NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
393612 |
1qnk   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1qnk
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 1832
_Distance_constraint_stats_list.Viol_count 4310
_Distance_constraint_stats_list.Viol_total 4416.609
_Distance_constraint_stats_list.Viol_max 0.256
_Distance_constraint_stats_list.Viol_rms 0.0221
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.0512
_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 1 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 GLU 0.832 0.156 12 0 "[ . 1 . 2]"
1 3 LEU 4.140 0.193 19 0 "[ . 1 . 2]"
1 4 ARG 3.800 0.134 17 0 "[ . 1 . 2]"
1 5 CYS 5.157 0.168 17 0 "[ . 1 . 2]"
1 6 GLN 0.751 0.060 12 0 "[ . 1 . 2]"
1 7 CYS 4.040 0.131 15 0 "[ . 1 . 2]"
1 8 LEU 1.907 0.104 9 0 "[ . 1 . 2]"
1 9 GLN 1.735 0.114 11 0 "[ . 1 . 2]"
1 10 THR 3.404 0.130 18 0 "[ . 1 . 2]"
1 11 LEU 1.203 0.115 15 0 "[ . 1 . 2]"
1 12 GLN 3.206 0.115 15 0 "[ . 1 . 2]"
1 13 GLY 0.903 0.115 9 0 "[ . 1 . 2]"
1 14 ILE 2.406 0.117 15 0 "[ . 1 . 2]"
1 15 HIS 1.973 0.135 13 0 "[ . 1 . 2]"
1 16 LEU 1.944 0.100 11 0 "[ . 1 . 2]"
1 17 LYS 1.467 0.135 13 0 "[ . 1 . 2]"
1 18 ASN 0.322 0.087 19 0 "[ . 1 . 2]"
1 19 ILE 0.708 0.088 11 0 "[ . 1 . 2]"
1 20 GLN 5.032 0.110 11 0 "[ . 1 . 2]"
1 21 SER 2.425 0.067 17 0 "[ . 1 . 2]"
1 22 VAL 1.522 0.098 2 0 "[ . 1 . 2]"
1 23 LYS 3.734 0.209 4 0 "[ . 1 . 2]"
1 24 VAL 3.372 0.155 17 0 "[ . 1 . 2]"
1 25 LYS 1.059 0.087 9 0 "[ . 1 . 2]"
1 26 SER 1.737 0.103 10 0 "[ . 1 . 2]"
1 27 PRO 1.264 0.091 20 0 "[ . 1 . 2]"
1 28 GLY 0.608 0.072 14 0 "[ . 1 . 2]"
1 29 PRO 3.097 0.142 14 0 "[ . 1 . 2]"
1 30 HIS 8.079 0.193 19 0 "[ . 1 . 2]"
1 31 CYS 0.935 0.070 2 0 "[ . 1 . 2]"
1 32 ALA 2.321 0.091 20 0 "[ . 1 . 2]"
1 33 GLN 1.819 0.069 20 0 "[ . 1 . 2]"
1 34 THR 1.731 0.103 10 0 "[ . 1 . 2]"
1 35 GLU 1.418 0.121 12 0 "[ . 1 . 2]"
1 36 VAL 0.688 0.085 20 0 "[ . 1 . 2]"
1 37 ILE 0.746 0.084 16 0 "[ . 1 . 2]"
1 38 ALA 1.544 0.095 15 0 "[ . 1 . 2]"
1 39 THR 0.877 0.047 11 0 "[ . 1 . 2]"
1 40 LEU 2.275 0.088 11 0 "[ . 1 . 2]"
1 41 LYS 3.956 0.178 2 0 "[ . 1 . 2]"
1 42 ASN 6.508 0.168 3 0 "[ . 1 . 2]"
1 43 GLY 6.805 0.186 12 0 "[ . 1 . 2]"
1 44 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 LYS 2.633 0.112 12 0 "[ . 1 . 2]"
1 46 ALA 2.509 0.112 12 0 "[ . 1 . 2]"
1 47 CYS 4.031 0.131 15 0 "[ . 1 . 2]"
1 48 LEU 1.127 0.121 17 0 "[ . 1 . 2]"
1 49 ASN 1.186 0.121 17 0 "[ . 1 . 2]"
1 50 PRO 0.638 0.091 14 0 "[ . 1 . 2]"
1 51 ALA 0.642 0.091 14 0 "[ . 1 . 2]"
1 52 SER 0.333 0.048 4 0 "[ . 1 . 2]"
1 53 PRO 1.120 0.103 7 0 "[ . 1 . 2]"
1 54 MET 2.233 0.103 7 0 "[ . 1 . 2]"
1 55 VAL 6.833 0.176 20 0 "[ . 1 . 2]"
1 56 LYS 1.647 0.153 4 0 "[ . 1 . 2]"
1 57 LYS 4.449 0.110 10 0 "[ . 1 . 2]"
1 58 ILE 7.942 0.129 4 0 "[ . 1 . 2]"
1 59 ILE 7.440 0.175 11 0 "[ . 1 . 2]"
1 60 GLU 2.348 0.065 10 0 "[ . 1 . 2]"
1 61 LYS 3.184 0.129 4 0 "[ . 1 . 2]"
1 62 MET 5.352 0.161 17 0 "[ . 1 . 2]"
1 63 LEU 1.496 0.095 18 0 "[ . 1 . 2]"
1 64 LYS 3.767 0.079 18 0 "[ . 1 . 2]"
1 65 ASN 3.001 0.100 19 0 "[ . 1 . 2]"
1 66 GLY 3.183 0.100 19 0 "[ . 1 . 2]"
1 67 LYS 0.178 0.043 19 0 "[ . 1 . 2]"
1 68 SER 0.009 0.009 9 0 "[ . 1 . 2]"
1 69 ASN 0.068 0.026 16 0 "[ . 1 . 2]"
2 1 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 2 GLU 0.408 0.129 14 0 "[ . 1 . 2]"
2 3 LEU 2.454 0.184 6 0 "[ . 1 . 2]"
2 4 ARG 3.389 0.135 1 0 "[ . 1 . 2]"
2 5 CYS 5.151 0.179 18 0 "[ . 1 . 2]"
2 6 GLN 0.749 0.061 18 0 "[ . 1 . 2]"
2 7 CYS 4.698 0.121 7 0 "[ . 1 . 2]"
2 8 LEU 1.914 0.105 6 0 "[ . 1 . 2]"
2 9 GLN 1.508 0.083 1 0 "[ . 1 . 2]"
2 10 THR 3.208 0.148 1 0 "[ . 1 . 2]"
2 11 LEU 1.212 0.122 1 0 "[ . 1 . 2]"
2 12 GLN 3.365 0.122 1 0 "[ . 1 . 2]"
2 13 GLY 0.862 0.136 5 0 "[ . 1 . 2]"
2 14 ILE 2.245 0.136 5 0 "[ . 1 . 2]"
2 15 HIS 2.115 0.227 7 0 "[ . 1 . 2]"
2 16 LEU 1.895 0.155 15 0 "[ . 1 . 2]"
2 17 LYS 1.663 0.227 7 0 "[ . 1 . 2]"
2 18 ASN 0.417 0.084 19 0 "[ . 1 . 2]"
2 19 ILE 0.544 0.065 15 0 "[ . 1 . 2]"
2 20 GLN 4.982 0.106 17 0 "[ . 1 . 2]"
2 21 SER 2.382 0.067 17 0 "[ . 1 . 2]"
2 22 VAL 1.572 0.109 19 0 "[ . 1 . 2]"
2 23 LYS 4.479 0.256 13 0 "[ . 1 . 2]"
2 24 VAL 3.401 0.152 20 0 "[ . 1 . 2]"
2 25 LYS 1.434 0.146 8 0 "[ . 1 . 2]"
2 26 SER 1.654 0.095 19 0 "[ . 1 . 2]"
2 27 PRO 1.162 0.179 20 0 "[ . 1 . 2]"
2 28 GLY 0.660 0.071 4 0 "[ . 1 . 2]"
2 29 PRO 3.147 0.131 6 0 "[ . 1 . 2]"
2 30 HIS 7.185 0.184 6 0 "[ . 1 . 2]"
2 31 CYS 0.826 0.098 18 0 "[ . 1 . 2]"
2 32 ALA 2.149 0.089 8 0 "[ . 1 . 2]"
2 33 GLN 1.739 0.103 17 0 "[ . 1 . 2]"
2 34 THR 1.587 0.179 20 0 "[ . 1 . 2]"
2 35 GLU 1.235 0.117 15 0 "[ . 1 . 2]"
2 36 VAL 0.854 0.056 19 0 "[ . 1 . 2]"
2 37 ILE 0.719 0.070 8 0 "[ . 1 . 2]"
2 38 ALA 1.117 0.078 15 0 "[ . 1 . 2]"
2 39 THR 0.882 0.050 18 0 "[ . 1 . 2]"
2 40 LEU 1.980 0.072 14 0 "[ . 1 . 2]"
2 41 LYS 3.972 0.177 5 0 "[ . 1 . 2]"
2 42 ASN 6.593 0.174 18 0 "[ . 1 . 2]"
2 43 GLY 6.835 0.186 3 0 "[ . 1 . 2]"
2 44 GLN 0.001 0.001 10 0 "[ . 1 . 2]"
2 45 LYS 2.652 0.082 12 0 "[ . 1 . 2]"
2 46 ALA 2.268 0.082 12 0 "[ . 1 . 2]"
2 47 CYS 3.819 0.148 1 0 "[ . 1 . 2]"
2 48 LEU 1.045 0.058 14 0 "[ . 1 . 2]"
2 49 ASN 0.868 0.058 14 0 "[ . 1 . 2]"
2 50 PRO 0.311 0.074 7 0 "[ . 1 . 2]"
2 51 ALA 0.295 0.074 7 0 "[ . 1 . 2]"
2 52 SER 0.134 0.028 7 0 "[ . 1 . 2]"
2 53 PRO 0.862 0.105 10 0 "[ . 1 . 2]"
2 54 MET 1.903 0.105 10 0 "[ . 1 . 2]"
2 55 VAL 6.843 0.179 16 0 "[ . 1 . 2]"
2 56 LYS 1.994 0.159 11 0 "[ . 1 . 2]"
2 57 LYS 4.610 0.118 16 0 "[ . 1 . 2]"
2 58 ILE 7.508 0.155 15 0 "[ . 1 . 2]"
2 59 ILE 7.643 0.180 19 0 "[ . 1 . 2]"
2 60 GLU 2.779 0.070 19 0 "[ . 1 . 2]"
2 61 LYS 3.262 0.118 15 0 "[ . 1 . 2]"
2 62 MET 5.438 0.137 15 0 "[ . 1 . 2]"
2 63 LEU 1.613 0.098 9 0 "[ . 1 . 2]"
2 64 LYS 3.799 0.089 1 0 "[ . 1 . 2]"
2 65 ASN 2.952 0.106 13 0 "[ . 1 . 2]"
2 66 GLY 3.247 0.106 13 0 "[ . 1 . 2]"
2 67 LYS 0.062 0.024 11 0 "[ . 1 . 2]"
2 68 SER 0.040 0.034 8 0 "[ . 1 . 2]"
2 69 ASN 0.032 0.023 3 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 1 THR MG 1 3 LEU H . . 6.530 4.865 3.488 5.555 . 0 0 "[ . 1 . 2]" 1
2 1 2 GLU H 1 2 GLU HB2 . . 2.770 2.750 2.554 2.777 0.007 7 0 "[ . 1 . 2]" 1
3 1 2 GLU H 1 2 GLU HB3 . . 2.770 2.759 2.702 2.776 0.006 15 0 "[ . 1 . 2]" 1
4 1 2 GLU H 1 3 LEU H . . 3.830 3.802 3.561 3.855 0.025 15 0 "[ . 1 . 2]" 1
5 1 2 GLU HA 1 3 LEU H . . 2.960 2.353 2.321 2.484 . 0 0 "[ . 1 . 2]" 1
6 1 2 GLU HA 1 3 LEU HG . . 5.500 5.213 4.769 5.656 0.156 12 0 "[ . 1 . 2]" 1
7 1 2 GLU QG 1 3 LEU HA . . 5.540 4.448 4.310 4.566 . 0 0 "[ . 1 . 2]" 1
8 1 3 LEU H 1 3 LEU HA . . 2.930 2.931 2.929 2.936 0.006 7 0 "[ . 1 . 2]" 1
9 1 3 LEU H 1 3 LEU QB . . 3.880 2.627 2.401 3.041 . 0 0 "[ . 1 . 2]" 1
10 1 3 LEU H 1 3 LEU MD1 . . 4.200 2.151 1.886 2.405 . 0 0 "[ . 1 . 2]" 1
11 1 3 LEU H 1 3 LEU MD2 . . 5.160 3.574 1.848 4.318 . 0 0 "[ . 1 . 2]" 1
12 1 3 LEU H 1 3 LEU HG . . 4.200 3.498 3.276 3.607 . 0 0 "[ . 1 . 2]" 1
13 1 3 LEU H 1 4 ARG H . . 4.510 4.520 4.479 4.545 0.035 4 0 "[ . 1 . 2]" 1
14 1 3 LEU HA 1 3 LEU MD2 . . 4.200 3.497 3.450 3.538 . 0 0 "[ . 1 . 2]" 1
15 1 3 LEU HA 1 4 ARG H . . 2.560 2.522 2.447 2.630 0.070 18 0 "[ . 1 . 2]" 1
16 1 3 LEU HA 1 30 HIS HB2 . . 4.600 4.305 4.064 4.793 0.193 19 0 "[ . 1 . 2]" 1
17 1 3 LEU HA 1 30 HIS HB3 . . 4.910 4.685 4.430 5.034 0.124 9 0 "[ . 1 . 2]" 1
18 1 3 LEU HA 1 30 HIS HD2 . . 5.500 5.105 4.816 5.553 0.053 9 0 "[ . 1 . 2]" 1
19 1 3 LEU HB2 1 4 ARG H . . 3.610 3.225 2.243 3.669 0.059 16 0 "[ . 1 . 2]" 1
20 1 3 LEU HB3 1 4 ARG H . . 3.610 2.686 2.368 3.259 . 0 0 "[ . 1 . 2]" 1
21 1 3 LEU MD1 1 4 ARG H . . 6.220 4.771 4.596 4.888 . 0 0 "[ . 1 . 2]" 1
22 1 3 LEU MD1 1 30 HIS HB2 . . 6.530 4.210 3.666 4.853 . 0 0 "[ . 1 . 2]" 1
23 1 3 LEU MD1 1 30 HIS HD2 . . 6.160 4.889 4.503 5.243 . 0 0 "[ . 1 . 2]" 1
24 1 3 LEU MD1 1 30 HIS HE1 . . 6.530 5.065 4.645 5.429 . 0 0 "[ . 1 . 2]" 1
25 1 3 LEU MD2 1 4 ARG H . . 5.290 3.874 3.593 4.086 . 0 0 "[ . 1 . 2]" 1
26 1 3 LEU MD2 1 30 HIS HD2 . . 5.190 3.498 2.742 3.944 . 0 0 "[ . 1 . 2]" 1
27 1 3 LEU MD2 1 30 HIS HE1 . . 6.090 4.072 3.123 4.702 . 0 0 "[ . 1 . 2]" 1
28 1 3 LEU HG 1 30 HIS HD2 . . 5.500 5.221 4.412 5.558 0.058 7 0 "[ . 1 . 2]" 1
29 1 4 ARG H 1 4 ARG HB2 . . 3.270 2.895 2.855 2.942 . 0 0 "[ . 1 . 2]" 1
30 1 4 ARG H 1 4 ARG HB3 . . 4.170 3.863 3.848 3.873 . 0 0 "[ . 1 . 2]" 1
31 1 4 ARG H 1 4 ARG QG . . 4.180 2.706 2.583 2.928 . 0 0 "[ . 1 . 2]" 1
32 1 4 ARG H 1 5 CYS H . . 3.920 4.037 4.008 4.054 0.134 17 0 "[ . 1 . 2]" 1
33 1 4 ARG H 1 30 HIS HB2 . . 4.630 3.816 3.526 4.209 . 0 0 "[ . 1 . 2]" 1
34 1 4 ARG H 1 30 HIS HB3 . . 5.500 5.001 4.750 5.258 . 0 0 "[ . 1 . 2]" 1
35 1 4 ARG HA 1 4 ARG HB3 . . 3.020 2.417 2.395 2.437 . 0 0 "[ . 1 . 2]" 1
36 1 4 ARG HA 1 5 CYS H . . 3.420 3.140 3.127 3.162 . 0 0 "[ . 1 . 2]" 1
37 1 4 ARG HA 1 30 HIS HB2 . . 4.760 2.775 2.096 3.050 . 0 0 "[ . 1 . 2]" 1
38 1 4 ARG HA 1 30 HIS HB3 . . 4.660 4.432 3.701 4.749 0.089 7 0 "[ . 1 . 2]" 1
39 1 4 ARG HB2 1 4 ARG HE . . 5.500 4.448 3.662 4.894 . 0 0 "[ . 1 . 2]" 1
40 1 4 ARG HB2 1 5 CYS H . . 2.960 2.076 2.022 2.160 . 0 0 "[ . 1 . 2]" 1
41 1 4 ARG HB3 1 5 CYS H . . 3.140 1.969 1.906 2.033 . 0 0 "[ . 1 . 2]" 1
42 1 4 ARG QD 1 5 CYS H . . 6.380 3.774 3.670 3.919 . 0 0 "[ . 1 . 2]" 1
43 1 4 ARG QG 1 5 CYS H . . 5.110 3.836 3.781 3.854 . 0 0 "[ . 1 . 2]" 1
44 1 5 CYS CB 1 31 CYS SG . . 3.100 3.086 3.000 3.139 0.039 11 0 "[ . 1 . 2]" 1
45 1 5 CYS H 1 5 CYS HB2 . . 3.020 2.380 2.271 2.549 . 0 0 "[ . 1 . 2]" 1
46 1 5 CYS H 1 5 CYS HB3 . . 3.480 3.571 3.506 3.648 0.168 17 0 "[ . 1 . 2]" 1
47 1 5 CYS H 1 6 GLN H . . 5.500 4.584 4.540 4.642 . 0 0 "[ . 1 . 2]" 1
48 1 5 CYS H 1 31 CYS QB . . 5.380 3.698 2.951 4.101 . 0 0 "[ . 1 . 2]" 1
49 1 5 CYS HA 1 5 CYS HB3 . . 2.990 2.536 2.425 2.650 . 0 0 "[ . 1 . 2]" 1
50 1 5 CYS HA 1 6 GLN H . . 3.550 2.444 2.306 2.563 . 0 0 "[ . 1 . 2]" 1
51 1 5 CYS HA 1 7 CYS H . . 4.010 3.863 3.657 4.010 . 0 0 "[ . 1 . 2]" 1
52 1 5 CYS HA 1 31 CYS QB . . 6.190 2.631 1.975 3.003 . 0 0 "[ . 1 . 2]" 1
53 1 5 CYS HB2 1 6 GLN H . . 4.420 3.841 3.514 4.152 . 0 0 "[ . 1 . 2]" 1
54 1 5 CYS HB2 1 7 CYS H . . 3.240 3.147 2.817 3.279 0.039 19 0 "[ . 1 . 2]" 1
55 1 5 CYS HB3 1 6 GLN H . . 3.300 2.630 2.340 3.021 . 0 0 "[ . 1 . 2]" 1
56 1 5 CYS HB3 1 7 CYS H . . 3.020 2.265 2.077 2.495 . 0 0 "[ . 1 . 2]" 1
57 1 5 CYS SG 1 31 CYS CB . . 3.100 3.112 2.989 3.170 0.070 2 0 "[ . 1 . 2]" 1
58 1 5 CYS SG 1 31 CYS SG . . 2.100 2.010 1.931 2.109 0.009 8 0 "[ . 1 . 2]" 1
59 1 6 GLN H 1 6 GLN HB2 . . 3.610 2.540 2.202 2.858 . 0 0 "[ . 1 . 2]" 1
60 1 6 GLN H 1 6 GLN QB . . 3.300 2.268 2.134 2.370 . 0 0 "[ . 1 . 2]" 1
61 1 6 GLN H 1 6 GLN HB3 . . 3.610 2.644 2.379 3.095 . 0 0 "[ . 1 . 2]" 1
62 1 6 GLN H 1 6 GLN QG . . 4.580 3.933 3.723 4.026 . 0 0 "[ . 1 . 2]" 1
63 1 6 GLN H 1 7 CYS H . . 2.650 2.384 2.165 2.578 . 0 0 "[ . 1 . 2]" 1
64 1 6 GLN HA 1 6 GLN HE21 . . 5.500 4.736 4.503 5.019 . 0 0 "[ . 1 . 2]" 1
65 1 6 GLN HA 1 7 CYS H . . 3.300 3.331 3.226 3.360 0.060 12 0 "[ . 1 . 2]" 1
66 1 6 GLN QB 1 7 CYS H . . 4.230 3.435 3.381 3.592 . 0 0 "[ . 1 . 2]" 1
67 1 6 GLN HB2 1 6 GLN HE21 . . 4.760 2.847 2.387 3.470 . 0 0 "[ . 1 . 2]" 1
68 1 6 GLN HB2 1 7 CYS H . . 4.450 4.276 3.930 4.438 . 0 0 "[ . 1 . 2]" 1
69 1 6 GLN HB3 1 6 GLN HE21 . . 4.760 2.380 1.944 3.095 . 0 0 "[ . 1 . 2]" 1
70 1 6 GLN HB3 1 7 CYS H . . 4.450 3.628 3.533 3.841 . 0 0 "[ . 1 . 2]" 1
71 1 6 GLN HE21 1 25 LYS QD . . 6.380 4.938 4.360 5.374 . 0 0 "[ . 1 . 2]" 1
72 1 6 GLN HE21 1 25 LYS QG . . 6.380 3.808 3.045 4.434 . 0 0 "[ . 1 . 2]" 1
73 1 6 GLN HE21 1 37 ILE MG . . 6.530 4.803 3.864 5.288 . 0 0 "[ . 1 . 2]" 1
74 1 6 GLN HE22 1 25 LYS QG . . 6.380 4.248 3.144 5.033 . 0 0 "[ . 1 . 2]" 1
75 1 6 GLN HE22 1 37 ILE MG . . 6.530 4.567 3.738 5.249 . 0 0 "[ . 1 . 2]" 1
76 1 6 GLN QG 1 7 CYS H . . 5.380 4.439 4.117 4.707 . 0 0 "[ . 1 . 2]" 1
77 1 7 CYS CB 1 47 CYS SG . . 3.100 3.071 2.988 3.231 0.131 15 0 "[ . 1 . 2]" 1
78 1 7 CYS H 1 7 CYS HB2 . . 2.740 2.745 2.474 2.842 0.102 12 0 "[ . 1 . 2]" 1
79 1 7 CYS H 1 7 CYS HB3 . . 3.420 3.371 3.304 3.450 0.030 1 0 "[ . 1 . 2]" 1
80 1 7 CYS H 1 8 LEU H . . 4.420 4.206 4.095 4.278 . 0 0 "[ . 1 . 2]" 1
81 1 7 CYS HA 1 7 CYS HB3 . . 2.830 2.868 2.772 2.909 0.079 16 0 "[ . 1 . 2]" 1
82 1 7 CYS HA 1 8 LEU H . . 2.740 2.245 2.220 2.280 . 0 0 "[ . 1 . 2]" 1
83 1 7 CYS HA 1 9 GLN H . . 3.580 3.546 3.414 3.623 0.043 11 0 "[ . 1 . 2]" 1
84 1 7 CYS HB2 1 8 LEU H . . 4.720 4.525 4.435 4.619 . 0 0 "[ . 1 . 2]" 1
85 1 7 CYS HB2 1 10 THR MG . . 5.570 4.026 3.655 4.244 . 0 0 "[ . 1 . 2]" 1
86 1 7 CYS HB3 1 8 LEU H . . 3.890 3.678 3.471 3.818 . 0 0 "[ . 1 . 2]" 1
87 1 7 CYS HB3 1 10 THR MG . . 4.640 2.925 2.573 3.136 . 0 0 "[ . 1 . 2]" 1
88 1 7 CYS SG 1 47 CYS CB . . 3.100 3.113 2.983 3.162 0.062 16 0 "[ . 1 . 2]" 1
89 1 7 CYS SG 1 47 CYS SG . . 2.100 1.938 1.867 1.978 . 0 0 "[ . 1 . 2]" 1
90 1 8 LEU H 1 8 LEU HA . . 2.830 2.915 2.885 2.934 0.104 9 0 "[ . 1 . 2]" 1
91 1 8 LEU H 1 8 LEU QB . . 3.650 2.589 2.516 2.633 . 0 0 "[ . 1 . 2]" 1
92 1 8 LEU H 1 8 LEU MD1 . . 5.500 3.321 3.213 3.405 . 0 0 "[ . 1 . 2]" 1
93 1 8 LEU H 1 8 LEU MD2 . . 5.810 3.647 3.494 3.742 . 0 0 "[ . 1 . 2]" 1
94 1 8 LEU H 1 8 LEU HG . . 3.020 2.254 2.152 2.422 . 0 0 "[ . 1 . 2]" 1
95 1 8 LEU H 1 9 GLN H . . 2.650 2.135 1.972 2.286 . 0 0 "[ . 1 . 2]" 1
96 1 8 LEU HA 1 8 LEU MD2 . . 3.740 2.472 2.283 2.660 . 0 0 "[ . 1 . 2]" 1
97 1 8 LEU HA 1 8 LEU HG . . 3.050 3.046 2.987 3.068 0.018 10 0 "[ . 1 . 2]" 1
98 1 8 LEU HA 1 9 GLN H . . 3.480 3.462 3.428 3.519 0.039 15 0 "[ . 1 . 2]" 1
99 1 8 LEU QB 1 9 GLN H . . 3.800 3.209 3.029 3.303 . 0 0 "[ . 1 . 2]" 1
100 1 8 LEU HG 1 9 GLN H . . 4.230 4.220 4.172 4.239 0.009 9 0 "[ . 1 . 2]" 1
101 1 9 GLN H 1 9 GLN HB2 . . 3.360 2.846 2.710 3.081 . 0 0 "[ . 1 . 2]" 1
102 1 9 GLN H 1 9 GLN HB3 . . 3.050 3.025 2.847 3.107 0.057 12 0 "[ . 1 . 2]" 1
103 1 9 GLN H 1 9 GLN QG . . 4.700 4.169 4.088 4.297 . 0 0 "[ . 1 . 2]" 1
104 1 9 GLN H 1 10 THR H . . 4.690 4.441 4.407 4.454 . 0 0 "[ . 1 . 2]" 1
105 1 9 GLN H 1 10 THR MG . . 5.660 3.808 3.727 3.877 . 0 0 "[ . 1 . 2]" 1
106 1 9 GLN HA 1 9 GLN HB2 . . 3.020 2.690 2.557 2.756 . 0 0 "[ . 1 . 2]" 1
107 1 9 GLN HA 1 10 THR H . . 3.420 2.584 2.533 2.670 . 0 0 "[ . 1 . 2]" 1
108 1 9 GLN HA 1 10 THR MG . . 6.400 3.523 3.316 3.673 . 0 0 "[ . 1 . 2]" 1
109 1 9 GLN HB2 1 10 THR H . . 3.890 3.945 3.842 4.004 0.114 11 0 "[ . 1 . 2]" 1
110 1 9 GLN HB3 1 10 THR H . . 3.390 3.042 2.866 3.424 0.034 2 0 "[ . 1 . 2]" 1
111 1 9 GLN QG 1 10 THR H . . 5.420 1.984 1.851 2.286 . 0 0 "[ . 1 . 2]" 1
112 1 10 THR H 1 10 THR MG . . 4.200 3.332 3.211 3.414 . 0 0 "[ . 1 . 2]" 1
113 1 10 THR HA 1 10 THR HB . . 2.650 2.624 2.574 2.666 0.016 17 0 "[ . 1 . 2]" 1
114 1 10 THR HA 1 11 LEU H . . 2.520 2.443 2.385 2.459 . 0 0 "[ . 1 . 2]" 1
115 1 10 THR HA 1 47 CYS H . . 4.230 4.111 3.867 4.249 0.019 11 0 "[ . 1 . 2]" 1
116 1 10 THR HA 1 47 CYS HA . . 4.230 4.320 4.134 4.360 0.130 18 0 "[ . 1 . 2]" 1
117 1 10 THR HA 1 47 CYS HB2 . . 4.320 2.828 2.557 2.931 . 0 0 "[ . 1 . 2]" 1
118 1 10 THR HA 1 47 CYS HB3 . . 3.980 2.044 1.970 2.394 . 0 0 "[ . 1 . 2]" 1
119 1 10 THR HB 1 11 LEU H . . 2.680 2.581 2.537 2.713 0.033 15 0 "[ . 1 . 2]" 1
120 1 10 THR HB 1 47 CYS HB3 . . 4.200 3.723 3.426 4.099 . 0 0 "[ . 1 . 2]" 1
121 1 10 THR HB 1 48 LEU HA . . 3.580 3.343 3.152 3.612 0.032 4 0 "[ . 1 . 2]" 1
122 1 10 THR HB 1 49 ASN H . . 3.950 3.278 3.029 3.470 . 0 0 "[ . 1 . 2]" 1
123 1 10 THR HB 1 49 ASN HB2 . . 3.670 2.900 2.672 3.136 . 0 0 "[ . 1 . 2]" 1
124 1 10 THR HB 1 49 ASN HB3 . . 4.420 4.283 4.004 4.435 0.015 5 0 "[ . 1 . 2]" 1
125 1 10 THR MG 1 11 LEU H . . 4.640 3.616 3.493 3.731 . 0 0 "[ . 1 . 2]" 1
126 1 10 THR MG 1 47 CYS H . . 6.160 4.942 4.900 5.007 . 0 0 "[ . 1 . 2]" 1
127 1 10 THR MG 1 47 CYS HA . . 6.530 4.012 3.843 4.215 . 0 0 "[ . 1 . 2]" 1
128 1 10 THR MG 1 47 CYS HB2 . . 4.510 3.445 3.238 3.518 . 0 0 "[ . 1 . 2]" 1
129 1 10 THR MG 1 47 CYS HB3 . . 4.390 1.943 1.908 1.978 . 0 0 "[ . 1 . 2]" 1
130 1 10 THR MG 1 48 LEU H . . 5.750 3.467 3.191 3.696 . 0 0 "[ . 1 . 2]" 1
131 1 10 THR MG 1 48 LEU HA . . 5.230 4.128 3.938 4.299 . 0 0 "[ . 1 . 2]" 1
132 1 10 THR MG 1 49 ASN H . . 5.720 4.427 4.222 4.627 . 0 0 "[ . 1 . 2]" 1
133 1 10 THR MG 1 49 ASN HB2 . . 6.310 4.236 3.992 4.537 . 0 0 "[ . 1 . 2]" 1
134 1 10 THR MG 1 50 PRO HD3 . . 6.530 2.672 2.239 3.276 . 0 0 "[ . 1 . 2]" 1
135 1 11 LEU H 1 11 LEU QB . . 3.710 2.440 2.277 2.630 . 0 0 "[ . 1 . 2]" 1
136 1 11 LEU H 1 11 LEU HG . . 2.900 2.870 2.711 2.970 0.070 15 0 "[ . 1 . 2]" 1
137 1 11 LEU H 1 12 GLN H . . 4.450 4.490 4.406 4.534 0.084 16 0 "[ . 1 . 2]" 1
138 1 11 LEU H 1 46 ALA MB . . 6.530 5.112 4.995 5.311 . 0 0 "[ . 1 . 2]" 1
139 1 11 LEU H 1 47 CYS H . . 5.500 4.730 4.537 5.127 . 0 0 "[ . 1 . 2]" 1
140 1 11 LEU H 1 47 CYS HB3 . . 5.500 3.686 3.506 4.259 . 0 0 "[ . 1 . 2]" 1
141 1 11 LEU H 1 48 LEU H . . 4.760 3.930 3.824 4.269 . 0 0 "[ . 1 . 2]" 1
142 1 11 LEU H 1 48 LEU HA . . 2.900 1.990 1.941 2.091 . 0 0 "[ . 1 . 2]" 1
143 1 11 LEU H 1 48 LEU MD1 . . 6.500 5.468 5.411 5.542 . 0 0 "[ . 1 . 2]" 1
144 1 11 LEU H 1 48 LEU MD2 . . 4.920 3.468 3.333 3.618 . 0 0 "[ . 1 . 2]" 1
145 1 11 LEU H 1 49 ASN H . . 4.070 3.447 3.218 3.776 . 0 0 "[ . 1 . 2]" 1
146 1 11 LEU HA 1 12 GLN H . . 3.080 2.526 2.223 2.682 . 0 0 "[ . 1 . 2]" 1
147 1 11 LEU QB 1 12 GLN H . . 4.080 2.374 2.057 3.080 . 0 0 "[ . 1 . 2]" 1
148 1 11 LEU QD 1 12 GLN H . . 6.860 3.322 2.946 3.886 . 0 0 "[ . 1 . 2]" 1
149 1 11 LEU QD 1 14 ILE H . . 7.630 3.990 3.589 5.152 . 0 0 "[ . 1 . 2]" 1
150 1 11 LEU QD 1 47 CYS H . . 7.230 2.744 2.262 4.108 . 0 0 "[ . 1 . 2]" 1
151 1 11 LEU HG 1 12 GLN H . . 4.880 4.716 4.521 4.995 0.115 15 0 "[ . 1 . 2]" 1
152 1 11 LEU HG 1 47 CYS H . . 5.500 3.853 3.597 4.160 . 0 0 "[ . 1 . 2]" 1
153 1 12 GLN H 1 12 GLN HB2 . . 3.210 3.048 2.763 3.222 0.012 15 0 "[ . 1 . 2]" 1
154 1 12 GLN H 1 12 GLN HB3 . . 2.770 2.312 2.210 2.439 . 0 0 "[ . 1 . 2]" 1
155 1 12 GLN H 1 12 GLN QG . . 4.490 3.877 3.787 4.095 . 0 0 "[ . 1 . 2]" 1
156 1 12 GLN H 1 13 GLY H . . 3.610 2.404 1.902 3.625 0.015 4 0 "[ . 1 . 2]" 1
157 1 12 GLN H 1 48 LEU MD2 . . 6.530 4.468 4.035 5.208 . 0 0 "[ . 1 . 2]" 1
158 1 12 GLN HA 1 12 GLN HB2 . . 2.870 2.362 2.343 2.386 . 0 0 "[ . 1 . 2]" 1
159 1 12 GLN HA 1 12 GLN HB3 . . 2.930 3.024 3.014 3.034 0.104 2 0 "[ . 1 . 2]" 1
160 1 12 GLN HA 1 12 GLN HE22 . . 5.500 5.042 4.357 5.501 0.001 10 0 "[ . 1 . 2]" 1
161 1 12 GLN HA 1 13 GLY H . . 3.420 3.286 2.466 3.447 0.027 2 0 "[ . 1 . 2]" 1
162 1 12 GLN HA 1 48 LEU MD2 . . 6.530 4.707 4.345 5.091 . 0 0 "[ . 1 . 2]" 1
163 1 12 GLN HA 1 49 ASN H . . 3.790 3.733 3.496 3.837 0.047 5 0 "[ . 1 . 2]" 1
164 1 12 GLN HA 1 49 ASN HB2 . . 5.500 3.334 2.490 3.840 . 0 0 "[ . 1 . 2]" 1
165 1 12 GLN HA 1 49 ASN HB3 . . 5.500 3.356 2.850 3.684 . 0 0 "[ . 1 . 2]" 1
166 1 12 GLN HA 1 52 SER QB . . 6.040 3.334 3.003 3.875 . 0 0 "[ . 1 . 2]" 1
167 1 13 GLY H 1 14 ILE H . . 3.270 3.076 2.205 3.330 0.060 15 0 "[ . 1 . 2]" 1
168 1 13 GLY H 1 48 LEU MD2 . . 5.440 3.093 2.547 3.503 . 0 0 "[ . 1 . 2]" 1
169 1 13 GLY QA 1 14 ILE H . . 3.230 2.330 2.213 2.865 . 0 0 "[ . 1 . 2]" 1
170 1 13 GLY QA 1 48 LEU MD2 . . 5.820 2.544 1.763 4.179 . 0 0 "[ . 1 . 2]" 1
171 1 13 GLY QA 1 58 ILE MG . . 6.630 3.875 3.246 4.541 . 0 0 "[ . 1 . 2]" 1
172 1 13 GLY HA2 1 14 ILE H . . 3.480 3.421 2.970 3.527 0.047 12 0 "[ . 1 . 2]" 1
173 1 13 GLY HA3 1 14 ILE H . . 3.480 2.462 2.239 3.595 0.115 9 0 "[ . 1 . 2]" 1
174 1 14 ILE H 1 14 ILE HB . . 3.360 2.420 2.142 3.373 0.013 9 0 "[ . 1 . 2]" 1
175 1 14 ILE H 1 14 ILE MD . . 5.230 3.774 2.208 4.319 . 0 0 "[ . 1 . 2]" 1
176 1 14 ILE H 1 14 ILE HG12 . . 4.420 3.499 2.815 4.359 . 0 0 "[ . 1 . 2]" 1
177 1 14 ILE H 1 14 ILE QG . . 3.840 3.017 2.631 3.401 . 0 0 "[ . 1 . 2]" 1
178 1 14 ILE H 1 14 ILE HG13 . . 4.420 3.734 2.676 4.374 . 0 0 "[ . 1 . 2]" 1
179 1 14 ILE H 1 14 ILE MG . . 4.730 3.638 3.507 4.053 . 0 0 "[ . 1 . 2]" 1
180 1 14 ILE H 1 15 HIS H . . 4.690 4.555 4.449 4.614 . 0 0 "[ . 1 . 2]" 1
181 1 14 ILE H 1 54 MET QG . . 6.380 5.340 4.072 5.691 . 0 0 "[ . 1 . 2]" 1
182 1 14 ILE H 1 58 ILE MD . . 4.820 2.812 1.860 3.759 . 0 0 "[ . 1 . 2]" 1
183 1 14 ILE HA 1 14 ILE HB . . 2.900 2.985 2.970 3.017 0.117 15 0 "[ . 1 . 2]" 1
184 1 14 ILE HA 1 14 ILE QG . . 3.910 2.464 2.038 2.847 . 0 0 "[ . 1 . 2]" 1
185 1 14 ILE HA 1 15 HIS H . . 2.740 2.429 2.363 2.477 . 0 0 "[ . 1 . 2]" 1
186 1 14 ILE HB 1 15 HIS H . . 4.140 3.966 3.788 4.093 . 0 0 "[ . 1 . 2]" 1
187 1 14 ILE QG 1 15 HIS H . . 4.710 3.937 3.380 4.247 . 0 0 "[ . 1 . 2]" 1
188 1 14 ILE HG12 1 15 HIS H . . 4.910 4.318 3.496 4.856 . 0 0 "[ . 1 . 2]" 1
189 1 14 ILE HG13 1 15 HIS H . . 4.910 4.649 3.852 4.905 . 0 0 "[ . 1 . 2]" 1
190 1 14 ILE MG 1 15 HIS H . . 4.510 1.910 1.826 2.088 . 0 0 "[ . 1 . 2]" 1
191 1 15 HIS H 1 15 HIS HB2 . . 3.300 2.045 2.023 2.099 . 0 0 "[ . 1 . 2]" 1
192 1 15 HIS H 1 15 HIS HB3 . . 2.990 3.012 2.949 3.052 0.062 10 0 "[ . 1 . 2]" 1
193 1 15 HIS H 1 15 HIS HD2 . . 5.500 4.842 4.164 5.270 . 0 0 "[ . 1 . 2]" 1
194 1 15 HIS HA 1 15 HIS HB2 . . 2.830 2.731 2.697 2.748 . 0 0 "[ . 1 . 2]" 1
195 1 15 HIS HA 1 15 HIS HD2 . . 3.360 2.597 2.019 3.394 0.034 11 0 "[ . 1 . 2]" 1
196 1 15 HIS HA 1 16 LEU H . . 2.930 2.257 2.225 2.332 . 0 0 "[ . 1 . 2]" 1
197 1 15 HIS HB2 1 17 LYS H . . 3.980 4.048 3.960 4.115 0.135 13 0 "[ . 1 . 2]" 1
198 1 15 HIS HB2 1 17 LYS QG . . 6.070 4.949 3.273 5.486 . 0 0 "[ . 1 . 2]" 1
199 1 15 HIS HB2 1 18 ASN H . . 5.500 4.784 4.428 5.174 . 0 0 "[ . 1 . 2]" 1
200 1 15 HIS HB2 1 18 ASN HD21 . . 5.500 4.063 3.778 4.359 . 0 0 "[ . 1 . 2]" 1
201 1 15 HIS HB2 1 18 ASN HD22 . . 5.500 5.400 5.063 5.514 0.014 11 0 "[ . 1 . 2]" 1
202 1 15 HIS HB3 1 15 HIS HD2 . . 3.920 3.479 3.049 3.921 0.001 11 0 "[ . 1 . 2]" 1
203 1 15 HIS HB3 1 17 LYS H . . 4.760 2.474 2.283 2.576 . 0 0 "[ . 1 . 2]" 1
204 1 16 LEU H 1 16 LEU HA . . 2.830 2.885 2.851 2.904 0.074 11 0 "[ . 1 . 2]" 1
205 1 16 LEU H 1 16 LEU HB2 . . 3.730 2.664 2.431 2.992 . 0 0 "[ . 1 . 2]" 1
206 1 16 LEU H 1 16 LEU HB3 . . 3.020 2.395 2.158 2.649 . 0 0 "[ . 1 . 2]" 1
207 1 16 LEU H 1 16 LEU HG . . 5.500 4.362 4.038 4.597 . 0 0 "[ . 1 . 2]" 1
208 1 16 LEU H 1 19 ILE MD . . 6.530 4.386 4.024 4.749 . 0 0 "[ . 1 . 2]" 1
209 1 16 LEU HA 1 16 LEU HB2 . . 2.680 2.435 2.287 2.580 . 0 0 "[ . 1 . 2]" 1
210 1 16 LEU HA 1 16 LEU MD1 . . 4.140 2.368 1.950 3.183 . 0 0 "[ . 1 . 2]" 1
211 1 16 LEU HA 1 16 LEU MD2 . . 4.570 3.481 1.871 3.939 . 0 0 "[ . 1 . 2]" 1
212 1 16 LEU HA 1 16 LEU HG . . 3.640 3.277 2.726 3.618 . 0 0 "[ . 1 . 2]" 1
213 1 16 LEU HA 1 19 ILE MD . . 4.050 2.520 1.985 2.992 . 0 0 "[ . 1 . 2]" 1
214 1 16 LEU HA 1 19 ILE MG . . 4.360 3.602 3.550 3.661 . 0 0 "[ . 1 . 2]" 1
215 1 16 LEU HA 1 58 ILE MG . . 4.260 2.968 2.677 3.226 . 0 0 "[ . 1 . 2]" 1
216 1 16 LEU HB2 1 58 ILE HA . . 4.010 3.364 3.177 3.569 . 0 0 "[ . 1 . 2]" 1
217 1 16 LEU HB3 1 58 ILE HA . . 4.570 4.611 4.553 4.670 0.100 11 0 "[ . 1 . 2]" 1
218 1 16 LEU MD1 1 19 ILE H . . 5.470 3.884 2.928 4.421 . 0 0 "[ . 1 . 2]" 1
219 1 16 LEU MD1 1 58 ILE HA . . 5.320 3.722 2.197 4.458 . 0 0 "[ . 1 . 2]" 1
220 1 16 LEU MD1 1 62 MET HG2 . . 5.690 1.901 1.755 2.761 . 0 0 "[ . 1 . 2]" 1
221 1 16 LEU MD1 1 62 MET QG . . 5.290 1.881 1.717 2.727 . 0 0 "[ . 1 . 2]" 1
222 1 16 LEU MD1 1 62 MET HG3 . . 5.690 3.059 2.332 4.237 . 0 0 "[ . 1 . 2]" 1
223 1 17 LYS H 1 17 LYS QG . . 4.860 2.986 2.078 3.741 . 0 0 "[ . 1 . 2]" 1
224 1 17 LYS H 1 18 ASN H . . 3.890 2.269 2.074 2.551 . 0 0 "[ . 1 . 2]" 1
225 1 17 LYS HA 1 17 LYS QD . . 4.890 2.934 2.141 4.247 . 0 0 "[ . 1 . 2]" 1
226 1 17 LYS HA 1 18 ASN H . . 3.480 3.448 3.349 3.507 0.027 1 0 "[ . 1 . 2]" 1
227 1 17 LYS QB 1 18 ASN H . . 4.210 3.359 3.098 3.875 . 0 0 "[ . 1 . 2]" 1
228 1 17 LYS QD 1 18 ASN H . . 6.250 4.958 3.597 5.588 . 0 0 "[ . 1 . 2]" 1
229 1 17 LYS QG 1 18 ASN H . . 5.850 3.863 2.515 4.640 . 0 0 "[ . 1 . 2]" 1
230 1 18 ASN H 1 18 ASN HB2 . . 2.900 2.211 2.124 2.334 . 0 0 "[ . 1 . 2]" 1
231 1 18 ASN H 1 18 ASN HB3 . . 3.390 3.358 3.235 3.477 0.087 19 0 "[ . 1 . 2]" 1
232 1 18 ASN H 1 18 ASN HD21 . . 5.500 3.770 3.130 4.157 . 0 0 "[ . 1 . 2]" 1
233 1 18 ASN H 1 18 ASN HD22 . . 5.500 4.988 4.510 5.301 . 0 0 "[ . 1 . 2]" 1
234 1 18 ASN H 1 19 ILE H . . 2.430 2.111 1.890 2.229 . 0 0 "[ . 1 . 2]" 1
235 1 18 ASN H 1 19 ILE MD . . 5.190 3.998 3.826 4.198 . 0 0 "[ . 1 . 2]" 1
236 1 18 ASN HA 1 40 LEU MD2 . . 6.530 2.822 2.461 3.064 . 0 0 "[ . 1 . 2]" 1
237 1 18 ASN HA 1 41 LYS H . . 4.070 3.661 3.400 3.823 . 0 0 "[ . 1 . 2]" 1
238 1 18 ASN HB2 1 18 ASN HD21 . . 3.300 2.124 2.102 2.168 . 0 0 "[ . 1 . 2]" 1
239 1 18 ASN HB2 1 40 LEU MD2 . . 4.610 3.271 3.177 3.421 . 0 0 "[ . 1 . 2]" 1
240 1 18 ASN HB2 1 41 LYS H . . 5.500 5.218 5.078 5.534 0.034 8 0 "[ . 1 . 2]" 1
241 1 18 ASN HB3 1 19 ILE H . . 4.140 3.145 2.775 3.402 . 0 0 "[ . 1 . 2]" 1
242 1 18 ASN HB3 1 40 LEU HA . . 5.500 3.813 3.630 4.082 . 0 0 "[ . 1 . 2]" 1
243 1 18 ASN HB3 1 40 LEU MD2 . . 4.760 1.899 1.843 2.033 . 0 0 "[ . 1 . 2]" 1
244 1 18 ASN HB3 1 41 LYS H . . 4.260 3.774 3.626 4.253 . 0 0 "[ . 1 . 2]" 1
245 1 18 ASN HD21 1 40 LEU MD1 . . 6.530 4.582 3.865 5.037 . 0 0 "[ . 1 . 2]" 1
246 1 18 ASN HD21 1 40 LEU MD2 . . 5.570 3.870 3.569 4.294 . 0 0 "[ . 1 . 2]" 1
247 1 19 ILE H 1 19 ILE HA . . 2.800 2.773 2.688 2.859 0.059 8 0 "[ . 1 . 2]" 1
248 1 19 ILE H 1 19 ILE HB . . 2.740 2.127 2.056 2.266 . 0 0 "[ . 1 . 2]" 1
249 1 19 ILE H 1 19 ILE MD . . 3.710 2.818 2.603 2.989 . 0 0 "[ . 1 . 2]" 1
250 1 19 ILE H 1 19 ILE QG . . 3.710 2.909 2.492 3.212 . 0 0 "[ . 1 . 2]" 1
251 1 19 ILE H 1 19 ILE MG . . 4.230 3.567 3.467 3.664 . 0 0 "[ . 1 . 2]" 1
252 1 19 ILE H 1 20 GLN H . . 4.600 4.596 4.562 4.619 0.019 17 0 "[ . 1 . 2]" 1
253 1 19 ILE H 1 40 LEU HA . . 4.760 4.601 4.440 4.767 0.007 5 0 "[ . 1 . 2]" 1
254 1 19 ILE HA 1 19 ILE MD . . 4.260 3.593 3.470 3.741 . 0 0 "[ . 1 . 2]" 1
255 1 19 ILE HA 1 19 ILE QG . . 3.520 2.096 2.008 2.260 . 0 0 "[ . 1 . 2]" 1
256 1 19 ILE HA 1 20 GLN H . . 2.400 2.204 2.187 2.221 . 0 0 "[ . 1 . 2]" 1
257 1 19 ILE HA 1 40 LEU HA . . 2.460 2.484 2.440 2.548 0.088 11 0 "[ . 1 . 2]" 1
258 1 19 ILE HA 1 40 LEU MD1 . . 6.530 4.988 4.846 5.254 . 0 0 "[ . 1 . 2]" 1
259 1 19 ILE HA 1 40 LEU MD2 . . 4.760 3.745 3.615 3.880 . 0 0 "[ . 1 . 2]" 1
260 1 19 ILE MD 1 58 ILE HA . . 6.190 5.036 4.945 5.140 . 0 0 "[ . 1 . 2]" 1
261 1 19 ILE QG 1 20 GLN H . . 4.760 3.733 3.626 3.931 . 0 0 "[ . 1 . 2]" 1
262 1 19 ILE MG 1 20 GLN H . . 4.080 2.681 2.474 2.931 . 0 0 "[ . 1 . 2]" 1
263 1 19 ILE MG 1 20 GLN HA . . 6.370 3.507 3.451 3.576 . 0 0 "[ . 1 . 2]" 1
264 1 19 ILE MG 1 21 SER H . . 4.700 2.425 2.160 2.604 . 0 0 "[ . 1 . 2]" 1
265 1 19 ILE MG 1 21 SER QB . . 7.400 4.551 4.399 4.644 . 0 0 "[ . 1 . 2]" 1
266 1 20 GLN H 1 20 GLN HB2 . . 2.930 2.549 2.506 2.621 . 0 0 "[ . 1 . 2]" 1
267 1 20 GLN H 1 20 GLN HB3 . . 3.730 2.986 2.860 3.068 . 0 0 "[ . 1 . 2]" 1
268 1 20 GLN H 1 20 GLN QG . . 5.040 4.018 3.954 4.071 . 0 0 "[ . 1 . 2]" 1
269 1 20 GLN H 1 21 SER H . . 2.560 1.890 1.857 2.009 . 0 0 "[ . 1 . 2]" 1
270 1 20 GLN H 1 39 THR H . . 4.290 4.057 3.944 4.131 . 0 0 "[ . 1 . 2]" 1
271 1 20 GLN H 1 39 THR HB . . 5.190 3.967 3.466 4.207 . 0 0 "[ . 1 . 2]" 1
272 1 20 GLN H 1 40 LEU HA . . 2.870 2.907 2.874 2.943 0.073 20 0 "[ . 1 . 2]" 1
273 1 20 GLN H 1 41 LYS H . . 3.860 3.722 3.578 3.961 0.101 11 0 "[ . 1 . 2]" 1
274 1 20 GLN HA 1 20 GLN HB3 . . 2.900 2.986 2.962 3.010 0.110 11 0 "[ . 1 . 2]" 1
275 1 20 GLN HA 1 20 GLN HE21 . . 5.160 3.892 2.996 4.521 . 0 0 "[ . 1 . 2]" 1
276 1 20 GLN HA 1 20 GLN HE22 . . 5.380 4.743 4.374 5.185 . 0 0 "[ . 1 . 2]" 1
277 1 20 GLN HA 1 21 SER H . . 3.450 3.498 3.439 3.517 0.067 17 0 "[ . 1 . 2]" 1
278 1 20 GLN HA 1 41 LYS QG . . 6.380 4.559 3.345 5.404 . 0 0 "[ . 1 . 2]" 1
279 1 20 GLN HA 1 62 MET ME . . 5.630 4.277 3.500 4.588 . 0 0 "[ . 1 . 2]" 1
280 1 20 GLN HA 2 26 SER H . . 5.500 5.560 5.529 5.595 0.095 19 0 "[ . 1 . 2]" 1
281 1 20 GLN HB2 1 40 LEU HA . . 3.670 3.652 3.524 3.744 0.074 11 0 "[ . 1 . 2]" 1
282 1 20 GLN HB3 1 21 SER H . . 3.830 3.267 3.155 3.420 . 0 0 "[ . 1 . 2]" 1
283 1 20 GLN HB3 1 40 LEU HA . . 5.340 4.748 4.664 4.905 . 0 0 "[ . 1 . 2]" 1
284 1 20 GLN HE21 1 39 THR MG . . 6.530 4.220 2.770 5.215 . 0 0 "[ . 1 . 2]" 1
285 1 20 GLN HE22 1 21 SER QB . . 6.380 4.628 3.619 5.386 . 0 0 "[ . 1 . 2]" 1
286 1 20 GLN HE22 1 39 THR MG . . 6.530 5.056 4.054 5.278 . 0 0 "[ . 1 . 2]" 1
287 1 20 GLN HE22 2 26 SER QB . . 6.380 5.362 4.722 5.735 . 0 0 "[ . 1 . 2]" 1
288 1 20 GLN QG 1 21 SER H . . 5.480 4.727 4.578 4.810 . 0 0 "[ . 1 . 2]" 1
289 1 20 GLN QG 1 21 SER HA . . 6.380 5.557 5.143 5.774 . 0 0 "[ . 1 . 2]" 1
290 1 20 GLN QG 1 41 LYS HA . . 4.860 2.393 2.100 2.693 . 0 0 "[ . 1 . 2]" 1
291 1 21 SER H 1 21 SER QB . . 3.800 3.183 3.121 3.362 . 0 0 "[ . 1 . 2]" 1
292 1 21 SER H 1 38 ALA HA . . 4.570 4.541 4.338 4.617 0.047 4 0 "[ . 1 . 2]" 1
293 1 21 SER H 1 38 ALA MB . . 6.000 3.923 3.592 4.225 . 0 0 "[ . 1 . 2]" 1
294 1 21 SER H 1 39 THR H . . 2.870 2.880 2.639 2.914 0.044 18 0 "[ . 1 . 2]" 1
295 1 21 SER H 1 39 THR HB . . 3.420 2.912 2.255 3.227 . 0 0 "[ . 1 . 2]" 1
296 1 21 SER H 1 39 THR MG . . 5.070 3.874 3.482 4.099 . 0 0 "[ . 1 . 2]" 1
297 1 21 SER H 1 40 LEU HA . . 4.660 4.459 4.368 4.593 . 0 0 "[ . 1 . 2]" 1
298 1 21 SER HA 1 22 VAL H . . 2.460 2.483 2.434 2.520 0.060 6 0 "[ . 1 . 2]" 1
299 1 21 SER HA 1 39 THR HB . . 5.500 4.233 3.779 4.711 . 0 0 "[ . 1 . 2]" 1
300 1 21 SER HA 1 62 MET ME . . 3.990 1.939 1.761 2.253 . 0 0 "[ . 1 . 2]" 1
301 1 21 SER HA 2 25 LYS H . . 5.500 5.252 5.118 5.385 . 0 0 "[ . 1 . 2]" 1
302 1 21 SER HA 2 25 LYS HA . . 2.830 2.778 2.557 2.885 0.055 17 0 "[ . 1 . 2]" 1
303 1 21 SER HA 2 26 SER H . . 3.450 2.941 2.611 3.324 . 0 0 "[ . 1 . 2]" 1
304 1 21 SER HA 2 26 SER QB . . 5.630 3.935 3.295 4.740 . 0 0 "[ . 1 . 2]" 1
305 1 21 SER QB 1 22 VAL H . . 3.060 2.634 2.565 2.734 . 0 0 "[ . 1 . 2]" 1
306 1 21 SER QB 1 22 VAL HA . . 5.110 3.983 3.947 4.038 . 0 0 "[ . 1 . 2]" 1
307 1 21 SER QB 2 25 LYS HA . . 3.440 2.023 1.966 2.210 . 0 0 "[ . 1 . 2]" 1
308 1 21 SER QB 2 25 LYS QG . . 7.250 2.601 1.995 3.876 . 0 0 "[ . 1 . 2]" 1
309 1 21 SER QB 2 26 SER H . . 4.490 3.720 3.661 3.768 . 0 0 "[ . 1 . 2]" 1
310 1 21 SER HB2 1 22 VAL H . . 3.450 3.014 2.679 3.173 . 0 0 "[ . 1 . 2]" 1
311 1 21 SER HB2 2 25 LYS HA . . 3.890 3.719 3.415 3.877 . 0 0 "[ . 1 . 2]" 1
312 1 21 SER HB3 1 22 VAL H . . 3.450 2.939 2.776 3.361 . 0 0 "[ . 1 . 2]" 1
313 1 21 SER HB3 2 25 LYS HA . . 3.890 2.032 1.973 2.223 . 0 0 "[ . 1 . 2]" 1
314 1 22 VAL H 1 22 VAL HB . . 3.450 2.556 2.513 2.647 . 0 0 "[ . 1 . 2]" 1
315 1 22 VAL H 1 22 VAL MG1 . . 4.610 3.737 3.699 3.805 . 0 0 "[ . 1 . 2]" 1
316 1 22 VAL H 1 22 VAL MG2 . . 4.540 3.074 2.957 3.130 . 0 0 "[ . 1 . 2]" 1
317 1 22 VAL H 1 23 LYS H . . 4.320 4.370 4.330 4.418 0.098 2 0 "[ . 1 . 2]" 1
318 1 22 VAL H 1 62 MET ME . . 4.110 2.811 2.622 3.245 . 0 0 "[ . 1 . 2]" 1
319 1 22 VAL H 2 23 LYS QD . . 5.350 3.081 2.609 3.505 . 0 0 "[ . 1 . 2]" 1
320 1 22 VAL H 2 24 VAL H . . 3.360 3.006 2.660 3.335 . 0 0 "[ . 1 . 2]" 1
321 1 22 VAL H 2 24 VAL HB . . 4.140 3.278 2.737 3.985 . 0 0 "[ . 1 . 2]" 1
322 1 22 VAL H 2 25 LYS QG . . 6.380 5.107 4.573 5.755 . 0 0 "[ . 1 . 2]" 1
323 1 22 VAL HA 1 23 LYS H . . 2.830 2.236 2.204 2.276 . 0 0 "[ . 1 . 2]" 1
324 1 22 VAL HA 1 38 ALA HA . . 2.870 2.005 1.957 2.254 . 0 0 "[ . 1 . 2]" 1
325 1 22 VAL HA 1 38 ALA MB . . 4.390 2.675 2.254 2.976 . 0 0 "[ . 1 . 2]" 1
326 1 22 VAL HB 2 24 VAL H . . 5.500 3.588 3.099 3.999 . 0 0 "[ . 1 . 2]" 1
327 1 22 VAL MG1 1 23 LYS H . . 3.830 2.500 2.251 2.745 . 0 0 "[ . 1 . 2]" 1
328 1 22 VAL MG1 1 23 LYS HA . . 4.480 3.374 3.254 3.510 . 0 0 "[ . 1 . 2]" 1
329 1 22 VAL MG1 1 38 ALA HA . . 5.230 3.806 3.695 4.022 . 0 0 "[ . 1 . 2]" 1
330 1 22 VAL MG1 1 59 ILE HA . . 5.190 3.362 3.027 3.779 . 0 0 "[ . 1 . 2]" 1
331 1 22 VAL MG2 1 23 LYS H . . 4.670 3.871 3.806 3.913 . 0 0 "[ . 1 . 2]" 1
332 1 22 VAL MG2 1 38 ALA HA . . 4.730 3.445 3.256 3.639 . 0 0 "[ . 1 . 2]" 1
333 1 22 VAL MG2 1 59 ILE HA . . 4.480 2.494 2.284 2.862 . 0 0 "[ . 1 . 2]" 1
334 1 23 LYS H 1 23 LYS HA . . 2.900 2.928 2.904 2.939 0.039 11 0 "[ . 1 . 2]" 1
335 1 23 LYS H 1 23 LYS QD . . 5.040 4.212 4.055 4.288 . 0 0 "[ . 1 . 2]" 1
336 1 23 LYS H 1 24 VAL H . . 4.260 4.257 4.164 4.307 0.047 7 0 "[ . 1 . 2]" 1
337 1 23 LYS H 1 37 ILE H . . 3.270 3.132 2.918 3.306 0.036 11 0 "[ . 1 . 2]" 1
338 1 23 LYS H 1 37 ILE HB . . 5.190 4.086 3.458 4.404 . 0 0 "[ . 1 . 2]" 1
339 1 23 LYS H 1 38 ALA HA . . 3.830 2.692 2.531 2.907 . 0 0 "[ . 1 . 2]" 1
340 1 23 LYS H 1 38 ALA MB . . 4.980 3.691 3.490 3.889 . 0 0 "[ . 1 . 2]" 1
341 1 23 LYS HA 1 23 LYS QD . . 3.430 2.523 1.865 3.086 . 0 0 "[ . 1 . 2]" 1
342 1 23 LYS HA 1 23 LYS HG2 . . 3.520 2.705 2.198 3.729 0.209 4 0 "[ . 1 . 2]" 1
343 1 23 LYS HA 1 23 LYS QG . . 3.340 2.510 2.176 3.105 . 0 0 "[ . 1 . 2]" 1
344 1 23 LYS HA 1 23 LYS HG3 . . 3.520 3.481 3.281 3.622 0.102 12 0 "[ . 1 . 2]" 1
345 1 23 LYS HA 1 24 VAL H . . 2.460 2.185 2.178 2.193 . 0 0 "[ . 1 . 2]" 1
346 1 23 LYS HA 1 24 VAL QG . . 6.040 3.848 3.410 4.291 . 0 0 "[ . 1 . 2]" 1
347 1 23 LYS HA 2 24 VAL H . . 4.140 3.191 2.723 3.586 . 0 0 "[ . 1 . 2]" 1
348 1 23 LYS QB 1 24 VAL H . . 4.140 3.830 3.760 3.904 . 0 0 "[ . 1 . 2]" 1
349 1 23 LYS QB 1 37 ILE H . . 5.260 3.135 2.845 3.567 . 0 0 "[ . 1 . 2]" 1
350 1 23 LYS QD 2 22 VAL H . . 5.350 3.069 2.481 3.659 . 0 0 "[ . 1 . 2]" 1
351 1 23 LYS QD 2 24 VAL H . . 5.880 4.935 3.996 5.351 . 0 0 "[ . 1 . 2]" 1
352 1 23 LYS HD2 1 24 VAL H . . 3.920 2.689 1.907 3.371 . 0 0 "[ . 1 . 2]" 1
353 1 23 LYS HD3 1 24 VAL H . . 3.920 2.718 2.055 3.600 . 0 0 "[ . 1 . 2]" 1
354 1 23 LYS QG 1 24 VAL H . . 4.290 3.352 3.046 3.549 . 0 0 "[ . 1 . 2]" 1
355 1 23 LYS HG2 1 24 VAL H . . 4.600 3.755 3.093 4.655 0.055 4 0 "[ . 1 . 2]" 1
356 1 23 LYS HG3 1 24 VAL H . . 4.600 4.311 3.511 4.657 0.057 12 0 "[ . 1 . 2]" 1
357 1 24 VAL H 1 24 VAL HB . . 2.680 2.430 2.321 2.630 . 0 0 "[ . 1 . 2]" 1
358 1 24 VAL H 1 24 VAL MG1 . . 4.330 3.566 2.655 3.848 . 0 0 "[ . 1 . 2]" 1
359 1 24 VAL H 1 24 VAL QG . . 3.620 2.810 2.603 3.001 . 0 0 "[ . 1 . 2]" 1
360 1 24 VAL H 1 24 VAL MG2 . . 4.330 3.066 2.656 3.745 . 0 0 "[ . 1 . 2]" 1
361 1 24 VAL H 1 25 LYS H . . 4.880 4.286 4.007 4.477 . 0 0 "[ . 1 . 2]" 1
362 1 24 VAL H 2 22 VAL H . . 3.360 2.990 2.681 3.326 . 0 0 "[ . 1 . 2]" 1
363 1 24 VAL H 2 22 VAL HB . . 5.500 3.582 3.143 4.049 . 0 0 "[ . 1 . 2]" 1
364 1 24 VAL H 2 23 LYS HA . . 4.140 3.257 2.752 3.769 . 0 0 "[ . 1 . 2]" 1
365 1 24 VAL H 2 23 LYS QD . . 5.880 4.716 3.761 5.336 . 0 0 "[ . 1 . 2]" 1
366 1 24 VAL HA 1 24 VAL HB . . 2.870 2.974 2.724 3.025 0.155 17 0 "[ . 1 . 2]" 1
367 1 24 VAL HA 1 25 LYS H . . 2.900 2.192 2.182 2.248 . 0 0 "[ . 1 . 2]" 1
368 1 24 VAL HA 1 36 VAL HA . . 2.710 2.364 2.156 2.665 . 0 0 "[ . 1 . 2]" 1
369 1 24 VAL HA 1 37 ILE H . . 3.270 3.235 3.084 3.320 0.050 1 0 "[ . 1 . 2]" 1
370 1 24 VAL HB 1 25 LYS H . . 4.720 4.485 4.319 4.585 . 0 0 "[ . 1 . 2]" 1
371 1 24 VAL HB 2 22 VAL H . . 4.140 3.347 2.914 4.115 . 0 0 "[ . 1 . 2]" 1
372 1 24 VAL QG 1 25 LYS H . . 5.390 2.825 2.575 3.187 . 0 0 "[ . 1 . 2]" 1
373 1 24 VAL QG 1 25 LYS HA . . 8.090 3.590 3.344 3.910 . 0 0 "[ . 1 . 2]" 1
374 1 24 VAL QG 1 37 ILE H . . 6.940 3.776 3.355 4.180 . 0 0 "[ . 1 . 2]" 1
375 1 25 LYS H 1 25 LYS HB2 . . 2.960 2.823 2.458 3.047 0.087 9 0 "[ . 1 . 2]" 1
376 1 25 LYS H 1 25 LYS QB . . 2.730 2.474 2.273 2.558 . 0 0 "[ . 1 . 2]" 1
377 1 25 LYS H 1 25 LYS HB3 . . 2.960 2.756 2.345 2.931 . 0 0 "[ . 1 . 2]" 1
378 1 25 LYS H 1 25 LYS QD . . 5.480 4.260 4.125 4.547 . 0 0 "[ . 1 . 2]" 1
379 1 25 LYS H 1 25 LYS QG . . 4.890 4.141 3.857 4.211 . 0 0 "[ . 1 . 2]" 1
380 1 25 LYS H 1 34 THR MG . . 4.730 3.787 3.445 3.892 . 0 0 "[ . 1 . 2]" 1
381 1 25 LYS H 1 35 GLU H . . 3.670 3.338 2.992 3.582 . 0 0 "[ . 1 . 2]" 1
382 1 25 LYS H 1 35 GLU QG . . 6.380 4.347 2.602 5.704 . 0 0 "[ . 1 . 2]" 1
383 1 25 LYS H 1 36 VAL HA . . 3.110 3.139 3.103 3.195 0.085 20 0 "[ . 1 . 2]" 1
384 1 25 LYS H 1 37 ILE H . . 4.200 4.112 3.669 4.236 0.036 7 0 "[ . 1 . 2]" 1
385 1 25 LYS H 2 21 SER HA . . 5.500 5.264 5.147 5.430 . 0 0 "[ . 1 . 2]" 1
386 1 25 LYS HA 1 26 SER H . . 3.020 2.289 2.215 2.345 . 0 0 "[ . 1 . 2]" 1
387 1 25 LYS HA 2 21 SER HA . . 2.830 2.779 2.597 2.870 0.040 20 0 "[ . 1 . 2]" 1
388 1 25 LYS HA 2 21 SER HB2 . . 3.890 3.705 3.561 3.810 . 0 0 "[ . 1 . 2]" 1
389 1 25 LYS HA 2 21 SER QB . . 3.440 2.001 1.959 2.102 . 0 0 "[ . 1 . 2]" 1
390 1 25 LYS HA 2 21 SER HB3 . . 3.890 2.010 1.966 2.112 . 0 0 "[ . 1 . 2]" 1
391 1 25 LYS HA 2 62 MET ME . . 6.370 3.132 2.717 3.433 . 0 0 "[ . 1 . 2]" 1
392 1 25 LYS QD 1 26 SER H . . 4.180 3.746 3.587 3.834 . 0 0 "[ . 1 . 2]" 1
393 1 25 LYS QD 1 30 HIS HD2 . . 6.380 5.691 5.407 5.762 . 0 0 "[ . 1 . 2]" 1
394 1 25 LYS QG 2 21 SER QB . . 7.250 2.327 1.980 3.851 . 0 0 "[ . 1 . 2]" 1
395 1 25 LYS QG 2 22 VAL H . . 6.380 4.926 4.540 5.755 . 0 0 "[ . 1 . 2]" 1
396 1 26 SER H 1 26 SER QB . . 3.520 2.081 1.997 2.884 . 0 0 "[ . 1 . 2]" 1
397 1 26 SER H 2 20 GLN HA . . 5.500 5.558 5.519 5.598 0.098 17 0 "[ . 1 . 2]" 1
398 1 26 SER H 2 21 SER HA . . 3.450 2.988 2.670 3.291 . 0 0 "[ . 1 . 2]" 1
399 1 26 SER H 2 21 SER QB . . 4.490 3.719 3.673 3.760 . 0 0 "[ . 1 . 2]" 1
400 1 26 SER H 2 62 MET ME . . 4.540 1.889 1.728 2.173 . 0 0 "[ . 1 . 2]" 1
401 1 26 SER H 2 63 LEU MD1 . . 6.250 5.112 5.057 5.160 . 0 0 "[ . 1 . 2]" 1
402 1 26 SER HA 1 27 PRO HD2 . . 3.210 3.043 2.877 3.110 . 0 0 "[ . 1 . 2]" 1
403 1 26 SER HA 1 27 PRO HD3 . . 3.210 2.235 2.107 2.293 . 0 0 "[ . 1 . 2]" 1
404 1 26 SER HA 1 34 THR HA . . 2.930 2.947 2.810 3.033 0.103 10 0 "[ . 1 . 2]" 1
405 1 26 SER HA 1 34 THR MG . . 4.820 2.258 1.966 2.769 . 0 0 "[ . 1 . 2]" 1
406 1 26 SER HA 1 35 GLU H . . 3.860 3.635 3.437 3.839 . 0 0 "[ . 1 . 2]" 1
407 1 26 SER HA 2 62 MET ME . . 5.290 3.493 3.213 3.785 . 0 0 "[ . 1 . 2]" 1
408 1 26 SER QB 1 27 PRO QD . . 4.680 2.015 1.866 2.222 . 0 0 "[ . 1 . 2]" 1
409 1 26 SER QB 1 34 THR MG . . 5.820 3.832 3.276 4.193 . 0 0 "[ . 1 . 2]" 1
410 1 26 SER QB 2 20 GLN HE22 . . 6.380 5.340 4.751 5.724 . 0 0 "[ . 1 . 2]" 1
411 1 26 SER QB 2 21 SER HA . . 5.630 3.910 3.601 5.026 . 0 0 "[ . 1 . 2]" 1
412 1 26 SER QB 2 62 MET ME . . 6.350 1.924 1.811 2.843 . 0 0 "[ . 1 . 2]" 1
413 1 27 PRO HA 1 28 GLY H . . 2.680 2.468 2.331 2.563 . 0 0 "[ . 1 . 2]" 1
414 1 27 PRO HA 1 31 CYS H . . 4.480 4.451 4.336 4.495 0.015 19 0 "[ . 1 . 2]" 1
415 1 27 PRO HB2 1 28 GLY H . . 3.170 2.636 2.410 2.984 . 0 0 "[ . 1 . 2]" 1
416 1 27 PRO HB2 1 32 ALA HA . . 2.590 2.181 2.025 2.294 . 0 0 "[ . 1 . 2]" 1
417 1 27 PRO HB3 1 32 ALA HA . . 3.110 2.809 2.568 3.046 . 0 0 "[ . 1 . 2]" 1
418 1 27 PRO QD 1 28 GLY H . . 5.590 4.955 4.893 5.023 . 0 0 "[ . 1 . 2]" 1
419 1 27 PRO QD 1 34 THR HA . . 4.300 2.846 2.590 2.937 . 0 0 "[ . 1 . 2]" 1
420 1 27 PRO QD 1 34 THR MG . . 5.510 3.001 2.659 3.490 . 0 0 "[ . 1 . 2]" 1
421 1 27 PRO HD2 1 34 THR HA . . 4.540 4.508 4.286 4.606 0.066 9 0 "[ . 1 . 2]" 1
422 1 27 PRO HD3 1 34 THR HA . . 4.540 2.877 2.611 2.972 . 0 0 "[ . 1 . 2]" 1
423 1 27 PRO QG 1 28 GLY H . . 5.510 4.337 4.176 4.566 . 0 0 "[ . 1 . 2]" 1
424 1 27 PRO HG2 1 32 ALA HA . . 4.010 3.935 3.820 4.004 . 0 0 "[ . 1 . 2]" 1
425 1 27 PRO HG3 1 32 ALA HA . . 4.010 4.057 4.018 4.101 0.091 20 0 "[ . 1 . 2]" 1
426 1 28 GLY H 1 29 PRO HD2 . . 5.220 4.473 4.368 4.558 . 0 0 "[ . 1 . 2]" 1
427 1 28 GLY H 1 29 PRO HD3 . . 5.160 4.734 4.701 4.756 . 0 0 "[ . 1 . 2]" 1
428 1 28 GLY H 1 30 HIS H . . 3.480 3.381 3.310 3.475 . 0 0 "[ . 1 . 2]" 1
429 1 28 GLY H 1 30 HIS HE1 . . 5.500 5.207 4.999 5.534 0.034 14 0 "[ . 1 . 2]" 1
430 1 28 GLY H 1 31 CYS H . . 3.730 2.704 2.589 2.839 . 0 0 "[ . 1 . 2]" 1
431 1 28 GLY H 1 31 CYS QB . . 5.350 3.221 2.770 3.398 . 0 0 "[ . 1 . 2]" 1
432 1 28 GLY H 1 32 ALA MB . . 6.530 4.797 4.607 5.042 . 0 0 "[ . 1 . 2]" 1
433 1 28 GLY H 1 33 GLN H . . 4.350 4.180 4.063 4.305 . 0 0 "[ . 1 . 2]" 1
434 1 28 GLY QA 1 29 PRO HD2 . . 2.880 2.234 2.218 2.253 . 0 0 "[ . 1 . 2]" 1
435 1 28 GLY QA 1 29 PRO HD3 . . 2.440 2.239 2.231 2.242 . 0 0 "[ . 1 . 2]" 1
436 1 28 GLY QA 1 30 HIS H . . 4.210 2.953 2.933 2.975 . 0 0 "[ . 1 . 2]" 1
437 1 28 GLY QA 1 30 HIS HE1 . . 5.350 3.011 2.852 3.435 . 0 0 "[ . 1 . 2]" 1
438 1 28 GLY HA2 1 29 PRO HD2 . . 3.360 2.267 2.246 2.290 . 0 0 "[ . 1 . 2]" 1
439 1 28 GLY HA2 1 29 PRO HD3 . . 2.740 2.469 2.421 2.518 . 0 0 "[ . 1 . 2]" 1
440 1 28 GLY HA3 1 29 PRO HD2 . . 3.360 3.388 3.341 3.432 0.072 14 0 "[ . 1 . 2]" 1
441 1 28 GLY HA3 1 29 PRO HD3 . . 2.740 2.566 2.516 2.615 . 0 0 "[ . 1 . 2]" 1
442 1 29 PRO HA 1 30 HIS H . . 3.110 3.235 3.227 3.252 0.142 14 0 "[ . 1 . 2]" 1
443 1 29 PRO HD2 1 30 HIS H . . 4.110 2.735 2.694 2.757 . 0 0 "[ . 1 . 2]" 1
444 1 29 PRO HD2 1 30 HIS HD2 . . 5.500 5.127 4.901 5.192 . 0 0 "[ . 1 . 2]" 1
445 1 29 PRO HD2 1 31 CYS H . . 4.510 4.345 4.209 4.455 . 0 0 "[ . 1 . 2]" 1
446 1 29 PRO HD3 1 30 HIS H . . 4.690 3.841 3.821 3.851 . 0 0 "[ . 1 . 2]" 1
447 1 29 PRO HD3 1 31 CYS H . . 5.500 5.438 5.328 5.512 0.012 13 0 "[ . 1 . 2]" 1
448 1 29 PRO HG2 1 30 HIS H . . 5.500 3.888 3.839 3.913 . 0 0 "[ . 1 . 2]" 1
449 1 29 PRO HG3 1 30 HIS H . . 5.500 4.776 4.742 4.793 . 0 0 "[ . 1 . 2]" 1
450 1 30 HIS H 1 30 HIS HB2 . . 3.420 3.563 3.530 3.602 0.182 17 0 "[ . 1 . 2]" 1
451 1 30 HIS H 1 30 HIS HB3 . . 3.480 3.377 3.355 3.439 . 0 0 "[ . 1 . 2]" 1
452 1 30 HIS H 1 30 HIS HD2 . . 5.470 4.125 4.035 4.229 . 0 0 "[ . 1 . 2]" 1
453 1 30 HIS H 1 31 CYS H . . 3.080 2.132 2.028 2.214 . 0 0 "[ . 1 . 2]" 1
454 1 30 HIS HB2 1 30 HIS HD2 . . 3.330 2.725 2.721 2.730 . 0 0 "[ . 1 . 2]" 1
455 1 30 HIS HB3 1 31 CYS H . . 4.110 4.052 3.972 4.131 0.021 8 0 "[ . 1 . 2]" 1
456 1 31 CYS HA 1 32 ALA H . . 2.900 2.226 2.220 2.235 . 0 0 "[ . 1 . 2]" 1
457 1 31 CYS HA 1 33 GLN H . . 3.610 3.584 3.501 3.633 0.023 9 0 "[ . 1 . 2]" 1
458 1 31 CYS QB 1 33 GLN H . . 5.380 2.934 2.417 3.500 . 0 0 "[ . 1 . 2]" 1
459 1 32 ALA H 1 32 ALA HA . . 2.900 2.915 2.905 2.927 0.027 14 0 "[ . 1 . 2]" 1
460 1 32 ALA H 1 32 ALA MB . . 3.430 2.187 2.074 2.288 . 0 0 "[ . 1 . 2]" 1
461 1 32 ALA H 1 33 GLN H . . 2.990 2.750 2.679 2.795 . 0 0 "[ . 1 . 2]" 1
462 1 32 ALA HA 1 33 GLN H . . 2.990 3.044 3.037 3.050 0.060 10 0 "[ . 1 . 2]" 1
463 1 32 ALA MB 1 33 GLN H . . 4.170 3.647 3.638 3.654 . 0 0 "[ . 1 . 2]" 1
464 1 32 ALA MB 1 33 GLN HE22 . . 6.530 4.092 2.516 5.149 . 0 0 "[ . 1 . 2]" 1
465 1 33 GLN H 1 33 GLN HB2 . . 2.930 2.865 2.762 2.977 0.047 11 0 "[ . 1 . 2]" 1
466 1 33 GLN H 1 33 GLN HB3 . . 4.110 3.848 3.805 3.901 . 0 0 "[ . 1 . 2]" 1
467 1 33 GLN H 1 33 GLN QG . . 3.900 2.811 2.322 3.237 . 0 0 "[ . 1 . 2]" 1
468 1 33 GLN HB2 1 34 THR H . . 3.550 3.573 3.533 3.619 0.069 20 0 "[ . 1 . 2]" 1
469 1 33 GLN HB3 1 34 THR H . . 3.580 2.697 2.536 2.984 . 0 0 "[ . 1 . 2]" 1
470 1 34 THR H 1 34 THR HB . . 3.110 2.524 2.436 2.659 . 0 0 "[ . 1 . 2]" 1
471 1 34 THR HA 1 35 GLU H . . 2.770 2.417 2.346 2.540 . 0 0 "[ . 1 . 2]" 1
472 1 34 THR HB 1 35 GLU H . . 3.610 3.616 3.395 3.678 0.068 12 0 "[ . 1 . 2]" 1
473 1 34 THR MG 1 35 GLU H . . 3.740 2.091 1.891 2.324 . 0 0 "[ . 1 . 2]" 1
474 1 34 THR MG 1 35 GLU HA . . 6.530 3.862 3.656 4.190 . 0 0 "[ . 1 . 2]" 1
475 1 34 THR MG 1 36 VAL HA . . 6.530 4.091 3.844 4.509 . 0 0 "[ . 1 . 2]" 1
476 1 34 THR MG 1 50 PRO QB . . 7.120 2.457 2.057 2.987 . 0 0 "[ . 1 . 2]" 1
477 1 34 THR MG 1 50 PRO HG2 . . 4.610 3.661 3.318 3.839 . 0 0 "[ . 1 . 2]" 1
478 1 35 GLU H 1 35 GLU HB2 . . 4.040 3.307 2.600 4.065 0.025 5 0 "[ . 1 . 2]" 1
479 1 35 GLU H 1 35 GLU HB3 . . 4.040 3.535 2.934 3.882 . 0 0 "[ . 1 . 2]" 1
480 1 35 GLU HA 1 35 GLU HB2 . . 2.930 2.753 2.352 3.051 0.121 12 0 "[ . 1 . 2]" 1
481 1 35 GLU HA 1 35 GLU QB . . 2.680 2.346 2.175 2.556 . 0 0 "[ . 1 . 2]" 1
482 1 35 GLU HA 1 35 GLU HB3 . . 2.930 2.602 2.288 3.047 0.117 7 0 "[ . 1 . 2]" 1
483 1 35 GLU HA 1 36 VAL H . . 2.930 2.324 2.203 2.451 . 0 0 "[ . 1 . 2]" 1
484 1 35 GLU HA 1 36 VAL MG2 . . 5.940 3.919 3.705 4.157 . 0 0 "[ . 1 . 2]" 1
485 1 35 GLU HA 1 50 PRO HD2 . . 5.500 5.074 4.632 5.519 0.019 4 0 "[ . 1 . 2]" 1
486 1 35 GLU HA 1 50 PRO HD3 . . 5.500 4.009 3.391 4.570 . 0 0 "[ . 1 . 2]" 1
487 1 35 GLU HA 1 50 PRO HG3 . . 5.000 3.307 2.612 3.708 . 0 0 "[ . 1 . 2]" 1
488 1 35 GLU QG 1 36 VAL H . . 6.380 4.229 3.097 4.916 . 0 0 "[ . 1 . 2]" 1
489 1 36 VAL H 1 36 VAL HB . . 2.740 2.404 2.268 2.503 . 0 0 "[ . 1 . 2]" 1
490 1 36 VAL H 1 36 VAL MG1 . . 4.730 3.720 3.672 3.769 . 0 0 "[ . 1 . 2]" 1
491 1 36 VAL H 1 36 VAL MG2 . . 3.800 2.297 1.904 2.689 . 0 0 "[ . 1 . 2]" 1
492 1 36 VAL H 1 37 ILE QG . . 5.910 4.226 3.833 4.752 . 0 0 "[ . 1 . 2]" 1
493 1 36 VAL H 1 48 LEU H . . 4.910 4.062 3.487 4.568 . 0 0 "[ . 1 . 2]" 1
494 1 36 VAL H 1 50 PRO HD3 . . 5.500 3.208 2.846 3.540 . 0 0 "[ . 1 . 2]" 1
495 1 36 VAL HA 1 37 ILE H . . 2.400 2.195 2.182 2.231 . 0 0 "[ . 1 . 2]" 1
496 1 36 VAL HA 1 37 ILE QG . . 6.380 3.646 3.252 4.153 . 0 0 "[ . 1 . 2]" 1
497 1 36 VAL HB 1 37 ILE H . . 4.690 4.301 4.107 4.482 . 0 0 "[ . 1 . 2]" 1
498 1 36 VAL HB 1 48 LEU H . . 3.270 2.964 2.523 3.313 0.043 12 0 "[ . 1 . 2]" 1
499 1 36 VAL HB 1 48 LEU HA . . 5.500 4.687 4.529 4.894 . 0 0 "[ . 1 . 2]" 1
500 1 36 VAL MG2 1 37 ILE H . . 4.950 4.117 4.074 4.168 . 0 0 "[ . 1 . 2]" 1
501 1 36 VAL MG2 1 49 ASN H . . 6.530 5.305 5.213 5.378 . 0 0 "[ . 1 . 2]" 1
502 1 37 ILE H 1 37 ILE HB . . 2.930 2.771 2.644 2.964 0.034 11 0 "[ . 1 . 2]" 1
503 1 37 ILE H 1 37 ILE MD . . 3.890 2.781 2.101 3.184 . 0 0 "[ . 1 . 2]" 1
504 1 37 ILE H 1 37 ILE HG12 . . 4.380 3.892 2.130 4.390 0.010 10 0 "[ . 1 . 2]" 1
505 1 37 ILE H 1 37 ILE QG . . 3.980 2.846 2.117 3.203 . 0 0 "[ . 1 . 2]" 1
506 1 37 ILE H 1 37 ILE HG13 . . 4.380 3.207 2.817 3.988 . 0 0 "[ . 1 . 2]" 1
507 1 37 ILE H 1 37 ILE MG . . 4.790 3.890 3.844 3.917 . 0 0 "[ . 1 . 2]" 1
508 1 37 ILE H 1 38 ALA MB . . 6.530 4.729 4.636 4.824 . 0 0 "[ . 1 . 2]" 1
509 1 37 ILE H 1 48 LEU H . . 4.910 4.766 4.530 4.899 . 0 0 "[ . 1 . 2]" 1
510 1 37 ILE HA 1 37 ILE MD . . 4.570 3.401 1.961 3.831 . 0 0 "[ . 1 . 2]" 1
511 1 37 ILE HA 1 37 ILE HG12 . . 3.920 3.344 3.168 3.651 . 0 0 "[ . 1 . 2]" 1
512 1 37 ILE HA 1 37 ILE QG . . 3.710 2.620 2.422 3.233 . 0 0 "[ . 1 . 2]" 1
513 1 37 ILE HA 1 37 ILE HG13 . . 3.920 2.819 2.475 3.973 0.053 11 0 "[ . 1 . 2]" 1
514 1 37 ILE HA 1 38 ALA H . . 2.900 2.216 2.177 2.428 . 0 0 "[ . 1 . 2]" 1
515 1 37 ILE HA 1 47 CYS HA . . 2.830 2.284 2.118 2.532 . 0 0 "[ . 1 . 2]" 1
516 1 37 ILE HB 1 38 ALA H . . 4.420 4.191 3.364 4.433 0.013 2 0 "[ . 1 . 2]" 1
517 1 37 ILE HG12 1 38 ALA H . . 5.500 5.257 4.685 5.517 0.017 8 0 "[ . 1 . 2]" 1
518 1 37 ILE HG12 1 47 CYS HA . . 5.500 4.553 3.987 5.312 . 0 0 "[ . 1 . 2]" 1
519 1 37 ILE HG13 1 38 ALA H . . 5.500 4.849 4.595 5.584 0.084 16 0 "[ . 1 . 2]" 1
520 1 37 ILE HG13 1 47 CYS HA . . 5.500 4.011 3.463 5.355 . 0 0 "[ . 1 . 2]" 1
521 1 37 ILE MG 1 38 ALA H . . 4.050 2.829 2.078 3.194 . 0 0 "[ . 1 . 2]" 1
522 1 37 ILE MG 1 46 ALA H . . 4.820 3.777 3.510 3.920 . 0 0 "[ . 1 . 2]" 1
523 1 37 ILE MG 1 47 CYS HA . . 6.340 3.231 2.482 3.599 . 0 0 "[ . 1 . 2]" 1
524 1 38 ALA H 1 45 LYS HA . . 4.970 4.801 4.311 4.974 0.004 20 0 "[ . 1 . 2]" 1
525 1 38 ALA H 1 46 ALA H . . 3.240 3.120 2.848 3.256 0.016 7 0 "[ . 1 . 2]" 1
526 1 38 ALA H 1 46 ALA MB . . 5.130 4.198 4.064 4.267 . 0 0 "[ . 1 . 2]" 1
527 1 38 ALA H 1 47 CYS H . . 5.280 4.734 4.556 4.956 . 0 0 "[ . 1 . 2]" 1
528 1 38 ALA H 1 47 CYS HA . . 3.550 3.107 2.906 3.533 . 0 0 "[ . 1 . 2]" 1
529 1 38 ALA H 1 48 LEU MD1 . . 5.160 3.854 3.404 4.175 . 0 0 "[ . 1 . 2]" 1
530 1 38 ALA H 1 48 LEU HG . . 4.720 3.724 3.010 4.296 . 0 0 "[ . 1 . 2]" 1
531 1 38 ALA HA 1 39 THR H . . 2.400 2.243 2.209 2.284 . 0 0 "[ . 1 . 2]" 1
532 1 38 ALA HA 1 39 THR HA . . 4.690 4.356 4.350 4.362 . 0 0 "[ . 1 . 2]" 1
533 1 38 ALA HA 1 39 THR HB . . 4.420 4.442 4.406 4.467 0.047 11 0 "[ . 1 . 2]" 1
534 1 38 ALA HA 1 46 ALA H . . 4.760 4.784 4.675 4.855 0.095 15 0 "[ . 1 . 2]" 1
535 1 38 ALA MB 1 39 THR H . . 4.080 3.056 2.939 3.183 . 0 0 "[ . 1 . 2]" 1
536 1 38 ALA MB 1 46 ALA H . . 4.820 3.260 3.130 3.407 . 0 0 "[ . 1 . 2]" 1
537 1 38 ALA MB 1 47 CYS HA . . 6.530 4.391 4.162 4.640 . 0 0 "[ . 1 . 2]" 1
538 1 39 THR H 1 39 THR HB . . 2.800 2.274 2.246 2.292 . 0 0 "[ . 1 . 2]" 1
539 1 39 THR H 1 39 THR MG . . 4.510 3.694 3.681 3.705 . 0 0 "[ . 1 . 2]" 1
540 1 39 THR H 1 40 LEU H . . 5.220 4.589 4.551 4.625 . 0 0 "[ . 1 . 2]" 1
541 1 39 THR HA 1 40 LEU H . . 2.650 2.214 2.166 2.262 . 0 0 "[ . 1 . 2]" 1
542 1 39 THR HA 1 45 LYS HA . . 2.740 2.463 2.368 2.521 . 0 0 "[ . 1 . 2]" 1
543 1 39 THR HA 1 45 LYS HB2 . . 5.410 4.565 4.457 4.686 . 0 0 "[ . 1 . 2]" 1
544 1 39 THR HA 1 45 LYS HB3 . . 5.000 3.437 3.295 3.754 . 0 0 "[ . 1 . 2]" 1
545 1 39 THR HA 1 45 LYS QG . . 6.250 2.134 2.012 2.351 . 0 0 "[ . 1 . 2]" 1
546 1 39 THR HA 1 46 ALA H . . 3.890 3.802 3.664 3.866 . 0 0 "[ . 1 . 2]" 1
547 1 39 THR HB 1 40 LEU H . . 4.450 4.261 4.156 4.378 . 0 0 "[ . 1 . 2]" 1
548 1 39 THR MG 1 40 LEU H . . 3.830 2.439 2.118 2.764 . 0 0 "[ . 1 . 2]" 1
549 1 39 THR MG 1 40 LEU HA . . 6.530 4.028 3.825 4.265 . 0 0 "[ . 1 . 2]" 1
550 1 39 THR MG 1 41 LYS HA . . 6.530 4.138 4.059 4.259 . 0 0 "[ . 1 . 2]" 1
551 1 39 THR MG 1 43 GLY H . . 4.920 3.866 3.795 3.951 . 0 0 "[ . 1 . 2]" 1
552 1 39 THR MG 1 43 GLY HA2 . . 5.940 4.986 4.924 5.022 . 0 0 "[ . 1 . 2]" 1
553 1 39 THR MG 1 43 GLY QA . . 5.550 3.540 3.487 3.565 . 0 0 "[ . 1 . 2]" 1
554 1 39 THR MG 1 43 GLY HA3 . . 5.940 3.621 3.566 3.647 . 0 0 "[ . 1 . 2]" 1
555 1 39 THR MG 1 44 GLN H . . 5.750 4.567 4.401 4.692 . 0 0 "[ . 1 . 2]" 1
556 1 39 THR MG 1 45 LYS HA . . 5.100 4.065 3.914 4.148 . 0 0 "[ . 1 . 2]" 1
557 1 39 THR MG 1 45 LYS QE . . 6.160 3.217 2.654 4.074 . 0 0 "[ . 1 . 2]" 1
558 1 40 LEU H 1 40 LEU HB2 . . 3.420 2.171 2.077 2.256 . 0 0 "[ . 1 . 2]" 1
559 1 40 LEU H 1 40 LEU HB3 . . 3.420 2.984 2.976 2.998 . 0 0 "[ . 1 . 2]" 1
560 1 40 LEU H 1 40 LEU MD1 . . 5.010 4.038 3.905 4.146 . 0 0 "[ . 1 . 2]" 1
561 1 40 LEU H 1 40 LEU MD2 . . 5.440 4.342 4.304 4.364 . 0 0 "[ . 1 . 2]" 1
562 1 40 LEU H 1 40 LEU HG . . 4.140 4.076 3.970 4.150 0.010 11 0 "[ . 1 . 2]" 1
563 1 40 LEU H 1 44 GLN H . . 3.920 3.719 3.536 3.846 . 0 0 "[ . 1 . 2]" 1
564 1 40 LEU H 1 45 LYS HA . . 2.870 2.553 2.344 2.679 . 0 0 "[ . 1 . 2]" 1
565 1 40 LEU H 1 45 LYS HB3 . . 4.630 4.604 4.477 4.676 0.046 11 0 "[ . 1 . 2]" 1
566 1 40 LEU H 1 45 LYS QG . . 6.380 2.856 2.698 3.043 . 0 0 "[ . 1 . 2]" 1
567 1 40 LEU H 1 46 ALA H . . 4.540 4.417 4.206 4.550 0.010 11 0 "[ . 1 . 2]" 1
568 1 40 LEU HA 1 40 LEU MD2 . . 3.430 2.594 2.458 2.682 . 0 0 "[ . 1 . 2]" 1
569 1 40 LEU HA 1 40 LEU HG . . 3.580 2.292 2.266 2.371 . 0 0 "[ . 1 . 2]" 1
570 1 40 LEU HA 1 41 LYS H . . 2.620 2.334 2.320 2.369 . 0 0 "[ . 1 . 2]" 1
571 1 40 LEU HA 1 41 LYS QG . . 6.380 5.723 5.100 5.799 . 0 0 "[ . 1 . 2]" 1
572 1 40 LEU HA 1 42 ASN H . . 3.920 3.690 3.666 3.742 . 0 0 "[ . 1 . 2]" 1
573 1 40 LEU QB 1 41 LYS H . . 4.330 3.258 3.185 3.292 . 0 0 "[ . 1 . 2]" 1
574 1 40 LEU QB 1 42 ASN H . . 3.960 2.201 2.151 2.216 . 0 0 "[ . 1 . 2]" 1
575 1 40 LEU QB 1 42 ASN HD22 . . 4.970 4.363 4.345 4.403 . 0 0 "[ . 1 . 2]" 1
576 1 40 LEU QB 1 44 GLN H . . 3.560 2.046 1.929 2.235 . 0 0 "[ . 1 . 2]" 1
577 1 40 LEU QB 1 45 LYS HA . . 6.380 2.912 2.839 2.976 . 0 0 "[ . 1 . 2]" 1
578 1 40 LEU HB2 1 42 ASN HD22 . . 5.500 5.529 5.515 5.542 0.042 16 0 "[ . 1 . 2]" 1
579 1 40 LEU HB3 1 42 ASN HD22 . . 5.500 4.569 4.547 4.621 . 0 0 "[ . 1 . 2]" 1
580 1 40 LEU MD1 1 42 ASN HD21 . . 5.470 2.631 2.516 2.861 . 0 0 "[ . 1 . 2]" 1
581 1 40 LEU MD1 1 42 ASN HD22 . . 5.070 3.992 3.921 4.119 . 0 0 "[ . 1 . 2]" 1
582 1 40 LEU MD1 1 44 GLN H . . 4.330 3.482 3.417 3.565 . 0 0 "[ . 1 . 2]" 1
583 1 40 LEU MD1 1 46 ALA H . . 5.600 4.506 4.437 4.608 . 0 0 "[ . 1 . 2]" 1
584 1 40 LEU MD2 1 41 LYS H . . 3.950 1.882 1.800 1.935 . 0 0 "[ . 1 . 2]" 1
585 1 40 LEU MD2 1 42 ASN H . . 4.850 1.902 1.879 1.922 . 0 0 "[ . 1 . 2]" 1
586 1 40 LEU MD2 1 42 ASN HD22 . . 6.530 4.702 4.577 5.071 . 0 0 "[ . 1 . 2]" 1
587 1 41 LYS H 1 41 LYS HA . . 2.830 2.851 2.848 2.862 0.032 1 0 "[ . 1 . 2]" 1
588 1 41 LYS H 1 41 LYS QB . . 3.440 2.169 2.046 2.235 . 0 0 "[ . 1 . 2]" 1
589 1 41 LYS H 1 41 LYS QD . . 5.760 4.145 2.906 4.323 . 0 0 "[ . 1 . 2]" 1
590 1 41 LYS H 1 41 LYS QG . . 4.760 3.885 3.633 4.001 . 0 0 "[ . 1 . 2]" 1
591 1 41 LYS H 1 42 ASN H . . 3.240 2.560 2.539 2.577 . 0 0 "[ . 1 . 2]" 1
592 1 41 LYS HA 1 41 LYS QD . . 3.870 3.007 2.103 3.555 . 0 0 "[ . 1 . 2]" 1
593 1 41 LYS HA 1 41 LYS QG . . 3.960 2.573 1.964 3.206 . 0 0 "[ . 1 . 2]" 1
594 1 41 LYS HA 1 42 ASN H . . 3.330 3.342 3.309 3.362 0.032 11 0 "[ . 1 . 2]" 1
595 1 41 LYS HA 1 43 GLY H . . 3.450 3.607 3.582 3.628 0.178 2 0 "[ . 1 . 2]" 1
596 1 41 LYS QD 1 42 ASN H . . 5.380 4.317 4.037 4.915 . 0 0 "[ . 1 . 2]" 1
597 1 41 LYS QG 1 42 ASN H . . 6.380 4.379 3.891 4.789 . 0 0 "[ . 1 . 2]" 1
598 1 42 ASN H 1 42 ASN HB2 . . 3.330 3.282 3.262 3.328 . 0 0 "[ . 1 . 2]" 1
599 1 42 ASN H 1 42 ASN QB . . 3.100 2.155 2.140 2.190 . 0 0 "[ . 1 . 2]" 1
600 1 42 ASN H 1 42 ASN HB3 . . 3.330 2.185 2.169 2.221 . 0 0 "[ . 1 . 2]" 1
601 1 42 ASN H 1 42 ASN HD21 . . 5.500 3.662 3.641 3.694 . 0 0 "[ . 1 . 2]" 1
602 1 42 ASN H 1 42 ASN HD22 . . 5.500 5.009 4.993 5.030 . 0 0 "[ . 1 . 2]" 1
603 1 42 ASN HA 1 42 ASN HB2 . . 2.870 2.306 2.305 2.307 . 0 0 "[ . 1 . 2]" 1
604 1 42 ASN HA 1 42 ASN HB3 . . 2.870 2.967 2.964 2.968 0.098 4 0 "[ . 1 . 2]" 1
605 1 42 ASN HA 1 43 GLY H . . 3.420 3.408 3.398 3.418 . 0 0 "[ . 1 . 2]" 1
606 1 42 ASN QB 1 42 ASN HD21 . . 2.880 2.085 2.082 2.088 . 0 0 "[ . 1 . 2]" 1
607 1 42 ASN QB 1 42 ASN HD22 . . 3.640 3.258 3.255 3.260 . 0 0 "[ . 1 . 2]" 1
608 1 42 ASN HB2 1 42 ASN HD21 . . 3.140 3.297 3.280 3.308 0.168 3 0 "[ . 1 . 2]" 1
609 1 42 ASN HB2 1 42 ASN HD22 . . 3.980 4.009 4.000 4.015 0.035 3 0 "[ . 1 . 2]" 1
610 1 42 ASN HB3 1 42 ASN HD21 . . 3.140 2.108 2.105 2.111 . 0 0 "[ . 1 . 2]" 1
611 1 42 ASN HB3 1 42 ASN HD22 . . 3.980 3.448 3.446 3.449 . 0 0 "[ . 1 . 2]" 1
612 1 42 ASN HD21 1 44 GLN HB2 . . 4.820 1.927 1.891 1.946 . 0 0 "[ . 1 . 2]" 1
613 1 42 ASN HD21 1 44 GLN HB3 . . 4.690 3.586 3.565 3.604 . 0 0 "[ . 1 . 2]" 1
614 1 42 ASN HD21 1 44 GLN HG2 . . 4.290 4.087 3.971 4.178 . 0 0 "[ . 1 . 2]" 1
615 1 42 ASN HD21 1 44 GLN HG3 . . 4.880 2.748 2.719 2.835 . 0 0 "[ . 1 . 2]" 1
616 1 42 ASN HD22 1 44 GLN HB2 . . 4.510 2.927 2.808 2.988 . 0 0 "[ . 1 . 2]" 1
617 1 42 ASN HD22 1 44 GLN HG2 . . 4.260 3.592 3.472 3.698 . 0 0 "[ . 1 . 2]" 1
618 1 42 ASN HD22 1 44 GLN HG3 . . 4.940 1.948 1.930 1.961 . 0 0 "[ . 1 . 2]" 1
619 1 43 GLY H 1 43 GLY HA2 . . 2.770 2.953 2.950 2.956 0.186 12 0 "[ . 1 . 2]" 1
620 1 43 GLY H 1 43 GLY QA . . 2.570 2.294 2.283 2.301 . 0 0 "[ . 1 . 2]" 1
621 1 43 GLY H 1 43 GLY HA3 . . 2.770 2.391 2.377 2.400 . 0 0 "[ . 1 . 2]" 1
622 1 43 GLY H 1 44 GLN H . . 2.520 2.281 2.198 2.359 . 0 0 "[ . 1 . 2]" 1
623 1 43 GLY HA2 1 44 GLN H . . 3.610 3.282 3.227 3.357 . 0 0 "[ . 1 . 2]" 1
624 1 43 GLY HA3 1 44 GLN H . . 3.610 3.421 3.353 3.465 . 0 0 "[ . 1 . 2]" 1
625 1 44 GLN H 1 44 GLN HA . . 2.900 2.867 2.853 2.891 . 0 0 "[ . 1 . 2]" 1
626 1 44 GLN H 1 44 GLN HB2 . . 3.050 2.179 2.147 2.238 . 0 0 "[ . 1 . 2]" 1
627 1 44 GLN H 1 44 GLN HG2 . . 4.570 4.096 4.006 4.184 . 0 0 "[ . 1 . 2]" 1
628 1 44 GLN H 1 44 GLN HG3 . . 3.270 3.120 3.035 3.252 . 0 0 "[ . 1 . 2]" 1
629 1 44 GLN H 1 45 LYS H . . 4.660 4.461 4.429 4.503 . 0 0 "[ . 1 . 2]" 1
630 1 44 GLN HA 1 44 GLN HE21 . . 5.500 4.565 4.044 4.854 . 0 0 "[ . 1 . 2]" 1
631 1 44 GLN HA 1 44 GLN HG2 . . 2.930 2.345 2.165 2.476 . 0 0 "[ . 1 . 2]" 1
632 1 44 GLN HA 1 45 LYS H . . 2.830 2.782 2.733 2.804 . 0 0 "[ . 1 . 2]" 1
633 1 44 GLN HB2 1 45 LYS H . . 3.730 3.461 3.409 3.525 . 0 0 "[ . 1 . 2]" 1
634 1 44 GLN HB3 1 45 LYS H . . 2.870 1.932 1.892 2.017 . 0 0 "[ . 1 . 2]" 1
635 1 44 GLN HB3 1 45 LYS HA . . 5.500 4.068 4.030 4.101 . 0 0 "[ . 1 . 2]" 1
636 1 44 GLN HE22 1 44 GLN HG2 . . 4.040 3.609 3.445 3.998 . 0 0 "[ . 1 . 2]" 1
637 1 44 GLN HG2 1 45 LYS H . . 4.630 3.332 3.275 3.395 . 0 0 "[ . 1 . 2]" 1
638 1 44 GLN HG3 1 45 LYS H . . 5.190 4.396 4.357 4.436 . 0 0 "[ . 1 . 2]" 1
639 1 45 LYS H 1 45 LYS HA . . 2.870 2.904 2.898 2.913 0.043 12 0 "[ . 1 . 2]" 1
640 1 45 LYS H 1 45 LYS HB2 . . 2.870 2.885 2.762 2.919 0.049 6 0 "[ . 1 . 2]" 1
641 1 45 LYS H 1 45 LYS QG . . 4.240 3.187 3.001 3.613 . 0 0 "[ . 1 . 2]" 1
642 1 45 LYS H 1 46 ALA H . . 4.350 4.343 4.328 4.384 0.034 12 0 "[ . 1 . 2]" 1
643 1 45 LYS HA 1 45 LYS HB3 . . 2.560 2.451 2.440 2.534 . 0 0 "[ . 1 . 2]" 1
644 1 45 LYS HA 1 46 ALA H . . 2.560 2.291 2.281 2.325 . 0 0 "[ . 1 . 2]" 1
645 1 45 LYS HA 1 46 ALA MB . . 5.190 3.753 3.728 3.838 . 0 0 "[ . 1 . 2]" 1
646 1 45 LYS HB2 1 46 ALA H . . 3.920 3.983 3.966 4.032 0.112 12 0 "[ . 1 . 2]" 1
647 1 45 LYS HB3 1 46 ALA H . . 3.520 2.957 2.861 2.984 . 0 0 "[ . 1 . 2]" 1
648 1 45 LYS QG 1 46 ALA H . . 4.950 4.101 3.874 4.148 . 0 0 "[ . 1 . 2]" 1
649 1 46 ALA H 1 47 CYS H . . 4.070 4.093 4.045 4.150 0.080 11 0 "[ . 1 . 2]" 1
650 1 46 ALA HA 1 47 CYS H . . 3.080 2.191 2.187 2.197 . 0 0 "[ . 1 . 2]" 1
651 1 46 ALA MB 1 47 CYS H . . 4.110 3.445 3.381 3.482 . 0 0 "[ . 1 . 2]" 1
652 1 46 ALA MB 1 47 CYS HA . . 6.530 4.468 4.411 4.503 . 0 0 "[ . 1 . 2]" 1
653 1 47 CYS H 1 47 CYS HB2 . . 2.870 2.091 2.058 2.196 . 0 0 "[ . 1 . 2]" 1
654 1 47 CYS H 1 47 CYS HB3 . . 3.420 3.361 3.311 3.480 0.060 15 0 "[ . 1 . 2]" 1
655 1 47 CYS H 1 48 LEU HG . . 5.440 5.091 4.910 5.348 . 0 0 "[ . 1 . 2]" 1
656 1 47 CYS HA 1 47 CYS HB3 . . 2.800 2.754 2.644 2.789 . 0 0 "[ . 1 . 2]" 1
657 1 47 CYS HA 1 48 LEU H . . 2.400 2.289 2.267 2.338 . 0 0 "[ . 1 . 2]" 1
658 1 47 CYS HA 1 48 LEU HA . . 4.790 4.402 4.391 4.408 . 0 0 "[ . 1 . 2]" 1
659 1 47 CYS HA 1 48 LEU QB . . 6.380 4.424 4.379 4.512 . 0 0 "[ . 1 . 2]" 1
660 1 47 CYS HA 1 48 LEU MD1 . . 6.530 4.712 4.551 4.849 . 0 0 "[ . 1 . 2]" 1
661 1 47 CYS HA 1 48 LEU MD2 . . 6.530 4.718 4.285 4.809 . 0 0 "[ . 1 . 2]" 1
662 1 47 CYS HA 1 48 LEU HG . . 4.940 3.660 3.473 3.796 . 0 0 "[ . 1 . 2]" 1
663 1 47 CYS HB2 1 48 LEU H . . 4.420 4.368 4.268 4.401 . 0 0 "[ . 1 . 2]" 1
664 1 47 CYS HB3 1 48 LEU H . . 3.270 3.263 3.107 3.317 0.047 20 0 "[ . 1 . 2]" 1
665 1 48 LEU H 1 48 LEU QB . . 3.650 2.507 2.412 2.602 . 0 0 "[ . 1 . 2]" 1
666 1 48 LEU H 1 48 LEU MD1 . . 4.510 3.690 3.576 3.770 . 0 0 "[ . 1 . 2]" 1
667 1 48 LEU H 1 48 LEU MD2 . . 4.700 3.929 3.713 3.979 . 0 0 "[ . 1 . 2]" 1
668 1 48 LEU H 1 48 LEU HG . . 3.170 2.808 2.612 2.886 . 0 0 "[ . 1 . 2]" 1
669 1 48 LEU HA 1 48 LEU MD1 . . 4.510 3.925 3.898 3.952 . 0 0 "[ . 1 . 2]" 1
670 1 48 LEU HA 1 48 LEU MD2 . . 3.740 2.230 2.073 2.386 . 0 0 "[ . 1 . 2]" 1
671 1 48 LEU HA 1 48 LEU HG . . 3.790 2.953 2.922 3.132 . 0 0 "[ . 1 . 2]" 1
672 1 48 LEU HA 1 49 ASN H . . 2.520 2.453 2.370 2.496 . 0 0 "[ . 1 . 2]" 1
673 1 48 LEU HA 1 55 VAL MG2 . . 5.440 3.385 3.165 3.610 . 0 0 "[ . 1 . 2]" 1
674 1 48 LEU QB 1 49 ASN H . . 3.900 2.480 2.389 2.656 . 0 0 "[ . 1 . 2]" 1
675 1 48 LEU MD1 1 49 ASN H . . 6.530 4.667 4.537 4.819 . 0 0 "[ . 1 . 2]" 1
676 1 48 LEU MD2 1 49 ASN H . . 4.700 3.414 3.175 3.632 . 0 0 "[ . 1 . 2]" 1
677 1 48 LEU MD2 1 55 VAL HA . . 5.810 3.858 3.492 4.526 . 0 0 "[ . 1 . 2]" 1
678 1 48 LEU HG 1 49 ASN H . . 4.850 4.880 4.824 4.971 0.121 17 0 "[ . 1 . 2]" 1
679 1 49 ASN H 1 49 ASN HB2 . . 2.800 2.568 2.384 2.723 . 0 0 "[ . 1 . 2]" 1
680 1 49 ASN H 1 49 ASN HB3 . . 2.770 2.620 2.407 2.811 0.041 4 0 "[ . 1 . 2]" 1
681 1 49 ASN H 1 49 ASN HD21 . . 5.500 4.752 4.616 4.884 . 0 0 "[ . 1 . 2]" 1
682 1 49 ASN H 1 52 SER HB2 . . 4.880 4.650 4.317 4.914 0.034 4 0 "[ . 1 . 2]" 1
683 1 49 ASN H 1 52 SER QB . . 4.740 3.664 3.416 3.999 . 0 0 "[ . 1 . 2]" 1
684 1 49 ASN H 1 52 SER HB3 . . 4.880 3.838 3.538 4.234 . 0 0 "[ . 1 . 2]" 1
685 1 49 ASN H 1 55 VAL MG2 . . 4.610 1.953 1.857 2.178 . 0 0 "[ . 1 . 2]" 1
686 1 49 ASN HA 1 49 ASN HB2 . . 3.050 2.598 2.487 2.700 . 0 0 "[ . 1 . 2]" 1
687 1 49 ASN HA 1 50 PRO HD2 . . 3.110 2.319 2.267 2.370 . 0 0 "[ . 1 . 2]" 1
688 1 49 ASN HA 1 50 PRO HD3 . . 3.110 2.029 1.991 2.089 . 0 0 "[ . 1 . 2]" 1
689 1 49 ASN HB2 1 49 ASN HD22 . . 3.920 3.866 3.804 3.939 0.019 19 0 "[ . 1 . 2]" 1
690 1 49 ASN HB2 1 52 SER H . . 5.500 5.127 4.646 5.527 0.027 19 0 "[ . 1 . 2]" 1
691 1 49 ASN HB2 1 52 SER HB2 . . 4.260 4.052 3.698 4.225 . 0 0 "[ . 1 . 2]" 1
692 1 49 ASN HB2 1 52 SER QB . . 4.090 3.674 3.489 3.752 . 0 0 "[ . 1 . 2]" 1
693 1 49 ASN HB2 1 52 SER HB3 . . 4.260 4.222 4.052 4.308 0.048 4 0 "[ . 1 . 2]" 1
694 1 49 ASN HB3 1 49 ASN HD21 . . 3.110 2.165 2.109 2.226 . 0 0 "[ . 1 . 2]" 1
695 1 49 ASN HB3 1 49 ASN HD22 . . 3.550 3.471 3.449 3.496 . 0 0 "[ . 1 . 2]" 1
696 1 49 ASN HB3 1 52 SER H . . 4.290 3.481 3.000 3.800 . 0 0 "[ . 1 . 2]" 1
697 1 49 ASN HB3 1 52 SER HB2 . . 3.760 2.601 2.208 2.886 . 0 0 "[ . 1 . 2]" 1
698 1 49 ASN HB3 1 52 SER QB . . 3.580 2.304 2.105 2.494 . 0 0 "[ . 1 . 2]" 1
699 1 49 ASN HB3 1 52 SER HB3 . . 3.760 2.599 2.383 2.935 . 0 0 "[ . 1 . 2]" 1
700 1 49 ASN HD21 1 51 ALA MB . . 4.880 3.096 2.691 3.584 . 0 0 "[ . 1 . 2]" 1
701 1 49 ASN HD21 1 55 VAL MG2 . . 5.540 4.387 4.202 4.503 . 0 0 "[ . 1 . 2]" 1
702 1 49 ASN HD22 1 51 ALA MB . . 4.330 2.215 1.815 3.152 . 0 0 "[ . 1 . 2]" 1
703 1 50 PRO HA 1 52 SER H . . 3.830 3.435 3.278 3.766 . 0 0 "[ . 1 . 2]" 1
704 1 50 PRO HA 1 55 VAL MG1 . . 3.430 2.623 2.422 2.716 . 0 0 "[ . 1 . 2]" 1
705 1 50 PRO HA 1 55 VAL MG2 . . 5.750 4.095 3.469 4.345 . 0 0 "[ . 1 . 2]" 1
706 1 50 PRO HD2 1 51 ALA H . . 4.350 3.085 2.587 4.049 . 0 0 "[ . 1 . 2]" 1
707 1 50 PRO HD3 1 51 ALA H . . 5.500 4.055 3.770 4.635 . 0 0 "[ . 1 . 2]" 1
708 1 50 PRO HG2 1 51 ALA H . . 4.910 4.175 3.702 5.001 0.091 14 0 "[ . 1 . 2]" 1
709 1 50 PRO HG3 1 51 ALA H . . 5.500 4.978 4.649 5.558 0.058 14 0 "[ . 1 . 2]" 1
710 1 51 ALA H 1 51 ALA MB . . 3.520 2.388 2.114 2.833 . 0 0 "[ . 1 . 2]" 1
711 1 51 ALA H 1 52 SER H . . 2.900 2.246 1.863 2.599 . 0 0 "[ . 1 . 2]" 1
712 1 51 ALA H 1 52 SER HB2 . . 4.450 4.214 3.705 4.469 0.019 15 0 "[ . 1 . 2]" 1
713 1 51 ALA H 1 52 SER QB . . 4.170 3.569 3.085 3.817 . 0 0 "[ . 1 . 2]" 1
714 1 51 ALA H 1 52 SER HB3 . . 4.450 3.876 3.187 4.354 . 0 0 "[ . 1 . 2]" 1
715 1 51 ALA HA 1 52 SER H . . 3.300 3.116 2.936 3.303 0.003 16 0 "[ . 1 . 2]" 1
716 1 51 ALA MB 1 52 SER H . . 4.360 3.581 3.407 3.712 . 0 0 "[ . 1 . 2]" 1
717 1 51 ALA MB 1 52 SER HA . . 6.530 4.123 4.012 4.204 . 0 0 "[ . 1 . 2]" 1
718 1 52 SER H 1 52 SER HB2 . . 3.520 3.167 2.800 3.448 . 0 0 "[ . 1 . 2]" 1
719 1 52 SER H 1 52 SER QB . . 3.110 2.371 2.260 2.522 . 0 0 "[ . 1 . 2]" 1
720 1 52 SER H 1 52 SER HB3 . . 3.520 2.454 2.324 2.653 . 0 0 "[ . 1 . 2]" 1
721 1 52 SER H 1 55 VAL HB . . 4.290 2.958 2.571 3.170 . 0 0 "[ . 1 . 2]" 1
722 1 52 SER H 1 55 VAL MG1 . . 4.760 3.705 3.255 3.870 . 0 0 "[ . 1 . 2]" 1
723 1 52 SER H 1 55 VAL MG2 . . 4.880 3.564 3.299 3.813 . 0 0 "[ . 1 . 2]" 1
724 1 52 SER HA 1 53 PRO HD2 . . 2.830 2.614 2.553 2.718 . 0 0 "[ . 1 . 2]" 1
725 1 52 SER HA 1 53 PRO QD . . 2.570 1.916 1.894 1.963 . 0 0 "[ . 1 . 2]" 1
726 1 52 SER HA 1 53 PRO HD3 . . 2.830 1.971 1.952 2.014 . 0 0 "[ . 1 . 2]" 1
727 1 52 SER HA 1 54 MET H . . 4.690 4.064 3.733 4.360 . 0 0 "[ . 1 . 2]" 1
728 1 52 SER QB 1 54 MET H . . 4.670 3.706 2.896 4.130 . 0 0 "[ . 1 . 2]" 1
729 1 52 SER QB 1 55 VAL H . . 4.210 2.901 2.547 3.139 . 0 0 "[ . 1 . 2]" 1
730 1 52 SER QB 1 55 VAL HB . . 4.920 2.387 2.069 2.902 . 0 0 "[ . 1 . 2]" 1
731 1 52 SER QB 1 55 VAL MG2 . . 4.510 2.018 1.885 2.179 . 0 0 "[ . 1 . 2]" 1
732 1 52 SER HB2 1 55 VAL MG2 . . 4.820 3.236 2.953 3.578 . 0 0 "[ . 1 . 2]" 1
733 1 52 SER HB3 1 55 VAL MG2 . . 4.820 2.039 1.905 2.207 . 0 0 "[ . 1 . 2]" 1
734 1 53 PRO HA 1 54 MET H . . 3.420 3.445 3.236 3.523 0.103 7 0 "[ . 1 . 2]" 1
735 1 53 PRO HA 1 55 VAL H . . 4.350 3.898 3.697 4.280 . 0 0 "[ . 1 . 2]" 1
736 1 53 PRO HA 1 56 LYS H . . 3.670 3.581 3.361 3.718 0.048 1 0 "[ . 1 . 2]" 1
737 1 53 PRO HA 1 56 LYS QB . . 4.360 3.443 3.251 3.577 . 0 0 "[ . 1 . 2]" 1
738 1 53 PRO QB 1 54 MET H . . 4.370 3.311 2.989 3.798 . 0 0 "[ . 1 . 2]" 1
739 1 53 PRO QD 1 54 MET H . . 5.050 2.314 2.236 2.677 . 0 0 "[ . 1 . 2]" 1
740 1 54 MET H 1 54 MET HA . . 2.900 2.823 2.754 2.906 0.006 4 0 "[ . 1 . 2]" 1
741 1 54 MET H 1 54 MET QB . . 3.540 2.131 1.979 2.282 . 0 0 "[ . 1 . 2]" 1
742 1 54 MET H 1 54 MET ME . . 4.450 3.153 2.606 3.421 . 0 0 "[ . 1 . 2]" 1
743 1 54 MET H 1 54 MET QG . . 4.800 3.982 3.865 4.116 . 0 0 "[ . 1 . 2]" 1
744 1 54 MET H 1 55 VAL H . . 2.900 2.467 2.106 2.695 . 0 0 "[ . 1 . 2]" 1
745 1 54 MET HA 1 54 MET ME . . 3.430 2.326 1.938 2.686 . 0 0 "[ . 1 . 2]" 1
746 1 54 MET HA 1 55 VAL H . . 3.520 3.506 3.453 3.567 0.047 19 0 "[ . 1 . 2]" 1
747 1 54 MET HA 1 55 VAL HA . . 4.690 4.747 4.685 4.792 0.102 19 0 "[ . 1 . 2]" 1
748 1 54 MET HA 1 56 LYS H . . 3.890 3.509 3.320 3.734 . 0 0 "[ . 1 . 2]" 1
749 1 54 MET HA 1 57 LYS H . . 3.520 3.400 3.278 3.526 0.006 11 0 "[ . 1 . 2]" 1
750 1 54 MET HA 1 58 ILE MD . . 6.500 3.873 3.608 4.105 . 0 0 "[ . 1 . 2]" 1
751 1 54 MET QB 1 55 VAL H . . 4.550 2.979 2.737 3.148 . 0 0 "[ . 1 . 2]" 1
752 1 54 MET QG 1 55 VAL H . . 6.310 4.365 4.041 4.642 . 0 0 "[ . 1 . 2]" 1
753 1 54 MET QG 1 55 VAL MG2 . . 7.400 4.567 4.061 4.879 . 0 0 "[ . 1 . 2]" 1
754 1 54 MET QG 1 58 ILE MD . . 6.230 2.138 1.748 2.696 . 0 0 "[ . 1 . 2]" 1
755 1 55 VAL H 1 55 VAL HA . . 2.710 2.848 2.814 2.886 0.176 20 0 "[ . 1 . 2]" 1
756 1 55 VAL H 1 55 VAL HB . . 2.400 2.159 2.072 2.235 . 0 0 "[ . 1 . 2]" 1
757 1 55 VAL H 1 55 VAL MG1 . . 4.360 3.600 3.520 3.656 . 0 0 "[ . 1 . 2]" 1
758 1 55 VAL H 1 55 VAL MG2 . . 3.430 2.592 2.367 2.798 . 0 0 "[ . 1 . 2]" 1
759 1 55 VAL H 1 56 LYS H . . 2.650 2.493 2.354 2.574 . 0 0 "[ . 1 . 2]" 1
760 1 55 VAL H 1 56 LYS QD . . 5.290 4.399 2.718 4.801 . 0 0 "[ . 1 . 2]" 1
761 1 55 VAL H 1 58 ILE MD . . 5.070 3.832 3.457 4.052 . 0 0 "[ . 1 . 2]" 1
762 1 55 VAL HA 1 55 VAL HB . . 2.930 2.997 2.970 3.013 0.083 6 0 "[ . 1 . 2]" 1
763 1 55 VAL HA 1 55 VAL MG1 . . 3.680 2.588 2.498 2.712 . 0 0 "[ . 1 . 2]" 1
764 1 55 VAL HA 1 55 VAL MG2 . . 3.520 2.197 2.039 2.323 . 0 0 "[ . 1 . 2]" 1
765 1 55 VAL HA 1 56 LYS H . . 3.420 3.425 3.335 3.502 0.082 13 0 "[ . 1 . 2]" 1
766 1 55 VAL HA 1 56 LYS HA . . 4.600 4.581 4.540 4.610 0.010 5 0 "[ . 1 . 2]" 1
767 1 55 VAL HA 1 57 LYS H . . 4.010 3.504 3.452 3.563 . 0 0 "[ . 1 . 2]" 1
768 1 55 VAL HA 1 58 ILE H . . 3.830 3.245 3.178 3.315 . 0 0 "[ . 1 . 2]" 1
769 1 55 VAL HA 1 58 ILE HB . . 3.210 2.867 2.750 2.966 . 0 0 "[ . 1 . 2]" 1
770 1 55 VAL HA 1 58 ILE MD . . 3.800 2.278 2.085 2.567 . 0 0 "[ . 1 . 2]" 1
771 1 55 VAL HA 1 58 ILE QG . . 4.860 3.797 3.656 3.900 . 0 0 "[ . 1 . 2]" 1
772 1 55 VAL HA 1 58 ILE MG . . 6.530 4.294 4.188 4.387 . 0 0 "[ . 1 . 2]" 1
773 1 55 VAL HA 1 59 ILE H . . 4.420 4.473 4.445 4.496 0.076 19 0 "[ . 1 . 2]" 1
774 1 55 VAL HB 1 56 LYS H . . 3.640 3.418 3.229 3.640 0.000 11 0 "[ . 1 . 2]" 1
775 1 55 VAL HB 1 56 LYS HA . . 5.500 4.867 4.774 4.988 . 0 0 "[ . 1 . 2]" 1
776 1 55 VAL MG1 1 56 LYS H . . 5.290 3.694 3.419 3.920 . 0 0 "[ . 1 . 2]" 1
777 1 55 VAL MG2 1 56 LYS H . . 6.030 4.299 4.239 4.394 . 0 0 "[ . 1 . 2]" 1
778 1 56 LYS H 1 56 LYS QB . . 3.340 2.578 2.445 2.696 . 0 0 "[ . 1 . 2]" 1
779 1 56 LYS H 1 56 LYS QD . . 5.010 3.322 1.907 3.718 . 0 0 "[ . 1 . 2]" 1
780 1 56 LYS H 1 56 LYS HG2 . . 3.830 2.493 2.075 3.983 0.153 4 0 "[ . 1 . 2]" 1
781 1 56 LYS H 1 56 LYS QG . . 3.630 2.362 2.060 3.246 . 0 0 "[ . 1 . 2]" 1
782 1 56 LYS H 1 56 LYS HG3 . . 3.830 3.581 3.358 3.763 . 0 0 "[ . 1 . 2]" 1
783 1 56 LYS H 1 57 LYS H . . 2.490 2.306 2.198 2.390 . 0 0 "[ . 1 . 2]" 1
784 1 56 LYS H 1 58 ILE H . . 5.040 3.771 3.658 3.884 . 0 0 "[ . 1 . 2]" 1
785 1 56 LYS HA 1 56 LYS HD2 . . 3.950 2.329 2.025 3.598 . 0 0 "[ . 1 . 2]" 1
786 1 56 LYS HA 1 56 LYS HD3 . . 3.950 3.717 3.621 3.905 . 0 0 "[ . 1 . 2]" 1
787 1 56 LYS HA 1 56 LYS HG2 . . 4.200 3.178 3.039 3.604 . 0 0 "[ . 1 . 2]" 1
788 1 56 LYS HA 1 56 LYS QG . . 3.730 2.886 2.359 3.105 . 0 0 "[ . 1 . 2]" 1
789 1 56 LYS HA 1 56 LYS HG3 . . 4.200 3.623 2.392 3.880 . 0 0 "[ . 1 . 2]" 1
790 1 56 LYS HA 1 57 LYS H . . 3.240 3.267 3.260 3.277 0.037 3 0 "[ . 1 . 2]" 1
791 1 56 LYS HA 1 59 ILE H . . 3.890 3.577 3.477 3.665 . 0 0 "[ . 1 . 2]" 1
792 1 56 LYS HA 1 59 ILE MD . . 4.360 3.088 2.933 3.249 . 0 0 "[ . 1 . 2]" 1
793 1 56 LYS HA 1 59 ILE QG . . 6.380 4.623 4.480 4.737 . 0 0 "[ . 1 . 2]" 1
794 1 56 LYS HA 1 59 ILE MG . . 6.530 4.228 4.109 4.365 . 0 0 "[ . 1 . 2]" 1
795 1 56 LYS HA 1 60 GLU H . . 3.920 3.843 3.680 3.958 0.038 3 0 "[ . 1 . 2]" 1
796 1 56 LYS HA 2 63 LEU MD2 . . 6.530 4.413 3.988 4.908 . 0 0 "[ . 1 . 2]" 1
797 1 57 LYS H 1 57 LYS HA . . 2.830 2.939 2.938 2.940 0.110 10 0 "[ . 1 . 2]" 1
798 1 57 LYS H 1 57 LYS QB . . 3.340 2.586 2.474 2.775 . 0 0 "[ . 1 . 2]" 1
799 1 57 LYS H 1 57 LYS QD . . 5.200 4.508 4.049 4.694 . 0 0 "[ . 1 . 2]" 1
800 1 57 LYS H 1 57 LYS HG2 . . 3.420 3.399 3.310 3.469 0.049 4 0 "[ . 1 . 2]" 1
801 1 57 LYS H 1 57 LYS HG3 . . 3.420 3.056 2.341 3.461 0.041 13 0 "[ . 1 . 2]" 1
802 1 57 LYS H 1 58 ILE H . . 2.870 1.821 1.794 1.860 . 0 0 "[ . 1 . 2]" 1
803 1 57 LYS H 1 59 ILE H . . 4.260 3.342 3.322 3.389 . 0 0 "[ . 1 . 2]" 1
804 1 57 LYS HA 1 57 LYS QD . . 4.240 3.383 3.185 3.667 . 0 0 "[ . 1 . 2]" 1
805 1 57 LYS HA 1 57 LYS QG . . 3.840 2.596 2.219 3.404 . 0 0 "[ . 1 . 2]" 1
806 1 57 LYS HA 1 58 ILE H . . 3.390 3.444 3.416 3.453 0.063 5 0 "[ . 1 . 2]" 1
807 1 57 LYS HA 1 59 ILE H . . 5.500 3.838 3.799 3.880 . 0 0 "[ . 1 . 2]" 1
808 1 57 LYS HA 1 60 GLU H . . 4.170 3.646 3.617 3.692 . 0 0 "[ . 1 . 2]" 1
809 1 57 LYS HA 1 60 GLU QB . . 3.710 2.898 2.875 2.926 . 0 0 "[ . 1 . 2]" 1
810 1 57 LYS HA 1 60 GLU HG3 . . 4.480 4.501 4.460 4.525 0.045 14 0 "[ . 1 . 2]" 1
811 1 57 LYS HA 1 61 LYS H . . 4.010 3.806 3.678 4.018 0.008 20 0 "[ . 1 . 2]" 1
812 1 57 LYS QG 1 58 ILE H . . 5.290 3.770 2.523 4.352 . 0 0 "[ . 1 . 2]" 1
813 1 57 LYS HG2 1 58 ILE H . . 5.500 4.593 4.144 4.792 . 0 0 "[ . 1 . 2]" 1
814 1 57 LYS HG3 1 58 ILE H . . 5.500 4.185 2.545 4.992 . 0 0 "[ . 1 . 2]" 1
815 1 58 ILE H 1 58 ILE HA . . 2.870 2.910 2.903 2.917 0.047 8 0 "[ . 1 . 2]" 1
816 1 58 ILE H 1 58 ILE HB . . 2.400 2.418 2.366 2.445 0.045 8 0 "[ . 1 . 2]" 1
817 1 58 ILE H 1 58 ILE MD . . 3.990 3.230 3.173 3.298 . 0 0 "[ . 1 . 2]" 1
818 1 58 ILE H 1 58 ILE HG12 . . 3.860 3.896 3.845 3.949 0.089 4 0 "[ . 1 . 2]" 1
819 1 58 ILE H 1 58 ILE QG . . 3.690 2.473 2.408 2.553 . 0 0 "[ . 1 . 2]" 1
820 1 58 ILE H 1 58 ILE HG13 . . 3.860 2.501 2.433 2.586 . 0 0 "[ . 1 . 2]" 1
821 1 58 ILE H 1 58 ILE MG . . 4.640 3.743 3.720 3.755 . 0 0 "[ . 1 . 2]" 1
822 1 58 ILE H 1 59 ILE H . . 2.590 2.180 2.142 2.220 . 0 0 "[ . 1 . 2]" 1
823 1 58 ILE H 1 59 ILE QG . . 6.380 4.139 3.992 4.203 . 0 0 "[ . 1 . 2]" 1
824 1 58 ILE HA 1 58 ILE MD . . 4.640 3.877 3.855 3.888 . 0 0 "[ . 1 . 2]" 1
825 1 58 ILE HA 1 58 ILE HG12 . . 3.050 2.815 2.780 2.840 . 0 0 "[ . 1 . 2]" 1
826 1 58 ILE HA 1 58 ILE QG . . 2.720 2.452 2.412 2.469 . 0 0 "[ . 1 . 2]" 1
827 1 58 ILE HA 1 58 ILE HG13 . . 3.050 2.698 2.646 2.743 . 0 0 "[ . 1 . 2]" 1
828 1 58 ILE HA 1 58 ILE MG . . 3.680 2.396 2.322 2.465 . 0 0 "[ . 1 . 2]" 1
829 1 58 ILE HA 1 59 ILE H . . 3.390 3.453 3.445 3.459 0.069 3 0 "[ . 1 . 2]" 1
830 1 58 ILE HA 1 61 LYS H . . 3.730 3.820 3.784 3.859 0.129 4 0 "[ . 1 . 2]" 1
831 1 58 ILE HA 1 62 MET H . . 4.230 4.277 4.242 4.321 0.091 14 0 "[ . 1 . 2]" 1
832 1 58 ILE HA 1 62 MET QG . . 6.380 4.817 4.311 5.171 . 0 0 "[ . 1 . 2]" 1
833 1 58 ILE HB 1 59 ILE H . . 3.480 3.318 3.302 3.339 . 0 0 "[ . 1 . 2]" 1
834 1 58 ILE MD 1 59 ILE H . . 6.160 4.693 4.641 4.773 . 0 0 "[ . 1 . 2]" 1
835 1 58 ILE QG 1 59 ILE H . . 6.380 4.233 4.204 4.291 . 0 0 "[ . 1 . 2]" 1
836 1 58 ILE MG 1 59 ILE H . . 5.040 3.959 3.890 3.994 . 0 0 "[ . 1 . 2]" 1
837 1 58 ILE MG 1 62 MET QG . . 5.450 3.417 2.985 3.668 . 0 0 "[ . 1 . 2]" 1
838 1 59 ILE H 1 59 ILE HB . . 2.400 2.252 2.238 2.279 . 0 0 "[ . 1 . 2]" 1
839 1 59 ILE H 1 59 ILE MD . . 4.260 3.478 3.433 3.541 . 0 0 "[ . 1 . 2]" 1
840 1 59 ILE H 1 59 ILE QG . . 3.520 2.916 2.792 2.956 . 0 0 "[ . 1 . 2]" 1
841 1 59 ILE H 1 59 ILE MG . . 4.230 3.617 3.602 3.654 . 0 0 "[ . 1 . 2]" 1
842 1 59 ILE H 1 60 GLU H . . 3.050 2.368 2.286 2.428 . 0 0 "[ . 1 . 2]" 1
843 1 59 ILE H 1 60 GLU HG3 . . 5.500 4.235 4.158 4.307 . 0 0 "[ . 1 . 2]" 1
844 1 59 ILE HA 1 59 ILE HB . . 2.830 2.998 2.995 3.005 0.175 11 0 "[ . 1 . 2]" 1
845 1 59 ILE HA 1 59 ILE MD . . 4.360 3.783 3.774 3.809 . 0 0 "[ . 1 . 2]" 1
846 1 59 ILE HA 1 59 ILE HG12 . . 2.680 2.693 2.643 2.715 0.035 12 0 "[ . 1 . 2]" 1
847 1 59 ILE HA 1 59 ILE HG13 . . 2.680 2.481 2.452 2.590 . 0 0 "[ . 1 . 2]" 1
848 1 59 ILE HA 1 59 ILE MG . . 3.490 2.556 2.501 2.600 . 0 0 "[ . 1 . 2]" 1
849 1 59 ILE HA 1 60 GLU H . . 3.610 3.635 3.628 3.638 0.028 4 0 "[ . 1 . 2]" 1
850 1 59 ILE HA 1 61 LYS H . . 4.170 4.132 3.837 4.228 0.058 8 0 "[ . 1 . 2]" 1
851 1 59 ILE HA 1 62 MET H . . 3.170 3.098 2.912 3.154 . 0 0 "[ . 1 . 2]" 1
852 1 59 ILE HA 1 62 MET HB2 . . 2.680 2.150 1.947 2.245 . 0 0 "[ . 1 . 2]" 1
853 1 59 ILE HA 1 62 MET HB3 . . 3.550 3.517 3.293 3.612 0.062 6 0 "[ . 1 . 2]" 1
854 1 59 ILE HA 1 62 MET HG2 . . 4.140 4.106 3.956 4.266 0.126 20 0 "[ . 1 . 2]" 1
855 1 59 ILE HA 1 62 MET QG . . 3.860 3.373 2.876 3.521 . 0 0 "[ . 1 . 2]" 1
856 1 59 ILE HA 1 62 MET HG3 . . 4.140 3.603 2.924 3.853 . 0 0 "[ . 1 . 2]" 1
857 1 59 ILE HB 1 60 GLU H . . 2.800 2.560 2.512 2.624 . 0 0 "[ . 1 . 2]" 1
858 1 59 ILE MD 1 60 GLU H . . 6.310 4.268 4.225 4.311 . 0 0 "[ . 1 . 2]" 1
859 1 59 ILE QG 1 60 GLU H . . 6.380 4.281 4.229 4.303 . 0 0 "[ . 1 . 2]" 1
860 1 59 ILE MG 1 60 GLU H . . 4.920 2.870 2.752 3.005 . 0 0 "[ . 1 . 2]" 1
861 1 59 ILE MG 1 60 GLU HA . . 4.570 3.105 2.945 3.250 . 0 0 "[ . 1 . 2]" 1
862 1 59 ILE MG 1 60 GLU HG3 . . 5.850 3.031 2.950 3.165 . 0 0 "[ . 1 . 2]" 1
863 1 60 GLU H 1 60 GLU QB . . 3.570 2.409 2.385 2.425 . 0 0 "[ . 1 . 2]" 1
864 1 60 GLU H 1 60 GLU HG2 . . 3.520 3.561 3.541 3.585 0.065 10 0 "[ . 1 . 2]" 1
865 1 60 GLU H 1 60 GLU HG3 . . 3.790 2.137 2.105 2.175 . 0 0 "[ . 1 . 2]" 1
866 1 60 GLU H 1 61 LYS H . . 3.020 2.776 2.721 2.841 . 0 0 "[ . 1 . 2]" 1
867 1 60 GLU H 2 63 LEU MD2 . . 6.530 5.504 5.452 5.536 . 0 0 "[ . 1 . 2]" 1
868 1 60 GLU HA 1 60 GLU HG2 . . 2.650 2.672 2.627 2.703 0.053 9 0 "[ . 1 . 2]" 1
869 1 60 GLU HA 1 60 GLU HG3 . . 3.140 2.688 2.657 2.734 . 0 0 "[ . 1 . 2]" 1
870 1 60 GLU HA 1 62 MET H . . 4.720 4.245 4.031 4.349 . 0 0 "[ . 1 . 2]" 1
871 1 60 GLU HA 1 63 LEU H . . 4.040 3.531 3.450 3.858 . 0 0 "[ . 1 . 2]" 1
872 1 60 GLU HA 1 63 LEU MD1 . . 5.160 2.950 2.845 3.147 . 0 0 "[ . 1 . 2]" 1
873 1 60 GLU HA 1 63 LEU MD2 . . 6.530 3.253 2.993 3.560 . 0 0 "[ . 1 . 2]" 1
874 1 60 GLU HG3 1 61 LYS H . . 5.000 4.487 4.464 4.529 . 0 0 "[ . 1 . 2]" 1
875 1 60 GLU HG3 1 63 LEU MD1 . . 5.940 4.768 4.733 4.864 . 0 0 "[ . 1 . 2]" 1
876 1 61 LYS H 1 61 LYS QB . . 3.770 2.122 2.030 2.273 . 0 0 "[ . 1 . 2]" 1
877 1 61 LYS H 1 61 LYS HG2 . . 4.450 3.463 2.572 3.875 . 0 0 "[ . 1 . 2]" 1
878 1 61 LYS H 1 61 LYS QG . . 3.760 2.956 2.525 3.551 . 0 0 "[ . 1 . 2]" 1
879 1 61 LYS H 1 61 LYS HG3 . . 4.450 3.390 2.754 4.255 . 0 0 "[ . 1 . 2]" 1
880 1 61 LYS HA 1 64 LYS H . . 3.210 3.269 3.238 3.289 0.079 18 0 "[ . 1 . 2]" 1
881 1 62 MET H 1 62 MET HB2 . . 2.680 1.973 1.969 1.986 . 0 0 "[ . 1 . 2]" 1
882 1 62 MET H 1 62 MET HB3 . . 3.170 3.207 3.105 3.270 0.100 20 0 "[ . 1 . 2]" 1
883 1 62 MET H 1 62 MET HG2 . . 4.480 3.454 3.365 3.638 . 0 0 "[ . 1 . 2]" 1
884 1 62 MET H 1 62 MET QG . . 3.830 3.282 3.195 3.450 . 0 0 "[ . 1 . 2]" 1
885 1 62 MET H 1 62 MET HG3 . . 4.480 4.126 3.545 4.285 . 0 0 "[ . 1 . 2]" 1
886 1 62 MET H 1 63 LEU H . . 3.110 2.723 2.594 2.813 . 0 0 "[ . 1 . 2]" 1
887 1 62 MET HA 1 62 MET HB2 . . 2.930 2.895 2.838 2.919 . 0 0 "[ . 1 . 2]" 1
888 1 62 MET HA 1 62 MET HB3 . . 2.800 2.911 2.887 2.961 0.161 17 0 "[ . 1 . 2]" 1
889 1 62 MET HA 1 62 MET ME . . 4.170 3.364 2.615 3.508 . 0 0 "[ . 1 . 2]" 1
890 1 62 MET HA 1 62 MET HG2 . . 3.950 2.418 2.001 2.600 . 0 0 "[ . 1 . 2]" 1
891 1 62 MET HA 1 62 MET QG . . 3.430 2.379 1.984 2.541 . 0 0 "[ . 1 . 2]" 1
892 1 62 MET HA 1 62 MET HG3 . . 3.950 3.563 3.257 3.592 . 0 0 "[ . 1 . 2]" 1
893 1 62 MET HA 1 65 ASN H . . 5.040 2.889 2.860 2.927 . 0 0 "[ . 1 . 2]" 1
894 1 62 MET HA 1 65 ASN HA . . 3.110 3.141 3.105 3.171 0.061 7 0 "[ . 1 . 2]" 1
895 1 62 MET HB2 1 63 LEU H . . 3.480 3.208 3.146 3.311 . 0 0 "[ . 1 . 2]" 1
896 1 62 MET ME 2 25 LYS HA . . 6.370 3.176 2.766 3.441 . 0 0 "[ . 1 . 2]" 1
897 1 62 MET ME 2 26 SER H . . 4.540 1.918 1.782 2.102 . 0 0 "[ . 1 . 2]" 1
898 1 62 MET ME 2 26 SER HA . . 5.290 3.549 3.190 3.757 . 0 0 "[ . 1 . 2]" 1
899 1 62 MET ME 2 26 SER QB . . 6.350 1.979 1.798 2.554 . 0 0 "[ . 1 . 2]" 1
900 1 63 LEU H 1 63 LEU HB2 . . 3.210 2.225 2.201 2.294 . 0 0 "[ . 1 . 2]" 1
901 1 63 LEU H 1 63 LEU HB3 . . 3.790 3.490 3.481 3.515 . 0 0 "[ . 1 . 2]" 1
902 1 63 LEU H 1 63 LEU MD1 . . 5.130 2.070 1.904 2.146 . 0 0 "[ . 1 . 2]" 1
903 1 63 LEU H 1 63 LEU HG . . 3.790 3.837 3.702 3.885 0.095 18 0 "[ . 1 . 2]" 1
904 1 63 LEU H 1 64 LYS H . . 3.140 2.538 2.491 2.576 . 0 0 "[ . 1 . 2]" 1
905 1 63 LEU HA 1 64 LYS H . . 3.420 3.444 3.433 3.452 0.032 1 0 "[ . 1 . 2]" 1
906 1 63 LEU MD1 1 64 LYS H . . 6.530 4.071 3.976 4.102 . 0 0 "[ . 1 . 2]" 1
907 1 63 LEU MD1 2 26 SER H . . 6.250 5.106 5.040 5.173 . 0 0 "[ . 1 . 2]" 1
908 1 63 LEU MD2 1 64 LYS H . . 6.530 5.191 5.159 5.228 . 0 0 "[ . 1 . 2]" 1
909 1 63 LEU MD2 2 56 LYS HA . . 6.530 4.341 3.887 4.809 . 0 0 "[ . 1 . 2]" 1
910 1 63 LEU MD2 2 60 GLU H . . 6.530 5.497 5.466 5.529 . 0 0 "[ . 1 . 2]" 1
911 1 64 LYS H 1 64 LYS HB2 . . 3.480 2.668 2.249 3.189 . 0 0 "[ . 1 . 2]" 1
912 1 64 LYS H 1 64 LYS QB . . 3.290 2.250 2.217 2.289 . 0 0 "[ . 1 . 2]" 1
913 1 64 LYS H 1 64 LYS HB3 . . 3.480 2.866 2.301 3.498 0.018 1 0 "[ . 1 . 2]" 1
914 1 64 LYS H 1 64 LYS HG2 . . 4.260 4.105 3.675 4.320 0.060 1 0 "[ . 1 . 2]" 1
915 1 64 LYS H 1 64 LYS HG3 . . 4.260 4.168 3.717 4.300 0.040 14 0 "[ . 1 . 2]" 1
916 1 64 LYS H 1 65 ASN H . . 3.270 2.010 1.980 2.039 . 0 0 "[ . 1 . 2]" 1
917 1 64 LYS HA 1 65 ASN H . . 3.520 3.539 3.468 3.564 0.044 7 0 "[ . 1 . 2]" 1
918 1 64 LYS HA 1 66 GLY H . . 4.350 4.411 4.394 4.422 0.072 2 0 "[ . 1 . 2]" 1
919 1 64 LYS QB 1 65 ASN H . . 4.080 3.045 2.955 3.229 . 0 0 "[ . 1 . 2]" 1
920 1 64 LYS HB2 1 65 ASN H . . 4.880 3.786 3.180 4.294 . 0 0 "[ . 1 . 2]" 1
921 1 64 LYS HB3 1 65 ASN H . . 4.880 3.334 3.060 3.743 . 0 0 "[ . 1 . 2]" 1
922 1 65 ASN H 1 65 ASN HB2 . . 3.520 3.259 3.242 3.270 . 0 0 "[ . 1 . 2]" 1
923 1 65 ASN H 1 65 ASN QB . . 3.250 3.003 2.999 3.008 . 0 0 "[ . 1 . 2]" 1
924 1 65 ASN H 1 65 ASN HB3 . . 3.520 3.517 3.503 3.563 0.043 10 0 "[ . 1 . 2]" 1
925 1 65 ASN H 1 66 GLY H . . 4.690 4.018 3.971 4.032 . 0 0 "[ . 1 . 2]" 1
926 1 65 ASN QB 1 66 GLY H . . 3.170 1.918 1.895 1.930 . 0 0 "[ . 1 . 2]" 1
927 1 65 ASN HB2 1 66 GLY H . . 3.390 3.484 3.480 3.490 0.100 19 0 "[ . 1 . 2]" 1
928 1 65 ASN HB3 1 66 GLY H . . 3.390 1.927 1.904 1.939 . 0 0 "[ . 1 . 2]" 1
929 1 66 GLY QA 1 67 LYS H . . 3.220 2.245 2.169 2.951 . 0 0 "[ . 1 . 2]" 1
930 1 66 GLY HA2 1 67 LYS H . . 3.450 2.492 2.200 3.472 0.022 5 0 "[ . 1 . 2]" 1
931 1 66 GLY HA3 1 67 LYS H . . 3.450 3.052 2.224 3.493 0.043 19 0 "[ . 1 . 2]" 1
932 1 67 LYS H 1 67 LYS HB2 . . 3.450 2.332 2.008 3.380 . 0 0 "[ . 1 . 2]" 1
933 1 67 LYS H 1 67 LYS QB . . 3.250 2.261 1.986 3.050 . 0 0 "[ . 1 . 2]" 1
934 1 67 LYS H 1 67 LYS HB3 . . 3.450 3.282 2.762 3.481 0.031 18 0 "[ . 1 . 2]" 1
935 1 67 LYS HB2 1 68 SER H . . 3.480 3.134 2.497 3.489 0.009 9 0 "[ . 1 . 2]" 1
936 1 67 LYS HB3 1 68 SER H . . 3.480 2.314 1.955 3.232 . 0 0 "[ . 1 . 2]" 1
937 1 68 SER H 1 68 SER HA . . 2.800 2.614 2.170 2.798 . 0 0 "[ . 1 . 2]" 1
938 1 68 SER H 1 69 ASN H . . 3.520 2.861 2.239 3.504 . 0 0 "[ . 1 . 2]" 1
939 1 69 ASN H 1 69 ASN HA . . 2.770 2.534 2.168 2.796 0.026 16 0 "[ . 1 . 2]" 1
940 1 69 ASN H 1 69 ASN HB2 . . 3.860 2.927 2.031 3.873 0.013 16 0 "[ . 1 . 2]" 1
941 1 69 ASN H 1 69 ASN HB3 . . 3.860 3.290 2.361 3.858 . 0 0 "[ . 1 . 2]" 1
942 2 1 THR MG 2 3 LEU H . . 6.530 4.894 3.299 5.545 . 0 0 "[ . 1 . 2]" 1
943 2 2 GLU H 2 2 GLU HB2 . . 2.770 2.673 2.467 2.780 0.010 6 0 "[ . 1 . 2]" 1
944 2 2 GLU H 2 2 GLU HB3 . . 2.770 2.738 2.636 2.769 . 0 0 "[ . 1 . 2]" 1
945 2 2 GLU H 2 3 LEU H . . 3.830 3.706 3.276 3.861 0.031 8 0 "[ . 1 . 2]" 1
946 2 2 GLU HA 2 3 LEU H . . 2.960 2.430 2.324 2.645 . 0 0 "[ . 1 . 2]" 1
947 2 2 GLU HA 2 3 LEU HG . . 5.500 5.256 4.861 5.629 0.129 14 0 "[ . 1 . 2]" 1
948 2 2 GLU QG 2 3 LEU HA . . 5.540 4.479 4.400 4.568 . 0 0 "[ . 1 . 2]" 1
949 2 3 LEU H 2 3 LEU HA . . 2.930 2.933 2.931 2.936 0.006 12 0 "[ . 1 . 2]" 1
950 2 3 LEU H 2 3 LEU QB . . 3.880 2.510 2.401 3.051 . 0 0 "[ . 1 . 2]" 1
951 2 3 LEU H 2 3 LEU MD1 . . 4.200 2.275 1.958 2.915 . 0 0 "[ . 1 . 2]" 1
952 2 3 LEU H 2 3 LEU MD2 . . 5.160 3.963 1.843 4.363 . 0 0 "[ . 1 . 2]" 1
953 2 3 LEU H 2 3 LEU HG . . 4.200 3.568 3.140 3.650 . 0 0 "[ . 1 . 2]" 1
954 2 3 LEU H 2 4 ARG H . . 4.510 4.517 4.473 4.534 0.024 1 0 "[ . 1 . 2]" 1
955 2 3 LEU HA 2 3 LEU MD2 . . 4.200 3.475 3.005 3.554 . 0 0 "[ . 1 . 2]" 1
956 2 3 LEU HA 2 4 ARG H . . 2.560 2.532 2.498 2.628 0.068 6 0 "[ . 1 . 2]" 1
957 2 3 LEU HA 2 30 HIS HB2 . . 4.600 4.199 3.996 4.784 0.184 6 0 "[ . 1 . 2]" 1
958 2 3 LEU HA 2 30 HIS HB3 . . 4.910 4.524 4.308 5.058 0.148 6 0 "[ . 1 . 2]" 1
959 2 3 LEU HA 2 30 HIS HD2 . . 5.500 5.068 4.862 5.581 0.081 8 0 "[ . 1 . 2]" 1
960 2 3 LEU HB2 2 4 ARG H . . 3.610 3.420 2.279 3.637 0.027 10 0 "[ . 1 . 2]" 1
961 2 3 LEU HB3 2 4 ARG H . . 3.610 2.499 2.298 3.261 . 0 0 "[ . 1 . 2]" 1
962 2 3 LEU MD1 2 4 ARG H . . 6.220 4.768 4.587 4.823 . 0 0 "[ . 1 . 2]" 1
963 2 3 LEU MD1 2 30 HIS HB2 . . 6.530 4.131 3.864 4.888 . 0 0 "[ . 1 . 2]" 1
964 2 3 LEU MD1 2 30 HIS HD2 . . 6.160 4.785 4.165 5.240 . 0 0 "[ . 1 . 2]" 1
965 2 3 LEU MD1 2 30 HIS HE1 . . 6.530 4.817 3.768 5.434 . 0 0 "[ . 1 . 2]" 1
966 2 3 LEU MD2 2 4 ARG H . . 5.290 3.805 3.427 3.976 . 0 0 "[ . 1 . 2]" 1
967 2 3 LEU MD2 2 30 HIS HD2 . . 5.190 3.654 2.738 4.066 . 0 0 "[ . 1 . 2]" 1
968 2 3 LEU MD2 2 30 HIS HE1 . . 6.090 4.250 3.108 4.853 . 0 0 "[ . 1 . 2]" 1
969 2 3 LEU HG 2 30 HIS HD2 . . 5.500 5.373 4.346 5.557 0.057 18 0 "[ . 1 . 2]" 1
970 2 4 ARG H 2 4 ARG HB2 . . 3.270 2.884 2.835 2.933 . 0 0 "[ . 1 . 2]" 1
971 2 4 ARG H 2 4 ARG HB3 . . 4.170 3.860 3.840 3.869 . 0 0 "[ . 1 . 2]" 1
972 2 4 ARG H 2 4 ARG QG . . 4.180 2.758 2.526 3.078 . 0 0 "[ . 1 . 2]" 1
973 2 4 ARG H 2 5 CYS H . . 3.920 4.033 3.991 4.055 0.135 1 0 "[ . 1 . 2]" 1
974 2 4 ARG H 2 30 HIS HB2 . . 4.630 3.772 3.589 4.271 . 0 0 "[ . 1 . 2]" 1
975 2 4 ARG H 2 30 HIS HB3 . . 5.500 4.936 4.820 5.329 . 0 0 "[ . 1 . 2]" 1
976 2 4 ARG HA 2 4 ARG HB3 . . 3.020 2.422 2.398 2.439 . 0 0 "[ . 1 . 2]" 1
977 2 4 ARG HA 2 5 CYS H . . 3.420 3.143 3.125 3.174 . 0 0 "[ . 1 . 2]" 1
978 2 4 ARG HA 2 30 HIS HB2 . . 4.760 2.916 2.072 3.082 . 0 0 "[ . 1 . 2]" 1
979 2 4 ARG HA 2 30 HIS HB3 . . 4.660 4.563 3.651 4.724 0.064 17 0 "[ . 1 . 2]" 1
980 2 4 ARG HB2 2 4 ARG HE . . 5.500 4.383 3.525 5.196 . 0 0 "[ . 1 . 2]" 1
981 2 4 ARG HB2 2 5 CYS H . . 2.960 2.084 1.997 2.137 . 0 0 "[ . 1 . 2]" 1
982 2 4 ARG HB3 2 5 CYS H . . 3.140 1.956 1.907 2.030 . 0 0 "[ . 1 . 2]" 1
983 2 4 ARG QD 2 5 CYS H . . 6.380 3.826 3.673 4.367 . 0 0 "[ . 1 . 2]" 1
984 2 4 ARG QG 2 5 CYS H . . 5.110 3.830 3.758 3.860 . 0 0 "[ . 1 . 2]" 1
985 2 5 CYS CB 2 31 CYS SG . . 3.100 3.096 3.024 3.153 0.053 18 0 "[ . 1 . 2]" 1
986 2 5 CYS H 2 5 CYS HB2 . . 3.020 2.363 2.259 2.569 . 0 0 "[ . 1 . 2]" 1
987 2 5 CYS H 2 5 CYS HB3 . . 3.480 3.570 3.522 3.659 0.179 18 0 "[ . 1 . 2]" 1
988 2 5 CYS H 2 6 GLN H . . 5.500 4.560 4.526 4.616 . 0 0 "[ . 1 . 2]" 1
989 2 5 CYS H 2 31 CYS QB . . 5.380 4.010 3.189 4.791 . 0 0 "[ . 1 . 2]" 1
990 2 5 CYS HA 2 5 CYS HB3 . . 2.990 2.563 2.416 2.636 . 0 0 "[ . 1 . 2]" 1
991 2 5 CYS HA 2 6 GLN H . . 3.550 2.447 2.302 2.572 . 0 0 "[ . 1 . 2]" 1
992 2 5 CYS HA 2 7 CYS H . . 4.010 3.864 3.664 4.027 0.017 2 0 "[ . 1 . 2]" 1
993 2 5 CYS HA 2 31 CYS QB . . 6.190 2.858 2.175 3.393 . 0 0 "[ . 1 . 2]" 1
994 2 5 CYS HB2 2 6 GLN H . . 4.420 3.877 3.588 4.161 . 0 0 "[ . 1 . 2]" 1
995 2 5 CYS HB2 2 7 CYS H . . 3.240 3.218 2.892 3.283 0.043 2 0 "[ . 1 . 2]" 1
996 2 5 CYS HB3 2 6 GLN H . . 3.300 2.629 2.318 3.025 . 0 0 "[ . 1 . 2]" 1
997 2 5 CYS HB3 2 7 CYS H . . 3.020 2.219 2.098 2.506 . 0 0 "[ . 1 . 2]" 1
998 2 5 CYS SG 2 31 CYS CB . . 3.100 3.110 3.027 3.198 0.098 18 0 "[ . 1 . 2]" 1
999 2 5 CYS SG 2 31 CYS SG . . 2.100 2.036 1.924 2.110 0.010 12 0 "[ . 1 . 2]" 1
1000 2 6 GLN H 2 6 GLN HB2 . . 3.610 2.476 2.239 2.902 . 0 0 "[ . 1 . 2]" 1
1001 2 6 GLN H 2 6 GLN QB . . 3.300 2.270 2.165 2.368 . 0 0 "[ . 1 . 2]" 1
1002 2 6 GLN H 2 6 GLN HB3 . . 3.610 2.718 2.441 2.973 . 0 0 "[ . 1 . 2]" 1
1003 2 6 GLN H 2 6 GLN QG . . 4.580 3.936 3.818 4.058 . 0 0 "[ . 1 . 2]" 1
1004 2 6 GLN H 2 7 CYS H . . 2.650 2.376 2.071 2.604 . 0 0 "[ . 1 . 2]" 1
1005 2 6 GLN HA 2 6 GLN HE21 . . 5.500 4.729 4.460 4.974 . 0 0 "[ . 1 . 2]" 1
1006 2 6 GLN HA 2 7 CYS H . . 3.300 3.330 3.218 3.361 0.061 18 0 "[ . 1 . 2]" 1
1007 2 6 GLN QB 2 7 CYS H . . 4.230 3.433 3.376 3.601 . 0 0 "[ . 1 . 2]" 1
1008 2 6 GLN HB2 2 6 GLN HE21 . . 4.760 2.776 2.270 3.340 . 0 0 "[ . 1 . 2]" 1
1009 2 6 GLN HB2 2 7 CYS H . . 4.450 4.230 4.043 4.413 . 0 0 "[ . 1 . 2]" 1
1010 2 6 GLN HB3 2 6 GLN HE21 . . 4.760 2.502 2.014 3.216 . 0 0 "[ . 1 . 2]" 1
1011 2 6 GLN HB3 2 7 CYS H . . 4.450 3.636 3.552 3.887 . 0 0 "[ . 1 . 2]" 1
1012 2 6 GLN HE21 2 25 LYS QD . . 6.380 5.044 4.696 5.593 . 0 0 "[ . 1 . 2]" 1
1013 2 6 GLN HE21 2 25 LYS QG . . 6.380 3.730 3.252 4.321 . 0 0 "[ . 1 . 2]" 1
1014 2 6 GLN HE21 2 37 ILE MG . . 6.530 5.036 4.246 5.334 . 0 0 "[ . 1 . 2]" 1
1015 2 6 GLN HE22 2 25 LYS QG . . 6.380 4.705 3.617 5.253 . 0 0 "[ . 1 . 2]" 1
1016 2 6 GLN HE22 2 37 ILE MG . . 6.530 3.998 3.317 5.083 . 0 0 "[ . 1 . 2]" 1
1017 2 6 GLN QG 2 7 CYS H . . 5.380 4.544 4.156 4.717 . 0 0 "[ . 1 . 2]" 1
1018 2 7 CYS CB 2 47 CYS SG . . 3.100 3.055 2.968 3.221 0.121 7 0 "[ . 1 . 2]" 1
1019 2 7 CYS H 2 7 CYS HB2 . . 2.740 2.769 2.475 2.838 0.098 13 0 "[ . 1 . 2]" 1
1020 2 7 CYS H 2 7 CYS HB3 . . 3.420 3.364 3.284 3.486 0.066 16 0 "[ . 1 . 2]" 1
1021 2 7 CYS H 2 8 LEU H . . 4.420 4.237 4.111 4.301 . 0 0 "[ . 1 . 2]" 1
1022 2 7 CYS HA 2 7 CYS HB3 . . 2.830 2.876 2.778 2.916 0.086 17 0 "[ . 1 . 2]" 1
1023 2 7 CYS HA 2 8 LEU H . . 2.740 2.260 2.221 2.292 . 0 0 "[ . 1 . 2]" 1
1024 2 7 CYS HA 2 9 GLN H . . 3.580 3.581 3.495 3.624 0.044 6 0 "[ . 1 . 2]" 1
1025 2 7 CYS HB2 2 8 LEU H . . 4.720 4.486 4.414 4.619 . 0 0 "[ . 1 . 2]" 1
1026 2 7 CYS HB2 2 10 THR MG . . 5.570 4.058 3.822 4.288 . 0 0 "[ . 1 . 2]" 1
1027 2 7 CYS HB3 2 8 LEU H . . 3.890 3.610 3.466 3.796 . 0 0 "[ . 1 . 2]" 1
1028 2 7 CYS HB3 2 10 THR MG . . 4.640 2.975 2.786 3.156 . 0 0 "[ . 1 . 2]" 1
1029 2 7 CYS SG 2 47 CYS CB . . 3.100 3.134 3.056 3.171 0.071 13 0 "[ . 1 . 2]" 1
1030 2 7 CYS SG 2 47 CYS SG . . 2.100 1.936 1.870 1.990 . 0 0 "[ . 1 . 2]" 1
1031 2 8 LEU H 2 8 LEU HA . . 2.830 2.919 2.894 2.935 0.105 6 0 "[ . 1 . 2]" 1
1032 2 8 LEU H 2 8 LEU QB . . 3.650 2.603 2.530 2.642 . 0 0 "[ . 1 . 2]" 1
1033 2 8 LEU H 2 8 LEU MD1 . . 5.500 3.319 3.212 3.473 . 0 0 "[ . 1 . 2]" 1
1034 2 8 LEU H 2 8 LEU MD2 . . 5.810 3.681 3.564 3.772 . 0 0 "[ . 1 . 2]" 1
1035 2 8 LEU H 2 8 LEU HG . . 3.020 2.288 2.142 2.431 . 0 0 "[ . 1 . 2]" 1
1036 2 8 LEU H 2 9 GLN H . . 2.650 2.097 1.962 2.240 . 0 0 "[ . 1 . 2]" 1
1037 2 8 LEU HA 2 8 LEU MD2 . . 3.740 2.482 2.289 2.631 . 0 0 "[ . 1 . 2]" 1
1038 2 8 LEU HA 2 8 LEU HG . . 3.050 3.041 3.019 3.060 0.010 13 0 "[ . 1 . 2]" 1
1039 2 8 LEU HA 2 9 GLN H . . 3.480 3.455 3.430 3.520 0.040 16 0 "[ . 1 . 2]" 1
1040 2 8 LEU QB 2 9 GLN H . . 3.800 3.230 3.032 3.294 . 0 0 "[ . 1 . 2]" 1
1041 2 8 LEU HG 2 9 GLN H . . 4.230 4.220 4.162 4.240 0.010 6 0 "[ . 1 . 2]" 1
1042 2 9 GLN H 2 9 GLN HB2 . . 3.360 2.935 2.738 3.080 . 0 0 "[ . 1 . 2]" 1
1043 2 9 GLN H 2 9 GLN HB3 . . 3.050 2.967 2.822 3.080 0.030 3 0 "[ . 1 . 2]" 1
1044 2 9 GLN H 2 9 GLN QG . . 4.700 4.153 4.109 4.231 . 0 0 "[ . 1 . 2]" 1
1045 2 9 GLN H 2 10 THR H . . 4.690 4.438 4.404 4.458 . 0 0 "[ . 1 . 2]" 1
1046 2 9 GLN H 2 10 THR MG . . 5.660 3.831 3.713 3.909 . 0 0 "[ . 1 . 2]" 1
1047 2 9 GLN HA 2 9 GLN HB2 . . 3.020 2.645 2.558 2.739 . 0 0 "[ . 1 . 2]" 1
1048 2 9 GLN HA 2 10 THR H . . 3.420 2.577 2.516 2.677 . 0 0 "[ . 1 . 2]" 1
1049 2 9 GLN HA 2 10 THR MG . . 6.400 3.573 3.346 3.702 . 0 0 "[ . 1 . 2]" 1
1050 2 9 GLN HB2 2 10 THR H . . 3.890 3.929 3.811 3.973 0.083 1 0 "[ . 1 . 2]" 1
1051 2 9 GLN HB3 2 10 THR H . . 3.390 3.152 2.893 3.415 0.025 17 0 "[ . 1 . 2]" 1
1052 2 9 GLN QG 2 10 THR H . . 5.420 1.917 1.815 2.088 . 0 0 "[ . 1 . 2]" 1
1053 2 10 THR H 2 10 THR MG . . 4.200 3.348 3.210 3.417 . 0 0 "[ . 1 . 2]" 1
1054 2 10 THR HA 2 10 THR HB . . 2.650 2.640 2.584 2.676 0.026 13 0 "[ . 1 . 2]" 1
1055 2 10 THR HA 2 11 LEU H . . 2.520 2.447 2.390 2.460 . 0 0 "[ . 1 . 2]" 1
1056 2 10 THR HA 2 47 CYS H . . 4.230 4.144 3.892 4.252 0.022 13 0 "[ . 1 . 2]" 1
1057 2 10 THR HA 2 47 CYS HA . . 4.230 4.312 4.095 4.378 0.148 1 0 "[ . 1 . 2]" 1
1058 2 10 THR HA 2 47 CYS HB2 . . 4.320 2.810 2.507 2.929 . 0 0 "[ . 1 . 2]" 1
1059 2 10 THR HA 2 47 CYS HB3 . . 3.980 2.007 1.963 2.305 . 0 0 "[ . 1 . 2]" 1
1060 2 10 THR HB 2 11 LEU H . . 2.680 2.581 2.531 2.694 0.014 16 0 "[ . 1 . 2]" 1
1061 2 10 THR HB 2 47 CYS HB3 . . 4.200 3.730 3.493 4.020 . 0 0 "[ . 1 . 2]" 1
1062 2 10 THR HB 2 48 LEU HA . . 3.580 3.365 3.260 3.623 0.043 16 0 "[ . 1 . 2]" 1
1063 2 10 THR HB 2 49 ASN H . . 3.950 3.289 3.075 3.581 . 0 0 "[ . 1 . 2]" 1
1064 2 10 THR HB 2 49 ASN HB2 . . 3.670 2.897 2.641 3.073 . 0 0 "[ . 1 . 2]" 1
1065 2 10 THR HB 2 49 ASN HB3 . . 4.420 4.267 4.078 4.438 0.018 16 0 "[ . 1 . 2]" 1
1066 2 10 THR MG 2 11 LEU H . . 4.640 3.567 3.464 3.747 . 0 0 "[ . 1 . 2]" 1
1067 2 10 THR MG 2 47 CYS H . . 6.160 4.945 4.928 4.976 . 0 0 "[ . 1 . 2]" 1
1068 2 10 THR MG 2 47 CYS HA . . 6.530 3.954 3.763 4.163 . 0 0 "[ . 1 . 2]" 1
1069 2 10 THR MG 2 47 CYS HB2 . . 4.510 3.466 3.243 3.519 . 0 0 "[ . 1 . 2]" 1
1070 2 10 THR MG 2 47 CYS HB3 . . 4.390 1.950 1.925 1.982 . 0 0 "[ . 1 . 2]" 1
1071 2 10 THR MG 2 48 LEU H . . 5.750 3.370 3.093 3.686 . 0 0 "[ . 1 . 2]" 1
1072 2 10 THR MG 2 48 LEU HA . . 5.230 4.091 3.894 4.307 . 0 0 "[ . 1 . 2]" 1
1073 2 10 THR MG 2 49 ASN H . . 5.720 4.419 4.209 4.614 . 0 0 "[ . 1 . 2]" 1
1074 2 10 THR MG 2 49 ASN HB2 . . 6.310 4.261 4.080 4.450 . 0 0 "[ . 1 . 2]" 1
1075 2 10 THR MG 2 50 PRO HD3 . . 6.530 2.588 2.233 2.883 . 0 0 "[ . 1 . 2]" 1
1076 2 11 LEU H 2 11 LEU QB . . 3.710 2.431 2.313 2.622 . 0 0 "[ . 1 . 2]" 1
1077 2 11 LEU H 2 11 LEU HG . . 2.900 2.839 2.646 2.923 0.023 4 0 "[ . 1 . 2]" 1
1078 2 11 LEU H 2 12 GLN H . . 4.450 4.495 4.274 4.572 0.122 1 0 "[ . 1 . 2]" 1
1079 2 11 LEU H 2 46 ALA MB . . 6.530 5.122 4.997 5.205 . 0 0 "[ . 1 . 2]" 1
1080 2 11 LEU H 2 47 CYS H . . 5.500 4.731 4.482 4.988 . 0 0 "[ . 1 . 2]" 1
1081 2 11 LEU H 2 47 CYS HB3 . . 5.500 3.636 3.462 4.150 . 0 0 "[ . 1 . 2]" 1
1082 2 11 LEU H 2 48 LEU H . . 4.760 3.882 3.778 4.065 . 0 0 "[ . 1 . 2]" 1
1083 2 11 LEU H 2 48 LEU HA . . 2.900 1.976 1.929 2.033 . 0 0 "[ . 1 . 2]" 1
1084 2 11 LEU H 2 48 LEU MD1 . . 6.500 5.462 5.425 5.494 . 0 0 "[ . 1 . 2]" 1
1085 2 11 LEU H 2 48 LEU MD2 . . 4.920 3.490 3.332 3.629 . 0 0 "[ . 1 . 2]" 1
1086 2 11 LEU H 2 49 ASN H . . 4.070 3.449 3.272 3.639 . 0 0 "[ . 1 . 2]" 1
1087 2 11 LEU HA 2 12 GLN H . . 3.080 2.529 2.214 2.895 . 0 0 "[ . 1 . 2]" 1
1088 2 11 LEU QB 2 12 GLN H . . 4.080 2.373 1.893 3.125 . 0 0 "[ . 1 . 2]" 1
1089 2 11 LEU QD 2 12 GLN H . . 6.860 3.297 3.030 3.615 . 0 0 "[ . 1 . 2]" 1
1090 2 11 LEU QD 2 14 ILE H . . 7.630 3.906 3.518 4.785 . 0 0 "[ . 1 . 2]" 1
1091 2 11 LEU QD 2 47 CYS H . . 7.230 2.721 2.206 3.395 . 0 0 "[ . 1 . 2]" 1
1092 2 11 LEU HG 2 12 GLN H . . 4.880 4.718 4.554 4.910 0.030 7 0 "[ . 1 . 2]" 1
1093 2 11 LEU HG 2 47 CYS H . . 5.500 3.814 3.545 4.171 . 0 0 "[ . 1 . 2]" 1
1094 2 12 GLN H 2 12 GLN HB2 . . 3.210 3.034 2.758 3.223 0.013 17 0 "[ . 1 . 2]" 1
1095 2 12 GLN H 2 12 GLN HB3 . . 2.770 2.300 2.209 2.418 . 0 0 "[ . 1 . 2]" 1
1096 2 12 GLN H 2 12 GLN QG . . 4.490 3.857 3.773 4.085 . 0 0 "[ . 1 . 2]" 1
1097 2 12 GLN H 2 13 GLY H . . 3.610 2.370 1.935 3.627 0.017 9 0 "[ . 1 . 2]" 1
1098 2 12 GLN H 2 48 LEU MD2 . . 6.530 4.434 3.812 5.176 . 0 0 "[ . 1 . 2]" 1
1099 2 12 GLN HA 2 12 GLN HB2 . . 2.870 2.359 2.345 2.379 . 0 0 "[ . 1 . 2]" 1
1100 2 12 GLN HA 2 12 GLN HB3 . . 2.930 3.023 3.015 3.031 0.101 16 0 "[ . 1 . 2]" 1
1101 2 12 GLN HA 2 12 GLN HE22 . . 5.500 5.270 4.649 5.555 0.055 16 0 "[ . 1 . 2]" 1
1102 2 12 GLN HA 2 13 GLY H . . 3.420 3.321 2.460 3.441 0.021 7 0 "[ . 1 . 2]" 1
1103 2 12 GLN HA 2 48 LEU MD2 . . 6.530 4.717 4.423 5.062 . 0 0 "[ . 1 . 2]" 1
1104 2 12 GLN HA 2 49 ASN H . . 3.790 3.725 3.482 3.837 0.047 16 0 "[ . 1 . 2]" 1
1105 2 12 GLN HA 2 49 ASN HB2 . . 5.500 3.284 2.923 3.474 . 0 0 "[ . 1 . 2]" 1
1106 2 12 GLN HA 2 49 ASN HB3 . . 5.500 3.248 2.930 3.712 . 0 0 "[ . 1 . 2]" 1
1107 2 12 GLN HA 2 52 SER QB . . 6.040 3.328 3.032 3.678 . 0 0 "[ . 1 . 2]" 1
1108 2 13 GLY H 2 14 ILE H . . 3.270 3.091 2.307 3.305 0.035 17 0 "[ . 1 . 2]" 1
1109 2 13 GLY H 2 48 LEU MD2 . . 5.440 3.024 2.342 3.540 . 0 0 "[ . 1 . 2]" 1
1110 2 13 GLY QA 2 14 ILE H . . 3.230 2.323 2.213 2.828 . 0 0 "[ . 1 . 2]" 1
1111 2 13 GLY QA 2 48 LEU MD2 . . 5.820 2.397 1.832 3.865 . 0 0 "[ . 1 . 2]" 1
1112 2 13 GLY QA 2 58 ILE MG . . 6.630 3.898 3.515 4.522 . 0 0 "[ . 1 . 2]" 1
1113 2 13 GLY HA2 2 14 ILE H . . 3.480 3.410 2.898 3.528 0.048 18 0 "[ . 1 . 2]" 1
1114 2 13 GLY HA3 2 14 ILE H . . 3.480 2.466 2.239 3.616 0.136 5 0 "[ . 1 . 2]" 1
1115 2 14 ILE H 2 14 ILE HB . . 3.360 2.371 2.128 3.295 . 0 0 "[ . 1 . 2]" 1
1116 2 14 ILE H 2 14 ILE MD . . 5.230 3.931 3.266 4.439 . 0 0 "[ . 1 . 2]" 1
1117 2 14 ILE H 2 14 ILE HG12 . . 4.420 3.580 2.767 4.325 . 0 0 "[ . 1 . 2]" 1
1118 2 14 ILE H 2 14 ILE QG . . 3.840 3.002 2.732 3.351 . 0 0 "[ . 1 . 2]" 1
1119 2 14 ILE H 2 14 ILE HG13 . . 4.420 3.612 2.868 4.364 . 0 0 "[ . 1 . 2]" 1
1120 2 14 ILE H 2 14 ILE MG . . 4.730 3.604 3.502 4.055 . 0 0 "[ . 1 . 2]" 1
1121 2 14 ILE H 2 15 HIS H . . 4.690 4.565 4.473 4.634 . 0 0 "[ . 1 . 2]" 1
1122 2 14 ILE H 2 54 MET QG . . 6.380 5.437 4.608 5.737 . 0 0 "[ . 1 . 2]" 1
1123 2 14 ILE H 2 58 ILE MD . . 4.820 2.894 1.921 3.591 . 0 0 "[ . 1 . 2]" 1
1124 2 14 ILE HA 2 14 ILE HB . . 2.900 2.975 2.969 2.987 0.087 10 0 "[ . 1 . 2]" 1
1125 2 14 ILE HA 2 14 ILE QG . . 3.910 2.378 2.119 2.717 . 0 0 "[ . 1 . 2]" 1
1126 2 14 ILE HA 2 15 HIS H . . 2.740 2.439 2.367 2.483 . 0 0 "[ . 1 . 2]" 1
1127 2 14 ILE HB 2 15 HIS H . . 4.140 3.983 3.902 4.107 . 0 0 "[ . 1 . 2]" 1
1128 2 14 ILE QG 2 15 HIS H . . 4.710 3.793 3.392 4.202 . 0 0 "[ . 1 . 2]" 1
1129 2 14 ILE HG12 2 15 HIS H . . 4.910 4.069 3.504 4.713 . 0 0 "[ . 1 . 2]" 1
1130 2 14 ILE HG13 2 15 HIS H . . 4.910 4.656 4.233 4.826 . 0 0 "[ . 1 . 2]" 1
1131 2 14 ILE MG 2 15 HIS H . . 4.510 1.901 1.845 2.006 . 0 0 "[ . 1 . 2]" 1
1132 2 15 HIS H 2 15 HIS HB2 . . 3.300 2.040 2.025 2.079 . 0 0 "[ . 1 . 2]" 1
1133 2 15 HIS H 2 15 HIS HB3 . . 2.990 3.013 2.943 3.043 0.053 7 0 "[ . 1 . 2]" 1
1134 2 15 HIS H 2 15 HIS HD2 . . 5.500 4.939 4.397 5.283 . 0 0 "[ . 1 . 2]" 1
1135 2 15 HIS HA 2 15 HIS HB2 . . 2.830 2.734 2.687 2.750 . 0 0 "[ . 1 . 2]" 1
1136 2 15 HIS HA 2 15 HIS HD2 . . 3.360 2.664 2.011 3.280 . 0 0 "[ . 1 . 2]" 1
1137 2 15 HIS HA 2 16 LEU H . . 2.930 2.266 2.202 2.346 . 0 0 "[ . 1 . 2]" 1
1138 2 15 HIS HB2 2 17 LYS H . . 3.980 4.054 3.951 4.207 0.227 7 0 "[ . 1 . 2]" 1
1139 2 15 HIS HB2 2 17 LYS QG . . 6.070 4.709 3.216 5.461 . 0 0 "[ . 1 . 2]" 1
1140 2 15 HIS HB2 2 18 ASN H . . 5.500 4.800 4.415 5.307 . 0 0 "[ . 1 . 2]" 1
1141 2 15 HIS HB2 2 18 ASN HD21 . . 5.500 4.054 3.734 4.342 . 0 0 "[ . 1 . 2]" 1
1142 2 15 HIS HB2 2 18 ASN HD22 . . 5.500 5.431 5.048 5.522 0.022 19 0 "[ . 1 . 2]" 1
1143 2 15 HIS HB3 2 15 HIS HD2 . . 3.920 3.386 3.034 3.846 . 0 0 "[ . 1 . 2]" 1
1144 2 15 HIS HB3 2 17 LYS H . . 4.760 2.468 2.315 2.672 . 0 0 "[ . 1 . 2]" 1
1145 2 16 LEU H 2 16 LEU HA . . 2.830 2.885 2.765 2.921 0.091 5 0 "[ . 1 . 2]" 1
1146 2 16 LEU H 2 16 LEU HB2 . . 3.730 2.650 2.361 2.891 . 0 0 "[ . 1 . 2]" 1
1147 2 16 LEU H 2 16 LEU HB3 . . 3.020 2.426 2.091 2.752 . 0 0 "[ . 1 . 2]" 1
1148 2 16 LEU H 2 16 LEU HG . . 5.500 4.396 4.113 4.689 . 0 0 "[ . 1 . 2]" 1
1149 2 16 LEU H 2 19 ILE MD . . 6.530 4.329 3.756 4.873 . 0 0 "[ . 1 . 2]" 1
1150 2 16 LEU HA 2 16 LEU HB2 . . 2.680 2.451 2.255 2.636 . 0 0 "[ . 1 . 2]" 1
1151 2 16 LEU HA 2 16 LEU MD1 . . 4.140 2.366 1.868 3.190 . 0 0 "[ . 1 . 2]" 1
1152 2 16 LEU HA 2 16 LEU MD2 . . 4.570 3.377 1.843 3.971 . 0 0 "[ . 1 . 2]" 1
1153 2 16 LEU HA 2 16 LEU HG . . 3.640 3.297 2.745 3.676 0.036 15 0 "[ . 1 . 2]" 1
1154 2 16 LEU HA 2 19 ILE MD . . 4.050 2.462 2.034 3.024 . 0 0 "[ . 1 . 2]" 1
1155 2 16 LEU HA 2 19 ILE MG . . 4.360 3.595 3.508 3.661 . 0 0 "[ . 1 . 2]" 1
1156 2 16 LEU HA 2 58 ILE MG . . 4.260 3.036 2.781 3.256 . 0 0 "[ . 1 . 2]" 1
1157 2 16 LEU HB2 2 58 ILE HA . . 4.010 3.375 3.099 3.764 . 0 0 "[ . 1 . 2]" 1
1158 2 16 LEU HB3 2 58 ILE HA . . 4.570 4.593 4.440 4.725 0.155 15 0 "[ . 1 . 2]" 1
1159 2 16 LEU MD1 2 19 ILE H . . 5.470 3.942 3.299 4.439 . 0 0 "[ . 1 . 2]" 1
1160 2 16 LEU MD1 2 58 ILE HA . . 5.320 3.775 1.978 4.553 . 0 0 "[ . 1 . 2]" 1
1161 2 16 LEU MD1 2 62 MET HG2 . . 5.690 1.882 1.759 2.277 . 0 0 "[ . 1 . 2]" 1
1162 2 16 LEU MD1 2 62 MET QG . . 5.290 1.861 1.742 2.260 . 0 0 "[ . 1 . 2]" 1
1163 2 16 LEU MD1 2 62 MET HG3 . . 5.690 3.056 2.198 3.798 . 0 0 "[ . 1 . 2]" 1
1164 2 17 LYS H 2 17 LYS QG . . 4.860 2.914 2.092 3.795 . 0 0 "[ . 1 . 2]" 1
1165 2 17 LYS H 2 18 ASN H . . 3.890 2.275 2.118 2.788 . 0 0 "[ . 1 . 2]" 1
1166 2 17 LYS HA 2 17 LYS QD . . 4.890 2.968 2.142 4.268 . 0 0 "[ . 1 . 2]" 1
1167 2 17 LYS HA 2 18 ASN H . . 3.480 3.448 3.346 3.511 0.031 20 0 "[ . 1 . 2]" 1
1168 2 17 LYS QB 2 18 ASN H . . 4.210 3.446 3.069 3.827 . 0 0 "[ . 1 . 2]" 1
1169 2 17 LYS QD 2 18 ASN H . . 6.250 4.823 3.744 5.535 . 0 0 "[ . 1 . 2]" 1
1170 2 17 LYS QG 2 18 ASN H . . 5.850 3.595 2.294 4.545 . 0 0 "[ . 1 . 2]" 1
1171 2 18 ASN H 2 18 ASN HB2 . . 2.900 2.217 2.125 2.325 . 0 0 "[ . 1 . 2]" 1
1172 2 18 ASN H 2 18 ASN HB3 . . 3.390 3.362 3.295 3.474 0.084 19 0 "[ . 1 . 2]" 1
1173 2 18 ASN H 2 18 ASN HD21 . . 5.500 3.711 3.278 4.125 . 0 0 "[ . 1 . 2]" 1
1174 2 18 ASN H 2 18 ASN HD22 . . 5.500 4.960 4.595 5.333 . 0 0 "[ . 1 . 2]" 1
1175 2 18 ASN H 2 19 ILE H . . 2.430 2.119 1.899 2.278 . 0 0 "[ . 1 . 2]" 1
1176 2 18 ASN H 2 19 ILE MD . . 5.190 3.965 3.485 4.127 . 0 0 "[ . 1 . 2]" 1
1177 2 18 ASN HA 2 40 LEU MD2 . . 6.530 2.950 2.686 3.287 . 0 0 "[ . 1 . 2]" 1
1178 2 18 ASN HA 2 41 LYS H . . 4.070 3.719 3.538 4.071 0.001 15 0 "[ . 1 . 2]" 1
1179 2 18 ASN HB2 2 18 ASN HD21 . . 3.300 2.113 2.102 2.148 . 0 0 "[ . 1 . 2]" 1
1180 2 18 ASN HB2 2 40 LEU MD2 . . 4.610 3.317 3.217 3.491 . 0 0 "[ . 1 . 2]" 1
1181 2 18 ASN HB2 2 41 LYS H . . 5.500 5.202 5.079 5.498 . 0 0 "[ . 1 . 2]" 1
1182 2 18 ASN HB3 2 19 ILE H . . 4.140 3.121 2.827 3.380 . 0 0 "[ . 1 . 2]" 1
1183 2 18 ASN HB3 2 40 LEU HA . . 5.500 3.812 3.642 4.139 . 0 0 "[ . 1 . 2]" 1
1184 2 18 ASN HB3 2 40 LEU MD2 . . 4.760 1.918 1.842 2.095 . 0 0 "[ . 1 . 2]" 1
1185 2 18 ASN HB3 2 41 LYS H . . 4.260 3.726 3.585 4.019 . 0 0 "[ . 1 . 2]" 1
1186 2 18 ASN HD21 2 40 LEU MD1 . . 6.530 4.796 4.170 5.282 . 0 0 "[ . 1 . 2]" 1
1187 2 18 ASN HD21 2 40 LEU MD2 . . 5.570 3.955 3.506 4.358 . 0 0 "[ . 1 . 2]" 1
1188 2 19 ILE H 2 19 ILE HA . . 2.800 2.760 2.710 2.821 0.021 17 0 "[ . 1 . 2]" 1
1189 2 19 ILE H 2 19 ILE HB . . 2.740 2.130 2.055 2.287 . 0 0 "[ . 1 . 2]" 1
1190 2 19 ILE H 2 19 ILE MD . . 3.710 2.774 2.302 2.994 . 0 0 "[ . 1 . 2]" 1
1191 2 19 ILE H 2 19 ILE QG . . 3.710 2.902 2.638 3.232 . 0 0 "[ . 1 . 2]" 1
1192 2 19 ILE H 2 19 ILE MG . . 4.230 3.569 3.483 3.673 . 0 0 "[ . 1 . 2]" 1
1193 2 19 ILE H 2 20 GLN H . . 4.600 4.602 4.578 4.637 0.037 10 0 "[ . 1 . 2]" 1
1194 2 19 ILE H 2 40 LEU HA . . 4.760 4.587 4.433 4.783 0.023 10 0 "[ . 1 . 2]" 1
1195 2 19 ILE HA 2 19 ILE MD . . 4.260 3.580 3.370 3.678 . 0 0 "[ . 1 . 2]" 1
1196 2 19 ILE HA 2 19 ILE QG . . 3.520 2.089 1.981 2.212 . 0 0 "[ . 1 . 2]" 1
1197 2 19 ILE HA 2 20 GLN H . . 2.400 2.209 2.194 2.244 . 0 0 "[ . 1 . 2]" 1
1198 2 19 ILE HA 2 40 LEU HA . . 2.460 2.468 2.411 2.525 0.065 15 0 "[ . 1 . 2]" 1
1199 2 19 ILE HA 2 40 LEU MD1 . . 6.530 4.993 4.845 5.226 . 0 0 "[ . 1 . 2]" 1
1200 2 19 ILE HA 2 40 LEU MD2 . . 4.760 3.740 3.694 3.920 . 0 0 "[ . 1 . 2]" 1
1201 2 19 ILE MD 2 58 ILE HA . . 6.190 5.046 4.810 5.120 . 0 0 "[ . 1 . 2]" 1
1202 2 19 ILE QG 2 20 GLN H . . 4.760 3.711 3.505 4.003 . 0 0 "[ . 1 . 2]" 1
1203 2 19 ILE MG 2 20 GLN H . . 4.080 2.682 2.533 2.837 . 0 0 "[ . 1 . 2]" 1
1204 2 19 ILE MG 2 20 GLN HA . . 6.370 3.503 3.422 3.658 . 0 0 "[ . 1 . 2]" 1
1205 2 19 ILE MG 2 21 SER H . . 4.700 2.417 2.167 2.654 . 0 0 "[ . 1 . 2]" 1
1206 2 19 ILE MG 2 21 SER QB . . 7.400 4.531 4.371 4.668 . 0 0 "[ . 1 . 2]" 1
1207 2 20 GLN H 2 20 GLN HB2 . . 2.930 2.535 2.450 2.618 . 0 0 "[ . 1 . 2]" 1
1208 2 20 GLN H 2 20 GLN HB3 . . 3.730 2.990 2.869 3.054 . 0 0 "[ . 1 . 2]" 1
1209 2 20 GLN H 2 20 GLN QG . . 5.040 4.002 3.935 4.069 . 0 0 "[ . 1 . 2]" 1
1210 2 20 GLN H 2 21 SER H . . 2.560 1.900 1.863 2.072 . 0 0 "[ . 1 . 2]" 1
1211 2 20 GLN H 2 39 THR H . . 4.290 4.059 3.983 4.115 . 0 0 "[ . 1 . 2]" 1
1212 2 20 GLN H 2 39 THR HB . . 5.190 3.885 3.453 4.321 . 0 0 "[ . 1 . 2]" 1
1213 2 20 GLN H 2 40 LEU HA . . 2.870 2.907 2.882 2.942 0.072 14 0 "[ . 1 . 2]" 1
1214 2 20 GLN H 2 41 LYS H . . 3.860 3.738 3.581 3.915 0.055 17 0 "[ . 1 . 2]" 1
1215 2 20 GLN HA 2 20 GLN HB3 . . 2.900 2.984 2.963 3.006 0.106 17 0 "[ . 1 . 2]" 1
1216 2 20 GLN HA 2 20 GLN HE21 . . 5.160 3.744 2.729 4.521 . 0 0 "[ . 1 . 2]" 1
1217 2 20 GLN HA 2 20 GLN HE22 . . 5.380 4.760 4.268 5.182 . 0 0 "[ . 1 . 2]" 1
1218 2 20 GLN HA 2 21 SER H . . 3.450 3.503 3.462 3.517 0.067 15 0 "[ . 1 . 2]" 1
1219 2 20 GLN HA 2 41 LYS QG . . 6.380 4.503 3.289 5.459 . 0 0 "[ . 1 . 2]" 1
1220 2 20 GLN HA 2 62 MET ME . . 5.630 4.224 3.615 4.617 . 0 0 "[ . 1 . 2]" 1
1221 2 20 GLN HB2 2 40 LEU HA . . 3.670 3.636 3.530 3.695 0.025 15 0 "[ . 1 . 2]" 1
1222 2 20 GLN HB3 2 21 SER H . . 3.830 3.254 3.164 3.392 . 0 0 "[ . 1 . 2]" 1
1223 2 20 GLN HB3 2 40 LEU HA . . 5.340 4.764 4.574 4.927 . 0 0 "[ . 1 . 2]" 1
1224 2 20 GLN HE21 2 39 THR MG . . 6.530 4.413 3.522 5.201 . 0 0 "[ . 1 . 2]" 1
1225 2 20 GLN HE22 2 21 SER QB . . 6.380 4.711 3.974 5.238 . 0 0 "[ . 1 . 2]" 1
1226 2 20 GLN HE22 2 39 THR MG . . 6.530 5.050 4.531 5.262 . 0 0 "[ . 1 . 2]" 1
1227 2 20 GLN QG 2 21 SER H . . 5.480 4.708 4.583 4.830 . 0 0 "[ . 1 . 2]" 1
1228 2 20 GLN QG 2 21 SER HA . . 6.380 5.534 5.198 5.750 . 0 0 "[ . 1 . 2]" 1
1229 2 20 GLN QG 2 41 LYS HA . . 4.860 2.311 2.035 2.589 . 0 0 "[ . 1 . 2]" 1
1230 2 21 SER H 2 21 SER QB . . 3.800 3.190 3.098 3.364 . 0 0 "[ . 1 . 2]" 1
1231 2 21 SER H 2 38 ALA HA . . 4.570 4.526 4.291 4.603 0.033 16 0 "[ . 1 . 2]" 1
1232 2 21 SER H 2 38 ALA MB . . 6.000 4.013 3.492 4.367 . 0 0 "[ . 1 . 2]" 1
1233 2 21 SER H 2 39 THR H . . 2.870 2.883 2.816 2.919 0.049 18 0 "[ . 1 . 2]" 1
1234 2 21 SER H 2 39 THR HB . . 3.420 2.806 2.347 3.296 . 0 0 "[ . 1 . 2]" 1
1235 2 21 SER H 2 39 THR MG . . 5.070 3.804 3.461 4.172 . 0 0 "[ . 1 . 2]" 1
1236 2 21 SER H 2 40 LEU HA . . 4.660 4.477 4.385 4.684 0.024 17 0 "[ . 1 . 2]" 1
1237 2 21 SER HA 2 22 VAL H . . 2.460 2.484 2.413 2.527 0.067 17 0 "[ . 1 . 2]" 1
1238 2 21 SER HA 2 39 THR HB . . 5.500 4.179 3.857 4.541 . 0 0 "[ . 1 . 2]" 1
1239 2 21 SER HA 2 62 MET ME . . 3.990 1.936 1.760 2.166 . 0 0 "[ . 1 . 2]" 1
1240 2 21 SER QB 2 22 VAL H . . 3.060 2.631 2.522 2.774 . 0 0 "[ . 1 . 2]" 1
1241 2 21 SER QB 2 22 VAL HA . . 5.110 3.986 3.943 4.023 . 0 0 "[ . 1 . 2]" 1
1242 2 21 SER HB2 2 22 VAL H . . 3.450 3.014 2.657 3.384 . 0 0 "[ . 1 . 2]" 1
1243 2 21 SER HB3 2 22 VAL H . . 3.450 2.939 2.743 3.148 . 0 0 "[ . 1 . 2]" 1
1244 2 22 VAL H 2 22 VAL HB . . 3.450 2.547 2.493 2.619 . 0 0 "[ . 1 . 2]" 1
1245 2 22 VAL H 2 22 VAL MG1 . . 4.610 3.735 3.691 3.790 . 0 0 "[ . 1 . 2]" 1
1246 2 22 VAL H 2 22 VAL MG2 . . 4.540 3.077 2.997 3.151 . 0 0 "[ . 1 . 2]" 1
1247 2 22 VAL H 2 23 LYS H . . 4.320 4.367 4.328 4.429 0.109 19 0 "[ . 1 . 2]" 1
1248 2 22 VAL H 2 62 MET ME . . 4.110 2.853 2.533 3.088 . 0 0 "[ . 1 . 2]" 1
1249 2 22 VAL HA 2 23 LYS H . . 2.830 2.231 2.207 2.280 . 0 0 "[ . 1 . 2]" 1
1250 2 22 VAL HA 2 38 ALA HA . . 2.870 2.004 1.929 2.133 . 0 0 "[ . 1 . 2]" 1
1251 2 22 VAL HA 2 38 ALA MB . . 4.390 2.794 2.242 3.130 . 0 0 "[ . 1 . 2]" 1
1252 2 22 VAL MG1 2 23 LYS H . . 3.830 2.464 2.133 2.742 . 0 0 "[ . 1 . 2]" 1
1253 2 22 VAL MG1 2 23 LYS HA . . 4.480 3.419 3.283 3.564 . 0 0 "[ . 1 . 2]" 1
1254 2 22 VAL MG1 2 38 ALA HA . . 5.230 3.773 3.593 3.996 . 0 0 "[ . 1 . 2]" 1
1255 2 22 VAL MG1 2 59 ILE HA . . 5.190 3.338 3.072 3.776 . 0 0 "[ . 1 . 2]" 1
1256 2 22 VAL MG2 2 23 LYS H . . 4.670 3.869 3.800 3.927 . 0 0 "[ . 1 . 2]" 1
1257 2 22 VAL MG2 2 38 ALA HA . . 4.730 3.330 2.979 3.590 . 0 0 "[ . 1 . 2]" 1
1258 2 22 VAL MG2 2 59 ILE HA . . 4.480 2.478 2.131 2.756 . 0 0 "[ . 1 . 2]" 1
1259 2 23 LYS H 2 23 LYS HA . . 2.900 2.933 2.924 2.938 0.038 6 0 "[ . 1 . 2]" 1
1260 2 23 LYS H 2 23 LYS QD . . 5.040 4.175 3.988 4.376 . 0 0 "[ . 1 . 2]" 1
1261 2 23 LYS H 2 24 VAL H . . 4.260 4.263 4.210 4.312 0.052 1 0 "[ . 1 . 2]" 1
1262 2 23 LYS H 2 37 ILE H . . 3.270 3.105 2.953 3.302 0.032 20 0 "[ . 1 . 2]" 1
1263 2 23 LYS H 2 37 ILE HB . . 5.190 3.917 3.246 4.413 . 0 0 "[ . 1 . 2]" 1
1264 2 23 LYS H 2 38 ALA HA . . 3.830 2.730 2.546 3.013 . 0 0 "[ . 1 . 2]" 1
1265 2 23 LYS H 2 38 ALA MB . . 4.980 3.778 3.378 4.127 . 0 0 "[ . 1 . 2]" 1
1266 2 23 LYS HA 2 23 LYS QD . . 3.430 2.345 1.853 3.092 . 0 0 "[ . 1 . 2]" 1
1267 2 23 LYS HA 2 23 LYS HG2 . . 3.520 3.063 2.244 3.776 0.256 13 0 "[ . 1 . 2]" 1
1268 2 23 LYS HA 2 23 LYS QG . . 3.340 2.733 2.221 3.106 . 0 0 "[ . 1 . 2]" 1
1269 2 23 LYS HA 2 23 LYS HG3 . . 3.520 3.440 3.202 3.625 0.105 9 0 "[ . 1 . 2]" 1
1270 2 23 LYS HA 2 24 VAL H . . 2.460 2.183 2.177 2.191 . 0 0 "[ . 1 . 2]" 1
1271 2 23 LYS HA 2 24 VAL QG . . 6.040 3.853 3.328 4.296 . 0 0 "[ . 1 . 2]" 1
1272 2 23 LYS QB 2 24 VAL H . . 4.140 3.863 3.783 3.916 . 0 0 "[ . 1 . 2]" 1
1273 2 23 LYS QB 2 37 ILE H . . 5.260 3.198 2.843 3.497 . 0 0 "[ . 1 . 2]" 1
1274 2 23 LYS HD2 2 24 VAL H . . 3.920 2.540 1.916 3.361 . 0 0 "[ . 1 . 2]" 1
1275 2 23 LYS HD3 2 24 VAL H . . 3.920 2.771 2.020 3.545 . 0 0 "[ . 1 . 2]" 1
1276 2 23 LYS QG 2 24 VAL H . . 4.290 3.363 2.994 3.584 . 0 0 "[ . 1 . 2]" 1
1277 2 23 LYS HG2 2 24 VAL H . . 4.600 4.018 3.038 4.697 0.097 5 0 "[ . 1 . 2]" 1
1278 2 23 LYS HG3 2 24 VAL H . . 4.600 4.053 3.349 4.645 0.045 9 0 "[ . 1 . 2]" 1
1279 2 24 VAL H 2 24 VAL HB . . 2.680 2.400 2.245 2.646 . 0 0 "[ . 1 . 2]" 1
1280 2 24 VAL H 2 24 VAL MG1 . . 4.330 3.566 2.683 3.850 . 0 0 "[ . 1 . 2]" 1
1281 2 24 VAL H 2 24 VAL QG . . 3.620 2.802 2.430 2.990 . 0 0 "[ . 1 . 2]" 1
1282 2 24 VAL H 2 24 VAL MG2 . . 4.330 3.036 2.456 3.766 . 0 0 "[ . 1 . 2]" 1
1283 2 24 VAL H 2 25 LYS H . . 4.880 4.304 4.104 4.425 . 0 0 "[ . 1 . 2]" 1
1284 2 24 VAL HA 2 24 VAL HB . . 2.870 2.977 2.730 3.022 0.152 20 0 "[ . 1 . 2]" 1
1285 2 24 VAL HA 2 25 LYS H . . 2.900 2.187 2.181 2.210 . 0 0 "[ . 1 . 2]" 1
1286 2 24 VAL HA 2 36 VAL HA . . 2.710 2.393 2.195 2.577 . 0 0 "[ . 1 . 2]" 1
1287 2 24 VAL HA 2 37 ILE H . . 3.270 3.248 3.078 3.340 0.070 8 0 "[ . 1 . 2]" 1
1288 2 24 VAL HB 2 25 LYS H . . 4.720 4.495 4.348 4.624 . 0 0 "[ . 1 . 2]" 1
1289 2 24 VAL QG 2 25 LYS H . . 5.390 2.839 2.586 3.170 . 0 0 "[ . 1 . 2]" 1
1290 2 24 VAL QG 2 25 LYS HA . . 8.090 3.559 3.339 4.108 . 0 0 "[ . 1 . 2]" 1
1291 2 24 VAL QG 2 37 ILE H . . 6.940 3.805 3.472 4.261 . 0 0 "[ . 1 . 2]" 1
1292 2 25 LYS H 2 25 LYS HB2 . . 2.960 2.876 2.718 3.106 0.146 8 0 "[ . 1 . 2]" 1
1293 2 25 LYS H 2 25 LYS QB . . 2.730 2.464 2.251 2.552 . 0 0 "[ . 1 . 2]" 1
1294 2 25 LYS H 2 25 LYS HB3 . . 2.960 2.711 2.327 2.875 . 0 0 "[ . 1 . 2]" 1
1295 2 25 LYS H 2 25 LYS QD . . 5.480 4.312 4.150 4.637 . 0 0 "[ . 1 . 2]" 1
1296 2 25 LYS H 2 25 LYS QG . . 4.890 4.117 3.868 4.209 . 0 0 "[ . 1 . 2]" 1
1297 2 25 LYS H 2 34 THR MG . . 4.730 3.799 3.517 3.873 . 0 0 "[ . 1 . 2]" 1
1298 2 25 LYS H 2 35 GLU H . . 3.670 3.282 3.098 3.537 . 0 0 "[ . 1 . 2]" 1
1299 2 25 LYS H 2 35 GLU QG . . 6.380 4.983 3.229 5.750 . 0 0 "[ . 1 . 2]" 1
1300 2 25 LYS H 2 36 VAL HA . . 3.110 3.141 3.110 3.166 0.056 19 0 "[ . 1 . 2]" 1
1301 2 25 LYS H 2 37 ILE H . . 4.200 4.128 3.848 4.238 0.038 5 0 "[ . 1 . 2]" 1
1302 2 25 LYS HA 2 26 SER H . . 3.020 2.303 2.225 2.379 . 0 0 "[ . 1 . 2]" 1
1303 2 25 LYS QD 2 26 SER H . . 4.180 3.709 3.492 3.808 . 0 0 "[ . 1 . 2]" 1
1304 2 25 LYS QD 2 30 HIS HD2 . . 6.380 5.628 5.380 5.749 . 0 0 "[ . 1 . 2]" 1
1305 2 26 SER H 2 26 SER QB . . 3.520 2.134 1.996 2.828 . 0 0 "[ . 1 . 2]" 1
1306 2 26 SER HA 2 27 PRO HD2 . . 3.210 3.022 2.891 3.168 . 0 0 "[ . 1 . 2]" 1
1307 2 26 SER HA 2 27 PRO HD3 . . 3.210 2.218 2.119 2.345 . 0 0 "[ . 1 . 2]" 1
1308 2 26 SER HA 2 34 THR HA . . 2.930 2.943 2.887 2.999 0.069 6 0 "[ . 1 . 2]" 1
1309 2 26 SER HA 2 34 THR MG . . 4.820 2.237 1.984 2.585 . 0 0 "[ . 1 . 2]" 1
1310 2 26 SER HA 2 35 GLU H . . 3.860 3.558 3.376 3.789 . 0 0 "[ . 1 . 2]" 1
1311 2 26 SER QB 2 27 PRO QD . . 4.680 2.040 1.874 2.313 . 0 0 "[ . 1 . 2]" 1
1312 2 26 SER QB 2 34 THR MG . . 5.820 3.776 3.367 4.180 . 0 0 "[ . 1 . 2]" 1
1313 2 27 PRO HA 2 28 GLY H . . 2.680 2.513 2.341 2.653 . 0 0 "[ . 1 . 2]" 1
1314 2 27 PRO HA 2 31 CYS H . . 4.480 4.405 4.206 4.494 0.014 15 0 "[ . 1 . 2]" 1
1315 2 27 PRO HB2 2 28 GLY H . . 3.170 2.532 2.214 2.958 . 0 0 "[ . 1 . 2]" 1
1316 2 27 PRO HB2 2 32 ALA HA . . 2.590 2.168 1.982 2.243 . 0 0 "[ . 1 . 2]" 1
1317 2 27 PRO HB3 2 32 ALA HA . . 3.110 2.813 2.594 2.980 . 0 0 "[ . 1 . 2]" 1
1318 2 27 PRO QD 2 28 GLY H . . 5.590 4.923 4.817 5.020 . 0 0 "[ . 1 . 2]" 1
1319 2 27 PRO QD 2 34 THR HA . . 4.300 2.788 2.540 3.152 . 0 0 "[ . 1 . 2]" 1
1320 2 27 PRO QD 2 34 THR MG . . 5.510 2.891 2.602 3.250 . 0 0 "[ . 1 . 2]" 1
1321 2 27 PRO HD2 2 34 THR HA . . 4.540 4.455 4.235 4.719 0.179 20 0 "[ . 1 . 2]" 1
1322 2 27 PRO HD3 2 34 THR HA . . 4.540 2.818 2.561 3.201 . 0 0 "[ . 1 . 2]" 1
1323 2 27 PRO QG 2 28 GLY H . . 5.510 4.260 4.020 4.551 . 0 0 "[ . 1 . 2]" 1
1324 2 27 PRO HG2 2 32 ALA HA . . 4.010 3.916 3.793 4.025 0.015 18 0 "[ . 1 . 2]" 1
1325 2 27 PRO HG3 2 32 ALA HA . . 4.010 4.049 4.009 4.099 0.089 8 0 "[ . 1 . 2]" 1
1326 2 28 GLY H 2 29 PRO HD2 . . 5.220 4.503 4.390 4.617 . 0 0 "[ . 1 . 2]" 1
1327 2 28 GLY H 2 29 PRO HD3 . . 5.160 4.739 4.712 4.757 . 0 0 "[ . 1 . 2]" 1
1328 2 28 GLY H 2 30 HIS H . . 3.480 3.395 3.296 3.503 0.023 18 0 "[ . 1 . 2]" 1
1329 2 28 GLY H 2 30 HIS HE1 . . 5.500 5.182 4.825 5.503 0.003 20 0 "[ . 1 . 2]" 1
1330 2 28 GLY H 2 31 CYS H . . 3.730 2.739 2.516 3.077 . 0 0 "[ . 1 . 2]" 1
1331 2 28 GLY H 2 31 CYS QB . . 5.350 3.369 3.140 3.744 . 0 0 "[ . 1 . 2]" 1
1332 2 28 GLY H 2 32 ALA MB . . 6.530 4.712 4.286 5.108 . 0 0 "[ . 1 . 2]" 1
1333 2 28 GLY H 2 33 GLN H . . 4.350 4.175 4.061 4.354 0.004 17 0 "[ . 1 . 2]" 1
1334 2 28 GLY QA 2 29 PRO HD2 . . 2.880 2.233 2.218 2.250 . 0 0 "[ . 1 . 2]" 1
1335 2 28 GLY QA 2 29 PRO HD3 . . 2.440 2.239 2.232 2.242 . 0 0 "[ . 1 . 2]" 1
1336 2 28 GLY QA 2 30 HIS H . . 4.210 2.954 2.936 2.974 . 0 0 "[ . 1 . 2]" 1
1337 2 28 GLY QA 2 30 HIS HE1 . . 5.350 2.941 2.829 3.154 . 0 0 "[ . 1 . 2]" 1
1338 2 28 GLY HA2 2 29 PRO HD2 . . 3.360 2.265 2.246 2.286 . 0 0 "[ . 1 . 2]" 1
1339 2 28 GLY HA2 2 29 PRO HD3 . . 2.740 2.466 2.423 2.510 . 0 0 "[ . 1 . 2]" 1
1340 2 28 GLY HA3 2 29 PRO HD2 . . 3.360 3.390 3.350 3.431 0.071 4 0 "[ . 1 . 2]" 1
1341 2 28 GLY HA3 2 29 PRO HD3 . . 2.740 2.568 2.525 2.614 . 0 0 "[ . 1 . 2]" 1
1342 2 29 PRO HA 2 30 HIS H . . 3.110 3.231 3.219 3.241 0.131 6 0 "[ . 1 . 2]" 1
1343 2 29 PRO HD2 2 30 HIS H . . 4.110 2.745 2.722 2.776 . 0 0 "[ . 1 . 2]" 1
1344 2 29 PRO HD2 2 30 HIS HD2 . . 5.500 5.153 5.053 5.184 . 0 0 "[ . 1 . 2]" 1
1345 2 29 PRO HD2 2 31 CYS H . . 4.510 4.383 4.312 4.452 . 0 0 "[ . 1 . 2]" 1
1346 2 29 PRO HD3 2 30 HIS H . . 4.690 3.846 3.834 3.860 . 0 0 "[ . 1 . 2]" 1
1347 2 29 PRO HD3 2 31 CYS H . . 5.500 5.463 5.370 5.518 0.018 17 0 "[ . 1 . 2]" 1
1348 2 29 PRO HG2 2 30 HIS H . . 5.500 3.900 3.872 3.935 . 0 0 "[ . 1 . 2]" 1
1349 2 29 PRO HG3 2 30 HIS H . . 5.500 4.784 4.765 4.807 . 0 0 "[ . 1 . 2]" 1
1350 2 30 HIS H 2 30 HIS HB2 . . 3.420 3.561 3.545 3.602 0.182 20 0 "[ . 1 . 2]" 1
1351 2 30 HIS H 2 30 HIS HB3 . . 3.480 3.366 3.345 3.416 . 0 0 "[ . 1 . 2]" 1
1352 2 30 HIS H 2 30 HIS HD2 . . 5.470 4.119 4.059 4.229 . 0 0 "[ . 1 . 2]" 1
1353 2 30 HIS H 2 31 CYS H . . 3.080 2.142 2.037 2.228 . 0 0 "[ . 1 . 2]" 1
1354 2 30 HIS HB2 2 30 HIS HD2 . . 3.330 2.726 2.722 2.731 . 0 0 "[ . 1 . 2]" 1
1355 2 30 HIS HB3 2 31 CYS H . . 4.110 4.050 3.952 4.148 0.038 8 0 "[ . 1 . 2]" 1
1356 2 31 CYS HA 2 32 ALA H . . 2.900 2.225 2.221 2.238 . 0 0 "[ . 1 . 2]" 1
1357 2 31 CYS HA 2 33 GLN H . . 3.610 3.584 3.513 3.640 0.030 4 0 "[ . 1 . 2]" 1
1358 2 31 CYS QB 2 33 GLN H . . 5.380 2.726 2.389 3.465 . 0 0 "[ . 1 . 2]" 1
1359 2 32 ALA H 2 32 ALA HA . . 2.900 2.913 2.907 2.921 0.021 11 0 "[ . 1 . 2]" 1
1360 2 32 ALA H 2 32 ALA MB . . 3.430 2.165 2.065 2.291 . 0 0 "[ . 1 . 2]" 1
1361 2 32 ALA H 2 33 GLN H . . 2.990 2.762 2.696 2.793 . 0 0 "[ . 1 . 2]" 1
1362 2 32 ALA HA 2 33 GLN H . . 2.990 3.045 3.039 3.058 0.068 4 0 "[ . 1 . 2]" 1
1363 2 32 ALA MB 2 33 GLN H . . 4.170 3.647 3.633 3.655 . 0 0 "[ . 1 . 2]" 1
1364 2 32 ALA MB 2 33 GLN HE22 . . 6.530 3.791 2.548 5.069 . 0 0 "[ . 1 . 2]" 1
1365 2 33 GLN H 2 33 GLN HB2 . . 2.930 2.857 2.672 2.966 0.036 8 0 "[ . 1 . 2]" 1
1366 2 33 GLN H 2 33 GLN HB3 . . 4.110 3.833 3.756 3.869 . 0 0 "[ . 1 . 2]" 1
1367 2 33 GLN H 2 33 GLN QG . . 3.900 2.629 2.340 2.993 . 0 0 "[ . 1 . 2]" 1
1368 2 33 GLN HB2 2 34 THR H . . 3.550 3.494 1.965 3.653 0.103 17 0 "[ . 1 . 2]" 1
1369 2 33 GLN HB3 2 34 THR H . . 3.580 2.697 1.980 2.966 . 0 0 "[ . 1 . 2]" 1
1370 2 34 THR H 2 34 THR HB . . 3.110 2.555 2.364 3.005 . 0 0 "[ . 1 . 2]" 1
1371 2 34 THR HA 2 35 GLU H . . 2.770 2.408 2.354 2.501 . 0 0 "[ . 1 . 2]" 1
1372 2 34 THR HB 2 35 GLU H . . 3.610 3.625 3.605 3.651 0.041 19 0 "[ . 1 . 2]" 1
1373 2 34 THR MG 2 35 GLU H . . 3.740 2.089 1.861 2.318 . 0 0 "[ . 1 . 2]" 1
1374 2 34 THR MG 2 35 GLU HA . . 6.530 3.879 3.422 4.207 . 0 0 "[ . 1 . 2]" 1
1375 2 34 THR MG 2 36 VAL HA . . 6.530 4.106 3.747 4.481 . 0 0 "[ . 1 . 2]" 1
1376 2 34 THR MG 2 50 PRO QB . . 7.120 2.415 2.073 2.842 . 0 0 "[ . 1 . 2]" 1
1377 2 34 THR MG 2 50 PRO HG2 . . 4.610 3.702 3.271 3.845 . 0 0 "[ . 1 . 2]" 1
1378 2 35 GLU H 2 35 GLU HB2 . . 4.040 2.976 2.644 3.860 . 0 0 "[ . 1 . 2]" 1
1379 2 35 GLU H 2 35 GLU HB3 . . 4.040 3.575 3.052 3.829 . 0 0 "[ . 1 . 2]" 1
1380 2 35 GLU HA 2 35 GLU HB2 . . 2.930 2.873 2.619 3.047 0.117 15 0 "[ . 1 . 2]" 1
1381 2 35 GLU HA 2 35 GLU QB . . 2.680 2.454 2.178 2.559 . 0 0 "[ . 1 . 2]" 1
1382 2 35 GLU HA 2 35 GLU HB3 . . 2.930 2.693 2.301 3.034 0.104 8 0 "[ . 1 . 2]" 1
1383 2 35 GLU HA 2 36 VAL H . . 2.930 2.316 2.208 2.482 . 0 0 "[ . 1 . 2]" 1
1384 2 35 GLU HA 2 36 VAL MG2 . . 5.940 3.910 3.689 4.061 . 0 0 "[ . 1 . 2]" 1
1385 2 35 GLU HA 2 50 PRO HD2 . . 5.500 5.256 4.731 5.517 0.017 11 0 "[ . 1 . 2]" 1
1386 2 35 GLU HA 2 50 PRO HD3 . . 5.500 4.167 3.798 4.418 . 0 0 "[ . 1 . 2]" 1
1387 2 35 GLU HA 2 50 PRO HG3 . . 5.000 3.387 3.026 3.814 . 0 0 "[ . 1 . 2]" 1
1388 2 35 GLU QG 2 36 VAL H . . 6.380 4.239 3.457 4.778 . 0 0 "[ . 1 . 2]" 1
1389 2 36 VAL H 2 36 VAL HB . . 2.740 2.400 2.285 2.531 . 0 0 "[ . 1 . 2]" 1
1390 2 36 VAL H 2 36 VAL MG1 . . 4.730 3.719 3.681 3.734 . 0 0 "[ . 1 . 2]" 1
1391 2 36 VAL H 2 36 VAL MG2 . . 3.800 2.292 1.950 2.786 . 0 0 "[ . 1 . 2]" 1
1392 2 36 VAL H 2 37 ILE QG . . 5.910 4.265 3.737 4.763 . 0 0 "[ . 1 . 2]" 1
1393 2 36 VAL H 2 48 LEU H . . 4.910 4.093 3.786 4.446 . 0 0 "[ . 1 . 2]" 1
1394 2 36 VAL H 2 50 PRO HD3 . . 5.500 3.265 2.933 3.477 . 0 0 "[ . 1 . 2]" 1
1395 2 36 VAL HA 2 37 ILE H . . 2.400 2.193 2.182 2.240 . 0 0 "[ . 1 . 2]" 1
1396 2 36 VAL HA 2 37 ILE QG . . 6.380 3.590 3.255 4.108 . 0 0 "[ . 1 . 2]" 1
1397 2 36 VAL HB 2 37 ILE H . . 4.690 4.314 4.033 4.519 . 0 0 "[ . 1 . 2]" 1
1398 2 36 VAL HB 2 48 LEU H . . 3.270 3.018 2.605 3.315 0.045 9 0 "[ . 1 . 2]" 1
1399 2 36 VAL HB 2 48 LEU HA . . 5.500 4.714 4.568 4.855 . 0 0 "[ . 1 . 2]" 1
1400 2 36 VAL MG2 2 37 ILE H . . 4.950 4.120 4.060 4.186 . 0 0 "[ . 1 . 2]" 1
1401 2 36 VAL MG2 2 49 ASN H . . 6.530 5.321 5.218 5.374 . 0 0 "[ . 1 . 2]" 1
1402 2 37 ILE H 2 37 ILE HB . . 2.930 2.793 2.685 2.960 0.030 19 0 "[ . 1 . 2]" 1
1403 2 37 ILE H 2 37 ILE MD . . 3.890 2.847 2.115 3.207 . 0 0 "[ . 1 . 2]" 1
1404 2 37 ILE H 2 37 ILE HG12 . . 4.380 3.581 2.161 4.371 . 0 0 "[ . 1 . 2]" 1
1405 2 37 ILE H 2 37 ILE QG . . 3.980 2.726 2.147 3.228 . 0 0 "[ . 1 . 2]" 1
1406 2 37 ILE H 2 37 ILE HG13 . . 4.380 3.314 2.792 3.891 . 0 0 "[ . 1 . 2]" 1
1407 2 37 ILE H 2 37 ILE MG . . 4.790 3.888 3.832 3.919 . 0 0 "[ . 1 . 2]" 1
1408 2 37 ILE H 2 38 ALA MB . . 6.530 4.754 4.643 4.975 . 0 0 "[ . 1 . 2]" 1
1409 2 37 ILE H 2 48 LEU H . . 4.910 4.738 4.517 4.907 . 0 0 "[ . 1 . 2]" 1
1410 2 37 ILE HA 2 37 ILE MD . . 4.570 3.172 1.976 3.855 . 0 0 "[ . 1 . 2]" 1
1411 2 37 ILE HA 2 37 ILE HG12 . . 3.920 3.348 3.161 3.547 . 0 0 "[ . 1 . 2]" 1
1412 2 37 ILE HA 2 37 ILE QG . . 3.710 2.728 2.423 3.260 . 0 0 "[ . 1 . 2]" 1
1413 2 37 ILE HA 2 37 ILE HG13 . . 3.920 3.025 2.468 3.939 0.019 13 0 "[ . 1 . 2]" 1
1414 2 37 ILE HA 2 38 ALA H . . 2.900 2.241 2.177 2.426 . 0 0 "[ . 1 . 2]" 1
1415 2 37 ILE HA 2 47 CYS HA . . 2.830 2.266 2.151 2.476 . 0 0 "[ . 1 . 2]" 1
1416 2 37 ILE HB 2 38 ALA H . . 4.420 4.077 3.349 4.429 0.009 6 0 "[ . 1 . 2]" 1
1417 2 37 ILE HG12 2 38 ALA H . . 5.500 5.248 5.086 5.475 . 0 0 "[ . 1 . 2]" 1
1418 2 37 ILE HG12 2 47 CYS HA . . 5.500 4.671 4.206 5.398 . 0 0 "[ . 1 . 2]" 1
1419 2 37 ILE HG13 2 38 ALA H . . 5.500 4.922 4.599 5.555 0.055 18 0 "[ . 1 . 2]" 1
1420 2 37 ILE HG13 2 47 CYS HA . . 5.500 4.249 3.195 5.408 . 0 0 "[ . 1 . 2]" 1
1421 2 37 ILE MG 2 38 ALA H . . 4.050 2.719 2.153 3.175 . 0 0 "[ . 1 . 2]" 1
1422 2 37 ILE MG 2 46 ALA H . . 4.820 3.731 3.421 3.904 . 0 0 "[ . 1 . 2]" 1
1423 2 37 ILE MG 2 47 CYS HA . . 6.340 3.145 2.362 3.668 . 0 0 "[ . 1 . 2]" 1
1424 2 38 ALA H 2 45 LYS HA . . 4.970 4.744 4.280 4.985 0.015 3 0 "[ . 1 . 2]" 1
1425 2 38 ALA H 2 46 ALA H . . 3.240 3.085 2.792 3.255 0.015 6 0 "[ . 1 . 2]" 1
1426 2 38 ALA H 2 46 ALA MB . . 5.130 4.198 4.034 4.256 . 0 0 "[ . 1 . 2]" 1
1427 2 38 ALA H 2 47 CYS H . . 5.280 4.709 4.530 4.920 . 0 0 "[ . 1 . 2]" 1
1428 2 38 ALA H 2 47 CYS HA . . 3.550 3.113 2.848 3.534 . 0 0 "[ . 1 . 2]" 1
1429 2 38 ALA H 2 48 LEU MD1 . . 5.160 3.873 3.421 4.137 . 0 0 "[ . 1 . 2]" 1
1430 2 38 ALA H 2 48 LEU HG . . 4.720 3.734 3.175 4.181 . 0 0 "[ . 1 . 2]" 1
1431 2 38 ALA HA 2 39 THR H . . 2.400 2.231 2.191 2.306 . 0 0 "[ . 1 . 2]" 1
1432 2 38 ALA HA 2 39 THR HA . . 4.690 4.360 4.353 4.372 . 0 0 "[ . 1 . 2]" 1
1433 2 38 ALA HA 2 39 THR HB . . 4.420 4.444 4.404 4.470 0.050 18 0 "[ . 1 . 2]" 1
1434 2 38 ALA HA 2 46 ALA H . . 4.760 4.757 4.481 4.838 0.078 15 0 "[ . 1 . 2]" 1
1435 2 38 ALA MB 2 39 THR H . . 4.080 3.107 2.820 3.308 . 0 0 "[ . 1 . 2]" 1
1436 2 38 ALA MB 2 46 ALA H . . 4.820 3.236 2.979 3.337 . 0 0 "[ . 1 . 2]" 1
1437 2 38 ALA MB 2 47 CYS HA . . 6.530 4.356 4.197 4.641 . 0 0 "[ . 1 . 2]" 1
1438 2 39 THR H 2 39 THR HB . . 2.800 2.278 2.253 2.310 . 0 0 "[ . 1 . 2]" 1
1439 2 39 THR H 2 39 THR MG . . 4.510 3.693 3.677 3.715 . 0 0 "[ . 1 . 2]" 1
1440 2 39 THR H 2 40 LEU H . . 5.220 4.596 4.529 4.634 . 0 0 "[ . 1 . 2]" 1
1441 2 39 THR HA 2 40 LEU H . . 2.650 2.216 2.177 2.258 . 0 0 "[ . 1 . 2]" 1
1442 2 39 THR HA 2 45 LYS HA . . 2.740 2.463 2.379 2.500 . 0 0 "[ . 1 . 2]" 1
1443 2 39 THR HA 2 45 LYS HB2 . . 5.410 4.554 4.432 4.664 . 0 0 "[ . 1 . 2]" 1
1444 2 39 THR HA 2 45 LYS HB3 . . 5.000 3.420 3.255 3.654 . 0 0 "[ . 1 . 2]" 1
1445 2 39 THR HA 2 45 LYS QG . . 6.250 2.118 1.977 2.272 . 0 0 "[ . 1 . 2]" 1
1446 2 39 THR HA 2 46 ALA H . . 3.890 3.802 3.732 3.880 . 0 0 "[ . 1 . 2]" 1
1447 2 39 THR HB 2 40 LEU H . . 4.450 4.249 4.158 4.378 . 0 0 "[ . 1 . 2]" 1
1448 2 39 THR MG 2 40 LEU H . . 3.830 2.393 2.146 2.671 . 0 0 "[ . 1 . 2]" 1
1449 2 39 THR MG 2 40 LEU HA . . 6.530 4.029 3.860 4.207 . 0 0 "[ . 1 . 2]" 1
1450 2 39 THR MG 2 41 LYS HA . . 6.530 4.161 4.058 4.256 . 0 0 "[ . 1 . 2]" 1
1451 2 39 THR MG 2 43 GLY H . . 4.920 3.869 3.812 3.944 . 0 0 "[ . 1 . 2]" 1
1452 2 39 THR MG 2 43 GLY HA2 . . 5.940 4.988 4.949 5.020 . 0 0 "[ . 1 . 2]" 1
1453 2 39 THR MG 2 43 GLY QA . . 5.550 3.542 3.505 3.586 . 0 0 "[ . 1 . 2]" 1
1454 2 39 THR MG 2 43 GLY HA3 . . 5.940 3.623 3.584 3.672 . 0 0 "[ . 1 . 2]" 1
1455 2 39 THR MG 2 44 GLN H . . 5.750 4.585 4.408 4.694 . 0 0 "[ . 1 . 2]" 1
1456 2 39 THR MG 2 45 LYS HA . . 5.100 4.059 3.968 4.148 . 0 0 "[ . 1 . 2]" 1
1457 2 39 THR MG 2 45 LYS QE . . 6.160 2.969 2.363 3.989 . 0 0 "[ . 1 . 2]" 1
1458 2 40 LEU H 2 40 LEU HB2 . . 3.420 2.182 2.092 2.249 . 0 0 "[ . 1 . 2]" 1
1459 2 40 LEU H 2 40 LEU HB3 . . 3.420 2.984 2.975 2.994 . 0 0 "[ . 1 . 2]" 1
1460 2 40 LEU H 2 40 LEU MD1 . . 5.010 4.046 3.881 4.175 . 0 0 "[ . 1 . 2]" 1
1461 2 40 LEU H 2 40 LEU MD2 . . 5.440 4.347 4.312 4.363 . 0 0 "[ . 1 . 2]" 1
1462 2 40 LEU H 2 40 LEU HG . . 4.140 4.088 3.988 4.143 0.003 5 0 "[ . 1 . 2]" 1
1463 2 40 LEU H 2 44 GLN H . . 3.920 3.740 3.539 3.817 . 0 0 "[ . 1 . 2]" 1
1464 2 40 LEU H 2 45 LYS HA . . 2.870 2.576 2.366 2.675 . 0 0 "[ . 1 . 2]" 1
1465 2 40 LEU H 2 45 LYS HB3 . . 4.630 4.609 4.516 4.663 0.033 6 0 "[ . 1 . 2]" 1
1466 2 40 LEU H 2 45 LYS QG . . 6.380 2.848 2.700 2.984 . 0 0 "[ . 1 . 2]" 1
1467 2 40 LEU H 2 46 ALA H . . 4.540 4.441 4.170 4.562 0.022 5 0 "[ . 1 . 2]" 1
1468 2 40 LEU HA 2 40 LEU MD2 . . 3.430 2.585 2.491 2.722 . 0 0 "[ . 1 . 2]" 1
1469 2 40 LEU HA 2 40 LEU HG . . 3.580 2.292 2.231 2.346 . 0 0 "[ . 1 . 2]" 1
1470 2 40 LEU HA 2 41 LYS H . . 2.620 2.334 2.317 2.368 . 0 0 "[ . 1 . 2]" 1
1471 2 40 LEU HA 2 41 LYS QG . . 6.380 5.726 5.208 5.788 . 0 0 "[ . 1 . 2]" 1
1472 2 40 LEU HA 2 42 ASN H . . 3.920 3.692 3.667 3.743 . 0 0 "[ . 1 . 2]" 1
1473 2 40 LEU QB 2 41 LYS H . . 4.330 3.257 3.181 3.306 . 0 0 "[ . 1 . 2]" 1
1474 2 40 LEU QB 2 42 ASN H . . 3.960 2.204 2.174 2.237 . 0 0 "[ . 1 . 2]" 1
1475 2 40 LEU QB 2 42 ASN HD22 . . 4.970 4.360 4.290 4.405 . 0 0 "[ . 1 . 2]" 1
1476 2 40 LEU QB 2 44 GLN H . . 3.560 2.066 1.927 2.182 . 0 0 "[ . 1 . 2]" 1
1477 2 40 LEU QB 2 45 LYS HA . . 6.380 2.915 2.878 2.967 . 0 0 "[ . 1 . 2]" 1
1478 2 40 LEU HB2 2 42 ASN HD22 . . 5.500 5.524 5.467 5.548 0.048 3 0 "[ . 1 . 2]" 1
1479 2 40 LEU HB3 2 42 ASN HD22 . . 5.500 4.566 4.484 4.624 . 0 0 "[ . 1 . 2]" 1
1480 2 40 LEU MD1 2 42 ASN HD21 . . 5.470 2.677 2.514 2.861 . 0 0 "[ . 1 . 2]" 1
1481 2 40 LEU MD1 2 42 ASN HD22 . . 5.070 4.019 3.928 4.123 . 0 0 "[ . 1 . 2]" 1
1482 2 40 LEU MD1 2 44 GLN H . . 4.330 3.478 3.402 3.570 . 0 0 "[ . 1 . 2]" 1
1483 2 40 LEU MD1 2 46 ALA H . . 5.600 4.527 4.456 4.610 . 0 0 "[ . 1 . 2]" 1
1484 2 40 LEU MD2 2 41 LYS H . . 3.950 1.880 1.823 1.910 . 0 0 "[ . 1 . 2]" 1
1485 2 40 LEU MD2 2 42 ASN H . . 4.850 1.903 1.876 1.934 . 0 0 "[ . 1 . 2]" 1
1486 2 40 LEU MD2 2 42 ASN HD22 . . 6.530 4.702 4.363 4.997 . 0 0 "[ . 1 . 2]" 1
1487 2 41 LYS H 2 41 LYS HA . . 2.830 2.850 2.846 2.853 0.023 10 0 "[ . 1 . 2]" 1
1488 2 41 LYS H 2 41 LYS QB . . 3.440 2.174 2.034 2.227 . 0 0 "[ . 1 . 2]" 1
1489 2 41 LYS H 2 41 LYS QD . . 5.760 4.150 2.999 4.333 . 0 0 "[ . 1 . 2]" 1
1490 2 41 LYS H 2 41 LYS QG . . 4.760 3.899 3.701 4.004 . 0 0 "[ . 1 . 2]" 1
1491 2 41 LYS H 2 42 ASN H . . 3.240 2.558 2.536 2.572 . 0 0 "[ . 1 . 2]" 1
1492 2 41 LYS HA 2 41 LYS QD . . 3.870 3.064 2.081 3.550 . 0 0 "[ . 1 . 2]" 1
1493 2 41 LYS HA 2 41 LYS QG . . 3.960 2.528 1.973 3.210 . 0 0 "[ . 1 . 2]" 1
1494 2 41 LYS HA 2 42 ASN H . . 3.330 3.347 3.323 3.366 0.036 17 0 "[ . 1 . 2]" 1
1495 2 41 LYS HA 2 43 GLY H . . 3.450 3.608 3.590 3.627 0.177 5 0 "[ . 1 . 2]" 1
1496 2 41 LYS QD 2 42 ASN H . . 5.380 4.291 4.032 4.942 . 0 0 "[ . 1 . 2]" 1
1497 2 41 LYS QG 2 42 ASN H . . 6.380 4.414 3.886 4.795 . 0 0 "[ . 1 . 2]" 1
1498 2 42 ASN H 2 42 ASN HB2 . . 3.330 3.278 3.264 3.296 . 0 0 "[ . 1 . 2]" 1
1499 2 42 ASN H 2 42 ASN QB . . 3.100 2.152 2.143 2.161 . 0 0 "[ . 1 . 2]" 1
1500 2 42 ASN H 2 42 ASN HB3 . . 3.330 2.182 2.173 2.191 . 0 0 "[ . 1 . 2]" 1
1501 2 42 ASN H 2 42 ASN HD21 . . 5.500 3.660 3.615 3.705 . 0 0 "[ . 1 . 2]" 1
1502 2 42 ASN H 2 42 ASN HD22 . . 5.500 5.009 4.970 5.035 . 0 0 "[ . 1 . 2]" 1
1503 2 42 ASN HA 2 42 ASN HB2 . . 2.870 2.306 2.302 2.308 . 0 0 "[ . 1 . 2]" 1
1504 2 42 ASN HA 2 42 ASN HB3 . . 2.870 2.967 2.961 2.969 0.099 14 0 "[ . 1 . 2]" 1
1505 2 42 ASN HA 2 43 GLY H . . 3.420 3.409 3.396 3.423 0.003 8 0 "[ . 1 . 2]" 1
1506 2 42 ASN QB 2 42 ASN HD21 . . 2.880 2.086 2.081 2.089 . 0 0 "[ . 1 . 2]" 1
1507 2 42 ASN QB 2 42 ASN HD22 . . 3.640 3.258 3.254 3.261 . 0 0 "[ . 1 . 2]" 1
1508 2 42 ASN HB2 2 42 ASN HD21 . . 3.140 3.298 3.274 3.314 0.174 18 0 "[ . 1 . 2]" 1
1509 2 42 ASN HB2 2 42 ASN HD22 . . 3.980 4.010 3.997 4.019 0.039 18 0 "[ . 1 . 2]" 1
1510 2 42 ASN HB3 2 42 ASN HD21 . . 3.140 2.109 2.105 2.112 . 0 0 "[ . 1 . 2]" 1
1511 2 42 ASN HB3 2 42 ASN HD22 . . 3.980 3.448 3.446 3.450 . 0 0 "[ . 1 . 2]" 1
1512 2 42 ASN HD21 2 44 GLN HB2 . . 4.820 1.928 1.891 1.945 . 0 0 "[ . 1 . 2]" 1
1513 2 42 ASN HD21 2 44 GLN HB3 . . 4.690 3.585 3.565 3.602 . 0 0 "[ . 1 . 2]" 1
1514 2 42 ASN HD21 2 44 GLN HG2 . . 4.290 4.072 3.971 4.203 . 0 0 "[ . 1 . 2]" 1
1515 2 42 ASN HD21 2 44 GLN HG3 . . 4.880 2.767 2.717 2.836 . 0 0 "[ . 1 . 2]" 1
1516 2 42 ASN HD22 2 44 GLN HB2 . . 4.510 2.930 2.823 2.995 . 0 0 "[ . 1 . 2]" 1
1517 2 42 ASN HD22 2 44 GLN HG2 . . 4.260 3.574 3.424 3.688 . 0 0 "[ . 1 . 2]" 1
1518 2 42 ASN HD22 2 44 GLN HG3 . . 4.940 1.965 1.939 2.054 . 0 0 "[ . 1 . 2]" 1
1519 2 43 GLY H 2 43 GLY HA2 . . 2.770 2.953 2.952 2.956 0.186 3 0 "[ . 1 . 2]" 1
1520 2 43 GLY H 2 43 GLY QA . . 2.570 2.295 2.288 2.303 . 0 0 "[ . 1 . 2]" 1
1521 2 43 GLY H 2 43 GLY HA3 . . 2.770 2.392 2.383 2.402 . 0 0 "[ . 1 . 2]" 1
1522 2 43 GLY H 2 44 GLN H . . 2.520 2.297 2.160 2.353 . 0 0 "[ . 1 . 2]" 1
1523 2 43 GLY HA2 2 44 GLN H . . 3.610 3.270 3.227 3.368 . 0 0 "[ . 1 . 2]" 1
1524 2 43 GLY HA3 2 44 GLN H . . 3.610 3.430 3.343 3.463 . 0 0 "[ . 1 . 2]" 1
1525 2 44 GLN H 2 44 GLN HA . . 2.900 2.863 2.849 2.895 . 0 0 "[ . 1 . 2]" 1
1526 2 44 GLN H 2 44 GLN HB2 . . 3.050 2.178 2.125 2.226 . 0 0 "[ . 1 . 2]" 1
1527 2 44 GLN H 2 44 GLN HG2 . . 4.570 4.100 3.987 4.183 . 0 0 "[ . 1 . 2]" 1
1528 2 44 GLN H 2 44 GLN HG3 . . 3.270 3.093 2.959 3.271 0.001 10 0 "[ . 1 . 2]" 1
1529 2 44 GLN H 2 45 LYS H . . 4.660 4.469 4.421 4.500 . 0 0 "[ . 1 . 2]" 1
1530 2 44 GLN HA 2 44 GLN HE21 . . 5.500 4.506 4.034 4.734 . 0 0 "[ . 1 . 2]" 1
1531 2 44 GLN HA 2 44 GLN HG2 . . 2.930 2.383 2.172 2.554 . 0 0 "[ . 1 . 2]" 1
1532 2 44 GLN HA 2 45 LYS H . . 2.830 2.775 2.740 2.809 . 0 0 "[ . 1 . 2]" 1
1533 2 44 GLN HB2 2 45 LYS H . . 3.730 3.465 3.432 3.535 . 0 0 "[ . 1 . 2]" 1
1534 2 44 GLN HB3 2 45 LYS H . . 2.870 1.942 1.901 2.004 . 0 0 "[ . 1 . 2]" 1
1535 2 44 GLN HB3 2 45 LYS HA . . 5.500 4.071 4.023 4.121 . 0 0 "[ . 1 . 2]" 1
1536 2 44 GLN HE22 2 44 GLN HG2 . . 4.040 3.540 3.446 3.857 . 0 0 "[ . 1 . 2]" 1
1537 2 44 GLN HG2 2 45 LYS H . . 4.630 3.339 3.269 3.448 . 0 0 "[ . 1 . 2]" 1
1538 2 44 GLN HG3 2 45 LYS H . . 5.190 4.383 4.304 4.442 . 0 0 "[ . 1 . 2]" 1
1539 2 45 LYS H 2 45 LYS HA . . 2.870 2.903 2.898 2.909 0.039 12 0 "[ . 1 . 2]" 1
1540 2 45 LYS H 2 45 LYS HB2 . . 2.870 2.889 2.831 2.917 0.047 20 0 "[ . 1 . 2]" 1
1541 2 45 LYS H 2 45 LYS QG . . 4.240 3.223 3.010 3.629 . 0 0 "[ . 1 . 2]" 1
1542 2 45 LYS H 2 46 ALA H . . 4.350 4.340 4.326 4.364 0.014 10 0 "[ . 1 . 2]" 1
1543 2 45 LYS HA 2 45 LYS HB3 . . 2.560 2.449 2.437 2.492 . 0 0 "[ . 1 . 2]" 1
1544 2 45 LYS HA 2 46 ALA H . . 2.560 2.289 2.281 2.313 . 0 0 "[ . 1 . 2]" 1
1545 2 45 LYS HA 2 46 ALA MB . . 5.190 3.749 3.730 3.797 . 0 0 "[ . 1 . 2]" 1
1546 2 45 LYS HB2 2 46 ALA H . . 3.920 3.985 3.972 4.002 0.082 12 0 "[ . 1 . 2]" 1
1547 2 45 LYS HB3 2 46 ALA H . . 3.520 2.962 2.887 2.990 . 0 0 "[ . 1 . 2]" 1
1548 2 45 LYS QG 2 46 ALA H . . 4.950 4.104 3.970 4.161 . 0 0 "[ . 1 . 2]" 1
1549 2 46 ALA H 2 47 CYS H . . 4.070 4.093 4.073 4.113 0.043 16 0 "[ . 1 . 2]" 1
1550 2 46 ALA HA 2 47 CYS H . . 3.080 2.192 2.187 2.202 . 0 0 "[ . 1 . 2]" 1
1551 2 46 ALA MB 2 47 CYS H . . 4.110 3.448 3.378 3.505 . 0 0 "[ . 1 . 2]" 1
1552 2 46 ALA MB 2 47 CYS HA . . 6.530 4.477 4.395 4.526 . 0 0 "[ . 1 . 2]" 1
1553 2 47 CYS H 2 47 CYS HB2 . . 2.870 2.092 2.055 2.205 . 0 0 "[ . 1 . 2]" 1
1554 2 47 CYS H 2 47 CYS HB3 . . 3.420 3.368 3.318 3.484 0.064 16 0 "[ . 1 . 2]" 1
1555 2 47 CYS H 2 48 LEU HG . . 5.440 5.107 5.044 5.248 . 0 0 "[ . 1 . 2]" 1
1556 2 47 CYS HA 2 47 CYS HB3 . . 2.800 2.751 2.646 2.789 . 0 0 "[ . 1 . 2]" 1
1557 2 47 CYS HA 2 48 LEU H . . 2.400 2.289 2.267 2.316 . 0 0 "[ . 1 . 2]" 1
1558 2 47 CYS HA 2 48 LEU HA . . 4.790 4.402 4.395 4.407 . 0 0 "[ . 1 . 2]" 1
1559 2 47 CYS HA 2 48 LEU QB . . 6.380 4.415 4.389 4.427 . 0 0 "[ . 1 . 2]" 1
1560 2 47 CYS HA 2 48 LEU MD1 . . 6.530 4.733 4.653 4.798 . 0 0 "[ . 1 . 2]" 1
1561 2 47 CYS HA 2 48 LEU MD2 . . 6.530 4.725 4.640 4.789 . 0 0 "[ . 1 . 2]" 1
1562 2 47 CYS HA 2 48 LEU HG . . 4.940 3.678 3.615 3.765 . 0 0 "[ . 1 . 2]" 1
1563 2 47 CYS HB2 2 48 LEU H . . 4.420 4.367 4.297 4.398 . 0 0 "[ . 1 . 2]" 1
1564 2 47 CYS HB3 2 48 LEU H . . 3.270 3.257 3.160 3.316 0.046 14 0 "[ . 1 . 2]" 1
1565 2 48 LEU H 2 48 LEU QB . . 3.650 2.497 2.437 2.526 . 0 0 "[ . 1 . 2]" 1
1566 2 48 LEU H 2 48 LEU MD1 . . 4.510 3.717 3.684 3.770 . 0 0 "[ . 1 . 2]" 1
1567 2 48 LEU H 2 48 LEU MD2 . . 4.700 3.934 3.912 3.965 . 0 0 "[ . 1 . 2]" 1
1568 2 48 LEU H 2 48 LEU HG . . 3.170 2.826 2.795 2.849 . 0 0 "[ . 1 . 2]" 1
1569 2 48 LEU HA 2 48 LEU MD1 . . 4.510 3.921 3.903 3.929 . 0 0 "[ . 1 . 2]" 1
1570 2 48 LEU HA 2 48 LEU MD2 . . 3.740 2.236 2.083 2.374 . 0 0 "[ . 1 . 2]" 1
1571 2 48 LEU HA 2 48 LEU HG . . 3.790 2.952 2.931 2.972 . 0 0 "[ . 1 . 2]" 1
1572 2 48 LEU HA 2 49 ASN H . . 2.520 2.460 2.392 2.490 . 0 0 "[ . 1 . 2]" 1
1573 2 48 LEU HA 2 55 VAL MG2 . . 5.440 3.385 3.171 3.688 . 0 0 "[ . 1 . 2]" 1
1574 2 48 LEU QB 2 49 ASN H . . 3.900 2.464 2.401 2.606 . 0 0 "[ . 1 . 2]" 1
1575 2 48 LEU MD1 2 49 ASN H . . 6.530 4.644 4.583 4.774 . 0 0 "[ . 1 . 2]" 1
1576 2 48 LEU MD2 2 49 ASN H . . 4.700 3.373 3.205 3.489 . 0 0 "[ . 1 . 2]" 1
1577 2 48 LEU MD2 2 55 VAL HA . . 5.810 3.926 3.655 4.265 . 0 0 "[ . 1 . 2]" 1
1578 2 48 LEU HG 2 49 ASN H . . 4.850 4.874 4.854 4.908 0.058 14 0 "[ . 1 . 2]" 1
1579 2 49 ASN H 2 49 ASN HB2 . . 2.800 2.610 2.452 2.788 . 0 0 "[ . 1 . 2]" 1
1580 2 49 ASN H 2 49 ASN HB3 . . 2.770 2.575 2.384 2.747 . 0 0 "[ . 1 . 2]" 1
1581 2 49 ASN H 2 49 ASN HD21 . . 5.500 4.722 4.629 4.863 . 0 0 "[ . 1 . 2]" 1
1582 2 49 ASN H 2 52 SER HB2 . . 4.880 4.610 4.330 4.897 0.017 17 0 "[ . 1 . 2]" 1
1583 2 49 ASN H 2 52 SER QB . . 4.740 3.631 3.466 3.923 . 0 0 "[ . 1 . 2]" 1
1584 2 49 ASN H 2 52 SER HB3 . . 4.880 3.803 3.608 4.129 . 0 0 "[ . 1 . 2]" 1
1585 2 49 ASN H 2 55 VAL MG2 . . 4.610 1.997 1.845 2.430 . 0 0 "[ . 1 . 2]" 1
1586 2 49 ASN HA 2 49 ASN HB2 . . 3.050 2.574 2.476 2.668 . 0 0 "[ . 1 . 2]" 1
1587 2 49 ASN HA 2 50 PRO HD2 . . 3.110 2.319 2.270 2.350 . 0 0 "[ . 1 . 2]" 1
1588 2 49 ASN HA 2 50 PRO HD3 . . 3.110 2.026 2.001 2.087 . 0 0 "[ . 1 . 2]" 1
1589 2 49 ASN HB2 2 49 ASN HD22 . . 3.920 3.858 3.739 3.946 0.026 17 0 "[ . 1 . 2]" 1
1590 2 49 ASN HB2 2 52 SER H . . 5.500 5.067 4.706 5.528 0.028 7 0 "[ . 1 . 2]" 1
1591 2 49 ASN HB2 2 52 SER HB2 . . 4.260 3.984 3.612 4.181 . 0 0 "[ . 1 . 2]" 1
1592 2 49 ASN HB2 2 52 SER QB . . 4.090 3.629 3.409 3.733 . 0 0 "[ . 1 . 2]" 1
1593 2 49 ASN HB2 2 52 SER HB3 . . 4.260 4.194 3.981 4.284 0.024 17 0 "[ . 1 . 2]" 1
1594 2 49 ASN HB3 2 49 ASN HD21 . . 3.110 2.177 2.107 2.321 . 0 0 "[ . 1 . 2]" 1
1595 2 49 ASN HB3 2 49 ASN HD22 . . 3.550 3.476 3.448 3.536 . 0 0 "[ . 1 . 2]" 1
1596 2 49 ASN HB3 2 52 SER H . . 4.290 3.459 3.011 3.793 . 0 0 "[ . 1 . 2]" 1
1597 2 49 ASN HB3 2 52 SER HB2 . . 3.760 2.519 2.154 2.791 . 0 0 "[ . 1 . 2]" 1
1598 2 49 ASN HB3 2 52 SER QB . . 3.580 2.235 2.052 2.459 . 0 0 "[ . 1 . 2]" 1
1599 2 49 ASN HB3 2 52 SER HB3 . . 3.760 2.526 2.308 2.814 . 0 0 "[ . 1 . 2]" 1
1600 2 49 ASN HD21 2 51 ALA MB . . 4.880 3.198 2.873 3.578 . 0 0 "[ . 1 . 2]" 1
1601 2 49 ASN HD21 2 55 VAL MG2 . . 5.540 4.354 4.032 4.471 . 0 0 "[ . 1 . 2]" 1
1602 2 49 ASN HD22 2 51 ALA MB . . 4.330 2.167 1.873 2.723 . 0 0 "[ . 1 . 2]" 1
1603 2 50 PRO HA 2 52 SER H . . 3.830 3.400 3.283 3.725 . 0 0 "[ . 1 . 2]" 1
1604 2 50 PRO HA 2 55 VAL MG1 . . 3.430 2.575 2.284 2.753 . 0 0 "[ . 1 . 2]" 1
1605 2 50 PRO HA 2 55 VAL MG2 . . 5.750 4.012 3.331 4.627 . 0 0 "[ . 1 . 2]" 1
1606 2 50 PRO HD2 2 51 ALA H . . 4.350 2.898 2.609 4.022 . 0 0 "[ . 1 . 2]" 1
1607 2 50 PRO HD3 2 51 ALA H . . 5.500 3.942 3.780 4.618 . 0 0 "[ . 1 . 2]" 1
1608 2 50 PRO HG2 2 51 ALA H . . 4.910 4.017 3.732 4.984 0.074 7 0 "[ . 1 . 2]" 1
1609 2 50 PRO HG3 2 51 ALA H . . 5.500 4.867 4.669 5.546 0.046 7 0 "[ . 1 . 2]" 1
1610 2 51 ALA H 2 51 ALA MB . . 3.520 2.306 2.148 2.813 . 0 0 "[ . 1 . 2]" 1
1611 2 51 ALA H 2 52 SER H . . 2.900 2.331 1.879 2.653 . 0 0 "[ . 1 . 2]" 1
1612 2 51 ALA H 2 52 SER HB2 . . 4.450 4.234 3.802 4.414 . 0 0 "[ . 1 . 2]" 1
1613 2 51 ALA H 2 52 SER QB . . 4.170 3.633 3.133 3.763 . 0 0 "[ . 1 . 2]" 1
1614 2 51 ALA H 2 52 SER HB3 . . 4.450 3.972 3.274 4.312 . 0 0 "[ . 1 . 2]" 1
1615 2 51 ALA HA 2 52 SER H . . 3.300 3.126 2.951 3.297 . 0 0 "[ . 1 . 2]" 1
1616 2 51 ALA MB 2 52 SER H . . 4.360 3.576 3.415 3.701 . 0 0 "[ . 1 . 2]" 1
1617 2 51 ALA MB 2 52 SER HA . . 6.530 4.121 4.007 4.207 . 0 0 "[ . 1 . 2]" 1
1618 2 52 SER H 2 52 SER HB2 . . 3.520 3.142 2.829 3.367 . 0 0 "[ . 1 . 2]" 1
1619 2 52 SER H 2 52 SER QB . . 3.110 2.370 2.255 2.484 . 0 0 "[ . 1 . 2]" 1
1620 2 52 SER H 2 52 SER HB3 . . 3.520 2.456 2.333 2.579 . 0 0 "[ . 1 . 2]" 1
1621 2 52 SER H 2 55 VAL HB . . 4.290 3.008 2.662 3.133 . 0 0 "[ . 1 . 2]" 1
1622 2 52 SER H 2 55 VAL MG1 . . 4.760 3.752 3.414 3.916 . 0 0 "[ . 1 . 2]" 1
1623 2 52 SER H 2 55 VAL MG2 . . 4.880 3.568 3.214 3.933 . 0 0 "[ . 1 . 2]" 1
1624 2 52 SER HA 2 53 PRO HD2 . . 2.830 2.603 2.548 2.666 . 0 0 "[ . 1 . 2]" 1
1625 2 52 SER HA 2 53 PRO QD . . 2.570 1.912 1.892 1.937 . 0 0 "[ . 1 . 2]" 1
1626 2 52 SER HA 2 53 PRO HD3 . . 2.830 1.967 1.951 1.990 . 0 0 "[ . 1 . 2]" 1
1627 2 52 SER HA 2 54 MET H . . 4.690 4.029 3.729 4.381 . 0 0 "[ . 1 . 2]" 1
1628 2 52 SER QB 2 54 MET H . . 4.670 3.683 2.998 4.119 . 0 0 "[ . 1 . 2]" 1
1629 2 52 SER QB 2 55 VAL H . . 4.210 2.914 2.562 3.164 . 0 0 "[ . 1 . 2]" 1
1630 2 52 SER QB 2 55 VAL HB . . 4.920 2.436 1.990 3.034 . 0 0 "[ . 1 . 2]" 1
1631 2 52 SER QB 2 55 VAL MG2 . . 4.510 2.034 1.878 2.302 . 0 0 "[ . 1 . 2]" 1
1632 2 52 SER HB2 2 55 VAL MG2 . . 4.820 3.311 2.994 3.535 . 0 0 "[ . 1 . 2]" 1
1633 2 52 SER HB3 2 55 VAL MG2 . . 4.820 2.054 1.898 2.341 . 0 0 "[ . 1 . 2]" 1
1634 2 53 PRO HA 2 54 MET H . . 3.420 3.444 3.251 3.525 0.105 10 0 "[ . 1 . 2]" 1
1635 2 53 PRO HA 2 55 VAL H . . 4.350 3.852 3.662 4.109 . 0 0 "[ . 1 . 2]" 1
1636 2 53 PRO HA 2 56 LYS H . . 3.670 3.543 3.406 3.691 0.021 7 0 "[ . 1 . 2]" 1
1637 2 53 PRO HA 2 56 LYS QB . . 4.360 3.456 3.172 3.966 . 0 0 "[ . 1 . 2]" 1
1638 2 53 PRO QB 2 54 MET H . . 4.370 3.333 2.970 3.779 . 0 0 "[ . 1 . 2]" 1
1639 2 53 PRO QD 2 54 MET H . . 5.050 2.300 2.234 2.643 . 0 0 "[ . 1 . 2]" 1
1640 2 54 MET H 2 54 MET HA . . 2.900 2.821 2.750 2.902 0.002 17 0 "[ . 1 . 2]" 1
1641 2 54 MET H 2 54 MET QB . . 3.540 2.114 1.985 2.237 . 0 0 "[ . 1 . 2]" 1
1642 2 54 MET H 2 54 MET ME . . 4.450 3.191 2.347 3.544 . 0 0 "[ . 1 . 2]" 1
1643 2 54 MET H 2 54 MET QG . . 4.800 3.956 3.820 4.066 . 0 0 "[ . 1 . 2]" 1
1644 2 54 MET H 2 55 VAL H . . 2.900 2.480 2.125 2.715 . 0 0 "[ . 1 . 2]" 1
1645 2 54 MET HA 2 54 MET ME . . 3.430 2.224 1.923 2.629 . 0 0 "[ . 1 . 2]" 1
1646 2 54 MET HA 2 55 VAL H . . 3.520 3.500 3.432 3.537 0.017 19 0 "[ . 1 . 2]" 1
1647 2 54 MET HA 2 55 VAL HA . . 4.690 4.741 4.677 4.779 0.089 6 0 "[ . 1 . 2]" 1
1648 2 54 MET HA 2 56 LYS H . . 3.890 3.521 3.377 3.659 . 0 0 "[ . 1 . 2]" 1
1649 2 54 MET HA 2 57 LYS H . . 3.520 3.431 3.326 3.523 0.003 15 0 "[ . 1 . 2]" 1
1650 2 54 MET HA 2 58 ILE MD . . 6.500 3.876 3.630 4.125 . 0 0 "[ . 1 . 2]" 1
1651 2 54 MET QB 2 55 VAL H . . 4.550 3.002 2.890 3.176 . 0 0 "[ . 1 . 2]" 1
1652 2 54 MET QG 2 55 VAL H . . 6.310 4.388 4.033 4.662 . 0 0 "[ . 1 . 2]" 1
1653 2 54 MET QG 2 55 VAL MG2 . . 7.400 4.616 4.153 5.046 . 0 0 "[ . 1 . 2]" 1
1654 2 54 MET QG 2 58 ILE MD . . 6.230 2.260 1.808 3.068 . 0 0 "[ . 1 . 2]" 1
1655 2 55 VAL H 2 55 VAL HA . . 2.710 2.852 2.827 2.889 0.179 16 0 "[ . 1 . 2]" 1
1656 2 55 VAL H 2 55 VAL HB . . 2.400 2.144 2.081 2.250 . 0 0 "[ . 1 . 2]" 1
1657 2 55 VAL H 2 55 VAL MG1 . . 4.360 3.585 3.530 3.663 . 0 0 "[ . 1 . 2]" 1
1658 2 55 VAL H 2 55 VAL MG2 . . 3.430 2.655 2.451 2.821 . 0 0 "[ . 1 . 2]" 1
1659 2 55 VAL H 2 56 LYS H . . 2.650 2.478 2.354 2.546 . 0 0 "[ . 1 . 2]" 1
1660 2 55 VAL H 2 56 LYS QD . . 5.290 4.157 2.652 4.796 . 0 0 "[ . 1 . 2]" 1
1661 2 55 VAL H 2 58 ILE MD . . 5.070 3.833 3.627 4.050 . 0 0 "[ . 1 . 2]" 1
1662 2 55 VAL HA 2 55 VAL HB . . 2.930 2.992 2.974 3.016 0.086 5 0 "[ . 1 . 2]" 1
1663 2 55 VAL HA 2 55 VAL MG1 . . 3.680 2.607 2.482 2.705 . 0 0 "[ . 1 . 2]" 1
1664 2 55 VAL HA 2 55 VAL MG2 . . 3.520 2.172 2.027 2.350 . 0 0 "[ . 1 . 2]" 1
1665 2 55 VAL HA 2 56 LYS H . . 3.420 3.426 3.343 3.487 0.067 18 0 "[ . 1 . 2]" 1
1666 2 55 VAL HA 2 56 LYS HA . . 4.600 4.586 4.534 4.613 0.013 11 0 "[ . 1 . 2]" 1
1667 2 55 VAL HA 2 57 LYS H . . 4.010 3.489 3.411 3.567 . 0 0 "[ . 1 . 2]" 1
1668 2 55 VAL HA 2 58 ILE H . . 3.830 3.218 3.109 3.342 . 0 0 "[ . 1 . 2]" 1
1669 2 55 VAL HA 2 58 ILE HB . . 3.210 2.832 2.720 3.006 . 0 0 "[ . 1 . 2]" 1
1670 2 55 VAL HA 2 58 ILE MD . . 3.800 2.241 2.058 2.503 . 0 0 "[ . 1 . 2]" 1
1671 2 55 VAL HA 2 58 ILE QG . . 4.860 3.748 3.499 3.937 . 0 0 "[ . 1 . 2]" 1
1672 2 55 VAL HA 2 58 ILE MG . . 6.530 4.259 4.155 4.388 . 0 0 "[ . 1 . 2]" 1
1673 2 55 VAL HA 2 59 ILE H . . 4.420 4.478 4.446 4.543 0.123 16 0 "[ . 1 . 2]" 1
1674 2 55 VAL HB 2 56 LYS H . . 3.640 3.426 3.279 3.586 . 0 0 "[ . 1 . 2]" 1
1675 2 55 VAL HB 2 56 LYS HA . . 5.500 4.883 4.762 4.956 . 0 0 "[ . 1 . 2]" 1
1676 2 55 VAL MG1 2 56 LYS H . . 5.290 3.663 3.415 3.944 . 0 0 "[ . 1 . 2]" 1
1677 2 55 VAL MG2 2 56 LYS H . . 6.030 4.312 4.218 4.381 . 0 0 "[ . 1 . 2]" 1
1678 2 56 LYS H 2 56 LYS QB . . 3.340 2.581 2.410 2.919 . 0 0 "[ . 1 . 2]" 1
1679 2 56 LYS H 2 56 LYS QD . . 5.010 3.077 1.842 3.749 . 0 0 "[ . 1 . 2]" 1
1680 2 56 LYS H 2 56 LYS HG2 . . 3.830 2.709 2.003 3.989 0.159 11 0 "[ . 1 . 2]" 1
1681 2 56 LYS H 2 56 LYS QG . . 3.630 2.431 1.914 3.347 . 0 0 "[ . 1 . 2]" 1
1682 2 56 LYS H 2 56 LYS HG3 . . 3.830 3.466 1.922 3.730 . 0 0 "[ . 1 . 2]" 1
1683 2 56 LYS H 2 57 LYS H . . 2.490 2.318 2.160 2.398 . 0 0 "[ . 1 . 2]" 1
1684 2 56 LYS H 2 58 ILE H . . 5.040 3.776 3.630 3.862 . 0 0 "[ . 1 . 2]" 1
1685 2 56 LYS HA 2 56 LYS HD2 . . 3.950 2.557 1.985 3.964 0.014 16 0 "[ . 1 . 2]" 1
1686 2 56 LYS HA 2 56 LYS HD3 . . 3.950 3.699 3.381 3.871 . 0 0 "[ . 1 . 2]" 1
1687 2 56 LYS HA 2 56 LYS HG2 . . 4.200 3.292 3.008 4.255 0.055 16 0 "[ . 1 . 2]" 1
1688 2 56 LYS HA 2 56 LYS QG . . 3.730 2.857 2.345 3.483 . 0 0 "[ . 1 . 2]" 1
1689 2 56 LYS HA 2 56 LYS HG3 . . 4.200 3.478 2.379 3.891 . 0 0 "[ . 1 . 2]" 1
1690 2 56 LYS HA 2 57 LYS H . . 3.240 3.268 3.261 3.278 0.038 16 0 "[ . 1 . 2]" 1
1691 2 56 LYS HA 2 59 ILE H . . 3.890 3.598 3.514 3.661 . 0 0 "[ . 1 . 2]" 1
1692 2 56 LYS HA 2 59 ILE MD . . 4.360 3.055 2.862 3.201 . 0 0 "[ . 1 . 2]" 1
1693 2 56 LYS HA 2 59 ILE QG . . 6.380 4.612 4.379 4.762 . 0 0 "[ . 1 . 2]" 1
1694 2 56 LYS HA 2 59 ILE MG . . 6.530 4.268 4.156 4.354 . 0 0 "[ . 1 . 2]" 1
1695 2 56 LYS HA 2 60 GLU H . . 3.920 3.889 3.734 3.967 0.047 11 0 "[ . 1 . 2]" 1
1696 2 57 LYS H 2 57 LYS HA . . 2.830 2.939 2.938 2.940 0.110 14 0 "[ . 1 . 2]" 1
1697 2 57 LYS H 2 57 LYS QB . . 3.340 2.595 2.443 2.800 . 0 0 "[ . 1 . 2]" 1
1698 2 57 LYS H 2 57 LYS QD . . 5.200 4.491 4.052 4.698 . 0 0 "[ . 1 . 2]" 1
1699 2 57 LYS H 2 57 LYS HG2 . . 3.420 3.399 3.297 3.443 0.023 16 0 "[ . 1 . 2]" 1
1700 2 57 LYS H 2 57 LYS HG3 . . 3.420 3.032 2.339 3.538 0.118 16 0 "[ . 1 . 2]" 1
1701 2 57 LYS H 2 58 ILE H . . 2.870 1.817 1.788 1.845 . 0 0 "[ . 1 . 2]" 1
1702 2 57 LYS H 2 59 ILE H . . 4.260 3.348 3.324 3.368 . 0 0 "[ . 1 . 2]" 1
1703 2 57 LYS HA 2 57 LYS QD . . 4.240 3.408 3.107 3.643 . 0 0 "[ . 1 . 2]" 1
1704 2 57 LYS HA 2 57 LYS QG . . 3.840 2.600 2.202 3.396 . 0 0 "[ . 1 . 2]" 1
1705 2 57 LYS HA 2 58 ILE H . . 3.390 3.446 3.439 3.462 0.072 16 0 "[ . 1 . 2]" 1
1706 2 57 LYS HA 2 59 ILE H . . 5.500 3.824 3.793 3.864 . 0 0 "[ . 1 . 2]" 1
1707 2 57 LYS HA 2 60 GLU H . . 4.170 3.630 3.581 3.701 . 0 0 "[ . 1 . 2]" 1
1708 2 57 LYS HA 2 60 GLU QB . . 3.710 2.896 2.851 2.946 . 0 0 "[ . 1 . 2]" 1
1709 2 57 LYS HA 2 60 GLU HG3 . . 4.480 4.508 4.480 4.550 0.070 19 0 "[ . 1 . 2]" 1
1710 2 57 LYS HA 2 61 LYS H . . 4.010 3.748 3.602 3.846 . 0 0 "[ . 1 . 2]" 1
1711 2 57 LYS QG 2 58 ILE H . . 5.290 3.761 2.537 4.378 . 0 0 "[ . 1 . 2]" 1
1712 2 57 LYS HG2 2 58 ILE H . . 5.500 4.595 4.155 4.801 . 0 0 "[ . 1 . 2]" 1
1713 2 57 LYS HG3 2 58 ILE H . . 5.500 4.163 2.559 5.049 . 0 0 "[ . 1 . 2]" 1
1714 2 58 ILE H 2 58 ILE HA . . 2.870 2.907 2.902 2.915 0.045 6 0 "[ . 1 . 2]" 1
1715 2 58 ILE H 2 58 ILE HB . . 2.400 2.411 2.363 2.442 0.042 6 0 "[ . 1 . 2]" 1
1716 2 58 ILE H 2 58 ILE MD . . 3.990 3.232 3.171 3.280 . 0 0 "[ . 1 . 2]" 1
1717 2 58 ILE H 2 58 ILE HG12 . . 3.860 3.887 3.828 3.952 0.092 4 0 "[ . 1 . 2]" 1
1718 2 58 ILE H 2 58 ILE QG . . 3.690 2.463 2.398 2.551 . 0 0 "[ . 1 . 2]" 1
1719 2 58 ILE H 2 58 ILE HG13 . . 3.860 2.491 2.423 2.583 . 0 0 "[ . 1 . 2]" 1
1720 2 58 ILE H 2 58 ILE MG . . 4.640 3.739 3.718 3.756 . 0 0 "[ . 1 . 2]" 1
1721 2 58 ILE H 2 59 ILE H . . 2.590 2.198 2.155 2.229 . 0 0 "[ . 1 . 2]" 1
1722 2 58 ILE H 2 59 ILE QG . . 6.380 4.135 3.914 4.218 . 0 0 "[ . 1 . 2]" 1
1723 2 58 ILE HA 2 58 ILE MD . . 4.640 3.875 3.853 3.887 . 0 0 "[ . 1 . 2]" 1
1724 2 58 ILE HA 2 58 ILE HG12 . . 3.050 2.811 2.783 2.853 . 0 0 "[ . 1 . 2]" 1
1725 2 58 ILE HA 2 58 ILE QG . . 2.720 2.448 2.410 2.467 . 0 0 "[ . 1 . 2]" 1
1726 2 58 ILE HA 2 58 ILE HG13 . . 3.050 2.695 2.636 2.740 . 0 0 "[ . 1 . 2]" 1
1727 2 58 ILE HA 2 58 ILE MG . . 3.680 2.383 2.316 2.461 . 0 0 "[ . 1 . 2]" 1
1728 2 58 ILE HA 2 59 ILE H . . 3.390 3.454 3.451 3.463 0.073 16 0 "[ . 1 . 2]" 1
1729 2 58 ILE HA 2 61 LYS H . . 3.730 3.820 3.785 3.848 0.118 15 0 "[ . 1 . 2]" 1
1730 2 58 ILE HA 2 62 MET H . . 4.230 4.276 4.247 4.307 0.077 10 0 "[ . 1 . 2]" 1
1731 2 58 ILE HA 2 62 MET QG . . 6.380 4.761 4.401 4.984 . 0 0 "[ . 1 . 2]" 1
1732 2 58 ILE HB 2 59 ILE H . . 3.480 3.315 3.287 3.326 . 0 0 "[ . 1 . 2]" 1
1733 2 58 ILE MD 2 59 ILE H . . 6.160 4.694 4.628 4.747 . 0 0 "[ . 1 . 2]" 1
1734 2 58 ILE QG 2 59 ILE H . . 6.380 4.237 4.206 4.296 . 0 0 "[ . 1 . 2]" 1
1735 2 58 ILE MG 2 59 ILE H . . 5.040 3.963 3.901 4.017 . 0 0 "[ . 1 . 2]" 1
1736 2 58 ILE MG 2 62 MET QG . . 5.450 3.394 3.122 3.610 . 0 0 "[ . 1 . 2]" 1
1737 2 59 ILE H 2 59 ILE HB . . 2.400 2.255 2.236 2.315 . 0 0 "[ . 1 . 2]" 1
1738 2 59 ILE H 2 59 ILE MD . . 4.260 3.463 3.407 3.529 . 0 0 "[ . 1 . 2]" 1
1739 2 59 ILE H 2 59 ILE QG . . 3.520 2.899 2.754 2.960 . 0 0 "[ . 1 . 2]" 1
1740 2 59 ILE H 2 59 ILE MG . . 4.230 3.622 3.603 3.681 . 0 0 "[ . 1 . 2]" 1
1741 2 59 ILE H 2 60 GLU H . . 3.050 2.378 2.323 2.478 . 0 0 "[ . 1 . 2]" 1
1742 2 59 ILE H 2 60 GLU HG3 . . 5.500 4.242 4.172 4.357 . 0 0 "[ . 1 . 2]" 1
1743 2 59 ILE HA 2 59 ILE HB . . 2.830 2.999 2.995 3.010 0.180 19 0 "[ . 1 . 2]" 1
1744 2 59 ILE HA 2 59 ILE MD . . 4.360 3.785 3.774 3.823 . 0 0 "[ . 1 . 2]" 1
1745 2 59 ILE HA 2 59 ILE HG12 . . 2.680 2.692 2.629 2.710 0.030 14 0 "[ . 1 . 2]" 1
1746 2 59 ILE HA 2 59 ILE HG13 . . 2.680 2.490 2.450 2.617 . 0 0 "[ . 1 . 2]" 1
1747 2 59 ILE HA 2 59 ILE MG . . 3.490 2.556 2.479 2.614 . 0 0 "[ . 1 . 2]" 1
1748 2 59 ILE HA 2 60 GLU H . . 3.610 3.635 3.631 3.639 0.029 16 0 "[ . 1 . 2]" 1
1749 2 59 ILE HA 2 61 LYS H . . 4.170 4.161 4.085 4.202 0.032 19 0 "[ . 1 . 2]" 1
1750 2 59 ILE HA 2 62 MET H . . 3.170 3.126 3.070 3.181 0.011 19 0 "[ . 1 . 2]" 1
1751 2 59 ILE HA 2 62 MET HB2 . . 2.680 2.189 2.039 2.254 . 0 0 "[ . 1 . 2]" 1
1752 2 59 ILE HA 2 62 MET HB3 . . 3.550 3.538 3.332 3.606 0.056 3 0 "[ . 1 . 2]" 1
1753 2 59 ILE HA 2 62 MET HG2 . . 4.140 4.118 3.799 4.224 0.084 10 0 "[ . 1 . 2]" 1
1754 2 59 ILE HA 2 62 MET QG . . 3.860 3.448 3.251 3.533 . 0 0 "[ . 1 . 2]" 1
1755 2 59 ILE HA 2 62 MET HG3 . . 4.140 3.704 3.516 3.843 . 0 0 "[ . 1 . 2]" 1
1756 2 59 ILE HB 2 60 GLU H . . 2.800 2.546 2.465 2.603 . 0 0 "[ . 1 . 2]" 1
1757 2 59 ILE MD 2 60 GLU H . . 6.310 4.256 4.226 4.290 . 0 0 "[ . 1 . 2]" 1
1758 2 59 ILE QG 2 60 GLU H . . 6.380 4.272 4.209 4.301 . 0 0 "[ . 1 . 2]" 1
1759 2 59 ILE MG 2 60 GLU H . . 4.920 2.870 2.716 3.127 . 0 0 "[ . 1 . 2]" 1
1760 2 59 ILE MG 2 60 GLU HA . . 4.570 3.104 2.925 3.346 . 0 0 "[ . 1 . 2]" 1
1761 2 59 ILE MG 2 60 GLU HG3 . . 5.850 3.020 2.864 3.173 . 0 0 "[ . 1 . 2]" 1
1762 2 60 GLU H 2 60 GLU QB . . 3.570 2.413 2.397 2.427 . 0 0 "[ . 1 . 2]" 1
1763 2 60 GLU H 2 60 GLU HG2 . . 3.520 3.560 3.544 3.580 0.060 18 0 "[ . 1 . 2]" 1
1764 2 60 GLU H 2 60 GLU HG3 . . 3.790 2.129 2.109 2.154 . 0 0 "[ . 1 . 2]" 1
1765 2 60 GLU H 2 61 LYS H . . 3.020 2.771 2.707 2.847 . 0 0 "[ . 1 . 2]" 1
1766 2 60 GLU HA 2 60 GLU HG2 . . 2.650 2.687 2.645 2.716 0.066 15 0 "[ . 1 . 2]" 1
1767 2 60 GLU HA 2 60 GLU HG3 . . 3.140 2.685 2.649 2.726 . 0 0 "[ . 1 . 2]" 1
1768 2 60 GLU HA 2 62 MET H . . 4.720 4.219 4.065 4.339 . 0 0 "[ . 1 . 2]" 1
1769 2 60 GLU HA 2 63 LEU H . . 4.040 3.467 3.417 3.572 . 0 0 "[ . 1 . 2]" 1
1770 2 60 GLU HA 2 63 LEU MD1 . . 5.160 3.006 2.844 3.172 . 0 0 "[ . 1 . 2]" 1
1771 2 60 GLU HA 2 63 LEU MD2 . . 6.530 3.275 2.822 3.561 . 0 0 "[ . 1 . 2]" 1
1772 2 60 GLU HG3 2 61 LYS H . . 5.000 4.476 4.442 4.498 . 0 0 "[ . 1 . 2]" 1
1773 2 60 GLU HG3 2 63 LEU MD1 . . 5.940 4.760 4.717 4.806 . 0 0 "[ . 1 . 2]" 1
1774 2 61 LYS H 2 61 LYS QB . . 3.770 2.204 2.102 2.371 . 0 0 "[ . 1 . 2]" 1
1775 2 61 LYS H 2 61 LYS HG2 . . 4.450 3.153 2.297 3.988 . 0 0 "[ . 1 . 2]" 1
1776 2 61 LYS H 2 61 LYS QG . . 3.760 2.678 2.261 2.929 . 0 0 "[ . 1 . 2]" 1
1777 2 61 LYS H 2 61 LYS HG3 . . 4.450 3.202 2.670 3.755 . 0 0 "[ . 1 . 2]" 1
1778 2 61 LYS HA 2 64 LYS H . . 3.210 3.277 3.254 3.299 0.089 1 0 "[ . 1 . 2]" 1
1779 2 62 MET H 2 62 MET HB2 . . 2.680 1.974 1.968 1.984 . 0 0 "[ . 1 . 2]" 1
1780 2 62 MET H 2 62 MET HB3 . . 3.170 3.209 3.150 3.236 0.066 1 0 "[ . 1 . 2]" 1
1781 2 62 MET H 2 62 MET HG2 . . 4.480 3.435 3.365 3.550 . 0 0 "[ . 1 . 2]" 1
1782 2 62 MET H 2 62 MET QG . . 3.830 3.283 3.220 3.382 . 0 0 "[ . 1 . 2]" 1
1783 2 62 MET H 2 62 MET HG3 . . 4.480 4.174 4.088 4.258 . 0 0 "[ . 1 . 2]" 1
1784 2 62 MET H 2 63 LEU H . . 3.110 2.689 2.571 2.786 . 0 0 "[ . 1 . 2]" 1
1785 2 62 MET HA 2 62 MET HB2 . . 2.930 2.901 2.867 2.915 . 0 0 "[ . 1 . 2]" 1
1786 2 62 MET HA 2 62 MET HB3 . . 2.800 2.906 2.894 2.937 0.137 15 0 "[ . 1 . 2]" 1
1787 2 62 MET HA 2 62 MET ME . . 4.170 3.388 3.250 3.490 . 0 0 "[ . 1 . 2]" 1
1788 2 62 MET HA 2 62 MET HG2 . . 3.950 2.475 2.354 2.583 . 0 0 "[ . 1 . 2]" 1
1789 2 62 MET HA 2 62 MET QG . . 3.430 2.432 2.324 2.527 . 0 0 "[ . 1 . 2]" 1
1790 2 62 MET HA 2 62 MET HG3 . . 3.950 3.583 3.571 3.589 . 0 0 "[ . 1 . 2]" 1
1791 2 62 MET HA 2 65 ASN H . . 5.040 2.904 2.858 2.957 . 0 0 "[ . 1 . 2]" 1
1792 2 62 MET HA 2 65 ASN HA . . 3.110 3.148 3.121 3.175 0.065 7 0 "[ . 1 . 2]" 1
1793 2 62 MET HB2 2 63 LEU H . . 3.480 3.185 3.089 3.258 . 0 0 "[ . 1 . 2]" 1
1794 2 63 LEU H 2 63 LEU HB2 . . 3.210 2.220 2.204 2.248 . 0 0 "[ . 1 . 2]" 1
1795 2 63 LEU H 2 63 LEU HB3 . . 3.790 3.488 3.480 3.499 . 0 0 "[ . 1 . 2]" 1
1796 2 63 LEU H 2 63 LEU MD1 . . 5.130 2.095 2.013 2.142 . 0 0 "[ . 1 . 2]" 1
1797 2 63 LEU H 2 63 LEU HG . . 3.790 3.846 3.795 3.888 0.098 9 0 "[ . 1 . 2]" 1
1798 2 63 LEU H 2 64 LYS H . . 3.140 2.527 2.466 2.578 . 0 0 "[ . 1 . 2]" 1
1799 2 63 LEU HA 2 64 LYS H . . 3.420 3.444 3.442 3.448 0.028 16 0 "[ . 1 . 2]" 1
1800 2 63 LEU MD1 2 64 LYS H . . 6.530 4.080 4.019 4.147 . 0 0 "[ . 1 . 2]" 1
1801 2 63 LEU MD2 2 64 LYS H . . 6.530 5.199 5.100 5.245 . 0 0 "[ . 1 . 2]" 1
1802 2 64 LYS H 2 64 LYS HB2 . . 3.480 2.527 2.247 3.161 . 0 0 "[ . 1 . 2]" 1
1803 2 64 LYS H 2 64 LYS QB . . 3.290 2.245 2.218 2.275 . 0 0 "[ . 1 . 2]" 1
1804 2 64 LYS H 2 64 LYS HB3 . . 3.480 3.050 2.301 3.484 0.004 14 0 "[ . 1 . 2]" 1
1805 2 64 LYS H 2 64 LYS HG2 . . 4.260 4.077 3.638 4.295 0.035 16 0 "[ . 1 . 2]" 1
1806 2 64 LYS H 2 64 LYS HG3 . . 4.260 3.987 3.371 4.331 0.071 3 0 "[ . 1 . 2]" 1
1807 2 64 LYS H 2 65 ASN H . . 3.270 2.007 1.970 2.028 . 0 0 "[ . 1 . 2]" 1
1808 2 64 LYS HA 2 65 ASN H . . 3.520 3.527 3.477 3.556 0.036 6 0 "[ . 1 . 2]" 1
1809 2 64 LYS HA 2 66 GLY H . . 4.350 4.416 4.402 4.433 0.083 9 0 "[ . 1 . 2]" 1
1810 2 64 LYS QB 2 65 ASN H . . 4.080 3.077 2.969 3.196 . 0 0 "[ . 1 . 2]" 1
1811 2 64 LYS HB2 2 65 ASN H . . 4.880 3.641 3.170 4.337 . 0 0 "[ . 1 . 2]" 1
1812 2 64 LYS HB3 2 65 ASN H . . 4.880 3.464 3.122 3.789 . 0 0 "[ . 1 . 2]" 1
1813 2 65 ASN H 2 65 ASN HB2 . . 3.520 3.260 3.255 3.267 . 0 0 "[ . 1 . 2]" 1
1814 2 65 ASN H 2 65 ASN QB . . 3.250 3.004 3.001 3.007 . 0 0 "[ . 1 . 2]" 1
1815 2 65 ASN H 2 65 ASN HB3 . . 3.520 3.518 3.505 3.532 0.012 3 0 "[ . 1 . 2]" 1
1816 2 65 ASN H 2 66 GLY H . . 4.690 4.015 3.995 4.030 . 0 0 "[ . 1 . 2]" 1
1817 2 65 ASN QB 2 66 GLY H . . 3.170 1.919 1.908 1.927 . 0 0 "[ . 1 . 2]" 1
1818 2 65 ASN HB2 2 66 GLY H . . 3.390 3.486 3.478 3.496 0.106 13 0 "[ . 1 . 2]" 1
1819 2 65 ASN HB3 2 66 GLY H . . 3.390 1.928 1.917 1.936 . 0 0 "[ . 1 . 2]" 1
1820 2 66 GLY QA 2 67 LYS H . . 3.220 2.249 2.171 2.330 . 0 0 "[ . 1 . 2]" 1
1821 2 66 GLY HA2 2 67 LYS H . . 3.450 2.833 2.213 3.333 . 0 0 "[ . 1 . 2]" 1
1822 2 66 GLY HA3 2 67 LYS H . . 3.450 2.500 2.200 3.409 . 0 0 "[ . 1 . 2]" 1
1823 2 67 LYS H 2 67 LYS HB2 . . 3.450 2.398 2.053 2.979 . 0 0 "[ . 1 . 2]" 1
1824 2 67 LYS H 2 67 LYS QB . . 3.250 2.319 2.034 2.769 . 0 0 "[ . 1 . 2]" 1
1825 2 67 LYS H 2 67 LYS HB3 . . 3.450 3.274 2.838 3.474 0.024 11 0 "[ . 1 . 2]" 1
1826 2 67 LYS HB2 2 68 SER H . . 3.480 3.237 2.513 3.485 0.005 14 0 "[ . 1 . 2]" 1
1827 2 67 LYS HB3 2 68 SER H . . 3.480 2.294 1.946 2.808 . 0 0 "[ . 1 . 2]" 1
1828 2 68 SER H 2 68 SER HA . . 2.800 2.592 2.169 2.834 0.034 8 0 "[ . 1 . 2]" 1
1829 2 68 SER H 2 69 ASN H . . 3.520 3.089 2.329 3.518 . 0 0 "[ . 1 . 2]" 1
1830 2 69 ASN H 2 69 ASN HA . . 2.770 2.488 2.167 2.793 0.023 3 0 "[ . 1 . 2]" 1
1831 2 69 ASN H 2 69 ASN HB2 . . 3.860 3.023 2.173 3.863 0.003 3 0 "[ . 1 . 2]" 1
1832 2 69 ASN H 2 69 ASN HB3 . . 3.860 3.399 2.522 3.865 0.005 12 0 "[ . 1 . 2]" 1
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