NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
645612 |
6qbi   |
34344 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6qbi
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 2242
_Distance_constraint_stats_list.Viol_count 2360
_Distance_constraint_stats_list.Viol_total 3073.691
_Distance_constraint_stats_list.Viol_max 0.771
_Distance_constraint_stats_list.Viol_rms 0.0204
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0034
_Distance_constraint_stats_list.Viol_average_violations_only 0.0651
_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 4 GLY 0.528 0.161 20 0 "[ . 1 . 2]"
1 5 PRO 2.103 0.194 7 0 "[ . 1 . 2]"
1 6 LYS 7.860 0.243 2 0 "[ . 1 . 2]"
1 7 SER 2.487 0.198 12 0 "[ . 1 . 2]"
1 8 LYS 0.854 0.128 5 0 "[ . 1 . 2]"
1 9 GLU 0.366 0.160 6 0 "[ . 1 . 2]"
1 10 GLU 6.560 0.326 10 0 "[ . 1 . 2]"
1 11 LEU 2.413 0.148 18 0 "[ . 1 . 2]"
1 12 LEU 1.262 0.230 1 0 "[ . 1 . 2]"
1 13 ARG 2.479 0.230 1 0 "[ . 1 . 2]"
1 14 GLU 2.888 0.158 4 0 "[ . 1 . 2]"
1 15 LYS 4.876 0.187 19 0 "[ . 1 . 2]"
1 16 LEU 1.053 0.139 20 0 "[ . 1 . 2]"
1 17 SER 1.558 0.126 3 0 "[ . 1 . 2]"
1 18 GLU 2.524 0.182 5 0 "[ . 1 . 2]"
1 19 ASP 3.890 0.182 5 0 "[ . 1 . 2]"
1 20 GLN 2.376 0.213 2 0 "[ . 1 . 2]"
1 21 LYS 0.596 0.086 3 0 "[ . 1 . 2]"
1 22 THR 0.054 0.026 8 0 "[ . 1 . 2]"
1 23 HIS 3.371 0.136 20 0 "[ . 1 . 2]"
1 24 LEU 2.593 0.178 12 0 "[ . 1 . 2]"
1 25 ASP 3.553 0.169 17 0 "[ . 1 . 2]"
1 26 TRP 3.061 0.116 8 0 "[ . 1 . 2]"
1 27 LEU 2.033 0.291 15 0 "[ . 1 . 2]"
1 28 LYS 3.249 0.246 1 0 "[ . 1 . 2]"
1 29 GLU 1.656 0.246 1 0 "[ . 1 . 2]"
1 30 ALA 0.288 0.074 1 0 "[ . 1 . 2]"
1 31 LEU 5.161 0.291 15 0 "[ . 1 . 2]"
1 32 GLY 0.076 0.054 10 0 "[ . 1 . 2]"
1 33 ASN 1.133 0.143 5 0 "[ . 1 . 2]"
1 34 ASP 1.104 0.103 17 0 "[ . 1 . 2]"
1 35 GLY 1.171 0.103 17 0 "[ . 1 . 2]"
1 36 GLU 3.228 0.143 5 0 "[ . 1 . 2]"
1 37 PHE 5.573 0.169 17 0 "[ . 1 . 2]"
1 38 ASP 5.439 0.319 18 0 "[ . 1 . 2]"
1 39 LYS 6.396 0.319 18 0 "[ . 1 . 2]"
1 40 PHE 4.258 0.234 11 0 "[ . 1 . 2]"
1 41 LEU 4.045 0.396 14 0 "[ . 1 . 2]"
1 42 GLY 0.668 0.129 5 0 "[ . 1 . 2]"
1 43 TYR 7.811 0.230 13 0 "[ . 1 . 2]"
1 44 ASP 8.276 0.771 20 1 "[ . 1 . +]"
1 45 GLU 3.889 0.771 20 1 "[ . 1 . +]"
1 46 SER 1.217 0.119 15 0 "[ . 1 . 2]"
1 47 LYS 8.630 0.252 16 0 "[ . 1 . 2]"
1 48 ILE 5.464 0.152 16 0 "[ . 1 . 2]"
1 49 LYS 4.475 0.345 6 0 "[ . 1 . 2]"
1 50 THR 0.720 0.046 7 0 "[ . 1 . 2]"
1 51 ALA 1.314 0.117 9 0 "[ . 1 . 2]"
1 52 LEU 1.915 0.147 19 0 "[ . 1 . 2]"
1 53 ASP 0.147 0.052 6 0 "[ . 1 . 2]"
1 54 HIS 3.824 0.162 17 0 "[ . 1 . 2]"
1 55 ILE 3.191 0.134 17 0 "[ . 1 . 2]"
1 56 LYS 3.144 0.141 18 0 "[ . 1 . 2]"
1 57 SER 1.238 0.207 7 0 "[ . 1 . 2]"
1 58 GLU 4.048 0.375 15 0 "[ . 1 . 2]"
1 59 LEU 2.368 0.112 8 0 "[ . 1 . 2]"
1 60 ASP 1.281 0.101 6 0 "[ . 1 . 2]"
1 61 LYS 2.850 0.375 15 0 "[ . 1 . 2]"
1 62 CYS 0.689 0.111 1 0 "[ . 1 . 2]"
1 63 ASN 2.304 0.212 7 0 "[ . 1 . 2]"
1 64 GLY 1.697 0.212 7 0 "[ . 1 . 2]"
1 65 ASN 0.404 0.051 11 0 "[ . 1 . 2]"
1 66 ASP 0.305 0.051 11 0 "[ . 1 . 2]"
1 67 ALA 1.897 0.173 12 0 "[ . 1 . 2]"
1 68 ASP 1.891 0.173 12 0 "[ . 1 . 2]"
1 69 GLN 2.164 0.137 4 0 "[ . 1 . 2]"
1 70 GLN 0.888 0.104 10 0 "[ . 1 . 2]"
1 71 LYS 0.344 0.080 13 0 "[ . 1 . 2]"
1 72 THR 1.350 0.090 15 0 "[ . 1 . 2]"
1 73 THR 0.625 0.073 7 0 "[ . 1 . 2]"
1 74 PHE 3.240 0.112 8 0 "[ . 1 . 2]"
1 75 LYS 1.873 0.074 1 0 "[ . 1 . 2]"
1 76 GLN 7.445 0.280 12 0 "[ . 1 . 2]"
1 77 THR 4.183 0.126 8 0 "[ . 1 . 2]"
1 78 VAL 3.351 0.149 20 0 "[ . 1 . 2]"
1 79 GLN 3.869 0.253 17 0 "[ . 1 . 2]"
1 80 GLY 1.306 0.131 10 0 "[ . 1 . 2]"
1 81 ALA 4.715 0.140 18 0 "[ . 1 . 2]"
1 82 LEU 9.756 0.419 19 0 "[ . 1 . 2]"
1 83 SER 2.571 0.366 10 0 "[ . 1 . 2]"
1 84 GLY 0.205 0.061 15 0 "[ . 1 . 2]"
1 85 GLY 2.992 0.183 8 0 "[ . 1 . 2]"
1 86 ILE 3.412 0.183 8 0 "[ . 1 . 2]"
1 87 ASP 1.003 0.235 14 0 "[ . 1 . 2]"
1 88 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 PHE 12.126 0.419 19 0 "[ . 1 . 2]"
1 90 GLY 1.898 0.160 4 0 "[ . 1 . 2]"
1 91 SER 1.072 0.162 17 0 "[ . 1 . 2]"
1 92 ASN 0.742 0.089 17 0 "[ . 1 . 2]"
1 93 ASN 1.979 0.126 8 0 "[ . 1 . 2]"
1 94 ALA 0.455 0.109 19 0 "[ . 1 . 2]"
1 95 VAL 2.704 0.159 10 0 "[ . 1 . 2]"
1 96 THR 2.779 0.200 16 0 "[ . 1 . 2]"
1 97 THR 2.309 0.159 10 0 "[ . 1 . 2]"
1 98 CYS 0.995 0.120 1 0 "[ . 1 . 2]"
1 99 GLY 0.761 0.147 7 0 "[ . 1 . 2]"
1 100 ASN 0.851 0.147 7 0 "[ . 1 . 2]"
1 101 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 GLY H 1 5 PRO QD . . 5.330 4.225 3.333 4.405 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLY QA 1 5 PRO QB . . 4.820 4.311 4.194 4.428 . 0 0 "[ . 1 . 2]" 1
3 1 4 GLY HA2 1 5 PRO QD . . 2.970 2.548 1.749 3.082 0.112 20 0 "[ . 1 . 2]" 1
4 1 4 GLY HA2 1 5 PRO QG . . 4.750 4.312 3.646 4.911 0.161 20 0 "[ . 1 . 2]" 1
5 1 4 GLY HA3 1 5 PRO QD . . 2.970 2.175 1.781 3.039 0.069 6 0 "[ . 1 . 2]" 1
6 1 4 GLY HA3 1 5 PRO QG . . 4.750 4.065 3.694 4.832 0.082 6 0 "[ . 1 . 2]" 1
7 1 5 PRO HA 1 6 LYS H . . 2.610 2.470 2.172 2.701 0.091 17 0 "[ . 1 . 2]" 1
8 1 5 PRO QB 1 6 LYS H . . 3.480 2.452 1.825 3.086 . 0 0 "[ . 1 . 2]" 1
9 1 5 PRO HB2 1 6 LYS H . . 4.030 2.618 1.836 3.581 . 0 0 "[ . 1 . 2]" 1
10 1 5 PRO HB3 1 6 LYS H . . 4.030 3.251 2.942 3.863 . 0 0 "[ . 1 . 2]" 1
11 1 5 PRO QD 1 6 LYS H . . 4.750 4.766 4.606 4.944 0.194 7 0 "[ . 1 . 2]" 1
12 1 5 PRO QG 1 6 LYS H . . 4.530 4.146 3.470 4.643 0.113 14 0 "[ . 1 . 2]" 1
13 1 6 LYS H 1 6 LYS HB2 . . 3.520 3.241 2.242 3.596 0.076 18 0 "[ . 1 . 2]" 1
14 1 6 LYS H 1 6 LYS QB . . 2.910 2.537 2.218 2.867 . 0 0 "[ . 1 . 2]" 1
15 1 6 LYS H 1 6 LYS HB3 . . 3.520 2.937 2.455 3.608 0.088 8 0 "[ . 1 . 2]" 1
16 1 6 LYS H 1 6 LYS QD . . 4.170 3.709 2.430 4.252 0.082 7 0 "[ . 1 . 2]" 1
17 1 6 LYS H 1 6 LYS QE . . 5.030 4.422 3.726 4.916 . 0 0 "[ . 1 . 2]" 1
18 1 6 LYS H 1 6 LYS HG2 . . 4.060 2.393 1.793 4.135 0.075 12 0 "[ . 1 . 2]" 1
19 1 6 LYS H 1 6 LYS QG . . 3.350 2.098 1.767 2.876 . 0 0 "[ . 1 . 2]" 1
20 1 6 LYS H 1 6 LYS HG3 . . 4.060 3.027 1.774 3.478 . 0 0 "[ . 1 . 2]" 1
21 1 6 LYS H 1 7 SER H . . 4.630 4.543 4.347 4.613 . 0 0 "[ . 1 . 2]" 1
22 1 6 LYS H 1 11 LEU QD . . 5.440 4.840 3.973 5.452 0.012 3 0 "[ . 1 . 2]" 1
23 1 6 LYS HA 1 6 LYS QD . . 4.110 3.951 2.111 4.322 0.212 11 0 "[ . 1 . 2]" 1
24 1 6 LYS HA 1 6 LYS HG2 . . 3.920 3.409 2.462 4.163 0.243 2 0 "[ . 1 . 2]" 1
25 1 6 LYS HA 1 6 LYS QG . . 3.430 3.094 2.306 3.359 . 0 0 "[ . 1 . 2]" 1
26 1 6 LYS HA 1 6 LYS HG3 . . 3.920 3.647 2.570 3.895 . 0 0 "[ . 1 . 2]" 1
27 1 6 LYS HA 1 7 SER H . . 2.670 2.177 2.058 2.395 . 0 0 "[ . 1 . 2]" 1
28 1 6 LYS HA 1 10 GLU HB2 . . 4.210 3.411 2.771 3.967 . 0 0 "[ . 1 . 2]" 1
29 1 6 LYS HA 1 10 GLU QB . . 3.650 3.149 2.535 3.534 . 0 0 "[ . 1 . 2]" 1
30 1 6 LYS HA 1 10 GLU HB3 . . 4.210 3.785 2.886 4.247 0.037 16 0 "[ . 1 . 2]" 1
31 1 6 LYS HA 1 10 GLU QG . . 4.540 3.081 1.806 4.294 . 0 0 "[ . 1 . 2]" 1
32 1 6 LYS HA 1 11 LEU QD . . 4.970 4.834 4.104 5.118 0.148 18 0 "[ . 1 . 2]" 1
33 1 6 LYS QB 1 6 LYS QE . . 4.110 2.606 1.860 3.608 . 0 0 "[ . 1 . 2]" 1
34 1 6 LYS QB 1 10 GLU QB . . 3.170 2.118 1.732 2.866 . 0 0 "[ . 1 . 2]" 1
35 1 6 LYS QB 1 11 LEU QD . . 3.460 2.999 1.972 3.504 0.044 11 0 "[ . 1 . 2]" 1
36 1 6 LYS HB2 1 6 LYS QE . . 4.670 2.966 1.886 3.968 . 0 0 "[ . 1 . 2]" 1
37 1 6 LYS HB2 1 7 SER H . . 4.200 3.340 2.625 4.346 0.146 13 0 "[ . 1 . 2]" 1
38 1 6 LYS HB3 1 6 LYS QE . . 4.670 3.166 1.895 4.209 . 0 0 "[ . 1 . 2]" 1
39 1 6 LYS HB3 1 7 SER H . . 4.200 3.736 2.481 4.215 0.015 14 0 "[ . 1 . 2]" 1
40 1 6 LYS QD 1 7 SER H . . 5.190 4.944 3.574 5.388 0.198 12 0 "[ . 1 . 2]" 1
41 1 6 LYS QD 1 11 LEU QD . . 3.690 2.947 1.793 3.740 0.050 16 0 "[ . 1 . 2]" 1
42 1 6 LYS QE 1 6 LYS HG2 . . 3.890 2.944 2.315 3.498 . 0 0 "[ . 1 . 2]" 1
43 1 6 LYS QE 1 6 LYS QG . . 3.350 2.335 2.122 2.877 . 0 0 "[ . 1 . 2]" 1
44 1 6 LYS QE 1 6 LYS HG3 . . 3.890 2.558 2.302 3.317 . 0 0 "[ . 1 . 2]" 1
45 1 6 LYS QE 1 10 GLU HB2 . . 5.500 4.633 2.998 5.577 0.077 3 0 "[ . 1 . 2]" 1
46 1 6 LYS QE 1 10 GLU HB3 . . 5.500 3.852 1.780 5.555 0.055 14 0 "[ . 1 . 2]" 1
47 1 6 LYS QE 1 11 LEU MD1 . . 5.340 3.997 2.011 4.785 . 0 0 "[ . 1 . 2]" 1
48 1 6 LYS QE 1 11 LEU QD . . 4.100 2.090 1.754 2.691 . 0 0 "[ . 1 . 2]" 1
49 1 6 LYS QE 1 11 LEU MD2 . . 5.340 2.114 1.757 2.716 . 0 0 "[ . 1 . 2]" 1
50 1 6 LYS QG 1 7 SER H . . 4.540 4.134 3.621 4.546 0.006 16 0 "[ . 1 . 2]" 1
51 1 6 LYS QG 1 10 GLU QB . . 4.260 3.634 2.692 4.349 0.089 2 0 "[ . 1 . 2]" 1
52 1 6 LYS QG 1 11 LEU QD . . 4.360 2.843 1.978 4.093 . 0 0 "[ . 1 . 2]" 1
53 1 7 SER H 1 7 SER QB . . 3.260 2.521 2.264 3.029 . 0 0 "[ . 1 . 2]" 1
54 1 7 SER H 1 10 GLU H . . 4.780 3.335 2.822 3.899 . 0 0 "[ . 1 . 2]" 1
55 1 7 SER H 1 10 GLU HB2 . . 3.940 2.367 1.854 2.728 . 0 0 "[ . 1 . 2]" 1
56 1 7 SER H 1 10 GLU QB . . 3.170 2.301 1.793 2.679 . 0 0 "[ . 1 . 2]" 1
57 1 7 SER H 1 10 GLU HB3 . . 3.940 3.420 2.133 3.989 0.049 1 0 "[ . 1 . 2]" 1
58 1 7 SER H 1 10 GLU HG2 . . 4.420 3.526 2.600 4.440 0.020 8 0 "[ . 1 . 2]" 1
59 1 7 SER H 1 10 GLU HG3 . . 4.420 3.560 2.275 4.482 0.062 20 0 "[ . 1 . 2]" 1
60 1 7 SER HA 1 8 LYS H . . 2.780 2.619 2.377 2.864 0.084 6 0 "[ . 1 . 2]" 1
61 1 7 SER HA 1 8 LYS HA . . 4.640 4.315 4.188 4.412 . 0 0 "[ . 1 . 2]" 1
62 1 7 SER HA 1 8 LYS QB . . 5.340 4.839 4.646 5.056 . 0 0 "[ . 1 . 2]" 1
63 1 7 SER HA 1 10 GLU H . . 4.540 4.550 4.295 4.693 0.153 6 0 "[ . 1 . 2]" 1
64 1 7 SER HA 1 11 LEU QD . . 4.860 4.092 3.309 4.813 . 0 0 "[ . 1 . 2]" 1
65 1 7 SER QB 1 8 LYS H . . 3.880 2.380 1.818 3.344 . 0 0 "[ . 1 . 2]" 1
66 1 7 SER QB 1 9 GLU QB . . 5.110 4.126 3.510 5.029 . 0 0 "[ . 1 . 2]" 1
67 1 8 LYS H 1 8 LYS HB2 . . 3.640 2.508 2.386 2.655 . 0 0 "[ . 1 . 2]" 1
68 1 8 LYS H 1 8 LYS QB . . 2.960 2.462 2.353 2.591 . 0 0 "[ . 1 . 2]" 1
69 1 8 LYS H 1 8 LYS HB3 . . 3.640 3.596 3.580 3.627 . 0 0 "[ . 1 . 2]" 1
70 1 8 LYS H 1 8 LYS QD . . 4.340 3.899 3.619 4.364 0.024 19 0 "[ . 1 . 2]" 1
71 1 8 LYS H 1 8 LYS HG2 . . 4.040 3.268 2.220 3.595 . 0 0 "[ . 1 . 2]" 1
72 1 8 LYS H 1 8 LYS HG3 . . 4.040 2.361 2.068 3.631 . 0 0 "[ . 1 . 2]" 1
73 1 8 LYS H 1 11 LEU QD . . 4.960 4.191 3.844 4.740 . 0 0 "[ . 1 . 2]" 1
74 1 8 LYS HA 1 8 LYS QD . . 4.320 3.835 2.155 4.234 . 0 0 "[ . 1 . 2]" 1
75 1 8 LYS HA 1 8 LYS HG2 . . 4.080 2.556 2.345 2.746 . 0 0 "[ . 1 . 2]" 1
76 1 8 LYS HA 1 8 LYS QG . . 3.280 2.448 2.279 2.678 . 0 0 "[ . 1 . 2]" 1
77 1 8 LYS HA 1 8 LYS HG3 . . 4.080 3.164 2.961 3.745 . 0 0 "[ . 1 . 2]" 1
78 1 8 LYS HA 1 11 LEU H . . 3.840 3.408 3.097 3.804 . 0 0 "[ . 1 . 2]" 1
79 1 8 LYS HA 1 11 LEU QD . . 3.240 2.464 1.850 2.921 . 0 0 "[ . 1 . 2]" 1
80 1 8 LYS HA 1 11 LEU HG . . 3.520 3.227 2.652 3.524 0.004 6 0 "[ . 1 . 2]" 1
81 1 8 LYS HA 1 12 LEU H . . 4.470 3.989 3.764 4.540 0.070 15 0 "[ . 1 . 2]" 1
82 1 8 LYS HA 1 41 LEU QD . . 4.770 4.050 3.836 4.677 . 0 0 "[ . 1 . 2]" 1
83 1 8 LYS QB 1 8 LYS QD . . 3.230 2.156 2.096 2.312 . 0 0 "[ . 1 . 2]" 1
84 1 8 LYS QB 1 8 LYS QE . . 4.390 3.210 2.007 3.802 . 0 0 "[ . 1 . 2]" 1
85 1 8 LYS QB 1 9 GLU H . . 3.780 2.593 2.365 2.935 . 0 0 "[ . 1 . 2]" 1
86 1 8 LYS QB 1 9 GLU HA . . 4.070 3.863 3.712 4.012 . 0 0 "[ . 1 . 2]" 1
87 1 8 LYS QB 1 41 LEU QB . . 4.720 2.106 1.844 2.534 . 0 0 "[ . 1 . 2]" 1
88 1 8 LYS QB 1 41 LEU QD . . 3.600 2.185 1.773 3.050 . 0 0 "[ . 1 . 2]" 1
89 1 8 LYS HB2 1 9 GLU HA . . 4.720 4.314 4.075 4.529 . 0 0 "[ . 1 . 2]" 1
90 1 8 LYS HB3 1 9 GLU HA . . 4.720 4.380 4.068 4.655 . 0 0 "[ . 1 . 2]" 1
91 1 8 LYS QD 1 41 LEU H . . 5.410 4.853 4.193 5.459 0.049 14 0 "[ . 1 . 2]" 1
92 1 8 LYS QD 1 41 LEU QB . . 4.380 2.643 2.170 3.221 . 0 0 "[ . 1 . 2]" 1
93 1 8 LYS QD 1 41 LEU QD . . 4.430 3.370 2.896 4.365 . 0 0 "[ . 1 . 2]" 1
94 1 8 LYS QD 1 42 GLY H . . 5.360 4.460 3.320 5.451 0.091 4 0 "[ . 1 . 2]" 1
95 1 8 LYS QD 1 42 GLY HA2 . . 5.500 3.967 3.112 5.398 . 0 0 "[ . 1 . 2]" 1
96 1 8 LYS QD 1 42 GLY QA . . 4.650 3.644 2.895 4.727 0.077 4 0 "[ . 1 . 2]" 1
97 1 8 LYS QD 1 42 GLY HA3 . . 5.500 4.293 3.227 5.224 . 0 0 "[ . 1 . 2]" 1
98 1 8 LYS QE 1 41 LEU QD . . 5.420 4.358 2.482 5.454 0.034 15 0 "[ . 1 . 2]" 1
99 1 8 LYS QE 1 42 GLY QA . . 5.020 4.074 3.050 5.027 0.007 11 0 "[ . 1 . 2]" 1
100 1 8 LYS QG 1 9 GLU H . . 4.810 4.083 3.779 4.314 . 0 0 "[ . 1 . 2]" 1
101 1 8 LYS QG 1 41 LEU QD . . 4.470 3.830 3.070 4.598 0.128 5 0 "[ . 1 . 2]" 1
102 1 8 LYS HG2 1 9 GLU H . . 5.500 4.945 4.494 5.153 . 0 0 "[ . 1 . 2]" 1
103 1 8 LYS HG3 1 9 GLU H . . 5.500 4.372 3.973 4.830 . 0 0 "[ . 1 . 2]" 1
104 1 9 GLU H 1 9 GLU HB2 . . 3.600 3.595 3.562 3.625 0.025 19 0 "[ . 1 . 2]" 1
105 1 9 GLU H 1 9 GLU QB . . 2.930 2.535 2.406 2.682 . 0 0 "[ . 1 . 2]" 1
106 1 9 GLU H 1 9 GLU HB3 . . 3.600 2.593 2.446 2.772 . 0 0 "[ . 1 . 2]" 1
107 1 9 GLU H 1 9 GLU QG . . 4.410 2.207 1.843 3.201 . 0 0 "[ . 1 . 2]" 1
108 1 9 GLU H 1 10 GLU H . . 3.310 2.645 2.491 2.801 . 0 0 "[ . 1 . 2]" 1
109 1 9 GLU H 1 37 PHE QE . . 5.500 4.621 4.128 5.146 . 0 0 "[ . 1 . 2]" 1
110 1 9 GLU H 1 41 LEU MD1 . . 4.720 2.553 1.978 3.931 . 0 0 "[ . 1 . 2]" 1
111 1 9 GLU H 1 41 LEU QD . . 3.670 2.472 1.967 3.478 . 0 0 "[ . 1 . 2]" 1
112 1 9 GLU H 1 41 LEU MD2 . . 4.720 3.718 3.405 4.654 . 0 0 "[ . 1 . 2]" 1
113 1 9 GLU HA 1 12 LEU H . . 3.930 3.521 3.158 3.899 . 0 0 "[ . 1 . 2]" 1
114 1 9 GLU HA 1 12 LEU HB2 . . 4.570 3.815 3.164 4.450 . 0 0 "[ . 1 . 2]" 1
115 1 9 GLU HA 1 12 LEU QB . . 3.920 2.685 2.356 3.155 . 0 0 "[ . 1 . 2]" 1
116 1 9 GLU HA 1 12 LEU HB3 . . 4.570 2.746 2.394 3.247 . 0 0 "[ . 1 . 2]" 1
117 1 9 GLU HA 1 24 LEU QD . . 4.210 2.721 2.148 3.065 . 0 0 "[ . 1 . 2]" 1
118 1 9 GLU HA 1 37 PHE HZ . . 5.100 4.621 4.156 5.106 0.006 2 0 "[ . 1 . 2]" 1
119 1 9 GLU HA 1 41 LEU MD1 . . 3.710 2.585 1.780 3.117 . 0 0 "[ . 1 . 2]" 1
120 1 9 GLU HA 1 41 LEU QD . . 3.240 1.967 1.775 2.332 . 0 0 "[ . 1 . 2]" 1
121 1 9 GLU HA 1 41 LEU MD2 . . 3.710 2.405 1.823 3.694 . 0 0 "[ . 1 . 2]" 1
122 1 9 GLU QB 1 24 LEU QD . . 5.280 2.271 1.756 3.041 . 0 0 "[ . 1 . 2]" 1
123 1 9 GLU QB 1 37 PHE QD . . 4.960 3.738 3.132 4.235 . 0 0 "[ . 1 . 2]" 1
124 1 9 GLU QB 1 37 PHE QE . . 4.090 2.181 1.816 2.809 . 0 0 "[ . 1 . 2]" 1
125 1 9 GLU QB 1 37 PHE HZ . . 5.340 3.149 2.618 3.610 . 0 0 "[ . 1 . 2]" 1
126 1 9 GLU QB 1 41 LEU QD . . 3.220 2.101 1.796 2.865 . 0 0 "[ . 1 . 2]" 1
127 1 9 GLU HG2 1 10 GLU H . . 3.610 2.603 1.914 3.625 0.015 14 0 "[ . 1 . 2]" 1
128 1 9 GLU HG3 1 10 GLU H . . 3.610 2.627 1.889 3.770 0.160 6 0 "[ . 1 . 2]" 1
129 1 10 GLU H 1 10 GLU HB2 . . 3.180 2.228 2.046 2.429 . 0 0 "[ . 1 . 2]" 1
130 1 10 GLU H 1 10 GLU QB . . 2.780 2.174 2.028 2.319 . 0 0 "[ . 1 . 2]" 1
131 1 10 GLU H 1 10 GLU HB3 . . 3.180 3.232 2.574 3.506 0.326 10 0 "[ . 1 . 2]" 1
132 1 10 GLU H 1 11 LEU H . . 3.510 2.507 2.279 2.658 . 0 0 "[ . 1 . 2]" 1
133 1 10 GLU H 1 11 LEU HA . . 5.260 5.153 4.957 5.304 0.044 6 0 "[ . 1 . 2]" 1
134 1 10 GLU H 1 11 LEU MD1 . . 5.500 5.093 4.862 5.259 . 0 0 "[ . 1 . 2]" 1
135 1 10 GLU H 1 11 LEU MD2 . . 5.500 4.990 4.624 5.478 . 0 0 "[ . 1 . 2]" 1
136 1 10 GLU H 1 11 LEU HG . . 5.120 4.063 3.771 4.397 . 0 0 "[ . 1 . 2]" 1
137 1 10 GLU H 1 41 LEU QD . . 5.440 4.215 3.939 4.617 . 0 0 "[ . 1 . 2]" 1
138 1 10 GLU HA 1 10 GLU QB . . 2.610 2.451 2.359 2.542 . 0 0 "[ . 1 . 2]" 1
139 1 10 GLU HA 1 10 GLU HG2 . . 3.640 3.025 2.433 3.677 0.037 4 0 "[ . 1 . 2]" 1
140 1 10 GLU HA 1 10 GLU HG3 . . 3.640 3.078 2.328 3.718 0.078 5 0 "[ . 1 . 2]" 1
141 1 10 GLU HA 1 13 ARG H . . 4.150 3.535 3.077 3.969 . 0 0 "[ . 1 . 2]" 1
142 1 10 GLU HA 1 13 ARG QB . . 3.670 3.292 1.968 3.859 0.189 5 0 "[ . 1 . 2]" 1
143 1 10 GLU HA 1 13 ARG HD2 . . 4.510 2.603 1.725 4.292 . 0 0 "[ . 1 . 2]" 1
144 1 10 GLU HA 1 13 ARG HD3 . . 4.510 2.886 1.943 4.098 . 0 0 "[ . 1 . 2]" 1
145 1 10 GLU HA 1 13 ARG HE . . 5.180 4.043 1.784 5.278 0.098 12 0 "[ . 1 . 2]" 1
146 1 10 GLU HA 1 13 ARG QG . . 4.910 2.581 1.832 3.771 . 0 0 "[ . 1 . 2]" 1
147 1 10 GLU HA 1 14 GLU H . . 4.740 4.612 4.023 4.812 0.072 2 0 "[ . 1 . 2]" 1
148 1 10 GLU QB 1 11 LEU HA . . 4.380 3.918 3.721 4.075 . 0 0 "[ . 1 . 2]" 1
149 1 10 GLU HB2 1 11 LEU H . . 3.650 3.044 2.302 3.710 0.060 4 0 "[ . 1 . 2]" 1
150 1 10 GLU HB3 1 11 LEU H . . 3.650 3.172 2.484 3.661 0.011 9 0 "[ . 1 . 2]" 1
151 1 10 GLU QG 1 13 ARG QD . . 4.320 3.351 2.330 4.376 0.056 19 0 "[ . 1 . 2]" 1
152 1 11 LEU H 1 11 LEU HB2 . . 3.670 2.554 2.470 2.656 . 0 0 "[ . 1 . 2]" 1
153 1 11 LEU H 1 11 LEU QB . . 2.960 2.503 2.429 2.590 . 0 0 "[ . 1 . 2]" 1
154 1 11 LEU H 1 11 LEU HB3 . . 3.670 3.596 3.566 3.668 . 0 0 "[ . 1 . 2]" 1
155 1 11 LEU H 1 11 LEU MD1 . . 3.980 3.577 3.442 3.763 . 0 0 "[ . 1 . 2]" 1
156 1 11 LEU H 1 11 LEU QD . . 3.420 2.988 2.816 3.246 . 0 0 "[ . 1 . 2]" 1
157 1 11 LEU H 1 11 LEU MD2 . . 3.980 3.215 2.938 3.547 . 0 0 "[ . 1 . 2]" 1
158 1 11 LEU H 1 11 LEU HG . . 3.190 2.178 1.970 2.570 . 0 0 "[ . 1 . 2]" 1
159 1 11 LEU H 1 12 LEU H . . 3.260 2.525 2.172 2.710 . 0 0 "[ . 1 . 2]" 1
160 1 11 LEU H 1 14 GLU H . . 5.500 5.013 4.741 5.170 . 0 0 "[ . 1 . 2]" 1
161 1 11 LEU HA 1 11 LEU QD . . 2.760 2.097 2.036 2.190 . 0 0 "[ . 1 . 2]" 1
162 1 11 LEU HA 1 11 LEU HG . . 3.700 3.178 3.047 3.351 . 0 0 "[ . 1 . 2]" 1
163 1 11 LEU HA 1 13 ARG H . . 4.810 4.437 4.011 4.616 . 0 0 "[ . 1 . 2]" 1
164 1 11 LEU HA 1 14 GLU H . . 3.950 3.794 3.516 4.014 0.064 5 0 "[ . 1 . 2]" 1
165 1 11 LEU HA 1 14 GLU QB . . 4.020 3.626 3.159 4.003 . 0 0 "[ . 1 . 2]" 1
166 1 11 LEU HA 1 14 GLU HG2 . . 4.110 4.013 3.275 4.214 0.104 11 0 "[ . 1 . 2]" 1
167 1 11 LEU HA 1 14 GLU QG . . 3.580 2.755 2.471 3.612 0.032 2 0 "[ . 1 . 2]" 1
168 1 11 LEU HA 1 14 GLU HG3 . . 4.110 2.891 2.489 4.135 0.025 1 0 "[ . 1 . 2]" 1
169 1 11 LEU QB 1 11 LEU QD . . 2.520 1.944 1.921 1.964 . 0 0 "[ . 1 . 2]" 1
170 1 11 LEU QB 1 12 LEU H . . 3.270 2.557 2.313 2.743 . 0 0 "[ . 1 . 2]" 1
171 1 11 LEU HB2 1 12 LEU H . . 3.820 2.604 2.344 2.805 . 0 0 "[ . 1 . 2]" 1
172 1 11 LEU HB2 1 12 LEU HA . . 5.480 4.180 3.993 4.359 . 0 0 "[ . 1 . 2]" 1
173 1 11 LEU HB3 1 12 LEU H . . 3.820 3.735 3.534 3.876 0.056 1 0 "[ . 1 . 2]" 1
174 1 11 LEU HB3 1 12 LEU HA . . 5.480 4.488 4.252 4.635 . 0 0 "[ . 1 . 2]" 1
175 1 11 LEU QD 1 14 GLU H . . 5.440 5.158 4.937 5.410 . 0 0 "[ . 1 . 2]" 1
176 1 11 LEU QD 1 14 GLU QB . . 5.210 4.556 4.113 4.916 . 0 0 "[ . 1 . 2]" 1
177 1 11 LEU QD 1 14 GLU QG . . 4.740 3.853 3.670 4.391 . 0 0 "[ . 1 . 2]" 1
178 1 11 LEU MD1 1 12 LEU H . . 4.760 4.443 4.105 4.674 . 0 0 "[ . 1 . 2]" 1
179 1 11 LEU MD2 1 12 LEU H . . 4.760 4.604 4.461 4.669 . 0 0 "[ . 1 . 2]" 1
180 1 11 LEU HG 1 12 LEU H . . 4.210 4.155 3.875 4.261 0.051 4 0 "[ . 1 . 2]" 1
181 1 12 LEU H 1 12 LEU HB2 . . 3.000 2.562 2.444 2.692 . 0 0 "[ . 1 . 2]" 1
182 1 12 LEU H 1 12 LEU HB3 . . 3.000 2.456 2.400 2.550 . 0 0 "[ . 1 . 2]" 1
183 1 12 LEU H 1 12 LEU MD1 . . 4.230 4.120 4.021 4.206 . 0 0 "[ . 1 . 2]" 1
184 1 12 LEU H 1 12 LEU MD2 . . 4.230 4.230 4.205 4.257 0.027 5 0 "[ . 1 . 2]" 1
185 1 12 LEU H 1 12 LEU HG . . 4.440 4.433 4.398 4.476 0.036 2 0 "[ . 1 . 2]" 1
186 1 12 LEU H 1 13 ARG H . . 3.260 2.549 2.150 2.687 . 0 0 "[ . 1 . 2]" 1
187 1 12 LEU H 1 13 ARG QB . . 5.340 4.589 3.703 4.864 . 0 0 "[ . 1 . 2]" 1
188 1 12 LEU H 1 13 ARG QG . . 5.290 4.287 3.882 5.520 0.230 1 0 "[ . 1 . 2]" 1
189 1 12 LEU H 1 14 GLU H . . 5.300 4.054 3.880 4.298 . 0 0 "[ . 1 . 2]" 1
190 1 12 LEU H 1 41 LEU QD . . 5.300 4.042 3.284 4.408 . 0 0 "[ . 1 . 2]" 1
191 1 12 LEU HA 1 12 LEU MD1 . . 4.060 2.092 1.981 2.153 . 0 0 "[ . 1 . 2]" 1
192 1 12 LEU HA 1 12 LEU QD . . 2.830 2.084 1.975 2.143 . 0 0 "[ . 1 . 2]" 1
193 1 12 LEU HA 1 12 LEU MD2 . . 4.060 3.885 3.852 3.906 . 0 0 "[ . 1 . 2]" 1
194 1 12 LEU HA 1 12 LEU HG . . 3.560 3.104 2.981 3.174 . 0 0 "[ . 1 . 2]" 1
195 1 12 LEU HA 1 14 GLU H . . 4.880 3.964 3.795 4.290 . 0 0 "[ . 1 . 2]" 1
196 1 12 LEU HA 1 15 LYS H . . 4.260 3.397 2.900 3.708 . 0 0 "[ . 1 . 2]" 1
197 1 12 LEU HA 1 15 LYS HD2 . . 4.540 3.636 2.102 4.646 0.106 6 0 "[ . 1 . 2]" 1
198 1 12 LEU HA 1 15 LYS HD3 . . 4.540 3.913 3.083 4.589 0.049 2 0 "[ . 1 . 2]" 1
199 1 12 LEU HA 1 15 LYS HG2 . . 5.230 4.483 2.099 5.274 0.044 10 0 "[ . 1 . 2]" 1
200 1 12 LEU HA 1 15 LYS QG . . 4.450 3.251 1.924 3.969 . 0 0 "[ . 1 . 2]" 1
201 1 12 LEU HA 1 15 LYS HG3 . . 5.230 3.444 2.235 4.104 . 0 0 "[ . 1 . 2]" 1
202 1 12 LEU HA 1 16 LEU H . . 5.500 5.048 4.605 5.530 0.030 3 0 "[ . 1 . 2]" 1
203 1 12 LEU HA 1 16 LEU QD . . 5.440 4.196 3.944 4.391 . 0 0 "[ . 1 . 2]" 1
204 1 12 LEU QB 1 13 ARG H . . 3.500 2.685 2.546 2.914 . 0 0 "[ . 1 . 2]" 1
205 1 12 LEU QB 1 41 LEU QD . . 4.520 2.639 1.933 3.082 . 0 0 "[ . 1 . 2]" 1
206 1 12 LEU HB2 1 13 ARG H . . 4.040 3.958 3.845 4.055 0.015 8 0 "[ . 1 . 2]" 1
207 1 12 LEU HB3 1 13 ARG H . . 4.040 2.732 2.581 2.989 . 0 0 "[ . 1 . 2]" 1
208 1 12 LEU QD 1 13 ARG H . . 5.080 3.981 3.866 4.201 . 0 0 "[ . 1 . 2]" 1
209 1 12 LEU QD 1 14 GLU H . . 5.440 4.933 4.819 5.197 . 0 0 "[ . 1 . 2]" 1
210 1 12 LEU QD 1 15 LYS QB . . 4.470 2.685 1.824 3.122 . 0 0 "[ . 1 . 2]" 1
211 1 12 LEU QD 1 15 LYS QD . . 5.040 3.165 2.280 4.200 . 0 0 "[ . 1 . 2]" 1
212 1 12 LEU QD 1 16 LEU QD . . 3.350 2.267 1.853 2.755 . 0 0 "[ . 1 . 2]" 1
213 1 12 LEU QD 1 16 LEU HG . . 5.180 3.153 2.781 3.693 . 0 0 "[ . 1 . 2]" 1
214 1 12 LEU QD 1 41 LEU HA . . 4.100 2.501 1.969 3.230 . 0 0 "[ . 1 . 2]" 1
215 1 12 LEU QD 1 41 LEU QD . . 3.160 2.058 1.788 2.458 . 0 0 "[ . 1 . 2]" 1
216 1 12 LEU QD 1 45 GLU H . . 5.440 4.857 4.423 5.158 . 0 0 "[ . 1 . 2]" 1
217 1 12 LEU QD 1 45 GLU HA . . 4.680 3.292 3.040 3.530 . 0 0 "[ . 1 . 2]" 1
218 1 12 LEU QD 1 45 GLU QG . . 3.900 2.430 1.993 3.980 0.080 20 0 "[ . 1 . 2]" 1
219 1 12 LEU QD 1 48 ILE MD . . 3.020 1.943 1.777 2.347 . 0 0 "[ . 1 . 2]" 1
220 1 12 LEU QD 1 48 ILE QG . . 5.280 3.416 3.210 3.694 . 0 0 "[ . 1 . 2]" 1
221 1 12 LEU MD1 1 48 ILE MD . . 3.520 2.536 2.065 3.231 . 0 0 "[ . 1 . 2]" 1
222 1 12 LEU MD2 1 48 ILE MD . . 3.520 2.047 1.787 2.553 . 0 0 "[ . 1 . 2]" 1
223 1 12 LEU HG 1 13 ARG HA . . 5.360 3.751 3.504 4.228 . 0 0 "[ . 1 . 2]" 1
224 1 12 LEU HG 1 16 LEU QD . . 3.690 2.107 1.852 2.504 . 0 0 "[ . 1 . 2]" 1
225 1 12 LEU HG 1 16 LEU HG . . 3.680 2.470 1.926 3.131 . 0 0 "[ . 1 . 2]" 1
226 1 13 ARG H 1 13 ARG HB2 . . 3.570 3.244 2.059 3.638 0.068 5 0 "[ . 1 . 2]" 1
227 1 13 ARG H 1 13 ARG QB . . 2.740 2.406 2.017 2.577 . 0 0 "[ . 1 . 2]" 1
228 1 13 ARG H 1 13 ARG HB3 . . 3.570 2.771 2.319 3.611 0.041 14 0 "[ . 1 . 2]" 1
229 1 13 ARG H 1 13 ARG HD2 . . 4.770 4.083 3.419 4.914 0.144 3 0 "[ . 1 . 2]" 1
230 1 13 ARG H 1 13 ARG HD3 . . 4.770 4.527 3.697 4.859 0.089 6 0 "[ . 1 . 2]" 1
231 1 13 ARG H 1 13 ARG QG . . 3.750 2.414 2.072 3.725 . 0 0 "[ . 1 . 2]" 1
232 1 13 ARG H 1 14 GLU H . . 3.390 2.632 2.442 2.818 . 0 0 "[ . 1 . 2]" 1
233 1 13 ARG H 1 14 GLU HA . . 5.500 5.231 5.061 5.385 . 0 0 "[ . 1 . 2]" 1
234 1 13 ARG H 1 14 GLU QG . . 5.180 3.972 3.750 4.428 . 0 0 "[ . 1 . 2]" 1
235 1 13 ARG H 1 15 LYS H . . 5.140 4.121 3.817 4.348 . 0 0 "[ . 1 . 2]" 1
236 1 13 ARG H 1 16 LEU H . . 5.450 4.976 4.706 5.218 . 0 0 "[ . 1 . 2]" 1
237 1 13 ARG H 1 16 LEU QD . . 4.870 3.766 3.472 4.214 . 0 0 "[ . 1 . 2]" 1
238 1 13 ARG H 1 24 LEU QD . . 4.480 3.592 2.817 4.314 . 0 0 "[ . 1 . 2]" 1
239 1 13 ARG HA 1 13 ARG QG . . 3.700 3.061 2.293 3.403 . 0 0 "[ . 1 . 2]" 1
240 1 13 ARG HA 1 15 LYS H . . 4.430 3.834 3.524 4.432 0.002 1 0 "[ . 1 . 2]" 1
241 1 13 ARG HA 1 16 LEU H . . 3.970 3.173 2.597 3.728 . 0 0 "[ . 1 . 2]" 1
242 1 13 ARG HA 1 16 LEU HB2 . . 4.640 2.385 1.913 3.210 . 0 0 "[ . 1 . 2]" 1
243 1 13 ARG HA 1 16 LEU QB . . 4.040 2.362 1.903 3.143 . 0 0 "[ . 1 . 2]" 1
244 1 13 ARG HA 1 16 LEU HB3 . . 4.640 3.883 3.420 4.495 . 0 0 "[ . 1 . 2]" 1
245 1 13 ARG HA 1 16 LEU QD . . 3.450 2.061 1.757 2.764 . 0 0 "[ . 1 . 2]" 1
246 1 13 ARG HA 1 16 LEU HG . . 3.640 2.633 2.016 3.480 . 0 0 "[ . 1 . 2]" 1
247 1 13 ARG HA 1 21 LYS QE . . 5.270 3.962 3.198 5.114 . 0 0 "[ . 1 . 2]" 1
248 1 13 ARG HA 1 21 LYS QG . . 5.340 2.962 2.403 3.721 . 0 0 "[ . 1 . 2]" 1
249 1 13 ARG HA 1 24 LEU QD . . 5.060 3.347 2.478 4.306 . 0 0 "[ . 1 . 2]" 1
250 1 13 ARG QB 1 13 ARG QD . . 2.950 2.246 2.024 2.427 . 0 0 "[ . 1 . 2]" 1
251 1 13 ARG QB 1 13 ARG HE . . 4.080 2.771 1.892 4.072 . 0 0 "[ . 1 . 2]" 1
252 1 13 ARG QB 1 13 ARG QH1 . . 5.340 3.799 2.294 4.369 . 0 0 "[ . 1 . 2]" 1
253 1 13 ARG QB 1 14 GLU H . . 3.700 3.376 2.331 3.808 0.108 5 0 "[ . 1 . 2]" 1
254 1 13 ARG QB 1 16 LEU QD . . 4.930 3.192 2.409 4.389 . 0 0 "[ . 1 . 2]" 1
255 1 13 ARG QB 1 24 LEU QD . . 4.050 2.817 1.925 3.787 . 0 0 "[ . 1 . 2]" 1
256 1 13 ARG QD 1 24 LEU QD . . 4.670 3.436 2.230 4.213 . 0 0 "[ . 1 . 2]" 1
257 1 13 ARG HD2 1 13 ARG QH1 . . 4.320 2.362 1.709 3.331 . 0 0 "[ . 1 . 2]" 1
258 1 13 ARG HD3 1 13 ARG QH1 . . 4.320 2.352 1.711 3.276 . 0 0 "[ . 1 . 2]" 1
259 1 13 ARG HE 1 24 LEU QD . . 5.290 4.059 2.849 5.429 0.139 19 0 "[ . 1 . 2]" 1
260 1 13 ARG QG 1 14 GLU H . . 4.700 3.031 2.119 4.363 . 0 0 "[ . 1 . 2]" 1
261 1 13 ARG QG 1 24 LEU QD . . 4.600 3.396 1.825 4.677 0.077 8 0 "[ . 1 . 2]" 1
262 1 14 GLU H 1 14 GLU HB2 . . 3.680 2.562 2.397 2.795 . 0 0 "[ . 1 . 2]" 1
263 1 14 GLU H 1 14 GLU QB . . 2.900 2.509 2.361 2.702 . 0 0 "[ . 1 . 2]" 1
264 1 14 GLU H 1 14 GLU HB3 . . 3.680 3.592 3.551 3.620 . 0 0 "[ . 1 . 2]" 1
265 1 14 GLU H 1 14 GLU HG2 . . 3.500 2.919 2.134 3.415 . 0 0 "[ . 1 . 2]" 1
266 1 14 GLU H 1 14 GLU QG . . 3.000 2.099 1.919 2.229 . 0 0 "[ . 1 . 2]" 1
267 1 14 GLU H 1 14 GLU HG3 . . 3.500 2.471 1.956 3.586 0.086 3 0 "[ . 1 . 2]" 1
268 1 14 GLU H 1 15 LYS H . . 3.200 2.559 2.415 2.789 . 0 0 "[ . 1 . 2]" 1
269 1 14 GLU H 1 15 LYS HA . . 5.500 5.210 5.087 5.367 . 0 0 "[ . 1 . 2]" 1
270 1 14 GLU H 1 21 LYS QE . . 5.500 4.751 3.939 5.586 0.086 3 0 "[ . 1 . 2]" 1
271 1 14 GLU HA 1 14 GLU HG2 . . 3.570 2.697 2.549 2.996 . 0 0 "[ . 1 . 2]" 1
272 1 14 GLU HA 1 14 GLU QG . . 2.800 2.592 2.440 2.877 0.077 2 0 "[ . 1 . 2]" 1
273 1 14 GLU HA 1 14 GLU HG3 . . 3.570 3.366 3.116 3.728 0.158 4 0 "[ . 1 . 2]" 1
274 1 14 GLU HA 1 16 LEU H . . 4.450 3.870 3.414 4.165 . 0 0 "[ . 1 . 2]" 1
275 1 14 GLU HA 1 21 LYS QE . . 4.300 3.461 1.926 4.035 . 0 0 "[ . 1 . 2]" 1
276 1 14 GLU QB 1 15 LYS H . . 3.330 2.767 2.470 2.957 . 0 0 "[ . 1 . 2]" 1
277 1 14 GLU HB2 1 15 LYS H . . 3.990 2.833 2.513 3.045 . 0 0 "[ . 1 . 2]" 1
278 1 14 GLU HB3 1 15 LYS H . . 3.990 3.890 3.601 4.043 0.053 11 0 "[ . 1 . 2]" 1
279 1 14 GLU QG 1 15 LYS H . . 4.780 3.986 3.659 4.145 . 0 0 "[ . 1 . 2]" 1
280 1 15 LYS H 1 15 LYS HB2 . . 3.630 2.519 2.371 2.688 . 0 0 "[ . 1 . 2]" 1
281 1 15 LYS H 1 15 LYS QB . . 2.980 2.473 2.339 2.618 . 0 0 "[ . 1 . 2]" 1
282 1 15 LYS H 1 15 LYS HB3 . . 3.630 3.613 3.561 3.653 0.023 12 0 "[ . 1 . 2]" 1
283 1 15 LYS H 1 15 LYS HD2 . . 4.400 4.041 3.123 4.534 0.134 1 0 "[ . 1 . 2]" 1
284 1 15 LYS H 1 15 LYS HD3 . . 4.400 4.256 3.277 4.576 0.176 13 0 "[ . 1 . 2]" 1
285 1 15 LYS H 1 15 LYS QE . . 5.340 4.503 2.971 5.295 . 0 0 "[ . 1 . 2]" 1
286 1 15 LYS H 1 15 LYS HG2 . . 3.820 3.307 1.947 3.858 0.038 9 0 "[ . 1 . 2]" 1
287 1 15 LYS H 1 15 LYS QG . . 3.220 2.259 1.937 2.500 . 0 0 "[ . 1 . 2]" 1
288 1 15 LYS H 1 15 LYS HG3 . . 3.820 2.581 2.022 3.781 . 0 0 "[ . 1 . 2]" 1
289 1 15 LYS H 1 16 LEU H . . 2.890 2.375 2.215 2.559 . 0 0 "[ . 1 . 2]" 1
290 1 15 LYS H 1 16 LEU QB . . 4.510 4.304 4.125 4.497 . 0 0 "[ . 1 . 2]" 1
291 1 15 LYS H 1 16 LEU MD1 . . 5.330 4.745 4.544 5.159 . 0 0 "[ . 1 . 2]" 1
292 1 15 LYS H 1 16 LEU QD . . 4.610 4.145 3.780 4.407 . 0 0 "[ . 1 . 2]" 1
293 1 15 LYS H 1 16 LEU MD2 . . 5.330 4.582 3.989 4.903 . 0 0 "[ . 1 . 2]" 1
294 1 15 LYS H 1 16 LEU HG . . 4.480 3.586 3.264 3.995 . 0 0 "[ . 1 . 2]" 1
295 1 15 LYS HA 1 15 LYS QD . . 4.030 3.766 2.208 4.217 0.187 19 0 "[ . 1 . 2]" 1
296 1 15 LYS HA 1 15 LYS HG2 . . 3.690 2.796 2.534 3.347 . 0 0 "[ . 1 . 2]" 1
297 1 15 LYS HA 1 15 LYS QG . . 3.030 2.616 2.447 3.131 0.101 4 0 "[ . 1 . 2]" 1
298 1 15 LYS HA 1 15 LYS HG3 . . 3.690 3.185 2.805 3.864 0.174 8 0 "[ . 1 . 2]" 1
299 1 15 LYS QB 1 15 LYS QD . . 3.160 2.237 2.096 2.883 . 0 0 "[ . 1 . 2]" 1
300 1 15 LYS QB 1 16 LEU H . . 4.360 3.301 2.984 3.590 . 0 0 "[ . 1 . 2]" 1
301 1 15 LYS QB 1 49 LYS QE . . 4.460 3.348 2.744 4.435 . 0 0 "[ . 1 . 2]" 1
302 1 15 LYS QD 1 16 LEU H . . 5.340 5.197 4.612 5.479 0.139 20 0 "[ . 1 . 2]" 1
303 1 15 LYS QG 1 16 LEU H . . 4.430 4.168 3.757 4.377 . 0 0 "[ . 1 . 2]" 1
304 1 16 LEU H 1 16 LEU QB . . 2.980 2.456 2.323 2.541 . 0 0 "[ . 1 . 2]" 1
305 1 16 LEU H 1 16 LEU MD1 . . 4.320 3.857 3.654 4.069 . 0 0 "[ . 1 . 2]" 1
306 1 16 LEU H 1 16 LEU QD . . 3.650 3.279 3.092 3.458 . 0 0 "[ . 1 . 2]" 1
307 1 16 LEU H 1 16 LEU MD2 . . 4.320 3.554 3.239 3.815 . 0 0 "[ . 1 . 2]" 1
308 1 16 LEU H 1 16 LEU HG . . 3.460 2.689 2.393 2.995 . 0 0 "[ . 1 . 2]" 1
309 1 16 LEU H 1 17 SER H . . 4.530 4.524 4.456 4.582 0.052 5 0 "[ . 1 . 2]" 1
310 1 16 LEU H 1 20 GLN QB . . 5.310 5.059 4.921 5.253 . 0 0 "[ . 1 . 2]" 1
311 1 16 LEU H 1 21 LYS QE . . 4.800 3.674 3.008 4.294 . 0 0 "[ . 1 . 2]" 1
312 1 16 LEU H 1 21 LYS QG . . 5.340 4.121 3.514 4.455 . 0 0 "[ . 1 . 2]" 1
313 1 16 LEU HA 1 16 LEU QD . . 3.130 2.031 1.947 2.138 . 0 0 "[ . 1 . 2]" 1
314 1 16 LEU HA 1 17 SER H . . 3.500 2.396 2.250 2.642 . 0 0 "[ . 1 . 2]" 1
315 1 16 LEU HA 1 20 GLN HB2 . . 4.590 3.806 3.413 4.343 . 0 0 "[ . 1 . 2]" 1
316 1 16 LEU HA 1 20 GLN HB3 . . 4.590 4.475 4.030 4.648 0.058 1 0 "[ . 1 . 2]" 1
317 1 16 LEU HA 1 49 LYS QE . . 3.390 2.973 2.349 3.500 0.110 19 0 "[ . 1 . 2]" 1
318 1 16 LEU QB 1 17 SER HA . . 5.340 4.249 4.067 4.382 . 0 0 "[ . 1 . 2]" 1
319 1 16 LEU QB 1 20 GLN H . . 4.620 4.062 3.954 4.356 . 0 0 "[ . 1 . 2]" 1
320 1 16 LEU QB 1 20 GLN QB . . 2.810 1.835 1.722 2.087 . 0 0 "[ . 1 . 2]" 1
321 1 16 LEU QB 1 21 LYS HA . . 4.870 3.613 3.199 3.936 . 0 0 "[ . 1 . 2]" 1
322 1 16 LEU QB 1 21 LYS QE . . 5.340 3.297 2.806 3.888 . 0 0 "[ . 1 . 2]" 1
323 1 16 LEU QB 1 21 LYS QG . . 4.150 2.513 2.057 2.838 . 0 0 "[ . 1 . 2]" 1
324 1 16 LEU QB 1 52 LEU QD . . 4.850 3.564 3.202 3.852 . 0 0 "[ . 1 . 2]" 1
325 1 16 LEU HB2 1 17 SER H . . 4.180 3.572 3.129 3.867 . 0 0 "[ . 1 . 2]" 1
326 1 16 LEU HB3 1 17 SER H . . 4.180 2.413 2.138 2.726 . 0 0 "[ . 1 . 2]" 1
327 1 16 LEU QD 1 17 SER H . . 3.800 3.288 2.970 3.452 . 0 0 "[ . 1 . 2]" 1
328 1 16 LEU QD 1 20 GLN H . . 5.210 4.608 4.338 4.972 . 0 0 "[ . 1 . 2]" 1
329 1 16 LEU QD 1 20 GLN HA . . 5.210 3.988 3.676 4.472 . 0 0 "[ . 1 . 2]" 1
330 1 16 LEU QD 1 20 GLN QB . . 2.810 2.125 1.790 2.534 . 0 0 "[ . 1 . 2]" 1
331 1 16 LEU QD 1 20 GLN QE . . 4.700 3.264 2.239 3.908 . 0 0 "[ . 1 . 2]" 1
332 1 16 LEU QD 1 20 GLN QG . . 5.030 3.334 2.561 3.773 . 0 0 "[ . 1 . 2]" 1
333 1 16 LEU QD 1 21 LYS H . . 4.480 3.900 3.529 4.284 . 0 0 "[ . 1 . 2]" 1
334 1 16 LEU QD 1 21 LYS HA . . 3.730 3.004 2.478 3.594 . 0 0 "[ . 1 . 2]" 1
335 1 16 LEU QD 1 21 LYS QG . . 4.780 3.237 2.900 3.581 . 0 0 "[ . 1 . 2]" 1
336 1 16 LEU QD 1 24 LEU H . . 4.870 4.303 3.812 4.866 . 0 0 "[ . 1 . 2]" 1
337 1 16 LEU QD 1 24 LEU QB . . 4.750 3.007 2.312 4.015 . 0 0 "[ . 1 . 2]" 1
338 1 16 LEU QD 1 24 LEU QD . . 3.260 2.107 1.769 2.714 . 0 0 "[ . 1 . 2]" 1
339 1 16 LEU QD 1 24 LEU HG . . 5.240 3.171 2.140 4.515 . 0 0 "[ . 1 . 2]" 1
340 1 16 LEU QD 1 48 ILE MG . . 3.600 2.512 2.180 2.909 . 0 0 "[ . 1 . 2]" 1
341 1 16 LEU QD 1 49 LYS H . . 4.710 4.050 3.636 4.515 . 0 0 "[ . 1 . 2]" 1
342 1 16 LEU QD 1 49 LYS HA . . 3.730 3.163 2.810 3.511 . 0 0 "[ . 1 . 2]" 1
343 1 16 LEU QD 1 49 LYS QD . . 4.890 3.227 2.057 3.758 . 0 0 "[ . 1 . 2]" 1
344 1 16 LEU QD 1 49 LYS QE . . 3.610 2.182 1.758 3.243 . 0 0 "[ . 1 . 2]" 1
345 1 16 LEU QD 1 49 LYS QG . . 4.150 2.222 1.857 3.803 . 0 0 "[ . 1 . 2]" 1
346 1 16 LEU MD1 1 20 GLN HB2 . . 4.310 3.160 2.671 3.642 . 0 0 "[ . 1 . 2]" 1
347 1 16 LEU MD1 1 20 GLN HB3 . . 4.310 2.397 1.851 2.916 . 0 0 "[ . 1 . 2]" 1
348 1 16 LEU MD2 1 20 GLN HB2 . . 4.310 3.291 2.830 4.138 . 0 0 "[ . 1 . 2]" 1
349 1 16 LEU MD2 1 20 GLN HB3 . . 4.310 2.721 2.084 3.404 . 0 0 "[ . 1 . 2]" 1
350 1 16 LEU HG 1 17 SER H . . 5.450 4.868 4.675 4.993 . 0 0 "[ . 1 . 2]" 1
351 1 16 LEU HG 1 21 LYS QG . . 4.800 4.545 3.992 4.827 0.027 1 0 "[ . 1 . 2]" 1
352 1 17 SER H 1 17 SER HB2 . . 3.900 3.093 2.468 3.629 . 0 0 "[ . 1 . 2]" 1
353 1 17 SER H 1 17 SER QB . . 3.210 2.584 2.251 2.868 . 0 0 "[ . 1 . 2]" 1
354 1 17 SER H 1 17 SER HB3 . . 3.900 2.963 2.462 3.629 . 0 0 "[ . 1 . 2]" 1
355 1 17 SER H 1 17 SER HG . . 5.110 3.383 2.158 4.482 . 0 0 "[ . 1 . 2]" 1
356 1 17 SER H 1 18 GLU H . . 5.010 4.552 4.450 4.635 . 0 0 "[ . 1 . 2]" 1
357 1 17 SER H 1 20 GLN H . . 3.960 3.734 3.508 3.952 . 0 0 "[ . 1 . 2]" 1
358 1 17 SER H 1 20 GLN HB2 . . 3.770 2.384 2.042 2.601 . 0 0 "[ . 1 . 2]" 1
359 1 17 SER H 1 20 GLN QB . . 3.080 2.358 2.021 2.558 . 0 0 "[ . 1 . 2]" 1
360 1 17 SER H 1 20 GLN HB3 . . 3.770 3.729 3.239 3.866 0.096 15 0 "[ . 1 . 2]" 1
361 1 17 SER H 1 20 GLN QE . . 5.340 3.911 3.270 4.520 . 0 0 "[ . 1 . 2]" 1
362 1 17 SER H 1 20 GLN QG . . 4.830 3.064 2.204 3.601 . 0 0 "[ . 1 . 2]" 1
363 1 17 SER H 1 21 LYS QG . . 5.340 4.242 3.755 4.660 . 0 0 "[ . 1 . 2]" 1
364 1 17 SER H 1 49 LYS QE . . 5.200 4.674 3.853 5.214 0.014 3 0 "[ . 1 . 2]" 1
365 1 17 SER H 1 52 LEU QD . . 5.440 5.035 4.567 5.387 . 0 0 "[ . 1 . 2]" 1
366 1 17 SER HA 1 18 GLU H . . 3.240 2.588 2.461 2.776 . 0 0 "[ . 1 . 2]" 1
367 1 17 SER HA 1 18 GLU HA . . 5.050 4.255 4.176 4.314 . 0 0 "[ . 1 . 2]" 1
368 1 17 SER HA 1 18 GLU QB . . 5.030 4.795 4.666 4.905 . 0 0 "[ . 1 . 2]" 1
369 1 17 SER HA 1 18 GLU QG . . 4.620 3.852 3.572 4.096 . 0 0 "[ . 1 . 2]" 1
370 1 17 SER QB 1 18 GLU H . . 3.250 2.435 1.969 3.239 . 0 0 "[ . 1 . 2]" 1
371 1 17 SER QB 1 18 GLU QG . . 5.340 4.156 3.696 4.926 . 0 0 "[ . 1 . 2]" 1
372 1 17 SER QB 1 19 ASP H . . 3.920 2.981 2.603 3.368 . 0 0 "[ . 1 . 2]" 1
373 1 17 SER QB 1 19 ASP QB . . 4.970 3.922 2.839 4.646 . 0 0 "[ . 1 . 2]" 1
374 1 17 SER QB 1 20 GLN H . . 4.350 3.066 2.132 3.843 . 0 0 "[ . 1 . 2]" 1
375 1 17 SER QB 1 20 GLN QG . . 5.340 3.029 1.808 4.165 . 0 0 "[ . 1 . 2]" 1
376 1 17 SER QB 1 21 LYS QG . . 5.180 4.859 4.485 5.211 0.031 11 0 "[ . 1 . 2]" 1
377 1 17 SER HG 1 18 GLU H . . 5.500 3.844 2.364 4.760 . 0 0 "[ . 1 . 2]" 1
378 1 17 SER HG 1 19 ASP H . . 4.770 3.679 2.497 4.896 0.126 3 0 "[ . 1 . 2]" 1
379 1 17 SER HG 1 19 ASP QB . . 5.320 4.005 2.557 5.409 0.089 6 0 "[ . 1 . 2]" 1
380 1 17 SER HG 1 20 GLN H . . 4.540 3.455 2.453 4.529 . 0 0 "[ . 1 . 2]" 1
381 1 17 SER HG 1 20 GLN QG . . 5.500 2.983 1.954 4.437 . 0 0 "[ . 1 . 2]" 1
382 1 18 GLU H 1 18 GLU HB2 . . 3.580 2.537 2.451 2.673 . 0 0 "[ . 1 . 2]" 1
383 1 18 GLU H 1 18 GLU QB . . 3.010 2.488 2.413 2.606 . 0 0 "[ . 1 . 2]" 1
384 1 18 GLU H 1 18 GLU HB3 . . 3.580 3.602 3.578 3.623 0.043 18 0 "[ . 1 . 2]" 1
385 1 18 GLU H 1 18 GLU QG . . 3.460 2.222 2.055 2.681 . 0 0 "[ . 1 . 2]" 1
386 1 18 GLU H 1 19 ASP H . . 3.410 2.507 2.335 2.719 . 0 0 "[ . 1 . 2]" 1
387 1 18 GLU H 1 19 ASP QB . . 4.520 4.599 4.368 4.677 0.157 20 0 "[ . 1 . 2]" 1
388 1 18 GLU H 1 20 GLN H . . 4.980 4.075 3.764 4.383 . 0 0 "[ . 1 . 2]" 1
389 1 18 GLU H 1 21 LYS QE . . 5.450 4.029 3.578 4.503 . 0 0 "[ . 1 . 2]" 1
390 1 18 GLU HA 1 18 GLU QG . . 3.480 2.686 2.336 3.169 . 0 0 "[ . 1 . 2]" 1
391 1 18 GLU HA 1 20 GLN H . . 4.850 4.425 3.797 4.714 . 0 0 "[ . 1 . 2]" 1
392 1 18 GLU HA 1 21 LYS H . . 3.940 3.485 3.000 3.897 . 0 0 "[ . 1 . 2]" 1
393 1 18 GLU HA 1 21 LYS QD . . 3.500 2.211 1.787 2.732 . 0 0 "[ . 1 . 2]" 1
394 1 18 GLU HA 1 21 LYS QE . . 3.310 2.875 2.060 3.332 0.022 14 0 "[ . 1 . 2]" 1
395 1 18 GLU QB 1 18 GLU QG . . 2.280 2.036 1.963 2.086 . 0 0 "[ . 1 . 2]" 1
396 1 18 GLU QB 1 19 ASP H . . 3.130 2.631 2.358 2.803 . 0 0 "[ . 1 . 2]" 1
397 1 18 GLU QB 1 19 ASP HA . . 4.910 3.941 3.807 4.082 . 0 0 "[ . 1 . 2]" 1
398 1 18 GLU QB 1 21 LYS QE . . 5.100 4.510 3.609 5.072 . 0 0 "[ . 1 . 2]" 1
399 1 18 GLU HB2 1 18 GLU QG . . 2.720 2.263 2.158 2.471 . 0 0 "[ . 1 . 2]" 1
400 1 18 GLU HB2 1 19 ASP H . . 3.830 2.686 2.404 2.877 . 0 0 "[ . 1 . 2]" 1
401 1 18 GLU HB3 1 18 GLU QG . . 2.720 2.321 2.132 2.436 . 0 0 "[ . 1 . 2]" 1
402 1 18 GLU HB3 1 19 ASP H . . 3.830 3.770 3.399 3.864 0.034 6 0 "[ . 1 . 2]" 1
403 1 18 GLU QG 1 19 ASP H . . 4.090 3.981 3.862 4.272 0.182 5 0 "[ . 1 . 2]" 1
404 1 18 GLU QG 1 21 LYS QE . . 4.740 3.691 2.203 4.678 . 0 0 "[ . 1 . 2]" 1
405 1 19 ASP H 1 19 ASP QB . . 2.890 2.481 2.169 2.630 . 0 0 "[ . 1 . 2]" 1
406 1 19 ASP H 1 20 GLN H . . 3.350 2.630 2.479 2.900 . 0 0 "[ . 1 . 2]" 1
407 1 19 ASP H 1 21 LYS H . . 5.110 4.060 3.905 4.249 . 0 0 "[ . 1 . 2]" 1
408 1 19 ASP H 1 22 THR H . . 5.500 5.033 4.658 5.323 . 0 0 "[ . 1 . 2]" 1
409 1 19 ASP HA 1 22 THR H . . 4.270 3.656 3.347 3.932 . 0 0 "[ . 1 . 2]" 1
410 1 19 ASP HA 1 22 THR HB . . 4.480 3.489 3.011 4.019 . 0 0 "[ . 1 . 2]" 1
411 1 19 ASP HA 1 56 LYS QE . . 5.340 5.049 3.572 5.393 0.053 18 0 "[ . 1 . 2]" 1
412 1 19 ASP QB 1 20 GLN H . . 3.530 2.910 2.054 3.547 0.017 18 0 "[ . 1 . 2]" 1
413 1 19 ASP QB 1 21 LYS H . . 5.500 4.813 4.409 5.138 . 0 0 "[ . 1 . 2]" 1
414 1 19 ASP QB 1 56 LYS QB . . 5.320 4.138 3.466 4.719 . 0 0 "[ . 1 . 2]" 1
415 1 19 ASP QB 1 56 LYS HD2 . . 3.880 2.646 2.099 3.963 0.083 7 0 "[ . 1 . 2]" 1
416 1 19 ASP QB 1 56 LYS QD . . 3.320 2.374 1.985 2.815 . 0 0 "[ . 1 . 2]" 1
417 1 19 ASP QB 1 56 LYS HD3 . . 3.880 3.327 2.020 4.004 0.124 16 0 "[ . 1 . 2]" 1
418 1 19 ASP QB 1 56 LYS HE2 . . 4.370 3.785 2.275 4.484 0.114 15 0 "[ . 1 . 2]" 1
419 1 19 ASP QB 1 56 LYS QE . . 3.770 2.885 2.019 3.641 . 0 0 "[ . 1 . 2]" 1
420 1 19 ASP QB 1 56 LYS HE3 . . 4.370 3.329 2.036 4.511 0.141 18 0 "[ . 1 . 2]" 1
421 1 19 ASP QB 1 56 LYS QG . . 5.200 4.016 3.448 4.546 . 0 0 "[ . 1 . 2]" 1
422 1 20 GLN H 1 20 GLN HB2 . . 3.880 2.437 2.240 2.526 . 0 0 "[ . 1 . 2]" 1
423 1 20 GLN H 1 20 GLN QB . . 3.310 2.398 2.217 2.480 . 0 0 "[ . 1 . 2]" 1
424 1 20 GLN H 1 20 GLN HB3 . . 3.880 3.568 3.526 3.631 . 0 0 "[ . 1 . 2]" 1
425 1 20 GLN H 1 20 GLN QE . . 5.340 4.757 4.030 5.040 . 0 0 "[ . 1 . 2]" 1
426 1 20 GLN H 1 20 GLN QG . . 3.040 2.218 1.957 2.770 . 0 0 "[ . 1 . 2]" 1
427 1 20 GLN H 1 21 LYS H . . 3.150 2.656 2.342 2.772 . 0 0 "[ . 1 . 2]" 1
428 1 20 GLN H 1 21 LYS QB . . 4.910 4.727 4.494 4.879 . 0 0 "[ . 1 . 2]" 1
429 1 20 GLN H 1 52 LEU QD . . 5.440 4.845 4.478 5.236 . 0 0 "[ . 1 . 2]" 1
430 1 20 GLN HA 1 20 GLN QG . . 3.470 2.529 2.303 2.968 . 0 0 "[ . 1 . 2]" 1
431 1 20 GLN HA 1 23 HIS H . . 4.450 3.341 3.025 3.643 . 0 0 "[ . 1 . 2]" 1
432 1 20 GLN HA 1 23 HIS QB . . 4.490 2.848 2.197 3.517 . 0 0 "[ . 1 . 2]" 1
433 1 20 GLN HA 1 52 LEU HB2 . . 4.950 4.072 3.516 4.596 . 0 0 "[ . 1 . 2]" 1
434 1 20 GLN HA 1 52 LEU QB . . 4.310 2.914 2.452 3.347 . 0 0 "[ . 1 . 2]" 1
435 1 20 GLN HA 1 52 LEU HB3 . . 4.950 2.987 2.503 3.438 . 0 0 "[ . 1 . 2]" 1
436 1 20 GLN HA 1 52 LEU QD . . 4.630 3.043 2.594 3.552 . 0 0 "[ . 1 . 2]" 1
437 1 20 GLN QB 1 21 LYS H . . 3.910 2.723 2.505 2.927 . 0 0 "[ . 1 . 2]" 1
438 1 20 GLN QB 1 52 LEU QB . . 4.350 3.101 2.732 3.340 . 0 0 "[ . 1 . 2]" 1
439 1 20 GLN QB 1 52 LEU QD . . 3.750 2.194 1.898 2.523 . 0 0 "[ . 1 . 2]" 1
440 1 20 GLN QE 1 49 LYS HA . . 4.250 2.768 1.873 3.570 . 0 0 "[ . 1 . 2]" 1
441 1 20 GLN QE 1 49 LYS QB . . 3.580 2.096 1.768 2.885 . 0 0 "[ . 1 . 2]" 1
442 1 20 GLN QE 1 49 LYS QD . . 4.160 3.000 2.419 3.719 . 0 0 "[ . 1 . 2]" 1
443 1 20 GLN QE 1 49 LYS QE . . 4.430 4.175 3.628 4.489 0.059 8 0 "[ . 1 . 2]" 1
444 1 20 GLN QE 1 49 LYS QG . . 4.190 2.860 1.873 4.224 0.034 19 0 "[ . 1 . 2]" 1
445 1 20 GLN QE 1 52 LEU QB . . 5.180 3.084 2.004 4.179 . 0 0 "[ . 1 . 2]" 1
446 1 20 GLN QE 1 52 LEU QD . . 5.270 3.662 2.479 4.406 . 0 0 "[ . 1 . 2]" 1
447 1 20 GLN HE21 1 49 LYS HA . . 4.890 3.165 2.037 4.158 . 0 0 "[ . 1 . 2]" 1
448 1 20 GLN HE21 1 49 LYS HB2 . . 4.660 4.549 4.035 4.873 0.213 2 0 "[ . 1 . 2]" 1
449 1 20 GLN HE21 1 49 LYS HB3 . . 4.660 2.934 2.282 3.396 . 0 0 "[ . 1 . 2]" 1
450 1 20 GLN HE22 1 49 LYS HA . . 4.890 3.092 2.185 4.026 . 0 0 "[ . 1 . 2]" 1
451 1 20 GLN HE22 1 49 LYS HB2 . . 4.660 3.875 3.504 4.761 0.101 16 0 "[ . 1 . 2]" 1
452 1 20 GLN HE22 1 49 LYS HB3 . . 4.660 2.283 1.783 3.550 . 0 0 "[ . 1 . 2]" 1
453 1 20 GLN QG 1 49 LYS HA . . 5.500 3.940 2.781 4.674 . 0 0 "[ . 1 . 2]" 1
454 1 20 GLN QG 1 52 LEU QB . . 4.910 2.907 2.021 4.025 . 0 0 "[ . 1 . 2]" 1
455 1 20 GLN QG 1 52 LEU MD1 . . 5.500 3.328 2.548 4.054 . 0 0 "[ . 1 . 2]" 1
456 1 20 GLN QG 1 52 LEU QD . . 4.410 3.265 2.528 3.944 . 0 0 "[ . 1 . 2]" 1
457 1 20 GLN QG 1 52 LEU MD2 . . 5.500 4.783 3.927 5.551 0.051 8 0 "[ . 1 . 2]" 1
458 1 21 LYS H 1 21 LYS HB2 . . 3.910 2.538 2.451 2.620 . 0 0 "[ . 1 . 2]" 1
459 1 21 LYS H 1 21 LYS QB . . 3.190 2.489 2.412 2.560 . 0 0 "[ . 1 . 2]" 1
460 1 21 LYS H 1 21 LYS HB3 . . 3.910 3.601 3.586 3.614 . 0 0 "[ . 1 . 2]" 1
461 1 21 LYS H 1 21 LYS QD . . 4.490 3.738 3.533 3.861 . 0 0 "[ . 1 . 2]" 1
462 1 21 LYS H 1 21 LYS QE . . 4.300 4.140 3.968 4.332 0.032 1 0 "[ . 1 . 2]" 1
463 1 21 LYS H 1 21 LYS HG2 . . 4.130 3.408 3.267 3.625 . 0 0 "[ . 1 . 2]" 1
464 1 21 LYS H 1 21 LYS QG . . 3.580 2.126 1.989 2.320 . 0 0 "[ . 1 . 2]" 1
465 1 21 LYS H 1 21 LYS HG3 . . 4.130 2.148 2.003 2.348 . 0 0 "[ . 1 . 2]" 1
466 1 21 LYS H 1 22 THR H . . 3.510 2.661 2.608 2.775 . 0 0 "[ . 1 . 2]" 1
467 1 21 LYS HA 1 21 LYS QE . . 5.210 4.701 4.595 4.937 . 0 0 "[ . 1 . 2]" 1
468 1 21 LYS HA 1 21 LYS QG . . 3.320 2.481 2.408 2.558 . 0 0 "[ . 1 . 2]" 1
469 1 21 LYS HA 1 24 LEU H . . 3.950 3.471 3.327 3.764 . 0 0 "[ . 1 . 2]" 1
470 1 21 LYS HA 1 24 LEU HB2 . . 4.230 2.844 2.507 3.413 . 0 0 "[ . 1 . 2]" 1
471 1 21 LYS HA 1 24 LEU QB . . 3.490 2.587 2.240 2.887 . 0 0 "[ . 1 . 2]" 1
472 1 21 LYS HA 1 24 LEU HB3 . . 4.230 3.306 2.387 4.290 0.060 14 0 "[ . 1 . 2]" 1
473 1 21 LYS HA 1 24 LEU MD1 . . 5.270 3.792 2.238 5.040 . 0 0 "[ . 1 . 2]" 1
474 1 21 LYS HA 1 24 LEU QD . . 3.980 3.153 2.232 3.910 . 0 0 "[ . 1 . 2]" 1
475 1 21 LYS HA 1 24 LEU MD2 . . 5.270 4.132 3.010 4.844 . 0 0 "[ . 1 . 2]" 1
476 1 21 LYS HA 1 24 LEU HG . . 5.500 4.014 2.875 5.348 . 0 0 "[ . 1 . 2]" 1
477 1 21 LYS HA 1 25 ASP H . . 4.730 4.435 3.996 4.753 0.023 7 0 "[ . 1 . 2]" 1
478 1 21 LYS HA 1 52 LEU QD . . 5.340 4.191 3.985 4.510 . 0 0 "[ . 1 . 2]" 1
479 1 21 LYS QB 1 22 THR H . . 3.390 2.623 2.487 2.860 . 0 0 "[ . 1 . 2]" 1
480 1 21 LYS HB2 1 21 LYS QE . . 4.230 3.881 3.799 3.960 . 0 0 "[ . 1 . 2]" 1
481 1 21 LYS HB3 1 21 LYS QE . . 4.230 4.021 3.931 4.217 . 0 0 "[ . 1 . 2]" 1
482 1 21 LYS QE 1 21 LYS QG . . 3.340 2.139 2.116 2.253 . 0 0 "[ . 1 . 2]" 1
483 1 21 LYS QG 1 22 THR H . . 5.070 4.038 3.874 4.170 . 0 0 "[ . 1 . 2]" 1
484 1 22 THR H 1 22 THR HB . . 3.020 2.575 2.494 2.644 . 0 0 "[ . 1 . 2]" 1
485 1 22 THR H 1 22 THR MG . . 3.900 3.756 3.740 3.772 . 0 0 "[ . 1 . 2]" 1
486 1 22 THR H 1 24 LEU H . . 4.950 3.847 3.680 3.985 . 0 0 "[ . 1 . 2]" 1
487 1 22 THR HA 1 22 THR MG . . 3.220 2.361 2.315 2.419 . 0 0 "[ . 1 . 2]" 1
488 1 22 THR HA 1 24 LEU H . . 5.500 4.142 3.875 4.358 . 0 0 "[ . 1 . 2]" 1
489 1 22 THR HA 1 25 ASP H . . 4.010 3.620 3.192 4.028 0.018 10 0 "[ . 1 . 2]" 1
490 1 22 THR HA 1 25 ASP QB . . 3.830 3.207 2.733 3.586 . 0 0 "[ . 1 . 2]" 1
491 1 22 THR HA 1 26 TRP H . . 5.500 4.366 4.093 4.721 . 0 0 "[ . 1 . 2]" 1
492 1 22 THR HB 1 23 HIS H . . 3.240 2.621 2.452 2.799 . 0 0 "[ . 1 . 2]" 1
493 1 22 THR HB 1 23 HIS HE1 . . 5.500 4.417 3.797 5.510 0.010 17 0 "[ . 1 . 2]" 1
494 1 22 THR MG 1 23 HIS H . . 4.370 3.591 3.354 3.742 . 0 0 "[ . 1 . 2]" 1
495 1 22 THR MG 1 23 HIS HA . . 4.850 3.623 3.385 3.780 . 0 0 "[ . 1 . 2]" 1
496 1 22 THR MG 1 23 HIS HD2 . . 5.500 4.564 4.140 5.290 . 0 0 "[ . 1 . 2]" 1
497 1 22 THR MG 1 25 ASP QB . . 4.390 3.822 3.185 4.416 0.026 8 0 "[ . 1 . 2]" 1
498 1 22 THR MG 1 26 TRP H . . 5.500 4.168 3.892 4.628 . 0 0 "[ . 1 . 2]" 1
499 1 22 THR MG 1 26 TRP QB . . 5.340 3.543 3.115 3.861 . 0 0 "[ . 1 . 2]" 1
500 1 23 HIS H 1 23 HIS HB2 . . 3.730 2.422 2.291 2.507 . 0 0 "[ . 1 . 2]" 1
501 1 23 HIS H 1 23 HIS QB . . 3.090 2.387 2.266 2.462 . 0 0 "[ . 1 . 2]" 1
502 1 23 HIS H 1 23 HIS HB3 . . 3.730 3.603 3.566 3.619 . 0 0 "[ . 1 . 2]" 1
503 1 23 HIS H 1 23 HIS HD2 . . 5.500 4.574 4.153 4.860 . 0 0 "[ . 1 . 2]" 1
504 1 23 HIS H 1 24 LEU H . . 3.120 2.477 2.303 2.581 . 0 0 "[ . 1 . 2]" 1
505 1 23 HIS H 1 24 LEU QB . . 5.010 4.237 4.009 4.416 . 0 0 "[ . 1 . 2]" 1
506 1 23 HIS H 1 52 LEU QD . . 4.700 3.991 3.766 4.361 . 0 0 "[ . 1 . 2]" 1
507 1 23 HIS HA 1 23 HIS HD2 . . 4.790 2.828 2.589 3.048 . 0 0 "[ . 1 . 2]" 1
508 1 23 HIS HA 1 26 TRP H . . 3.560 2.982 2.790 3.182 . 0 0 "[ . 1 . 2]" 1
509 1 23 HIS HA 1 26 TRP HB2 . . 4.010 2.698 2.281 3.119 . 0 0 "[ . 1 . 2]" 1
510 1 23 HIS HA 1 26 TRP QB . . 3.290 2.018 1.814 2.359 . 0 0 "[ . 1 . 2]" 1
511 1 23 HIS HA 1 26 TRP HB3 . . 4.010 2.088 1.849 2.483 . 0 0 "[ . 1 . 2]" 1
512 1 23 HIS HA 1 26 TRP HD1 . . 5.500 5.074 4.673 5.500 . 0 0 "[ . 1 . 2]" 1
513 1 23 HIS HA 1 26 TRP HE3 . . 4.680 4.062 3.799 4.567 . 0 0 "[ . 1 . 2]" 1
514 1 23 HIS QB 1 23 HIS HD2 . . 3.240 2.857 2.777 2.965 . 0 0 "[ . 1 . 2]" 1
515 1 23 HIS QB 1 24 LEU H . . 3.770 2.991 2.804 3.140 . 0 0 "[ . 1 . 2]" 1
516 1 23 HIS QB 1 52 LEU HA . . 4.830 3.445 3.107 3.761 . 0 0 "[ . 1 . 2]" 1
517 1 23 HIS QB 1 52 LEU QB . . 3.830 2.779 2.312 3.075 . 0 0 "[ . 1 . 2]" 1
518 1 23 HIS QB 1 52 LEU QD . . 3.390 2.354 1.834 2.688 . 0 0 "[ . 1 . 2]" 1
519 1 23 HIS QB 1 55 ILE HB . . 5.130 3.320 3.037 3.675 . 0 0 "[ . 1 . 2]" 1
520 1 23 HIS QB 1 55 ILE MD . . 4.680 3.338 2.864 3.872 . 0 0 "[ . 1 . 2]" 1
521 1 23 HIS QB 1 55 ILE MG . . 4.010 2.943 2.577 3.451 . 0 0 "[ . 1 . 2]" 1
522 1 23 HIS QB 1 56 LYS H . . 5.340 4.328 3.989 4.836 . 0 0 "[ . 1 . 2]" 1
523 1 23 HIS HB2 1 24 LEU H . . 4.500 3.096 2.879 3.270 . 0 0 "[ . 1 . 2]" 1
524 1 23 HIS HB2 1 52 LEU HA . . 5.490 4.078 3.705 4.713 . 0 0 "[ . 1 . 2]" 1
525 1 23 HIS HB2 1 52 LEU HB2 . . 5.460 4.649 4.083 5.025 . 0 0 "[ . 1 . 2]" 1
526 1 23 HIS HB2 1 52 LEU HB3 . . 5.460 2.919 2.424 3.296 . 0 0 "[ . 1 . 2]" 1
527 1 23 HIS HB3 1 24 LEU H . . 4.500 3.960 3.743 4.054 . 0 0 "[ . 1 . 2]" 1
528 1 23 HIS HB3 1 52 LEU HA . . 5.490 3.727 3.254 4.016 . 0 0 "[ . 1 . 2]" 1
529 1 23 HIS HB3 1 52 LEU HB2 . . 5.460 5.388 4.689 5.551 0.091 6 0 "[ . 1 . 2]" 1
530 1 23 HIS HB3 1 52 LEU HB3 . . 5.460 3.728 3.023 3.919 . 0 0 "[ . 1 . 2]" 1
531 1 23 HIS HD2 1 26 TRP H . . 5.500 5.522 5.411 5.577 0.077 19 0 "[ . 1 . 2]" 1
532 1 23 HIS HD2 1 26 TRP HB2 . . 5.290 3.997 3.721 4.324 . 0 0 "[ . 1 . 2]" 1
533 1 23 HIS HD2 1 26 TRP QB . . 4.590 3.354 3.214 3.578 . 0 0 "[ . 1 . 2]" 1
534 1 23 HIS HD2 1 26 TRP HB3 . . 5.290 3.607 3.474 3.816 . 0 0 "[ . 1 . 2]" 1
535 1 23 HIS HD2 1 55 ILE HB . . 5.360 4.399 3.755 5.026 . 0 0 "[ . 1 . 2]" 1
536 1 23 HIS HD2 1 55 ILE MG . . 3.110 2.755 2.415 3.093 . 0 0 "[ . 1 . 2]" 1
537 1 23 HIS HD2 1 56 LYS H . . 4.940 4.854 4.588 4.945 0.005 20 0 "[ . 1 . 2]" 1
538 1 23 HIS HD2 1 56 LYS HA . . 4.180 3.784 3.381 4.058 . 0 0 "[ . 1 . 2]" 1
539 1 23 HIS HD2 1 59 LEU QB . . 5.100 3.942 3.241 4.806 . 0 0 "[ . 1 . 2]" 1
540 1 23 HIS HD2 1 59 LEU QD . . 2.910 2.265 1.791 2.916 0.006 12 0 "[ . 1 . 2]" 1
541 1 23 HIS HE1 1 55 ILE MG . . 5.500 5.385 4.907 5.581 0.081 17 0 "[ . 1 . 2]" 1
542 1 23 HIS HE1 1 56 LYS HA . . 4.530 3.488 3.038 4.290 . 0 0 "[ . 1 . 2]" 1
543 1 23 HIS HE1 1 56 LYS QB . . 5.020 2.587 2.060 3.223 . 0 0 "[ . 1 . 2]" 1
544 1 23 HIS HE1 1 56 LYS HD2 . . 3.990 2.630 1.789 3.897 . 0 0 "[ . 1 . 2]" 1
545 1 23 HIS HE1 1 56 LYS QD . . 3.270 2.308 1.780 2.655 . 0 0 "[ . 1 . 2]" 1
546 1 23 HIS HE1 1 56 LYS HD3 . . 3.990 3.457 1.963 4.057 0.067 10 0 "[ . 1 . 2]" 1
547 1 23 HIS HE1 1 56 LYS HE2 . . 4.660 4.334 3.501 4.796 0.136 20 0 "[ . 1 . 2]" 1
548 1 23 HIS HE1 1 56 LYS HE3 . . 4.660 4.188 3.128 4.743 0.083 9 0 "[ . 1 . 2]" 1
549 1 23 HIS HE1 1 56 LYS QG . . 4.540 2.344 1.962 2.855 . 0 0 "[ . 1 . 2]" 1
550 1 23 HIS HE1 1 59 LEU QD . . 5.060 4.769 4.405 5.161 0.101 14 0 "[ . 1 . 2]" 1
551 1 24 LEU H 1 24 LEU HB2 . . 3.350 2.348 2.161 2.491 . 0 0 "[ . 1 . 2]" 1
552 1 24 LEU H 1 24 LEU HB3 . . 3.350 2.903 2.488 3.528 0.178 12 0 "[ . 1 . 2]" 1
553 1 24 LEU H 1 24 LEU MD1 . . 4.390 4.040 3.807 4.242 . 0 0 "[ . 1 . 2]" 1
554 1 24 LEU H 1 24 LEU QD . . 3.790 3.537 3.262 3.697 . 0 0 "[ . 1 . 2]" 1
555 1 24 LEU H 1 24 LEU MD2 . . 4.390 3.933 3.526 4.274 . 0 0 "[ . 1 . 2]" 1
556 1 24 LEU H 1 24 LEU HG . . 5.180 3.929 2.715 4.536 . 0 0 "[ . 1 . 2]" 1
557 1 24 LEU H 1 25 ASP H . . 3.240 2.692 2.565 2.807 . 0 0 "[ . 1 . 2]" 1
558 1 24 LEU H 1 25 ASP QB . . 5.150 4.459 4.362 4.589 . 0 0 "[ . 1 . 2]" 1
559 1 24 LEU H 1 26 TRP H . . 4.950 3.875 3.672 4.114 . 0 0 "[ . 1 . 2]" 1
560 1 24 LEU H 1 52 LEU MD1 . . 4.650 3.700 3.463 4.128 . 0 0 "[ . 1 . 2]" 1
561 1 24 LEU H 1 52 LEU QD . . 3.770 3.123 2.832 3.400 . 0 0 "[ . 1 . 2]" 1
562 1 24 LEU H 1 52 LEU MD2 . . 4.650 3.375 3.003 3.678 . 0 0 "[ . 1 . 2]" 1
563 1 24 LEU HA 1 24 LEU MD1 . . 4.010 2.962 1.913 3.789 . 0 0 "[ . 1 . 2]" 1
564 1 24 LEU HA 1 24 LEU QD . . 3.010 1.900 1.770 2.058 . 0 0 "[ . 1 . 2]" 1
565 1 24 LEU HA 1 24 LEU MD2 . . 4.010 2.559 1.773 3.878 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU HA 1 24 LEU HG . . 4.000 3.228 2.890 3.713 . 0 0 "[ . 1 . 2]" 1
567 1 24 LEU HA 1 27 LEU H . . 4.030 3.483 3.180 3.732 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU HA 1 27 LEU QB . . 3.840 2.833 2.433 3.298 . 0 0 "[ . 1 . 2]" 1
569 1 24 LEU HA 1 27 LEU QD . . 4.500 3.560 3.204 3.872 . 0 0 "[ . 1 . 2]" 1
570 1 24 LEU HA 1 52 LEU QD . . 3.240 2.607 2.234 3.193 . 0 0 "[ . 1 . 2]" 1
571 1 24 LEU QB 1 24 LEU QD . . 2.850 1.986 1.934 2.073 . 0 0 "[ . 1 . 2]" 1
572 1 24 LEU QB 1 25 ASP H . . 3.290 2.375 2.156 2.541 . 0 0 "[ . 1 . 2]" 1
573 1 24 LEU QB 1 37 PHE HZ . . 4.120 3.328 1.827 4.131 0.011 8 0 "[ . 1 . 2]" 1
574 1 24 LEU HB2 1 25 ASP H . . 3.850 3.290 2.490 3.787 . 0 0 "[ . 1 . 2]" 1
575 1 24 LEU HB3 1 25 ASP H . . 3.850 2.633 2.176 3.308 . 0 0 "[ . 1 . 2]" 1
576 1 24 LEU QD 1 25 ASP H . . 4.410 3.665 3.001 4.096 . 0 0 "[ . 1 . 2]" 1
577 1 24 LEU QD 1 27 LEU H . . 4.690 4.442 4.134 4.713 0.023 14 0 "[ . 1 . 2]" 1
578 1 24 LEU QD 1 27 LEU QD . . 3.650 3.033 2.210 3.594 . 0 0 "[ . 1 . 2]" 1
579 1 24 LEU QD 1 28 LYS H . . 5.050 4.392 3.759 4.899 . 0 0 "[ . 1 . 2]" 1
580 1 24 LEU QD 1 37 PHE QD . . 4.110 4.029 3.804 4.172 0.062 19 0 "[ . 1 . 2]" 1
581 1 24 LEU QD 1 37 PHE QE . . 3.400 2.343 2.023 2.538 . 0 0 "[ . 1 . 2]" 1
582 1 24 LEU QD 1 37 PHE HZ . . 2.860 1.961 1.720 2.567 . 0 0 "[ . 1 . 2]" 1
583 1 24 LEU QD 1 40 PHE QB . . 5.280 4.305 3.893 4.684 . 0 0 "[ . 1 . 2]" 1
584 1 24 LEU QD 1 40 PHE QD . . 3.410 2.897 2.575 3.243 . 0 0 "[ . 1 . 2]" 1
585 1 24 LEU QD 1 41 LEU QD . . 3.580 2.076 1.859 2.309 . 0 0 "[ . 1 . 2]" 1
586 1 24 LEU QD 1 52 LEU QD . . 3.370 2.103 1.860 2.574 . 0 0 "[ . 1 . 2]" 1
587 1 24 LEU QD 1 52 LEU HG . . 5.440 3.993 3.698 4.650 . 0 0 "[ . 1 . 2]" 1
588 1 24 LEU MD1 1 25 ASP H . . 5.150 4.074 3.067 4.599 . 0 0 "[ . 1 . 2]" 1
589 1 24 LEU MD1 1 37 PHE QE . . 4.540 3.018 2.309 4.036 . 0 0 "[ . 1 . 2]" 1
590 1 24 LEU MD1 1 37 PHE HZ . . 3.290 2.445 1.803 3.318 0.028 14 0 "[ . 1 . 2]" 1
591 1 24 LEU MD2 1 25 ASP H . . 5.150 4.341 3.996 4.608 . 0 0 "[ . 1 . 2]" 1
592 1 24 LEU MD2 1 37 PHE QE . . 4.540 2.960 2.036 4.029 . 0 0 "[ . 1 . 2]" 1
593 1 24 LEU MD2 1 37 PHE HZ . . 3.290 2.396 1.783 3.297 0.007 19 0 "[ . 1 . 2]" 1
594 1 24 LEU HG 1 25 ASP H . . 5.290 4.352 3.537 4.811 . 0 0 "[ . 1 . 2]" 1
595 1 24 LEU HG 1 37 PHE HZ . . 4.030 3.279 1.650 4.193 0.163 11 0 "[ . 1 . 2]" 1
596 1 24 LEU HG 1 41 LEU QD . . 5.440 3.899 3.011 4.713 . 0 0 "[ . 1 . 2]" 1
597 1 25 ASP H 1 25 ASP HB2 . . 3.470 2.455 2.271 2.575 . 0 0 "[ . 1 . 2]" 1
598 1 25 ASP H 1 25 ASP QB . . 3.010 2.288 2.227 2.515 . 0 0 "[ . 1 . 2]" 1
599 1 25 ASP H 1 25 ASP HB3 . . 3.470 2.925 2.472 3.598 0.128 6 0 "[ . 1 . 2]" 1
600 1 25 ASP H 1 26 TRP H . . 3.320 2.632 2.502 2.763 . 0 0 "[ . 1 . 2]" 1
601 1 25 ASP H 1 26 TRP HB2 . . 5.370 5.005 4.771 5.127 . 0 0 "[ . 1 . 2]" 1
602 1 25 ASP H 1 26 TRP QB . . 4.650 4.347 4.195 4.453 . 0 0 "[ . 1 . 2]" 1
603 1 25 ASP H 1 26 TRP HB3 . . 5.370 4.773 4.652 4.889 . 0 0 "[ . 1 . 2]" 1
604 1 25 ASP H 1 27 LEU H . . 4.630 4.197 4.052 4.423 . 0 0 "[ . 1 . 2]" 1
605 1 25 ASP H 1 37 PHE HZ . . 4.750 4.822 4.577 4.919 0.169 17 0 "[ . 1 . 2]" 1
606 1 25 ASP HA 1 28 LYS H . . 3.690 3.360 3.066 3.629 . 0 0 "[ . 1 . 2]" 1
607 1 25 ASP HA 1 28 LYS HB2 . . 4.230 3.002 2.416 3.520 . 0 0 "[ . 1 . 2]" 1
608 1 25 ASP HA 1 28 LYS QB . . 3.710 2.541 2.289 2.862 . 0 0 "[ . 1 . 2]" 1
609 1 25 ASP HA 1 28 LYS HB3 . . 4.230 2.834 2.466 3.435 . 0 0 "[ . 1 . 2]" 1
610 1 25 ASP HA 1 28 LYS HD2 . . 5.240 3.915 3.013 5.260 0.020 4 0 "[ . 1 . 2]" 1
611 1 25 ASP HA 1 28 LYS HD3 . . 5.240 4.747 3.304 5.319 0.079 10 0 "[ . 1 . 2]" 1
612 1 25 ASP HA 1 28 LYS QE . . 5.210 3.458 2.026 5.276 0.066 8 0 "[ . 1 . 2]" 1
613 1 25 ASP HA 1 28 LYS QG . . 5.340 4.441 4.126 4.806 . 0 0 "[ . 1 . 2]" 1
614 1 25 ASP HA 1 37 PHE HZ . . 5.180 4.267 3.755 4.944 . 0 0 "[ . 1 . 2]" 1
615 1 25 ASP QB 1 26 TRP H . . 3.220 2.584 2.349 2.756 . 0 0 "[ . 1 . 2]" 1
616 1 25 ASP QB 1 26 TRP QB . . 4.760 4.007 3.773 4.154 . 0 0 "[ . 1 . 2]" 1
617 1 25 ASP HB2 1 26 TRP H . . 3.790 3.434 2.387 3.881 0.091 10 0 "[ . 1 . 2]" 1
618 1 25 ASP HB3 1 26 TRP H . . 3.790 2.936 2.435 3.755 . 0 0 "[ . 1 . 2]" 1
619 1 26 TRP H 1 26 TRP HB2 . . 3.270 2.528 2.461 2.607 . 0 0 "[ . 1 . 2]" 1
620 1 26 TRP H 1 26 TRP HB3 . . 3.270 2.516 2.465 2.553 . 0 0 "[ . 1 . 2]" 1
621 1 26 TRP H 1 26 TRP HE3 . . 4.810 4.686 4.548 4.754 . 0 0 "[ . 1 . 2]" 1
622 1 26 TRP H 1 27 LEU H . . 3.550 2.750 2.669 2.831 . 0 0 "[ . 1 . 2]" 1
623 1 26 TRP H 1 28 LYS H . . 5.180 4.054 3.858 4.280 . 0 0 "[ . 1 . 2]" 1
624 1 26 TRP HA 1 26 TRP HD1 . . 3.460 3.236 3.124 3.309 . 0 0 "[ . 1 . 2]" 1
625 1 26 TRP HA 1 26 TRP HE1 . . 5.470 5.135 5.076 5.198 . 0 0 "[ . 1 . 2]" 1
626 1 26 TRP HA 1 28 LYS H . . 5.450 4.307 4.067 4.610 . 0 0 "[ . 1 . 2]" 1
627 1 26 TRP HA 1 29 GLU H . . 4.130 3.567 3.448 3.705 . 0 0 "[ . 1 . 2]" 1
628 1 26 TRP HA 1 29 GLU QB . . 3.840 3.151 2.582 3.733 . 0 0 "[ . 1 . 2]" 1
629 1 26 TRP HA 1 29 GLU HG2 . . 5.320 4.664 3.282 5.366 0.046 14 0 "[ . 1 . 2]" 1
630 1 26 TRP HA 1 29 GLU QG . . 4.480 3.361 3.064 3.671 . 0 0 "[ . 1 . 2]" 1
631 1 26 TRP HA 1 29 GLU HG3 . . 5.320 3.539 3.106 4.144 . 0 0 "[ . 1 . 2]" 1
632 1 26 TRP HA 1 30 ALA H . . 4.480 4.239 4.040 4.510 0.030 7 0 "[ . 1 . 2]" 1
633 1 26 TRP HA 1 30 ALA MB . . 5.500 4.673 4.338 4.955 . 0 0 "[ . 1 . 2]" 1
634 1 26 TRP QB 1 26 TRP HD1 . . 3.390 2.617 2.592 2.647 . 0 0 "[ . 1 . 2]" 1
635 1 26 TRP QB 1 26 TRP HE3 . . 3.490 2.562 2.524 2.598 . 0 0 "[ . 1 . 2]" 1
636 1 26 TRP QB 1 26 TRP HZ3 . . 5.150 4.802 4.768 4.839 . 0 0 "[ . 1 . 2]" 1
637 1 26 TRP QB 1 27 LEU H . . 3.540 2.459 2.373 2.565 . 0 0 "[ . 1 . 2]" 1
638 1 26 TRP QB 1 59 LEU QD . . 5.180 3.673 3.356 3.963 . 0 0 "[ . 1 . 2]" 1
639 1 26 TRP HB2 1 27 LEU H . . 4.110 3.829 3.767 3.925 . 0 0 "[ . 1 . 2]" 1
640 1 26 TRP HB2 1 55 ILE MG . . 5.500 5.071 4.890 5.340 . 0 0 "[ . 1 . 2]" 1
641 1 26 TRP HB3 1 27 LEU H . . 4.110 2.489 2.399 2.600 . 0 0 "[ . 1 . 2]" 1
642 1 26 TRP HB3 1 55 ILE MG . . 5.500 4.026 3.818 4.269 . 0 0 "[ . 1 . 2]" 1
643 1 26 TRP HD1 1 75 LYS HE2 . . 4.610 3.949 3.484 4.607 . 0 0 "[ . 1 . 2]" 1
644 1 26 TRP HD1 1 75 LYS QE . . 4.030 3.539 2.923 4.007 . 0 0 "[ . 1 . 2]" 1
645 1 26 TRP HD1 1 75 LYS HE3 . . 4.610 4.090 3.084 4.674 0.064 3 0 "[ . 1 . 2]" 1
646 1 26 TRP HD1 1 75 LYS QG . . 5.110 4.728 4.288 5.093 . 0 0 "[ . 1 . 2]" 1
647 1 26 TRP HE1 1 59 LEU MD1 . . 4.730 3.419 2.981 4.366 . 0 0 "[ . 1 . 2]" 1
648 1 26 TRP HE1 1 59 LEU QD . . 4.010 2.900 2.524 3.402 . 0 0 "[ . 1 . 2]" 1
649 1 26 TRP HE1 1 59 LEU MD2 . . 4.730 3.174 2.685 3.838 . 0 0 "[ . 1 . 2]" 1
650 1 26 TRP HE1 1 71 LYS QB . . 4.910 2.953 2.227 3.467 . 0 0 "[ . 1 . 2]" 1
651 1 26 TRP HE1 1 74 PHE QD . . 5.300 4.751 4.214 5.194 . 0 0 "[ . 1 . 2]" 1
652 1 26 TRP HE1 1 75 LYS H . . 5.500 5.128 4.533 5.539 0.039 18 0 "[ . 1 . 2]" 1
653 1 26 TRP HE1 1 75 LYS QD . . 5.340 4.445 3.987 4.838 . 0 0 "[ . 1 . 2]" 1
654 1 26 TRP HE1 1 75 LYS HE2 . . 4.680 3.456 2.843 4.017 . 0 0 "[ . 1 . 2]" 1
655 1 26 TRP HE1 1 75 LYS QE . . 4.120 2.656 2.397 3.027 . 0 0 "[ . 1 . 2]" 1
656 1 26 TRP HE1 1 75 LYS HE3 . . 4.680 2.790 2.428 3.203 . 0 0 "[ . 1 . 2]" 1
657 1 26 TRP HE1 1 75 LYS HG2 . . 5.350 3.788 3.437 4.129 . 0 0 "[ . 1 . 2]" 1
658 1 26 TRP HE1 1 75 LYS HG3 . . 5.350 3.501 2.854 3.901 . 0 0 "[ . 1 . 2]" 1
659 1 26 TRP HE3 1 27 LEU H . . 3.390 2.802 2.689 2.975 . 0 0 "[ . 1 . 2]" 1
660 1 26 TRP HE3 1 27 LEU HA . . 3.420 2.600 2.429 2.797 . 0 0 "[ . 1 . 2]" 1
661 1 26 TRP HE3 1 27 LEU QB . . 3.740 2.798 2.522 3.735 . 0 0 "[ . 1 . 2]" 1
662 1 26 TRP HE3 1 27 LEU MD1 . . 5.320 3.441 3.190 3.844 . 0 0 "[ . 1 . 2]" 1
663 1 26 TRP HE3 1 27 LEU QD . . 4.030 3.265 2.580 3.619 . 0 0 "[ . 1 . 2]" 1
664 1 26 TRP HE3 1 27 LEU MD2 . . 5.320 4.369 2.628 4.755 . 0 0 "[ . 1 . 2]" 1
665 1 26 TRP HE3 1 28 LYS H . . 5.100 5.000 4.836 5.148 0.048 10 0 "[ . 1 . 2]" 1
666 1 26 TRP HE3 1 30 ALA H . . 5.250 4.883 4.650 5.126 . 0 0 "[ . 1 . 2]" 1
667 1 26 TRP HE3 1 55 ILE MD . . 4.010 2.985 2.733 3.243 . 0 0 "[ . 1 . 2]" 1
668 1 26 TRP HE3 1 55 ILE MG . . 3.280 2.852 2.706 3.074 . 0 0 "[ . 1 . 2]" 1
669 1 26 TRP HE3 1 78 VAL QG . . 4.300 3.866 3.727 3.969 . 0 0 "[ . 1 . 2]" 1
670 1 26 TRP HH2 1 55 ILE MD . . 4.840 4.179 3.890 4.585 . 0 0 "[ . 1 . 2]" 1
671 1 26 TRP HH2 1 55 ILE MG . . 3.530 3.372 3.205 3.525 . 0 0 "[ . 1 . 2]" 1
672 1 26 TRP HH2 1 59 LEU QD . . 4.780 3.682 3.306 4.220 . 0 0 "[ . 1 . 2]" 1
673 1 26 TRP HH2 1 74 PHE QB . . 4.210 3.254 2.914 3.722 . 0 0 "[ . 1 . 2]" 1
674 1 26 TRP HH2 1 74 PHE QD . . 3.200 2.842 2.555 3.223 0.023 8 0 "[ . 1 . 2]" 1
675 1 26 TRP HH2 1 75 LYS H . . 4.710 3.818 3.523 4.129 . 0 0 "[ . 1 . 2]" 1
676 1 26 TRP HH2 1 75 LYS HA . . 3.350 2.595 2.385 2.793 . 0 0 "[ . 1 . 2]" 1
677 1 26 TRP HH2 1 75 LYS QG . . 4.440 3.530 3.263 3.782 . 0 0 "[ . 1 . 2]" 1
678 1 26 TRP HH2 1 76 GLN H . . 5.500 5.420 5.250 5.521 0.021 3 0 "[ . 1 . 2]" 1
679 1 26 TRP HH2 1 78 VAL H . . 4.510 4.037 3.654 4.280 . 0 0 "[ . 1 . 2]" 1
680 1 26 TRP HH2 1 78 VAL HB . . 3.660 3.524 3.064 3.776 0.116 8 0 "[ . 1 . 2]" 1
681 1 26 TRP HH2 1 78 VAL QG . . 3.110 2.137 1.875 2.343 . 0 0 "[ . 1 . 2]" 1
682 1 26 TRP HZ2 1 59 LEU MD1 . . 4.190 3.222 2.745 3.668 . 0 0 "[ . 1 . 2]" 1
683 1 26 TRP HZ2 1 59 LEU MD2 . . 4.190 3.223 2.472 4.078 . 0 0 "[ . 1 . 2]" 1
684 1 26 TRP HZ2 1 71 LYS HA . . 5.100 3.774 3.164 4.172 . 0 0 "[ . 1 . 2]" 1
685 1 26 TRP HZ2 1 74 PHE H . . 5.010 4.305 3.843 4.789 . 0 0 "[ . 1 . 2]" 1
686 1 26 TRP HZ2 1 74 PHE QB . . 3.480 2.407 1.888 2.916 . 0 0 "[ . 1 . 2]" 1
687 1 26 TRP HZ2 1 74 PHE QD . . 3.320 2.730 2.390 3.041 . 0 0 "[ . 1 . 2]" 1
688 1 26 TRP HZ2 1 75 LYS H . . 3.420 3.071 2.676 3.350 . 0 0 "[ . 1 . 2]" 1
689 1 26 TRP HZ2 1 75 LYS HA . . 3.960 3.364 2.946 3.722 . 0 0 "[ . 1 . 2]" 1
690 1 26 TRP HZ2 1 75 LYS QB . . 4.490 4.217 3.983 4.495 0.005 12 0 "[ . 1 . 2]" 1
691 1 26 TRP HZ2 1 75 LYS QD . . 5.340 4.482 4.261 4.646 . 0 0 "[ . 1 . 2]" 1
692 1 26 TRP HZ2 1 75 LYS HE2 . . 4.990 4.568 3.858 5.022 0.032 1 0 "[ . 1 . 2]" 1
693 1 26 TRP HZ2 1 75 LYS HE3 . . 4.990 4.025 3.427 4.447 . 0 0 "[ . 1 . 2]" 1
694 1 26 TRP HZ2 1 75 LYS HG2 . . 3.600 3.122 2.677 3.510 . 0 0 "[ . 1 . 2]" 1
695 1 26 TRP HZ2 1 75 LYS HG3 . . 3.600 2.548 2.316 2.722 . 0 0 "[ . 1 . 2]" 1
696 1 26 TRP HZ3 1 27 LEU HA . . 4.530 3.456 3.234 3.711 . 0 0 "[ . 1 . 2]" 1
697 1 26 TRP HZ3 1 27 LEU QB . . 4.680 3.940 3.593 4.753 0.073 10 0 "[ . 1 . 2]" 1
698 1 26 TRP HZ3 1 27 LEU QD . . 3.400 2.871 2.111 3.462 0.062 20 0 "[ . 1 . 2]" 1
699 1 26 TRP HZ3 1 55 ILE MD . . 3.790 2.312 2.116 2.609 . 0 0 "[ . 1 . 2]" 1
700 1 26 TRP HZ3 1 55 ILE QG . . 5.340 3.552 3.332 3.749 . 0 0 "[ . 1 . 2]" 1
701 1 26 TRP HZ3 1 55 ILE MG . . 3.350 2.702 2.522 2.893 . 0 0 "[ . 1 . 2]" 1
702 1 26 TRP HZ3 1 78 VAL H . . 5.430 5.170 4.973 5.385 . 0 0 "[ . 1 . 2]" 1
703 1 26 TRP HZ3 1 78 VAL HA . . 5.500 5.511 5.343 5.614 0.114 10 0 "[ . 1 . 2]" 1
704 1 26 TRP HZ3 1 78 VAL HB . . 4.460 3.422 2.924 3.832 . 0 0 "[ . 1 . 2]" 1
705 1 26 TRP HZ3 1 78 VAL MG1 . . 3.370 2.750 2.389 3.028 . 0 0 "[ . 1 . 2]" 1
706 1 26 TRP HZ3 1 78 VAL MG2 . . 3.370 2.046 1.776 2.319 . 0 0 "[ . 1 . 2]" 1
707 1 27 LEU H 1 27 LEU HB2 . . 3.480 2.421 2.093 2.592 . 0 0 "[ . 1 . 2]" 1
708 1 27 LEU H 1 27 LEU HB3 . . 3.480 2.655 2.430 3.537 0.057 10 0 "[ . 1 . 2]" 1
709 1 27 LEU H 1 27 LEU MD1 . . 4.660 4.028 3.660 4.121 . 0 0 "[ . 1 . 2]" 1
710 1 27 LEU H 1 27 LEU QD . . 4.070 3.667 3.303 3.751 . 0 0 "[ . 1 . 2]" 1
711 1 27 LEU H 1 27 LEU MD2 . . 4.660 4.220 3.760 4.339 . 0 0 "[ . 1 . 2]" 1
712 1 27 LEU H 1 28 LYS H . . 3.490 2.626 2.529 2.779 . 0 0 "[ . 1 . 2]" 1
713 1 27 LEU H 1 28 LYS QB . . 4.850 4.315 4.143 4.395 . 0 0 "[ . 1 . 2]" 1
714 1 27 LEU H 1 29 GLU H . . 5.090 4.282 4.183 4.402 . 0 0 "[ . 1 . 2]" 1
715 1 27 LEU H 1 37 PHE HZ . . 5.500 5.271 4.898 5.534 0.034 1 0 "[ . 1 . 2]" 1
716 1 27 LEU HA 1 27 LEU MD1 . . 4.400 2.438 1.961 3.777 . 0 0 "[ . 1 . 2]" 1
717 1 27 LEU HA 1 27 LEU QD . . 3.180 2.108 1.860 2.781 . 0 0 "[ . 1 . 2]" 1
718 1 27 LEU HA 1 27 LEU MD2 . . 4.400 3.498 1.864 3.891 . 0 0 "[ . 1 . 2]" 1
719 1 27 LEU HA 1 27 LEU HG . . 4.140 2.990 2.318 3.279 . 0 0 "[ . 1 . 2]" 1
720 1 27 LEU HA 1 28 LYS HA . . 5.390 4.838 4.785 4.887 . 0 0 "[ . 1 . 2]" 1
721 1 27 LEU HA 1 30 ALA H . . 3.880 3.048 2.665 3.469 . 0 0 "[ . 1 . 2]" 1
722 1 27 LEU HA 1 30 ALA MB . . 3.450 2.054 1.747 2.498 . 0 0 "[ . 1 . 2]" 1
723 1 27 LEU HA 1 31 LEU H . . 4.650 3.700 3.153 4.051 . 0 0 "[ . 1 . 2]" 1
724 1 27 LEU HA 1 55 ILE MD . . 5.130 4.163 3.830 4.501 . 0 0 "[ . 1 . 2]" 1
725 1 27 LEU HA 1 78 VAL QG . . 4.610 3.866 3.318 4.251 . 0 0 "[ . 1 . 2]" 1
726 1 27 LEU QB 1 28 LYS H . . 3.660 2.703 2.346 2.914 . 0 0 "[ . 1 . 2]" 1
727 1 27 LEU QB 1 28 LYS HA . . 5.250 4.138 3.859 4.266 . 0 0 "[ . 1 . 2]" 1
728 1 27 LEU QB 1 31 LEU QD . . 5.260 3.801 2.088 4.359 . 0 0 "[ . 1 . 2]" 1
729 1 27 LEU QB 1 52 LEU QD . . 5.280 3.061 2.804 3.589 . 0 0 "[ . 1 . 2]" 1
730 1 27 LEU QB 1 55 ILE MD . . 3.920 3.164 2.802 4.001 0.081 10 0 "[ . 1 . 2]" 1
731 1 27 LEU QD 1 28 LYS HA . . 4.970 4.325 3.632 5.015 0.045 10 0 "[ . 1 . 2]" 1
732 1 27 LEU QD 1 30 ALA H . . 5.190 4.056 3.821 4.530 . 0 0 "[ . 1 . 2]" 1
733 1 27 LEU QD 1 31 LEU H . . 4.610 3.278 2.803 3.854 . 0 0 "[ . 1 . 2]" 1
734 1 27 LEU QD 1 31 LEU QD . . 3.100 2.158 1.803 2.563 . 0 0 "[ . 1 . 2]" 1
735 1 27 LEU QD 1 31 LEU HG . . 4.040 2.532 1.789 4.091 0.051 1 0 "[ . 1 . 2]" 1
736 1 27 LEU QD 1 37 PHE QD . . 3.490 2.707 1.950 3.179 . 0 0 "[ . 1 . 2]" 1
737 1 27 LEU QD 1 37 PHE QE . . 3.400 2.269 1.859 2.869 . 0 0 "[ . 1 . 2]" 1
738 1 27 LEU QD 1 37 PHE HZ . . 5.230 4.246 3.816 4.681 . 0 0 "[ . 1 . 2]" 1
739 1 27 LEU QD 1 40 PHE QB . . 4.710 2.836 2.610 3.336 . 0 0 "[ . 1 . 2]" 1
740 1 27 LEU QD 1 40 PHE QD . . 3.780 2.808 2.691 3.157 . 0 0 "[ . 1 . 2]" 1
741 1 27 LEU QD 1 40 PHE HZ . . 3.850 3.441 2.992 3.633 . 0 0 "[ . 1 . 2]" 1
742 1 27 LEU QD 1 51 ALA MB . . 5.440 3.825 3.362 4.057 . 0 0 "[ . 1 . 2]" 1
743 1 27 LEU QD 1 52 LEU QD . . 3.650 2.463 1.889 2.796 . 0 0 "[ . 1 . 2]" 1
744 1 27 LEU QD 1 52 LEU HG . . 5.440 4.141 3.488 4.449 . 0 0 "[ . 1 . 2]" 1
745 1 27 LEU QD 1 55 ILE QG . . 5.280 3.852 3.327 4.216 . 0 0 "[ . 1 . 2]" 1
746 1 27 LEU QD 1 78 VAL H . . 5.440 5.287 5.114 5.589 0.149 20 0 "[ . 1 . 2]" 1
747 1 27 LEU QD 1 78 VAL HA . . 5.440 4.728 4.617 4.847 . 0 0 "[ . 1 . 2]" 1
748 1 27 LEU QD 1 78 VAL QG . . 3.460 1.866 1.721 2.082 . 0 0 "[ . 1 . 2]" 1
749 1 27 LEU QD 1 82 LEU QD . . 4.100 2.221 1.758 2.769 . 0 0 "[ . 1 . 2]" 1
750 1 27 LEU MD1 1 28 LYS H . . 4.940 4.567 4.347 4.928 . 0 0 "[ . 1 . 2]" 1
751 1 27 LEU MD1 1 31 LEU HG . . 5.420 3.070 2.125 5.422 0.002 15 0 "[ . 1 . 2]" 1
752 1 27 LEU MD1 1 40 PHE QD . . 5.230 4.203 2.963 4.690 . 0 0 "[ . 1 . 2]" 1
753 1 27 LEU MD1 1 55 ILE MD . . 3.890 2.420 1.852 2.845 . 0 0 "[ . 1 . 2]" 1
754 1 27 LEU MD2 1 28 LYS H . . 4.940 4.422 3.865 4.749 . 0 0 "[ . 1 . 2]" 1
755 1 27 LEU MD2 1 31 LEU HG . . 5.420 3.746 1.790 5.419 . 0 0 "[ . 1 . 2]" 1
756 1 27 LEU MD2 1 40 PHE QD . . 5.230 3.047 2.712 4.529 . 0 0 "[ . 1 . 2]" 1
757 1 27 LEU MD2 1 55 ILE MD . . 3.890 2.990 2.020 3.935 0.045 9 0 "[ . 1 . 2]" 1
758 1 27 LEU HG 1 28 LYS H . . 5.040 4.197 3.608 5.055 0.015 20 0 "[ . 1 . 2]" 1
759 1 27 LEU HG 1 31 LEU H . . 5.270 4.300 3.788 5.561 0.291 15 0 "[ . 1 . 2]" 1
760 1 27 LEU HG 1 31 LEU QD . . 4.110 2.770 2.040 4.107 . 0 0 "[ . 1 . 2]" 1
761 1 27 LEU HG 1 37 PHE QD . . 4.740 3.002 2.049 4.886 0.146 15 0 "[ . 1 . 2]" 1
762 1 28 LYS H 1 28 LYS HB2 . . 3.250 2.455 2.162 2.706 . 0 0 "[ . 1 . 2]" 1
763 1 28 LYS H 1 28 LYS QB . . 2.830 2.199 2.100 2.254 . 0 0 "[ . 1 . 2]" 1
764 1 28 LYS H 1 28 LYS HB3 . . 3.250 2.541 2.341 2.851 . 0 0 "[ . 1 . 2]" 1
765 1 28 LYS H 1 28 LYS QD . . 4.890 4.556 4.169 4.832 . 0 0 "[ . 1 . 2]" 1
766 1 28 LYS H 1 28 LYS QE . . 5.500 4.500 3.653 5.695 0.195 9 0 "[ . 1 . 2]" 1
767 1 28 LYS H 1 28 LYS HG2 . . 4.630 4.456 4.356 4.535 . 0 0 "[ . 1 . 2]" 1
768 1 28 LYS H 1 28 LYS QG . . 4.000 3.936 3.825 3.981 . 0 0 "[ . 1 . 2]" 1
769 1 28 LYS H 1 28 LYS HG3 . . 4.630 4.391 4.120 4.493 . 0 0 "[ . 1 . 2]" 1
770 1 28 LYS H 1 29 GLU H . . 3.350 2.739 2.589 2.833 . 0 0 "[ . 1 . 2]" 1
771 1 28 LYS H 1 29 GLU QB . . 5.280 4.765 4.627 4.968 . 0 0 "[ . 1 . 2]" 1
772 1 28 LYS H 1 29 GLU QG . . 5.340 4.403 4.079 4.763 . 0 0 "[ . 1 . 2]" 1
773 1 28 LYS H 1 30 ALA H . . 4.590 3.887 3.771 4.053 . 0 0 "[ . 1 . 2]" 1
774 1 28 LYS H 1 37 PHE QE . . 4.650 3.509 3.079 4.301 . 0 0 "[ . 1 . 2]" 1
775 1 28 LYS H 1 37 PHE HZ . . 4.620 4.125 3.715 4.538 . 0 0 "[ . 1 . 2]" 1
776 1 28 LYS HA 1 28 LYS QD . . 4.970 4.092 3.716 4.258 . 0 0 "[ . 1 . 2]" 1
777 1 28 LYS HA 1 28 LYS QE . . 4.900 4.131 3.330 4.556 . 0 0 "[ . 1 . 2]" 1
778 1 28 LYS HA 1 28 LYS HG2 . . 3.670 3.183 2.897 3.652 . 0 0 "[ . 1 . 2]" 1
779 1 28 LYS HA 1 28 LYS QG . . 3.060 2.453 2.295 2.589 . 0 0 "[ . 1 . 2]" 1
780 1 28 LYS HA 1 28 LYS HG3 . . 3.670 2.558 2.400 2.689 . 0 0 "[ . 1 . 2]" 1
781 1 28 LYS HA 1 29 GLU HA . . 4.740 4.738 4.694 4.825 0.085 1 0 "[ . 1 . 2]" 1
782 1 28 LYS HA 1 30 ALA H . . 4.980 4.385 4.177 4.556 . 0 0 "[ . 1 . 2]" 1
783 1 28 LYS HA 1 31 LEU H . . 4.160 3.813 3.493 4.204 0.044 10 0 "[ . 1 . 2]" 1
784 1 28 LYS HA 1 31 LEU QB . . 3.960 3.308 2.749 3.833 . 0 0 "[ . 1 . 2]" 1
785 1 28 LYS HA 1 31 LEU HG . . 5.480 4.789 3.955 5.610 0.130 17 0 "[ . 1 . 2]" 1
786 1 28 LYS HA 1 32 GLY H . . 4.910 4.002 3.648 4.604 . 0 0 "[ . 1 . 2]" 1
787 1 28 LYS HA 1 37 PHE HA . . 5.170 4.693 4.403 4.966 . 0 0 "[ . 1 . 2]" 1
788 1 28 LYS HA 1 37 PHE QD . . 3.570 3.110 2.857 3.447 . 0 0 "[ . 1 . 2]" 1
789 1 28 LYS QB 1 28 LYS QD . . 3.330 2.245 2.076 2.475 . 0 0 "[ . 1 . 2]" 1
790 1 28 LYS QB 1 29 GLU H . . 3.200 2.415 2.301 2.573 . 0 0 "[ . 1 . 2]" 1
791 1 28 LYS QB 1 29 GLU HA . . 4.480 4.183 3.967 4.338 . 0 0 "[ . 1 . 2]" 1
792 1 28 LYS QB 1 30 ALA H . . 5.150 4.512 4.358 4.656 . 0 0 "[ . 1 . 2]" 1
793 1 28 LYS QB 1 37 PHE QE . . 4.300 3.121 2.651 3.614 . 0 0 "[ . 1 . 2]" 1
794 1 28 LYS QB 1 37 PHE HZ . . 4.610 3.431 2.738 4.037 . 0 0 "[ . 1 . 2]" 1
795 1 28 LYS HB2 1 28 LYS QE . . 4.560 2.533 1.834 3.837 . 0 0 "[ . 1 . 2]" 1
796 1 28 LYS HB2 1 29 GLU H . . 3.740 3.741 3.514 3.856 0.116 16 0 "[ . 1 . 2]" 1
797 1 28 LYS HB3 1 28 LYS QE . . 4.560 3.052 1.784 4.168 . 0 0 "[ . 1 . 2]" 1
798 1 28 LYS HB3 1 29 GLU H . . 3.740 2.446 2.332 2.617 . 0 0 "[ . 1 . 2]" 1
799 1 28 LYS QD 1 29 GLU H . . 4.730 4.580 4.228 4.976 0.246 1 0 "[ . 1 . 2]" 1
800 1 28 LYS QD 1 37 PHE QE . . 4.330 3.702 2.641 4.435 0.105 15 0 "[ . 1 . 2]" 1
801 1 28 LYS HD2 1 37 PHE QE . . 5.050 4.384 3.181 5.030 . 0 0 "[ . 1 . 2]" 1
802 1 28 LYS HD3 1 37 PHE QE . . 5.050 4.415 2.663 5.063 0.013 15 0 "[ . 1 . 2]" 1
803 1 28 LYS QE 1 28 LYS HG2 . . 3.750 3.092 2.468 3.488 . 0 0 "[ . 1 . 2]" 1
804 1 28 LYS QE 1 28 LYS HG3 . . 3.750 2.670 2.151 3.467 . 0 0 "[ . 1 . 2]" 1
805 1 28 LYS QE 1 37 PHE QB . . 5.340 4.598 2.977 5.362 0.022 17 0 "[ . 1 . 2]" 1
806 1 28 LYS QE 1 37 PHE QD . . 4.430 3.364 1.961 4.502 0.072 3 0 "[ . 1 . 2]" 1
807 1 28 LYS QE 1 37 PHE QE . . 4.280 2.813 2.092 3.602 . 0 0 "[ . 1 . 2]" 1
808 1 28 LYS QE 1 37 PHE HZ . . 4.960 4.127 3.393 5.057 0.097 12 0 "[ . 1 . 2]" 1
809 1 28 LYS QG 1 29 GLU H . . 4.440 3.532 3.087 4.029 . 0 0 "[ . 1 . 2]" 1
810 1 28 LYS QG 1 29 GLU HA . . 4.900 3.759 3.301 4.421 . 0 0 "[ . 1 . 2]" 1
811 1 28 LYS QG 1 32 GLY H . . 5.340 4.484 3.879 5.394 0.054 10 0 "[ . 1 . 2]" 1
812 1 28 LYS QG 1 37 PHE QB . . 5.180 3.350 2.875 3.768 . 0 0 "[ . 1 . 2]" 1
813 1 28 LYS HG2 1 29 GLU H . . 5.120 3.678 3.175 4.277 . 0 0 "[ . 1 . 2]" 1
814 1 28 LYS HG3 1 29 GLU H . . 5.120 4.589 3.958 4.919 . 0 0 "[ . 1 . 2]" 1
815 1 29 GLU H 1 29 GLU QB . . 2.960 2.476 2.274 2.604 . 0 0 "[ . 1 . 2]" 1
816 1 29 GLU H 1 29 GLU HG2 . . 4.010 2.990 1.927 3.547 . 0 0 "[ . 1 . 2]" 1
817 1 29 GLU H 1 29 GLU QG . . 3.430 2.247 1.917 2.590 . 0 0 "[ . 1 . 2]" 1
818 1 29 GLU H 1 29 GLU HG3 . . 4.010 2.686 2.054 3.707 . 0 0 "[ . 1 . 2]" 1
819 1 29 GLU H 1 30 ALA H . . 3.110 2.533 2.373 2.840 . 0 0 "[ . 1 . 2]" 1
820 1 29 GLU H 1 30 ALA HA . . 5.500 5.155 4.992 5.427 . 0 0 "[ . 1 . 2]" 1
821 1 29 GLU H 1 31 LEU H . . 4.520 4.380 4.179 4.569 0.049 1 0 "[ . 1 . 2]" 1
822 1 29 GLU HA 1 29 GLU QB . . 2.790 2.358 2.298 2.429 . 0 0 "[ . 1 . 2]" 1
823 1 29 GLU HA 1 29 GLU HG2 . . 3.730 2.679 2.465 3.280 . 0 0 "[ . 1 . 2]" 1
824 1 29 GLU HA 1 29 GLU QG . . 3.230 2.582 2.393 3.090 . 0 0 "[ . 1 . 2]" 1
825 1 29 GLU HA 1 29 GLU HG3 . . 3.730 3.398 3.149 3.807 0.077 4 0 "[ . 1 . 2]" 1
826 1 29 GLU HA 1 30 ALA H . . 3.540 3.503 3.473 3.527 . 0 0 "[ . 1 . 2]" 1
827 1 29 GLU HA 1 31 LEU H . . 4.820 4.636 4.466 4.902 0.082 10 0 "[ . 1 . 2]" 1
828 1 29 GLU HA 1 32 GLY H . . 4.280 3.439 3.218 3.719 . 0 0 "[ . 1 . 2]" 1
829 1 29 GLU QB 1 30 ALA H . . 3.370 2.650 2.423 2.792 . 0 0 "[ . 1 . 2]" 1
830 1 29 GLU QB 1 30 ALA HA . . 5.030 3.860 3.678 3.959 . 0 0 "[ . 1 . 2]" 1
831 1 29 GLU QG 1 30 ALA H . . 4.410 4.011 3.842 4.196 . 0 0 "[ . 1 . 2]" 1
832 1 29 GLU QG 1 30 ALA MB . . 5.340 5.232 5.040 5.356 0.016 11 0 "[ . 1 . 2]" 1
833 1 30 ALA H 1 30 ALA MB . . 3.110 2.229 2.219 2.238 . 0 0 "[ . 1 . 2]" 1
834 1 30 ALA H 1 31 LEU H . . 3.410 2.783 2.600 2.966 . 0 0 "[ . 1 . 2]" 1
835 1 30 ALA H 1 32 GLY H . . 4.900 3.919 3.727 4.170 . 0 0 "[ . 1 . 2]" 1
836 1 30 ALA HA 1 32 GLY H . . 4.850 4.510 4.182 4.812 . 0 0 "[ . 1 . 2]" 1
837 1 30 ALA HA 1 75 LYS HA . . 4.270 3.682 2.865 4.344 0.074 1 0 "[ . 1 . 2]" 1
838 1 30 ALA HA 1 75 LYS HB2 . . 3.840 3.603 3.380 3.870 0.030 13 0 "[ . 1 . 2]" 1
839 1 30 ALA HA 1 75 LYS QB . . 3.070 1.994 1.750 2.402 . 0 0 "[ . 1 . 2]" 1
840 1 30 ALA HA 1 75 LYS HB3 . . 3.840 2.004 1.755 2.425 . 0 0 "[ . 1 . 2]" 1
841 1 30 ALA HA 1 75 LYS QD . . 3.590 2.531 2.109 3.070 . 0 0 "[ . 1 . 2]" 1
842 1 30 ALA HA 1 75 LYS HE2 . . 5.120 3.822 3.025 4.165 . 0 0 "[ . 1 . 2]" 1
843 1 30 ALA HA 1 75 LYS QE . . 4.470 3.699 2.963 3.991 . 0 0 "[ . 1 . 2]" 1
844 1 30 ALA HA 1 75 LYS HE3 . . 5.120 4.946 4.236 5.159 0.039 1 0 "[ . 1 . 2]" 1
845 1 30 ALA HA 1 75 LYS HG2 . . 4.750 2.791 2.022 3.386 . 0 0 "[ . 1 . 2]" 1
846 1 30 ALA HA 1 75 LYS QG . . 3.870 2.748 2.010 3.300 . 0 0 "[ . 1 . 2]" 1
847 1 30 ALA HA 1 75 LYS HG3 . . 4.750 4.152 3.509 4.568 . 0 0 "[ . 1 . 2]" 1
848 1 30 ALA MB 1 31 LEU H . . 3.360 2.318 2.105 2.453 . 0 0 "[ . 1 . 2]" 1
849 1 30 ALA MB 1 75 LYS H . . 4.840 4.411 4.242 4.559 . 0 0 "[ . 1 . 2]" 1
850 1 30 ALA MB 1 75 LYS HA . . 3.210 2.251 2.057 2.518 . 0 0 "[ . 1 . 2]" 1
851 1 30 ALA MB 1 75 LYS HB2 . . 4.260 3.795 3.440 4.200 . 0 0 "[ . 1 . 2]" 1
852 1 30 ALA MB 1 75 LYS HB3 . . 4.260 2.485 2.042 3.098 . 0 0 "[ . 1 . 2]" 1
853 1 30 ALA MB 1 75 LYS QD . . 4.780 3.462 3.041 4.011 . 0 0 "[ . 1 . 2]" 1
854 1 30 ALA MB 1 75 LYS QE . . 5.000 3.509 3.195 3.859 . 0 0 "[ . 1 . 2]" 1
855 1 30 ALA MB 1 75 LYS QG . . 4.030 2.227 1.985 2.505 . 0 0 "[ . 1 . 2]" 1
856 1 30 ALA MB 1 76 GLN H . . 5.500 4.759 4.412 5.021 . 0 0 "[ . 1 . 2]" 1
857 1 31 LEU H 1 31 LEU HB2 . . 3.690 2.352 2.199 2.484 . 0 0 "[ . 1 . 2]" 1
858 1 31 LEU H 1 31 LEU QB . . 2.870 2.321 2.176 2.443 . 0 0 "[ . 1 . 2]" 1
859 1 31 LEU H 1 31 LEU HB3 . . 3.690 3.567 3.486 3.611 . 0 0 "[ . 1 . 2]" 1
860 1 31 LEU H 1 31 LEU MD1 . . 4.330 3.525 2.052 3.806 . 0 0 "[ . 1 . 2]" 1
861 1 31 LEU H 1 31 LEU QD . . 3.710 2.952 1.933 3.269 . 0 0 "[ . 1 . 2]" 1
862 1 31 LEU H 1 31 LEU MD2 . . 4.330 3.367 1.942 3.835 . 0 0 "[ . 1 . 2]" 1
863 1 31 LEU H 1 31 LEU HG . . 3.550 2.757 2.342 3.811 0.261 15 0 "[ . 1 . 2]" 1
864 1 31 LEU H 1 32 GLY H . . 3.250 2.537 2.332 2.820 . 0 0 "[ . 1 . 2]" 1
865 1 31 LEU HA 1 31 LEU MD1 . . 4.500 3.512 1.906 3.850 . 0 0 "[ . 1 . 2]" 1
866 1 31 LEU HA 1 31 LEU QD . . 3.020 1.989 1.864 2.563 . 0 0 "[ . 1 . 2]" 1
867 1 31 LEU HA 1 31 LEU MD2 . . 4.500 2.189 1.911 3.779 . 0 0 "[ . 1 . 2]" 1
868 1 31 LEU HA 1 31 LEU HG . . 3.450 3.033 2.424 3.652 0.202 15 0 "[ . 1 . 2]" 1
869 1 31 LEU HA 1 33 ASN H . . 5.500 4.293 4.025 4.829 . 0 0 "[ . 1 . 2]" 1
870 1 31 LEU HA 1 79 GLN HE21 . . 5.340 2.656 1.870 3.820 . 0 0 "[ . 1 . 2]" 1
871 1 31 LEU HA 1 79 GLN HE22 . . 5.340 3.639 2.428 4.656 . 0 0 "[ . 1 . 2]" 1
872 1 31 LEU HA 1 79 GLN HG2 . . 3.950 2.387 1.798 3.320 . 0 0 "[ . 1 . 2]" 1
873 1 31 LEU HA 1 79 GLN QG . . 3.380 2.314 1.788 2.959 . 0 0 "[ . 1 . 2]" 1
874 1 31 LEU HA 1 79 GLN HG3 . . 3.950 3.403 2.853 4.077 0.127 20 0 "[ . 1 . 2]" 1
875 1 31 LEU QB 1 32 GLY H . . 3.450 2.703 2.412 2.999 . 0 0 "[ . 1 . 2]" 1
876 1 31 LEU QB 1 32 GLY QA . . 4.250 4.003 3.858 4.187 . 0 0 "[ . 1 . 2]" 1
877 1 31 LEU QB 1 33 ASN H . . 4.790 3.019 2.476 3.551 . 0 0 "[ . 1 . 2]" 1
878 1 31 LEU QB 1 33 ASN QB . . 5.080 3.598 2.802 4.480 . 0 0 "[ . 1 . 2]" 1
879 1 31 LEU QB 1 36 GLU QB . . 3.800 2.528 1.994 3.860 0.060 5 0 "[ . 1 . 2]" 1
880 1 31 LEU QB 1 37 PHE QB . . 3.650 2.648 2.444 2.905 . 0 0 "[ . 1 . 2]" 1
881 1 31 LEU QB 1 37 PHE QD . . 4.690 3.668 3.039 4.198 . 0 0 "[ . 1 . 2]" 1
882 1 31 LEU QB 1 79 GLN QG . . 5.180 4.031 3.619 4.728 . 0 0 "[ . 1 . 2]" 1
883 1 31 LEU HB2 1 32 GLY H . . 4.130 2.787 2.465 3.111 . 0 0 "[ . 1 . 2]" 1
884 1 31 LEU HB2 1 32 GLY QA . . 4.970 4.410 4.184 4.641 . 0 0 "[ . 1 . 2]" 1
885 1 31 LEU HB2 1 37 PHE H . . 4.970 4.076 3.563 4.359 . 0 0 "[ . 1 . 2]" 1
886 1 31 LEU HB2 1 37 PHE HB2 . . 4.980 2.766 2.510 3.146 . 0 0 "[ . 1 . 2]" 1
887 1 31 LEU HB2 1 37 PHE HB3 . . 4.980 4.432 4.030 4.902 . 0 0 "[ . 1 . 2]" 1
888 1 31 LEU HB3 1 32 GLY H . . 4.130 3.650 3.230 3.932 . 0 0 "[ . 1 . 2]" 1
889 1 31 LEU HB3 1 32 GLY QA . . 4.970 4.598 4.323 4.777 . 0 0 "[ . 1 . 2]" 1
890 1 31 LEU HB3 1 37 PHE H . . 4.970 3.754 3.416 4.033 . 0 0 "[ . 1 . 2]" 1
891 1 31 LEU HB3 1 37 PHE HB2 . . 4.980 3.637 3.477 3.813 . 0 0 "[ . 1 . 2]" 1
892 1 31 LEU HB3 1 37 PHE HB3 . . 4.980 5.040 4.796 5.126 0.146 11 0 "[ . 1 . 2]" 1
893 1 31 LEU QD 1 32 GLY H . . 5.300 4.100 3.792 4.293 . 0 0 "[ . 1 . 2]" 1
894 1 31 LEU QD 1 36 GLU H . . 5.440 4.441 4.056 4.828 . 0 0 "[ . 1 . 2]" 1
895 1 31 LEU QD 1 36 GLU QB . . 3.620 2.373 1.780 3.417 . 0 0 "[ . 1 . 2]" 1
896 1 31 LEU QD 1 36 GLU QG . . 4.060 3.760 2.785 4.194 0.134 18 0 "[ . 1 . 2]" 1
897 1 31 LEU QD 1 37 PHE H . . 4.360 3.213 2.769 3.955 . 0 0 "[ . 1 . 2]" 1
898 1 31 LEU QD 1 37 PHE HA . . 3.440 1.994 1.761 3.085 . 0 0 "[ . 1 . 2]" 1
899 1 31 LEU QD 1 37 PHE QB . . 3.530 2.564 1.966 3.176 . 0 0 "[ . 1 . 2]" 1
900 1 31 LEU QD 1 37 PHE QD . . 2.900 2.148 1.774 2.868 . 0 0 "[ . 1 . 2]" 1
901 1 31 LEU QD 1 40 PHE H . . 4.820 3.954 3.147 4.786 . 0 0 "[ . 1 . 2]" 1
902 1 31 LEU QD 1 40 PHE QB . . 4.150 2.994 2.316 3.712 . 0 0 "[ . 1 . 2]" 1
903 1 31 LEU QD 1 40 PHE QD . . 5.390 4.164 3.606 4.725 . 0 0 "[ . 1 . 2]" 1
904 1 31 LEU QD 1 79 GLN H . . 4.500 3.834 3.339 4.212 . 0 0 "[ . 1 . 2]" 1
905 1 31 LEU QD 1 79 GLN HA . . 3.170 2.291 1.810 2.823 . 0 0 "[ . 1 . 2]" 1
906 1 31 LEU QD 1 79 GLN QB . . 3.610 3.491 3.239 3.692 0.082 5 0 "[ . 1 . 2]" 1
907 1 31 LEU QD 1 79 GLN QE . . 4.850 3.151 2.339 4.011 . 0 0 "[ . 1 . 2]" 1
908 1 31 LEU QD 1 79 GLN QG . . 3.230 2.152 1.777 2.916 . 0 0 "[ . 1 . 2]" 1
909 1 31 LEU QD 1 80 GLY H . . 5.440 5.063 4.584 5.459 0.019 1 0 "[ . 1 . 2]" 1
910 1 31 LEU QD 1 82 LEU QD . . 3.540 2.563 1.860 3.274 . 0 0 "[ . 1 . 2]" 1
911 1 31 LEU MD1 1 37 PHE H . . 5.460 3.518 2.785 5.344 . 0 0 "[ . 1 . 2]" 1
912 1 31 LEU MD2 1 37 PHE H . . 5.460 4.726 2.933 5.387 . 0 0 "[ . 1 . 2]" 1
913 1 32 GLY H 1 32 GLY QA . . 2.740 2.220 2.190 2.258 . 0 0 "[ . 1 . 2]" 1
914 1 32 GLY H 1 33 ASN H . . 3.630 3.169 2.481 3.649 0.019 5 0 "[ . 1 . 2]" 1
915 1 32 GLY H 1 79 GLN QE . . 5.340 4.740 4.217 5.319 . 0 0 "[ . 1 . 2]" 1
916 1 32 GLY QA 1 33 ASN H . . 3.270 2.650 2.461 2.906 . 0 0 "[ . 1 . 2]" 1
917 1 32 GLY QA 1 33 ASN QB . . 5.280 4.163 3.852 4.507 . 0 0 "[ . 1 . 2]" 1
918 1 32 GLY QA 1 79 GLN QE . . 5.340 4.348 3.372 5.123 . 0 0 "[ . 1 . 2]" 1
919 1 33 ASN H 1 33 ASN HB2 . . 3.820 2.784 2.291 3.333 . 0 0 "[ . 1 . 2]" 1
920 1 33 ASN H 1 33 ASN HB3 . . 3.820 3.130 2.410 3.664 . 0 0 "[ . 1 . 2]" 1
921 1 33 ASN H 1 34 ASP H . . 4.500 4.344 4.025 4.545 0.045 13 0 "[ . 1 . 2]" 1
922 1 33 ASN HA 1 33 ASN HD22 . . 5.230 4.495 3.824 4.803 . 0 0 "[ . 1 . 2]" 1
923 1 33 ASN HA 1 35 GLY H . . 5.110 3.845 3.522 4.448 . 0 0 "[ . 1 . 2]" 1
924 1 33 ASN QB 1 36 GLU H . . 3.450 2.561 2.332 2.833 . 0 0 "[ . 1 . 2]" 1
925 1 33 ASN QB 1 36 GLU QB . . 3.420 2.483 1.864 3.386 . 0 0 "[ . 1 . 2]" 1
926 1 33 ASN HB2 1 36 GLU H . . 4.030 3.614 2.427 4.173 0.143 5 0 "[ . 1 . 2]" 1
927 1 33 ASN HB3 1 36 GLU H . . 4.030 2.719 2.484 3.221 . 0 0 "[ . 1 . 2]" 1
928 1 33 ASN QD 1 35 GLY H . . 5.340 4.298 3.072 5.427 0.087 6 0 "[ . 1 . 2]" 1
929 1 33 ASN QD 1 36 GLU H . . 5.330 3.866 2.463 4.760 . 0 0 "[ . 1 . 2]" 1
930 1 33 ASN QD 1 36 GLU QG . . 4.760 2.773 1.740 3.967 . 0 0 "[ . 1 . 2]" 1
931 1 34 ASP H 1 34 ASP HB2 . . 3.900 2.689 2.219 3.606 . 0 0 "[ . 1 . 2]" 1
932 1 34 ASP H 1 34 ASP HB3 . . 3.900 2.880 2.471 3.607 . 0 0 "[ . 1 . 2]" 1
933 1 34 ASP H 1 35 GLY H . . 3.950 2.609 2.081 2.844 . 0 0 "[ . 1 . 2]" 1
934 1 34 ASP HA 1 37 PHE QB . . 3.490 2.582 1.994 3.459 . 0 0 "[ . 1 . 2]" 1
935 1 34 ASP QB 1 35 GLY H . . 3.360 2.823 2.275 3.463 0.103 17 0 "[ . 1 . 2]" 1
936 1 34 ASP HB2 1 35 GLY H . . 3.830 3.530 2.340 3.912 0.082 6 0 "[ . 1 . 2]" 1
937 1 34 ASP HB3 1 35 GLY H . . 3.830 3.244 2.297 3.933 0.103 1 0 "[ . 1 . 2]" 1
938 1 35 GLY H 1 36 GLU H . . 3.300 2.709 2.571 2.924 . 0 0 "[ . 1 . 2]" 1
939 1 35 GLY H 1 36 GLU QB . . 5.140 4.795 4.654 5.165 0.025 5 0 "[ . 1 . 2]" 1
940 1 35 GLY H 1 36 GLU QG . . 5.300 4.349 3.981 5.308 0.008 4 0 "[ . 1 . 2]" 1
941 1 35 GLY QA 1 38 ASP H . . 5.020 3.414 3.198 3.573 . 0 0 "[ . 1 . 2]" 1
942 1 35 GLY QA 1 38 ASP QB . . 3.380 2.517 2.268 2.841 . 0 0 "[ . 1 . 2]" 1
943 1 35 GLY QA 1 39 LYS H . . 4.740 4.269 3.722 4.705 . 0 0 "[ . 1 . 2]" 1
944 1 35 GLY HA2 1 38 ASP HB2 . . 5.020 2.924 2.616 3.252 . 0 0 "[ . 1 . 2]" 1
945 1 35 GLY HA2 1 38 ASP HB3 . . 5.020 2.855 2.406 3.346 . 0 0 "[ . 1 . 2]" 1
946 1 35 GLY HA3 1 38 ASP HB2 . . 5.020 4.611 4.295 4.924 . 0 0 "[ . 1 . 2]" 1
947 1 35 GLY HA3 1 38 ASP HB3 . . 5.020 4.271 3.950 4.682 . 0 0 "[ . 1 . 2]" 1
948 1 36 GLU H 1 36 GLU HB2 . . 3.590 2.531 2.373 3.634 0.044 5 0 "[ . 1 . 2]" 1
949 1 36 GLU H 1 36 GLU QB . . 3.040 2.446 2.341 2.714 . 0 0 "[ . 1 . 2]" 1
950 1 36 GLU H 1 36 GLU HB3 . . 3.590 3.568 2.802 3.649 0.059 6 0 "[ . 1 . 2]" 1
951 1 36 GLU H 1 36 GLU HG2 . . 3.690 2.856 1.878 3.784 0.094 4 0 "[ . 1 . 2]" 1
952 1 36 GLU H 1 36 GLU QG . . 3.110 2.327 1.866 2.861 . 0 0 "[ . 1 . 2]" 1
953 1 36 GLU H 1 36 GLU HG3 . . 3.690 3.114 2.179 3.823 0.133 13 0 "[ . 1 . 2]" 1
954 1 36 GLU H 1 37 PHE H . . 3.140 2.462 2.096 2.756 . 0 0 "[ . 1 . 2]" 1
955 1 36 GLU H 1 37 PHE HB2 . . 5.500 4.872 4.453 5.173 . 0 0 "[ . 1 . 2]" 1
956 1 36 GLU H 1 37 PHE QB . . 4.830 4.234 3.852 4.582 . 0 0 "[ . 1 . 2]" 1
957 1 36 GLU H 1 37 PHE HB3 . . 5.500 4.657 4.216 5.115 . 0 0 "[ . 1 . 2]" 1
958 1 36 GLU H 1 39 LYS H . . 5.410 4.791 4.339 5.071 . 0 0 "[ . 1 . 2]" 1
959 1 36 GLU HA 1 36 GLU HG2 . . 3.830 2.910 2.455 3.645 . 0 0 "[ . 1 . 2]" 1
960 1 36 GLU HA 1 36 GLU QG . . 3.360 2.722 2.359 3.333 . 0 0 "[ . 1 . 2]" 1
961 1 36 GLU HA 1 36 GLU HG3 . . 3.830 3.421 2.454 3.860 0.030 5 0 "[ . 1 . 2]" 1
962 1 36 GLU HA 1 39 LYS H . . 3.430 3.317 3.098 3.491 0.061 1 0 "[ . 1 . 2]" 1
963 1 36 GLU HA 1 39 LYS QB . . 3.150 2.839 2.207 3.203 0.053 11 0 "[ . 1 . 2]" 1
964 1 36 GLU HA 1 39 LYS QG . . 5.340 4.288 2.597 5.177 . 0 0 "[ . 1 . 2]" 1
965 1 36 GLU HB2 1 37 PHE H . . 4.200 2.835 2.525 4.025 . 0 0 "[ . 1 . 2]" 1
966 1 36 GLU HB2 1 39 LYS H . . 5.500 5.474 5.027 5.569 0.069 4 0 "[ . 1 . 2]" 1
967 1 36 GLU HB3 1 37 PHE H . . 4.200 3.804 3.646 4.224 0.024 5 0 "[ . 1 . 2]" 1
968 1 36 GLU HB3 1 39 LYS H . . 5.500 5.211 4.963 5.497 . 0 0 "[ . 1 . 2]" 1
969 1 36 GLU QG 1 37 PHE H . . 5.250 4.029 2.660 4.411 . 0 0 "[ . 1 . 2]" 1
970 1 37 PHE H 1 37 PHE HB2 . . 3.400 2.589 2.408 2.703 . 0 0 "[ . 1 . 2]" 1
971 1 37 PHE H 1 37 PHE HB3 . . 3.400 2.474 2.319 2.603 . 0 0 "[ . 1 . 2]" 1
972 1 37 PHE H 1 37 PHE QD . . 4.500 4.180 4.132 4.213 . 0 0 "[ . 1 . 2]" 1
973 1 37 PHE H 1 38 ASP H . . 3.530 2.488 2.425 2.578 . 0 0 "[ . 1 . 2]" 1
974 1 37 PHE H 1 39 LYS H . . 4.660 4.061 3.824 4.281 . 0 0 "[ . 1 . 2]" 1
975 1 37 PHE H 1 40 PHE H . . 5.500 5.067 4.634 5.428 . 0 0 "[ . 1 . 2]" 1
976 1 37 PHE HA 1 37 PHE QD . . 3.520 2.344 1.921 2.577 . 0 0 "[ . 1 . 2]" 1
977 1 37 PHE HA 1 40 PHE QB . . 3.940 3.003 2.522 3.398 . 0 0 "[ . 1 . 2]" 1
978 1 37 PHE QB 1 38 ASP H . . 3.600 2.681 2.528 2.884 . 0 0 "[ . 1 . 2]" 1
979 1 37 PHE HB2 1 38 ASP H . . 4.100 3.933 3.798 4.104 0.004 18 0 "[ . 1 . 2]" 1
980 1 37 PHE HB3 1 38 ASP H . . 4.100 2.729 2.566 2.946 . 0 0 "[ . 1 . 2]" 1
981 1 37 PHE QD 1 38 ASP H . . 4.470 4.031 3.734 4.333 . 0 0 "[ . 1 . 2]" 1
982 1 37 PHE QE 1 41 LEU MD1 . . 4.040 2.986 2.208 4.035 . 0 0 "[ . 1 . 2]" 1
983 1 37 PHE QE 1 41 LEU QD . . 3.450 2.554 2.119 3.033 . 0 0 "[ . 1 . 2]" 1
984 1 37 PHE QE 1 41 LEU MD2 . . 4.040 2.907 2.667 3.155 . 0 0 "[ . 1 . 2]" 1
985 1 37 PHE HZ 1 41 LEU MD1 . . 4.710 3.916 3.619 4.361 . 0 0 "[ . 1 . 2]" 1
986 1 37 PHE HZ 1 41 LEU QD . . 3.320 2.813 2.477 3.348 0.028 14 0 "[ . 1 . 2]" 1
987 1 37 PHE HZ 1 41 LEU MD2 . . 4.710 2.900 2.518 3.694 . 0 0 "[ . 1 . 2]" 1
988 1 38 ASP H 1 38 ASP HB2 . . 3.150 2.390 2.296 2.659 . 0 0 "[ . 1 . 2]" 1
989 1 38 ASP H 1 38 ASP HB3 . . 3.150 2.606 2.409 2.715 . 0 0 "[ . 1 . 2]" 1
990 1 38 ASP H 1 39 LYS H . . 3.370 2.728 2.649 2.849 . 0 0 "[ . 1 . 2]" 1
991 1 38 ASP H 1 41 LEU QD . . 5.440 3.918 3.623 4.233 . 0 0 "[ . 1 . 2]" 1
992 1 38 ASP HA 1 39 LYS HA . . 4.880 4.861 4.764 4.938 0.058 7 0 "[ . 1 . 2]" 1
993 1 38 ASP HA 1 40 PHE QB . . 4.960 4.872 4.429 5.052 0.092 7 0 "[ . 1 . 2]" 1
994 1 38 ASP HA 1 41 LEU H . . 4.310 3.403 3.155 3.669 . 0 0 "[ . 1 . 2]" 1
995 1 38 ASP HA 1 41 LEU QB . . 3.510 2.796 2.306 3.511 0.001 14 0 "[ . 1 . 2]" 1
996 1 38 ASP HA 1 41 LEU QD . . 3.370 2.136 1.757 2.976 . 0 0 "[ . 1 . 2]" 1
997 1 38 ASP HA 1 41 LEU HG . . 3.900 3.175 2.541 3.895 . 0 0 "[ . 1 . 2]" 1
998 1 38 ASP QB 1 39 LYS QB . . 5.340 3.854 3.690 3.965 . 0 0 "[ . 1 . 2]" 1
999 1 38 ASP QB 1 40 PHE H . . 5.340 4.676 4.494 4.861 . 0 0 "[ . 1 . 2]" 1
1000 1 38 ASP QB 1 41 LEU QD . . 4.940 3.761 3.374 4.514 . 0 0 "[ . 1 . 2]" 1
1001 1 38 ASP HB2 1 39 LYS H . . 3.450 3.688 3.633 3.769 0.319 18 0 "[ . 1 . 2]" 1
1002 1 38 ASP HB3 1 39 LYS H . . 3.450 2.428 2.303 2.546 . 0 0 "[ . 1 . 2]" 1
1003 1 39 LYS H 1 39 LYS QB . . 2.700 2.227 2.157 2.283 . 0 0 "[ . 1 . 2]" 1
1004 1 39 LYS H 1 39 LYS QD . . 4.490 4.171 3.856 4.558 0.068 20 0 "[ . 1 . 2]" 1
1005 1 39 LYS H 1 39 LYS QG . . 4.820 3.902 2.612 4.065 . 0 0 "[ . 1 . 2]" 1
1006 1 39 LYS H 1 40 PHE HB2 . . 5.380 5.249 4.953 5.391 0.011 10 0 "[ . 1 . 2]" 1
1007 1 39 LYS H 1 40 PHE QB . . 4.610 4.525 4.388 4.609 . 0 0 "[ . 1 . 2]" 1
1008 1 39 LYS H 1 40 PHE HB3 . . 5.380 4.945 4.838 5.077 . 0 0 "[ . 1 . 2]" 1
1009 1 39 LYS HA 1 39 LYS QB . . 2.780 2.357 2.156 2.449 . 0 0 "[ . 1 . 2]" 1
1010 1 39 LYS HA 1 39 LYS QD . . 4.490 2.620 1.904 4.531 0.041 18 0 "[ . 1 . 2]" 1
1011 1 39 LYS HA 1 39 LYS QE . . 5.450 3.715 1.716 5.445 . 0 0 "[ . 1 . 2]" 1
1012 1 39 LYS HA 1 39 LYS HG2 . . 3.890 3.713 3.153 3.882 . 0 0 "[ . 1 . 2]" 1
1013 1 39 LYS HA 1 39 LYS HG3 . . 3.890 2.995 2.452 3.683 . 0 0 "[ . 1 . 2]" 1
1014 1 39 LYS QB 1 39 LYS QE . . 3.970 2.944 1.761 3.810 . 0 0 "[ . 1 . 2]" 1
1015 1 39 LYS QB 1 40 PHE H . . 3.350 2.648 2.205 3.584 0.234 11 0 "[ . 1 . 2]" 1
1016 1 39 LYS QB 1 40 PHE QB . . 4.910 3.968 3.548 4.852 . 0 0 "[ . 1 . 2]" 1
1017 1 39 LYS QB 1 43 TYR QD . . 5.310 5.286 4.999 5.383 0.073 10 0 "[ . 1 . 2]" 1
1018 1 39 LYS QB 1 43 TYR QE . . 5.500 4.178 3.889 4.381 . 0 0 "[ . 1 . 2]" 1
1019 1 39 LYS QG 1 40 PHE H . . 4.460 3.582 2.287 4.230 . 0 0 "[ . 1 . 2]" 1
1020 1 39 LYS QG 1 43 TYR QE . . 3.720 2.862 2.348 3.649 . 0 0 "[ . 1 . 2]" 1
1021 1 40 PHE H 1 40 PHE HB2 . . 3.150 2.589 2.439 2.685 . 0 0 "[ . 1 . 2]" 1
1022 1 40 PHE H 1 40 PHE QB . . 2.670 2.223 2.199 2.262 . 0 0 "[ . 1 . 2]" 1
1023 1 40 PHE H 1 40 PHE HB3 . . 3.150 2.426 2.345 2.527 . 0 0 "[ . 1 . 2]" 1
1024 1 40 PHE H 1 40 PHE QD . . 4.130 4.162 4.147 4.188 0.058 4 0 "[ . 1 . 2]" 1
1025 1 40 PHE H 1 41 LEU MD1 . . 5.500 5.109 4.790 5.657 0.157 11 0 "[ . 1 . 2]" 1
1026 1 40 PHE H 1 41 LEU QD . . 4.660 4.145 3.111 4.706 0.046 4 0 "[ . 1 . 2]" 1
1027 1 40 PHE H 1 41 LEU MD2 . . 5.500 4.575 3.138 5.335 . 0 0 "[ . 1 . 2]" 1
1028 1 40 PHE H 1 43 TYR QD . . 4.960 4.581 4.442 4.687 . 0 0 "[ . 1 . 2]" 1
1029 1 40 PHE H 1 43 TYR QE . . 4.720 4.480 4.083 4.750 0.030 5 0 "[ . 1 . 2]" 1
1030 1 40 PHE HA 1 40 PHE QD . . 3.790 2.768 2.551 2.899 . 0 0 "[ . 1 . 2]" 1
1031 1 40 PHE HA 1 42 GLY H . . 4.920 3.794 3.543 4.118 . 0 0 "[ . 1 . 2]" 1
1032 1 40 PHE HA 1 43 TYR QD . . 3.080 1.881 1.772 2.192 . 0 0 "[ . 1 . 2]" 1
1033 1 40 PHE HA 1 43 TYR QE . . 2.950 2.630 2.265 2.986 0.036 5 0 "[ . 1 . 2]" 1
1034 1 40 PHE HA 1 86 ILE HB . . 5.190 4.558 4.043 5.164 . 0 0 "[ . 1 . 2]" 1
1035 1 40 PHE HA 1 86 ILE MD . . 5.310 3.720 3.347 3.977 . 0 0 "[ . 1 . 2]" 1
1036 1 40 PHE QB 1 41 LEU H . . 3.340 2.628 2.443 2.760 . 0 0 "[ . 1 . 2]" 1
1037 1 40 PHE QB 1 41 LEU HA . . 5.340 4.164 4.062 4.265 . 0 0 "[ . 1 . 2]" 1
1038 1 40 PHE QB 1 41 LEU QD . . 4.460 3.154 2.007 3.647 . 0 0 "[ . 1 . 2]" 1
1039 1 40 PHE QB 1 41 LEU HG . . 4.800 3.625 3.025 4.913 0.113 14 0 "[ . 1 . 2]" 1
1040 1 40 PHE QB 1 42 GLY H . . 5.340 4.509 4.430 4.592 . 0 0 "[ . 1 . 2]" 1
1041 1 40 PHE QB 1 82 LEU QD . . 4.960 3.083 2.250 3.902 . 0 0 "[ . 1 . 2]" 1
1042 1 40 PHE HB2 1 41 LEU H . . 3.920 3.929 3.827 3.999 0.079 8 0 "[ . 1 . 2]" 1
1043 1 40 PHE HB3 1 41 LEU H . . 3.920 2.670 2.472 2.814 . 0 0 "[ . 1 . 2]" 1
1044 1 40 PHE QD 1 41 LEU HA . . 4.100 3.445 3.068 3.783 . 0 0 "[ . 1 . 2]" 1
1045 1 40 PHE QD 1 41 LEU QD . . 3.680 2.301 1.791 2.691 . 0 0 "[ . 1 . 2]" 1
1046 1 40 PHE QD 1 51 ALA MB . . 3.910 3.975 3.904 4.027 0.117 9 0 "[ . 1 . 2]" 1
1047 1 40 PHE QD 1 52 LEU MD1 . . 4.880 4.594 4.252 4.881 0.001 4 0 "[ . 1 . 2]" 1
1048 1 40 PHE QD 1 52 LEU QD . . 3.920 3.836 3.580 3.942 0.022 10 0 "[ . 1 . 2]" 1
1049 1 40 PHE QD 1 52 LEU MD2 . . 4.880 4.114 3.840 4.230 . 0 0 "[ . 1 . 2]" 1
1050 1 40 PHE QD 1 82 LEU MD1 . . 3.980 2.396 2.105 2.753 . 0 0 "[ . 1 . 2]" 1
1051 1 40 PHE QD 1 82 LEU QD . . 3.290 2.279 1.906 2.635 . 0 0 "[ . 1 . 2]" 1
1052 1 40 PHE QD 1 82 LEU MD2 . . 3.980 3.044 2.109 3.945 . 0 0 "[ . 1 . 2]" 1
1053 1 40 PHE HZ 1 48 ILE HA . . 3.990 2.932 2.758 3.471 . 0 0 "[ . 1 . 2]" 1
1054 1 40 PHE HZ 1 48 ILE QG . . 4.660 3.916 3.623 4.299 . 0 0 "[ . 1 . 2]" 1
1055 1 40 PHE HZ 1 48 ILE MG . . 3.400 2.418 2.187 2.679 . 0 0 "[ . 1 . 2]" 1
1056 1 40 PHE HZ 1 51 ALA MB . . 3.510 2.474 2.133 2.851 . 0 0 "[ . 1 . 2]" 1
1057 1 40 PHE HZ 1 52 LEU H . . 4.570 3.244 2.971 3.517 . 0 0 "[ . 1 . 2]" 1
1058 1 40 PHE HZ 1 52 LEU QD . . 3.100 2.551 2.195 2.706 . 0 0 "[ . 1 . 2]" 1
1059 1 40 PHE HZ 1 52 LEU HG . . 3.980 2.006 1.850 2.182 . 0 0 "[ . 1 . 2]" 1
1060 1 41 LEU H 1 41 LEU HB2 . . 3.590 2.472 2.263 2.647 . 0 0 "[ . 1 . 2]" 1
1061 1 41 LEU H 1 41 LEU QB . . 3.010 2.428 2.236 2.580 . 0 0 "[ . 1 . 2]" 1
1062 1 41 LEU H 1 41 LEU HB3 . . 3.590 3.562 3.495 3.594 0.004 6 0 "[ . 1 . 2]" 1
1063 1 41 LEU H 1 41 LEU MD1 . . 4.210 3.508 3.220 3.725 . 0 0 "[ . 1 . 2]" 1
1064 1 41 LEU H 1 41 LEU QD . . 3.670 2.718 1.752 3.086 . 0 0 "[ . 1 . 2]" 1
1065 1 41 LEU H 1 41 LEU MD2 . . 4.210 2.924 1.758 3.394 . 0 0 "[ . 1 . 2]" 1
1066 1 41 LEU H 1 41 LEU HG . . 3.300 2.516 1.922 3.696 0.396 14 0 "[ . 1 . 2]" 1
1067 1 41 LEU H 1 42 GLY H . . 3.470 2.602 2.514 2.723 . 0 0 "[ . 1 . 2]" 1
1068 1 41 LEU HA 1 41 LEU MD1 . . 4.430 3.439 1.926 3.933 . 0 0 "[ . 1 . 2]" 1
1069 1 41 LEU HA 1 41 LEU QD . . 2.920 2.066 1.905 2.201 . 0 0 "[ . 1 . 2]" 1
1070 1 41 LEU HA 1 41 LEU MD2 . . 4.430 2.246 2.025 3.016 . 0 0 "[ . 1 . 2]" 1
1071 1 41 LEU HA 1 41 LEU HG . . 3.710 3.269 3.075 3.753 0.043 2 0 "[ . 1 . 2]" 1
1072 1 41 LEU HA 1 43 TYR H . . 4.220 3.640 3.444 3.870 . 0 0 "[ . 1 . 2]" 1
1073 1 41 LEU HA 1 48 ILE MD . . 3.500 2.799 2.381 3.247 . 0 0 "[ . 1 . 2]" 1
1074 1 41 LEU HA 1 48 ILE QG . . 5.320 4.128 3.743 4.611 . 0 0 "[ . 1 . 2]" 1
1075 1 41 LEU QB 1 41 LEU QD . . 2.680 1.967 1.928 2.071 . 0 0 "[ . 1 . 2]" 1
1076 1 41 LEU QB 1 42 GLY H . . 3.800 3.101 2.813 3.551 . 0 0 "[ . 1 . 2]" 1
1077 1 41 LEU QB 1 42 GLY QA . . 5.180 3.724 3.633 3.886 . 0 0 "[ . 1 . 2]" 1
1078 1 41 LEU QB 1 43 TYR H . . 5.190 4.612 4.357 4.907 . 0 0 "[ . 1 . 2]" 1
1079 1 41 LEU HB2 1 42 GLY H . . 4.510 3.215 2.892 3.746 . 0 0 "[ . 1 . 2]" 1
1080 1 41 LEU HB3 1 42 GLY H . . 4.510 4.089 3.742 4.405 . 0 0 "[ . 1 . 2]" 1
1081 1 41 LEU QD 1 42 GLY H . . 4.750 4.153 3.616 4.383 . 0 0 "[ . 1 . 2]" 1
1082 1 41 LEU HG 1 42 GLY H . . 5.080 4.650 4.226 5.209 0.129 5 0 "[ . 1 . 2]" 1
1083 1 42 GLY H 1 43 TYR H . . 3.230 2.792 2.369 3.247 0.017 14 0 "[ . 1 . 2]" 1
1084 1 42 GLY H 1 43 TYR QB . . 4.970 4.265 3.810 4.590 . 0 0 "[ . 1 . 2]" 1
1085 1 42 GLY QA 1 43 TYR QB . . 5.090 4.538 4.430 4.618 . 0 0 "[ . 1 . 2]" 1
1086 1 42 GLY QA 1 48 ILE MD . . 4.780 4.061 3.834 4.281 . 0 0 "[ . 1 . 2]" 1
1087 1 42 GLY HA2 1 48 ILE MD . . 5.470 4.261 3.996 4.520 . 0 0 "[ . 1 . 2]" 1
1088 1 42 GLY HA3 1 48 ILE MD . . 5.470 5.118 4.931 5.299 . 0 0 "[ . 1 . 2]" 1
1089 1 43 TYR H 1 43 TYR HB2 . . 3.560 2.403 2.289 2.576 . 0 0 "[ . 1 . 2]" 1
1090 1 43 TYR H 1 43 TYR QB . . 2.970 2.369 2.263 2.529 . 0 0 "[ . 1 . 2]" 1
1091 1 43 TYR H 1 43 TYR HB3 . . 3.560 3.608 3.547 3.690 0.130 14 0 "[ . 1 . 2]" 1
1092 1 43 TYR H 1 44 ASP H . . 4.740 4.444 4.348 4.530 . 0 0 "[ . 1 . 2]" 1
1093 1 43 TYR H 1 48 ILE MD . . 3.750 2.188 1.981 2.481 . 0 0 "[ . 1 . 2]" 1
1094 1 43 TYR H 1 48 ILE HG12 . . 5.150 3.829 3.621 4.063 . 0 0 "[ . 1 . 2]" 1
1095 1 43 TYR H 1 48 ILE QG . . 4.360 3.477 3.341 3.668 . 0 0 "[ . 1 . 2]" 1
1096 1 43 TYR H 1 48 ILE HG13 . . 5.150 3.992 3.877 4.176 . 0 0 "[ . 1 . 2]" 1
1097 1 43 TYR H 1 86 ILE MG . . 5.500 5.304 5.055 5.521 0.021 14 0 "[ . 1 . 2]" 1
1098 1 43 TYR HA 1 43 TYR QD . . 3.400 2.228 1.988 2.432 . 0 0 "[ . 1 . 2]" 1
1099 1 43 TYR HA 1 44 ASP H . . 3.340 2.565 2.479 2.679 . 0 0 "[ . 1 . 2]" 1
1100 1 43 TYR HA 1 44 ASP QB . . 5.340 4.362 4.293 4.780 . 0 0 "[ . 1 . 2]" 1
1101 1 43 TYR QB 1 44 ASP H . . 2.970 1.978 1.784 2.132 . 0 0 "[ . 1 . 2]" 1
1102 1 43 TYR QB 1 47 LYS QB . . 3.570 2.919 2.719 3.047 . 0 0 "[ . 1 . 2]" 1
1103 1 43 TYR QB 1 47 LYS QD . . 5.180 3.582 3.112 4.459 . 0 0 "[ . 1 . 2]" 1
1104 1 43 TYR QB 1 48 ILE HB . . 4.560 4.589 4.521 4.661 0.101 6 0 "[ . 1 . 2]" 1
1105 1 43 TYR QB 1 48 ILE MD . . 3.610 2.531 2.416 2.742 . 0 0 "[ . 1 . 2]" 1
1106 1 43 TYR QB 1 48 ILE QG . . 3.420 2.206 2.091 2.308 . 0 0 "[ . 1 . 2]" 1
1107 1 43 TYR QB 1 86 ILE MD . . 3.790 2.428 2.154 2.789 . 0 0 "[ . 1 . 2]" 1
1108 1 43 TYR QB 1 86 ILE QG . . 4.760 4.196 3.925 4.530 . 0 0 "[ . 1 . 2]" 1
1109 1 43 TYR QB 1 86 ILE MG . . 3.380 2.355 1.970 2.645 . 0 0 "[ . 1 . 2]" 1
1110 1 43 TYR HB2 1 44 ASP H . . 3.650 3.460 3.320 3.592 . 0 0 "[ . 1 . 2]" 1
1111 1 43 TYR HB2 1 47 LYS HB2 . . 5.230 4.397 4.191 4.598 . 0 0 "[ . 1 . 2]" 1
1112 1 43 TYR HB2 1 47 LYS HB3 . . 5.230 5.265 5.212 5.318 0.088 2 0 "[ . 1 . 2]" 1
1113 1 43 TYR HB2 1 48 ILE HB . . 5.260 5.004 4.880 5.107 . 0 0 "[ . 1 . 2]" 1
1114 1 43 TYR HB2 1 48 ILE HG12 . . 4.760 2.529 2.340 2.705 . 0 0 "[ . 1 . 2]" 1
1115 1 43 TYR HB2 1 48 ILE HG13 . . 4.760 2.685 2.552 2.837 . 0 0 "[ . 1 . 2]" 1
1116 1 43 TYR HB2 1 48 ILE MG . . 5.500 4.496 4.333 4.651 . 0 0 "[ . 1 . 2]" 1
1117 1 43 TYR HB2 1 86 ILE HB . . 5.500 4.551 4.013 4.951 . 0 0 "[ . 1 . 2]" 1
1118 1 43 TYR HB2 1 86 ILE MG . . 3.960 3.367 3.096 3.713 . 0 0 "[ . 1 . 2]" 1
1119 1 43 TYR HB3 1 44 ASP H . . 3.650 1.990 1.791 2.148 . 0 0 "[ . 1 . 2]" 1
1120 1 43 TYR HB3 1 47 LYS HB2 . . 5.230 3.064 2.821 3.228 . 0 0 "[ . 1 . 2]" 1
1121 1 43 TYR HB3 1 47 LYS HB3 . . 5.230 4.081 3.920 4.156 . 0 0 "[ . 1 . 2]" 1
1122 1 43 TYR HB3 1 48 ILE HB . . 5.260 5.337 5.263 5.391 0.131 20 0 "[ . 1 . 2]" 1
1123 1 43 TYR HB3 1 48 ILE HG12 . . 4.760 3.586 3.412 3.724 . 0 0 "[ . 1 . 2]" 1
1124 1 43 TYR HB3 1 48 ILE HG13 . . 4.760 2.905 2.827 2.975 . 0 0 "[ . 1 . 2]" 1
1125 1 43 TYR HB3 1 48 ILE MG . . 5.500 5.341 5.227 5.452 . 0 0 "[ . 1 . 2]" 1
1126 1 43 TYR HB3 1 86 ILE HB . . 5.500 4.369 3.855 4.834 . 0 0 "[ . 1 . 2]" 1
1127 1 43 TYR HB3 1 86 ILE MG . . 3.960 2.407 1.993 2.707 . 0 0 "[ . 1 . 2]" 1
1128 1 43 TYR QD 1 44 ASP H . . 3.330 2.981 2.821 3.113 . 0 0 "[ . 1 . 2]" 1
1129 1 43 TYR QD 1 47 LYS QD . . 4.380 3.940 3.239 4.473 0.093 10 0 "[ . 1 . 2]" 1
1130 1 43 TYR QD 1 48 ILE QG . . 4.350 3.543 3.316 3.730 . 0 0 "[ . 1 . 2]" 1
1131 1 43 TYR QD 1 86 ILE HB . . 4.190 3.282 2.788 3.719 . 0 0 "[ . 1 . 2]" 1
1132 1 43 TYR QD 1 86 ILE MD . . 2.920 2.631 2.386 2.906 . 0 0 "[ . 1 . 2]" 1
1133 1 43 TYR QD 1 86 ILE QG . . 4.560 4.318 4.037 4.559 . 0 0 "[ . 1 . 2]" 1
1134 1 43 TYR QD 1 86 ILE MG . . 3.320 2.714 2.564 2.808 . 0 0 "[ . 1 . 2]" 1
1135 1 43 TYR QE 1 44 ASP H . . 5.090 5.217 5.109 5.320 0.230 13 0 "[ . 1 . 2]" 1
1136 1 43 TYR QE 1 85 GLY H . . 5.500 5.234 3.514 5.590 0.090 8 0 "[ . 1 . 2]" 1
1137 1 43 TYR QE 1 85 GLY QA . . 4.720 3.765 3.011 4.299 . 0 0 "[ . 1 . 2]" 1
1138 1 43 TYR QE 1 86 ILE H . . 5.020 3.579 3.081 4.862 . 0 0 "[ . 1 . 2]" 1
1139 1 43 TYR QE 1 86 ILE HB . . 3.230 3.125 2.825 3.284 0.054 9 0 "[ . 1 . 2]" 1
1140 1 43 TYR QE 1 86 ILE QG . . 5.330 4.715 4.364 4.957 . 0 0 "[ . 1 . 2]" 1
1141 1 43 TYR QE 1 86 ILE MG . . 3.510 3.011 2.800 3.206 . 0 0 "[ . 1 . 2]" 1
1142 1 43 TYR QE 1 87 ASP H . . 5.170 5.016 4.395 5.230 0.060 9 0 "[ . 1 . 2]" 1
1143 1 44 ASP H 1 44 ASP HB2 . . 3.160 2.497 2.347 2.699 . 0 0 "[ . 1 . 2]" 1
1144 1 44 ASP H 1 44 ASP QB . . 2.760 2.255 2.211 2.447 . 0 0 "[ . 1 . 2]" 1
1145 1 44 ASP H 1 44 ASP HB3 . . 3.160 2.638 2.362 3.519 0.359 17 0 "[ . 1 . 2]" 1
1146 1 44 ASP H 1 45 GLU H . . 4.670 4.580 4.500 4.616 . 0 0 "[ . 1 . 2]" 1
1147 1 44 ASP H 1 47 LYS HD2 . . 4.920 3.156 2.680 4.683 . 0 0 "[ . 1 . 2]" 1
1148 1 44 ASP H 1 47 LYS QD . . 4.310 3.094 2.659 4.284 . 0 0 "[ . 1 . 2]" 1
1149 1 44 ASP H 1 47 LYS HD3 . . 4.920 4.634 4.127 4.963 0.043 10 0 "[ . 1 . 2]" 1
1150 1 44 ASP H 1 47 LYS QG . . 4.260 4.196 3.790 4.386 0.126 19 0 "[ . 1 . 2]" 1
1151 1 44 ASP H 1 48 ILE MD . . 4.940 4.186 3.950 4.361 . 0 0 "[ . 1 . 2]" 1
1152 1 44 ASP H 1 86 ILE MG . . 4.350 3.503 3.046 3.831 . 0 0 "[ . 1 . 2]" 1
1153 1 44 ASP HA 1 45 GLU H . . 2.640 2.194 2.056 2.221 . 0 0 "[ . 1 . 2]" 1
1154 1 44 ASP HA 1 45 GLU HA . . 4.440 4.352 4.260 4.404 . 0 0 "[ . 1 . 2]" 1
1155 1 44 ASP HA 1 45 GLU QB . . 4.340 4.193 3.810 4.323 . 0 0 "[ . 1 . 2]" 1
1156 1 44 ASP HA 1 45 GLU QG . . 4.920 4.567 3.978 5.691 0.771 20 1 "[ . 1 . +]" 1
1157 1 44 ASP HA 1 46 SER H . . 4.170 3.957 3.721 4.143 . 0 0 "[ . 1 . 2]" 1
1158 1 44 ASP HA 1 48 ILE MD . . 4.900 4.189 3.974 4.405 . 0 0 "[ . 1 . 2]" 1
1159 1 44 ASP QB 1 45 GLU H . . 3.800 3.633 3.103 3.783 . 0 0 "[ . 1 . 2]" 1
1160 1 44 ASP QB 1 46 SER H . . 3.830 3.427 3.044 3.752 . 0 0 "[ . 1 . 2]" 1
1161 1 44 ASP QB 1 47 LYS QB . . 3.480 2.360 1.994 2.837 . 0 0 "[ . 1 . 2]" 1
1162 1 44 ASP QB 1 47 LYS QD . . 3.580 2.393 1.766 3.362 . 0 0 "[ . 1 . 2]" 1
1163 1 44 ASP QB 1 47 LYS QG . . 3.110 2.154 1.798 2.461 . 0 0 "[ . 1 . 2]" 1
1164 1 44 ASP QB 1 48 ILE H . . 4.720 3.809 3.719 3.933 . 0 0 "[ . 1 . 2]" 1
1165 1 44 ASP QB 1 48 ILE MD . . 5.340 4.790 4.657 4.910 . 0 0 "[ . 1 . 2]" 1
1166 1 44 ASP HB2 1 45 GLU H . . 4.520 4.211 4.038 4.332 . 0 0 "[ . 1 . 2]" 1
1167 1 44 ASP HB2 1 46 SER H . . 4.480 4.494 3.992 4.599 0.119 15 0 "[ . 1 . 2]" 1
1168 1 44 ASP HB2 1 47 LYS H . . 3.920 3.997 2.766 4.115 0.195 8 0 "[ . 1 . 2]" 1
1169 1 44 ASP HB2 1 86 ILE MG . . 5.500 4.832 4.111 5.182 . 0 0 "[ . 1 . 2]" 1
1170 1 44 ASP HB3 1 45 GLU H . . 4.520 3.990 3.213 4.257 . 0 0 "[ . 1 . 2]" 1
1171 1 44 ASP HB3 1 46 SER H . . 4.480 3.567 3.157 4.008 . 0 0 "[ . 1 . 2]" 1
1172 1 44 ASP HB3 1 47 LYS H . . 3.920 2.475 2.276 3.275 . 0 0 "[ . 1 . 2]" 1
1173 1 44 ASP HB3 1 86 ILE MG . . 5.500 4.335 3.605 5.551 0.051 17 0 "[ . 1 . 2]" 1
1174 1 45 GLU H 1 45 GLU HB2 . . 3.370 2.184 2.062 2.328 . 0 0 "[ . 1 . 2]" 1
1175 1 45 GLU H 1 45 GLU QB . . 2.810 2.160 2.002 2.297 . 0 0 "[ . 1 . 2]" 1
1176 1 45 GLU H 1 45 GLU HB3 . . 3.370 3.423 2.716 3.532 0.162 17 0 "[ . 1 . 2]" 1
1177 1 45 GLU H 1 45 GLU QG . . 3.630 2.881 2.310 3.897 0.267 20 0 "[ . 1 . 2]" 1
1178 1 45 GLU H 1 46 SER H . . 3.480 2.744 2.653 2.836 . 0 0 "[ . 1 . 2]" 1
1179 1 45 GLU H 1 46 SER QB . . 5.500 4.832 4.431 5.046 . 0 0 "[ . 1 . 2]" 1
1180 1 45 GLU H 1 47 LYS H . . 4.650 4.160 4.013 4.288 . 0 0 "[ . 1 . 2]" 1
1181 1 45 GLU H 1 48 ILE MD . . 5.280 3.817 3.451 4.118 . 0 0 "[ . 1 . 2]" 1
1182 1 45 GLU HA 1 45 GLU QG . . 2.980 2.263 2.146 2.824 . 0 0 "[ . 1 . 2]" 1
1183 1 45 GLU HA 1 47 LYS H . . 4.580 4.174 3.890 4.404 . 0 0 "[ . 1 . 2]" 1
1184 1 45 GLU HA 1 48 ILE H . . 3.690 3.344 2.955 3.726 0.036 20 0 "[ . 1 . 2]" 1
1185 1 45 GLU HA 1 48 ILE HB . . 3.070 2.343 1.804 2.883 . 0 0 "[ . 1 . 2]" 1
1186 1 45 GLU HA 1 48 ILE MD . . 3.460 2.409 2.071 2.701 . 0 0 "[ . 1 . 2]" 1
1187 1 45 GLU HA 1 48 ILE QG . . 4.500 3.281 2.931 3.548 . 0 0 "[ . 1 . 2]" 1
1188 1 45 GLU HA 1 49 LYS QG . . 4.180 3.614 3.270 4.263 0.083 20 0 "[ . 1 . 2]" 1
1189 1 45 GLU QB 1 48 ILE MD . . 5.320 4.171 3.828 4.448 . 0 0 "[ . 1 . 2]" 1
1190 1 45 GLU HB2 1 46 SER H . . 3.510 3.005 2.718 3.596 0.086 20 0 "[ . 1 . 2]" 1
1191 1 45 GLU HB3 1 46 SER H . . 3.510 3.302 2.563 3.574 0.064 1 0 "[ . 1 . 2]" 1
1192 1 45 GLU QG 1 48 ILE HB . . 4.800 3.841 3.097 4.719 . 0 0 "[ . 1 . 2]" 1
1193 1 45 GLU QG 1 48 ILE MD . . 4.750 3.172 2.677 4.641 . 0 0 "[ . 1 . 2]" 1
1194 1 45 GLU QG 1 49 LYS H . . 5.020 4.906 4.486 5.113 0.093 16 0 "[ . 1 . 2]" 1
1195 1 45 GLU QG 1 49 LYS QE . . 3.730 3.006 2.542 3.782 0.052 2 0 "[ . 1 . 2]" 1
1196 1 45 GLU QG 1 49 LYS QG . . 5.340 3.839 3.155 4.286 . 0 0 "[ . 1 . 2]" 1
1197 1 46 SER H 1 46 SER QB . . 2.940 2.496 2.230 2.707 . 0 0 "[ . 1 . 2]" 1
1198 1 46 SER H 1 47 LYS H . . 2.980 2.556 2.459 2.677 . 0 0 "[ . 1 . 2]" 1
1199 1 46 SER H 1 47 LYS QG . . 5.340 4.216 4.090 4.378 . 0 0 "[ . 1 . 2]" 1
1200 1 46 SER H 1 48 ILE H . . 4.130 4.000 3.866 4.150 0.020 17 0 "[ . 1 . 2]" 1
1201 1 46 SER H 1 48 ILE MD . . 5.500 5.143 4.939 5.336 . 0 0 "[ . 1 . 2]" 1
1202 1 46 SER HA 1 46 SER QB . . 2.600 2.341 2.268 2.438 . 0 0 "[ . 1 . 2]" 1
1203 1 46 SER HA 1 49 LYS QB . . 4.390 3.294 2.764 3.766 . 0 0 "[ . 1 . 2]" 1
1204 1 46 SER HA 1 49 LYS QD . . 4.780 3.547 2.487 4.865 0.085 19 0 "[ . 1 . 2]" 1
1205 1 46 SER HA 1 49 LYS QE . . 5.340 4.799 4.337 5.258 . 0 0 "[ . 1 . 2]" 1
1206 1 46 SER QB 1 47 LYS H . . 3.710 2.778 2.612 2.963 . 0 0 "[ . 1 . 2]" 1
1207 1 46 SER QB 1 48 ILE H . . 5.130 4.769 4.635 4.896 . 0 0 "[ . 1 . 2]" 1
1208 1 47 LYS H 1 47 LYS HB2 . . 3.860 2.409 2.345 2.512 . 0 0 "[ . 1 . 2]" 1
1209 1 47 LYS H 1 47 LYS QB . . 3.160 2.375 2.315 2.469 . 0 0 "[ . 1 . 2]" 1
1210 1 47 LYS H 1 47 LYS HB3 . . 3.860 3.601 3.561 3.638 . 0 0 "[ . 1 . 2]" 1
1211 1 47 LYS H 1 47 LYS QD . . 4.440 3.926 3.541 4.393 . 0 0 "[ . 1 . 2]" 1
1212 1 47 LYS H 1 47 LYS QE . . 4.750 4.640 3.734 5.002 0.252 16 0 "[ . 1 . 2]" 1
1213 1 47 LYS H 1 47 LYS HG2 . . 3.930 3.614 3.455 3.752 . 0 0 "[ . 1 . 2]" 1
1214 1 47 LYS H 1 47 LYS QG . . 3.250 2.419 2.254 2.569 . 0 0 "[ . 1 . 2]" 1
1215 1 47 LYS H 1 47 LYS HG3 . . 3.930 2.459 2.281 2.618 . 0 0 "[ . 1 . 2]" 1
1216 1 47 LYS H 1 48 ILE H . . 3.150 2.347 2.233 2.470 . 0 0 "[ . 1 . 2]" 1
1217 1 47 LYS H 1 48 ILE HA . . 5.500 5.004 4.912 5.106 . 0 0 "[ . 1 . 2]" 1
1218 1 47 LYS H 1 48 ILE HB . . 4.690 4.390 4.257 4.499 . 0 0 "[ . 1 . 2]" 1
1219 1 47 LYS H 1 48 ILE MD . . 5.260 4.936 4.801 5.110 . 0 0 "[ . 1 . 2]" 1
1220 1 47 LYS H 1 48 ILE HG12 . . 5.500 5.568 5.525 5.652 0.152 16 0 "[ . 1 . 2]" 1
1221 1 47 LYS H 1 48 ILE HG13 . . 5.500 4.002 3.913 4.135 . 0 0 "[ . 1 . 2]" 1
1222 1 47 LYS H 1 48 ILE MG . . 5.500 5.570 5.468 5.651 0.151 3 0 "[ . 1 . 2]" 1
1223 1 47 LYS H 1 86 ILE MD . . 4.570 4.436 4.257 4.632 0.062 4 0 "[ . 1 . 2]" 1
1224 1 47 LYS H 1 86 ILE MG . . 5.270 4.906 4.545 5.206 . 0 0 "[ . 1 . 2]" 1
1225 1 47 LYS HA 1 47 LYS QD . . 4.770 3.980 3.908 4.060 . 0 0 "[ . 1 . 2]" 1
1226 1 47 LYS HA 1 47 LYS HG2 . . 3.480 2.500 2.410 2.633 . 0 0 "[ . 1 . 2]" 1
1227 1 47 LYS HA 1 47 LYS QG . . 3.030 2.385 2.322 2.480 . 0 0 "[ . 1 . 2]" 1
1228 1 47 LYS HA 1 47 LYS HG3 . . 3.480 3.036 2.786 3.196 . 0 0 "[ . 1 . 2]" 1
1229 1 47 LYS HA 1 50 THR H . . 3.720 3.567 3.388 3.731 0.011 6 0 "[ . 1 . 2]" 1
1230 1 47 LYS HA 1 50 THR HB . . 3.490 2.713 2.350 2.886 . 0 0 "[ . 1 . 2]" 1
1231 1 47 LYS HA 1 51 ALA H . . 4.290 3.977 3.822 4.158 . 0 0 "[ . 1 . 2]" 1
1232 1 47 LYS HA 1 86 ILE MD . . 4.950 4.013 3.778 4.229 . 0 0 "[ . 1 . 2]" 1
1233 1 47 LYS HA 1 86 ILE QG . . 5.340 4.143 3.880 4.356 . 0 0 "[ . 1 . 2]" 1
1234 1 47 LYS QB 1 48 ILE H . . 3.990 2.605 2.485 2.782 . 0 0 "[ . 1 . 2]" 1
1235 1 47 LYS QB 1 48 ILE QG . . 4.630 3.270 3.090 3.438 . 0 0 "[ . 1 . 2]" 1
1236 1 47 LYS QB 1 86 ILE HB . . 4.830 4.330 4.121 4.548 . 0 0 "[ . 1 . 2]" 1
1237 1 47 LYS QB 1 86 ILE QG . . 3.770 2.411 2.153 2.698 . 0 0 "[ . 1 . 2]" 1
1238 1 47 LYS QB 1 86 ILE MG . . 3.480 2.252 1.913 2.593 . 0 0 "[ . 1 . 2]" 1
1239 1 47 LYS QB 1 87 ASP H . . 5.340 4.896 4.076 5.343 0.003 4 0 "[ . 1 . 2]" 1
1240 1 47 LYS HB2 1 86 ILE MD . . 4.460 2.724 2.462 3.082 . 0 0 "[ . 1 . 2]" 1
1241 1 47 LYS HB3 1 86 ILE MD . . 4.460 2.541 2.310 2.687 . 0 0 "[ . 1 . 2]" 1
1242 1 47 LYS QD 1 47 LYS QE . . 2.310 2.028 1.969 2.093 . 0 0 "[ . 1 . 2]" 1
1243 1 47 LYS QD 1 86 ILE MG . . 3.920 2.078 1.772 2.356 . 0 0 "[ . 1 . 2]" 1
1244 1 47 LYS HD2 1 86 ILE MG . . 4.460 2.733 2.153 3.269 . 0 0 "[ . 1 . 2]" 1
1245 1 47 LYS HD3 1 86 ILE MG . . 4.460 2.233 1.795 3.681 . 0 0 "[ . 1 . 2]" 1
1246 1 47 LYS QE 1 47 LYS QG . . 2.680 2.272 2.109 2.460 . 0 0 "[ . 1 . 2]" 1
1247 1 47 LYS QE 1 86 ILE MG . . 4.560 3.665 2.275 4.233 . 0 0 "[ . 1 . 2]" 1
1248 1 47 LYS QG 1 48 ILE H . . 4.950 4.052 3.937 4.155 . 0 0 "[ . 1 . 2]" 1
1249 1 47 LYS HG2 1 86 ILE MG . . 5.500 3.749 3.402 4.169 . 0 0 "[ . 1 . 2]" 1
1250 1 47 LYS HG2 1 87 ASP HA . . 5.500 3.881 3.196 4.278 . 0 0 "[ . 1 . 2]" 1
1251 1 47 LYS HG3 1 86 ILE MG . . 5.500 4.154 3.817 4.436 . 0 0 "[ . 1 . 2]" 1
1252 1 47 LYS HG3 1 87 ASP HA . . 5.500 5.299 4.736 5.609 0.109 8 0 "[ . 1 . 2]" 1
1253 1 48 ILE H 1 48 ILE HB . . 3.080 2.417 2.386 2.461 . 0 0 "[ . 1 . 2]" 1
1254 1 48 ILE H 1 48 ILE MD . . 3.550 3.558 3.520 3.594 0.044 16 0 "[ . 1 . 2]" 1
1255 1 48 ILE H 1 48 ILE HG12 . . 3.820 3.435 3.374 3.531 . 0 0 "[ . 1 . 2]" 1
1256 1 48 ILE H 1 48 ILE QG . . 3.220 2.153 2.109 2.215 . 0 0 "[ . 1 . 2]" 1
1257 1 48 ILE H 1 48 ILE HG13 . . 3.820 2.175 2.130 2.240 . 0 0 "[ . 1 . 2]" 1
1258 1 48 ILE H 1 48 ILE MG . . 4.380 3.729 3.713 3.745 . 0 0 "[ . 1 . 2]" 1
1259 1 48 ILE H 1 86 ILE MD . . 3.950 3.219 3.043 3.480 . 0 0 "[ . 1 . 2]" 1
1260 1 48 ILE H 1 86 ILE QG . . 5.340 4.811 4.537 5.123 . 0 0 "[ . 1 . 2]" 1
1261 1 48 ILE HA 1 48 ILE HG12 . . 3.860 2.456 2.393 2.515 . 0 0 "[ . 1 . 2]" 1
1262 1 48 ILE HA 1 48 ILE QG . . 3.380 2.334 2.282 2.368 . 0 0 "[ . 1 . 2]" 1
1263 1 48 ILE HA 1 48 ILE HG13 . . 3.860 2.918 2.857 2.967 . 0 0 "[ . 1 . 2]" 1
1264 1 48 ILE HA 1 48 ILE MG . . 3.430 2.480 2.445 2.504 . 0 0 "[ . 1 . 2]" 1
1265 1 48 ILE HA 1 50 THR H . . 5.500 4.479 4.334 4.604 . 0 0 "[ . 1 . 2]" 1
1266 1 48 ILE HA 1 51 ALA H . . 4.090 3.557 3.406 3.700 . 0 0 "[ . 1 . 2]" 1
1267 1 48 ILE HA 1 51 ALA MB . . 3.650 2.723 2.589 2.903 . 0 0 "[ . 1 . 2]" 1
1268 1 48 ILE HA 1 52 LEU H . . 5.090 4.057 3.848 4.242 . 0 0 "[ . 1 . 2]" 1
1269 1 48 ILE HA 1 86 ILE MD . . 3.590 2.089 1.854 2.317 . 0 0 "[ . 1 . 2]" 1
1270 1 48 ILE HB 1 48 ILE MD . . 3.330 2.427 2.397 2.470 . 0 0 "[ . 1 . 2]" 1
1271 1 48 ILE HB 1 49 LYS H . . 3.010 2.413 2.314 2.596 . 0 0 "[ . 1 . 2]" 1
1272 1 48 ILE MD 1 48 ILE MG . . 3.070 1.922 1.880 1.979 . 0 0 "[ . 1 . 2]" 1
1273 1 48 ILE MD 1 49 LYS H . . 5.500 4.455 4.373 4.602 . 0 0 "[ . 1 . 2]" 1
1274 1 48 ILE MG 1 49 LYS H . . 3.480 3.043 2.840 3.186 . 0 0 "[ . 1 . 2]" 1
1275 1 48 ILE MG 1 49 LYS HA . . 3.870 3.118 3.026 3.267 . 0 0 "[ . 1 . 2]" 1
1276 1 48 ILE MG 1 50 THR H . . 5.500 4.818 4.710 4.927 . 0 0 "[ . 1 . 2]" 1
1277 1 48 ILE MG 1 51 ALA H . . 5.370 4.737 4.636 4.879 . 0 0 "[ . 1 . 2]" 1
1278 1 48 ILE MG 1 51 ALA MB . . 4.590 3.753 3.630 4.000 . 0 0 "[ . 1 . 2]" 1
1279 1 48 ILE MG 1 52 LEU H . . 4.260 3.981 3.806 4.115 . 0 0 "[ . 1 . 2]" 1
1280 1 48 ILE MG 1 52 LEU HA . . 5.500 5.373 5.159 5.550 0.050 6 0 "[ . 1 . 2]" 1
1281 1 48 ILE MG 1 52 LEU QB . . 4.830 3.877 3.680 4.060 . 0 0 "[ . 1 . 2]" 1
1282 1 48 ILE MG 1 52 LEU QD . . 2.750 2.329 2.201 2.485 . 0 0 "[ . 1 . 2]" 1
1283 1 48 ILE MG 1 52 LEU HG . . 3.770 2.839 2.646 2.999 . 0 0 "[ . 1 . 2]" 1
1284 1 49 LYS H 1 49 LYS HB2 . . 3.780 2.514 2.423 2.782 . 0 0 "[ . 1 . 2]" 1
1285 1 49 LYS H 1 49 LYS QB . . 3.240 2.466 2.386 2.698 . 0 0 "[ . 1 . 2]" 1
1286 1 49 LYS H 1 49 LYS HB3 . . 3.780 3.587 3.546 3.629 . 0 0 "[ . 1 . 2]" 1
1287 1 49 LYS H 1 49 LYS HD2 . . 4.880 3.860 3.071 4.259 . 0 0 "[ . 1 . 2]" 1
1288 1 49 LYS H 1 49 LYS HD3 . . 4.880 4.496 2.883 4.885 0.005 18 0 "[ . 1 . 2]" 1
1289 1 49 LYS H 1 49 LYS HE2 . . 5.220 5.194 4.534 5.565 0.345 6 0 "[ . 1 . 2]" 1
1290 1 49 LYS H 1 49 LYS HE3 . . 5.220 4.583 3.899 5.348 0.128 20 0 "[ . 1 . 2]" 1
1291 1 49 LYS H 1 49 LYS HG2 . . 3.870 3.286 2.042 3.680 . 0 0 "[ . 1 . 2]" 1
1292 1 49 LYS H 1 49 LYS QG . . 3.220 2.126 1.865 2.268 . 0 0 "[ . 1 . 2]" 1
1293 1 49 LYS H 1 49 LYS HG3 . . 3.870 2.302 1.885 3.606 . 0 0 "[ . 1 . 2]" 1
1294 1 49 LYS H 1 50 THR H . . 3.480 2.711 2.622 2.870 . 0 0 "[ . 1 . 2]" 1
1295 1 49 LYS H 1 52 LEU QD . . 5.440 4.444 4.271 4.642 . 0 0 "[ . 1 . 2]" 1
1296 1 49 LYS HA 1 49 LYS QE . . 5.340 4.598 4.012 5.002 . 0 0 "[ . 1 . 2]" 1
1297 1 49 LYS HA 1 49 LYS HG2 . . 3.570 2.646 2.457 3.371 . 0 0 "[ . 1 . 2]" 1
1298 1 49 LYS HA 1 49 LYS QG . . 3.100 2.486 2.368 3.161 0.061 19 0 "[ . 1 . 2]" 1
1299 1 49 LYS HA 1 49 LYS HG3 . . 3.570 3.062 2.657 3.822 0.252 19 0 "[ . 1 . 2]" 1
1300 1 49 LYS HA 1 51 ALA H . . 5.430 4.463 4.354 4.644 . 0 0 "[ . 1 . 2]" 1
1301 1 49 LYS HA 1 52 LEU H . . 3.840 3.511 3.312 3.696 . 0 0 "[ . 1 . 2]" 1
1302 1 49 LYS HA 1 52 LEU HA . . 5.500 5.515 5.337 5.647 0.147 19 0 "[ . 1 . 2]" 1
1303 1 49 LYS HA 1 52 LEU HB2 . . 4.610 2.776 2.620 2.908 . 0 0 "[ . 1 . 2]" 1
1304 1 49 LYS HA 1 52 LEU QB . . 3.930 2.749 2.598 2.877 . 0 0 "[ . 1 . 2]" 1
1305 1 49 LYS HA 1 52 LEU HB3 . . 4.610 4.425 4.284 4.563 . 0 0 "[ . 1 . 2]" 1
1306 1 49 LYS HA 1 52 LEU QD . . 3.990 2.801 2.524 3.166 . 0 0 "[ . 1 . 2]" 1
1307 1 49 LYS HA 1 52 LEU HG . . 4.780 3.766 3.483 4.028 . 0 0 "[ . 1 . 2]" 1
1308 1 49 LYS HA 1 53 ASP H . . 4.860 3.902 3.667 4.057 . 0 0 "[ . 1 . 2]" 1
1309 1 49 LYS QB 1 50 THR H . . 3.220 2.652 2.394 2.807 . 0 0 "[ . 1 . 2]" 1
1310 1 49 LYS HB2 1 50 THR H . . 3.810 2.715 2.429 2.888 . 0 0 "[ . 1 . 2]" 1
1311 1 49 LYS HB3 1 50 THR H . . 3.810 3.738 3.533 3.856 0.046 7 0 "[ . 1 . 2]" 1
1312 1 49 LYS QE 1 49 LYS QG . . 3.300 2.169 2.092 2.402 . 0 0 "[ . 1 . 2]" 1
1313 1 49 LYS QG 1 50 THR H . . 4.810 4.070 3.673 4.189 . 0 0 "[ . 1 . 2]" 1
1314 1 49 LYS HG2 1 50 THR H . . 5.460 4.947 3.843 5.171 . 0 0 "[ . 1 . 2]" 1
1315 1 49 LYS HG3 1 50 THR H . . 5.460 4.381 4.105 4.756 . 0 0 "[ . 1 . 2]" 1
1316 1 50 THR H 1 50 THR HB . . 3.030 2.518 2.421 2.605 . 0 0 "[ . 1 . 2]" 1
1317 1 50 THR H 1 50 THR MG . . 3.730 3.757 3.742 3.768 0.038 5 0 "[ . 1 . 2]" 1
1318 1 50 THR H 1 51 ALA H . . 3.010 2.655 2.551 2.776 . 0 0 "[ . 1 . 2]" 1
1319 1 50 THR H 1 51 ALA MB . . 4.520 4.317 4.224 4.414 . 0 0 "[ . 1 . 2]" 1
1320 1 50 THR H 1 52 LEU H . . 4.670 4.232 4.116 4.353 . 0 0 "[ . 1 . 2]" 1
1321 1 50 THR HA 1 50 THR MG . . 3.210 2.408 2.351 2.488 . 0 0 "[ . 1 . 2]" 1
1322 1 50 THR HA 1 53 ASP H . . 3.980 3.550 3.346 3.845 . 0 0 "[ . 1 . 2]" 1
1323 1 50 THR HA 1 53 ASP HB2 . . 4.110 3.666 2.349 4.138 0.028 3 0 "[ . 1 . 2]" 1
1324 1 50 THR HA 1 53 ASP QB . . 3.500 2.745 2.332 3.120 . 0 0 "[ . 1 . 2]" 1
1325 1 50 THR HA 1 53 ASP HB3 . . 4.110 2.909 2.573 3.941 . 0 0 "[ . 1 . 2]" 1
1326 1 50 THR HA 1 54 HIS H . . 5.320 3.965 3.798 4.210 . 0 0 "[ . 1 . 2]" 1
1327 1 50 THR HB 1 51 ALA H . . 3.360 2.587 2.460 2.689 . 0 0 "[ . 1 . 2]" 1
1328 1 50 THR HB 1 51 ALA MB . . 5.500 4.015 3.908 4.132 . 0 0 "[ . 1 . 2]" 1
1329 1 50 THR MG 1 51 ALA H . . 3.930 3.438 3.234 3.546 . 0 0 "[ . 1 . 2]" 1
1330 1 50 THR MG 1 51 ALA MB . . 4.610 4.168 3.967 4.307 . 0 0 "[ . 1 . 2]" 1
1331 1 50 THR MG 1 53 ASP H . . 5.500 4.816 4.686 5.088 . 0 0 "[ . 1 . 2]" 1
1332 1 50 THR MG 1 53 ASP QB . . 4.510 3.890 3.535 4.319 . 0 0 "[ . 1 . 2]" 1
1333 1 50 THR MG 1 54 HIS H . . 5.010 4.043 3.830 4.314 . 0 0 "[ . 1 . 2]" 1
1334 1 50 THR MG 1 54 HIS HB2 . . 5.500 3.406 3.088 3.707 . 0 0 "[ . 1 . 2]" 1
1335 1 50 THR MG 1 54 HIS QB . . 4.650 3.270 2.978 3.548 . 0 0 "[ . 1 . 2]" 1
1336 1 50 THR MG 1 54 HIS HB3 . . 5.500 4.225 3.914 4.526 . 0 0 "[ . 1 . 2]" 1
1337 1 50 THR MG 1 89 PHE QD . . 5.500 4.218 3.647 4.641 . 0 0 "[ . 1 . 2]" 1
1338 1 50 THR MG 1 89 PHE QE . . 5.500 5.253 4.588 5.544 0.044 7 0 "[ . 1 . 2]" 1
1339 1 51 ALA H 1 51 ALA MB . . 3.070 2.238 2.231 2.247 . 0 0 "[ . 1 . 2]" 1
1340 1 51 ALA H 1 52 LEU H . . 3.230 2.764 2.706 2.864 . 0 0 "[ . 1 . 2]" 1
1341 1 51 ALA H 1 52 LEU QD . . 5.440 4.890 4.822 5.017 . 0 0 "[ . 1 . 2]" 1
1342 1 51 ALA H 1 52 LEU HG . . 5.010 4.647 4.540 4.835 . 0 0 "[ . 1 . 2]" 1
1343 1 51 ALA H 1 53 ASP H . . 4.440 4.170 4.075 4.363 . 0 0 "[ . 1 . 2]" 1
1344 1 51 ALA H 1 54 HIS H . . 4.790 4.696 4.633 4.764 . 0 0 "[ . 1 . 2]" 1
1345 1 51 ALA H 1 86 ILE MD . . 4.870 3.620 3.272 4.084 . 0 0 "[ . 1 . 2]" 1
1346 1 51 ALA H 1 89 PHE QD . . 5.450 4.751 4.503 5.119 . 0 0 "[ . 1 . 2]" 1
1347 1 51 ALA HA 1 54 HIS H . . 5.250 3.632 3.500 3.787 . 0 0 "[ . 1 . 2]" 1
1348 1 51 ALA HA 1 54 HIS HB2 . . 4.130 3.719 3.535 3.884 . 0 0 "[ . 1 . 2]" 1
1349 1 51 ALA HA 1 54 HIS HB3 . . 4.130 2.858 2.739 2.995 . 0 0 "[ . 1 . 2]" 1
1350 1 51 ALA MB 1 52 LEU H . . 3.500 2.380 2.289 2.449 . 0 0 "[ . 1 . 2]" 1
1351 1 51 ALA MB 1 52 LEU QD . . 4.730 3.476 3.383 3.602 . 0 0 "[ . 1 . 2]" 1
1352 1 51 ALA MB 1 52 LEU HG . . 4.690 3.215 3.147 3.318 . 0 0 "[ . 1 . 2]" 1
1353 1 51 ALA MB 1 53 ASP H . . 5.100 4.494 4.401 4.658 . 0 0 "[ . 1 . 2]" 1
1354 1 51 ALA MB 1 54 HIS H . . 5.500 4.658 4.571 4.737 . 0 0 "[ . 1 . 2]" 1
1355 1 51 ALA MB 1 54 HIS HB2 . . 5.500 5.155 5.004 5.295 . 0 0 "[ . 1 . 2]" 1
1356 1 51 ALA MB 1 54 HIS QB . . 4.760 4.060 3.961 4.167 . 0 0 "[ . 1 . 2]" 1
1357 1 51 ALA MB 1 54 HIS HB3 . . 5.500 4.250 4.146 4.359 . 0 0 "[ . 1 . 2]" 1
1358 1 51 ALA MB 1 86 ILE MD . . 3.230 2.240 1.905 2.554 . 0 0 "[ . 1 . 2]" 1
1359 1 51 ALA MB 1 89 PHE QD . . 3.630 3.000 2.569 3.287 . 0 0 "[ . 1 . 2]" 1
1360 1 51 ALA MB 1 89 PHE QE . . 3.750 3.225 2.954 3.406 . 0 0 "[ . 1 . 2]" 1
1361 1 52 LEU H 1 52 LEU HB2 . . 3.740 2.446 2.413 2.500 . 0 0 "[ . 1 . 2]" 1
1362 1 52 LEU H 1 52 LEU QB . . 3.110 2.407 2.377 2.456 . 0 0 "[ . 1 . 2]" 1
1363 1 52 LEU H 1 52 LEU HB3 . . 3.740 3.586 3.579 3.596 . 0 0 "[ . 1 . 2]" 1
1364 1 52 LEU H 1 52 LEU MD1 . . 4.120 3.616 3.508 3.674 . 0 0 "[ . 1 . 2]" 1
1365 1 52 LEU H 1 52 LEU QD . . 3.440 3.106 3.047 3.164 . 0 0 "[ . 1 . 2]" 1
1366 1 52 LEU H 1 52 LEU MD2 . . 4.120 3.386 3.273 3.470 . 0 0 "[ . 1 . 2]" 1
1367 1 52 LEU H 1 52 LEU HG . . 3.200 2.339 2.224 2.438 . 0 0 "[ . 1 . 2]" 1
1368 1 52 LEU H 1 55 ILE MD . . 4.570 4.268 4.074 4.484 . 0 0 "[ . 1 . 2]" 1
1369 1 52 LEU H 1 86 ILE MD . . 5.500 4.664 4.324 5.052 . 0 0 "[ . 1 . 2]" 1
1370 1 52 LEU H 1 89 PHE QE . . 5.500 5.300 5.040 5.563 0.063 18 0 "[ . 1 . 2]" 1
1371 1 52 LEU HA 1 52 LEU QD . . 3.020 1.965 1.904 2.065 . 0 0 "[ . 1 . 2]" 1
1372 1 52 LEU HA 1 52 LEU HG . . 4.140 3.034 2.991 3.102 . 0 0 "[ . 1 . 2]" 1
1373 1 52 LEU HA 1 55 ILE HA . . 5.500 5.348 5.094 5.509 0.009 16 0 "[ . 1 . 2]" 1
1374 1 52 LEU HA 1 55 ILE HB . . 3.300 2.702 2.364 2.927 . 0 0 "[ . 1 . 2]" 1
1375 1 52 LEU HA 1 55 ILE MD . . 3.730 2.308 2.045 2.718 . 0 0 "[ . 1 . 2]" 1
1376 1 52 LEU HA 1 55 ILE QG . . 4.860 3.195 2.849 3.661 . 0 0 "[ . 1 . 2]" 1
1377 1 52 LEU QB 1 52 LEU QD . . 2.820 1.944 1.927 1.953 . 0 0 "[ . 1 . 2]" 1
1378 1 52 LEU HB2 1 53 ASP H . . 3.630 2.626 2.501 2.725 . 0 0 "[ . 1 . 2]" 1
1379 1 52 LEU HB3 1 53 ASP H . . 3.630 3.582 3.483 3.631 0.001 9 0 "[ . 1 . 2]" 1
1380 1 52 LEU QD 1 53 ASP H . . 4.600 4.095 4.012 4.150 . 0 0 "[ . 1 . 2]" 1
1381 1 52 LEU QD 1 55 ILE H . . 5.080 4.785 4.579 4.903 . 0 0 "[ . 1 . 2]" 1
1382 1 52 LEU QD 1 55 ILE HB . . 4.600 3.674 3.299 3.872 . 0 0 "[ . 1 . 2]" 1
1383 1 52 LEU QD 1 55 ILE MD . . 3.840 2.221 1.969 2.642 . 0 0 "[ . 1 . 2]" 1
1384 1 52 LEU QD 1 56 LYS H . . 5.440 4.994 4.738 5.300 . 0 0 "[ . 1 . 2]" 1
1385 1 52 LEU MD1 1 53 ASP H . . 5.340 4.531 4.364 4.618 . 0 0 "[ . 1 . 2]" 1
1386 1 52 LEU MD2 1 53 ASP H . . 5.340 4.672 4.635 4.704 . 0 0 "[ . 1 . 2]" 1
1387 1 52 LEU HG 1 53 ASP H . . 4.750 4.423 4.326 4.524 . 0 0 "[ . 1 . 2]" 1
1388 1 53 ASP H 1 53 ASP HB2 . . 3.530 2.509 2.360 2.653 . 0 0 "[ . 1 . 2]" 1
1389 1 53 ASP H 1 53 ASP QB . . 3.010 2.275 2.236 2.344 . 0 0 "[ . 1 . 2]" 1
1390 1 53 ASP H 1 53 ASP HB3 . . 3.530 2.654 2.467 3.582 0.052 6 0 "[ . 1 . 2]" 1
1391 1 53 ASP H 1 54 HIS H . . 3.230 2.607 2.472 2.740 . 0 0 "[ . 1 . 2]" 1
1392 1 53 ASP H 1 54 HIS QB . . 4.530 4.383 4.302 4.493 . 0 0 "[ . 1 . 2]" 1
1393 1 53 ASP H 1 55 ILE HB . . 5.500 5.062 4.909 5.204 . 0 0 "[ . 1 . 2]" 1
1394 1 53 ASP H 1 56 LYS H . . 5.110 4.649 4.490 4.844 . 0 0 "[ . 1 . 2]" 1
1395 1 53 ASP HA 1 56 LYS H . . 3.980 3.311 3.159 3.489 . 0 0 "[ . 1 . 2]" 1
1396 1 53 ASP HA 1 56 LYS QB . . 3.810 2.317 1.823 2.855 . 0 0 "[ . 1 . 2]" 1
1397 1 53 ASP QB 1 54 HIS H . . 3.410 2.694 2.551 2.930 . 0 0 "[ . 1 . 2]" 1
1398 1 53 ASP HB2 1 54 HIS H . . 4.000 3.854 2.631 4.026 0.026 19 0 "[ . 1 . 2]" 1
1399 1 53 ASP HB3 1 54 HIS H . . 4.000 2.788 2.624 3.431 . 0 0 "[ . 1 . 2]" 1
1400 1 54 HIS H 1 54 HIS HB2 . . 3.190 2.622 2.554 2.754 . 0 0 "[ . 1 . 2]" 1
1401 1 54 HIS H 1 54 HIS HB3 . . 3.190 2.491 2.444 2.539 . 0 0 "[ . 1 . 2]" 1
1402 1 54 HIS H 1 54 HIS HD2 . . 5.140 5.034 4.938 5.109 . 0 0 "[ . 1 . 2]" 1
1403 1 54 HIS H 1 55 ILE HB . . 5.380 4.711 4.551 4.841 . 0 0 "[ . 1 . 2]" 1
1404 1 54 HIS H 1 55 ILE QG . . 5.340 4.291 4.115 4.520 . 0 0 "[ . 1 . 2]" 1
1405 1 54 HIS H 1 56 LYS H . . 4.430 4.054 3.840 4.270 . 0 0 "[ . 1 . 2]" 1
1406 1 54 HIS H 1 57 SER H . . 5.500 4.559 4.311 4.805 . 0 0 "[ . 1 . 2]" 1
1407 1 54 HIS HA 1 57 SER H . . 3.900 3.200 2.951 3.325 . 0 0 "[ . 1 . 2]" 1
1408 1 54 HIS HA 1 57 SER QB . . 3.350 2.602 2.203 3.402 0.052 16 0 "[ . 1 . 2]" 1
1409 1 54 HIS QB 1 54 HIS HD2 . . 3.280 2.618 2.608 2.631 . 0 0 "[ . 1 . 2]" 1
1410 1 54 HIS QB 1 55 ILE H . . 3.810 2.440 2.331 2.529 . 0 0 "[ . 1 . 2]" 1
1411 1 54 HIS QB 1 55 ILE QG . . 4.760 3.362 3.273 3.509 . 0 0 "[ . 1 . 2]" 1
1412 1 54 HIS QB 1 89 PHE QE . . 4.050 2.256 1.959 2.516 . 0 0 "[ . 1 . 2]" 1
1413 1 54 HIS HB2 1 54 HIS HD2 . . 3.740 3.773 3.759 3.795 0.055 13 0 "[ . 1 . 2]" 1
1414 1 54 HIS HB2 1 89 PHE QE . . 4.710 3.839 3.536 4.132 . 0 0 "[ . 1 . 2]" 1
1415 1 54 HIS HB3 1 54 HIS HD2 . . 3.740 2.670 2.660 2.683 . 0 0 "[ . 1 . 2]" 1
1416 1 54 HIS HB3 1 89 PHE QE . . 4.710 2.272 1.968 2.538 . 0 0 "[ . 1 . 2]" 1
1417 1 54 HIS HD2 1 55 ILE H . . 3.660 3.720 3.621 3.768 0.108 10 0 "[ . 1 . 2]" 1
1418 1 54 HIS HD2 1 55 ILE HG12 . . 4.290 4.037 3.864 4.204 . 0 0 "[ . 1 . 2]" 1
1419 1 54 HIS HD2 1 55 ILE QG . . 3.600 3.464 3.283 3.622 0.022 13 0 "[ . 1 . 2]" 1
1420 1 54 HIS HD2 1 55 ILE HG13 . . 4.290 3.776 3.476 3.958 . 0 0 "[ . 1 . 2]" 1
1421 1 54 HIS HD2 1 78 VAL QG . . 4.780 4.526 4.256 4.833 0.053 4 0 "[ . 1 . 2]" 1
1422 1 54 HIS HD2 1 89 PHE QE . . 2.960 2.209 1.782 2.612 . 0 0 "[ . 1 . 2]" 1
1423 1 54 HIS HD2 1 89 PHE HZ . . 3.300 3.256 3.008 3.385 0.085 20 0 "[ . 1 . 2]" 1
1424 1 54 HIS HD2 1 90 GLY H . . 5.140 4.788 4.341 5.104 . 0 0 "[ . 1 . 2]" 1
1425 1 54 HIS HD2 1 90 GLY QA . . 4.870 3.533 3.043 4.133 . 0 0 "[ . 1 . 2]" 1
1426 1 54 HIS HE1 1 58 GLU HG2 . . 4.270 3.741 3.275 4.050 . 0 0 "[ . 1 . 2]" 1
1427 1 54 HIS HE1 1 58 GLU HG3 . . 4.270 4.075 3.683 4.324 0.054 18 0 "[ . 1 . 2]" 1
1428 1 54 HIS HE1 1 90 GLY QA . . 4.720 3.727 3.338 4.092 . 0 0 "[ . 1 . 2]" 1
1429 1 54 HIS HE1 1 91 SER H . . 4.970 3.250 2.969 3.725 . 0 0 "[ . 1 . 2]" 1
1430 1 54 HIS HE1 1 91 SER HA . . 3.660 2.817 2.504 3.378 . 0 0 "[ . 1 . 2]" 1
1431 1 54 HIS HE1 1 91 SER QB . . 3.170 2.689 1.834 3.332 0.162 17 0 "[ . 1 . 2]" 1
1432 1 54 HIS HE1 1 95 VAL QG . . 3.490 3.441 3.148 3.596 0.106 19 0 "[ . 1 . 2]" 1
1433 1 55 ILE H 1 55 ILE HB . . 3.250 2.529 2.392 2.601 . 0 0 "[ . 1 . 2]" 1
1434 1 55 ILE H 1 55 ILE MD . . 3.830 3.566 3.499 3.607 . 0 0 "[ . 1 . 2]" 1
1435 1 55 ILE H 1 55 ILE HG12 . . 4.130 3.377 3.225 3.533 . 0 0 "[ . 1 . 2]" 1
1436 1 55 ILE H 1 55 ILE QG . . 3.440 2.090 1.976 2.244 . 0 0 "[ . 1 . 2]" 1
1437 1 55 ILE H 1 55 ILE HG13 . . 4.130 2.110 1.994 2.269 . 0 0 "[ . 1 . 2]" 1
1438 1 55 ILE H 1 56 LYS H . . 3.590 2.809 2.710 2.931 . 0 0 "[ . 1 . 2]" 1
1439 1 55 ILE H 1 57 SER H . . 4.820 4.131 3.935 4.277 . 0 0 "[ . 1 . 2]" 1
1440 1 55 ILE H 1 89 PHE QE . . 3.620 3.193 2.988 3.470 . 0 0 "[ . 1 . 2]" 1
1441 1 55 ILE HA 1 55 ILE MD . . 4.200 3.823 3.789 3.848 . 0 0 "[ . 1 . 2]" 1
1442 1 55 ILE HA 1 55 ILE HG12 . . 4.030 2.506 2.436 2.553 . 0 0 "[ . 1 . 2]" 1
1443 1 55 ILE HA 1 55 ILE HG13 . . 4.030 2.959 2.851 3.037 . 0 0 "[ . 1 . 2]" 1
1444 1 55 ILE HA 1 57 SER H . . 5.500 4.373 3.922 4.574 . 0 0 "[ . 1 . 2]" 1
1445 1 55 ILE HA 1 58 GLU H . . 4.370 3.631 3.510 3.918 . 0 0 "[ . 1 . 2]" 1
1446 1 55 ILE HA 1 58 GLU QB . . 4.180 3.001 2.660 3.392 . 0 0 "[ . 1 . 2]" 1
1447 1 55 ILE HA 1 58 GLU HG2 . . 5.370 3.910 3.352 4.583 . 0 0 "[ . 1 . 2]" 1
1448 1 55 ILE HA 1 58 GLU HG3 . . 5.370 4.235 3.749 4.859 . 0 0 "[ . 1 . 2]" 1
1449 1 55 ILE HA 1 59 LEU H . . 5.390 3.895 3.594 4.128 . 0 0 "[ . 1 . 2]" 1
1450 1 55 ILE HA 1 59 LEU QD . . 5.440 4.237 3.464 4.803 . 0 0 "[ . 1 . 2]" 1
1451 1 55 ILE HA 1 74 PHE QE . . 3.430 2.330 1.970 2.779 . 0 0 "[ . 1 . 2]" 1
1452 1 55 ILE HA 1 74 PHE HZ . . 3.870 2.507 2.086 2.859 . 0 0 "[ . 1 . 2]" 1
1453 1 55 ILE HA 1 89 PHE QE . . 4.670 4.264 4.010 4.463 . 0 0 "[ . 1 . 2]" 1
1454 1 55 ILE HA 1 89 PHE HZ . . 4.720 4.158 3.941 4.297 . 0 0 "[ . 1 . 2]" 1
1455 1 55 ILE HB 1 55 ILE MD . . 3.410 2.427 2.400 2.449 . 0 0 "[ . 1 . 2]" 1
1456 1 55 ILE HB 1 56 LYS H . . 3.600 2.447 2.252 2.644 . 0 0 "[ . 1 . 2]" 1
1457 1 55 ILE HB 1 59 LEU QD . . 5.300 4.335 3.776 4.957 . 0 0 "[ . 1 . 2]" 1
1458 1 55 ILE HB 1 74 PHE QE . . 4.500 4.252 4.043 4.517 0.017 11 0 "[ . 1 . 2]" 1
1459 1 55 ILE MD 1 55 ILE MG . . 3.450 1.940 1.900 2.017 . 0 0 "[ . 1 . 2]" 1
1460 1 55 ILE MD 1 74 PHE QE . . 4.970 4.108 3.905 4.435 . 0 0 "[ . 1 . 2]" 1
1461 1 55 ILE MD 1 89 PHE QE . . 3.570 3.383 3.193 3.576 0.006 10 0 "[ . 1 . 2]" 1
1462 1 55 ILE MD 1 89 PHE HZ . . 3.200 2.769 2.379 3.139 . 0 0 "[ . 1 . 2]" 1
1463 1 55 ILE QG 1 74 PHE QE . . 4.540 3.125 2.735 3.659 . 0 0 "[ . 1 . 2]" 1
1464 1 55 ILE QG 1 74 PHE HZ . . 4.010 3.218 2.807 3.501 . 0 0 "[ . 1 . 2]" 1
1465 1 55 ILE QG 1 78 VAL QG . . 4.690 2.564 2.268 2.909 . 0 0 "[ . 1 . 2]" 1
1466 1 55 ILE QG 1 89 PHE QE . . 3.340 2.546 2.300 2.846 . 0 0 "[ . 1 . 2]" 1
1467 1 55 ILE QG 1 89 PHE HZ . . 3.090 2.192 1.995 2.359 . 0 0 "[ . 1 . 2]" 1
1468 1 55 ILE HG12 1 74 PHE QE . . 5.380 3.193 2.778 3.766 . 0 0 "[ . 1 . 2]" 1
1469 1 55 ILE HG12 1 89 PHE QE . . 3.840 3.440 3.191 3.704 . 0 0 "[ . 1 . 2]" 1
1470 1 55 ILE HG12 1 89 PHE HZ . . 3.550 2.349 2.169 2.453 . 0 0 "[ . 1 . 2]" 1
1471 1 55 ILE HG13 1 74 PHE QE . . 5.380 4.459 4.082 4.971 . 0 0 "[ . 1 . 2]" 1
1472 1 55 ILE HG13 1 89 PHE QE . . 3.840 2.629 2.358 2.961 . 0 0 "[ . 1 . 2]" 1
1473 1 55 ILE HG13 1 89 PHE HZ . . 3.550 2.668 2.206 3.153 . 0 0 "[ . 1 . 2]" 1
1474 1 55 ILE MG 1 56 LYS H . . 3.950 3.209 2.980 3.479 . 0 0 "[ . 1 . 2]" 1
1475 1 55 ILE MG 1 56 LYS HA . . 4.380 3.354 3.230 3.515 . 0 0 "[ . 1 . 2]" 1
1476 1 55 ILE MG 1 58 GLU H . . 5.500 4.849 4.718 5.127 . 0 0 "[ . 1 . 2]" 1
1477 1 55 ILE MG 1 58 GLU QG . . 5.340 4.987 4.627 5.346 0.006 12 0 "[ . 1 . 2]" 1
1478 1 55 ILE MG 1 59 LEU QD . . 3.330 2.224 1.769 2.738 . 0 0 "[ . 1 . 2]" 1
1479 1 55 ILE MG 1 74 PHE QE . . 2.950 1.808 1.748 1.958 . 0 0 "[ . 1 . 2]" 1
1480 1 55 ILE MG 1 74 PHE HZ . . 4.170 3.546 3.082 3.823 . 0 0 "[ . 1 . 2]" 1
1481 1 55 ILE MG 1 89 PHE HZ . . 4.260 4.322 4.188 4.394 0.134 17 0 "[ . 1 . 2]" 1
1482 1 56 LYS H 1 56 LYS HB2 . . 3.650 2.571 2.434 2.716 . 0 0 "[ . 1 . 2]" 1
1483 1 56 LYS H 1 56 LYS QB . . 3.100 2.199 2.079 2.271 . 0 0 "[ . 1 . 2]" 1
1484 1 56 LYS H 1 56 LYS HB3 . . 3.650 2.402 2.185 2.586 . 0 0 "[ . 1 . 2]" 1
1485 1 56 LYS H 1 56 LYS QD . . 5.340 4.405 4.086 4.885 . 0 0 "[ . 1 . 2]" 1
1486 1 56 LYS H 1 56 LYS QG . . 4.940 3.942 3.878 3.984 . 0 0 "[ . 1 . 2]" 1
1487 1 56 LYS H 1 57 SER H . . 3.370 2.765 2.691 2.869 . 0 0 "[ . 1 . 2]" 1
1488 1 56 LYS H 1 57 SER QB . . 4.850 4.724 4.406 4.906 0.056 16 0 "[ . 1 . 2]" 1
1489 1 56 LYS HA 1 56 LYS QD . . 4.370 3.989 3.871 4.158 . 0 0 "[ . 1 . 2]" 1
1490 1 56 LYS HA 1 56 LYS QG . . 3.450 2.548 2.389 2.737 . 0 0 "[ . 1 . 2]" 1
1491 1 56 LYS HA 1 58 GLU H . . 5.500 4.706 4.294 4.982 . 0 0 "[ . 1 . 2]" 1
1492 1 56 LYS HA 1 59 LEU H . . 4.180 3.672 3.393 4.030 . 0 0 "[ . 1 . 2]" 1
1493 1 56 LYS HA 1 59 LEU HB2 . . 4.110 3.152 2.416 4.114 0.004 8 0 "[ . 1 . 2]" 1
1494 1 56 LYS HA 1 59 LEU QB . . 3.490 2.694 2.398 2.995 . 0 0 "[ . 1 . 2]" 1
1495 1 56 LYS HA 1 59 LEU HB3 . . 4.110 3.597 2.764 4.186 0.076 18 0 "[ . 1 . 2]" 1
1496 1 56 LYS HA 1 59 LEU QD . . 3.990 3.267 2.620 3.881 . 0 0 "[ . 1 . 2]" 1
1497 1 56 LYS HA 1 60 ASP H . . 4.470 4.095 3.339 4.543 0.073 14 0 "[ . 1 . 2]" 1
1498 1 56 LYS QB 1 57 SER H . . 3.330 2.598 2.375 2.936 . 0 0 "[ . 1 . 2]" 1
1499 1 56 LYS QB 1 57 SER HA . . 5.340 4.226 4.017 4.426 . 0 0 "[ . 1 . 2]" 1
1500 1 56 LYS HB2 1 57 SER H . . 4.150 3.943 3.790 4.174 0.024 8 0 "[ . 1 . 2]" 1
1501 1 56 LYS HB3 1 57 SER H . . 4.150 2.636 2.400 3.000 . 0 0 "[ . 1 . 2]" 1
1502 1 56 LYS HE2 1 56 LYS QG . . 3.900 2.605 2.086 3.535 . 0 0 "[ . 1 . 2]" 1
1503 1 56 LYS HE3 1 56 LYS QG . . 3.900 2.792 2.394 3.390 . 0 0 "[ . 1 . 2]" 1
1504 1 56 LYS QG 1 57 SER H . . 4.370 3.439 2.993 3.772 . 0 0 "[ . 1 . 2]" 1
1505 1 56 LYS QG 1 57 SER HA . . 4.590 3.446 3.200 3.698 . 0 0 "[ . 1 . 2]" 1
1506 1 56 LYS QG 1 60 ASP H . . 5.340 4.420 3.775 4.998 . 0 0 "[ . 1 . 2]" 1
1507 1 57 SER H 1 57 SER QB . . 2.810 2.405 2.105 2.548 . 0 0 "[ . 1 . 2]" 1
1508 1 57 SER H 1 58 GLU HA . . 5.500 5.331 5.137 5.434 . 0 0 "[ . 1 . 2]" 1
1509 1 57 SER H 1 59 LEU H . . 5.500 4.121 3.835 4.366 . 0 0 "[ . 1 . 2]" 1
1510 1 57 SER H 1 60 ASP QB . . 5.340 4.746 4.379 5.021 . 0 0 "[ . 1 . 2]" 1
1511 1 57 SER HA 1 59 LEU H . . 5.360 4.641 4.387 4.976 . 0 0 "[ . 1 . 2]" 1
1512 1 57 SER HA 1 60 ASP H . . 4.770 3.720 3.425 4.228 . 0 0 "[ . 1 . 2]" 1
1513 1 57 SER HA 1 60 ASP HB2 . . 3.850 3.576 2.658 3.944 0.094 20 0 "[ . 1 . 2]" 1
1514 1 57 SER HA 1 60 ASP QB . . 3.360 2.904 2.361 3.409 0.049 11 0 "[ . 1 . 2]" 1
1515 1 57 SER HA 1 60 ASP HB3 . . 3.850 3.175 2.642 3.951 0.101 6 0 "[ . 1 . 2]" 1
1516 1 57 SER HA 1 61 LYS H . . 5.390 4.903 4.068 5.504 0.114 12 0 "[ . 1 . 2]" 1
1517 1 57 SER QB 1 58 GLU H . . 3.350 2.455 2.203 3.359 0.009 16 0 "[ . 1 . 2]" 1
1518 1 57 SER QB 1 58 GLU QG . . 4.740 3.248 2.913 4.252 . 0 0 "[ . 1 . 2]" 1
1519 1 57 SER QB 1 61 LYS QE . . 5.180 4.179 3.114 5.387 0.207 7 0 "[ . 1 . 2]" 1
1520 1 58 GLU H 1 58 GLU QB . . 3.130 2.394 2.288 2.498 . 0 0 "[ . 1 . 2]" 1
1521 1 58 GLU H 1 58 GLU HG2 . . 3.990 2.295 2.069 2.571 . 0 0 "[ . 1 . 2]" 1
1522 1 58 GLU H 1 58 GLU QG . . 3.230 2.273 2.057 2.537 . 0 0 "[ . 1 . 2]" 1
1523 1 58 GLU H 1 58 GLU HG3 . . 3.990 3.703 3.585 3.904 . 0 0 "[ . 1 . 2]" 1
1524 1 58 GLU H 1 59 LEU H . . 3.370 2.680 2.445 2.773 . 0 0 "[ . 1 . 2]" 1
1525 1 58 GLU H 1 60 ASP H . . 4.830 4.021 3.721 4.170 . 0 0 "[ . 1 . 2]" 1
1526 1 58 GLU H 1 61 LYS H . . 5.500 5.041 4.647 5.401 . 0 0 "[ . 1 . 2]" 1
1527 1 58 GLU H 1 74 PHE QE . . 5.090 4.565 4.341 4.796 . 0 0 "[ . 1 . 2]" 1
1528 1 58 GLU H 1 74 PHE HZ . . 5.380 4.539 4.206 4.912 . 0 0 "[ . 1 . 2]" 1
1529 1 58 GLU H 1 96 THR H . . 5.500 5.610 5.533 5.700 0.200 16 0 "[ . 1 . 2]" 1
1530 1 58 GLU H 1 96 THR MG . . 5.450 4.658 4.517 4.887 . 0 0 "[ . 1 . 2]" 1
1531 1 58 GLU HA 1 61 LYS H . . 4.030 3.554 3.241 3.944 . 0 0 "[ . 1 . 2]" 1
1532 1 58 GLU HA 1 61 LYS QD . . 3.200 2.439 1.663 3.575 0.375 15 0 "[ . 1 . 2]" 1
1533 1 58 GLU HA 1 61 LYS HE2 . . 4.380 3.535 1.804 4.408 0.028 16 0 "[ . 1 . 2]" 1
1534 1 58 GLU HA 1 61 LYS QE . . 3.840 2.740 1.718 3.788 . 0 0 "[ . 1 . 2]" 1
1535 1 58 GLU HA 1 61 LYS HE3 . . 4.380 3.295 1.724 4.464 0.084 12 0 "[ . 1 . 2]" 1
1536 1 58 GLU HA 1 61 LYS QG . . 5.120 2.742 1.830 3.418 . 0 0 "[ . 1 . 2]" 1
1537 1 58 GLU HA 1 74 PHE HZ . . 5.500 5.527 5.434 5.574 0.074 10 0 "[ . 1 . 2]" 1
1538 1 58 GLU HA 1 96 THR H . . 5.250 3.881 3.682 4.188 . 0 0 "[ . 1 . 2]" 1
1539 1 58 GLU QB 1 59 LEU H . . 3.130 2.518 2.349 2.709 . 0 0 "[ . 1 . 2]" 1
1540 1 58 GLU QB 1 59 LEU QD . . 5.440 3.761 2.613 4.381 . 0 0 "[ . 1 . 2]" 1
1541 1 58 GLU QB 1 60 ASP H . . 4.620 4.499 4.243 4.646 0.026 7 0 "[ . 1 . 2]" 1
1542 1 58 GLU QB 1 74 PHE QE . . 4.570 2.842 2.595 3.038 . 0 0 "[ . 1 . 2]" 1
1543 1 58 GLU QB 1 74 PHE HZ . . 3.520 2.638 2.410 2.893 . 0 0 "[ . 1 . 2]" 1
1544 1 58 GLU QB 1 95 VAL HA . . 4.770 3.532 3.007 3.864 . 0 0 "[ . 1 . 2]" 1
1545 1 58 GLU QB 1 96 THR H . . 4.340 2.517 2.278 2.773 . 0 0 "[ . 1 . 2]" 1
1546 1 58 GLU QB 1 96 THR MG . . 3.530 1.825 1.724 2.003 . 0 0 "[ . 1 . 2]" 1
1547 1 58 GLU QG 1 74 PHE HZ . . 3.680 2.788 2.287 3.406 . 0 0 "[ . 1 . 2]" 1
1548 1 58 GLU QG 1 95 VAL HA . . 3.820 2.400 1.795 2.789 . 0 0 "[ . 1 . 2]" 1
1549 1 58 GLU QG 1 95 VAL QG . . 4.440 3.470 2.967 3.820 . 0 0 "[ . 1 . 2]" 1
1550 1 58 GLU QG 1 96 THR H . . 4.320 2.947 2.676 3.191 . 0 0 "[ . 1 . 2]" 1
1551 1 58 GLU QG 1 96 THR MG . . 4.500 3.406 3.285 3.703 . 0 0 "[ . 1 . 2]" 1
1552 1 58 GLU HG2 1 59 LEU H . . 5.500 4.325 4.185 4.503 . 0 0 "[ . 1 . 2]" 1
1553 1 58 GLU HG2 1 74 PHE QE . . 5.500 4.436 3.975 4.899 . 0 0 "[ . 1 . 2]" 1
1554 1 58 GLU HG2 1 95 VAL HA . . 4.490 3.957 3.464 4.267 . 0 0 "[ . 1 . 2]" 1
1555 1 58 GLU HG2 1 96 THR H . . 5.080 4.228 4.022 4.466 . 0 0 "[ . 1 . 2]" 1
1556 1 58 GLU HG2 1 96 THR MG . . 5.260 4.411 4.266 4.614 . 0 0 "[ . 1 . 2]" 1
1557 1 58 GLU HG3 1 59 LEU H . . 5.500 4.944 4.793 5.072 . 0 0 "[ . 1 . 2]" 1
1558 1 58 GLU HG3 1 74 PHE QE . . 5.500 3.368 2.984 3.855 . 0 0 "[ . 1 . 2]" 1
1559 1 58 GLU HG3 1 95 VAL HA . . 4.490 2.423 1.801 2.828 . 0 0 "[ . 1 . 2]" 1
1560 1 58 GLU HG3 1 96 THR H . . 5.080 3.008 2.717 3.273 . 0 0 "[ . 1 . 2]" 1
1561 1 58 GLU HG3 1 96 THR MG . . 5.260 3.545 3.403 3.900 . 0 0 "[ . 1 . 2]" 1
1562 1 59 LEU H 1 59 LEU HB2 . . 3.650 2.300 2.068 2.454 . 0 0 "[ . 1 . 2]" 1
1563 1 59 LEU H 1 59 LEU QB . . 3.090 2.220 2.044 2.358 . 0 0 "[ . 1 . 2]" 1
1564 1 59 LEU H 1 59 LEU HB3 . . 3.650 3.156 2.537 3.585 . 0 0 "[ . 1 . 2]" 1
1565 1 59 LEU H 1 59 LEU MD1 . . 4.290 3.583 2.310 4.042 . 0 0 "[ . 1 . 2]" 1
1566 1 59 LEU H 1 59 LEU MD2 . . 4.290 3.787 3.326 4.231 . 0 0 "[ . 1 . 2]" 1
1567 1 59 LEU H 1 60 ASP H . . 3.380 2.620 2.480 2.694 . 0 0 "[ . 1 . 2]" 1
1568 1 59 LEU H 1 61 LYS H . . 4.720 4.138 3.844 4.342 . 0 0 "[ . 1 . 2]" 1
1569 1 59 LEU H 1 74 PHE QD . . 5.500 4.679 4.369 5.064 . 0 0 "[ . 1 . 2]" 1
1570 1 59 LEU H 1 74 PHE QE . . 4.510 3.594 3.023 4.132 . 0 0 "[ . 1 . 2]" 1
1571 1 59 LEU H 1 74 PHE HZ . . 5.260 4.738 4.037 5.330 0.070 7 0 "[ . 1 . 2]" 1
1572 1 59 LEU H 1 96 THR MG . . 4.980 3.652 3.328 4.332 . 0 0 "[ . 1 . 2]" 1
1573 1 59 LEU HA 1 59 LEU MD1 . . 4.370 2.660 1.775 3.836 . 0 0 "[ . 1 . 2]" 1
1574 1 59 LEU HA 1 59 LEU QD . . 3.070 1.889 1.772 2.038 . 0 0 "[ . 1 . 2]" 1
1575 1 59 LEU HA 1 59 LEU MD2 . . 4.370 3.033 1.854 3.869 . 0 0 "[ . 1 . 2]" 1
1576 1 59 LEU HA 1 59 LEU HG . . 4.030 2.981 2.769 3.153 . 0 0 "[ . 1 . 2]" 1
1577 1 59 LEU HA 1 62 CYS H . . 4.400 3.547 3.144 3.912 . 0 0 "[ . 1 . 2]" 1
1578 1 59 LEU HA 1 62 CYS QB . . 5.110 3.436 2.566 3.980 . 0 0 "[ . 1 . 2]" 1
1579 1 59 LEU HA 1 96 THR MG . . 3.850 2.656 2.045 3.579 . 0 0 "[ . 1 . 2]" 1
1580 1 59 LEU QB 1 60 ASP H . . 3.430 2.876 2.728 3.042 . 0 0 "[ . 1 . 2]" 1
1581 1 59 LEU QB 1 60 ASP HA . . 4.750 4.026 3.846 4.185 . 0 0 "[ . 1 . 2]" 1
1582 1 59 LEU QB 1 74 PHE QD . . 5.340 3.885 2.600 5.026 . 0 0 "[ . 1 . 2]" 1
1583 1 59 LEU HB2 1 60 ASP H . . 4.070 3.404 2.816 4.001 . 0 0 "[ . 1 . 2]" 1
1584 1 59 LEU HB3 1 60 ASP H . . 4.070 3.360 2.821 3.884 . 0 0 "[ . 1 . 2]" 1
1585 1 59 LEU QD 1 60 ASP H . . 4.720 4.183 3.998 4.292 . 0 0 "[ . 1 . 2]" 1
1586 1 59 LEU QD 1 62 CYS H . . 5.440 4.464 3.778 4.860 . 0 0 "[ . 1 . 2]" 1
1587 1 59 LEU QD 1 62 CYS QB . . 5.440 3.453 2.568 3.970 . 0 0 "[ . 1 . 2]" 1
1588 1 59 LEU QD 1 71 LYS H . . 4.880 4.274 3.805 4.703 . 0 0 "[ . 1 . 2]" 1
1589 1 59 LEU QD 1 71 LYS HA . . 3.620 2.401 1.787 2.869 . 0 0 "[ . 1 . 2]" 1
1590 1 59 LEU QD 1 71 LYS QB . . 3.670 2.642 2.092 3.510 . 0 0 "[ . 1 . 2]" 1
1591 1 59 LEU QD 1 71 LYS QD . . 4.070 3.086 2.147 3.805 . 0 0 "[ . 1 . 2]" 1
1592 1 59 LEU QD 1 71 LYS QE . . 4.280 3.746 2.795 4.220 . 0 0 "[ . 1 . 2]" 1
1593 1 59 LEU QD 1 71 LYS QG . . 3.720 2.066 1.784 2.719 . 0 0 "[ . 1 . 2]" 1
1594 1 59 LEU QD 1 72 THR H . . 5.440 4.983 4.614 5.453 0.013 14 0 "[ . 1 . 2]" 1
1595 1 59 LEU QD 1 74 PHE H . . 5.390 4.548 4.093 4.907 . 0 0 "[ . 1 . 2]" 1
1596 1 59 LEU QD 1 74 PHE QB . . 3.640 2.704 2.386 2.957 . 0 0 "[ . 1 . 2]" 1
1597 1 59 LEU QD 1 74 PHE QD . . 2.830 1.841 1.719 1.991 . 0 0 "[ . 1 . 2]" 1
1598 1 59 LEU QD 1 74 PHE QE . . 4.940 2.946 2.427 3.122 . 0 0 "[ . 1 . 2]" 1
1599 1 59 LEU QD 1 74 PHE HZ . . 4.790 4.638 4.046 4.827 0.037 9 0 "[ . 1 . 2]" 1
1600 1 59 LEU QD 1 96 THR MG . . 4.210 2.781 1.857 3.565 . 0 0 "[ . 1 . 2]" 1
1601 1 59 LEU MD1 1 60 ASP H . . 5.380 4.652 4.228 5.009 . 0 0 "[ . 1 . 2]" 1
1602 1 59 LEU MD1 1 71 LYS QD . . 5.500 3.665 2.905 4.338 . 0 0 "[ . 1 . 2]" 1
1603 1 59 LEU MD1 1 74 PHE HZ . . 5.500 5.153 4.149 5.566 0.066 1 0 "[ . 1 . 2]" 1
1604 1 59 LEU MD2 1 60 ASP H . . 5.380 4.768 4.617 4.972 . 0 0 "[ . 1 . 2]" 1
1605 1 59 LEU MD2 1 71 LYS QD . . 5.500 3.527 2.173 4.220 . 0 0 "[ . 1 . 2]" 1
1606 1 59 LEU MD2 1 74 PHE HZ . . 5.500 5.405 4.817 5.612 0.112 8 0 "[ . 1 . 2]" 1
1607 1 59 LEU HG 1 60 ASP H . . 5.500 4.662 4.148 5.386 . 0 0 "[ . 1 . 2]" 1
1608 1 59 LEU HG 1 74 PHE QD . . 4.510 3.784 2.432 4.568 0.058 12 0 "[ . 1 . 2]" 1
1609 1 60 ASP H 1 60 ASP HB2 . . 3.410 2.559 2.086 2.851 . 0 0 "[ . 1 . 2]" 1
1610 1 60 ASP H 1 60 ASP QB . . 2.930 2.230 2.061 2.277 . 0 0 "[ . 1 . 2]" 1
1611 1 60 ASP H 1 60 ASP HB3 . . 3.410 2.561 2.314 3.425 0.015 6 0 "[ . 1 . 2]" 1
1612 1 60 ASP H 1 61 LYS H . . 3.320 2.522 2.398 2.722 . 0 0 "[ . 1 . 2]" 1
1613 1 60 ASP H 1 61 LYS HA . . 5.450 5.131 5.018 5.309 . 0 0 "[ . 1 . 2]" 1
1614 1 60 ASP H 1 62 CYS H . . 4.880 4.092 3.675 4.302 . 0 0 "[ . 1 . 2]" 1
1615 1 60 ASP HA 1 62 CYS H . . 4.110 3.892 3.397 4.143 0.033 4 0 "[ . 1 . 2]" 1
1616 1 60 ASP HA 1 63 ASN HD21 . . 5.500 4.091 2.929 5.501 0.001 5 0 "[ . 1 . 2]" 1
1617 1 60 ASP HA 1 63 ASN HD22 . . 5.500 4.229 1.950 5.589 0.089 9 0 "[ . 1 . 2]" 1
1618 1 60 ASP QB 1 61 LYS H . . 3.710 2.916 2.565 3.112 . 0 0 "[ . 1 . 2]" 1
1619 1 60 ASP QB 1 61 LYS QG . . 5.180 3.530 3.238 4.417 . 0 0 "[ . 1 . 2]" 1
1620 1 60 ASP HB2 1 61 LYS H . . 4.350 4.012 3.234 4.249 . 0 0 "[ . 1 . 2]" 1
1621 1 60 ASP HB3 1 61 LYS H . . 4.350 3.017 2.602 3.483 . 0 0 "[ . 1 . 2]" 1
1622 1 61 LYS H 1 61 LYS HB2 . . 3.740 2.627 2.321 3.654 . 0 0 "[ . 1 . 2]" 1
1623 1 61 LYS H 1 61 LYS QB . . 3.270 2.483 2.293 2.675 . 0 0 "[ . 1 . 2]" 1
1624 1 61 LYS H 1 61 LYS HB3 . . 3.740 3.503 2.605 3.620 . 0 0 "[ . 1 . 2]" 1
1625 1 61 LYS H 1 61 LYS HD2 . . 4.710 4.100 3.651 4.747 0.037 9 0 "[ . 1 . 2]" 1
1626 1 61 LYS H 1 61 LYS HD3 . . 4.710 4.485 3.533 4.749 0.039 8 0 "[ . 1 . 2]" 1
1627 1 61 LYS H 1 61 LYS HE2 . . 5.500 4.847 2.514 5.744 0.244 2 0 "[ . 1 . 2]" 1
1628 1 61 LYS H 1 61 LYS HE3 . . 5.500 4.779 3.216 5.542 0.042 13 0 "[ . 1 . 2]" 1
1629 1 61 LYS H 1 61 LYS HG2 . . 3.960 3.278 1.973 3.892 . 0 0 "[ . 1 . 2]" 1
1630 1 61 LYS H 1 61 LYS HG3 . . 3.960 2.384 2.012 3.518 . 0 0 "[ . 1 . 2]" 1
1631 1 61 LYS H 1 62 CYS H . . 3.220 2.533 2.340 2.678 . 0 0 "[ . 1 . 2]" 1
1632 1 61 LYS H 1 62 CYS QB . . 5.350 4.660 4.176 4.912 . 0 0 "[ . 1 . 2]" 1
1633 1 61 LYS HA 1 61 LYS QD . . 4.890 4.053 2.786 4.534 . 0 0 "[ . 1 . 2]" 1
1634 1 61 LYS HA 1 61 LYS QE . . 5.220 4.525 1.931 5.172 . 0 0 "[ . 1 . 2]" 1
1635 1 61 LYS HA 1 61 LYS HG2 . . 4.060 2.804 2.565 3.744 . 0 0 "[ . 1 . 2]" 1
1636 1 61 LYS HA 1 61 LYS QG . . 3.210 2.611 2.400 3.334 0.124 6 0 "[ . 1 . 2]" 1
1637 1 61 LYS HA 1 61 LYS HG3 . . 4.060 3.144 2.744 3.902 . 0 0 "[ . 1 . 2]" 1
1638 1 61 LYS HA 1 63 ASN HD21 . . 5.430 3.868 2.810 5.029 . 0 0 "[ . 1 . 2]" 1
1639 1 61 LYS HA 1 63 ASN QD . . 4.600 3.525 2.537 4.640 0.040 4 0 "[ . 1 . 2]" 1
1640 1 61 LYS HA 1 63 ASN HD22 . . 5.430 4.191 2.888 5.445 0.015 12 0 "[ . 1 . 2]" 1
1641 1 61 LYS QB 1 62 CYS H . . 4.020 2.973 2.592 3.650 . 0 0 "[ . 1 . 2]" 1
1642 1 61 LYS QB 1 98 CYS QB . . 3.390 2.948 2.035 3.510 0.120 1 0 "[ . 1 . 2]" 1
1643 1 61 LYS HB2 1 62 CYS H . . 4.790 3.089 2.650 4.041 . 0 0 "[ . 1 . 2]" 1
1644 1 61 LYS HB3 1 62 CYS H . . 4.790 3.982 3.663 4.350 . 0 0 "[ . 1 . 2]" 1
1645 1 61 LYS QE 1 61 LYS QG . . 3.320 2.267 2.134 2.421 . 0 0 "[ . 1 . 2]" 1
1646 1 61 LYS HG2 1 62 CYS H . . 5.500 4.853 2.886 5.424 . 0 0 "[ . 1 . 2]" 1
1647 1 61 LYS HG3 1 62 CYS H . . 5.500 4.234 2.767 4.901 . 0 0 "[ . 1 . 2]" 1
1648 1 62 CYS H 1 62 CYS QB . . 3.160 2.545 2.280 2.732 . 0 0 "[ . 1 . 2]" 1
1649 1 62 CYS H 1 63 ASN H . . 4.390 4.008 3.667 4.369 . 0 0 "[ . 1 . 2]" 1
1650 1 62 CYS H 1 67 ALA MB . . 5.500 5.085 4.389 5.574 0.074 16 0 "[ . 1 . 2]" 1
1651 1 62 CYS H 1 71 LYS QE . . 5.500 5.066 4.119 5.545 0.045 18 0 "[ . 1 . 2]" 1
1652 1 62 CYS H 1 98 CYS QB . . 5.100 3.975 3.332 4.452 . 0 0 "[ . 1 . 2]" 1
1653 1 62 CYS HA 1 63 ASN H . . 2.930 2.243 2.154 2.433 . 0 0 "[ . 1 . 2]" 1
1654 1 62 CYS HA 1 98 CYS HB2 . . 4.400 3.419 2.678 4.162 . 0 0 "[ . 1 . 2]" 1
1655 1 62 CYS HA 1 98 CYS QB . . 3.570 2.576 1.734 3.300 . 0 0 "[ . 1 . 2]" 1
1656 1 62 CYS HA 1 98 CYS HB3 . . 4.400 2.705 1.741 3.522 . 0 0 "[ . 1 . 2]" 1
1657 1 62 CYS QB 1 63 ASN H . . 4.600 3.744 3.479 3.962 . 0 0 "[ . 1 . 2]" 1
1658 1 62 CYS QB 1 67 ALA HA . . 3.380 2.822 2.084 3.491 0.111 1 0 "[ . 1 . 2]" 1
1659 1 62 CYS QB 1 67 ALA MB . . 4.140 2.951 1.712 3.944 . 0 0 "[ . 1 . 2]" 1
1660 1 62 CYS QB 1 70 GLN QB . . 5.110 2.687 2.126 3.836 . 0 0 "[ . 1 . 2]" 1
1661 1 62 CYS QB 1 71 LYS H . . 5.230 3.979 3.555 4.555 . 0 0 "[ . 1 . 2]" 1
1662 1 62 CYS QB 1 71 LYS HG2 . . 4.550 3.346 2.480 4.348 . 0 0 "[ . 1 . 2]" 1
1663 1 62 CYS QB 1 71 LYS QG . . 3.960 2.814 2.107 3.392 . 0 0 "[ . 1 . 2]" 1
1664 1 62 CYS QB 1 71 LYS HG3 . . 4.550 3.054 2.205 3.539 . 0 0 "[ . 1 . 2]" 1
1665 1 62 CYS QB 1 98 CYS QB . . 5.080 3.233 2.331 3.985 . 0 0 "[ . 1 . 2]" 1
1666 1 63 ASN H 1 63 ASN HD21 . . 5.500 3.444 2.789 4.347 . 0 0 "[ . 1 . 2]" 1
1667 1 63 ASN H 1 63 ASN QD . . 4.790 3.268 2.710 4.049 . 0 0 "[ . 1 . 2]" 1
1668 1 63 ASN H 1 63 ASN HD22 . . 5.500 4.250 3.419 5.018 . 0 0 "[ . 1 . 2]" 1
1669 1 63 ASN H 1 64 GLY H . . 3.690 3.203 1.958 3.902 0.212 7 0 "[ . 1 . 2]" 1
1670 1 63 ASN H 1 98 CYS QB . . 5.340 4.256 3.217 5.139 . 0 0 "[ . 1 . 2]" 1
1671 1 63 ASN HA 1 67 ALA MB . . 3.780 2.452 1.787 3.808 0.028 11 0 "[ . 1 . 2]" 1
1672 1 63 ASN QB 1 64 GLY H . . 4.300 3.662 3.361 4.009 . 0 0 "[ . 1 . 2]" 1
1673 1 63 ASN QB 1 67 ALA MB . . 4.660 3.917 3.357 4.648 . 0 0 "[ . 1 . 2]" 1
1674 1 63 ASN HB2 1 64 GLY H . . 4.940 4.116 3.518 4.532 . 0 0 "[ . 1 . 2]" 1
1675 1 63 ASN HB2 1 67 ALA MB . . 5.500 4.502 3.984 5.236 . 0 0 "[ . 1 . 2]" 1
1676 1 63 ASN HB3 1 64 GLY H . . 4.940 4.228 3.740 4.617 . 0 0 "[ . 1 . 2]" 1
1677 1 63 ASN HB3 1 67 ALA MB . . 5.500 4.334 3.507 5.410 . 0 0 "[ . 1 . 2]" 1
1678 1 64 GLY H 1 67 ALA H . . 5.070 3.658 2.929 4.429 . 0 0 "[ . 1 . 2]" 1
1679 1 64 GLY H 1 67 ALA MB . . 4.150 2.114 1.716 2.944 . 0 0 "[ . 1 . 2]" 1
1680 1 64 GLY QA 1 65 ASN QB . . 5.150 4.092 3.824 4.259 . 0 0 "[ . 1 . 2]" 1
1681 1 64 GLY QA 1 67 ALA MB . . 3.930 3.383 2.815 3.925 . 0 0 "[ . 1 . 2]" 1
1682 1 65 ASN HA 1 65 ASN QB . . 2.710 2.308 2.166 2.419 . 0 0 "[ . 1 . 2]" 1
1683 1 65 ASN HA 1 65 ASN HD22 . . 5.500 4.553 3.469 5.348 . 0 0 "[ . 1 . 2]" 1
1684 1 65 ASN HA 1 66 ASP H . . 3.510 3.472 3.257 3.561 0.051 11 0 "[ . 1 . 2]" 1
1685 1 65 ASN HA 1 67 ALA H . . 4.170 3.826 3.391 4.118 . 0 0 "[ . 1 . 2]" 1
1686 1 65 ASN QB 1 66 ASP H . . 4.080 2.890 1.982 3.775 . 0 0 "[ . 1 . 2]" 1
1687 1 65 ASN QB 1 67 ALA MB . . 5.500 5.371 5.007 5.535 0.035 13 0 "[ . 1 . 2]" 1
1688 1 66 ASP H 1 66 ASP HB2 . . 3.920 3.063 2.307 3.702 . 0 0 "[ . 1 . 2]" 1
1689 1 66 ASP H 1 66 ASP QB . . 3.360 2.574 2.280 2.951 . 0 0 "[ . 1 . 2]" 1
1690 1 66 ASP H 1 66 ASP HB3 . . 3.920 3.172 2.464 3.686 . 0 0 "[ . 1 . 2]" 1
1691 1 66 ASP H 1 67 ALA H . . 3.140 2.592 2.246 3.109 . 0 0 "[ . 1 . 2]" 1
1692 1 66 ASP H 1 67 ALA MB . . 5.000 4.069 3.795 4.470 . 0 0 "[ . 1 . 2]" 1
1693 1 66 ASP HA 1 67 ALA HA . . 5.000 4.811 4.700 4.870 . 0 0 "[ . 1 . 2]" 1
1694 1 66 ASP HA 1 69 GLN QB . . 4.960 3.478 3.080 4.134 . 0 0 "[ . 1 . 2]" 1
1695 1 66 ASP QB 1 67 ALA H . . 4.420 3.701 2.804 4.026 . 0 0 "[ . 1 . 2]" 1
1696 1 66 ASP QB 1 69 GLN H . . 5.130 4.410 3.409 5.109 . 0 0 "[ . 1 . 2]" 1
1697 1 66 ASP QB 1 69 GLN QB . . 4.550 3.446 2.215 4.393 . 0 0 "[ . 1 . 2]" 1
1698 1 67 ALA H 1 67 ALA MB . . 2.950 2.225 2.204 2.245 . 0 0 "[ . 1 . 2]" 1
1699 1 67 ALA H 1 68 ASP H . . 3.320 2.746 2.598 2.971 . 0 0 "[ . 1 . 2]" 1
1700 1 67 ALA H 1 68 ASP QB . . 4.520 4.530 4.355 4.693 0.173 12 0 "[ . 1 . 2]" 1
1701 1 67 ALA H 1 69 GLN H . . 4.950 4.249 3.925 4.675 . 0 0 "[ . 1 . 2]" 1
1702 1 67 ALA HA 1 68 ASP HA . . 5.030 4.797 4.670 4.884 . 0 0 "[ . 1 . 2]" 1
1703 1 67 ALA HA 1 70 GLN H . . 3.850 3.568 2.908 3.954 0.104 10 0 "[ . 1 . 2]" 1
1704 1 67 ALA HA 1 70 GLN QB . . 3.430 2.800 1.947 3.283 . 0 0 "[ . 1 . 2]" 1
1705 1 67 ALA HA 1 70 GLN QG . . 4.140 3.312 2.203 4.069 . 0 0 "[ . 1 . 2]" 1
1706 1 67 ALA HA 1 71 LYS H . . 4.300 3.952 3.496 4.331 0.031 11 0 "[ . 1 . 2]" 1
1707 1 67 ALA MB 1 68 ASP H . . 3.470 2.465 2.017 2.923 . 0 0 "[ . 1 . 2]" 1
1708 1 67 ALA MB 1 68 ASP HA . . 5.090 3.753 3.601 3.930 . 0 0 "[ . 1 . 2]" 1
1709 1 67 ALA MB 1 68 ASP QB . . 4.370 3.934 3.451 4.399 0.029 20 0 "[ . 1 . 2]" 1
1710 1 67 ALA MB 1 69 GLN H . . 5.360 4.458 4.188 4.737 . 0 0 "[ . 1 . 2]" 1
1711 1 67 ALA MB 1 70 GLN QB . . 5.320 4.058 3.144 4.544 . 0 0 "[ . 1 . 2]" 1
1712 1 67 ALA MB 1 71 LYS QD . . 4.050 3.578 2.963 4.062 0.012 11 0 "[ . 1 . 2]" 1
1713 1 67 ALA MB 1 71 LYS QE . . 3.580 2.196 1.770 3.011 . 0 0 "[ . 1 . 2]" 1
1714 1 68 ASP H 1 68 ASP QB . . 2.830 2.261 2.136 2.423 . 0 0 "[ . 1 . 2]" 1
1715 1 68 ASP H 1 69 GLN H . . 3.200 2.711 2.560 2.862 . 0 0 "[ . 1 . 2]" 1
1716 1 68 ASP H 1 69 GLN QB . . 5.300 4.510 4.356 4.716 . 0 0 "[ . 1 . 2]" 1
1717 1 68 ASP HA 1 71 LYS QB . . 3.430 2.764 2.371 3.360 . 0 0 "[ . 1 . 2]" 1
1718 1 68 ASP HA 1 71 LYS QD . . 4.210 2.537 1.747 4.048 . 0 0 "[ . 1 . 2]" 1
1719 1 68 ASP HA 1 71 LYS QE . . 4.370 3.611 1.997 4.450 0.080 13 0 "[ . 1 . 2]" 1
1720 1 68 ASP QB 1 69 GLN H . . 3.220 2.634 2.384 2.952 . 0 0 "[ . 1 . 2]" 1
1721 1 68 ASP QB 1 69 GLN HA . . 4.560 3.995 3.778 4.209 . 0 0 "[ . 1 . 2]" 1
1722 1 68 ASP QB 1 69 GLN QE . . 5.030 4.352 2.436 5.167 0.137 4 0 "[ . 1 . 2]" 1
1723 1 69 GLN H 1 69 GLN QB . . 2.990 2.246 2.189 2.311 . 0 0 "[ . 1 . 2]" 1
1724 1 69 GLN H 1 69 GLN QG . . 4.240 3.936 3.460 4.084 . 0 0 "[ . 1 . 2]" 1
1725 1 69 GLN H 1 72 THR H . . 4.610 4.640 4.484 4.700 0.090 15 0 "[ . 1 . 2]" 1
1726 1 69 GLN HA 1 69 GLN QB . . 2.760 2.429 2.324 2.483 . 0 0 "[ . 1 . 2]" 1
1727 1 69 GLN HA 1 69 GLN QE . . 5.340 2.179 1.977 2.583 . 0 0 "[ . 1 . 2]" 1
1728 1 69 GLN HA 1 69 GLN QG . . 3.170 2.745 2.433 3.079 . 0 0 "[ . 1 . 2]" 1
1729 1 69 GLN HA 1 71 LYS H . . 5.500 4.415 4.149 4.643 . 0 0 "[ . 1 . 2]" 1
1730 1 69 GLN HA 1 72 THR H . . 3.650 3.372 3.055 3.601 . 0 0 "[ . 1 . 2]" 1
1731 1 69 GLN HA 1 72 THR HB . . 3.610 2.762 2.397 3.011 . 0 0 "[ . 1 . 2]" 1
1732 1 69 GLN HA 1 72 THR MG . . 4.250 4.077 3.802 4.239 . 0 0 "[ . 1 . 2]" 1
1733 1 69 GLN HA 1 73 THR H . . 4.670 4.143 3.895 4.410 . 0 0 "[ . 1 . 2]" 1
1734 1 69 GLN QB 1 69 GLN QG . . 2.400 1.993 1.973 2.008 . 0 0 "[ . 1 . 2]" 1
1735 1 69 GLN QB 1 70 GLN H . . 3.080 2.547 2.262 2.826 . 0 0 "[ . 1 . 2]" 1
1736 1 69 GLN HE21 1 72 THR HB . . 5.500 3.222 2.168 5.024 . 0 0 "[ . 1 . 2]" 1
1737 1 69 GLN HE21 1 72 THR MG . . 5.500 3.852 2.990 5.459 . 0 0 "[ . 1 . 2]" 1
1738 1 69 GLN HE22 1 72 THR HB . . 5.500 3.990 2.806 5.515 0.015 19 0 "[ . 1 . 2]" 1
1739 1 69 GLN HE22 1 72 THR MG . . 5.500 3.918 2.939 5.566 0.066 7 0 "[ . 1 . 2]" 1
1740 1 69 GLN QG 1 72 THR MG . . 5.070 4.830 4.299 5.135 0.065 4 0 "[ . 1 . 2]" 1
1741 1 69 GLN QG 1 73 THR H . . 5.500 4.637 4.092 5.566 0.066 7 0 "[ . 1 . 2]" 1
1742 1 70 GLN H 1 70 GLN QB . . 3.060 2.429 2.334 2.522 . 0 0 "[ . 1 . 2]" 1
1743 1 70 GLN H 1 70 GLN QE . . 4.990 4.727 4.259 5.006 0.016 11 0 "[ . 1 . 2]" 1
1744 1 70 GLN H 1 70 GLN HG2 . . 3.550 2.240 2.053 3.333 . 0 0 "[ . 1 . 2]" 1
1745 1 70 GLN H 1 70 GLN QG . . 2.990 2.169 2.040 2.312 . 0 0 "[ . 1 . 2]" 1
1746 1 70 GLN H 1 70 GLN HG3 . . 3.550 3.504 2.326 3.627 0.077 19 0 "[ . 1 . 2]" 1
1747 1 70 GLN H 1 71 LYS H . . 3.260 2.671 2.510 2.786 . 0 0 "[ . 1 . 2]" 1
1748 1 70 GLN HA 1 70 GLN QE . . 4.590 3.377 2.511 3.949 . 0 0 "[ . 1 . 2]" 1
1749 1 70 GLN HA 1 70 GLN HG2 . . 3.780 2.973 2.472 3.183 . 0 0 "[ . 1 . 2]" 1
1750 1 70 GLN HA 1 70 GLN QG . . 3.150 2.858 2.394 3.025 . 0 0 "[ . 1 . 2]" 1
1751 1 70 GLN HA 1 70 GLN HG3 . . 3.780 3.715 3.205 3.785 0.005 18 0 "[ . 1 . 2]" 1
1752 1 70 GLN HA 1 73 THR H . . 3.900 3.173 2.884 3.512 . 0 0 "[ . 1 . 2]" 1
1753 1 70 GLN HA 1 73 THR HB . . 3.370 2.609 2.339 2.908 . 0 0 "[ . 1 . 2]" 1
1754 1 70 GLN HA 1 73 THR MG . . 4.610 4.033 3.753 4.382 . 0 0 "[ . 1 . 2]" 1
1755 1 70 GLN HA 1 74 PHE H . . 5.040 3.928 3.689 4.247 . 0 0 "[ . 1 . 2]" 1
1756 1 70 GLN QB 1 96 THR MG . . 5.340 3.701 3.249 4.126 . 0 0 "[ . 1 . 2]" 1
1757 1 70 GLN QB 1 97 THR H . . 5.340 4.980 3.660 5.405 0.065 14 0 "[ . 1 . 2]" 1
1758 1 70 GLN HB2 1 71 LYS H . . 4.130 2.652 2.466 2.816 . 0 0 "[ . 1 . 2]" 1
1759 1 70 GLN HB3 1 71 LYS H . . 4.130 3.672 3.516 3.840 . 0 0 "[ . 1 . 2]" 1
1760 1 70 GLN QE 1 98 CYS HA . . 4.620 3.112 2.003 4.385 . 0 0 "[ . 1 . 2]" 1
1761 1 70 GLN HE21 1 97 THR H . . 5.500 4.200 2.976 5.012 . 0 0 "[ . 1 . 2]" 1
1762 1 70 GLN HE21 1 98 CYS HA . . 5.260 3.305 2.397 4.671 . 0 0 "[ . 1 . 2]" 1
1763 1 70 GLN HE22 1 97 THR H . . 5.500 4.292 2.629 5.480 . 0 0 "[ . 1 . 2]" 1
1764 1 70 GLN HE22 1 98 CYS HA . . 5.260 4.177 2.016 5.358 0.098 18 0 "[ . 1 . 2]" 1
1765 1 70 GLN QG 1 71 LYS H . . 4.370 4.045 3.906 4.146 . 0 0 "[ . 1 . 2]" 1
1766 1 70 GLN QG 1 98 CYS HA . . 4.430 3.615 2.321 4.439 0.009 19 0 "[ . 1 . 2]" 1
1767 1 70 GLN HG2 1 71 LYS H . . 5.040 4.334 4.122 4.970 . 0 0 "[ . 1 . 2]" 1
1768 1 70 GLN HG3 1 71 LYS H . . 5.040 4.893 4.333 5.025 . 0 0 "[ . 1 . 2]" 1
1769 1 71 LYS H 1 71 LYS QB . . 2.980 2.450 2.367 2.567 . 0 0 "[ . 1 . 2]" 1
1770 1 71 LYS H 1 71 LYS QD . . 4.430 3.805 3.630 4.228 . 0 0 "[ . 1 . 2]" 1
1771 1 71 LYS H 1 71 LYS HG2 . . 3.950 3.514 3.263 3.687 . 0 0 "[ . 1 . 2]" 1
1772 1 71 LYS H 1 71 LYS HG3 . . 3.950 2.271 1.977 2.480 . 0 0 "[ . 1 . 2]" 1
1773 1 71 LYS H 1 72 THR H . . 3.270 2.646 2.549 2.780 . 0 0 "[ . 1 . 2]" 1
1774 1 71 LYS HA 1 71 LYS QD . . 4.410 4.031 3.990 4.081 . 0 0 "[ . 1 . 2]" 1
1775 1 71 LYS HA 1 71 LYS HG2 . . 3.500 2.597 2.510 2.710 . 0 0 "[ . 1 . 2]" 1
1776 1 71 LYS HA 1 71 LYS HG3 . . 3.500 3.029 2.934 3.143 . 0 0 "[ . 1 . 2]" 1
1777 1 71 LYS HA 1 74 PHE QB . . 3.590 2.644 2.204 2.844 . 0 0 "[ . 1 . 2]" 1
1778 1 71 LYS HA 1 74 PHE QD . . 4.860 3.835 3.494 4.053 . 0 0 "[ . 1 . 2]" 1
1779 1 71 LYS QB 1 71 LYS QD . . 3.090 2.122 2.082 2.334 . 0 0 "[ . 1 . 2]" 1
1780 1 71 LYS QB 1 72 THR H . . 3.420 2.645 2.330 3.000 . 0 0 "[ . 1 . 2]" 1
1781 1 71 LYS QD 1 72 THR H . . 5.260 4.737 4.339 5.310 0.050 18 0 "[ . 1 . 2]" 1
1782 1 71 LYS QG 1 72 THR H . . 4.810 4.107 3.836 4.250 . 0 0 "[ . 1 . 2]" 1
1783 1 72 THR H 1 72 THR HB . . 3.000 2.535 2.407 2.633 . 0 0 "[ . 1 . 2]" 1
1784 1 72 THR H 1 72 THR MG . . 3.830 3.766 3.745 3.800 . 0 0 "[ . 1 . 2]" 1
1785 1 72 THR H 1 73 THR H . . 3.020 2.545 2.312 2.718 . 0 0 "[ . 1 . 2]" 1
1786 1 72 THR H 1 75 LYS QD . . 5.340 4.856 4.420 5.301 . 0 0 "[ . 1 . 2]" 1
1787 1 72 THR HA 1 72 THR MG . . 3.160 2.385 2.335 2.488 . 0 0 "[ . 1 . 2]" 1
1788 1 72 THR HA 1 74 PHE H . . 4.330 4.229 4.046 4.369 0.039 12 0 "[ . 1 . 2]" 1
1789 1 72 THR HA 1 75 LYS H . . 4.490 3.574 3.064 3.862 . 0 0 "[ . 1 . 2]" 1
1790 1 72 THR HA 1 75 LYS QB . . 5.030 3.474 2.978 3.964 . 0 0 "[ . 1 . 2]" 1
1791 1 72 THR HA 1 75 LYS HD2 . . 4.880 2.168 1.779 2.663 . 0 0 "[ . 1 . 2]" 1
1792 1 72 THR HA 1 75 LYS QD . . 4.130 2.156 1.773 2.637 . 0 0 "[ . 1 . 2]" 1
1793 1 72 THR HA 1 75 LYS HD3 . . 4.880 3.855 3.351 4.311 . 0 0 "[ . 1 . 2]" 1
1794 1 72 THR HA 1 75 LYS QE . . 5.240 2.789 1.773 3.351 . 0 0 "[ . 1 . 2]" 1
1795 1 72 THR HA 1 75 LYS HG2 . . 5.500 4.208 3.584 4.624 . 0 0 "[ . 1 . 2]" 1
1796 1 72 THR HA 1 75 LYS QG . . 4.680 2.722 2.156 3.101 . 0 0 "[ . 1 . 2]" 1
1797 1 72 THR HA 1 75 LYS HG3 . . 5.500 2.758 2.174 3.151 . 0 0 "[ . 1 . 2]" 1
1798 1 72 THR MG 1 73 THR H . . 3.980 3.572 3.303 3.776 . 0 0 "[ . 1 . 2]" 1
1799 1 72 THR MG 1 75 LYS H . . 5.430 4.602 4.307 4.770 . 0 0 "[ . 1 . 2]" 1
1800 1 72 THR MG 1 75 LYS QE . . 4.100 3.839 3.122 4.139 0.039 20 0 "[ . 1 . 2]" 1
1801 1 72 THR MG 1 75 LYS QG . . 5.340 4.055 3.797 4.279 . 0 0 "[ . 1 . 2]" 1
1802 1 72 THR MG 1 76 GLN H . . 5.500 4.981 4.382 5.440 . 0 0 "[ . 1 . 2]" 1
1803 1 72 THR MG 1 76 GLN QE . . 5.340 4.088 2.850 5.351 0.011 20 0 "[ . 1 . 2]" 1
1804 1 73 THR H 1 73 THR HB . . 3.010 2.583 2.532 2.627 . 0 0 "[ . 1 . 2]" 1
1805 1 73 THR H 1 73 THR MG . . 3.840 3.764 3.750 3.776 . 0 0 "[ . 1 . 2]" 1
1806 1 73 THR H 1 74 PHE H . . 3.450 2.523 2.447 2.608 . 0 0 "[ . 1 . 2]" 1
1807 1 73 THR H 1 74 PHE QB . . 5.160 4.258 4.191 4.357 . 0 0 "[ . 1 . 2]" 1
1808 1 73 THR H 1 75 LYS H . . 4.750 4.081 3.947 4.222 . 0 0 "[ . 1 . 2]" 1
1809 1 73 THR HA 1 73 THR MG . . 3.100 2.355 2.326 2.390 . 0 0 "[ . 1 . 2]" 1
1810 1 73 THR HA 1 75 LYS QD . . 5.340 5.284 5.051 5.413 0.073 7 0 "[ . 1 . 2]" 1
1811 1 73 THR HA 1 76 GLN H . . 4.380 3.428 3.199 3.615 . 0 0 "[ . 1 . 2]" 1
1812 1 73 THR HA 1 76 GLN QB . . 4.450 3.326 2.865 3.744 . 0 0 "[ . 1 . 2]" 1
1813 1 73 THR HA 1 76 GLN QG . . 5.200 3.381 2.627 4.783 . 0 0 "[ . 1 . 2]" 1
1814 1 73 THR HB 1 74 PHE H . . 3.510 2.822 2.692 3.054 . 0 0 "[ . 1 . 2]" 1
1815 1 73 THR HB 1 75 LYS H . . 5.500 5.024 4.929 5.216 . 0 0 "[ . 1 . 2]" 1
1816 1 73 THR MG 1 74 PHE H . . 4.000 3.744 3.633 3.827 . 0 0 "[ . 1 . 2]" 1
1817 1 73 THR MG 1 74 PHE HA . . 4.230 3.773 3.652 3.917 . 0 0 "[ . 1 . 2]" 1
1818 1 73 THR MG 1 74 PHE QB . . 5.030 4.626 4.507 4.760 . 0 0 "[ . 1 . 2]" 1
1819 1 73 THR MG 1 76 GLN H . . 4.620 4.224 4.021 4.431 . 0 0 "[ . 1 . 2]" 1
1820 1 73 THR MG 1 76 GLN HB2 . . 5.250 3.318 2.978 3.819 . 0 0 "[ . 1 . 2]" 1
1821 1 73 THR MG 1 76 GLN QB . . 4.610 3.226 2.911 3.446 . 0 0 "[ . 1 . 2]" 1
1822 1 73 THR MG 1 76 GLN HB3 . . 5.250 4.475 3.921 4.798 . 0 0 "[ . 1 . 2]" 1
1823 1 73 THR MG 1 76 GLN HE21 . . 5.500 3.154 2.362 5.049 . 0 0 "[ . 1 . 2]" 1
1824 1 73 THR MG 1 76 GLN HE22 . . 5.500 3.183 2.470 4.895 . 0 0 "[ . 1 . 2]" 1
1825 1 73 THR MG 1 76 GLN QG . . 5.060 4.264 3.738 5.112 0.052 4 0 "[ . 1 . 2]" 1
1826 1 73 THR MG 1 77 THR H . . 4.270 4.088 3.778 4.317 0.047 4 0 "[ . 1 . 2]" 1
1827 1 73 THR MG 1 77 THR HA . . 5.500 5.293 4.912 5.538 0.038 2 0 "[ . 1 . 2]" 1
1828 1 74 PHE H 1 74 PHE QB . . 3.040 2.228 2.194 2.283 . 0 0 "[ . 1 . 2]" 1
1829 1 74 PHE H 1 74 PHE QD . . 4.250 4.148 4.118 4.177 . 0 0 "[ . 1 . 2]" 1
1830 1 74 PHE H 1 75 LYS H . . 3.630 2.605 2.554 2.662 . 0 0 "[ . 1 . 2]" 1
1831 1 74 PHE H 1 75 LYS QB . . 5.300 4.555 4.390 4.693 . 0 0 "[ . 1 . 2]" 1
1832 1 74 PHE H 1 75 LYS QD . . 5.340 5.305 5.169 5.360 0.020 18 0 "[ . 1 . 2]" 1
1833 1 74 PHE H 1 76 GLN H . . 4.900 4.241 4.095 4.378 . 0 0 "[ . 1 . 2]" 1
1834 1 74 PHE H 1 96 THR MG . . 5.220 4.542 4.241 4.851 . 0 0 "[ . 1 . 2]" 1
1835 1 74 PHE HA 1 76 GLN H . . 5.500 4.060 3.896 4.316 . 0 0 "[ . 1 . 2]" 1
1836 1 74 PHE HA 1 77 THR H . . 4.500 3.041 2.922 3.156 . 0 0 "[ . 1 . 2]" 1
1837 1 74 PHE HA 1 77 THR HB . . 4.620 2.601 2.292 2.985 . 0 0 "[ . 1 . 2]" 1
1838 1 74 PHE HA 1 77 THR MG . . 4.380 3.819 3.469 4.125 . 0 0 "[ . 1 . 2]" 1
1839 1 74 PHE HA 1 78 VAL H . . 5.500 4.083 3.810 4.515 . 0 0 "[ . 1 . 2]" 1
1840 1 74 PHE HA 1 96 THR MG . . 5.020 4.039 3.705 4.483 . 0 0 "[ . 1 . 2]" 1
1841 1 74 PHE QB 1 75 LYS H . . 3.860 2.788 2.661 2.912 . 0 0 "[ . 1 . 2]" 1
1842 1 74 PHE QB 1 75 LYS QB . . 5.220 4.715 4.598 4.832 . 0 0 "[ . 1 . 2]" 1
1843 1 74 PHE QB 1 76 GLN H . . 5.170 4.818 4.742 4.911 . 0 0 "[ . 1 . 2]" 1
1844 1 74 PHE QB 1 77 THR H . . 4.910 4.773 4.624 4.874 . 0 0 "[ . 1 . 2]" 1
1845 1 74 PHE QB 1 96 THR MG . . 3.640 2.508 2.226 2.727 . 0 0 "[ . 1 . 2]" 1
1846 1 74 PHE QD 1 75 LYS H . . 4.840 4.369 4.256 4.475 . 0 0 "[ . 1 . 2]" 1
1847 1 74 PHE QD 1 77 THR H . . 4.350 4.307 4.024 4.407 0.057 7 0 "[ . 1 . 2]" 1
1848 1 74 PHE QD 1 77 THR HB . . 4.160 2.449 2.169 2.748 . 0 0 "[ . 1 . 2]" 1
1849 1 74 PHE QD 1 77 THR MG . . 3.960 2.929 2.536 3.257 . 0 0 "[ . 1 . 2]" 1
1850 1 74 PHE QD 1 78 VAL H . . 4.650 4.278 3.886 4.676 0.026 8 0 "[ . 1 . 2]" 1
1851 1 74 PHE QD 1 78 VAL QG . . 3.620 3.284 3.060 3.621 0.001 20 0 "[ . 1 . 2]" 1
1852 1 74 PHE QD 1 96 THR HA . . 4.550 3.730 2.958 4.400 . 0 0 "[ . 1 . 2]" 1
1853 1 74 PHE QD 1 96 THR MG . . 3.540 2.892 2.643 3.067 . 0 0 "[ . 1 . 2]" 1
1854 1 74 PHE QE 1 77 THR MG . . 4.070 2.937 2.702 3.107 . 0 0 "[ . 1 . 2]" 1
1855 1 74 PHE QE 1 78 VAL QG . . 4.030 3.089 2.804 3.432 . 0 0 "[ . 1 . 2]" 1
1856 1 74 PHE QE 1 94 ALA MB . . 3.060 2.523 2.085 3.017 . 0 0 "[ . 1 . 2]" 1
1857 1 74 PHE QE 1 95 VAL H . . 3.560 3.157 2.640 3.636 0.076 9 0 "[ . 1 . 2]" 1
1858 1 74 PHE QE 1 95 VAL QG . . 5.440 4.248 3.928 4.593 . 0 0 "[ . 1 . 2]" 1
1859 1 74 PHE QE 1 96 THR H . . 4.430 4.138 3.608 4.442 0.012 7 0 "[ . 1 . 2]" 1
1860 1 74 PHE QE 1 96 THR MG . . 4.810 3.166 2.924 3.407 . 0 0 "[ . 1 . 2]" 1
1861 1 74 PHE HZ 1 77 THR MG . . 4.980 4.881 4.650 5.030 0.050 12 0 "[ . 1 . 2]" 1
1862 1 74 PHE HZ 1 78 VAL QG . . 3.880 3.344 2.990 3.716 . 0 0 "[ . 1 . 2]" 1
1863 1 74 PHE HZ 1 89 PHE HZ . . 5.150 4.001 3.575 4.404 . 0 0 "[ . 1 . 2]" 1
1864 1 74 PHE HZ 1 94 ALA MB . . 3.810 3.085 2.348 3.788 . 0 0 "[ . 1 . 2]" 1
1865 1 74 PHE HZ 1 96 THR H . . 5.270 4.991 4.621 5.355 0.085 8 0 "[ . 1 . 2]" 1
1866 1 74 PHE HZ 1 96 THR MG . . 4.170 3.718 3.384 4.119 . 0 0 "[ . 1 . 2]" 1
1867 1 75 LYS H 1 75 LYS HB2 . . 3.510 2.450 2.292 2.554 . 0 0 "[ . 1 . 2]" 1
1868 1 75 LYS H 1 75 LYS QB . . 3.060 2.408 2.264 2.502 . 0 0 "[ . 1 . 2]" 1
1869 1 75 LYS H 1 75 LYS HB3 . . 3.510 3.561 3.525 3.581 0.071 3 0 "[ . 1 . 2]" 1
1870 1 75 LYS H 1 75 LYS HD2 . . 4.630 3.819 3.660 3.896 . 0 0 "[ . 1 . 2]" 1
1871 1 75 LYS H 1 75 LYS HD3 . . 4.630 4.626 4.587 4.662 0.032 20 0 "[ . 1 . 2]" 1
1872 1 75 LYS H 1 75 LYS QE . . 5.340 4.375 4.060 4.602 . 0 0 "[ . 1 . 2]" 1
1873 1 75 LYS H 1 75 LYS HG2 . . 3.860 3.482 3.271 3.705 . 0 0 "[ . 1 . 2]" 1
1874 1 75 LYS H 1 75 LYS QG . . 3.230 2.175 1.982 2.410 . 0 0 "[ . 1 . 2]" 1
1875 1 75 LYS H 1 75 LYS HG3 . . 3.860 2.197 1.998 2.442 . 0 0 "[ . 1 . 2]" 1
1876 1 75 LYS H 1 76 GLN H . . 3.350 2.732 2.648 2.843 . 0 0 "[ . 1 . 2]" 1
1877 1 75 LYS H 1 77 THR H . . 4.850 4.032 3.793 4.139 . 0 0 "[ . 1 . 2]" 1
1878 1 75 LYS HA 1 75 LYS QD . . 4.890 4.038 4.011 4.086 . 0 0 "[ . 1 . 2]" 1
1879 1 75 LYS HA 1 75 LYS HG2 . . 4.230 2.590 2.533 2.730 . 0 0 "[ . 1 . 2]" 1
1880 1 75 LYS HA 1 75 LYS QG . . 3.440 2.434 2.359 2.523 . 0 0 "[ . 1 . 2]" 1
1881 1 75 LYS HA 1 75 LYS HG3 . . 4.230 2.960 2.815 3.096 . 0 0 "[ . 1 . 2]" 1
1882 1 75 LYS HA 1 78 VAL H . . 4.420 3.651 3.522 3.851 . 0 0 "[ . 1 . 2]" 1
1883 1 75 LYS HA 1 78 VAL HB . . 4.040 3.187 2.808 3.609 . 0 0 "[ . 1 . 2]" 1
1884 1 75 LYS HA 1 78 VAL QG . . 4.440 3.174 3.010 3.463 . 0 0 "[ . 1 . 2]" 1
1885 1 75 LYS QB 1 75 LYS QD . . 3.340 2.123 2.102 2.143 . 0 0 "[ . 1 . 2]" 1
1886 1 75 LYS QB 1 76 GLN H . . 3.390 2.528 2.335 2.667 . 0 0 "[ . 1 . 2]" 1
1887 1 75 LYS QB 1 76 GLN QG . . 4.920 3.037 2.826 4.248 . 0 0 "[ . 1 . 2]" 1
1888 1 75 LYS HB2 1 76 GLN H . . 3.990 2.587 2.389 2.741 . 0 0 "[ . 1 . 2]" 1
1889 1 75 LYS HB3 1 76 GLN H . . 3.990 3.562 3.226 3.714 . 0 0 "[ . 1 . 2]" 1
1890 1 75 LYS QE 1 75 LYS QG . . 3.240 2.130 2.107 2.147 . 0 0 "[ . 1 . 2]" 1
1891 1 75 LYS QG 1 76 GLN H . . 4.430 4.081 3.925 4.236 . 0 0 "[ . 1 . 2]" 1
1892 1 75 LYS HG2 1 76 GLN H . . 5.230 5.005 4.916 5.097 . 0 0 "[ . 1 . 2]" 1
1893 1 75 LYS HG3 1 76 GLN H . . 5.230 4.326 4.119 4.532 . 0 0 "[ . 1 . 2]" 1
1894 1 76 GLN H 1 76 GLN HB2 . . 3.260 2.357 2.065 2.525 . 0 0 "[ . 1 . 2]" 1
1895 1 76 GLN H 1 76 GLN HB3 . . 3.260 3.498 3.185 3.540 0.280 12 0 "[ . 1 . 2]" 1
1896 1 76 GLN H 1 76 GLN QE . . 5.250 3.598 2.963 4.412 . 0 0 "[ . 1 . 2]" 1
1897 1 76 GLN H 1 76 GLN QG . . 3.520 2.310 1.933 3.524 0.004 4 0 "[ . 1 . 2]" 1
1898 1 76 GLN H 1 77 THR H . . 3.060 2.467 2.386 2.532 . 0 0 "[ . 1 . 2]" 1
1899 1 76 GLN H 1 77 THR HA . . 5.160 5.102 5.037 5.159 . 0 0 "[ . 1 . 2]" 1
1900 1 76 GLN H 1 77 THR HB . . 4.650 4.736 4.707 4.751 0.101 5 0 "[ . 1 . 2]" 1
1901 1 76 GLN H 1 78 VAL H . . 4.850 4.171 4.045 4.351 . 0 0 "[ . 1 . 2]" 1
1902 1 76 GLN HA 1 76 GLN QG . . 3.130 2.430 2.233 2.541 . 0 0 "[ . 1 . 2]" 1
1903 1 76 GLN HA 1 79 GLN H . . 4.090 3.391 2.989 3.665 . 0 0 "[ . 1 . 2]" 1
1904 1 76 GLN HA 1 79 GLN QB . . 3.550 2.504 1.795 3.475 . 0 0 "[ . 1 . 2]" 1
1905 1 76 GLN HA 1 79 GLN QG . . 4.210 3.053 2.312 4.220 0.010 8 0 "[ . 1 . 2]" 1
1906 1 76 GLN QB 1 76 GLN QG . . 2.340 2.081 2.069 2.086 . 0 0 "[ . 1 . 2]" 1
1907 1 76 GLN QB 1 77 THR H . . 3.210 2.668 2.486 2.954 . 0 0 "[ . 1 . 2]" 1
1908 1 76 GLN QB 1 77 THR HA . . 5.140 3.947 3.866 4.060 . 0 0 "[ . 1 . 2]" 1
1909 1 76 GLN HB2 1 77 THR H . . 3.690 2.754 2.525 3.415 . 0 0 "[ . 1 . 2]" 1
1910 1 76 GLN HB3 1 77 THR H . . 3.690 3.690 3.233 3.798 0.108 20 0 "[ . 1 . 2]" 1
1911 1 77 THR H 1 77 THR HB . . 3.200 2.576 2.504 2.652 . 0 0 "[ . 1 . 2]" 1
1912 1 77 THR H 1 77 THR MG . . 4.370 3.748 3.729 3.757 . 0 0 "[ . 1 . 2]" 1
1913 1 77 THR H 1 78 VAL H . . 3.400 2.698 2.606 2.810 . 0 0 "[ . 1 . 2]" 1
1914 1 77 THR H 1 78 VAL HB . . 5.500 4.907 4.739 5.054 . 0 0 "[ . 1 . 2]" 1
1915 1 77 THR H 1 78 VAL QG . . 4.670 4.007 3.847 4.152 . 0 0 "[ . 1 . 2]" 1
1916 1 77 THR HA 1 77 THR MG . . 3.280 2.367 2.316 2.414 . 0 0 "[ . 1 . 2]" 1
1917 1 77 THR HA 1 79 GLN H . . 5.150 4.372 4.033 4.520 . 0 0 "[ . 1 . 2]" 1
1918 1 77 THR HA 1 81 ALA MB . . 5.500 4.749 4.392 5.249 . 0 0 "[ . 1 . 2]" 1
1919 1 77 THR HB 1 78 VAL H . . 3.260 2.450 2.281 2.645 . 0 0 "[ . 1 . 2]" 1
1920 1 77 THR HB 1 78 VAL HB . . 4.810 4.808 4.722 4.871 0.061 8 0 "[ . 1 . 2]" 1
1921 1 77 THR HB 1 78 VAL QG . . 4.490 2.999 2.880 3.128 . 0 0 "[ . 1 . 2]" 1
1922 1 77 THR MG 1 78 VAL H . . 3.970 3.456 3.235 3.594 . 0 0 "[ . 1 . 2]" 1
1923 1 77 THR MG 1 78 VAL HA . . 4.080 3.547 3.368 3.843 . 0 0 "[ . 1 . 2]" 1
1924 1 77 THR MG 1 78 VAL QG . . 4.160 3.511 3.313 3.764 . 0 0 "[ . 1 . 2]" 1
1925 1 77 THR MG 1 80 GLY H . . 5.500 4.654 4.375 4.865 . 0 0 "[ . 1 . 2]" 1
1926 1 77 THR MG 1 81 ALA H . . 4.970 4.626 4.175 5.048 0.078 10 0 "[ . 1 . 2]" 1
1927 1 77 THR MG 1 93 ASN QD . . 5.340 5.343 5.159 5.466 0.126 8 0 "[ . 1 . 2]" 1
1928 1 77 THR MG 1 94 ALA H . . 5.180 4.349 3.863 4.858 . 0 0 "[ . 1 . 2]" 1
1929 1 77 THR MG 1 94 ALA HA . . 3.210 2.036 1.755 2.502 . 0 0 "[ . 1 . 2]" 1
1930 1 77 THR MG 1 94 ALA MB . . 3.660 2.739 2.472 3.078 . 0 0 "[ . 1 . 2]" 1
1931 1 77 THR MG 1 95 VAL H . . 3.200 2.376 1.842 2.956 . 0 0 "[ . 1 . 2]" 1
1932 1 77 THR MG 1 95 VAL QG . . 4.590 3.511 2.997 4.010 . 0 0 "[ . 1 . 2]" 1
1933 1 78 VAL H 1 78 VAL HB . . 3.070 2.535 2.463 2.621 . 0 0 "[ . 1 . 2]" 1
1934 1 78 VAL H 1 78 VAL MG1 . . 3.890 3.758 3.722 3.776 . 0 0 "[ . 1 . 2]" 1
1935 1 78 VAL H 1 78 VAL QG . . 3.120 2.037 1.959 2.140 . 0 0 "[ . 1 . 2]" 1
1936 1 78 VAL H 1 78 VAL MG2 . . 3.890 2.046 1.965 2.152 . 0 0 "[ . 1 . 2]" 1
1937 1 78 VAL H 1 79 GLN H . . 3.420 2.651 2.572 2.756 . 0 0 "[ . 1 . 2]" 1
1938 1 78 VAL H 1 80 GLY H . . 5.120 4.285 4.064 4.484 . 0 0 "[ . 1 . 2]" 1
1939 1 78 VAL H 1 81 ALA H . . 5.500 4.863 4.594 5.274 . 0 0 "[ . 1 . 2]" 1
1940 1 78 VAL H 1 89 PHE QE . . 5.500 5.267 4.753 5.625 0.125 12 0 "[ . 1 . 2]" 1
1941 1 78 VAL HA 1 78 VAL MG1 . . 3.470 2.394 2.340 2.442 . 0 0 "[ . 1 . 2]" 1
1942 1 78 VAL HA 1 78 VAL QG . . 3.020 2.123 2.107 2.133 . 0 0 "[ . 1 . 2]" 1
1943 1 78 VAL HA 1 78 VAL MG2 . . 3.470 2.373 2.308 2.414 . 0 0 "[ . 1 . 2]" 1
1944 1 78 VAL HA 1 80 GLY H . . 5.280 4.236 4.023 4.455 . 0 0 "[ . 1 . 2]" 1
1945 1 78 VAL HA 1 81 ALA H . . 3.880 3.235 2.975 3.443 . 0 0 "[ . 1 . 2]" 1
1946 1 78 VAL HA 1 81 ALA MB . . 3.630 2.210 1.965 2.547 . 0 0 "[ . 1 . 2]" 1
1947 1 78 VAL HA 1 82 LEU H . . 4.760 3.993 3.584 4.474 . 0 0 "[ . 1 . 2]" 1
1948 1 78 VAL HA 1 89 PHE QE . . 3.420 2.705 2.081 3.221 . 0 0 "[ . 1 . 2]" 1
1949 1 78 VAL HA 1 89 PHE HZ . . 4.270 4.072 3.545 4.316 0.046 20 0 "[ . 1 . 2]" 1
1950 1 78 VAL HA 1 94 ALA MB . . 4.100 3.148 2.768 3.417 . 0 0 "[ . 1 . 2]" 1
1951 1 78 VAL HB 1 79 GLN H . . 3.580 2.777 2.648 2.982 . 0 0 "[ . 1 . 2]" 1
1952 1 78 VAL HB 1 89 PHE QE . . 4.680 4.655 4.414 4.784 0.104 20 0 "[ . 1 . 2]" 1
1953 1 78 VAL HB 1 94 ALA MB . . 5.500 5.219 4.639 5.523 0.023 14 0 "[ . 1 . 2]" 1
1954 1 78 VAL QG 1 79 GLN H . . 3.710 3.303 3.193 3.404 . 0 0 "[ . 1 . 2]" 1
1955 1 78 VAL QG 1 79 GLN HA . . 4.620 3.640 3.447 3.773 . 0 0 "[ . 1 . 2]" 1
1956 1 78 VAL QG 1 81 ALA MB . . 4.310 2.869 2.642 3.264 . 0 0 "[ . 1 . 2]" 1
1957 1 78 VAL QG 1 82 LEU H . . 4.530 3.568 3.282 3.954 . 0 0 "[ . 1 . 2]" 1
1958 1 78 VAL QG 1 82 LEU QD . . 3.690 2.071 1.767 2.326 . 0 0 "[ . 1 . 2]" 1
1959 1 78 VAL QG 1 82 LEU HG . . 4.470 2.912 2.153 3.803 . 0 0 "[ . 1 . 2]" 1
1960 1 78 VAL QG 1 89 PHE QE . . 3.090 2.009 1.794 2.217 . 0 0 "[ . 1 . 2]" 1
1961 1 78 VAL QG 1 94 ALA MB . . 4.090 2.799 2.172 3.127 . 0 0 "[ . 1 . 2]" 1
1962 1 78 VAL MG1 1 79 GLN H . . 4.250 3.585 3.399 3.735 . 0 0 "[ . 1 . 2]" 1
1963 1 78 VAL MG1 1 80 GLY H . . 5.500 5.029 4.869 5.193 . 0 0 "[ . 1 . 2]" 1
1964 1 78 VAL MG1 1 81 ALA MB . . 5.460 3.006 2.742 3.518 . 0 0 "[ . 1 . 2]" 1
1965 1 78 VAL MG1 1 89 PHE QE . . 4.010 2.048 1.800 2.305 . 0 0 "[ . 1 . 2]" 1
1966 1 78 VAL MG1 1 89 PHE HZ . . 3.130 2.808 2.353 3.134 0.004 20 0 "[ . 1 . 2]" 1
1967 1 78 VAL MG2 1 79 GLN H . . 4.250 3.872 3.778 3.992 . 0 0 "[ . 1 . 2]" 1
1968 1 78 VAL MG2 1 80 GLY H . . 5.500 5.405 5.228 5.551 0.051 4 0 "[ . 1 . 2]" 1
1969 1 78 VAL MG2 1 81 ALA MB . . 5.460 3.652 3.452 3.945 . 0 0 "[ . 1 . 2]" 1
1970 1 78 VAL MG2 1 89 PHE QE . . 4.010 3.076 2.633 3.494 . 0 0 "[ . 1 . 2]" 1
1971 1 78 VAL MG2 1 89 PHE HZ . . 3.130 2.685 2.146 2.936 . 0 0 "[ . 1 . 2]" 1
1972 1 79 GLN H 1 79 GLN HB2 . . 3.360 2.199 1.990 2.496 . 0 0 "[ . 1 . 2]" 1
1973 1 79 GLN H 1 79 GLN QB . . 2.910 2.173 1.971 2.450 . 0 0 "[ . 1 . 2]" 1
1974 1 79 GLN H 1 79 GLN HB3 . . 3.360 3.405 2.876 3.569 0.209 19 0 "[ . 1 . 2]" 1
1975 1 79 GLN H 1 79 GLN HG2 . . 4.000 3.372 2.426 3.967 . 0 0 "[ . 1 . 2]" 1
1976 1 79 GLN H 1 79 GLN QG . . 3.450 2.878 2.144 3.646 0.196 17 0 "[ . 1 . 2]" 1
1977 1 79 GLN H 1 79 GLN HG3 . . 4.000 3.453 2.167 4.253 0.253 17 0 "[ . 1 . 2]" 1
1978 1 79 GLN H 1 80 GLY H . . 3.470 2.807 2.629 2.951 . 0 0 "[ . 1 . 2]" 1
1979 1 79 GLN H 1 81 ALA H . . 4.100 3.941 3.783 4.109 0.009 19 0 "[ . 1 . 2]" 1
1980 1 79 GLN HA 1 79 GLN QE . . 4.800 4.155 3.493 4.777 . 0 0 "[ . 1 . 2]" 1
1981 1 79 GLN HA 1 79 GLN HG2 . . 3.750 2.506 2.258 3.640 . 0 0 "[ . 1 . 2]" 1
1982 1 79 GLN HA 1 79 GLN HG3 . . 3.750 3.350 2.389 3.707 . 0 0 "[ . 1 . 2]" 1
1983 1 79 GLN HA 1 81 ALA H . . 4.310 3.991 3.688 4.334 0.024 3 0 "[ . 1 . 2]" 1
1984 1 79 GLN HA 1 82 LEU H . . 4.730 4.024 3.421 4.440 . 0 0 "[ . 1 . 2]" 1
1985 1 79 GLN HA 1 82 LEU QB . . 4.690 3.977 3.075 4.720 0.030 20 0 "[ . 1 . 2]" 1
1986 1 79 GLN HA 1 82 LEU QD . . 5.060 4.072 3.514 4.662 . 0 0 "[ . 1 . 2]" 1
1987 1 79 GLN QB 1 80 GLY H . . 3.110 2.553 2.305 2.759 . 0 0 "[ . 1 . 2]" 1
1988 1 79 GLN QB 1 80 GLY QA . . 4.120 3.515 3.390 3.622 . 0 0 "[ . 1 . 2]" 1
1989 1 79 GLN QB 1 81 ALA H . . 5.210 4.343 4.224 4.490 . 0 0 "[ . 1 . 2]" 1
1990 1 79 GLN HB2 1 80 GLY H . . 3.800 2.847 2.347 3.493 . 0 0 "[ . 1 . 2]" 1
1991 1 79 GLN HB3 1 80 GLY H . . 3.800 3.114 2.454 3.564 . 0 0 "[ . 1 . 2]" 1
1992 1 80 GLY H 1 81 ALA H . . 3.160 2.509 2.319 2.794 . 0 0 "[ . 1 . 2]" 1
1993 1 80 GLY H 1 81 ALA HA . . 4.950 5.005 4.925 5.081 0.131 10 0 "[ . 1 . 2]" 1
1994 1 80 GLY H 1 81 ALA MB . . 5.050 4.070 3.971 4.155 . 0 0 "[ . 1 . 2]" 1
1995 1 80 GLY QA 1 83 SER H . . 4.660 3.752 3.375 4.238 . 0 0 "[ . 1 . 2]" 1
1996 1 80 GLY HA2 1 81 ALA MB . . 5.500 4.894 4.711 4.976 . 0 0 "[ . 1 . 2]" 1
1997 1 80 GLY HA2 1 83 SER H . . 5.470 3.873 3.477 4.427 . 0 0 "[ . 1 . 2]" 1
1998 1 80 GLY HA3 1 81 ALA MB . . 5.500 4.496 4.390 4.631 . 0 0 "[ . 1 . 2]" 1
1999 1 80 GLY HA3 1 83 SER H . . 5.470 5.029 4.563 5.469 . 0 0 "[ . 1 . 2]" 1
2000 1 81 ALA H 1 81 ALA MB . . 2.900 2.302 2.231 2.444 . 0 0 "[ . 1 . 2]" 1
2001 1 81 ALA H 1 83 SER H . . 4.230 3.673 3.113 4.235 0.005 14 0 "[ . 1 . 2]" 1
2002 1 81 ALA H 1 89 PHE QE . . 5.150 4.543 4.073 4.929 . 0 0 "[ . 1 . 2]" 1
2003 1 81 ALA H 1 94 ALA MB . . 5.280 4.752 4.237 5.188 . 0 0 "[ . 1 . 2]" 1
2004 1 81 ALA HA 1 83 SER H . . 4.600 3.801 3.585 4.496 . 0 0 "[ . 1 . 2]" 1
2005 1 81 ALA HA 1 89 PHE QD . . 4.230 4.184 3.900 4.342 0.112 16 0 "[ . 1 . 2]" 1
2006 1 81 ALA HA 1 89 PHE QE . . 5.500 4.983 4.773 5.304 . 0 0 "[ . 1 . 2]" 1
2007 1 81 ALA HA 1 93 ASN QB . . 4.770 3.301 2.267 4.034 . 0 0 "[ . 1 . 2]" 1
2008 1 81 ALA HA 1 93 ASN HD21 . . 4.730 2.282 1.822 2.746 . 0 0 "[ . 1 . 2]" 1
2009 1 81 ALA HA 1 93 ASN QD . . 3.980 2.209 1.773 2.693 . 0 0 "[ . 1 . 2]" 1
2010 1 81 ALA HA 1 93 ASN HD22 . . 4.730 3.048 2.426 3.896 . 0 0 "[ . 1 . 2]" 1
2011 1 81 ALA HA 1 94 ALA MB . . 5.500 4.459 3.834 5.341 . 0 0 "[ . 1 . 2]" 1
2012 1 81 ALA MB 1 83 SER H . . 4.830 4.144 4.008 4.380 . 0 0 "[ . 1 . 2]" 1
2013 1 81 ALA MB 1 89 PHE QB . . 4.880 3.743 3.330 4.022 . 0 0 "[ . 1 . 2]" 1
2014 1 81 ALA MB 1 89 PHE QD . . 2.770 2.120 1.918 2.385 . 0 0 "[ . 1 . 2]" 1
2015 1 81 ALA MB 1 89 PHE QE . . 2.880 2.127 1.949 2.421 . 0 0 "[ . 1 . 2]" 1
2016 1 81 ALA MB 1 89 PHE HZ . . 3.960 4.018 3.840 4.100 0.140 18 0 "[ . 1 . 2]" 1
2017 1 81 ALA MB 1 90 GLY H . . 5.420 4.063 3.639 4.491 . 0 0 "[ . 1 . 2]" 1
2018 1 81 ALA MB 1 93 ASN H . . 5.060 4.925 4.243 5.184 0.124 13 0 "[ . 1 . 2]" 1
2019 1 81 ALA MB 1 93 ASN HB2 . . 4.690 3.347 2.149 3.816 . 0 0 "[ . 1 . 2]" 1
2020 1 81 ALA MB 1 93 ASN QB . . 3.910 3.187 2.083 3.670 . 0 0 "[ . 1 . 2]" 1
2021 1 81 ALA MB 1 93 ASN HB3 . . 4.690 4.149 2.391 4.768 0.078 16 0 "[ . 1 . 2]" 1
2022 1 81 ALA MB 1 93 ASN HD21 . . 4.700 2.811 2.338 3.367 . 0 0 "[ . 1 . 2]" 1
2023 1 81 ALA MB 1 93 ASN QD . . 4.020 2.284 2.002 2.710 . 0 0 "[ . 1 . 2]" 1
2024 1 81 ALA MB 1 93 ASN HD22 . . 4.700 2.724 2.054 4.235 . 0 0 "[ . 1 . 2]" 1
2025 1 81 ALA MB 1 94 ALA H . . 5.170 3.998 3.002 4.706 . 0 0 "[ . 1 . 2]" 1
2026 1 81 ALA MB 1 94 ALA HA . . 4.930 3.713 3.155 4.437 . 0 0 "[ . 1 . 2]" 1
2027 1 81 ALA MB 1 94 ALA MB . . 3.490 2.288 1.787 2.965 . 0 0 "[ . 1 . 2]" 1
2028 1 82 LEU H 1 82 LEU QB . . 2.770 2.400 2.324 2.466 . 0 0 "[ . 1 . 2]" 1
2029 1 82 LEU H 1 82 LEU MD1 . . 4.100 3.539 2.951 3.919 . 0 0 "[ . 1 . 2]" 1
2030 1 82 LEU H 1 82 LEU MD2 . . 4.100 2.970 1.772 3.828 . 0 0 "[ . 1 . 2]" 1
2031 1 82 LEU H 1 82 LEU HG . . 3.560 3.058 2.420 3.853 0.293 16 0 "[ . 1 . 2]" 1
2032 1 82 LEU H 1 83 SER H . . 3.160 2.618 2.410 3.020 . 0 0 "[ . 1 . 2]" 1
2033 1 82 LEU H 1 83 SER QB . . 5.000 4.445 4.039 5.024 0.024 13 0 "[ . 1 . 2]" 1
2034 1 82 LEU H 1 84 GLY H . . 5.140 4.635 3.962 5.192 0.052 15 0 "[ . 1 . 2]" 1
2035 1 82 LEU H 1 89 PHE QD . . 3.870 3.836 3.511 3.953 0.083 15 0 "[ . 1 . 2]" 1
2036 1 82 LEU H 1 89 PHE QE . . 5.370 3.961 3.677 4.451 . 0 0 "[ . 1 . 2]" 1
2037 1 82 LEU HA 1 82 LEU QD . . 3.010 1.951 1.832 2.023 . 0 0 "[ . 1 . 2]" 1
2038 1 82 LEU HA 1 82 LEU HG . . 3.550 3.258 2.993 3.657 0.107 16 0 "[ . 1 . 2]" 1
2039 1 82 LEU HA 1 83 SER H . . 3.040 3.129 2.812 3.406 0.366 10 0 "[ . 1 . 2]" 1
2040 1 82 LEU HA 1 84 GLY H . . 4.740 3.638 3.356 4.131 . 0 0 "[ . 1 . 2]" 1
2041 1 82 LEU HA 1 85 GLY H . . 3.470 3.246 2.869 3.532 0.062 13 0 "[ . 1 . 2]" 1
2042 1 82 LEU HA 1 85 GLY QA . . 4.860 4.330 3.813 4.845 . 0 0 "[ . 1 . 2]" 1
2043 1 82 LEU HA 1 86 ILE HA . . 4.930 3.637 3.163 4.040 . 0 0 "[ . 1 . 2]" 1
2044 1 82 LEU HA 1 89 PHE QD . . 4.540 3.602 3.106 4.082 . 0 0 "[ . 1 . 2]" 1
2045 1 82 LEU QB 1 83 SER H . . 3.970 3.443 2.720 3.811 . 0 0 "[ . 1 . 2]" 1
2046 1 82 LEU QB 1 83 SER QB . . 5.340 4.682 3.793 5.321 . 0 0 "[ . 1 . 2]" 1
2047 1 82 LEU QB 1 85 GLY H . . 5.190 4.489 3.993 5.040 . 0 0 "[ . 1 . 2]" 1
2048 1 82 LEU QB 1 86 ILE HA . . 5.010 4.714 4.312 5.039 0.029 3 0 "[ . 1 . 2]" 1
2049 1 82 LEU HB2 1 82 LEU MD1 . . 3.520 2.624 2.285 3.197 . 0 0 "[ . 1 . 2]" 1
2050 1 82 LEU HB2 1 82 LEU MD2 . . 3.520 2.848 2.155 3.201 . 0 0 "[ . 1 . 2]" 1
2051 1 82 LEU HB2 1 83 SER H . . 4.820 3.651 2.792 4.188 . 0 0 "[ . 1 . 2]" 1
2052 1 82 LEU HB3 1 82 LEU MD1 . . 3.520 2.416 2.343 2.526 . 0 0 "[ . 1 . 2]" 1
2053 1 82 LEU HB3 1 82 LEU MD2 . . 3.520 2.643 2.327 3.182 . 0 0 "[ . 1 . 2]" 1
2054 1 82 LEU HB3 1 83 SER H . . 4.820 4.248 3.746 4.452 . 0 0 "[ . 1 . 2]" 1
2055 1 82 LEU QD 1 83 SER H . . 5.080 4.103 3.621 4.388 . 0 0 "[ . 1 . 2]" 1
2056 1 82 LEU QD 1 84 GLY H . . 5.440 4.739 4.237 5.222 . 0 0 "[ . 1 . 2]" 1
2057 1 82 LEU QD 1 85 GLY H . . 5.170 4.240 3.928 4.752 . 0 0 "[ . 1 . 2]" 1
2058 1 82 LEU QD 1 86 ILE HA . . 3.500 2.410 2.107 2.833 . 0 0 "[ . 1 . 2]" 1
2059 1 82 LEU QD 1 86 ILE MG . . 5.120 3.872 3.674 4.273 . 0 0 "[ . 1 . 2]" 1
2060 1 82 LEU QD 1 89 PHE H . . 5.220 4.592 4.166 5.157 . 0 0 "[ . 1 . 2]" 1
2061 1 82 LEU QD 1 89 PHE HA . . 5.440 4.290 3.977 4.747 . 0 0 "[ . 1 . 2]" 1
2062 1 82 LEU QD 1 89 PHE QB . . 3.590 2.564 2.238 2.954 . 0 0 "[ . 1 . 2]" 1
2063 1 82 LEU QD 1 89 PHE QD . . 3.240 2.273 1.744 2.728 . 0 0 "[ . 1 . 2]" 1
2064 1 82 LEU QD 1 89 PHE QE . . 4.200 2.704 1.695 3.415 . 0 0 "[ . 1 . 2]" 1
2065 1 82 LEU MD1 1 89 PHE QE . . 5.260 3.575 2.881 4.227 . 0 0 "[ . 1 . 2]" 1
2066 1 82 LEU MD2 1 89 PHE QE . . 5.260 2.874 1.704 3.785 . 0 0 "[ . 1 . 2]" 1
2067 1 82 LEU HG 1 89 PHE QD . . 3.890 3.417 2.532 4.081 0.191 19 0 "[ . 1 . 2]" 1
2068 1 82 LEU HG 1 89 PHE QE . . 3.630 3.318 2.703 4.049 0.419 19 0 "[ . 1 . 2]" 1
2069 1 83 SER H 1 83 SER QB . . 3.010 2.507 2.283 2.896 . 0 0 "[ . 1 . 2]" 1
2070 1 83 SER H 1 84 GLY H . . 3.390 2.601 2.217 3.451 0.061 15 0 "[ . 1 . 2]" 1
2071 1 83 SER HA 1 83 SER QB . . 2.760 2.303 2.170 2.415 . 0 0 "[ . 1 . 2]" 1
2072 1 83 SER QB 1 84 GLY H . . 4.040 3.267 2.514 4.029 . 0 0 "[ . 1 . 2]" 1
2073 1 84 GLY H 1 85 GLY H . . 3.140 2.341 1.677 2.910 . 0 0 "[ . 1 . 2]" 1
2074 1 84 GLY H 1 85 GLY QA . . 5.310 4.163 3.588 4.416 . 0 0 "[ . 1 . 2]" 1
2075 1 85 GLY H 1 86 ILE H . . 4.200 4.075 3.377 4.302 0.102 16 0 "[ . 1 . 2]" 1
2076 1 85 GLY H 1 86 ILE HA . . 4.900 4.682 4.378 4.931 0.031 12 0 "[ . 1 . 2]" 1
2077 1 85 GLY H 1 86 ILE MG . . 5.500 5.513 4.803 5.683 0.183 8 0 "[ . 1 . 2]" 1
2078 1 85 GLY QA 1 86 ILE H . . 3.030 2.150 2.084 2.269 . 0 0 "[ . 1 . 2]" 1
2079 1 85 GLY QA 1 86 ILE HA . . 5.100 3.981 3.945 4.057 . 0 0 "[ . 1 . 2]" 1
2080 1 85 GLY QA 1 86 ILE HB . . 4.730 4.179 3.933 4.329 . 0 0 "[ . 1 . 2]" 1
2081 1 85 GLY QA 1 86 ILE MG . . 4.580 3.649 3.509 3.809 . 0 0 "[ . 1 . 2]" 1
2082 1 85 GLY QA 1 87 ASP H . . 4.310 3.118 2.874 3.619 . 0 0 "[ . 1 . 2]" 1
2083 1 85 GLY HA2 1 86 ILE HB . . 5.400 4.370 4.230 4.519 . 0 0 "[ . 1 . 2]" 1
2084 1 85 GLY HA2 1 86 ILE MG . . 5.230 3.881 3.740 4.253 . 0 0 "[ . 1 . 2]" 1
2085 1 85 GLY HA3 1 86 ILE HB . . 5.400 5.335 4.679 5.545 0.145 13 0 "[ . 1 . 2]" 1
2086 1 85 GLY HA3 1 86 ILE MG . . 5.230 4.489 4.047 4.945 . 0 0 "[ . 1 . 2]" 1
2087 1 86 ILE H 1 86 ILE HB . . 3.410 2.678 2.334 3.481 0.071 9 0 "[ . 1 . 2]" 1
2088 1 86 ILE H 1 86 ILE MG . . 3.250 2.083 1.929 2.739 . 0 0 "[ . 1 . 2]" 1
2089 1 86 ILE H 1 87 ASP H . . 3.060 2.262 1.783 2.580 . 0 0 "[ . 1 . 2]" 1
2090 1 86 ILE H 1 87 ASP HA . . 5.500 4.819 4.346 5.175 . 0 0 "[ . 1 . 2]" 1
2091 1 86 ILE H 1 87 ASP HB2 . . 5.500 4.460 3.768 5.516 0.016 14 0 "[ . 1 . 2]" 1
2092 1 86 ILE H 1 87 ASP HB3 . . 5.500 4.682 3.903 5.159 . 0 0 "[ . 1 . 2]" 1
2093 1 86 ILE HA 1 86 ILE MD . . 3.720 3.743 3.722 3.772 0.052 5 0 "[ . 1 . 2]" 1
2094 1 86 ILE HA 1 86 ILE HG12 . . 3.780 3.043 2.866 3.091 . 0 0 "[ . 1 . 2]" 1
2095 1 86 ILE HA 1 86 ILE QG . . 3.090 2.309 2.251 2.340 . 0 0 "[ . 1 . 2]" 1
2096 1 86 ILE HA 1 86 ILE HG13 . . 3.780 2.393 2.351 2.427 . 0 0 "[ . 1 . 2]" 1
2097 1 86 ILE HA 1 89 PHE H . . 4.000 3.495 3.102 3.814 . 0 0 "[ . 1 . 2]" 1
2098 1 86 ILE HA 1 89 PHE HB2 . . 3.980 2.375 1.924 2.815 . 0 0 "[ . 1 . 2]" 1
2099 1 86 ILE HA 1 89 PHE QB . . 3.310 2.315 1.892 2.756 . 0 0 "[ . 1 . 2]" 1
2100 1 86 ILE HA 1 89 PHE HB3 . . 3.980 3.292 2.797 3.927 . 0 0 "[ . 1 . 2]" 1
2101 1 86 ILE HB 1 87 ASP H . . 4.460 4.103 4.002 4.277 . 0 0 "[ . 1 . 2]" 1
2102 1 86 ILE HB 1 89 PHE QB . . 5.330 4.355 3.970 4.670 . 0 0 "[ . 1 . 2]" 1
2103 1 86 ILE MD 1 86 ILE MG . . 3.690 1.958 1.882 2.006 . 0 0 "[ . 1 . 2]" 1
2104 1 86 ILE QG 1 87 ASP H . . 4.830 4.135 3.905 4.317 . 0 0 "[ . 1 . 2]" 1
2105 1 86 ILE QG 1 87 ASP HA . . 5.340 4.091 3.845 4.454 . 0 0 "[ . 1 . 2]" 1
2106 1 86 ILE QG 1 89 PHE H . . 5.260 4.112 3.789 4.336 . 0 0 "[ . 1 . 2]" 1
2107 1 86 ILE QG 1 89 PHE QB . . 3.810 2.735 2.362 2.991 . 0 0 "[ . 1 . 2]" 1
2108 1 86 ILE HG12 1 87 ASP H . . 5.500 4.402 4.104 4.639 . 0 0 "[ . 1 . 2]" 1
2109 1 86 ILE HG12 1 89 PHE HB2 . . 5.150 4.044 3.318 4.766 . 0 0 "[ . 1 . 2]" 1
2110 1 86 ILE HG12 1 89 PHE HB3 . . 5.150 3.465 2.983 3.849 . 0 0 "[ . 1 . 2]" 1
2111 1 86 ILE HG13 1 87 ASP H . . 5.500 5.024 4.893 5.141 . 0 0 "[ . 1 . 2]" 1
2112 1 86 ILE HG13 1 89 PHE HB2 . . 5.150 3.332 2.685 3.943 . 0 0 "[ . 1 . 2]" 1
2113 1 86 ILE HG13 1 89 PHE HB3 . . 5.150 3.300 2.781 3.791 . 0 0 "[ . 1 . 2]" 1
2114 1 86 ILE MG 1 87 ASP H . . 3.410 2.560 2.293 2.943 . 0 0 "[ . 1 . 2]" 1
2115 1 86 ILE MG 1 87 ASP HA . . 4.000 3.167 2.950 3.404 . 0 0 "[ . 1 . 2]" 1
2116 1 86 ILE MG 1 87 ASP HB2 . . 5.250 3.501 3.128 4.576 . 0 0 "[ . 1 . 2]" 1
2117 1 86 ILE MG 1 87 ASP HB3 . . 5.250 4.253 3.095 4.765 . 0 0 "[ . 1 . 2]" 1
2118 1 87 ASP H 1 87 ASP HB2 . . 3.350 2.578 2.191 3.585 0.235 14 0 "[ . 1 . 2]" 1
2119 1 87 ASP H 1 87 ASP QB . . 2.840 2.279 2.123 2.777 . 0 0 "[ . 1 . 2]" 1
2120 1 87 ASP H 1 87 ASP HB3 . . 3.350 2.633 2.405 2.951 . 0 0 "[ . 1 . 2]" 1
2121 1 87 ASP H 1 88 GLY H . . 4.510 2.766 2.382 4.282 . 0 0 "[ . 1 . 2]" 1
2122 1 87 ASP H 1 89 PHE H . . 5.000 4.006 3.750 4.463 . 0 0 "[ . 1 . 2]" 1
2123 1 87 ASP HA 1 89 PHE H . . 3.950 3.682 3.304 3.960 0.010 3 0 "[ . 1 . 2]" 1
2124 1 87 ASP QB 1 88 GLY QA . . 4.900 3.913 3.598 4.314 . 0 0 "[ . 1 . 2]" 1
2125 1 88 GLY H 1 89 PHE H . . 3.860 2.444 2.012 2.754 . 0 0 "[ . 1 . 2]" 1
2126 1 88 GLY QA 1 93 ASN QD . . 5.180 4.371 3.837 4.930 . 0 0 "[ . 1 . 2]" 1
2127 1 89 PHE H 1 89 PHE HB2 . . 3.350 2.601 2.502 2.741 . 0 0 "[ . 1 . 2]" 1
2128 1 89 PHE H 1 89 PHE HB3 . . 3.350 2.521 2.416 2.589 . 0 0 "[ . 1 . 2]" 1
2129 1 89 PHE H 1 89 PHE QD . . 4.230 4.205 4.166 4.231 0.001 17 0 "[ . 1 . 2]" 1
2130 1 89 PHE H 1 90 GLY H . . 4.370 4.435 4.327 4.530 0.160 4 0 "[ . 1 . 2]" 1
2131 1 89 PHE H 1 93 ASN QD . . 5.070 4.574 3.987 5.127 0.057 8 0 "[ . 1 . 2]" 1
2132 1 89 PHE HA 1 90 GLY H . . 2.880 2.128 2.093 2.188 . 0 0 "[ . 1 . 2]" 1
2133 1 89 PHE HA 1 90 GLY QA . . 5.150 3.904 3.882 3.935 . 0 0 "[ . 1 . 2]" 1
2134 1 89 PHE HA 1 93 ASN QD . . 3.370 2.535 2.030 3.386 0.016 2 0 "[ . 1 . 2]" 1
2135 1 89 PHE QB 1 90 GLY H . . 3.800 3.792 3.560 3.882 0.082 5 0 "[ . 1 . 2]" 1
2136 1 89 PHE QB 1 93 ASN QD . . 5.060 3.760 3.071 4.594 . 0 0 "[ . 1 . 2]" 1
2137 1 89 PHE HB2 1 90 GLY H . . 4.380 4.306 4.068 4.415 0.035 5 0 "[ . 1 . 2]" 1
2138 1 89 PHE HB3 1 90 GLY H . . 4.380 4.213 3.933 4.336 . 0 0 "[ . 1 . 2]" 1
2139 1 89 PHE QD 1 90 GLY H . . 4.140 3.640 3.090 3.950 . 0 0 "[ . 1 . 2]" 1
2140 1 89 PHE QD 1 93 ASN QD . . 4.100 3.347 2.550 4.157 0.057 17 0 "[ . 1 . 2]" 1
2141 1 89 PHE QD 1 94 ALA MB . . 4.050 3.581 3.329 3.953 . 0 0 "[ . 1 . 2]" 1
2142 1 89 PHE QE 1 90 GLY QA . . 5.340 4.134 3.609 4.634 . 0 0 "[ . 1 . 2]" 1
2143 1 89 PHE QE 1 93 ASN QD . . 5.340 4.785 4.170 5.368 0.028 19 0 "[ . 1 . 2]" 1
2144 1 89 PHE QE 1 94 ALA MB . . 3.000 2.863 2.561 3.074 0.074 13 0 "[ . 1 . 2]" 1
2145 1 90 GLY H 1 91 SER HA . . 5.080 4.946 4.853 5.018 . 0 0 "[ . 1 . 2]" 1
2146 1 90 GLY H 1 92 ASN H . . 4.120 3.599 3.296 3.866 . 0 0 "[ . 1 . 2]" 1
2147 1 90 GLY H 1 92 ASN QB . . 5.210 4.132 3.791 4.425 . 0 0 "[ . 1 . 2]" 1
2148 1 90 GLY H 1 93 ASN H . . 3.950 3.226 2.929 3.580 . 0 0 "[ . 1 . 2]" 1
2149 1 90 GLY H 1 93 ASN QD . . 4.200 3.573 3.222 4.203 0.003 2 0 "[ . 1 . 2]" 1
2150 1 90 GLY H 1 94 ALA H . . 3.860 3.184 2.831 3.661 . 0 0 "[ . 1 . 2]" 1
2151 1 90 GLY H 1 94 ALA MB . . 4.290 3.341 2.890 4.073 . 0 0 "[ . 1 . 2]" 1
2152 1 90 GLY QA 1 94 ALA H . . 5.340 4.265 3.938 4.558 . 0 0 "[ . 1 . 2]" 1
2153 1 90 GLY QA 1 94 ALA MB . . 4.780 3.850 3.468 4.345 . 0 0 "[ . 1 . 2]" 1
2154 1 90 GLY HA2 1 94 ALA MB . . 5.500 4.005 3.564 4.551 . 0 0 "[ . 1 . 2]" 1
2155 1 90 GLY HA3 1 94 ALA MB . . 5.500 5.004 4.736 5.501 0.001 2 0 "[ . 1 . 2]" 1
2156 1 91 SER H 1 91 SER QB . . 3.660 2.576 2.199 2.766 . 0 0 "[ . 1 . 2]" 1
2157 1 91 SER H 1 95 VAL QG . . 5.440 4.348 4.091 4.669 . 0 0 "[ . 1 . 2]" 1
2158 1 91 SER HA 1 92 ASN QB . . 5.270 5.201 4.999 5.328 0.058 16 0 "[ . 1 . 2]" 1
2159 1 91 SER HA 1 93 ASN H . . 4.220 3.832 3.440 4.226 0.006 4 0 "[ . 1 . 2]" 1
2160 1 91 SER HA 1 94 ALA H . . 3.950 3.686 3.385 4.059 0.109 19 0 "[ . 1 . 2]" 1
2161 1 91 SER HA 1 95 VAL HB . . 5.410 4.893 4.548 5.269 . 0 0 "[ . 1 . 2]" 1
2162 1 91 SER HA 1 95 VAL QG . . 3.070 2.057 1.794 2.412 . 0 0 "[ . 1 . 2]" 1
2163 1 91 SER QB 1 92 ASN HA . . 5.350 4.298 4.086 4.525 . 0 0 "[ . 1 . 2]" 1
2164 1 91 SER QB 1 95 VAL QG . . 3.850 2.670 2.198 3.369 . 0 0 "[ . 1 . 2]" 1
2165 1 92 ASN H 1 92 ASN QB . . 3.110 2.389 2.239 2.588 . 0 0 "[ . 1 . 2]" 1
2166 1 92 ASN H 1 92 ASN QD . . 5.060 4.000 2.310 4.563 . 0 0 "[ . 1 . 2]" 1
2167 1 92 ASN H 1 93 ASN H . . 3.210 2.353 2.170 2.479 . 0 0 "[ . 1 . 2]" 1
2168 1 92 ASN H 1 93 ASN HA . . 5.040 5.026 4.867 5.129 0.089 17 0 "[ . 1 . 2]" 1
2169 1 92 ASN H 1 94 ALA H . . 4.090 3.700 3.229 4.104 0.014 17 0 "[ . 1 . 2]" 1
2170 1 92 ASN H 1 95 VAL QG . . 5.440 4.193 3.799 4.496 . 0 0 "[ . 1 . 2]" 1
2171 1 92 ASN HA 1 92 ASN QB . . 2.690 2.370 2.315 2.422 . 0 0 "[ . 1 . 2]" 1
2172 1 92 ASN QB 1 92 ASN HD22 . . 3.700 3.249 3.204 3.302 . 0 0 "[ . 1 . 2]" 1
2173 1 92 ASN QB 1 93 ASN H . . 3.280 2.837 2.544 3.306 0.026 1 0 "[ . 1 . 2]" 1
2174 1 92 ASN QB 1 93 ASN QD . . 5.340 4.608 3.503 5.152 . 0 0 "[ . 1 . 2]" 1
2175 1 92 ASN QB 1 94 ALA H . . 4.820 4.546 4.309 4.833 0.013 2 0 "[ . 1 . 2]" 1
2176 1 92 ASN QB 1 95 VAL QG . . 5.440 5.108 4.856 5.374 . 0 0 "[ . 1 . 2]" 1
2177 1 93 ASN H 1 93 ASN QD . . 5.340 4.217 3.749 4.577 . 0 0 "[ . 1 . 2]" 1
2178 1 93 ASN H 1 94 ALA H . . 2.690 1.964 1.772 2.283 . 0 0 "[ . 1 . 2]" 1
2179 1 93 ASN H 1 94 ALA MB . . 4.260 3.949 3.787 4.265 0.005 2 0 "[ . 1 . 2]" 1
2180 1 93 ASN H 1 95 VAL QG . . 5.440 3.892 3.432 4.248 . 0 0 "[ . 1 . 2]" 1
2181 1 93 ASN QB 1 93 ASN QD . . 2.960 2.128 2.098 2.158 . 0 0 "[ . 1 . 2]" 1
2182 1 93 ASN QB 1 94 ALA H . . 4.100 3.272 2.110 3.810 . 0 0 "[ . 1 . 2]" 1
2183 1 93 ASN HB2 1 93 ASN HD22 . . 3.960 3.505 3.449 3.768 . 0 0 "[ . 1 . 2]" 1
2184 1 93 ASN HB2 1 94 ALA H . . 4.830 3.567 2.130 4.266 . 0 0 "[ . 1 . 2]" 1
2185 1 93 ASN HB2 1 94 ALA MB . . 5.500 4.075 3.197 4.449 . 0 0 "[ . 1 . 2]" 1
2186 1 93 ASN HB3 1 93 ASN HD22 . . 3.960 3.721 3.467 3.771 . 0 0 "[ . 1 . 2]" 1
2187 1 93 ASN HB3 1 94 ALA H . . 4.830 3.963 3.275 4.289 . 0 0 "[ . 1 . 2]" 1
2188 1 93 ASN HB3 1 94 ALA MB . . 5.500 4.800 3.529 5.207 . 0 0 "[ . 1 . 2]" 1
2189 1 93 ASN QD 1 94 ALA H . . 5.340 4.265 3.905 4.884 . 0 0 "[ . 1 . 2]" 1
2190 1 94 ALA H 1 94 ALA MB . . 3.140 2.438 2.271 2.598 . 0 0 "[ . 1 . 2]" 1
2191 1 94 ALA H 1 95 VAL QG . . 5.210 3.486 3.155 3.821 . 0 0 "[ . 1 . 2]" 1
2192 1 94 ALA HA 1 95 VAL H . . 2.730 2.174 2.116 2.226 . 0 0 "[ . 1 . 2]" 1
2193 1 94 ALA HA 1 95 VAL MG1 . . 5.290 4.309 4.201 4.612 . 0 0 "[ . 1 . 2]" 1
2194 1 94 ALA HA 1 95 VAL QG . . 4.240 3.488 3.362 3.583 . 0 0 "[ . 1 . 2]" 1
2195 1 94 ALA HA 1 95 VAL MG2 . . 5.290 3.687 3.506 3.807 . 0 0 "[ . 1 . 2]" 1
2196 1 95 VAL H 1 95 VAL HB . . 4.140 3.793 3.697 3.840 . 0 0 "[ . 1 . 2]" 1
2197 1 95 VAL H 1 95 VAL MG1 . . 3.510 3.320 3.233 3.488 . 0 0 "[ . 1 . 2]" 1
2198 1 95 VAL H 1 95 VAL QG . . 2.840 2.194 2.113 2.270 . 0 0 "[ . 1 . 2]" 1
2199 1 95 VAL H 1 95 VAL MG2 . . 3.510 2.227 2.139 2.310 . 0 0 "[ . 1 . 2]" 1
2200 1 95 VAL H 1 96 THR H . . 5.500 4.348 4.259 4.390 . 0 0 "[ . 1 . 2]" 1
2201 1 95 VAL H 1 97 THR MG . . 5.390 5.202 4.678 5.482 0.092 15 0 "[ . 1 . 2]" 1
2202 1 95 VAL HA 1 95 VAL QG . . 3.150 2.202 2.144 2.237 . 0 0 "[ . 1 . 2]" 1
2203 1 95 VAL HB 1 96 THR H . . 3.390 2.882 2.710 3.159 . 0 0 "[ . 1 . 2]" 1
2204 1 95 VAL HB 1 96 THR MG . . 5.500 5.089 4.876 5.321 . 0 0 "[ . 1 . 2]" 1
2205 1 95 VAL HB 1 97 THR H . . 4.620 4.696 4.629 4.779 0.159 10 0 "[ . 1 . 2]" 1
2206 1 95 VAL HB 1 97 THR HA . . 4.800 4.621 4.375 4.821 0.021 10 0 "[ . 1 . 2]" 1
2207 1 95 VAL HB 1 97 THR MG . . 5.500 4.146 3.783 5.505 0.005 14 0 "[ . 1 . 2]" 1
2208 1 95 VAL QG 1 96 THR H . . 3.770 3.298 3.192 3.418 . 0 0 "[ . 1 . 2]" 1
2209 1 95 VAL QG 1 97 THR H . . 5.440 4.064 3.720 4.662 . 0 0 "[ . 1 . 2]" 1
2210 1 95 VAL QG 1 97 THR MG . . 4.140 3.014 2.540 4.010 . 0 0 "[ . 1 . 2]" 1
2211 1 95 VAL MG1 1 96 THR H . . 4.300 3.523 3.369 3.670 . 0 0 "[ . 1 . 2]" 1
2212 1 95 VAL MG2 1 96 THR H . . 4.300 3.982 3.867 4.205 . 0 0 "[ . 1 . 2]" 1
2213 1 96 THR H 1 96 THR MG . . 4.030 2.784 2.658 2.934 . 0 0 "[ . 1 . 2]" 1
2214 1 96 THR H 1 97 THR H . . 4.390 4.317 4.234 4.424 0.034 6 0 "[ . 1 . 2]" 1
2215 1 96 THR H 1 98 CYS H . . 5.500 4.823 4.327 5.241 . 0 0 "[ . 1 . 2]" 1
2216 1 96 THR HA 1 96 THR MG . . 3.630 2.257 2.200 2.347 . 0 0 "[ . 1 . 2]" 1
2217 1 96 THR HA 1 97 THR H . . 3.150 2.131 2.073 2.165 . 0 0 "[ . 1 . 2]" 1
2218 1 96 THR HB 1 97 THR H . . 4.630 3.598 3.283 3.809 . 0 0 "[ . 1 . 2]" 1
2219 1 96 THR HB 1 98 CYS H . . 3.580 2.850 2.425 3.489 . 0 0 "[ . 1 . 2]" 1
2220 1 96 THR HB 1 98 CYS QB . . 5.200 3.075 2.404 3.869 . 0 0 "[ . 1 . 2]" 1
2221 1 96 THR MG 1 97 THR H . . 4.100 3.898 3.705 3.999 . 0 0 "[ . 1 . 2]" 1
2222 1 96 THR MG 1 97 THR MG . . 5.500 5.347 4.740 5.517 0.017 18 0 "[ . 1 . 2]" 1
2223 1 96 THR MG 1 98 CYS H . . 4.870 4.377 3.976 4.902 0.032 3 0 "[ . 1 . 2]" 1
2224 1 96 THR MG 1 98 CYS HB2 . . 5.500 4.460 3.754 5.418 . 0 0 "[ . 1 . 2]" 1
2225 1 96 THR MG 1 98 CYS HB3 . . 5.500 5.327 4.352 5.561 0.061 17 0 "[ . 1 . 2]" 1
2226 1 97 THR H 1 97 THR MG . . 3.600 2.528 1.834 2.767 . 0 0 "[ . 1 . 2]" 1
2227 1 97 THR H 1 98 CYS H . . 3.680 3.299 2.837 3.787 0.107 3 0 "[ . 1 . 2]" 1
2228 1 97 THR MG 1 98 CYS H . . 4.650 4.318 3.719 4.417 . 0 0 "[ . 1 . 2]" 1
2229 1 98 CYS H 1 98 CYS HB2 . . 3.860 2.510 2.301 2.668 . 0 0 "[ . 1 . 2]" 1
2230 1 98 CYS H 1 98 CYS QB . . 3.320 2.459 2.275 2.615 . 0 0 "[ . 1 . 2]" 1
2231 1 98 CYS H 1 98 CYS HB3 . . 3.860 3.591 2.690 3.758 . 0 0 "[ . 1 . 2]" 1
2232 1 98 CYS H 1 99 GLY H . . 5.090 3.501 2.054 4.598 . 0 0 "[ . 1 . 2]" 1
2233 1 98 CYS QB 1 99 GLY H . . 4.440 3.297 1.976 3.895 . 0 0 "[ . 1 . 2]" 1
2234 1 98 CYS QB 1 99 GLY QA . . 5.170 3.892 3.487 4.203 . 0 0 "[ . 1 . 2]" 1
2235 1 99 GLY H 1 100 ASN H . . 5.500 3.202 2.077 4.398 . 0 0 "[ . 1 . 2]" 1
2236 1 99 GLY H 1 100 ASN HA . . 4.630 4.561 3.887 4.777 0.147 7 0 "[ . 1 . 2]" 1
2237 1 99 GLY QA 1 100 ASN HA . . 4.120 4.012 3.903 4.136 0.016 16 0 "[ . 1 . 2]" 1
2238 1 99 GLY QA 1 100 ASN QB . . 5.030 4.110 3.592 4.574 . 0 0 "[ . 1 . 2]" 1
2239 1 99 GLY HA2 1 100 ASN HA . . 4.710 4.502 4.314 4.672 . 0 0 "[ . 1 . 2]" 1
2240 1 99 GLY HA3 1 100 ASN HA . . 4.710 4.514 4.345 4.722 0.012 12 0 "[ . 1 . 2]" 1
2241 1 100 ASN HA 1 100 ASN QD . . 4.220 3.544 1.778 4.281 0.061 18 0 "[ . 1 . 2]" 1
2242 1 101 GLY H 1 102 SER H . . 5.240 3.113 1.903 4.566 . 0 0 "[ . 1 . 2]" 1
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