549 4.053 4.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1017 1 63 PRO HA 1 64 VAL H . . 3.080 2.287 2.253 2.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
1018 1 63 PRO HA 1 64 VAL HA . . 5.100 4.518 4.442 4.563 . 0 0 "[ . 1 . 2 . 3 ]" 1
1019 1 63 PRO HA 1 64 VAL MG1 . . 5.500 3.769 3.491 4.406 . 0 0 "[ . 1 . 2 . 3 ]" 1
1020 1 63 PRO HA 1 64 VAL MG2 . . 5.070 3.580 3.104 4.048 . 0 0 "[ . 1 . 2 . 3 ]" 1
1021 1 63 PRO HB2 1 64 VAL H . . 4.060 2.909 2.761 3.094 . 0 0 "[ . 1 . 2 . 3 ]" 1
1022 1 63 PRO HB3 1 64 VAL H . . 4.490 3.723 3.609 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
1023 1 64 VAL H 1 64 VAL MG1 . . 4.390 3.239 2.998 3.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
1024 1 64 VAL H 1 64 VAL MG2 . . 4.020 2.401 2.291 2.479 . 0 0 "[ . 1 . 2 . 3 ]" 1
1025 1 64 VAL HA 1 64 VAL HB . . 2.940 2.501 2.426 2.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1026 1 64 VAL HA 1 64 VAL MG1 . . 3.420 2.306 2.184 2.375 . 0 0 "[ . 1 . 2 . 3 ]" 1
1027 1 64 VAL HA 1 65 PRO QD . . 2.950 2.165 2.114 2.235 . 0 0 "[ . 1 . 2 . 3 ]" 1
1028 1 64 VAL HA 1 66 PHE H . . 5.500 4.433 4.243 4.553 . 0 0 "[ . 1 . 2 . 3 ]" 1
1029 1 64 VAL HB 1 65 PRO QD . . 3.300 2.073 1.998 2.215 . 0 0 "[ . 1 . 2 . 3 ]" 1
1030 1 64 VAL HB 1 66 PHE H . . 3.380 3.165 2.864 3.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
1031 1 64 VAL HB 1 82 TYR QE . . 4.250 3.859 3.474 4.250 0.000 30 0 "[ . 1 . 2 . 3 ]" 1
1032 1 64 VAL MG1 1 65 PRO QD . . 4.050 3.036 2.372 3.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
1033 1 64 VAL MG1 1 66 PHE H . . 4.770 4.662 4.296 4.791 0.021 25 0 "[ . 1 . 2 . 3 ]" 1
1034 1 64 VAL MG1 1 82 TYR QD . . 5.320 3.852 3.369 4.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
1035 1 64 VAL MG1 1 82 TYR QE . . 3.960 2.512 2.098 3.217 . 0 0 "[ . 1 . 2 . 3 ]" 1
1036 1 64 VAL MG2 1 65 PRO HA . . 5.500 4.720 4.517 5.197 . 0 0 "[ . 1 . 2 . 3 ]" 1
1037 1 64 VAL MG2 1 65 PRO HD2 . . 5.430 3.585 3.357 3.951 . 0 0 "[ . 1 . 2 . 3 ]" 1
1038 1 64 VAL MG2 1 65 PRO QD . . 4.700 3.429 3.233 3.715 . 0 0 "[ . 1 . 2 . 3 ]" 1
1039 1 64 VAL MG2 1 65 PRO HD3 . . 5.430 4.375 4.212 4.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
1040 1 64 VAL MG2 1 66 PHE H . . 4.390 3.249 2.783 4.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1041 1 64 VAL MG2 1 82 TYR QD . . 4.570 2.634 2.381 2.944 . 0 0 "[ . 1 . 2 . 3 ]" 1
1042 1 64 VAL MG2 1 82 TYR QE . . 4.130 2.403 2.190 2.776 . 0 0 "[ . 1 . 2 . 3 ]" 1
1043 1 65 PRO HA 1 66 PHE QD . . 4.260 4.293 4.275 4.305 0.045 7 0 "[ . 1 . 2 . 3 ]" 1
1044 1 65 PRO QB 1 66 PHE H . . 3.870 3.480 3.399 3.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
1045 1 65 PRO QB 1 66 PHE QD . . 3.070 2.328 2.264 2.403 . 0 0 "[ . 1 . 2 . 3 ]" 1
1046 1 65 PRO QB 1 66 PHE QE . . 3.660 3.487 3.329 3.665 0.005 21 0 "[ . 1 . 2 . 3 ]" 1
1047 1 65 PRO HB2 1 66 PHE H . . 4.660 3.685 3.585 3.794 . 0 0 "[ . 1 . 2 . 3 ]" 1
1048 1 65 PRO HB3 1 66 PHE H . . 4.660 4.276 4.218 4.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
1049 1 65 PRO QD 1 66 PHE QD . . 4.910 4.414 4.190 4.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
1050 1 65 PRO QD 1 66 PHE QE . . 6.370 4.800 4.486 4.955 . 0 0 "[ . 1 . 2 . 3 ]" 1
1051 1 65 PRO HD2 1 66 PHE H . . 3.730 2.505 2.466 2.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
1052 1 65 PRO HD3 1 66 PHE H . . 3.730 3.772 3.762 3.784 0.054 20 0 "[ . 1 . 2 . 3 ]" 1
1053 1 65 PRO QG 1 66 PHE H . . 3.720 2.518 2.406 2.726 . 0 0 "[ . 1 . 2 . 3 ]" 1
1054 1 65 PRO QG 1 66 PHE QD . . 4.050 2.701 2.465 2.997 . 0 0 "[ . 1 . 2 . 3 ]" 1
1055 1 65 PRO QG 1 66 PHE QE . . 4.690 2.970 2.678 3.145 . 0 0 "[ . 1 . 2 . 3 ]" 1
1056 1 66 PHE H 1 66 PHE QB . . 3.670 3.399 3.378 3.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
1057 1 66 PHE H 1 66 PHE QD . . 4.200 3.437 3.280 3.518 . 0 0 "[ . 1 . 2 . 3 ]" 1
1058 1 66 PHE H 1 66 PHE QE . . 5.060 4.742 4.575 4.810 . 0 0 "[ . 1 . 2 . 3 ]" 1
1059 1 66 PHE H 1 67 LEU H . . 4.410 4.313 4.278 4.340 . 0 0 "[ . 1 . 2 . 3 ]" 1
1060 1 66 PHE H 1 67 LEU HA . . 5.190 4.773 4.686 4.841 . 0 0 "[ . 1 . 2 . 3 ]" 1
1061 1 66 PHE H 1 67 LEU MD2 . . 5.500 4.096 3.935 4.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
1062 1 66 PHE HA 1 66 PHE QD . . 3.990 3.728 3.687 3.765 . 0 0 "[ . 1 . 2 . 3 ]" 1
1063 1 66 PHE HA 1 66 PHE QE . . 5.700 5.633 5.587 5.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
1064 1 66 PHE HA 1 67 LEU H . . 3.000 2.368 2.286 2.447 . 0 0 "[ . 1 . 2 . 3 ]" 1
1065 1 66 PHE QB 1 67 LEU H . . 3.220 2.299 2.208 2.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
1066 1 66 PHE QB 1 67 LEU HA . . 4.590 4.271 4.195 4.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
1067 1 66 PHE HB2 1 67 LEU H . . 3.680 2.322 2.227 2.398 . 0 0 "[ . 1 . 2 . 3 ]" 1
1068 1 66 PHE HB3 1 67 LEU H . . 3.680 3.695 3.647 3.721 0.041 7 0 "[ . 1 . 2 . 3 ]" 1
1069 1 66 PHE QD 1 67 LEU H . . 3.920 3.135 2.995 3.291 . 0 0 "[ . 1 . 2 . 3 ]" 1
1070 1 66 PHE QD 1 67 LEU HA . . 4.210 3.254 3.131 3.448 . 0 0 "[ . 1 . 2 . 3 ]" 1
1071 1 66 PHE QD 1 67 LEU QB . . 5.270 4.369 4.323 4.452 . 0 0 "[ . 1 . 2 . 3 ]" 1
1072 1 66 PHE QD 1 67 LEU MD1 . . 6.320 5.994 5.926 6.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
1073 1 66 PHE QD 1 67 LEU MD2 . . 5.810 4.687 4.551 4.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
1074 1 66 PHE QD 1 68 GLU H . . 3.980 3.890 3.590 4.002 0.022 14 0 "[ . 1 . 2 . 3 ]" 1
1075 1 66 PHE QD 1 68 GLU HA . . 4.720 3.799 3.596 4.022 . 0 0 "[ . 1 . 2 . 3 ]" 1
1076 1 66 PHE QD 1 68 GLU QB . . 3.660 3.279 2.712 3.552 . 0 0 "[ . 1 . 2 . 3 ]" 1
1077 1 66 PHE QD 1 68 GLU QG . . 5.340 5.237 4.872 5.363 0.023 13 0 "[ . 1 . 2 . 3 ]" 1
1078 1 66 PHE QE 1 67 LEU HA . . 4.450 4.475 4.454 4.492 0.042 27 0 "[ . 1 . 2 . 3 ]" 1
1079 1 66 PHE QE 1 68 GLU H . . 4.500 4.509 4.269 4.539 0.039 7 0 "[ . 1 . 2 . 3 ]" 1
1080 1 66 PHE QE 1 68 GLU HA . . 6.070 4.542 4.185 4.977 . 0 0 "[ . 1 . 2 . 3 ]" 1
1081 1 66 PHE QE 1 68 GLU QB . . 3.530 2.662 2.311 3.112 . 0 0 "[ . 1 . 2 . 3 ]" 1
1082 1 67 LEU H 1 67 LEU HB2 . . 4.080 2.695 2.585 2.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
1083 1 67 LEU H 1 67 LEU QB . . 3.300 2.642 2.542 2.734 . 0 0 "[ . 1 . 2 . 3 ]" 1
1084 1 67 LEU H 1 67 LEU HB3 . . 4.080 3.807 3.752 3.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
1085 1 67 LEU H 1 67 LEU MD1 . . 5.140 4.181 4.080 4.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
1086 1 67 LEU H 1 67 LEU MD2 . . 5.080 3.501 3.346 3.671 . 0 0 "[ . 1 . 2 . 3 ]" 1
1087 1 67 LEU H 1 67 LEU HG . . 4.630 2.926 2.777 3.093 . 0 0 "[ . 1 . 2 . 3 ]" 1
1088 1 67 LEU HA 1 67 LEU MD1 . . 4.080 3.863 3.779 3.908 . 0 0 "[ . 1 . 2 . 3 ]" 1
1089 1 67 LEU HA 1 67 LEU MD2 . . 3.660 2.306 2.226 2.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
1090 1 67 LEU HA 1 68 GLU H . . 2.710 2.321 2.245 2.431 . 0 0 "[ . 1 . 2 . 3 ]" 1
1091 1 67 LEU HA 1 68 GLU QB . . 4.300 3.991 3.891 4.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
1092 1 67 LEU HA 1 82 TYR QE . . 5.520 5.405 5.081 5.541 0.021 24 0 "[ . 1 . 2 . 3 ]" 1
1093 1 67 LEU QB 1 77 LEU MD1 . . 4.230 4.038 3.836 4.254 0.024 3 0 "[ . 1 . 2 . 3 ]" 1
1094 1 67 LEU HB2 1 68 GLU H . . 3.990 3.608 3.445 3.867 . 0 0 "[ . 1 . 2 . 3 ]" 1
1095 1 67 LEU HB3 1 68 GLU H . . 3.990 2.594 2.511 2.759 . 0 0 "[ . 1 . 2 . 3 ]" 1
1096 1 67 LEU MD1 1 68 GLU H . . 4.400 4.430 4.405 4.454 0.054 15 0 "[ . 1 . 2 . 3 ]" 1
1097 1 67 LEU MD1 1 77 LEU HG . . 5.500 2.308 2.047 2.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1098 1 67 LEU MD1 1 82 TYR QB . . 4.360 2.662 2.158 3.258 . 0 0 "[ . 1 . 2 . 3 ]" 1
1099 1 67 LEU MD1 1 82 TYR QD . . 4.420 3.568 3.184 3.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
1100 1 67 LEU MD1 1 82 TYR QE . . 4.710 4.621 4.152 4.735 0.025 21 0 "[ . 1 . 2 . 3 ]" 1
1101 1 67 LEU MD1 1 84 PHE QD . . 5.400 5.367 5.037 5.442 0.042 22 0 "[ . 1 . 2 . 3 ]" 1
1102 1 67 LEU MD1 1 84 PHE QE . . 6.350 4.349 3.912 4.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
1103 1 67 LEU MD1 1 84 PHE HZ . . 5.950 4.602 3.869 5.103 . 0 0 "[ . 1 . 2 . 3 ]" 1
1104 1 67 LEU MD2 1 68 GLU H . . 4.480 3.824 3.689 3.937 . 0 0 "[ . 1 . 2 . 3 ]" 1
1105 1 67 LEU MD2 1 77 LEU MD1 . . 4.850 4.332 3.819 4.711 . 0 0 "[ . 1 . 2 . 3 ]" 1
1106 1 67 LEU MD2 1 82 TYR H . . 6.530 5.645 4.906 6.538 0.008 20 0 "[ . 1 . 2 . 3 ]" 1
1107 1 67 LEU MD2 1 82 TYR HA . . 6.470 4.572 3.874 5.133 . 0 0 "[ . 1 . 2 . 3 ]" 1
1108 1 67 LEU MD2 1 82 TYR HB2 . . 4.810 3.864 3.321 4.504 . 0 0 "[ . 1 . 2 . 3 ]" 1
1109 1 67 LEU MD2 1 82 TYR HB3 . . 4.810 2.972 2.341 3.635 . 0 0 "[ . 1 . 2 . 3 ]" 1
1110 1 67 LEU MD2 1 82 TYR QD . . 4.150 2.478 2.181 2.966 . 0 0 "[ . 1 . 2 . 3 ]" 1
1111 1 67 LEU MD2 1 82 TYR QE . . 4.300 2.997 2.627 3.253 . 0 0 "[ . 1 . 2 . 3 ]" 1
1112 1 67 LEU MD2 1 83 HIS H . . 5.470 4.821 4.185 5.310 . 0 0 "[ . 1 . 2 . 3 ]" 1
1113 1 67 LEU MD2 1 84 PHE QD . . 6.600 6.482 6.287 6.605 0.005 29 0 "[ . 1 . 2 . 3 ]" 1
1114 1 67 LEU MD2 1 84 PHE QE . . 6.600 5.750 5.505 6.066 . 0 0 "[ . 1 . 2 . 3 ]" 1
1115 1 67 LEU MD2 1 84 PHE HZ . . 6.600 6.042 5.541 6.603 0.003 14 0 "[ . 1 . 2 . 3 ]" 1
1116 1 67 LEU HG 1 68 GLU H . . 6.350 5.109 5.028 5.181 . 0 0 "[ . 1 . 2 . 3 ]" 1
1117 1 67 LEU HG 1 82 TYR QD . . 6.530 4.776 4.462 5.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
1118 1 68 GLU H 1 68 GLU HB2 . . 3.410 3.089 2.836 3.444 0.034 31 0 "[ . 1 . 2 . 3 ]" 1
1119 1 68 GLU H 1 68 GLU QB . . 2.700 2.502 2.386 2.696 . 0 0 "[ . 1 . 2 . 3 ]" 1
1120 1 68 GLU H 1 68 GLU HB3 . . 3.410 2.647 2.524 2.844 . 0 0 "[ . 1 . 2 . 3 ]" 1
1121 1 68 GLU H 1 68 GLU HG2 . . 4.990 4.722 4.379 4.897 . 0 0 "[ . 1 . 2 . 3 ]" 1
1122 1 68 GLU H 1 68 GLU QG . . 4.350 4.099 4.011 4.147 . 0 0 "[ . 1 . 2 . 3 ]" 1
1123 1 68 GLU H 1 68 GLU HG3 . . 4.990 4.511 4.354 4.668 . 0 0 "[ . 1 . 2 . 3 ]" 1
1124 1 68 GLU H 1 69 VAL H . . 4.650 4.429 4.315 4.547 . 0 0 "[ . 1 . 2 . 3 ]" 1
1125 1 68 GLU HA 1 68 GLU HG2 . . 4.220 3.739 3.404 3.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
1126 1 68 GLU HA 1 68 GLU HG3 . . 4.220 2.812 2.391 3.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
1127 1 68 GLU HA 1 69 VAL H . . 2.980 2.253 2.160 2.335 . 0 0 "[ . 1 . 2 . 3 ]" 1
1128 1 68 GLU HB2 1 69 VAL H . . 4.550 4.151 3.829 4.306 . 0 0 "[ . 1 . 2 . 3 ]" 1
1129 1 68 GLU HB3 1 69 VAL H . . 4.550 4.019 3.833 4.154 . 0 0 "[ . 1 . 2 . 3 ]" 1
1130 1 68 GLU QG 1 69 VAL H . . 3.830 2.400 1.953 2.787 . 0 0 "[ . 1 . 2 . 3 ]" 1
1131 1 68 GLU QG 1 69 VAL HA . . 3.300 3.391 3.343 3.519 0.219 20 0 "[ . 1 . 2 . 3 ]" 1
1132 1 68 GLU HG2 1 69 VAL H . . 4.370 3.922 2.823 4.370 0.000 12 0 "[ . 1 . 2 . 3 ]" 1
1133 1 68 GLU HG3 1 69 VAL H . . 4.370 2.423 1.991 2.820 . 0 0 "[ . 1 . 2 . 3 ]" 1
1134 1 69 VAL H 1 69 VAL HB . . 3.490 2.965 2.668 3.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
1135 1 69 VAL H 1 69 VAL MG2 . . 3.670 3.025 2.751 3.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
1136 1 69 VAL H 1 70 PRO HD2 . . 5.780 4.858 4.723 4.976 . 0 0 "[ . 1 . 2 . 3 ]" 1
1137 1 69 VAL H 1 70 PRO QD . . 5.070 4.191 3.900 4.299 . 0 0 "[ . 1 . 2 . 3 ]" 1
1138 1 69 VAL H 1 70 PRO HD3 . . 5.780 4.582 4.155 4.785 . 0 0 "[ . 1 . 2 . 3 ]" 1
1139 1 69 VAL HA 1 69 VAL MG1 . . 3.260 2.463 2.327 2.650 . 0 0 "[ . 1 . 2 . 3 ]" 1
1140 1 69 VAL HA 1 69 VAL MG2 . . 3.560 2.527 2.309 2.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
1141 1 69 VAL HA 1 70 PRO QD . . 2.340 2.044 2.007 2.089 . 0 0 "[ . 1 . 2 . 3 ]" 1
1142 1 69 VAL MG1 1 70 PRO HD2 . . 4.810 2.177 2.061 2.590 . 0 0 "[ . 1 . 2 . 3 ]" 1
1143 1 69 VAL MG1 1 70 PRO QD . . 3.940 2.157 2.043 2.549 . 0 0 "[ . 1 . 2 . 3 ]" 1
1144 1 69 VAL MG1 1 70 PRO HD3 . . 4.810 3.517 3.369 3.809 . 0 0 "[ . 1 . 2 . 3 ]" 1
1145 1 69 VAL MG1 1 73 GLY H . . 4.980 3.701 3.228 4.231 . 0 0 "[ . 1 . 2 . 3 ]" 1
1146 1 69 VAL MG2 1 70 PRO HD2 . . 5.510 3.758 3.292 4.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
1147 1 69 VAL MG2 1 70 PRO QD . . 4.690 3.573 3.160 3.832 . 0 0 "[ . 1 . 2 . 3 ]" 1
1148 1 69 VAL MG2 1 70 PRO HD3 . . 5.510 4.475 4.073 4.762 . 0 0 "[ . 1 . 2 . 3 ]" 1
1149 1 70 PRO HA 1 71 PRO HD2 . . 3.470 2.475 2.342 2.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
1150 1 70 PRO HA 1 71 PRO HD3 . . 3.350 2.541 2.196 2.750 . 0 0 "[ . 1 . 2 . 3 ]" 1
1151 1 70 PRO QB 1 71 PRO HD2 . . 3.100 2.225 2.126 2.354 . 0 0 "[ . 1 . 2 . 3 ]" 1
1152 1 70 PRO QB 1 71 PRO HD3 . . 3.790 3.506 3.123 3.593 . 0 0 "[ . 1 . 2 . 3 ]" 1
1153 1 70 PRO HB2 1 71 PRO HD2 . . 3.590 2.291 2.199 2.427 . 0 0 "[ . 1 . 2 . 3 ]" 1
1154 1 70 PRO HB3 1 71 PRO HD2 . . 3.590 3.022 2.815 3.219 . 0 0 "[ . 1 . 2 . 3 ]" 1
1155 1 71 PRO HA 1 72 LYS H . . 2.930 2.163 2.100 2.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
1156 1 71 PRO HA 1 73 GLY H . . 3.800 3.450 3.201 3.830 0.030 2 0 "[ . 1 . 2 . 3 ]" 1
1157 1 72 LYS H 1 72 LYS QB . . 3.470 3.396 3.230 3.492 0.022 29 0 "[ . 1 . 2 . 3 ]" 1
1158 1 72 LYS H 1 72 LYS QD . . 4.300 2.738 2.107 4.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
1159 1 72 LYS H 1 72 LYS QE . . 5.500 3.972 3.638 4.823 . 0 0 "[ . 1 . 2 . 3 ]" 1
1160 1 72 LYS H 1 72 LYS HG2 . . 4.700 3.193 2.285 4.478 . 0 0 "[ . 1 . 2 . 3 ]" 1
1161 1 72 LYS H 1 72 LYS QG . . 4.030 3.037 2.202 3.881 . 0 0 "[ . 1 . 2 . 3 ]" 1
1162 1 72 LYS H 1 72 LYS HG3 . . 4.700 4.220 2.694 4.643 . 0 0 "[ . 1 . 2 . 3 ]" 1
1163 1 72 LYS H 1 73 GLY H . . 3.550 2.849 2.638 3.018 . 0 0 "[ . 1 . 2 . 3 ]" 1
1164 1 72 LYS HA 1 72 LYS QD . . 3.470 2.377 2.096 3.510 0.040 3 0 "[ . 1 . 2 . 3 ]" 1
1165 1 72 LYS HA 1 72 LYS QG . . 3.670 2.937 2.111 3.308 . 0 0 "[ . 1 . 2 . 3 ]" 1
1166 1 72 LYS HB2 1 73 GLY H . . 4.650 3.640 3.399 4.332 . 0 0 "[ . 1 . 2 . 3 ]" 1
1167 1 72 LYS HB3 1 73 GLY H . . 4.650 4.318 4.021 4.442 . 0 0 "[ . 1 . 2 . 3 ]" 1
1168 1 72 LYS QD 1 73 GLY H . . 5.500 4.768 4.248 5.623 0.123 14 0 "[ . 1 . 2 . 3 ]" 1
1169 1 72 LYS HG2 1 73 GLY H . . 5.500 4.676 4.268 5.675 0.175 17 0 "[ . 1 . 2 . 3 ]" 1
1170 1 72 LYS HG3 1 73 GLY H . . 5.500 5.470 4.875 5.589 0.089 4 0 "[ . 1 . 2 . 3 ]" 1
1171 1 73 GLY QA 1 74 ARG HA . . 4.310 3.984 3.840 4.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
1172 1 73 GLY HA3 1 74 ARG H . . 3.140 2.753 2.487 3.174 0.034 26 0 "[ . 1 . 2 . 3 ]" 1
1173 1 73 GLY HA3 1 74 ARG HA . . 4.920 4.446 4.124 4.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1174 1 74 ARG H 1 74 ARG HG2 . . 4.270 3.571 2.497 4.348 0.078 26 0 "[ . 1 . 2 . 3 ]" 1
1175 1 74 ARG H 1 74 ARG HG3 . . 4.270 3.489 2.506 4.380 0.110 3 0 "[ . 1 . 2 . 3 ]" 1
1176 1 74 ARG H 1 75 VAL H . . 4.890 4.390 4.112 4.626 . 0 0 "[ . 1 . 2 . 3 ]" 1
1177 1 74 ARG H 1 75 VAL MG2 . . 4.690 4.044 3.008 4.726 0.036 22 0 "[ . 1 . 2 . 3 ]" 1
1178 1 74 ARG HA 1 75 VAL H . . 3.130 2.214 2.116 2.327 . 0 0 "[ . 1 . 2 . 3 ]" 1
1179 1 74 ARG HA 1 75 VAL MG2 . . 4.640 3.648 3.281 4.173 . 0 0 "[ . 1 . 2 . 3 ]" 1
1180 1 74 ARG QB 1 74 ARG QD . . 3.150 2.197 1.959 2.760 . 0 0 "[ . 1 . 2 . 3 ]" 1
1181 1 74 ARG QB 1 74 ARG QG . . 2.310 2.064 1.963 2.119 . 0 0 "[ . 1 . 2 . 3 ]" 1
1182 1 74 ARG QB 1 75 VAL H . . 3.620 2.955 2.409 3.711 0.091 26 0 "[ . 1 . 2 . 3 ]" 1
1183 1 74 ARG HB2 1 75 VAL H . . 4.400 3.375 2.438 4.462 0.062 4 0 "[ . 1 . 2 . 3 ]" 1
1184 1 74 ARG HB3 1 75 VAL H . . 4.400 3.768 2.478 4.397 . 0 0 "[ . 1 . 2 . 3 ]" 1
1185 1 74 ARG QD 1 74 ARG QG . . 2.180 2.037 1.924 2.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
1186 1 74 ARG QD 1 76 GLU QG . . 4.210 3.422 2.001 4.292 0.082 21 0 "[ . 1 . 2 . 3 ]" 1
1187 1 74 ARG HD2 1 74 ARG HG2 . . 2.870 2.804 2.286 3.039 0.169 27 0 "[ . 1 . 2 . 3 ]" 1
1188 1 74 ARG HD2 1 74 ARG HG3 . . 2.870 2.558 2.190 2.996 0.126 31 0 "[ . 1 . 2 . 3 ]" 1
1189 1 74 ARG HD3 1 74 ARG HG2 . . 2.870 2.549 2.202 3.004 0.134 18 0 "[ . 1 . 2 . 3 ]" 1
1190 1 74 ARG HD3 1 74 ARG HG3 . . 2.870 2.775 2.227 2.979 0.109 12 0 "[ . 1 . 2 . 3 ]" 1
1191 1 74 ARG QG 1 75 VAL H . . 4.710 3.678 2.230 4.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
1192 1 75 VAL H 1 75 VAL HB . . 4.200 2.877 2.539 3.097 . 0 0 "[ . 1 . 2 . 3 ]" 1
1193 1 75 VAL H 1 75 VAL MG1 . . 4.460 3.989 3.842 4.090 . 0 0 "[ . 1 . 2 . 3 ]" 1
1194 1 75 VAL H 1 75 VAL MG2 . . 4.250 3.049 2.433 3.441 . 0 0 "[ . 1 . 2 . 3 ]" 1
1195 1 75 VAL HA 1 75 VAL MG1 . . 3.530 2.432 2.366 2.527 . 0 0 "[ . 1 . 2 . 3 ]" 1
1196 1 75 VAL HA 1 76 GLU H . . 3.130 2.308 2.052 2.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
1197 1 75 VAL HB 1 76 GLU H . . 5.130 4.251 3.353 4.523 . 0 0 "[ . 1 . 2 . 3 ]" 1
1198 1 75 VAL MG1 1 76 GLU H . . 4.450 3.022 1.827 4.101 . 0 0 "[ . 1 . 2 . 3 ]" 1
1199 1 76 GLU H 1 76 GLU HB2 . . 3.750 3.112 2.556 3.802 0.052 16 0 "[ . 1 . 2 . 3 ]" 1
1200 1 76 GLU H 1 76 GLU HB3 . . 3.750 3.534 2.355 3.819 0.069 6 0 "[ . 1 . 2 . 3 ]" 1
1201 1 76 GLU H 1 76 GLU QG . . 3.870 2.634 1.655 3.977 0.107 21 0 "[ . 1 . 2 . 3 ]" 1
1202 1 76 GLU H 1 77 LEU H . . 4.940 4.507 4.260 4.752 . 0 0 "[ . 1 . 2 . 3 ]" 1
1203 1 76 GLU HA 1 76 GLU HG2 . . 4.000 3.589 2.372 4.134 0.134 31 0 "[ . 1 . 2 . 3 ]" 1
1204 1 76 GLU HA 1 76 GLU QG . . 3.410 2.932 2.338 3.425 0.015 23 0 "[ . 1 . 2 . 3 ]" 1
1205 1 76 GLU HA 1 76 GLU HG3 . . 4.000 3.268 2.629 3.797 . 0 0 "[ . 1 . 2 . 3 ]" 1
1206 1 76 GLU QB 1 77 LEU H . . 4.240 2.953 2.486 3.861 . 0 0 "[ . 1 . 2 . 3 ]" 1
1207 1 76 GLU HB2 1 77 LEU H . . 4.890 3.544 2.867 4.319 . 0 0 "[ . 1 . 2 . 3 ]" 1
1208 1 76 GLU HB3 1 77 LEU H . . 4.890 3.287 2.567 4.350 . 0 0 "[ . 1 . 2 . 3 ]" 1
1209 1 77 LEU H 1 77 LEU MD1 . . 4.010 2.515 2.225 3.056 . 0 0 "[ . 1 . 2 . 3 ]" 1
1210 1 77 LEU H 1 77 LEU MD2 . . 5.500 4.145 3.807 4.343 . 0 0 "[ . 1 . 2 . 3 ]" 1
1211 1 77 LEU H 1 77 LEU HG . . 5.670 3.780 3.166 4.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
1212 1 77 LEU HB2 1 83 HIS HA . . 4.940 3.946 3.403 4.721 . 0 0 "[ . 1 . 2 . 3 ]" 1
1213 1 77 LEU HB3 1 83 HIS HA . . 4.730 2.539 2.017 3.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
1214 1 77 LEU MD1 1 82 TYR HB2 . . 5.080 4.430 3.763 4.933 . 0 0 "[ . 1 . 2 . 3 ]" 1
1215 1 77 LEU MD1 1 82 TYR HB3 . . 5.080 4.352 3.577 4.813 . 0 0 "[ . 1 . 2 . 3 ]" 1
1216 1 77 LEU MD1 1 84 PHE QD . . 5.290 3.751 3.072 4.446 . 0 0 "[ . 1 . 2 . 3 ]" 1
1217 1 77 LEU MD1 1 84 PHE QE . . 4.020 2.719 2.337 3.445 . 0 0 "[ . 1 . 2 . 3 ]" 1
1218 1 77 LEU MD1 1 84 PHE HZ . . 3.970 3.999 3.973 4.034 0.064 19 0 "[ . 1 . 2 . 3 ]" 1
1219 1 77 LEU MD2 1 82 TYR H . . 6.300 5.405 4.624 6.334 0.034 7 0 "[ . 1 . 2 . 3 ]" 1
1220 1 77 LEU MD2 1 82 TYR HA . . 5.500 4.485 3.960 5.344 . 0 0 "[ . 1 . 2 . 3 ]" 1
1221 1 77 LEU MD2 1 82 TYR HB2 . . 5.270 3.906 3.130 4.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
1222 1 77 LEU MD2 1 82 TYR QB . . 4.600 3.007 2.429 4.010 . 0 0 "[ . 1 . 2 . 3 ]" 1
1223 1 77 LEU MD2 1 82 TYR HB3 . . 5.270 3.150 2.478 4.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
1224 1 77 LEU MD2 1 82 TYR QD . . 5.550 4.603 3.913 5.559 0.009 15 0 "[ . 1 . 2 . 3 ]" 1
1225 1 77 LEU MD2 1 83 HIS H . . 5.030 3.270 2.657 4.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
1226 1 77 LEU MD2 1 83 HIS HA . . 4.210 2.196 1.975 2.602 . 0 0 "[ . 1 . 2 . 3 ]" 1
1227 1 77 LEU MD2 1 83 HIS HB2 . . 5.500 4.113 3.586 4.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
1228 1 77 LEU MD2 1 83 HIS HB3 . . 5.500 4.178 3.817 4.551 . 0 0 "[ . 1 . 2 . 3 ]" 1
1229 1 77 LEU MD2 1 84 PHE H . . 5.070 2.750 1.995 3.144 . 0 0 "[ . 1 . 2 . 3 ]" 1
1230 1 77 LEU MD2 1 84 PHE QD . . 4.930 2.397 2.041 2.707 . 0 0 "[ . 1 . 2 . 3 ]" 1
1231 1 77 LEU MD2 1 84 PHE QE . . 4.840 2.588 2.168 2.924 . 0 0 "[ . 1 . 2 . 3 ]" 1
1232 1 77 LEU MD2 1 84 PHE HZ . . 5.430 3.762 3.196 4.368 . 0 0 "[ . 1 . 2 . 3 ]" 1
1233 1 77 LEU HG 1 78 LYS H . . 4.910 4.608 3.872 4.963 0.053 26 0 "[ . 1 . 2 . 3 ]" 1
1234 1 77 LEU HG 1 82 TYR H . . 5.800 5.356 4.544 5.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
1235 1 77 LEU HG 1 82 TYR HB2 . . 4.150 3.094 2.540 3.511 . 0 0 "[ . 1 . 2 . 3 ]" 1
1236 1 77 LEU HG 1 82 TYR QB . . 3.510 2.652 2.349 3.118 . 0 0 "[ . 1 . 2 . 3 ]" 1
1237 1 77 LEU HG 1 82 TYR HB3 . . 4.150 2.917 2.437 3.584 . 0 0 "[ . 1 . 2 . 3 ]" 1
1238 1 77 LEU HG 1 82 TYR QD . . 5.500 4.574 4.120 4.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
1239 1 77 LEU HG 1 83 HIS HA . . 4.460 3.967 2.729 4.468 0.008 26 0 "[ . 1 . 2 . 3 ]" 1
1240 1 78 LYS H 1 82 TYR H . . 4.900 4.141 2.864 4.941 0.041 21 0 "[ . 1 . 2 . 3 ]" 1
1241 1 78 LYS H 1 82 TYR QB . . 5.340 3.771 1.744 4.936 . 0 0 "[ . 1 . 2 . 3 ]" 1
1242 1 78 LYS HA 1 79 PRO HD3 . . 3.920 2.566 2.378 2.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
1243 1 78 LYS QD 1 81 GLY H . . 5.500 4.743 3.259 5.502 0.002 10 0 "[ . 1 . 2 . 3 ]" 1
1244 1 78 LYS QG 1 81 GLY H . . 3.900 3.320 2.373 3.964 0.064 24 0 "[ . 1 . 2 . 3 ]" 1
1245 1 78 LYS HG2 1 81 GLY H . . 4.770 3.961 2.389 4.848 0.078 29 0 "[ . 1 . 2 . 3 ]" 1
1246 1 78 LYS HG3 1 81 GLY H . . 4.770 4.053 2.784 4.837 0.067 22 0 "[ . 1 . 2 . 3 ]" 1
1247 1 81 GLY H 1 82 TYR H . . 4.710 3.270 1.985 4.294 . 0 0 "[ . 1 . 2 . 3 ]" 1
1248 1 81 GLY HA3 1 82 TYR H . . 3.470 2.513 2.140 3.222 . 0 0 "[ . 1 . 2 . 3 ]" 1
1249 1 81 GLY HA3 1 82 TYR QD . . 5.410 3.865 3.083 4.689 . 0 0 "[ . 1 . 2 . 3 ]" 1
1250 1 82 TYR H 1 82 TYR HB2 . . 3.900 2.591 2.358 2.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1251 1 82 TYR H 1 82 TYR HB3 . . 3.900 3.724 3.588 3.919 0.019 9 0 "[ . 1 . 2 . 3 ]" 1
1252 1 82 TYR H 1 82 TYR QD . . 3.990 2.861 2.186 3.457 . 0 0 "[ . 1 . 2 . 3 ]" 1
1253 1 82 TYR H 1 82 TYR QE . . 5.260 4.761 4.136 5.313 0.053 20 0 "[ . 1 . 2 . 3 ]" 1
1254 1 82 TYR H 1 83 HIS H . . 5.500 4.532 4.304 4.671 . 0 0 "[ . 1 . 2 . 3 ]" 1
1255 1 82 TYR HA 1 82 TYR QD . . 3.470 2.749 2.315 3.083 . 0 0 "[ . 1 . 2 . 3 ]" 1
1256 1 82 TYR HA 1 82 TYR QE . . 4.680 4.537 4.399 4.701 0.021 31 0 "[ . 1 . 2 . 3 ]" 1
1257 1 82 TYR HA 1 83 HIS H . . 3.180 2.179 2.072 2.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
1258 1 82 TYR QB 1 83 HIS H . . 3.470 2.760 2.405 2.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1259 1 82 TYR HB2 1 83 HIS H . . 3.950 3.984 3.623 4.043 0.093 17 0 "[ . 1 . 2 . 3 ]" 1
1260 1 82 TYR HB3 1 83 HIS H . . 3.950 2.815 2.441 2.945 . 0 0 "[ . 1 . 2 . 3 ]" 1
1261 1 82 TYR QD 1 83 HIS H . . 4.240 3.586 3.479 3.733 . 0 0 "[ . 1 . 2 . 3 ]" 1
1262 1 82 TYR QE 1 83 HIS H . . 5.720 5.759 5.736 5.820 0.100 31 0 "[ . 1 . 2 . 3 ]" 1
1263 1 83 HIS H 1 83 HIS HD2 . . 5.740 4.765 4.628 4.985 . 0 0 "[ . 1 . 2 . 3 ]" 1
1264 1 83 HIS H 1 83 HIS HE1 . . 5.760 4.670 4.456 4.879 . 0 0 "[ . 1 . 2 . 3 ]" 1
1265 1 83 HIS HA 1 83 HIS HB3 . . 2.400 2.410 2.370 2.426 0.026 2 0 "[ . 1 . 2 . 3 ]" 1
1266 1 83 HIS HB2 1 84 PHE H . . 4.010 2.707 2.409 2.913 . 0 0 "[ . 1 . 2 . 3 ]" 1
1267 1 83 HIS HB3 1 84 PHE H . . 4.020 3.936 3.789 4.030 0.010 29 0 "[ . 1 . 2 . 3 ]" 1
1268 1 83 HIS HD2 1 85 MET HA . . 5.490 3.219 2.777 3.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
1269 1 83 HIS HD2 1 85 MET ME . . 5.850 4.006 2.931 4.795 . 0 0 "[ . 1 . 2 . 3 ]" 1
1270 1 84 PHE H 1 84 PHE HB2 . . 4.030 2.361 2.281 2.454 . 0 0 "[ . 1 . 2 . 3 ]" 1
1271 1 84 PHE H 1 84 PHE QB . . 3.510 2.332 2.256 2.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
1272 1 84 PHE H 1 84 PHE HB3 . . 4.030 3.618 3.556 3.677 . 0 0 "[ . 1 . 2 . 3 ]" 1
1273 1 84 PHE H 1 84 PHE QD . . 4.230 2.912 2.512 3.318 . 0 0 "[ . 1 . 2 . 3 ]" 1
1274 1 84 PHE H 1 85 MET H . . 4.840 4.490 4.284 4.581 . 0 0 "[ . 1 . 2 . 3 ]" 1
1275 1 84 PHE HA 1 84 PHE QD . . 3.920 2.627 2.310 2.937 . 0 0 "[ . 1 . 2 . 3 ]" 1
1276 1 84 PHE HA 1 85 MET H . . 3.330 2.189 2.098 2.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1277 1 84 PHE QB 1 85 MET H . . 3.660 3.083 2.683 3.458 . 0 0 "[ . 1 . 2 . 3 ]" 1
1278 1 84 PHE QB 1 101 LEU QD . . 4.760 3.132 2.510 3.899 . 0 0 "[ . 1 . 2 . 3 ]" 1
1279 1 84 PHE HB2 1 85 MET H . . 4.360 4.206 3.929 4.409 0.049 31 0 "[ . 1 . 2 . 3 ]" 1
1280 1 84 PHE HB3 1 85 MET H . . 4.360 3.173 2.731 3.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
1281 1 84 PHE QD 1 85 MET H . . 4.150 3.715 3.432 3.920 . 0 0 "[ . 1 . 2 . 3 ]" 1
1282 1 84 PHE QD 1 101 LEU MD1 . . 5.600 4.542 2.894 5.613 0.013 12 0 "[ . 1 . 2 . 3 ]" 1
1283 1 84 PHE QD 1 101 LEU QD . . 4.610 3.228 2.576 4.081 . 0 0 "[ . 1 . 2 . 3 ]" 1
1284 1 84 PHE QD 1 101 LEU MD2 . . 5.600 3.757 2.588 5.612 0.012 16 0 "[ . 1 . 2 . 3 ]" 1
1285 1 84 PHE QD 1 103 LEU HG . . 6.270 5.573 4.627 6.240 . 0 0 "[ . 1 . 2 . 3 ]" 1
1286 1 84 PHE QE 1 85 MET H . . 5.920 5.856 5.623 5.938 0.018 15 0 "[ . 1 . 2 . 3 ]" 1
1287 1 84 PHE QE 1 101 LEU QD . . 5.440 3.874 2.808 4.893 . 0 0 "[ . 1 . 2 . 3 ]" 1
1288 1 84 PHE QE 1 103 LEU HA . . 5.310 4.802 3.921 5.312 0.002 19 0 "[ . 1 . 2 . 3 ]" 1
1289 1 84 PHE QE 1 103 LEU QD . . 5.080 3.860 2.174 4.536 . 0 0 "[ . 1 . 2 . 3 ]" 1
1290 1 84 PHE QE 1 103 LEU HG . . 5.460 3.871 2.740 4.623 . 0 0 "[ . 1 . 2 . 3 ]" 1
1291 1 84 PHE HZ 1 101 LEU QD . . 6.420 4.981 3.522 6.216 . 0 0 "[ . 1 . 2 . 3 ]" 1
1292 1 84 PHE HZ 1 103 LEU HA . . 5.180 4.542 3.639 5.169 . 0 0 "[ . 1 . 2 . 3 ]" 1
1293 1 84 PHE HZ 1 103 LEU QD . . 5.390 4.499 2.536 5.146 . 0 0 "[ . 1 . 2 . 3 ]" 1
1294 1 84 PHE HZ 1 103 LEU HG . . 4.960 4.391 3.232 4.981 0.021 9 0 "[ . 1 . 2 . 3 ]" 1
1295 1 85 MET H 1 85 MET HB2 . . 4.070 2.543 2.345 2.883 . 0 0 "[ . 1 . 2 . 3 ]" 1
1296 1 85 MET H 1 85 MET HB3 . . 4.070 2.876 2.574 3.824 . 0 0 "[ . 1 . 2 . 3 ]" 1
1297 1 85 MET H 1 85 MET HG2 . . 5.500 4.733 4.073 4.919 . 0 0 "[ . 1 . 2 . 3 ]" 1
1298 1 85 MET H 1 85 MET HG3 . . 5.500 4.508 3.218 4.653 . 0 0 "[ . 1 . 2 . 3 ]" 1
1299 1 85 MET H 1 86 LEU QD . . 4.700 3.868 3.283 4.910 0.210 10 0 "[ . 1 . 2 . 3 ]" 1
1300 1 85 MET HA 1 85 MET ME . . 4.420 3.101 2.162 3.675 . 0 0 "[ . 1 . 2 . 3 ]" 1
1301 1 85 MET HA 1 85 MET QG . . 3.730 2.386 1.992 2.490 . 0 0 "[ . 1 . 2 . 3 ]" 1
1302 1 85 MET HA 1 86 LEU H . . 3.070 2.209 2.056 2.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
1303 1 85 MET HA 1 87 LEU MD1 . . 5.500 4.806 3.738 5.545 0.045 24 0 "[ . 1 . 2 . 3 ]" 1
1304 1 85 MET QB 1 86 LEU H . . 3.520 3.700 2.847 3.945 0.425 12 0 "[ . 1 . 2 . 3 ]" 1
1305 1 85 MET QB 1 87 LEU MD1 . . 5.340 3.401 2.318 4.681 . 0 0 "[ . 1 . 2 . 3 ]" 1
1306 1 85 MET ME 1 87 LEU MD1 . . 5.500 4.105 2.983 4.872 . 0 0 "[ . 1 . 2 . 3 ]" 1
1307 1 85 MET QG 1 86 LEU H . . 5.050 2.868 2.379 3.439 . 0 0 "[ . 1 . 2 . 3 ]" 1
1308 1 85 MET HG2 1 87 LEU MD1 . . 5.500 3.192 2.154 5.198 . 0 0 "[ . 1 . 2 . 3 ]" 1
1309 1 85 MET HG3 1 87 LEU MD1 . . 5.500 3.264 2.148 5.537 0.037 21 0 "[ . 1 . 2 . 3 ]" 1
1310 1 86 LEU H 1 86 LEU QB . . 3.550 2.291 2.174 2.520 . 0 0 "[ . 1 . 2 . 3 ]" 1
1311 1 86 LEU H 1 86 LEU QD . . 4.120 2.781 2.477 3.577 . 0 0 "[ . 1 . 2 . 3 ]" 1
1312 1 86 LEU H 1 86 LEU HG . . 4.570 4.028 2.834 4.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
1313 1 86 LEU H 1 87 LEU MD1 . . 5.500 4.255 3.073 5.513 0.013 12 0 "[ . 1 . 2 . 3 ]" 1
1314 1 86 LEU HA 1 87 LEU H . . 2.480 2.196 2.101 2.312 . 0 0 "[ . 1 . 2 . 3 ]" 1
1315 1 86 LEU HB2 1 87 LEU H . . 4.620 4.461 4.273 4.618 . 0 0 "[ . 1 . 2 . 3 ]" 1
1316 1 86 LEU HB2 1 89 LEU MD2 . . 5.500 3.069 2.726 3.555 . 0 0 "[ . 1 . 2 . 3 ]" 1
1317 1 86 LEU HB3 1 89 LEU MD2 . . 5.500 2.546 2.280 3.034 . 0 0 "[ . 1 . 2 . 3 ]" 1
1318 1 87 LEU H 1 88 GLY H . . 5.030 4.490 4.359 4.592 . 0 0 "[ . 1 . 2 . 3 ]" 1
1319 1 87 LEU HA 1 88 GLY H . . 2.880 2.166 2.101 2.241 . 0 0 "[ . 1 . 2 . 3 ]" 1
1320 1 87 LEU HA 1 88 GLY QA . . 5.450 3.966 3.929 4.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
1321 1 87 LEU QB 1 88 GLY H . . 3.910 3.027 2.600 3.783 . 0 0 "[ . 1 . 2 . 3 ]" 1
1322 1 87 LEU HB2 1 88 GLY H . . 4.460 4.156 3.867 4.347 . 0 0 "[ . 1 . 2 . 3 ]" 1
1323 1 87 LEU HB3 1 88 GLY H . . 4.460 3.127 2.642 4.172 . 0 0 "[ . 1 . 2 . 3 ]" 1
1324 1 87 LEU MD2 1 88 GLY H . . 4.680 4.262 2.825 4.738 0.058 21 0 "[ . 1 . 2 . 3 ]" 1
1325 1 88 GLY H 1 89 LEU H . . 3.840 2.721 2.399 3.437 . 0 0 "[ . 1 . 2 . 3 ]" 1
1326 1 88 GLY QA 1 89 LEU QB . . 5.160 4.512 4.230 4.688 . 0 0 "[ . 1 . 2 . 3 ]" 1
1327 1 89 LEU H 1 89 LEU QB . . 2.940 2.927 2.753 3.281 0.341 16 0 "[ . 1 . 2 . 3 ]" 1
1328 1 89 LEU HA 1 90 LYS H . . 3.330 2.168 2.011 2.307 . 0 0 "[ . 1 . 2 . 3 ]" 1
1329 1 89 LEU HA 1 91 ARG H . . 3.970 3.981 3.758 4.035 0.065 5 0 "[ . 1 . 2 . 3 ]" 1
1330 1 89 LEU QB 1 90 LYS H . . 2.930 2.305 2.147 2.414 . 0 0 "[ . 1 . 2 . 3 ]" 1
1331 1 89 LEU QB 1 90 LYS HA . . 4.760 4.136 4.079 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1332 1 89 LEU QB 1 91 ARG H . . 3.310 2.823 2.329 3.063 . 0 0 "[ . 1 . 2 . 3 ]" 1
1333 1 89 LEU HB2 1 90 LYS H . . 3.360 3.431 3.385 3.463 0.103 27 0 "[ . 1 . 2 . 3 ]" 1
1334 1 89 LEU HB3 1 90 LYS H . . 3.360 2.343 2.171 2.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
1335 1 89 LEU MD1 1 90 LYS H . . 4.160 4.193 4.002 4.230 0.070 22 0 "[ . 1 . 2 . 3 ]" 1
1336 1 89 LEU MD1 1 91 ARG H . . 4.190 4.234 3.837 4.530 0.340 14 0 "[ . 1 . 2 . 3 ]" 1
1337 1 89 LEU MD1 1 92 PRO HA . . 4.950 3.193 2.234 4.981 0.031 15 0 "[ . 1 . 2 . 3 ]" 1
1338 1 90 LYS H 1 90 LYS QD . . 3.660 3.558 3.317 3.895 0.235 22 0 "[ . 1 . 2 . 3 ]" 1
1339 1 90 LYS H 1 90 LYS QG . . 3.380 2.609 2.381 2.834 . 0 0 "[ . 1 . 2 . 3 ]" 1
1340 1 90 LYS H 1 91 ARG H . . 3.190 2.027 1.834 2.229 . 0 0 "[ . 1 . 2 . 3 ]" 1
1341 1 90 LYS HA 1 90 LYS QD . . 3.690 2.460 2.063 3.827 0.137 27 0 "[ . 1 . 2 . 3 ]" 1
1342 1 90 LYS HA 1 90 LYS HG2 . . 3.740 3.207 2.269 3.407 . 0 0 "[ . 1 . 2 . 3 ]" 1
1343 1 90 LYS HA 1 90 LYS QG . . 3.220 3.026 2.216 3.193 . 0 0 "[ . 1 . 2 . 3 ]" 1
1344 1 90 LYS HA 1 90 LYS HG3 . . 3.740 3.718 2.720 3.936 0.196 19 0 "[ . 1 . 2 . 3 ]" 1
1345 1 90 LYS HA 1 91 ARG H . . 3.370 3.446 3.279 3.510 0.140 23 0 "[ . 1 . 2 . 3 ]" 1
1346 1 90 LYS QB 1 91 ARG H . . 3.800 2.811 2.664 3.053 . 0 0 "[ . 1 . 2 . 3 ]" 1
1347 1 90 LYS QE 1 90 LYS QG . . 3.080 2.221 2.034 2.541 . 0 0 "[ . 1 . 2 . 3 ]" 1
1348 1 90 LYS HE2 1 90 LYS HG2 . . 3.940 2.781 2.224 3.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
1349 1 90 LYS HE2 1 90 LYS HG3 . . 3.940 3.035 2.474 3.757 . 0 0 "[ . 1 . 2 . 3 ]" 1
1350 1 90 LYS HE3 1 90 LYS HG2 . . 3.940 3.226 2.695 3.827 . 0 0 "[ . 1 . 2 . 3 ]" 1
1351 1 90 LYS HE3 1 90 LYS HG3 . . 3.940 2.774 2.213 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1352 1 91 ARG H 1 91 ARG QB . . 3.060 2.594 2.178 3.073 0.013 31 0 "[ . 1 . 2 . 3 ]" 1
1353 1 91 ARG H 1 91 ARG QD . . 4.490 4.177 2.914 4.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
1354 1 91 ARG H 1 91 ARG QG . . 3.400 2.981 2.275 3.283 . 0 0 "[ . 1 . 2 . 3 ]" 1
1355 1 91 ARG H 1 92 PRO HD2 . . 5.320 4.844 4.699 5.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1356 1 91 ARG H 1 92 PRO QD . . 4.650 4.300 4.171 4.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
1357 1 91 ARG H 1 92 PRO HD3 . . 5.320 4.817 4.546 4.984 . 0 0 "[ . 1 . 2 . 3 ]" 1
1358 1 91 ARG HA 1 91 ARG QB . . 2.490 2.358 2.091 2.485 . 0 0 "[ . 1 . 2 . 3 ]" 1
1359 1 91 ARG HA 1 92 PRO QD . . 2.840 2.090 1.971 2.171 . 0 0 "[ . 1 . 2 . 3 ]" 1
1360 1 91 ARG QB 1 91 ARG QD . . 2.970 2.363 2.071 2.830 . 0 0 "[ . 1 . 2 . 3 ]" 1
1361 1 92 PRO HA 1 93 LEU H . . 2.920 2.266 2.177 2.533 . 0 0 "[ . 1 . 2 . 3 ]" 1
1362 1 93 LEU H 1 94 LYS H . . 4.100 4.459 3.772 4.714 0.614 14 9 "[ * . 1 +** *2-***. 3 ]" 1
1363 1 93 LEU HA 1 93 LEU QD . . 3.980 2.687 2.023 3.501 . 0 0 "[ . 1 . 2 . 3 ]" 1
1364 1 93 LEU HA 1 94 LYS H . . 3.170 2.203 1.941 2.487 . 0 0 "[ . 1 . 2 . 3 ]" 1
1365 1 93 LEU QD 1 94 LYS H . . 4.810 3.660 3.081 4.469 . 0 0 "[ . 1 . 2 . 3 ]" 1
1366 1 94 LYS H 1 94 LYS QB . . 3.170 2.811 2.221 3.481 0.311 20 0 "[ . 1 . 2 . 3 ]" 1
1367 1 94 LYS H 1 94 LYS QD . . 4.040 3.448 2.042 4.146 0.106 18 0 "[ . 1 . 2 . 3 ]" 1
1368 1 94 LYS H 1 94 LYS QG . . 3.510 2.693 2.062 3.492 . 0 0 "[ . 1 . 2 . 3 ]" 1
1369 1 94 LYS H 1 97 GLU QB . . 4.400 3.669 2.971 4.464 0.064 17 0 "[ . 1 . 2 . 3 ]" 1
1370 1 94 LYS H 1 97 GLU QG . . 4.880 2.814 1.826 4.435 . 0 0 "[ . 1 . 2 . 3 ]" 1
1371 1 94 LYS HA 1 95 ALA H . . 2.680 2.436 2.039 2.748 0.068 2 0 "[ . 1 . 2 . 3 ]" 1
1372 1 94 LYS HA 1 95 ALA MB . . 5.000 4.057 3.892 4.136 . 0 0 "[ . 1 . 2 . 3 ]" 1
1373 1 94 LYS QB 1 97 GLU QG . . 4.510 3.161 2.078 4.560 0.050 12 0 "[ . 1 . 2 . 3 ]" 1
1374 1 94 LYS QD 1 95 ALA H . . 4.280 3.988 2.975 4.380 0.100 19 0 "[ . 1 . 2 . 3 ]" 1
1375 1 94 LYS QG 1 95 ALA H . . 4.180 4.012 2.813 4.281 0.101 14 0 "[ . 1 . 2 . 3 ]" 1
1376 1 95 ALA H 1 95 ALA MB . . 2.910 2.332 2.130 3.062 0.152 2 0 "[ . 1 . 2 . 3 ]" 1
1377 1 95 ALA H 1 96 GLY H . . 4.350 4.466 4.368 4.520 0.170 29 0 "[ . 1 . 2 . 3 ]" 1
1378 1 95 ALA H 1 117 VAL MG1 . . 5.500 4.003 2.413 4.949 . 0 0 "[ . 1 . 2 . 3 ]" 1
1379 1 95 ALA HA 1 96 GLY H . . 2.880 2.169 2.052 2.450 . 0 0 "[ . 1 . 2 . 3 ]" 1
1380 1 95 ALA HA 1 97 GLU H . . 4.120 3.499 3.007 3.779 . 0 0 "[ . 1 . 2 . 3 ]" 1
1381 1 95 ALA HA 1 117 VAL HB . . 5.500 3.284 2.423 3.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
1382 1 95 ALA HA 1 117 VAL MG1 . . 4.110 2.807 2.078 3.519 . 0 0 "[ . 1 . 2 . 3 ]" 1
1383 1 95 ALA MB 1 96 GLY H . . 3.980 2.997 2.393 3.346 . 0 0 "[ . 1 . 2 . 3 ]" 1
1384 1 95 ALA MB 1 97 GLU H . . 4.930 4.648 4.203 4.869 . 0 0 "[ . 1 . 2 . 3 ]" 1
1385 1 95 ALA MB 1 118 GLU HA . . 5.100 2.944 2.294 4.190 . 0 0 "[ . 1 . 2 . 3 ]" 1
1386 1 96 GLY H 1 97 GLU H . . 3.940 2.531 2.253 2.947 . 0 0 "[ . 1 . 2 . 3 ]" 1
1387 1 96 GLY H 1 117 VAL HB . . 4.310 3.350 2.609 4.282 . 0 0 "[ . 1 . 2 . 3 ]" 1
1388 1 96 GLY H 1 117 VAL MG1 . . 4.720 3.969 3.246 4.762 0.042 21 0 "[ . 1 . 2 . 3 ]" 1
1389 1 96 GLY QA 1 117 VAL H . . 4.670 4.471 4.009 4.734 0.064 25 0 "[ . 1 . 2 . 3 ]" 1
1390 1 97 GLU H 1 97 GLU QB . . 3.080 2.571 2.309 2.901 . 0 0 "[ . 1 . 2 . 3 ]" 1
1391 1 97 GLU H 1 97 GLU HG2 . . 3.940 3.313 2.107 3.995 0.055 28 0 "[ . 1 . 2 . 3 ]" 1
1392 1 97 GLU H 1 97 GLU HG3 . . 3.940 3.244 2.391 3.974 0.034 5 0 "[ . 1 . 2 . 3 ]" 1
1393 1 97 GLU H 1 98 GLU H . . 4.470 4.440 4.369 4.516 0.046 8 0 "[ . 1 . 2 . 3 ]" 1
1394 1 97 GLU H 1 117 VAL H . . 3.760 3.350 2.819 3.754 . 0 0 "[ . 1 . 2 . 3 ]" 1
1395 1 97 GLU H 1 117 VAL MG1 . . 4.520 3.847 3.530 4.242 . 0 0 "[ . 1 . 2 . 3 ]" 1
1396 1 97 GLU HA 1 98 GLU H . . 2.890 2.610 2.381 2.730 . 0 0 "[ . 1 . 2 . 3 ]" 1
1397 1 97 GLU QB 1 98 GLU H . . 2.620 2.030 1.831 2.267 . 0 0 "[ . 1 . 2 . 3 ]" 1
1398 1 97 GLU QB 1 117 VAL H . . 3.680 3.704 3.493 3.809 0.129 16 0 "[ . 1 . 2 . 3 ]" 1
1399 1 97 GLU HB2 1 98 GLU H . . 3.060 3.110 2.936 3.193 0.133 31 0 "[ . 1 . 2 . 3 ]" 1
1400 1 97 GLU HB3 1 98 GLU H . . 3.060 2.062 1.843 2.336 . 0 0 "[ . 1 . 2 . 3 ]" 1
1401 1 97 GLU QG 1 98 GLU H . . 4.270 3.952 3.543 4.290 0.020 2 0 "[ . 1 . 2 . 3 ]" 1
1402 1 97 GLU HG2 1 99 VAL MG2 . . 5.500 5.265 4.053 5.615 0.115 6 0 "[ . 1 . 2 . 3 ]" 1
1403 1 97 GLU HG2 1 117 VAL MG2 . . 5.500 4.389 3.301 5.376 . 0 0 "[ . 1 . 2 . 3 ]" 1
1404 1 98 GLU H 1 98 GLU QB . . 3.560 2.936 2.448 3.338 . 0 0 "[ . 1 . 2 . 3 ]" 1
1405 1 98 GLU H 1 98 GLU QG . . 3.800 3.172 2.382 3.847 0.047 4 0 "[ . 1 . 2 . 3 ]" 1
1406 1 98 GLU H 1 99 VAL H . . 3.910 4.035 3.963 4.103 0.193 6 0 "[ . 1 . 2 . 3 ]" 1
1407 1 98 GLU H 1 99 VAL MG2 . . 5.050 3.383 2.817 4.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
1408 1 98 GLU H 1 117 VAL MG2 . . 5.500 3.482 2.955 4.275 . 0 0 "[ . 1 . 2 . 3 ]" 1
1409 1 98 GLU HA 1 99 VAL H . . 2.600 2.137 2.051 2.261 . 0 0 "[ . 1 . 2 . 3 ]" 1
1410 1 98 GLU QB 1 99 VAL H . . 3.800 2.771 2.277 3.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
1411 1 99 VAL H 1 99 VAL MG1 . . 4.230 3.968 3.842 4.087 . 0 0 "[ . 1 . 2 . 3 ]" 1
1412 1 99 VAL H 1 99 VAL MG2 . . 3.740 3.021 2.500 3.285 . 0 0 "[ . 1 . 2 . 3 ]" 1
1413 1 99 VAL H 1 100 GLU H . . 5.010 4.388 4.296 4.473 . 0 0 "[ . 1 . 2 . 3 ]" 1
1414 1 99 VAL H 1 115 LEU H . . 4.220 3.017 2.748 3.363 . 0 0 "[ . 1 . 2 . 3 ]" 1
1415 1 99 VAL HA 1 99 VAL MG1 . . 3.380 2.424 2.210 2.580 . 0 0 "[ . 1 . 2 . 3 ]" 1
1416 1 99 VAL HA 1 100 GLU H . . 2.810 2.213 2.032 2.380 . 0 0 "[ . 1 . 2 . 3 ]" 1
1417 1 99 VAL MG1 1 100 GLU H . . 4.260 2.289 2.060 2.628 . 0 0 "[ . 1 . 2 . 3 ]" 1
1418 1 99 VAL MG2 1 116 PRO HA . . 5.040 4.872 4.249 5.079 0.039 3 0 "[ . 1 . 2 . 3 ]" 1
1419 1 99 VAL MG2 1 117 VAL H . . 5.270 4.504 3.860 5.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
1420 1 100 GLU H 1 100 GLU QB . . 3.580 2.754 2.331 3.182 . 0 0 "[ . 1 . 2 . 3 ]" 1
1421 1 100 GLU H 1 100 GLU QG . . 4.700 2.609 1.990 4.092 . 0 0 "[ . 1 . 2 . 3 ]" 1
1422 1 100 GLU H 1 101 LEU H . . 5.500 4.530 4.385 4.632 . 0 0 "[ . 1 . 2 . 3 ]" 1
1423 1 100 GLU HA 1 101 LEU H . . 3.320 2.169 2.057 2.302 . 0 0 "[ . 1 . 2 . 3 ]" 1
1424 1 100 GLU QB 1 101 LEU H . . 4.480 2.833 2.291 3.695 . 0 0 "[ . 1 . 2 . 3 ]" 1
1425 1 100 GLU QG 1 101 LEU H . . 5.230 3.905 2.281 4.885 . 0 0 "[ . 1 . 2 . 3 ]" 1
1426 1 101 LEU H 1 101 LEU HB2 . . 3.690 2.712 2.408 3.556 . 0 0 "[ . 1 . 2 . 3 ]" 1
1427 1 101 LEU H 1 101 LEU HB3 . . 3.690 3.522 2.817 3.735 0.045 9 0 "[ . 1 . 2 . 3 ]" 1
1428 1 101 LEU H 1 101 LEU MD1 . . 5.500 3.869 3.102 4.884 . 0 0 "[ . 1 . 2 . 3 ]" 1
1429 1 101 LEU H 1 101 LEU QD . . 4.570 3.388 3.048 3.916 . 0 0 "[ . 1 . 2 . 3 ]" 1
1430 1 101 LEU H 1 101 LEU MD2 . . 5.500 4.264 3.107 4.843 . 0 0 "[ . 1 . 2 . 3 ]" 1
1431 1 101 LEU H 1 101 LEU HG . . 5.000 4.517 3.203 4.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
1432 1 101 LEU H 1 102 ASP H . . 5.080 4.296 4.120 4.408 . 0 0 "[ . 1 . 2 . 3 ]" 1
1433 1 101 LEU H 1 113 VAL HB . . 4.980 4.289 2.346 4.988 0.008 5 0 "[ . 1 . 2 . 3 ]" 1
1434 1 101 LEU HA 1 101 LEU QD . . 3.860 2.619 2.123 3.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
1435 1 101 LEU HA 1 101 LEU HG . . 3.990 2.715 2.268 3.786 . 0 0 "[ . 1 . 2 . 3 ]" 1
1436 1 101 LEU HA 1 102 ASP H . . 3.030 2.112 2.013 2.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
1437 1 101 LEU QB 1 102 ASP H . . 3.840 3.027 2.444 3.672 . 0 0 "[ . 1 . 2 . 3 ]" 1
1438 1 101 LEU QB 1 103 LEU QD . . 4.270 2.751 2.050 4.065 . 0 0 "[ . 1 . 2 . 3 ]" 1
1439 1 101 LEU QB 1 113 VAL HB . . 4.500 4.116 2.707 4.563 0.063 17 0 "[ . 1 . 2 . 3 ]" 1
1440 1 101 LEU HB2 1 102 ASP H . . 4.460 4.146 3.691 4.377 . 0 0 "[ . 1 . 2 . 3 ]" 1
1441 1 101 LEU HB3 1 102 ASP H . . 4.460 3.164 2.480 4.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1442 1 101 LEU QD 1 102 ASP H . . 4.260 3.523 2.841 4.044 . 0 0 "[ . 1 . 2 . 3 ]" 1
1443 1 101 LEU QD 1 103 LEU HG . . 5.440 4.195 2.263 5.239 . 0 0 "[ . 1 . 2 . 3 ]" 1
1444 1 101 LEU QD 1 113 VAL H . . 6.360 4.948 3.627 5.410 . 0 0 "[ . 1 . 2 . 3 ]" 1
1445 1 101 LEU QD 1 115 LEU MD1 . . 5.420 2.706 1.995 4.334 . 0 0 "[ . 1 . 2 . 3 ]" 1
1446 1 101 LEU MD1 1 102 ASP H . . 5.500 4.117 2.890 4.982 . 0 0 "[ . 1 . 2 . 3 ]" 1
1447 1 101 LEU MD2 1 102 ASP H . . 5.500 4.034 2.858 4.474 . 0 0 "[ . 1 . 2 . 3 ]" 1
1448 1 101 LEU HG 1 102 ASP H . . 4.880 3.677 2.566 4.945 0.065 31 0 "[ . 1 . 2 . 3 ]" 1
1449 1 101 LEU HG 1 103 LEU QD . . 5.030 4.538 3.807 5.053 0.023 29 0 "[ . 1 . 2 . 3 ]" 1
1450 1 102 ASP H 1 102 ASP HB2 . . 3.560 2.314 1.995 2.790 . 0 0 "[ . 1 . 2 . 3 ]" 1
1451 1 102 ASP H 1 102 ASP HB3 . . 3.620 3.550 3.360 3.652 0.032 17 0 "[ . 1 . 2 . 3 ]" 1
1452 1 102 ASP H 1 103 LEU H . . 5.480 4.416 4.042 4.571 . 0 0 "[ . 1 . 2 . 3 ]" 1
1453 1 102 ASP HA 1 103 LEU H . . 2.960 2.242 2.155 2.419 . 0 0 "[ . 1 . 2 . 3 ]" 1
1454 1 102 ASP HA 1 103 LEU QB . . 4.560 4.311 4.118 4.464 . 0 0 "[ . 1 . 2 . 3 ]" 1
1455 1 102 ASP HA 1 110 VAL QG . . 4.310 3.607 3.100 4.228 . 0 0 "[ . 1 . 2 . 3 ]" 1
1456 1 102 ASP HB2 1 103 LEU H . . 4.990 4.310 3.847 4.615 . 0 0 "[ . 1 . 2 . 3 ]" 1
1457 1 102 ASP HB2 1 110 VAL QG . . 4.190 3.920 3.364 4.262 0.072 6 0 "[ . 1 . 2 . 3 ]" 1
1458 1 102 ASP HB3 1 103 LEU H . . 4.330 3.461 2.734 4.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
1459 1 102 ASP HB3 1 110 VAL QG . . 3.840 2.626 2.114 3.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
1460 1 103 LEU H 1 103 LEU HB2 . . 4.140 2.306 2.133 2.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
1461 1 103 LEU H 1 103 LEU QB . . 3.610 2.279 2.114 2.502 . 0 0 "[ . 1 . 2 . 3 ]" 1
1462 1 103 LEU H 1 103 LEU HB3 . . 4.140 3.577 3.465 3.722 . 0 0 "[ . 1 . 2 . 3 ]" 1
1463 1 103 LEU H 1 103 LEU MD1 . . 4.690 2.463 2.168 3.423 . 0 0 "[ . 1 . 2 . 3 ]" 1
1464 1 103 LEU H 1 103 LEU MD2 . . 4.690 4.023 3.442 4.443 . 0 0 "[ . 1 . 2 . 3 ]" 1
1465 1 103 LEU H 1 103 LEU HG . . 3.920 3.906 3.062 4.006 0.086 25 0 "[ . 1 . 2 . 3 ]" 1
1466 1 103 LEU H 1 104 LEU H . . 5.330 4.455 4.281 4.621 . 0 0 "[ . 1 . 2 . 3 ]" 1
1467 1 103 LEU H 1 105 PHE QD . . 5.330 5.302 5.107 5.426 0.096 1 0 "[ . 1 . 2 . 3 ]" 1
1468 1 103 LEU H 1 105 PHE QE . . 5.320 4.451 3.656 5.040 . 0 0 "[ . 1 . 2 . 3 ]" 1
1469 1 103 LEU H 1 110 VAL HA . . 5.410 4.631 4.278 5.070 . 0 0 "[ . 1 . 2 . 3 ]" 1
1470 1 103 LEU H 1 110 VAL QG . . 4.620 3.493 2.847 3.934 . 0 0 "[ . 1 . 2 . 3 ]" 1
1471 1 103 LEU H 1 111 LEU H . . 4.280 2.893 2.567 3.218 . 0 0 "[ . 1 . 2 . 3 ]" 1
1472 1 103 LEU H 1 111 LEU QB . . 4.080 3.734 3.337 4.102 0.022 13 0 "[ . 1 . 2 . 3 ]" 1
1473 1 103 LEU H 1 112 LYS HA . . 3.770 3.202 2.622 3.814 0.044 8 0 "[ . 1 . 2 . 3 ]" 1
1474 1 103 LEU HA 1 103 LEU QD . . 3.870 2.819 2.417 3.082 . 0 0 "[ . 1 . 2 . 3 ]" 1
1475 1 103 LEU HA 1 104 LEU H . . 3.130 2.183 2.119 2.265 . 0 0 "[ . 1 . 2 . 3 ]" 1
1476 1 103 LEU HA 1 105 PHE QE . . 5.260 4.883 4.460 5.194 . 0 0 "[ . 1 . 2 . 3 ]" 1
1477 1 103 LEU QB 1 104 LEU H . . 3.940 3.284 3.003 3.598 . 0 0 "[ . 1 . 2 . 3 ]" 1
1478 1 103 LEU QB 1 105 PHE QD . . 4.780 3.483 2.936 3.833 . 0 0 "[ . 1 . 2 . 3 ]" 1
1479 1 103 LEU QB 1 105 PHE QE . . 3.860 2.333 2.044 2.649 . 0 0 "[ . 1 . 2 . 3 ]" 1
1480 1 103 LEU QB 1 111 LEU H . . 4.230 3.217 2.705 3.610 . 0 0 "[ . 1 . 2 . 3 ]" 1
1481 1 103 LEU QB 1 111 LEU QB . . 4.490 2.708 2.164 3.390 . 0 0 "[ . 1 . 2 . 3 ]" 1
1482 1 103 LEU HB2 1 104 LEU H . . 4.700 4.359 4.198 4.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
1483 1 103 LEU HB2 1 105 PHE QE . . 4.460 2.536 2.249 2.978 . 0 0 "[ . 1 . 2 . 3 ]" 1
1484 1 103 LEU HB2 1 111 LEU H . . 4.930 3.302 2.744 3.740 . 0 0 "[ . 1 . 2 . 3 ]" 1
1485 1 103 LEU HB3 1 104 LEU H . . 4.700 3.399 3.071 3.773 . 0 0 "[ . 1 . 2 . 3 ]" 1
1486 1 103 LEU HB3 1 105 PHE QE . . 4.460 2.801 2.083 3.162 . 0 0 "[ . 1 . 2 . 3 ]" 1
1487 1 103 LEU HB3 1 111 LEU H . . 4.930 4.459 3.903 4.826 . 0 0 "[ . 1 . 2 . 3 ]" 1
1488 1 103 LEU QD 1 104 LEU H . . 4.400 4.278 3.661 4.416 0.016 23 0 "[ . 1 . 2 . 3 ]" 1
1489 1 103 LEU QD 1 105 PHE QD . . 5.300 4.349 4.011 4.657 . 0 0 "[ . 1 . 2 . 3 ]" 1
1490 1 103 LEU QD 1 105 PHE QE . . 4.260 2.870 2.412 3.277 . 0 0 "[ . 1 . 2 . 3 ]" 1
1491 1 103 LEU HG 1 104 LEU H . . 4.840 4.332 3.831 4.851 0.011 1 0 "[ . 1 . 2 . 3 ]" 1
1492 1 104 LEU H 1 104 LEU HB2 . . 3.640 2.500 2.284 2.567 . 0 0 "[ . 1 . 2 . 3 ]" 1
1493 1 104 LEU H 1 104 LEU HB3 . . 3.640 3.660 3.581 3.688 0.048 16 0 "[ . 1 . 2 . 3 ]" 1
1494 1 104 LEU H 1 104 LEU MD1 . . 4.250 3.849 3.575 4.259 0.009 23 0 "[ . 1 . 2 . 3 ]" 1
1495 1 104 LEU H 1 104 LEU QD . . 3.670 3.213 2.536 3.368 . 0 0 "[ . 1 . 2 . 3 ]" 1
1496 1 104 LEU H 1 104 LEU MD2 . . 4.250 3.462 2.556 3.723 . 0 0 "[ . 1 . 2 . 3 ]" 1
1497 1 104 LEU H 1 104 LEU HG . . 3.770 2.615 2.288 3.796 0.026 23 0 "[ . 1 . 2 . 3 ]" 1
1498 1 104 LEU H 1 105 PHE QD . . 5.540 4.930 4.141 5.330 . 0 0 "[ . 1 . 2 . 3 ]" 1
1499 1 104 LEU HA 1 104 LEU QD . . 3.440 2.201 2.136 2.287 . 0 0 "[ . 1 . 2 . 3 ]" 1
1500 1 104 LEU HA 1 105 PHE H . . 3.090 2.123 2.063 2.184 . 0 0 "[ . 1 . 2 . 3 ]" 1
1501 1 104 LEU HA 1 105 PHE QD . . 4.410 3.873 3.048 4.412 0.002 8 0 "[ . 1 . 2 . 3 ]" 1
1502 1 104 LEU HA 1 110 VAL HA . . 4.680 2.951 2.631 3.247 . 0 0 "[ . 1 . 2 . 3 ]" 1
1503 1 104 LEU HA 1 110 VAL QG . . 5.040 3.023 2.225 3.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
1504 1 104 LEU HB2 1 105 PHE H . . 4.800 4.341 4.143 4.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
1505 1 104 LEU HB3 1 105 PHE H . . 4.430 3.625 3.261 3.873 . 0 0 "[ . 1 . 2 . 3 ]" 1
1506 1 104 LEU QD 1 110 VAL HA . . 4.410 3.226 2.591 3.886 . 0 0 "[ . 1 . 2 . 3 ]" 1
1507 1 105 PHE H 1 105 PHE HB2 . . 3.370 2.398 2.275 2.564 . 0 0 "[ . 1 . 2 . 3 ]" 1
1508 1 105 PHE H 1 105 PHE HB3 . . 4.000 3.638 3.563 3.743 . 0 0 "[ . 1 . 2 . 3 ]" 1
1509 1 105 PHE H 1 105 PHE QD . . 3.900 2.836 2.467 3.371 . 0 0 "[ . 1 . 2 . 3 ]" 1
1510 1 105 PHE H 1 105 PHE QE . . 5.670 4.850 4.653 5.264 . 0 0 "[ . 1 . 2 . 3 ]" 1
1511 1 105 PHE H 1 109 LYS H . . 5.070 3.831 3.455 4.341 . 0 0 "[ . 1 . 2 . 3 ]" 1
1512 1 105 PHE H 1 110 VAL HA . . 4.190 3.289 2.568 4.166 . 0 0 "[ . 1 . 2 . 3 ]" 1
1513 1 105 PHE HA 1 105 PHE QD . . 3.740 2.736 2.367 3.164 . 0 0 "[ . 1 . 2 . 3 ]" 1
1514 1 105 PHE HA 1 105 PHE QE . . 5.220 4.627 4.386 4.860 . 0 0 "[ . 1 . 2 . 3 ]" 1
1515 1 105 PHE HA 1 106 ALA H . . 3.180 2.205 2.088 2.346 . 0 0 "[ . 1 . 2 . 3 ]" 1
1516 1 105 PHE HA 1 106 ALA MB . . 4.560 4.025 3.916 4.142 . 0 0 "[ . 1 . 2 . 3 ]" 1
1517 1 105 PHE HB2 1 106 ALA H . . 4.590 4.118 3.648 4.489 . 0 0 "[ . 1 . 2 . 3 ]" 1
1518 1 105 PHE HB2 1 109 LYS H . . 4.270 3.621 2.873 4.016 . 0 0 "[ . 1 . 2 . 3 ]" 1
1519 1 105 PHE HB2 1 109 LYS HB2 . . 3.540 2.275 1.953 3.451 . 0 0 "[ . 1 . 2 . 3 ]" 1
1520 1 105 PHE HB2 1 109 LYS QB . . 2.720 2.127 1.944 2.361 . 0 0 "[ . 1 . 2 . 3 ]" 1
1521 1 105 PHE HB2 1 109 LYS HB3 . . 3.540 2.742 2.065 3.584 0.044 11 0 "[ . 1 . 2 . 3 ]" 1
1522 1 105 PHE HB2 1 109 LYS QD . . 4.660 3.702 2.863 4.268 . 0 0 "[ . 1 . 2 . 3 ]" 1
1523 1 105 PHE HB3 1 106 ALA H . . 3.820 3.121 2.473 3.767 . 0 0 "[ . 1 . 2 . 3 ]" 1
1524 1 105 PHE HB3 1 106 ALA MB . . 5.500 3.957 3.380 4.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1525 1 105 PHE HB3 1 109 LYS H . . 4.730 4.640 4.059 4.780 0.050 4 0 "[ . 1 . 2 . 3 ]" 1
1526 1 105 PHE HB3 1 109 LYS QB . . 4.180 3.026 2.445 3.617 . 0 0 "[ . 1 . 2 . 3 ]" 1
1527 1 105 PHE HB3 1 109 LYS QD . . 4.400 3.769 2.867 4.420 0.020 29 0 "[ . 1 . 2 . 3 ]" 1
1528 1 105 PHE QD 1 106 ALA H . . 4.740 3.908 3.602 4.354 . 0 0 "[ . 1 . 2 . 3 ]" 1
1529 1 105 PHE QD 1 109 LYS HA . . 6.110 5.131 4.649 5.570 . 0 0 "[ . 1 . 2 . 3 ]" 1
1530 1 105 PHE QD 1 109 LYS HB2 . . 4.730 3.929 2.987 4.758 0.028 28 0 "[ . 1 . 2 . 3 ]" 1
1531 1 105 PHE QD 1 109 LYS QB . . 3.930 3.173 2.809 3.468 . 0 0 "[ . 1 . 2 . 3 ]" 1
1532 1 105 PHE QD 1 109 LYS HB3 . . 4.730 3.381 2.912 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
1533 1 105 PHE QD 1 109 LYS QG . . 5.400 5.078 3.687 5.409 0.009 8 0 "[ . 1 . 2 . 3 ]" 1
1534 1 105 PHE QD 1 110 VAL H . . 5.500 4.637 3.788 5.140 . 0 0 "[ . 1 . 2 . 3 ]" 1
1535 1 105 PHE QD 1 110 VAL HA . . 4.210 3.237 2.363 4.088 . 0 0 "[ . 1 . 2 . 3 ]" 1
1536 1 105 PHE QD 1 110 VAL QG . . 6.020 4.407 3.635 5.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
1537 1 105 PHE QD 1 111 LEU H . . 4.530 3.649 3.119 4.249 . 0 0 "[ . 1 . 2 . 3 ]" 1
1538 1 105 PHE QD 1 111 LEU QB . . 4.610 3.327 2.641 4.143 . 0 0 "[ . 1 . 2 . 3 ]" 1
1539 1 105 PHE QD 1 111 LEU QD . . 4.280 4.042 2.364 4.306 0.026 3 0 "[ . 1 . 2 . 3 ]" 1
1540 1 105 PHE QE 1 110 VAL HA . . 5.030 4.632 3.179 5.070 0.040 1 0 "[ . 1 . 2 . 3 ]" 1
1541 1 105 PHE QE 1 111 LEU H . . 4.710 3.726 2.570 4.320 . 0 0 "[ . 1 . 2 . 3 ]" 1
1542 1 105 PHE QE 1 111 LEU HB2 . . 3.950 3.016 2.151 3.845 . 0 0 "[ . 1 . 2 . 3 ]" 1
1543 1 105 PHE QE 1 111 LEU QB . . 3.360 2.216 2.005 2.717 . 0 0 "[ . 1 . 2 . 3 ]" 1
1544 1 105 PHE QE 1 111 LEU HB3 . . 3.950 2.508 2.071 3.926 . 0 0 "[ . 1 . 2 . 3 ]" 1
1545 1 105 PHE QE 1 111 LEU QD . . 4.330 2.861 2.305 3.859 . 0 0 "[ . 1 . 2 . 3 ]" 1
1546 1 106 ALA H 1 106 ALA MB . . 3.640 2.407 2.182 2.768 . 0 0 "[ . 1 . 2 . 3 ]" 1
1547 1 106 ALA MB 1 108 GLY H . . 5.500 4.400 2.956 5.507 0.007 1 0 "[ . 1 . 2 . 3 ]" 1
1548 1 108 GLY H 1 109 LYS H . . 3.810 2.842 2.125 3.127 . 0 0 "[ . 1 . 2 . 3 ]" 1
1549 1 109 LYS H 1 109 LYS HB2 . . 3.840 2.463 2.138 2.874 . 0 0 "[ . 1 . 2 . 3 ]" 1
1550 1 109 LYS H 1 109 LYS QB . . 3.030 2.422 2.093 2.803 . 0 0 "[ . 1 . 2 . 3 ]" 1
1551 1 109 LYS H 1 109 LYS HB3 . . 3.840 3.643 2.478 3.895 0.055 11 0 "[ . 1 . 2 . 3 ]" 1
1552 1 109 LYS H 1 109 LYS HG2 . . 4.590 4.365 4.049 4.613 0.023 11 0 "[ . 1 . 2 . 3 ]" 1
1553 1 109 LYS H 1 109 LYS QG . . 3.800 3.178 2.769 3.884 0.084 28 0 "[ . 1 . 2 . 3 ]" 1
1554 1 109 LYS H 1 109 LYS HG3 . . 4.590 3.275 2.819 4.290 . 0 0 "[ . 1 . 2 . 3 ]" 1
1555 1 109 LYS H 1 110 VAL H . . 4.890 4.367 4.144 4.540 . 0 0 "[ . 1 . 2 . 3 ]" 1
1556 1 109 LYS H 1 110 VAL QG . . 5.440 4.573 3.677 5.337 . 0 0 "[ . 1 . 2 . 3 ]" 1
1557 1 109 LYS HA 1 109 LYS QE . . 4.720 4.525 3.967 4.755 0.035 17 0 "[ . 1 . 2 . 3 ]" 1
1558 1 109 LYS HA 1 109 LYS HG2 . . 3.890 2.628 2.339 3.587 . 0 0 "[ . 1 . 2 . 3 ]" 1
1559 1 109 LYS HA 1 109 LYS HG3 . . 3.890 2.639 2.478 2.855 . 0 0 "[ . 1 . 2 . 3 ]" 1
1560 1 109 LYS HA 1 110 VAL H . . 2.700 2.132 2.047 2.243 . 0 0 "[ . 1 . 2 . 3 ]" 1
1561 1 109 LYS HA 1 110 VAL HA . . 4.460 4.442 4.360 4.479 0.019 27 0 "[ . 1 . 2 . 3 ]" 1
1562 1 109 LYS HA 1 110 VAL QG . . 5.290 3.711 3.482 3.932 . 0 0 "[ . 1 . 2 . 3 ]" 1
1563 1 109 LYS QB 1 110 VAL H . . 3.580 3.201 2.420 3.641 0.061 28 0 "[ . 1 . 2 . 3 ]" 1
1564 1 109 LYS QE 1 109 LYS QG . . 3.180 2.270 2.040 2.904 . 0 0 "[ . 1 . 2 . 3 ]" 1
1565 1 109 LYS QG 1 110 VAL H . . 3.880 3.791 2.719 3.964 0.084 2 0 "[ . 1 . 2 . 3 ]" 1
1566 1 109 LYS QG 1 110 VAL HA . . 5.710 5.639 4.175 5.778 0.068 20 0 "[ . 1 . 2 . 3 ]" 1
1567 1 109 LYS HG2 1 110 VAL H . . 4.620 4.056 2.895 4.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1568 1 109 LYS HG3 1 110 VAL H . . 4.620 4.588 3.301 4.689 0.069 15 0 "[ . 1 . 2 . 3 ]" 1
1569 1 110 VAL H 1 110 VAL HB . . 3.130 2.928 2.563 3.191 0.061 27 0 "[ . 1 . 2 . 3 ]" 1
1570 1 110 VAL H 1 110 VAL MG1 . . 4.490 3.181 2.030 4.055 . 0 0 "[ . 1 . 2 . 3 ]" 1
1571 1 110 VAL H 1 110 VAL QG . . 3.670 2.566 2.023 3.128 . 0 0 "[ . 1 . 2 . 3 ]" 1
1572 1 110 VAL H 1 110 VAL MG2 . . 4.490 3.395 2.346 4.039 . 0 0 "[ . 1 . 2 . 3 ]" 1
1573 1 110 VAL H 1 111 LEU H . . 4.740 4.410 4.223 4.664 . 0 0 "[ . 1 . 2 . 3 ]" 1
1574 1 110 VAL HA 1 111 LEU H . . 3.070 2.229 2.093 2.355 . 0 0 "[ . 1 . 2 . 3 ]" 1
1575 1 110 VAL HA 1 111 LEU QB . . 4.500 3.962 3.664 4.391 . 0 0 "[ . 1 . 2 . 3 ]" 1
1576 1 110 VAL QG 1 111 LEU H . . 3.880 2.397 2.182 2.854 . 0 0 "[ . 1 . 2 . 3 ]" 1
1577 1 110 VAL QG 1 111 LEU HA . . 4.480 3.423 3.086 3.720 . 0 0 "[ . 1 . 2 . 3 ]" 1
1578 1 110 VAL MG1 1 111 LEU H . . 4.930 3.078 2.196 4.297 . 0 0 "[ . 1 . 2 . 3 ]" 1
1579 1 110 VAL MG2 1 111 LEU H . . 4.930 3.264 2.200 4.111 . 0 0 "[ . 1 . 2 . 3 ]" 1
1580 1 111 LEU H 1 111 LEU HB2 . . 3.970 3.124 2.434 3.418 . 0 0 "[ . 1 . 2 . 3 ]" 1
1581 1 111 LEU H 1 111 LEU HB3 . . 3.970 2.969 2.604 3.839 . 0 0 "[ . 1 . 2 . 3 ]" 1
1582 1 111 LEU HA 1 112 LYS H . . 2.890 2.266 2.111 2.735 . 0 0 "[ . 1 . 2 . 3 ]" 1
1583 1 111 LEU QB 1 112 LYS H . . 4.090 3.659 2.258 4.017 . 0 0 "[ . 1 . 2 . 3 ]" 1
1584 1 111 LEU HB2 1 112 LYS H . . 4.940 4.323 3.646 4.569 . 0 0 "[ . 1 . 2 . 3 ]" 1
1585 1 111 LEU HB3 1 112 LYS H . . 4.940 4.008 2.280 4.505 . 0 0 "[ . 1 . 2 . 3 ]" 1
1586 1 111 LEU QD 1 112 LYS H . . 4.200 2.884 2.023 4.227 0.027 2 0 "[ . 1 . 2 . 3 ]" 1
1587 1 111 LEU MD1 1 112 LYS H . . 5.020 3.676 2.030 5.045 0.025 4 0 "[ . 1 . 2 . 3 ]" 1
1588 1 111 LEU MD2 1 112 LYS H . . 5.020 3.845 2.502 5.030 0.010 30 0 "[ . 1 . 2 . 3 ]" 1
1589 1 111 LEU HG 1 112 LYS H . . 4.560 3.414 1.851 4.624 0.064 24 0 "[ . 1 . 2 . 3 ]" 1
1590 1 112 LYS H 1 112 LYS HB2 . . 4.080 2.945 2.000 4.074 . 0 0 "[ . 1 . 2 . 3 ]" 1
1591 1 112 LYS H 1 112 LYS QB . . 3.450 2.521 1.969 3.279 . 0 0 "[ . 1 . 2 . 3 ]" 1
1592 1 112 LYS H 1 112 LYS HB3 . . 4.080 2.836 2.307 3.862 . 0 0 "[ . 1 . 2 . 3 ]" 1
1593 1 112 LYS H 1 112 LYS QE . . 5.500 4.771 3.756 5.593 0.093 29 0 "[ . 1 . 2 . 3 ]" 1
1594 1 112 LYS H 1 113 VAL H . . 4.870 4.506 4.269 4.670 . 0 0 "[ . 1 . 2 . 3 ]" 1
1595 1 112 LYS HA 1 112 LYS HG2 . . 4.240 3.294 2.229 3.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
1596 1 112 LYS HA 1 112 LYS QG . . 3.730 2.601 2.116 3.427 . 0 0 "[ . 1 . 2 . 3 ]" 1
1597 1 112 LYS HA 1 112 LYS HG3 . . 4.240 2.817 2.162 3.835 . 0 0 "[ . 1 . 2 . 3 ]" 1
1598 1 112 LYS HA 1 113 VAL H . . 2.930 2.179 2.097 2.317 . 0 0 "[ . 1 . 2 . 3 ]" 1
1599 1 112 LYS QB 1 113 VAL H . . 4.010 3.350 2.373 3.957 . 0 0 "[ . 1 . 2 . 3 ]" 1
1600 1 112 LYS HB2 1 113 VAL H . . 4.620 3.811 2.398 4.539 . 0 0 "[ . 1 . 2 . 3 ]" 1
1601 1 112 LYS HB3 1 113 VAL H . . 4.620 3.937 2.743 4.399 . 0 0 "[ . 1 . 2 . 3 ]" 1
1602 1 112 LYS QG 1 113 VAL H . . 4.270 2.980 2.337 4.107 . 0 0 "[ . 1 . 2 . 3 ]" 1
1603 1 112 LYS HG2 1 113 VAL H . . 4.880 3.627 2.434 4.960 0.080 10 0 "[ . 1 . 2 . 3 ]" 1
1604 1 112 LYS HG3 1 113 VAL H . . 4.880 3.346 2.415 4.877 . 0 0 "[ . 1 . 2 . 3 ]" 1
1605 1 113 VAL H 1 113 VAL MG1 . . 4.600 3.762 2.779 4.123 . 0 0 "[ . 1 . 2 . 3 ]" 1
1606 1 113 VAL H 1 113 VAL MG2 . . 3.850 2.630 2.068 3.006 . 0 0 "[ . 1 . 2 . 3 ]" 1
1607 1 113 VAL H 1 114 VAL H . . 4.960 4.456 4.345 4.597 . 0 0 "[ . 1 . 2 . 3 ]" 1
1608 1 113 VAL HA 1 114 VAL H . . 3.040 2.414 2.136 2.611 . 0 0 "[ . 1 . 2 . 3 ]" 1
1609 1 113 VAL HB 1 114 VAL H . . 3.280 3.088 2.312 3.414 0.134 28 0 "[ . 1 . 2 . 3 ]" 1
1610 1 113 VAL MG1 1 114 VAL H . . 5.590 2.383 1.775 3.870 . 0 0 "[ . 1 . 2 . 3 ]" 1
1611 1 114 VAL H 1 114 VAL HB . . 3.350 2.910 2.467 3.383 0.033 3 0 "[ . 1 . 2 . 3 ]" 1
1612 1 114 VAL H 1 114 VAL QG . . 3.750 2.599 2.060 3.086 . 0 0 "[ . 1 . 2 . 3 ]" 1
1613 1 114 VAL H 1 115 LEU H . . 5.320 4.388 4.143 4.546 . 0 0 "[ . 1 . 2 . 3 ]" 1
1614 1 114 VAL HB 1 115 LEU H . . 4.800 4.049 3.800 4.238 . 0 0 "[ . 1 . 2 . 3 ]" 1
1615 1 114 VAL QG 1 115 LEU H . . 4.640 2.420 2.117 2.780 . 0 0 "[ . 1 . 2 . 3 ]" 1
1616 1 114 VAL QG 1 116 PRO QD . . 5.280 4.047 2.684 4.604 . 0 0 "[ . 1 . 2 . 3 ]" 1
1617 1 115 LEU H 1 115 LEU HB3 . . 4.080 3.684 3.340 3.868 . 0 0 "[ . 1 . 2 . 3 ]" 1
1618 1 115 LEU H 1 115 LEU MD1 . . 5.500 3.773 2.516 4.405 . 0 0 "[ . 1 . 2 . 3 ]" 1
1619 1 115 LEU H 1 115 LEU HG . . 4.980 3.362 2.553 4.512 . 0 0 "[ . 1 . 2 . 3 ]" 1
1620 1 115 LEU HA 1 115 LEU MD2 . . 3.520 3.286 2.192 3.587 0.067 29 0 "[ . 1 . 2 . 3 ]" 1
1621 1 115 LEU HA 1 116 PRO HD2 . . 3.850 2.202 2.011 2.360 . 0 0 "[ . 1 . 2 . 3 ]" 1
1622 1 115 LEU HA 1 116 PRO HD3 . . 3.850 2.573 2.330 3.221 . 0 0 "[ . 1 . 2 . 3 ]" 1
1623 1 115 LEU HA 1 116 PRO HG2 . . 4.630 4.418 3.947 4.543 . 0 0 "[ . 1 . 2 . 3 ]" 1
1624 1 115 LEU HA 1 116 PRO QG . . 4.040 4.007 3.743 4.051 0.011 3 0 "[ . 1 . 2 . 3 ]" 1
1625 1 115 LEU HA 1 116 PRO HG3 . . 4.630 4.596 4.499 4.648 0.018 26 0 "[ . 1 . 2 . 3 ]" 1
1626 1 116 PRO HA 1 117 VAL H . . 2.400 2.289 2.163 2.417 0.017 30 0 "[ . 1 . 2 . 3 ]" 1
1627 1 116 PRO HA 1 117 VAL MG2 . . 4.520 3.603 3.283 4.021 . 0 0 "[ . 1 . 2 . 3 ]" 1
1628 1 117 VAL H 1 117 VAL MG2 . . 4.090 2.486 2.326 2.852 . 0 0 "[ . 1 . 2 . 3 ]" 1
1629 1 117 VAL H 1 118 GLU H . . 5.500 4.448 3.775 4.619 . 0 0 "[ . 1 . 2 . 3 ]" 1
1630 1 117 VAL MG1 1 118 GLU H . . 4.990 2.716 2.192 3.658 . 0 0 "[ . 1 . 2 . 3 ]" 1
1631 1 118 GLU H 1 118 GLU QB . . 3.900 2.673 2.133 3.411 . 0 0 "[ . 1 . 2 . 3 ]" 1
1632 1 118 GLU H 1 118 GLU QG . . 3.930 3.392 2.277 4.079 0.149 25 0 "[ . 1 . 2 . 3 ]" 1
1633 1 119 ALA H 1 120 ARG H . . 4.700 3.835 3.087 4.582 . 0 0 "[ . 1 . 2 . 3 ]" 1
1634 1 119 ALA HA 1 120 ARG H . . 2.900 2.366 2.056 2.674 . 0 0 "[ . 1 . 2 . 3 ]" 1
1635 1 119 ALA MB 1 120 ARG H . . 4.220 3.521 2.201 3.789 . 0 0 "[ . 1 . 2 . 3 ]" 1
1636 1 120 ARG H 1 120 ARG QB . . 3.590 2.822 2.133 3.558 . 0 0 "[ . 1 . 2 . 3 ]" 1
1637 1 120 ARG H 1 120 ARG QD . . 4.920 4.600 2.895 5.677 0.757 20 1 "[ . 1 . + . 3 ]" 1
1638 1 120 ARG H 1 120 ARG HG2 . . 4.620 4.138 2.537 5.022 0.402 15 0 "[ . 1 . 2 . 3 ]" 1
1639 1 120 ARG H 1 120 ARG QG . . 3.990 3.590 2.473 4.355 0.365 5 0 "[ . 1 . 2 . 3 ]" 1
1640 1 120 ARG H 1 120 ARG HG3 . . 4.620 4.178 2.781 5.168 0.548 19 2 "[ - 1 . +2 . 3 ]" 1
1641 1 120 ARG HA 1 120 ARG QB . . 2.380 2.324 2.146 2.485 0.105 6 0 "[ . 1 . 2 . 3 ]" 1
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