NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
408481 |
1yus   |
6532 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1yus
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 1968
_Distance_constraint_stats_list.Viol_count 1918
_Distance_constraint_stats_list.Viol_total 2714.832
_Distance_constraint_stats_list.Viol_max 1.103
_Distance_constraint_stats_list.Viol_rms 0.0180
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0022
_Distance_constraint_stats_list.Viol_average_violations_only 0.0566
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ALA 0.176 0.132 23 0 "[ . 1 . 2 .]"
1 3 ALA 0.440 0.120 8 0 "[ . 1 . 2 .]"
1 4 GLU 4.673 0.198 14 0 "[ . 1 . 2 .]"
1 5 PRO 1.255 0.177 11 0 "[ . 1 . 2 .]"
1 6 LEU 2.459 0.184 16 0 "[ . 1 . 2 .]"
1 7 THR 0.328 0.122 9 0 "[ . 1 . 2 .]"
1 8 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 9 LEU 2.063 0.148 9 0 "[ . 1 . 2 .]"
1 10 GLU 0.610 0.118 12 0 "[ . 1 . 2 .]"
1 11 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 12 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 13 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 14 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 15 THR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 16 VAL 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 17 VAL 0.695 0.098 19 0 "[ . 1 . 2 .]"
1 18 THR 0.224 0.053 17 0 "[ . 1 . 2 .]"
1 19 THR 0.260 0.053 17 0 "[ . 1 . 2 .]"
1 20 PHE 1.062 0.143 17 0 "[ . 1 . 2 .]"
1 21 PHE 0.480 0.255 25 0 "[ . 1 . 2 .]"
1 22 THR 0.480 0.255 25 0 "[ . 1 . 2 .]"
1 23 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 28 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 29 ARG 0.033 0.033 12 0 "[ . 1 . 2 .]"
1 30 LYS 0.422 0.069 22 0 "[ . 1 . 2 .]"
1 31 ASP 0.365 0.069 22 0 "[ . 1 . 2 .]"
1 32 SER 0.718 0.124 16 0 "[ . 1 . 2 .]"
1 33 LEU 2.064 0.162 22 0 "[ . 1 . 2 .]"
1 34 SER 0.989 0.113 14 0 "[ . 1 . 2 .]"
1 35 VAL 2.384 0.124 7 0 "[ . 1 . 2 .]"
1 36 ASN 2.909 0.136 17 0 "[ . 1 . 2 .]"
1 37 GLU 0.158 0.034 25 0 "[ . 1 . 2 .]"
1 38 PHE 0.566 0.162 22 0 "[ . 1 . 2 .]"
1 39 LYS 0.222 0.095 6 0 "[ . 1 . 2 .]"
1 40 GLU 0.186 0.095 6 0 "[ . 1 . 2 .]"
1 42 VAL 1.855 0.152 22 0 "[ . 1 . 2 .]"
1 43 THR 0.100 0.063 13 0 "[ . 1 . 2 .]"
1 44 GLN 0.244 0.113 8 0 "[ . 1 . 2 .]"
1 45 GLN 2.293 0.187 22 0 "[ . 1 . 2 .]"
1 46 LEU 0.187 0.113 8 0 "[ . 1 . 2 .]"
1 47 PRO 0.024 0.024 3 0 "[ . 1 . 2 .]"
1 48 HIS 1.367 0.405 8 0 "[ . 1 . 2 .]"
1 50 LEU 1.885 0.152 8 0 "[ . 1 . 2 .]"
1 51 LYS 6.578 1.103 21 1 "[ . 1 . 2+ .]"
1 52 ASP 2.092 0.236 21 0 "[ . 1 . 2 .]"
1 53 VAL 2.543 0.156 17 0 "[ . 1 . 2 .]"
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 56 LEU 1.143 0.088 7 0 "[ . 1 . 2 .]"
1 57 ASP 1.501 0.138 14 0 "[ . 1 . 2 .]"
1 58 GLU 0.019 0.019 19 0 "[ . 1 . 2 .]"
1 59 LYS 2.780 0.165 1 0 "[ . 1 . 2 .]"
1 60 MET 0.563 0.108 8 0 "[ . 1 . 2 .]"
1 61 LYS 1.889 0.087 14 0 "[ . 1 . 2 .]"
1 62 SER 1.497 0.082 19 0 "[ . 1 . 2 .]"
1 63 LEU 3.935 0.136 17 0 "[ . 1 . 2 .]"
1 64 ASP 0.476 0.062 19 0 "[ . 1 . 2 .]"
1 65 VAL 0.946 0.097 2 0 "[ . 1 . 2 .]"
1 66 ASN 0.104 0.028 16 0 "[ . 1 . 2 .]"
1 67 GLN 1.977 0.141 6 0 "[ . 1 . 2 .]"
1 68 ASP 1.257 0.102 3 0 "[ . 1 . 2 .]"
1 69 SER 0.279 0.051 13 0 "[ . 1 . 2 .]"
1 70 GLU 2.165 0.182 19 0 "[ . 1 . 2 .]"
1 71 LEU 2.824 0.182 19 0 "[ . 1 . 2 .]"
1 72 LYS 0.585 0.124 16 0 "[ . 1 . 2 .]"
1 73 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 74 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 75 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 77 TRP 8.822 0.898 25 2 "[ . - . 2 +]"
1 78 ARG 5.609 0.198 22 0 "[ . 1 . 2 .]"
1 79 LEU 0.730 0.132 13 0 "[ . 1 . 2 .]"
1 80 ILE 1.927 0.165 1 0 "[ . 1 . 2 .]"
1 81 GLY 0.510 0.073 23 0 "[ . 1 . 2 .]"
1 82 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 84 ALA 6.677 0.786 7 3 "[ .-+ 1 . 2 * .]"
1 85 LYS 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 86 GLU 1.826 0.156 17 0 "[ . 1 . 2 .]"
1 87 ILE 3.053 1.103 21 1 "[ . 1 . 2+ .]"
1 88 ARG 0.016 0.016 8 0 "[ . 1 . 2 .]"
1 89 LYS 1.074 0.079 25 0 "[ . 1 . 2 .]"
1 92 ASP 2.275 0.234 13 0 "[ . 1 . 2 .]"
1 93 LEU 1.705 0.234 13 0 "[ . 1 . 2 .]"
1 94 LYS 1.380 0.405 8 0 "[ . 1 . 2 .]"
1 95 ILE 1.666 0.190 16 0 "[ . 1 . 2 .]"
1 96 ARG 2.423 0.229 17 0 "[ . 1 . 2 .]"
2 2 ALA 1.097 0.267 15 0 "[ . 1 . 2 .]"
2 3 ALA 0.421 0.267 15 0 "[ . 1 . 2 .]"
2 4 GLU 4.981 0.263 12 0 "[ . 1 . 2 .]"
2 5 PRO 1.362 0.183 12 0 "[ . 1 . 2 .]"
2 6 LEU 1.810 0.263 12 0 "[ . 1 . 2 .]"
2 7 THR 0.344 0.106 23 0 "[ . 1 . 2 .]"
2 8 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 9 LEU 1.753 0.187 22 0 "[ . 1 . 2 .]"
2 10 GLU 1.090 0.241 22 0 "[ . 1 . 2 .]"
2 11 GLU 0.155 0.115 22 0 "[ . 1 . 2 .]"
2 12 SER 0.021 0.020 6 0 "[ . 1 . 2 .]"
2 13 ILE 1.266 0.980 9 1 "[ . +1 . 2 .]"
2 14 GLU 0.357 0.241 22 0 "[ . 1 . 2 .]"
2 15 THR 0.075 0.075 19 0 "[ . 1 . 2 .]"
2 16 VAL 0.662 0.370 9 0 "[ . 1 . 2 .]"
2 17 VAL 0.287 0.063 16 0 "[ . 1 . 2 .]"
2 18 THR 0.402 0.053 16 0 "[ . 1 . 2 .]"
2 19 THR 0.402 0.053 16 0 "[ . 1 . 2 .]"
2 20 PHE 1.421 0.370 9 0 "[ . 1 . 2 .]"
2 21 PHE 0.282 0.133 15 0 "[ . 1 . 2 .]"
2 22 THR 0.282 0.133 15 0 "[ . 1 . 2 .]"
2 23 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 28 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 29 ARG 0.009 0.009 17 0 "[ . 1 . 2 .]"
2 30 LYS 0.748 0.085 15 0 "[ . 1 . 2 .]"
2 31 ASP 0.669 0.085 15 0 "[ . 1 . 2 .]"
2 32 SER 0.779 0.074 25 0 "[ . 1 . 2 .]"
2 33 LEU 1.668 0.128 10 0 "[ . 1 . 2 .]"
2 34 SER 0.625 0.128 10 0 "[ . 1 . 2 .]"
2 35 VAL 1.909 0.123 17 0 "[ . 1 . 2 .]"
2 36 ASN 2.865 0.167 21 0 "[ . 1 . 2 .]"
2 37 GLU 0.140 0.029 11 0 "[ . 1 . 2 .]"
2 38 PHE 0.538 0.054 11 0 "[ . 1 . 2 .]"
2 39 LYS 0.233 0.108 14 0 "[ . 1 . 2 .]"
2 40 GLU 0.116 0.108 14 0 "[ . 1 . 2 .]"
2 42 VAL 2.163 0.144 7 0 "[ . 1 . 2 .]"
2 43 THR 0.373 0.116 24 0 "[ . 1 . 2 .]"
2 44 GLN 0.253 0.046 7 0 "[ . 1 . 2 .]"
2 45 GLN 2.563 0.148 9 0 "[ . 1 . 2 .]"
2 46 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 47 PRO 0.003 0.003 15 0 "[ . 1 . 2 .]"
2 48 HIS 0.949 0.120 24 0 "[ . 1 . 2 .]"
2 50 LEU 1.956 0.138 3 0 "[ . 1 . 2 .]"
2 51 LYS 5.310 0.220 19 0 "[ . 1 . 2 .]"
2 52 ASP 2.181 0.191 2 0 "[ . 1 . 2 .]"
2 53 VAL 1.880 0.149 4 0 "[ . 1 . 2 .]"
2 54 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 55 SER 0.050 0.030 15 0 "[ . 1 . 2 .]"
2 56 LEU 1.442 0.091 25 0 "[ . 1 . 2 .]"
2 57 ASP 1.643 0.126 1 0 "[ . 1 . 2 .]"
2 58 GLU 0.036 0.022 25 0 "[ . 1 . 2 .]"
2 59 LYS 2.539 0.192 19 0 "[ . 1 . 2 .]"
2 60 MET 0.498 0.088 5 0 "[ . 1 . 2 .]"
2 61 LYS 1.912 0.125 6 0 "[ . 1 . 2 .]"
2 62 SER 1.524 0.125 6 0 "[ . 1 . 2 .]"
2 63 LEU 3.577 0.167 21 0 "[ . 1 . 2 .]"
2 64 ASP 0.423 0.056 10 0 "[ . 1 . 2 .]"
2 65 VAL 0.645 0.055 10 0 "[ . 1 . 2 .]"
2 66 ASN 0.380 0.143 14 0 "[ . 1 . 2 .]"
2 67 GLN 1.788 0.137 7 0 "[ . 1 . 2 .]"
2 68 ASP 1.294 0.137 7 0 "[ . 1 . 2 .]"
2 69 SER 0.247 0.045 23 0 "[ . 1 . 2 .]"
2 70 GLU 2.240 0.197 9 0 "[ . 1 . 2 .]"
2 71 LEU 2.714 0.197 9 0 "[ . 1 . 2 .]"
2 72 LYS 0.722 0.074 25 0 "[ . 1 . 2 .]"
2 73 PHE 0.002 0.002 18 0 "[ . 1 . 2 .]"
2 74 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 75 GLU 0.018 0.013 22 0 "[ . 1 . 2 .]"
2 77 TRP 9.064 0.980 9 4 "[ .-* +1 . 2 * .]"
2 78 ARG 5.689 0.198 22 0 "[ . 1 . 2 .]"
2 79 LEU 0.669 0.192 19 0 "[ . 1 . 2 .]"
2 80 ILE 1.957 0.144 7 0 "[ . 1 . 2 .]"
2 81 GLY 0.346 0.052 24 0 "[ . 1 . 2 .]"
2 82 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 83 LEU 0.000 0.000 . 0 "[ . 1 . 2 .]"
2 84 ALA 6.951 0.898 25 2 "[ . - . 2 +]"
2 85 LYS 0.222 0.069 10 0 "[ . 1 . 2 .]"
2 86 GLU 1.850 0.149 4 0 "[ . 1 . 2 .]"
2 87 ILE 2.163 0.220 19 0 "[ . 1 . 2 .]"
2 88 ARG 0.266 0.069 10 0 "[ . 1 . 2 .]"
2 89 LYS 0.609 0.100 19 0 "[ . 1 . 2 .]"
2 92 ASP 0.927 0.225 17 0 "[ . 1 . 2 .]"
2 93 LEU 0.982 0.100 19 0 "[ . 1 . 2 .]"
2 94 LYS 1.388 0.120 24 0 "[ . 1 . 2 .]"
2 95 ILE 1.705 0.225 17 0 "[ . 1 . 2 .]"
2 96 ARG 1.963 0.177 11 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ALA H 1 2 ALA MB . . 3.600 2.589 2.163 2.911 . 0 0 "[ . 1 . 2 .]" 1
2 1 2 ALA H 1 3 ALA H . . 4.800 4.003 2.573 4.660 . 0 0 "[ . 1 . 2 .]" 1
3 1 2 ALA HA 1 3 ALA HA . . 4.900 4.460 4.211 4.584 . 0 0 "[ . 1 . 2 .]" 1
4 1 2 ALA HA 1 4 GLU H . . 4.700 4.276 3.696 4.832 0.132 23 0 "[ . 1 . 2 .]" 1
5 1 2 ALA HA 1 4 GLU QG . . 6.300 4.660 2.526 5.656 . 0 0 "[ . 1 . 2 .]" 1
6 1 2 ALA MB 1 6 LEU QD . . 8.370 3.645 1.795 5.185 . 0 0 "[ . 1 . 2 .]" 1
7 1 3 ALA H 1 4 GLU H . . 6.100 2.713 2.010 3.575 . 0 0 "[ . 1 . 2 .]" 1
8 1 3 ALA H 2 94 LYS HB3 . . 4.500 3.863 2.571 4.620 0.120 8 0 "[ . 1 . 2 .]" 1
9 1 3 ALA H 2 94 LYS QG . . 5.380 4.196 1.896 4.908 . 0 0 "[ . 1 . 2 .]" 1
10 1 3 ALA HA 1 4 GLU HA . . 5.400 4.479 4.288 4.605 . 0 0 "[ . 1 . 2 .]" 1
11 1 4 GLU H 1 6 LEU H . . 6.100 4.105 3.500 4.582 . 0 0 "[ . 1 . 2 .]" 1
12 1 4 GLU H 2 94 LYS QD . . 5.380 4.620 3.870 4.920 . 0 0 "[ . 1 . 2 .]" 1
13 1 4 GLU HA 1 6 LEU H . . 6.100 4.491 4.366 4.912 . 0 0 "[ . 1 . 2 .]" 1
14 1 4 GLU HA 2 96 ARG HA . . 5.800 5.504 4.142 5.924 0.124 7 0 "[ . 1 . 2 .]" 1
15 1 4 GLU HB2 2 96 ARG QG . . 3.400 2.676 2.052 3.122 . 0 0 "[ . 1 . 2 .]" 1
16 1 4 GLU HB3 1 5 PRO HD3 . . 5.100 4.067 3.116 4.981 . 0 0 "[ . 1 . 2 .]" 1
17 1 4 GLU HB3 1 6 LEU H . . 4.800 4.879 4.449 4.984 0.184 16 0 "[ . 1 . 2 .]" 1
18 1 4 GLU HB3 2 95 ILE HA . . 5.200 5.249 5.098 5.398 0.198 14 0 "[ . 1 . 2 .]" 1
19 1 4 GLU QG 1 6 LEU H . . 5.600 3.003 2.336 4.632 . 0 0 "[ . 1 . 2 .]" 1
20 1 4 GLU QG 2 96 ARG H . . 5.700 4.896 3.910 5.134 . 0 0 "[ . 1 . 2 .]" 1
21 1 4 GLU QG 2 96 ARG HA . . 6.500 5.041 3.982 5.888 . 0 0 "[ . 1 . 2 .]" 1
22 1 5 PRO HA 1 6 LEU QB . . 7.000 4.873 4.527 5.068 . 0 0 "[ . 1 . 2 .]" 1
23 1 5 PRO HD3 2 96 ARG HA . . 5.600 5.585 4.733 5.777 0.177 11 0 "[ . 1 . 2 .]" 1
24 1 6 LEU H 1 6 LEU MD1 . . 5.200 3.321 1.935 4.010 . 0 0 "[ . 1 . 2 .]" 1
25 1 6 LEU H 1 6 LEU QD . . 4.700 2.506 1.908 3.305 . 0 0 "[ . 1 . 2 .]" 1
26 1 6 LEU H 1 6 LEU MD2 . . 5.200 3.039 1.914 3.960 . 0 0 "[ . 1 . 2 .]" 1
27 1 6 LEU H 1 7 THR H . . 6.100 4.590 4.304 4.726 . 0 0 "[ . 1 . 2 .]" 1
28 1 6 LEU HA 1 7 THR HA . . 6.100 4.514 4.329 4.627 . 0 0 "[ . 1 . 2 .]" 1
29 1 6 LEU HA 1 10 GLU QB . . 7.000 3.726 2.227 5.293 . 0 0 "[ . 1 . 2 .]" 1
30 1 6 LEU QB 1 7 THR H . . 7.000 2.547 2.051 3.501 . 0 0 "[ . 1 . 2 .]" 1
31 1 6 LEU QB 1 11 GLU H . . 5.300 3.808 3.090 4.733 . 0 0 "[ . 1 . 2 .]" 1
32 1 6 LEU QB 1 11 GLU QB . . 7.800 3.945 2.904 5.043 . 0 0 "[ . 1 . 2 .]" 1
33 1 6 LEU QD 1 7 THR H . . 6.870 3.214 2.218 4.353 . 0 0 "[ . 1 . 2 .]" 1
34 1 6 LEU QD 1 11 GLU H . . 5.970 3.363 2.529 4.093 . 0 0 "[ . 1 . 2 .]" 1
35 1 6 LEU MD1 1 11 GLU QB . . 7.800 2.923 2.013 4.974 . 0 0 "[ . 1 . 2 .]" 1
36 1 6 LEU MD2 1 11 GLU QB . . 7.800 3.706 1.997 5.363 . 0 0 "[ . 1 . 2 .]" 1
37 1 7 THR H 1 7 THR MG . . 4.800 3.756 2.093 4.020 . 0 0 "[ . 1 . 2 .]" 1
38 1 7 THR H 1 8 GLU H . . 6.100 4.455 4.267 4.675 . 0 0 "[ . 1 . 2 .]" 1
39 1 7 THR H 1 10 GLU H . . 6.100 3.628 3.127 4.431 . 0 0 "[ . 1 . 2 .]" 1
40 1 7 THR H 1 10 GLU QB . . 7.000 2.660 1.885 4.097 . 0 0 "[ . 1 . 2 .]" 1
41 1 7 THR H 1 10 GLU QG . . 7.000 3.147 1.939 4.881 . 0 0 "[ . 1 . 2 .]" 1
42 1 7 THR H 1 11 GLU H . . 6.100 3.569 3.035 4.211 . 0 0 "[ . 1 . 2 .]" 1
43 1 7 THR H 1 11 GLU QB . . 7.000 4.339 3.334 5.536 . 0 0 "[ . 1 . 2 .]" 1
44 1 7 THR HA 1 8 GLU HA . . 6.100 4.304 4.162 4.458 . 0 0 "[ . 1 . 2 .]" 1
45 1 7 THR HA 1 8 GLU QB . . 7.000 4.786 4.305 5.058 . 0 0 "[ . 1 . 2 .]" 1
46 1 7 THR HA 1 8 GLU QG . . 7.000 4.187 3.731 6.091 . 0 0 "[ . 1 . 2 .]" 1
47 1 7 THR HA 1 9 LEU H . . 6.100 4.660 4.434 4.994 . 0 0 "[ . 1 . 2 .]" 1
48 1 7 THR HA 1 10 GLU H . . 6.100 5.017 4.526 5.447 . 0 0 "[ . 1 . 2 .]" 1
49 1 7 THR HA 1 10 GLU QB . . 7.000 4.950 4.196 6.262 . 0 0 "[ . 1 . 2 .]" 1
50 1 7 THR HA 1 11 GLU H . . 6.100 4.853 4.621 5.285 . 0 0 "[ . 1 . 2 .]" 1
51 1 7 THR HB 1 8 GLU H . . 4.600 3.586 3.280 3.922 . 0 0 "[ . 1 . 2 .]" 1
52 1 7 THR HB 1 8 GLU QB . . 6.300 4.972 4.294 5.624 . 0 0 "[ . 1 . 2 .]" 1
53 1 7 THR HB 1 9 LEU H . . 5.900 3.508 2.775 5.181 . 0 0 "[ . 1 . 2 .]" 1
54 1 7 THR HB 1 10 GLU H . . 6.100 3.332 2.708 5.062 . 0 0 "[ . 1 . 2 .]" 1
55 1 7 THR HB 1 10 GLU QB . . 6.400 3.681 2.395 4.831 . 0 0 "[ . 1 . 2 .]" 1
56 1 7 THR HB 1 10 GLU QG . . 7.000 4.301 2.292 6.288 . 0 0 "[ . 1 . 2 .]" 1
57 1 7 THR HB 2 45 GLN QB . . 6.200 3.062 2.102 4.852 . 0 0 "[ . 1 . 2 .]" 1
58 1 7 THR HB 2 45 GLN HG2 . . 4.500 4.007 3.237 4.622 0.122 9 0 "[ . 1 . 2 .]" 1
59 1 7 THR HB 2 45 GLN HG3 . . 5.200 2.869 2.106 4.225 . 0 0 "[ . 1 . 2 .]" 1
60 1 7 THR MG 1 8 GLU H . . 4.800 2.248 2.013 3.445 . 0 0 "[ . 1 . 2 .]" 1
61 1 7 THR MG 1 8 GLU QB . . 7.800 3.350 2.913 4.402 . 0 0 "[ . 1 . 2 .]" 1
62 1 7 THR MG 1 9 LEU H . . 4.000 2.839 2.009 3.231 . 0 0 "[ . 1 . 2 .]" 1
63 1 7 THR MG 1 9 LEU QD . . 5.670 2.926 2.265 3.653 . 0 0 "[ . 1 . 2 .]" 1
64 1 7 THR MG 1 10 GLU H . . 5.800 4.010 2.127 4.575 . 0 0 "[ . 1 . 2 .]" 1
65 1 7 THR MG 1 11 GLU H . . 6.100 5.039 3.711 5.522 . 0 0 "[ . 1 . 2 .]" 1
66 1 7 THR MG 2 45 GLN HA . . 4.700 3.246 2.153 3.923 . 0 0 "[ . 1 . 2 .]" 1
67 1 7 THR MG 2 45 GLN QB . . 7.500 3.387 2.134 3.920 . 0 0 "[ . 1 . 2 .]" 1
68 1 8 GLU H 1 9 LEU H . . 5.300 3.109 2.686 3.389 . 0 0 "[ . 1 . 2 .]" 1
69 1 8 GLU H 1 9 LEU QD . . 6.370 3.886 3.070 4.494 . 0 0 "[ . 1 . 2 .]" 1
70 1 8 GLU H 1 10 GLU H . . 6.100 4.689 4.237 5.005 . 0 0 "[ . 1 . 2 .]" 1
71 1 8 GLU H 1 11 GLU H . . 6.100 4.690 4.474 4.969 . 0 0 "[ . 1 . 2 .]" 1
72 1 8 GLU HA 1 9 LEU HA . . 5.100 4.804 4.582 4.923 . 0 0 "[ . 1 . 2 .]" 1
73 1 8 GLU HA 1 11 GLU H . . 6.100 3.628 3.235 3.890 . 0 0 "[ . 1 . 2 .]" 1
74 1 8 GLU HA 1 11 GLU QB . . 7.000 2.619 2.260 4.471 . 0 0 "[ . 1 . 2 .]" 1
75 1 8 GLU HA 1 12 SER H . . 5.500 4.271 3.869 5.417 . 0 0 "[ . 1 . 2 .]" 1
76 1 8 GLU HA 1 12 SER QB . . 7.000 5.344 4.460 6.280 . 0 0 "[ . 1 . 2 .]" 1
77 1 8 GLU QB 1 10 GLU H . . 6.800 4.848 4.564 5.273 . 0 0 "[ . 1 . 2 .]" 1
78 1 8 GLU QB 2 19 THR HA . . 5.100 4.305 3.804 4.594 . 0 0 "[ . 1 . 2 .]" 1
79 1 8 GLU QB 2 19 THR MG . . 7.500 2.527 2.014 3.255 . 0 0 "[ . 1 . 2 .]" 1
80 1 8 GLU QG 1 9 LEU H . . 5.800 4.191 3.142 4.521 . 0 0 "[ . 1 . 2 .]" 1
81 1 8 GLU QG 1 9 LEU QD . . 9.370 4.035 2.742 4.456 . 0 0 "[ . 1 . 2 .]" 1
82 1 9 LEU H 1 10 GLU H . . 5.500 2.783 2.521 2.967 . 0 0 "[ . 1 . 2 .]" 1
83 1 9 LEU H 1 11 GLU H . . 4.400 4.122 3.715 4.388 . 0 0 "[ . 1 . 2 .]" 1
84 1 9 LEU H 1 12 SER H . . 6.100 4.793 4.586 5.281 . 0 0 "[ . 1 . 2 .]" 1
85 1 9 LEU H 2 19 THR MG . . 4.900 3.673 3.119 4.011 . 0 0 "[ . 1 . 2 .]" 1
86 1 9 LEU H 2 45 GLN QB . . 4.300 3.762 3.331 3.900 . 0 0 "[ . 1 . 2 .]" 1
87 1 9 LEU H 2 45 GLN HG3 . . 3.800 3.801 3.419 3.948 0.148 9 0 "[ . 1 . 2 .]" 1
88 1 9 LEU HA 1 10 GLU HA . . 6.100 4.808 4.644 5.005 . 0 0 "[ . 1 . 2 .]" 1
89 1 9 LEU HA 1 12 SER H . . 6.100 3.523 3.177 3.968 . 0 0 "[ . 1 . 2 .]" 1
90 1 9 LEU HA 1 12 SER QB . . 7.000 3.193 2.780 3.879 . 0 0 "[ . 1 . 2 .]" 1
91 1 9 LEU HA 1 13 ILE H . . 6.100 4.598 3.941 5.572 . 0 0 "[ . 1 . 2 .]" 1
92 1 9 LEU HA 1 13 ILE MD . . 6.100 4.098 3.470 4.817 . 0 0 "[ . 1 . 2 .]" 1
93 1 9 LEU HA 2 19 THR MG . . 4.500 3.159 2.414 3.796 . 0 0 "[ . 1 . 2 .]" 1
94 1 9 LEU QB 1 10 GLU H . . 6.900 2.459 2.190 3.369 . 0 0 "[ . 1 . 2 .]" 1
95 1 9 LEU QB 2 19 THR MG . . 7.500 4.045 2.291 4.380 . 0 0 "[ . 1 . 2 .]" 1
96 1 9 LEU QB 2 45 GLN QB . . 7.500 2.263 1.976 4.139 . 0 0 "[ . 1 . 2 .]" 1
97 1 9 LEU QB 2 45 GLN HG2 . . 5.100 2.555 2.161 4.318 . 0 0 "[ . 1 . 2 .]" 1
98 1 9 LEU QD 1 10 GLU H . . 5.260 3.772 3.473 3.936 . 0 0 "[ . 1 . 2 .]" 1
99 1 9 LEU QD 2 19 THR HB . . 7.270 3.641 2.687 4.277 . 0 0 "[ . 1 . 2 .]" 1
100 1 9 LEU QD 2 19 THR MG . . 4.520 1.920 1.761 2.192 . 0 0 "[ . 1 . 2 .]" 1
101 1 9 LEU MD1 1 10 GLU H . . 6.100 4.475 3.812 4.840 . 0 0 "[ . 1 . 2 .]" 1
102 1 9 LEU MD1 2 19 THR MG . . 5.600 2.188 1.827 3.715 . 0 0 "[ . 1 . 2 .]" 1
103 1 9 LEU MD2 1 10 GLU H . . 6.100 4.180 3.646 4.916 . 0 0 "[ . 1 . 2 .]" 1
104 1 9 LEU MD2 2 19 THR MG . . 5.600 2.578 1.911 3.787 . 0 0 "[ . 1 . 2 .]" 1
105 1 9 LEU HG 2 19 THR MG . . 5.300 3.596 2.157 4.264 . 0 0 "[ . 1 . 2 .]" 1
106 1 9 LEU HG 2 42 VAL HA . . 5.200 4.446 3.037 5.308 0.108 15 0 "[ . 1 . 2 .]" 1
107 1 9 LEU HG 2 42 VAL QG . . 7.160 3.845 2.638 4.480 . 0 0 "[ . 1 . 2 .]" 1
108 1 9 LEU HG 2 45 GLN QB . . 5.400 3.687 2.475 4.669 . 0 0 "[ . 1 . 2 .]" 1
109 1 9 LEU HG 2 45 GLN HG2 . . 4.000 3.118 2.181 4.100 0.100 2 0 "[ . 1 . 2 .]" 1
110 1 10 GLU H 1 11 GLU H . . 5.400 2.729 2.396 3.017 . 0 0 "[ . 1 . 2 .]" 1
111 1 10 GLU H 1 12 SER H . . 5.300 4.170 3.917 4.444 . 0 0 "[ . 1 . 2 .]" 1
112 1 10 GLU H 2 45 GLN QB . . 4.300 3.176 2.856 3.696 . 0 0 "[ . 1 . 2 .]" 1
113 1 10 GLU H 2 45 GLN HG2 . . 4.600 4.511 3.382 4.718 0.118 12 0 "[ . 1 . 2 .]" 1
114 1 10 GLU HA 1 11 GLU HA . . 6.100 4.893 4.701 5.212 . 0 0 "[ . 1 . 2 .]" 1
115 1 10 GLU HA 1 13 ILE H . . 6.100 3.385 3.056 3.794 . 0 0 "[ . 1 . 2 .]" 1
116 1 10 GLU HA 1 13 ILE HB . . 6.100 2.726 2.250 3.613 . 0 0 "[ . 1 . 2 .]" 1
117 1 10 GLU HA 1 13 ILE MD . . 6.100 2.352 2.040 3.828 . 0 0 "[ . 1 . 2 .]" 1
118 1 10 GLU HA 1 14 GLU H . . 6.100 3.957 3.631 4.475 . 0 0 "[ . 1 . 2 .]" 1
119 1 10 GLU HA 2 45 GLN QB . . 6.700 4.835 4.194 5.998 . 0 0 "[ . 1 . 2 .]" 1
120 1 10 GLU HA 2 46 LEU QD . . 7.070 2.726 2.236 3.236 . 0 0 "[ . 1 . 2 .]" 1
121 1 10 GLU QB 2 45 GLN HA . . 6.500 4.922 4.092 5.865 . 0 0 "[ . 1 . 2 .]" 1
122 1 10 GLU QG 2 45 GLN QB . . 5.500 4.250 3.651 4.469 . 0 0 "[ . 1 . 2 .]" 1
123 1 10 GLU QG 2 46 LEU QD . . 9.070 2.846 1.825 4.284 . 0 0 "[ . 1 . 2 .]" 1
124 1 10 GLU QG 2 47 PRO QD . . 7.500 3.285 2.086 4.458 . 0 0 "[ . 1 . 2 .]" 1
125 1 11 GLU H 1 12 SER H . . 5.300 2.937 2.783 3.142 . 0 0 "[ . 1 . 2 .]" 1
126 1 11 GLU H 1 12 SER QB . . 7.000 4.900 4.526 5.235 . 0 0 "[ . 1 . 2 .]" 1
127 1 11 GLU H 1 13 ILE H . . 6.100 4.303 4.132 4.452 . 0 0 "[ . 1 . 2 .]" 1
128 1 11 GLU HA 1 12 SER HA . . 6.100 4.719 4.210 4.862 . 0 0 "[ . 1 . 2 .]" 1
129 1 11 GLU HA 1 13 ILE H . . 6.100 4.359 3.881 4.643 . 0 0 "[ . 1 . 2 .]" 1
130 1 11 GLU HA 1 14 GLU H . . 5.900 3.634 3.256 5.196 . 0 0 "[ . 1 . 2 .]" 1
131 1 11 GLU HA 1 14 GLU QB . . 7.000 3.436 2.324 5.922 . 0 0 "[ . 1 . 2 .]" 1
132 1 11 GLU QG 1 12 SER H . . 5.280 4.218 3.955 4.574 . 0 0 "[ . 1 . 2 .]" 1
133 1 12 SER H 1 13 ILE H . . 5.400 2.495 2.240 2.835 . 0 0 "[ . 1 . 2 .]" 1
134 1 12 SER H 1 13 ILE HB . . 6.000 4.561 4.260 5.493 . 0 0 "[ . 1 . 2 .]" 1
135 1 12 SER H 1 13 ILE MD . . 5.200 4.427 4.368 4.483 . 0 0 "[ . 1 . 2 .]" 1
136 1 12 SER H 1 14 GLU H . . 6.100 4.158 3.855 4.486 . 0 0 "[ . 1 . 2 .]" 1
137 1 12 SER HA 1 14 GLU QG . . 6.300 5.163 4.461 5.716 . 0 0 "[ . 1 . 2 .]" 1
138 1 12 SER HA 1 15 THR H . . 6.100 3.685 3.228 4.061 . 0 0 "[ . 1 . 2 .]" 1
139 1 12 SER HA 1 15 THR HB . . 6.100 2.839 2.595 3.481 . 0 0 "[ . 1 . 2 .]" 1
140 1 12 SER QB 1 13 ILE HB . . 6.100 4.599 4.349 5.370 . 0 0 "[ . 1 . 2 .]" 1
141 1 12 SER QB 1 13 ILE MD . . 7.800 3.848 2.755 4.158 . 0 0 "[ . 1 . 2 .]" 1
142 1 12 SER QB 1 13 ILE QG . . 7.800 2.946 2.563 3.908 . 0 0 "[ . 1 . 2 .]" 1
143 1 12 SER QB 1 13 ILE MG . . 7.000 5.107 4.886 5.227 . 0 0 "[ . 1 . 2 .]" 1
144 1 12 SER QB 2 15 THR HB . . 5.900 3.693 2.298 5.006 . 0 0 "[ . 1 . 2 .]" 1
145 1 12 SER QB 2 15 THR MG . . 6.800 2.912 2.192 3.854 . 0 0 "[ . 1 . 2 .]" 1
146 1 12 SER QB 2 16 VAL HA . . 6.300 3.877 2.671 4.416 . 0 0 "[ . 1 . 2 .]" 1
147 1 13 ILE H 1 13 ILE MD . . 4.500 3.087 2.505 3.504 . 0 0 "[ . 1 . 2 .]" 1
148 1 13 ILE H 1 13 ILE MG . . 4.800 3.744 3.697 3.833 . 0 0 "[ . 1 . 2 .]" 1
149 1 13 ILE H 1 14 GLU H . . 4.000 2.609 2.389 2.860 . 0 0 "[ . 1 . 2 .]" 1
150 1 13 ILE H 1 15 THR H . . 5.600 4.020 3.640 4.309 . 0 0 "[ . 1 . 2 .]" 1
151 1 13 ILE HA 1 15 THR H . . 6.100 4.447 4.275 4.683 . 0 0 "[ . 1 . 2 .]" 1
152 1 13 ILE HA 1 16 VAL H . . 6.100 3.361 3.128 3.805 . 0 0 "[ . 1 . 2 .]" 1
153 1 13 ILE HA 1 16 VAL HB . . 6.100 2.928 2.628 3.884 . 0 0 "[ . 1 . 2 .]" 1
154 1 13 ILE HA 1 77 TRP HZ3 . . 6.100 4.397 4.074 4.859 . 0 0 "[ . 1 . 2 .]" 1
155 1 13 ILE HB 1 14 GLU H . . 5.400 2.505 1.995 2.664 . 0 0 "[ . 1 . 2 .]" 1
156 1 13 ILE HB 1 14 GLU QG . . 5.400 4.359 3.168 5.005 . 0 0 "[ . 1 . 2 .]" 1
157 1 13 ILE HB 1 15 THR H . . 6.100 4.958 4.590 5.138 . 0 0 "[ . 1 . 2 .]" 1
158 1 13 ILE MD 1 77 TRP HH2 . . 7.000 4.267 3.751 4.482 . 0 0 "[ . 1 . 2 .]" 1
159 1 13 ILE MD 1 77 TRP HZ2 . . 7.000 3.573 2.496 3.868 . 0 0 "[ . 1 . 2 .]" 1
160 1 13 ILE MD 1 77 TRP HZ3 . . 8.000 5.908 5.554 5.978 . 0 0 "[ . 1 . 2 .]" 1
161 1 13 ILE MD 2 46 LEU MD1 . . 4.200 2.363 2.047 2.877 . 0 0 "[ . 1 . 2 .]" 1
162 1 13 ILE MD 2 46 LEU QD . . 3.680 2.024 1.855 2.323 . 0 0 "[ . 1 . 2 .]" 1
163 1 13 ILE MD 2 46 LEU MD2 . . 4.200 2.277 1.947 2.884 . 0 0 "[ . 1 . 2 .]" 1
164 1 13 ILE QG 1 77 TRP HH2 . . 7.000 3.104 2.565 4.776 . 0 0 "[ . 1 . 2 .]" 1
165 1 13 ILE QG 2 80 ILE HB . . 6.000 3.537 2.862 4.689 . 0 0 "[ . 1 . 2 .]" 1
166 1 13 ILE QG 2 80 ILE MD . . 5.600 2.292 2.008 4.211 . 0 0 "[ . 1 . 2 .]" 1
167 1 13 ILE MG 1 14 GLU HA . . 5.300 3.541 3.030 4.097 . 0 0 "[ . 1 . 2 .]" 1
168 1 13 ILE MG 1 17 VAL MG1 . . 5.300 2.825 2.429 3.318 . 0 0 "[ . 1 . 2 .]" 1
169 1 13 ILE MG 2 80 ILE HB . . 5.600 4.388 3.796 4.702 . 0 0 "[ . 1 . 2 .]" 1
170 1 13 ILE MG 2 80 ILE MD . . 5.500 3.789 3.401 3.873 . 0 0 "[ . 1 . 2 .]" 1
171 1 13 ILE MG 2 84 ALA MB . . 4.500 2.607 2.166 3.129 . 0 0 "[ . 1 . 2 .]" 1
172 1 13 ILE MG 2 89 LYS QE . . 7.100 2.564 1.874 4.310 . 0 0 "[ . 1 . 2 .]" 1
173 1 14 GLU H 1 15 THR H . . 5.300 2.725 2.579 2.870 . 0 0 "[ . 1 . 2 .]" 1
174 1 14 GLU H 1 16 VAL H . . 5.900 4.378 4.191 4.546 . 0 0 "[ . 1 . 2 .]" 1
175 1 14 GLU HA 1 16 VAL H . . 6.100 4.608 4.241 4.936 . 0 0 "[ . 1 . 2 .]" 1
176 1 14 GLU HA 1 17 VAL H . . 6.100 3.609 3.341 3.807 . 0 0 "[ . 1 . 2 .]" 1
177 1 14 GLU HA 1 17 VAL MG2 . . 5.000 1.982 1.863 2.068 . 0 0 "[ . 1 . 2 .]" 1
178 1 14 GLU HA 2 89 LYS QE . . 5.700 4.113 2.227 5.121 . 0 0 "[ . 1 . 2 .]" 1
179 1 14 GLU QB 1 15 THR HA . . 7.000 4.456 3.766 4.916 . 0 0 "[ . 1 . 2 .]" 1
180 1 14 GLU QG 1 15 THR H . . 4.700 2.771 2.070 4.089 . 0 0 "[ . 1 . 2 .]" 1
181 1 14 GLU QG 2 93 LEU QD . . 7.770 3.013 2.046 4.180 . 0 0 "[ . 1 . 2 .]" 1
182 1 14 GLU QG 2 93 LEU HG . . 5.500 4.499 2.368 5.016 . 0 0 "[ . 1 . 2 .]" 1
183 1 15 THR H 1 16 VAL H . . 5.400 2.987 2.796 3.120 . 0 0 "[ . 1 . 2 .]" 1
184 1 15 THR H 1 16 VAL HA . . 6.100 5.510 5.369 5.643 . 0 0 "[ . 1 . 2 .]" 1
185 1 15 THR H 1 16 VAL HB . . 6.100 5.044 4.806 5.229 . 0 0 "[ . 1 . 2 .]" 1
186 1 15 THR H 1 17 VAL H . . 6.100 4.504 4.388 4.628 . 0 0 "[ . 1 . 2 .]" 1
187 1 15 THR H 1 17 VAL MG2 . . 5.100 4.309 4.290 4.359 . 0 0 "[ . 1 . 2 .]" 1
188 1 15 THR HA 1 16 VAL HA . . 6.100 4.804 4.725 4.853 . 0 0 "[ . 1 . 2 .]" 1
189 1 15 THR HA 1 18 THR H . . 6.100 3.654 3.312 3.853 . 0 0 "[ . 1 . 2 .]" 1
190 1 15 THR HA 1 18 THR HB . . 6.100 3.385 2.203 4.446 . 0 0 "[ . 1 . 2 .]" 1
191 1 15 THR HA 1 19 THR H . . 6.100 3.893 3.699 4.077 . 0 0 "[ . 1 . 2 .]" 1
192 1 15 THR HB 1 16 VAL H . . 6.100 2.714 2.443 2.984 . 0 0 "[ . 1 . 2 .]" 1
193 1 15 THR HB 1 16 VAL HA . . 6.100 4.512 3.865 4.843 . 0 0 "[ . 1 . 2 .]" 1
194 1 15 THR HB 1 16 VAL HB . . 6.100 5.022 4.573 5.253 . 0 0 "[ . 1 . 2 .]" 1
195 1 15 THR HB 2 12 SER QB . . 5.900 3.877 2.343 5.305 . 0 0 "[ . 1 . 2 .]" 1
196 1 15 THR MG 1 16 VAL H . . 5.200 3.480 3.112 3.816 . 0 0 "[ . 1 . 2 .]" 1
197 1 15 THR MG 1 19 THR H . . 5.100 4.066 3.887 4.147 . 0 0 "[ . 1 . 2 .]" 1
198 1 15 THR MG 2 12 SER QB . . 6.800 3.383 2.314 4.691 . 0 0 "[ . 1 . 2 .]" 1
199 1 16 VAL H 1 16 VAL MG1 . . 4.400 3.727 3.710 3.748 . 0 0 "[ . 1 . 2 .]" 1
200 1 16 VAL H 1 16 VAL MG2 . . 4.500 2.275 2.149 2.451 . 0 0 "[ . 1 . 2 .]" 1
201 1 16 VAL H 1 17 VAL H . . 5.700 2.888 2.656 2.995 . 0 0 "[ . 1 . 2 .]" 1
202 1 16 VAL H 1 17 VAL MG1 . . 5.900 4.465 4.166 4.656 . 0 0 "[ . 1 . 2 .]" 1
203 1 16 VAL H 1 17 VAL MG2 . . 5.400 4.126 3.722 4.364 . 0 0 "[ . 1 . 2 .]" 1
204 1 16 VAL HA 1 17 VAL HA . . 6.100 4.691 4.653 4.757 . 0 0 "[ . 1 . 2 .]" 1
205 1 16 VAL HA 1 19 THR H . . 6.100 3.443 2.911 3.634 . 0 0 "[ . 1 . 2 .]" 1
206 1 16 VAL HA 1 19 THR HB . . 6.100 2.761 2.467 4.407 . 0 0 "[ . 1 . 2 .]" 1
207 1 16 VAL HA 1 20 PHE H . . 6.100 4.392 3.898 4.724 . 0 0 "[ . 1 . 2 .]" 1
208 1 16 VAL HA 2 12 SER QB . . 6.300 3.805 3.014 4.270 . 0 0 "[ . 1 . 2 .]" 1
209 1 16 VAL HB 1 17 VAL H . . 6.100 2.481 2.355 2.655 . 0 0 "[ . 1 . 2 .]" 1
210 1 16 VAL HB 1 17 VAL MG2 . . 7.000 4.103 3.596 4.336 . 0 0 "[ . 1 . 2 .]" 1
211 1 16 VAL HB 1 77 TRP HE3 . . 5.400 4.915 4.654 5.341 . 0 0 "[ . 1 . 2 .]" 1
212 1 16 VAL MG1 1 17 VAL H . . 3.600 2.994 2.877 3.032 . 0 0 "[ . 1 . 2 .]" 1
213 1 16 VAL MG1 1 19 THR H . . 5.500 4.573 4.113 4.656 . 0 0 "[ . 1 . 2 .]" 1
214 1 16 VAL MG1 1 20 PHE H . . 5.200 4.176 3.796 4.410 . 0 0 "[ . 1 . 2 .]" 1
215 1 16 VAL MG1 1 77 TRP HE3 . . 7.000 3.098 2.812 3.465 . 0 0 "[ . 1 . 2 .]" 1
216 1 16 VAL MG2 1 77 TRP HE3 . . 6.000 4.731 3.999 5.001 . 0 0 "[ . 1 . 2 .]" 1
217 1 17 VAL H 1 18 THR H . . 5.800 2.800 2.594 2.935 . 0 0 "[ . 1 . 2 .]" 1
218 1 17 VAL H 1 18 THR HB . . 6.100 4.922 4.314 5.430 . 0 0 "[ . 1 . 2 .]" 1
219 1 17 VAL H 1 19 THR H . . 6.100 4.197 3.973 4.379 . 0 0 "[ . 1 . 2 .]" 1
220 1 17 VAL HA 1 20 PHE H . . 6.100 3.592 2.994 4.088 . 0 0 "[ . 1 . 2 .]" 1
221 1 17 VAL HA 1 20 PHE QB . . 7.000 3.431 2.483 4.373 . 0 0 "[ . 1 . 2 .]" 1
222 1 17 VAL HB 1 18 THR H . . 6.100 3.935 3.708 4.157 . 0 0 "[ . 1 . 2 .]" 1
223 1 17 VAL HB 1 20 PHE H . . 6.100 5.530 5.071 6.078 . 0 0 "[ . 1 . 2 .]" 1
224 1 17 VAL HB 1 77 TRP HH2 . . 6.100 6.093 5.880 6.198 0.098 19 0 "[ . 1 . 2 .]" 1
225 1 17 VAL MG1 1 18 THR H . . 5.100 4.098 3.979 4.225 . 0 0 "[ . 1 . 2 .]" 1
226 1 17 VAL MG1 1 18 THR HA . . 7.000 5.625 5.507 5.792 . 0 0 "[ . 1 . 2 .]" 1
227 1 17 VAL MG1 1 20 PHE QD . . 8.700 3.703 2.524 4.870 . 0 0 "[ . 1 . 2 .]" 1
228 1 17 VAL MG1 2 89 LYS QD . . 4.580 2.965 2.209 3.440 . 0 0 "[ . 1 . 2 .]" 1
229 1 17 VAL MG2 1 18 THR H . . 5.500 2.354 2.176 2.672 . 0 0 "[ . 1 . 2 .]" 1
230 1 17 VAL MG2 1 73 PHE QB . . 7.800 5.680 5.060 5.846 . 0 0 "[ . 1 . 2 .]" 1
231 1 17 VAL MG2 2 93 LEU QD . . 5.370 2.980 2.068 3.373 . 0 0 "[ . 1 . 2 .]" 1
232 1 18 THR H 1 19 THR H . . 5.900 2.694 2.510 3.017 . 0 0 "[ . 1 . 2 .]" 1
233 1 18 THR H 1 19 THR HA . . 5.300 5.227 4.673 5.353 0.053 17 0 "[ . 1 . 2 .]" 1
234 1 18 THR H 1 19 THR HB . . 5.500 4.777 4.548 5.056 . 0 0 "[ . 1 . 2 .]" 1
235 1 18 THR H 1 20 PHE H . . 6.100 4.402 4.021 4.798 . 0 0 "[ . 1 . 2 .]" 1
236 1 18 THR HA 1 20 PHE H . . 6.100 4.422 4.041 4.756 . 0 0 "[ . 1 . 2 .]" 1
237 1 18 THR HA 1 21 PHE H . . 6.100 3.447 2.952 4.780 . 0 0 "[ . 1 . 2 .]" 1
238 1 18 THR HA 1 21 PHE QB . . 7.000 3.037 2.161 4.878 . 0 0 "[ . 1 . 2 .]" 1
239 1 18 THR HB 1 19 THR H . . 5.000 3.538 2.468 4.509 . 0 0 "[ . 1 . 2 .]" 1
240 1 18 THR HB 1 19 THR HA . . 6.100 5.317 4.178 6.034 . 0 0 "[ . 1 . 2 .]" 1
241 1 18 THR MG 1 19 THR H . . 4.800 2.552 2.229 3.632 . 0 0 "[ . 1 . 2 .]" 1
242 1 18 THR MG 1 19 THR HA . . 4.700 3.119 2.564 3.834 . 0 0 "[ . 1 . 2 .]" 1
243 1 18 THR MG 1 19 THR HB . . 5.200 4.102 2.764 4.299 . 0 0 "[ . 1 . 2 .]" 1
244 1 18 THR MG 1 21 PHE H . . 5.700 4.551 3.696 4.992 . 0 0 "[ . 1 . 2 .]" 1
245 1 18 THR MG 1 21 PHE QB . . 7.800 4.124 2.629 4.711 . 0 0 "[ . 1 . 2 .]" 1
246 1 19 THR H 1 20 PHE H . . 5.700 2.883 2.507 3.208 . 0 0 "[ . 1 . 2 .]" 1
247 1 19 THR H 1 20 PHE QB . . 7.000 4.821 4.005 5.248 . 0 0 "[ . 1 . 2 .]" 1
248 1 19 THR H 1 21 PHE H . . 6.100 4.220 3.898 4.500 . 0 0 "[ . 1 . 2 .]" 1
249 1 19 THR HA 1 20 PHE HA . . 6.100 4.856 4.307 4.975 . 0 0 "[ . 1 . 2 .]" 1
250 1 19 THR HA 1 21 PHE H . . 6.100 3.969 3.497 4.403 . 0 0 "[ . 1 . 2 .]" 1
251 1 19 THR HA 1 22 THR H . . 6.100 3.213 2.739 5.042 . 0 0 "[ . 1 . 2 .]" 1
252 1 19 THR HA 2 8 GLU QB . . 5.100 4.157 3.500 4.654 . 0 0 "[ . 1 . 2 .]" 1
253 1 19 THR HB 1 20 PHE H . . 5.500 3.051 2.067 4.645 . 0 0 "[ . 1 . 2 .]" 1
254 1 19 THR HB 1 20 PHE HA . . 6.100 4.934 4.180 6.136 0.036 18 0 "[ . 1 . 2 .]" 1
255 1 19 THR HB 2 9 LEU QD . . 7.270 3.627 2.515 4.529 . 0 0 "[ . 1 . 2 .]" 1
256 1 19 THR MG 1 20 PHE H . . 4.600 3.440 2.832 4.043 . 0 0 "[ . 1 . 2 .]" 1
257 1 19 THR MG 1 22 THR H . . 5.800 4.638 4.058 5.563 . 0 0 "[ . 1 . 2 .]" 1
258 1 19 THR MG 2 8 GLU QB . . 7.500 2.345 1.936 3.869 . 0 0 "[ . 1 . 2 .]" 1
259 1 19 THR MG 2 9 LEU H . . 4.900 3.397 2.953 3.734 . 0 0 "[ . 1 . 2 .]" 1
260 1 19 THR MG 2 9 LEU HA . . 4.500 3.110 2.253 3.752 . 0 0 "[ . 1 . 2 .]" 1
261 1 19 THR MG 2 9 LEU QB . . 7.500 3.912 2.008 4.362 . 0 0 "[ . 1 . 2 .]" 1
262 1 19 THR MG 2 9 LEU MD1 . . 5.600 2.375 1.882 3.797 . 0 0 "[ . 1 . 2 .]" 1
263 1 19 THR MG 2 9 LEU QD . . 4.520 1.935 1.793 2.302 . 0 0 "[ . 1 . 2 .]" 1
264 1 19 THR MG 2 9 LEU MD2 . . 5.600 2.498 1.841 3.786 . 0 0 "[ . 1 . 2 .]" 1
265 1 19 THR MG 2 9 LEU HG . . 5.300 3.634 2.370 4.263 . 0 0 "[ . 1 . 2 .]" 1
266 1 20 PHE H 1 20 PHE QE . . 7.000 4.503 3.937 5.042 . 0 0 "[ . 1 . 2 .]" 1
267 1 20 PHE H 1 20 PHE HZ . . 6.400 5.961 5.423 6.471 0.071 19 0 "[ . 1 . 2 .]" 1
268 1 20 PHE H 1 21 PHE H . . 5.500 2.889 2.760 3.051 . 0 0 "[ . 1 . 2 .]" 1
269 1 20 PHE H 1 21 PHE QB . . 7.000 4.682 4.486 4.994 . 0 0 "[ . 1 . 2 .]" 1
270 1 20 PHE HA 1 20 PHE HZ . . 6.100 6.004 5.540 6.135 0.035 14 0 "[ . 1 . 2 .]" 1
271 1 20 PHE HA 1 21 PHE HA . . 5.500 4.762 4.671 4.893 . 0 0 "[ . 1 . 2 .]" 1
272 1 20 PHE HA 1 32 SER HA . . 6.800 4.912 4.127 5.583 . 0 0 "[ . 1 . 2 .]" 1
273 1 20 PHE QB 1 21 PHE HA . . 7.000 3.943 3.674 4.291 . 0 0 "[ . 1 . 2 .]" 1
274 1 20 PHE QB 1 21 PHE QB . . 7.100 3.916 3.481 4.519 . 0 0 "[ . 1 . 2 .]" 1
275 1 20 PHE QB 1 22 THR H . . 7.000 4.872 4.621 5.307 . 0 0 "[ . 1 . 2 .]" 1
276 1 20 PHE QD 1 31 ASP HA . . 7.800 4.722 3.268 5.796 . 0 0 "[ . 1 . 2 .]" 1
277 1 20 PHE QD 1 32 SER H . . 5.900 5.066 4.108 5.327 . 0 0 "[ . 1 . 2 .]" 1
278 1 20 PHE QD 1 32 SER HA . . 7.800 2.930 2.263 4.377 . 0 0 "[ . 1 . 2 .]" 1
279 1 20 PHE QD 1 32 SER QB . . 8.680 3.905 2.834 4.622 . 0 0 "[ . 1 . 2 .]" 1
280 1 20 PHE QE 1 32 SER H . . 6.200 5.093 3.647 5.569 . 0 0 "[ . 1 . 2 .]" 1
281 1 20 PHE QE 1 32 SER HA . . 7.700 3.231 2.398 4.489 . 0 0 "[ . 1 . 2 .]" 1
282 1 20 PHE QE 1 32 SER QB . . 8.680 2.793 2.211 3.726 . 0 0 "[ . 1 . 2 .]" 1
283 1 20 PHE QE 1 33 LEU MD2 . . 8.700 3.620 2.276 5.471 . 0 0 "[ . 1 . 2 .]" 1
284 1 20 PHE QE 1 71 LEU QD . . 11.300 4.367 2.867 5.288 . 0 0 "[ . 1 . 2 .]" 1
285 1 20 PHE QE 1 72 LYS HA . . 7.800 5.143 2.848 6.152 . 0 0 "[ . 1 . 2 .]" 1
286 1 20 PHE QE 1 73 PHE QB . . 8.700 2.839 2.146 4.253 . 0 0 "[ . 1 . 2 .]" 1
287 1 20 PHE HZ 1 32 SER HA . . 6.100 4.961 4.191 6.143 0.043 1 0 "[ . 1 . 2 .]" 1
288 1 20 PHE HZ 1 71 LEU QD . . 8.200 4.832 3.247 6.103 . 0 0 "[ . 1 . 2 .]" 1
289 1 20 PHE HZ 1 73 PHE QB . . 7.000 3.537 2.600 5.271 . 0 0 "[ . 1 . 2 .]" 1
290 1 20 PHE HZ 1 77 TRP H . . 4.500 4.483 3.907 4.643 0.143 17 0 "[ . 1 . 2 .]" 1
291 1 21 PHE H 1 22 THR H . . 6.100 2.549 2.336 2.913 . 0 0 "[ . 1 . 2 .]" 1
292 1 21 PHE H 1 29 ARG QB . . 5.900 4.705 3.584 5.313 . 0 0 "[ . 1 . 2 .]" 1
293 1 21 PHE HA 1 22 THR HA . . 6.100 4.666 4.461 4.759 . 0 0 "[ . 1 . 2 .]" 1
294 1 21 PHE HA 1 22 THR HB . . 6.100 5.848 4.804 6.355 0.255 25 0 "[ . 1 . 2 .]" 1
295 1 21 PHE QB 1 22 THR HA . . 7.000 4.285 3.792 4.727 . 0 0 "[ . 1 . 2 .]" 1
296 1 22 THR H 1 23 PHE H . . 6.100 3.774 3.150 4.873 . 0 0 "[ . 1 . 2 .]" 1
297 1 22 THR HA 1 23 PHE HA . . 6.100 4.286 2.188 4.636 . 0 0 "[ . 1 . 2 .]" 1
298 1 22 THR HB 1 23 PHE H . . 6.100 4.348 3.182 4.615 . 0 0 "[ . 1 . 2 .]" 1
299 1 22 THR MG 1 23 PHE H . . 5.900 4.019 2.616 4.515 . 0 0 "[ . 1 . 2 .]" 1
300 1 28 GLY H 1 29 ARG H . . 5.400 4.093 2.534 4.712 . 0 0 "[ . 1 . 2 .]" 1
301 1 28 GLY H 1 29 ARG QB . . 7.000 5.251 3.704 6.269 . 0 0 "[ . 1 . 2 .]" 1
302 1 28 GLY QA 1 29 ARG HA . . 6.980 4.064 3.879 4.181 . 0 0 "[ . 1 . 2 .]" 1
303 1 29 ARG H 1 30 LYS H . . 4.800 4.088 3.405 4.622 . 0 0 "[ . 1 . 2 .]" 1
304 1 29 ARG H 1 30 LYS HA . . 6.100 4.853 4.166 5.573 . 0 0 "[ . 1 . 2 .]" 1
305 1 29 ARG HA 1 30 LYS HA . . 5.000 4.496 4.304 4.673 . 0 0 "[ . 1 . 2 .]" 1
306 1 29 ARG HA 1 31 ASP H . . 5.800 4.543 3.436 5.833 0.033 12 0 "[ . 1 . 2 .]" 1
307 1 29 ARG QB 1 31 ASP H . . 7.000 4.515 3.030 6.276 . 0 0 "[ . 1 . 2 .]" 1
308 1 29 ARG QG 1 30 LYS H . . 5.000 3.714 2.564 4.512 . 0 0 "[ . 1 . 2 .]" 1
309 1 29 ARG QG 1 31 ASP H . . 5.600 4.127 2.587 5.056 . 0 0 "[ . 1 . 2 .]" 1
310 1 30 LYS H 1 30 LYS HD2 . . 6.100 5.052 2.658 6.071 . 0 0 "[ . 1 . 2 .]" 1
311 1 30 LYS H 1 30 LYS HD3 . . 6.100 4.967 3.309 6.037 . 0 0 "[ . 1 . 2 .]" 1
312 1 30 LYS H 1 30 LYS QE . . 7.000 4.042 2.089 5.047 . 0 0 "[ . 1 . 2 .]" 1
313 1 30 LYS H 1 31 ASP H . . 4.000 3.030 2.556 3.499 . 0 0 "[ . 1 . 2 .]" 1
314 1 30 LYS H 1 31 ASP HA . . 5.000 4.909 4.509 5.069 0.069 22 0 "[ . 1 . 2 .]" 1
315 1 30 LYS HA 1 31 ASP HA . . 5.900 4.691 4.442 4.872 . 0 0 "[ . 1 . 2 .]" 1
316 1 30 LYS QB 1 31 ASP HA . . 6.980 4.595 4.108 5.340 . 0 0 "[ . 1 . 2 .]" 1
317 1 30 LYS HB2 1 31 ASP H . . 5.300 3.153 1.977 4.518 . 0 0 "[ . 1 . 2 .]" 1
318 1 30 LYS HB2 1 32 SER H . . 6.100 4.910 3.240 6.136 0.036 1 0 "[ . 1 . 2 .]" 1
319 1 30 LYS HB3 1 31 ASP H . . 5.300 2.838 1.966 4.455 . 0 0 "[ . 1 . 2 .]" 1
320 1 30 LYS HB3 1 32 SER H . . 6.100 4.370 3.448 6.107 0.007 9 0 "[ . 1 . 2 .]" 1
321 1 30 LYS QE 1 31 ASP H . . 5.700 3.997 2.737 5.141 . 0 0 "[ . 1 . 2 .]" 1
322 1 30 LYS QG 1 31 ASP H . . 5.680 3.883 1.800 4.690 . 0 0 "[ . 1 . 2 .]" 1
323 1 31 ASP H 1 32 SER H . . 5.000 2.850 1.981 4.348 . 0 0 "[ . 1 . 2 .]" 1
324 1 31 ASP HA 1 32 SER HA . . 6.100 4.596 3.851 4.766 . 0 0 "[ . 1 . 2 .]" 1
325 1 31 ASP HA 1 32 SER HB2 . . 6.500 5.097 4.145 5.684 . 0 0 "[ . 1 . 2 .]" 1
326 1 31 ASP HA 1 32 SER QB . . 6.240 4.790 3.985 5.257 . 0 0 "[ . 1 . 2 .]" 1
327 1 31 ASP HA 1 32 SER HB3 . . 6.500 5.835 5.171 6.394 . 0 0 "[ . 1 . 2 .]" 1
328 1 31 ASP HA 1 72 LYS HA . . 6.000 4.947 4.204 5.497 . 0 0 "[ . 1 . 2 .]" 1
329 1 31 ASP HA 1 72 LYS QB . . 7.000 5.653 4.864 6.260 . 0 0 "[ . 1 . 2 .]" 1
330 1 31 ASP HA 1 72 LYS QG . . 7.000 5.586 4.724 6.296 . 0 0 "[ . 1 . 2 .]" 1
331 1 31 ASP HA 1 73 PHE H . . 6.100 4.716 3.463 5.590 . 0 0 "[ . 1 . 2 .]" 1
332 1 31 ASP QB 1 33 LEU H . . 6.680 5.598 4.614 5.956 . 0 0 "[ . 1 . 2 .]" 1
333 1 31 ASP QB 1 70 GLU QB . . 8.080 5.104 4.220 6.416 . 0 0 "[ . 1 . 2 .]" 1
334 1 31 ASP QB 1 71 LEU QD . . 10.180 5.657 4.728 6.343 . 0 0 "[ . 1 . 2 .]" 1
335 1 31 ASP QB 1 72 LYS H . . 6.680 5.263 4.364 6.053 . 0 0 "[ . 1 . 2 .]" 1
336 1 31 ASP QB 1 72 LYS QB . . 7.880 3.535 2.321 4.577 . 0 0 "[ . 1 . 2 .]" 1
337 1 31 ASP QB 1 72 LYS QD . . 7.880 4.553 3.848 6.027 . 0 0 "[ . 1 . 2 .]" 1
338 1 31 ASP QB 1 72 LYS QG . . 7.880 3.072 2.356 4.768 . 0 0 "[ . 1 . 2 .]" 1
339 1 31 ASP HB2 1 72 LYS HA . . 6.100 3.712 2.239 5.045 . 0 0 "[ . 1 . 2 .]" 1
340 1 31 ASP HB3 1 72 LYS HA . . 6.100 2.886 2.129 4.966 . 0 0 "[ . 1 . 2 .]" 1
341 1 32 SER H 1 33 LEU H . . 6.100 4.088 3.505 4.476 . 0 0 "[ . 1 . 2 .]" 1
342 1 32 SER H 1 34 SER H . . 7.800 7.052 6.121 7.814 0.014 9 0 "[ . 1 . 2 .]" 1
343 1 32 SER H 1 71 LEU QD . . 8.200 5.226 4.126 6.051 . 0 0 "[ . 1 . 2 .]" 1
344 1 32 SER H 1 72 LYS QG . . 6.000 4.283 3.117 5.343 . 0 0 "[ . 1 . 2 .]" 1
345 1 32 SER H 1 73 PHE H . . 6.100 4.701 2.633 5.924 . 0 0 "[ . 1 . 2 .]" 1
346 1 32 SER HA 1 72 LYS HA . . 6.100 4.939 4.320 5.516 . 0 0 "[ . 1 . 2 .]" 1
347 1 32 SER QB 1 33 LEU HA . . 6.980 4.507 3.922 4.784 . 0 0 "[ . 1 . 2 .]" 1
348 1 32 SER QB 1 33 LEU MD2 . . 6.180 3.491 2.659 4.432 . 0 0 "[ . 1 . 2 .]" 1
349 1 32 SER QB 1 71 LEU H . . 5.780 3.700 2.979 4.395 . 0 0 "[ . 1 . 2 .]" 1
350 1 32 SER QB 1 71 LEU HA . . 5.680 4.305 4.042 4.709 . 0 0 "[ . 1 . 2 .]" 1
351 1 32 SER QB 1 71 LEU HB2 . . 5.640 3.546 2.069 4.479 . 0 0 "[ . 1 . 2 .]" 1
352 1 32 SER QB 1 71 LEU HG . . 6.170 3.697 2.572 4.769 . 0 0 "[ . 1 . 2 .]" 1
353 1 32 SER QB 1 72 LYS H . . 4.370 3.631 2.921 3.935 . 0 0 "[ . 1 . 2 .]" 1
354 1 32 SER QB 1 72 LYS HA . . 6.980 2.665 2.151 3.294 . 0 0 "[ . 1 . 2 .]" 1
355 1 32 SER QB 1 73 PHE HA . . 6.680 3.598 2.537 4.646 . 0 0 "[ . 1 . 2 .]" 1
356 1 32 SER HB2 1 33 LEU H . . 6.100 3.226 2.332 3.525 . 0 0 "[ . 1 . 2 .]" 1
357 1 32 SER HB2 1 71 LEU HB2 . . 6.000 4.648 2.316 6.004 0.004 11 0 "[ . 1 . 2 .]" 1
358 1 32 SER HB2 1 71 LEU QD . . 8.200 3.649 2.147 4.565 . 0 0 "[ . 1 . 2 .]" 1
359 1 32 SER HB2 1 71 LEU HG . . 6.800 4.608 2.943 6.353 . 0 0 "[ . 1 . 2 .]" 1
360 1 32 SER HB2 1 72 LYS H . . 4.700 4.285 3.474 4.747 0.047 25 0 "[ . 1 . 2 .]" 1
361 1 32 SER HB3 1 33 LEU H . . 6.100 2.392 2.037 2.775 . 0 0 "[ . 1 . 2 .]" 1
362 1 32 SER HB3 1 71 LEU HB2 . . 6.000 3.793 2.106 5.281 . 0 0 "[ . 1 . 2 .]" 1
363 1 32 SER HB3 1 71 LEU QD . . 8.200 3.040 2.110 3.962 . 0 0 "[ . 1 . 2 .]" 1
364 1 32 SER HB3 1 71 LEU HG . . 6.800 3.962 2.671 5.502 . 0 0 "[ . 1 . 2 .]" 1
365 1 32 SER HB3 1 72 LYS H . . 4.700 4.123 3.021 4.824 0.124 16 0 "[ . 1 . 2 .]" 1
366 1 33 LEU H 1 33 LEU MD1 . . 5.600 3.487 3.133 4.214 . 0 0 "[ . 1 . 2 .]" 1
367 1 33 LEU H 1 34 SER H . . 6.100 4.383 4.262 4.589 . 0 0 "[ . 1 . 2 .]" 1
368 1 33 LEU H 1 34 SER HA . . 5.200 5.193 4.904 5.313 0.113 14 0 "[ . 1 . 2 .]" 1
369 1 33 LEU H 1 70 GLU QB . . 7.300 5.646 4.785 6.520 . 0 0 "[ . 1 . 2 .]" 1
370 1 33 LEU H 1 71 LEU H . . 4.700 4.140 3.051 4.546 . 0 0 "[ . 1 . 2 .]" 1
371 1 33 LEU H 1 71 LEU HB2 . . 5.300 4.173 2.663 5.147 . 0 0 "[ . 1 . 2 .]" 1
372 1 33 LEU H 1 71 LEU QD . . 8.100 3.007 1.856 3.794 . 0 0 "[ . 1 . 2 .]" 1
373 1 33 LEU H 1 72 LYS HA . . 6.100 5.383 4.439 6.112 0.012 2 0 "[ . 1 . 2 .]" 1
374 1 33 LEU HA 1 34 SER HA . . 6.100 4.454 4.096 4.623 . 0 0 "[ . 1 . 2 .]" 1
375 1 33 LEU HA 1 34 SER QB . . 7.000 4.853 4.211 5.180 . 0 0 "[ . 1 . 2 .]" 1
376 1 33 LEU HA 1 37 GLU QB . . 7.000 4.785 3.893 5.345 . 0 0 "[ . 1 . 2 .]" 1
377 1 33 LEU HA 1 38 PHE QB . . 7.000 5.118 2.251 5.746 . 0 0 "[ . 1 . 2 .]" 1
378 1 33 LEU HA 1 70 GLU QB . . 7.000 5.287 4.375 6.297 . 0 0 "[ . 1 . 2 .]" 1
379 1 33 LEU HA 1 71 LEU H . . 4.800 4.763 4.509 4.909 0.109 15 0 "[ . 1 . 2 .]" 1
380 1 33 LEU HB2 1 34 SER H . . 6.100 2.963 2.035 3.964 . 0 0 "[ . 1 . 2 .]" 1
381 1 33 LEU HB2 1 37 GLU H . . 6.100 5.737 4.887 6.126 0.026 12 0 "[ . 1 . 2 .]" 1
382 1 33 LEU HB2 1 37 GLU QB . . 6.300 3.628 2.659 4.436 . 0 0 "[ . 1 . 2 .]" 1
383 1 33 LEU HB2 1 37 GLU QG . . 7.000 3.791 2.247 6.243 . 0 0 "[ . 1 . 2 .]" 1
384 1 33 LEU HB2 1 38 PHE H . . 4.700 3.371 2.627 3.758 . 0 0 "[ . 1 . 2 .]" 1
385 1 33 LEU HB2 1 38 PHE HA . . 5.900 3.494 2.994 3.881 . 0 0 "[ . 1 . 2 .]" 1
386 1 33 LEU HB2 1 71 LEU HB2 . . 6.000 5.133 4.297 6.080 0.080 20 0 "[ . 1 . 2 .]" 1
387 1 33 LEU HB3 1 34 SER H . . 5.900 2.082 1.951 2.714 . 0 0 "[ . 1 . 2 .]" 1
388 1 33 LEU HB3 1 37 GLU QB . . 5.200 3.063 2.277 3.612 . 0 0 "[ . 1 . 2 .]" 1
389 1 33 LEU HB3 1 37 GLU QG . . 6.300 2.977 1.960 5.057 . 0 0 "[ . 1 . 2 .]" 1
390 1 33 LEU HB3 1 38 PHE H . . 4.100 3.814 2.697 4.262 0.162 22 0 "[ . 1 . 2 .]" 1
391 1 33 LEU HB3 1 38 PHE HA . . 5.900 4.426 3.201 5.277 . 0 0 "[ . 1 . 2 .]" 1
392 1 33 LEU HB3 1 71 LEU QD . . 7.400 4.757 3.219 5.516 . 0 0 "[ . 1 . 2 .]" 1
393 1 33 LEU MD1 1 34 SER H . . 5.700 3.724 2.984 4.493 . 0 0 "[ . 1 . 2 .]" 1
394 1 33 LEU MD1 1 37 GLU QB . . 7.800 4.435 2.287 5.208 . 0 0 "[ . 1 . 2 .]" 1
395 1 33 LEU MD1 1 37 GLU QG . . 7.800 3.776 2.226 5.588 . 0 0 "[ . 1 . 2 .]" 1
396 1 33 LEU MD2 1 34 SER H . . 5.300 4.422 3.476 4.528 . 0 0 "[ . 1 . 2 .]" 1
397 1 33 LEU MD2 1 38 PHE HA . . 5.000 3.534 2.155 4.181 . 0 0 "[ . 1 . 2 .]" 1
398 1 33 LEU MD2 1 71 LEU QD . . 6.800 3.608 2.594 4.252 . 0 0 "[ . 1 . 2 .]" 1
399 1 34 SER H 1 35 VAL H . . 6.100 4.626 4.445 4.716 . 0 0 "[ . 1 . 2 .]" 1
400 1 34 SER H 1 37 GLU H . . 6.100 4.664 4.113 5.170 . 0 0 "[ . 1 . 2 .]" 1
401 1 34 SER H 1 37 GLU QB . . 7.000 2.653 2.098 3.563 . 0 0 "[ . 1 . 2 .]" 1
402 1 34 SER H 1 37 GLU QG . . 5.900 3.411 2.421 4.800 . 0 0 "[ . 1 . 2 .]" 1
403 1 34 SER H 1 38 PHE H . . 6.100 3.927 3.100 4.348 . 0 0 "[ . 1 . 2 .]" 1
404 1 34 SER H 1 38 PHE QB . . 7.000 4.524 4.066 4.870 . 0 0 "[ . 1 . 2 .]" 1
405 1 34 SER H 1 70 GLU HA . . 5.900 4.742 4.389 5.028 . 0 0 "[ . 1 . 2 .]" 1
406 1 34 SER HA 1 35 VAL HA . . 6.100 4.183 3.844 4.335 . 0 0 "[ . 1 . 2 .]" 1
407 1 34 SER HA 1 35 VAL QG . . 6.660 3.414 2.833 3.644 . 0 0 "[ . 1 . 2 .]" 1
408 1 34 SER HA 1 37 GLU H . . 5.300 5.129 4.873 5.334 0.034 25 0 "[ . 1 . 2 .]" 1
409 1 34 SER HA 1 38 PHE H . . 5.600 4.902 4.766 5.047 . 0 0 "[ . 1 . 2 .]" 1
410 1 34 SER HA 1 68 ASP HA . . 6.100 5.541 4.400 6.136 0.036 14 0 "[ . 1 . 2 .]" 1
411 1 34 SER HA 1 70 GLU HA . . 6.100 2.172 2.031 2.426 . 0 0 "[ . 1 . 2 .]" 1
412 1 34 SER HA 1 70 GLU QG . . 5.980 3.816 2.333 5.311 . 0 0 "[ . 1 . 2 .]" 1
413 1 34 SER HA 1 71 LEU H . . 5.100 3.092 2.239 3.925 . 0 0 "[ . 1 . 2 .]" 1
414 1 34 SER QB 1 36 ASN H . . 7.000 3.649 2.900 4.517 . 0 0 "[ . 1 . 2 .]" 1
415 1 34 SER QB 1 37 GLU H . . 7.000 2.965 2.529 3.764 . 0 0 "[ . 1 . 2 .]" 1
416 1 34 SER QB 1 37 GLU QB . . 7.300 2.384 2.033 4.427 . 0 0 "[ . 1 . 2 .]" 1
417 1 34 SER QB 1 38 PHE H . . 7.000 4.013 3.677 4.723 . 0 0 "[ . 1 . 2 .]" 1
418 1 34 SER QB 1 68 ASP HA . . 6.400 3.788 2.320 4.784 . 0 0 "[ . 1 . 2 .]" 1
419 1 34 SER QB 1 70 GLU HA . . 6.900 3.726 3.272 4.297 . 0 0 "[ . 1 . 2 .]" 1
420 1 34 SER QB 1 70 GLU QG . . 7.880 4.711 2.761 6.263 . 0 0 "[ . 1 . 2 .]" 1
421 1 35 VAL H 1 35 VAL MG1 . . 4.800 3.738 3.657 3.806 . 0 0 "[ . 1 . 2 .]" 1
422 1 35 VAL H 1 35 VAL MG2 . . 4.800 2.032 1.915 2.297 . 0 0 "[ . 1 . 2 .]" 1
423 1 35 VAL H 1 36 ASN H . . 5.700 2.828 2.569 3.091 . 0 0 "[ . 1 . 2 .]" 1
424 1 35 VAL H 1 36 ASN QB . . 7.000 4.742 4.377 5.419 . 0 0 "[ . 1 . 2 .]" 1
425 1 35 VAL H 1 37 GLU H . . 6.100 4.257 3.807 4.768 . 0 0 "[ . 1 . 2 .]" 1
426 1 35 VAL H 1 67 GLN HA . . 4.900 4.048 3.604 4.321 . 0 0 "[ . 1 . 2 .]" 1
427 1 35 VAL H 1 68 ASP H . . 6.100 5.484 5.055 5.862 . 0 0 "[ . 1 . 2 .]" 1
428 1 35 VAL H 1 68 ASP HA . . 5.000 4.569 3.835 5.028 0.028 7 0 "[ . 1 . 2 .]" 1
429 1 35 VAL H 1 69 SER H . . 5.900 4.668 3.680 5.286 . 0 0 "[ . 1 . 2 .]" 1
430 1 35 VAL H 1 69 SER QB . . 6.000 4.815 4.144 5.397 . 0 0 "[ . 1 . 2 .]" 1
431 1 35 VAL H 1 70 GLU HA . . 3.900 3.484 2.182 3.942 0.042 12 0 "[ . 1 . 2 .]" 1
432 1 35 VAL H 1 71 LEU H . . 5.900 4.454 3.436 5.482 . 0 0 "[ . 1 . 2 .]" 1
433 1 35 VAL H 1 71 LEU QD . . 6.900 4.063 3.052 4.644 . 0 0 "[ . 1 . 2 .]" 1
434 1 35 VAL HA 1 36 ASN HA . . 6.100 4.776 4.643 4.905 . 0 0 "[ . 1 . 2 .]" 1
435 1 35 VAL HA 1 38 PHE H . . 6.100 3.579 3.199 3.818 . 0 0 "[ . 1 . 2 .]" 1
436 1 35 VAL HA 1 38 PHE QB . . 7.000 2.477 2.179 2.740 . 0 0 "[ . 1 . 2 .]" 1
437 1 35 VAL HA 1 38 PHE QD . . 7.800 3.636 2.980 4.309 . 0 0 "[ . 1 . 2 .]" 1
438 1 35 VAL HA 1 39 LYS H . . 6.100 4.223 4.022 4.512 . 0 0 "[ . 1 . 2 .]" 1
439 1 35 VAL HA 1 63 LEU HA . . 6.100 5.504 5.117 6.118 0.018 10 0 "[ . 1 . 2 .]" 1
440 1 35 VAL HA 1 70 GLU HA . . 6.100 5.154 3.818 5.842 . 0 0 "[ . 1 . 2 .]" 1
441 1 35 VAL HA 1 71 LEU H . . 6.100 4.806 3.841 5.889 . 0 0 "[ . 1 . 2 .]" 1
442 1 35 VAL HA 1 71 LEU HB2 . . 5.800 3.805 2.146 5.843 0.043 14 0 "[ . 1 . 2 .]" 1
443 1 35 VAL HA 1 71 LEU HB3 . . 6.100 4.383 3.465 5.853 . 0 0 "[ . 1 . 2 .]" 1
444 1 35 VAL HA 1 71 LEU QD . . 7.500 2.356 1.957 2.782 . 0 0 "[ . 1 . 2 .]" 1
445 1 35 VAL HB 1 36 ASN H . . 6.100 2.422 2.115 2.923 . 0 0 "[ . 1 . 2 .]" 1
446 1 35 VAL HB 1 37 GLU H . . 6.100 4.972 4.543 5.385 . 0 0 "[ . 1 . 2 .]" 1
447 1 35 VAL HB 1 63 LEU HA . . 6.100 3.570 2.619 4.195 . 0 0 "[ . 1 . 2 .]" 1
448 1 35 VAL HB 1 63 LEU HB3 . . 4.800 4.354 2.574 4.835 0.035 6 0 "[ . 1 . 2 .]" 1
449 1 35 VAL HB 1 63 LEU QD . . 8.200 3.943 3.441 4.366 . 0 0 "[ . 1 . 2 .]" 1
450 1 35 VAL HB 1 63 LEU HG . . 4.700 3.841 2.598 4.711 0.011 13 0 "[ . 1 . 2 .]" 1
451 1 35 VAL HB 1 67 GLN H . . 5.900 4.609 4.492 4.756 . 0 0 "[ . 1 . 2 .]" 1
452 1 35 VAL HB 1 67 GLN HA . . 5.300 2.026 1.965 2.087 . 0 0 "[ . 1 . 2 .]" 1
453 1 35 VAL HB 1 67 GLN HB2 . . 3.300 2.779 2.295 3.145 . 0 0 "[ . 1 . 2 .]" 1
454 1 35 VAL HB 1 67 GLN QB . . 2.980 2.626 2.230 2.755 . 0 0 "[ . 1 . 2 .]" 1
455 1 35 VAL HB 1 67 GLN HB3 . . 3.300 3.291 2.988 3.424 0.124 7 0 "[ . 1 . 2 .]" 1
456 1 35 VAL HB 1 68 ASP H . . 6.100 4.877 4.720 5.193 . 0 0 "[ . 1 . 2 .]" 1
457 1 35 VAL HB 1 68 ASP HA . . 5.300 5.281 5.059 5.384 0.084 12 0 "[ . 1 . 2 .]" 1
458 1 35 VAL HB 1 69 SER H . . 4.800 4.694 4.103 4.851 0.051 13 0 "[ . 1 . 2 .]" 1
459 1 35 VAL HB 1 69 SER QB . . 6.600 4.869 3.882 5.449 . 0 0 "[ . 1 . 2 .]" 1
460 1 35 VAL QG 1 36 ASN H . . 4.890 3.144 2.810 3.501 . 0 0 "[ . 1 . 2 .]" 1
461 1 35 VAL QG 1 39 LYS H . . 7.560 4.114 3.785 4.436 . 0 0 "[ . 1 . 2 .]" 1
462 1 35 VAL QG 1 62 SER QB . . 9.360 4.004 3.001 5.154 . 0 0 "[ . 1 . 2 .]" 1
463 1 35 VAL QG 1 63 LEU HB2 . . 7.160 3.856 2.121 4.425 . 0 0 "[ . 1 . 2 .]" 1
464 1 35 VAL QG 1 63 LEU HB3 . . 7.160 3.164 2.101 4.028 . 0 0 "[ . 1 . 2 .]" 1
465 1 35 VAL QG 1 63 LEU HG . . 6.160 2.224 2.016 3.364 . 0 0 "[ . 1 . 2 .]" 1
466 1 35 VAL QG 1 66 ASN H . . 7.060 4.447 3.896 5.172 . 0 0 "[ . 1 . 2 .]" 1
467 1 35 VAL QG 1 66 ASN QB . . 7.860 4.421 3.640 5.120 . 0 0 "[ . 1 . 2 .]" 1
468 1 35 VAL QG 1 67 GLN HA . . 5.240 2.469 2.166 2.710 . 0 0 "[ . 1 . 2 .]" 1
469 1 35 VAL QG 1 69 SER H . . 6.860 3.440 2.799 4.061 . 0 0 "[ . 1 . 2 .]" 1
470 1 35 VAL QG 1 69 SER QB . . 8.560 2.812 2.230 3.250 . 0 0 "[ . 1 . 2 .]" 1
471 1 35 VAL QG 1 70 GLU HA . . 8.360 3.291 2.234 4.293 . 0 0 "[ . 1 . 2 .]" 1
472 1 35 VAL QG 1 71 LEU HB3 . . 5.960 3.714 2.288 4.493 . 0 0 "[ . 1 . 2 .]" 1
473 1 35 VAL QG 1 79 LEU QD . . 9.160 2.806 2.146 3.323 . 0 0 "[ . 1 . 2 .]" 1
474 1 35 VAL MG1 1 36 ASN H . . 5.700 3.440 2.898 3.931 . 0 0 "[ . 1 . 2 .]" 1
475 1 35 VAL MG1 1 67 GLN HA . . 5.900 2.872 2.310 3.410 . 0 0 "[ . 1 . 2 .]" 1
476 1 35 VAL MG2 1 36 ASN H . . 5.700 3.740 3.422 4.071 . 0 0 "[ . 1 . 2 .]" 1
477 1 35 VAL MG2 1 67 GLN HA . . 5.900 2.757 2.485 3.046 . 0 0 "[ . 1 . 2 .]" 1
478 1 36 ASN H 1 36 ASN HD21 . . 6.100 3.895 2.066 4.501 . 0 0 "[ . 1 . 2 .]" 1
479 1 36 ASN H 1 36 ASN HD22 . . 6.100 5.015 3.326 5.691 . 0 0 "[ . 1 . 2 .]" 1
480 1 36 ASN H 1 37 GLU H . . 4.100 2.746 2.490 3.179 . 0 0 "[ . 1 . 2 .]" 1
481 1 36 ASN H 1 38 PHE H . . 6.100 4.299 3.929 4.582 . 0 0 "[ . 1 . 2 .]" 1
482 1 36 ASN H 1 63 LEU HG . . 4.300 4.173 3.584 4.388 0.088 19 0 "[ . 1 . 2 .]" 1
483 1 36 ASN H 1 67 GLN HA . . 6.000 3.601 3.428 3.941 . 0 0 "[ . 1 . 2 .]" 1
484 1 36 ASN H 1 67 GLN QB . . 4.480 2.199 1.947 2.534 . 0 0 "[ . 1 . 2 .]" 1
485 1 36 ASN H 1 68 ASP HA . . 6.100 4.853 3.943 5.308 . 0 0 "[ . 1 . 2 .]" 1
486 1 36 ASN HA 1 39 LYS H . . 6.100 3.354 2.895 3.823 . 0 0 "[ . 1 . 2 .]" 1
487 1 36 ASN HA 1 39 LYS QB . . 7.000 2.804 2.258 3.483 . 0 0 "[ . 1 . 2 .]" 1
488 1 36 ASN HA 1 40 GLU H . . 6.100 4.339 3.982 4.980 . 0 0 "[ . 1 . 2 .]" 1
489 1 36 ASN HA 1 63 LEU HA . . 5.100 5.000 4.616 5.186 0.086 19 0 "[ . 1 . 2 .]" 1
490 1 36 ASN HA 1 63 LEU HB2 . . 4.600 4.560 2.723 4.736 0.136 17 0 "[ . 1 . 2 .]" 1
491 1 36 ASN HA 1 63 LEU HB3 . . 5.300 3.445 2.751 5.369 0.069 6 0 "[ . 1 . 2 .]" 1
492 1 36 ASN HA 1 63 LEU QD . . 7.400 3.067 2.031 3.770 . 0 0 "[ . 1 . 2 .]" 1
493 1 36 ASN HA 1 63 LEU HG . . 5.100 2.817 2.227 3.257 . 0 0 "[ . 1 . 2 .]" 1
494 1 36 ASN HA 1 67 GLN HA . . 6.100 5.162 4.595 5.451 . 0 0 "[ . 1 . 2 .]" 1
495 1 36 ASN HA 1 67 GLN QB . . 6.880 3.297 2.541 3.796 . 0 0 "[ . 1 . 2 .]" 1
496 1 36 ASN QB 1 37 GLU HA . . 7.000 3.975 3.674 4.308 . 0 0 "[ . 1 . 2 .]" 1
497 1 36 ASN QB 1 67 GLN QB . . 7.880 2.092 1.919 2.267 . 0 0 "[ . 1 . 2 .]" 1
498 1 36 ASN QB 1 68 ASP HA . . 5.800 4.967 3.650 5.249 . 0 0 "[ . 1 . 2 .]" 1
499 1 36 ASN QD 1 67 GLN H . . 5.270 4.652 4.259 4.801 . 0 0 "[ . 1 . 2 .]" 1
500 1 37 GLU H 1 38 PHE H . . 5.300 2.976 2.717 3.135 . 0 0 "[ . 1 . 2 .]" 1
501 1 37 GLU H 1 38 PHE QB . . 7.000 4.528 4.277 4.852 . 0 0 "[ . 1 . 2 .]" 1
502 1 37 GLU H 1 39 LYS H . . 6.100 4.351 4.201 4.652 . 0 0 "[ . 1 . 2 .]" 1
503 1 37 GLU H 1 40 GLU H . . 5.600 4.900 4.713 5.350 . 0 0 "[ . 1 . 2 .]" 1
504 1 37 GLU HA 1 38 PHE HA . . 5.200 4.905 4.647 4.994 . 0 0 "[ . 1 . 2 .]" 1
505 1 37 GLU HA 1 39 LYS H . . 6.100 4.636 4.276 4.903 . 0 0 "[ . 1 . 2 .]" 1
506 1 37 GLU HA 1 40 GLU H . . 6.100 3.654 3.101 4.050 . 0 0 "[ . 1 . 2 .]" 1
507 1 37 GLU HA 1 40 GLU QB . . 7.000 3.015 2.494 4.039 . 0 0 "[ . 1 . 2 .]" 1
508 1 37 GLU HA 1 40 GLU HG3 . . 5.000 3.948 2.737 4.906 . 0 0 "[ . 1 . 2 .]" 1
509 1 37 GLU QG 1 38 PHE H . . 5.400 3.371 2.767 4.352 . 0 0 "[ . 1 . 2 .]" 1
510 1 38 PHE H 1 38 PHE QE . . 7.000 6.146 6.026 6.258 . 0 0 "[ . 1 . 2 .]" 1
511 1 38 PHE H 1 39 LYS H . . 5.900 3.081 2.943 3.355 . 0 0 "[ . 1 . 2 .]" 1
512 1 38 PHE H 1 40 GLU H . . 6.100 4.519 4.305 4.711 . 0 0 "[ . 1 . 2 .]" 1
513 1 38 PHE HA 1 38 PHE HZ . . 6.800 6.266 5.687 6.521 . 0 0 "[ . 1 . 2 .]" 1
514 1 38 PHE HA 1 39 LYS HA . . 6.100 4.808 4.644 4.935 . 0 0 "[ . 1 . 2 .]" 1
515 1 38 PHE HA 1 42 VAL H . . 5.900 3.746 3.457 3.957 . 0 0 "[ . 1 . 2 .]" 1
516 1 38 PHE QB 1 63 LEU HG . . 7.000 4.950 4.403 5.847 . 0 0 "[ . 1 . 2 .]" 1
517 1 38 PHE QB 1 71 LEU HB3 . . 7.000 4.291 3.028 5.587 . 0 0 "[ . 1 . 2 .]" 1
518 1 38 PHE QB 1 71 LEU QD . . 10.500 2.072 1.848 2.732 . 0 0 "[ . 1 . 2 .]" 1
519 1 38 PHE QB 1 79 LEU QD . . 10.500 4.069 3.160 4.571 . 0 0 "[ . 1 . 2 .]" 1
520 1 38 PHE QD 1 39 LYS H . . 6.500 2.795 2.496 4.060 . 0 0 "[ . 1 . 2 .]" 1
521 1 38 PHE QD 1 42 VAL QG . . 10.260 2.985 2.562 3.705 . 0 0 "[ . 1 . 2 .]" 1
522 1 38 PHE QD 1 71 LEU QD . . 11.300 2.590 2.300 2.902 . 0 0 "[ . 1 . 2 .]" 1
523 1 38 PHE QE 1 59 LYS QE . . 8.700 3.506 2.196 5.482 . 0 0 "[ . 1 . 2 .]" 1
524 1 38 PHE QE 1 71 LEU QD . . 11.300 3.447 3.014 3.942 . 0 0 "[ . 1 . 2 .]" 1
525 1 38 PHE QE 1 79 LEU QB . . 8.700 2.471 2.228 2.938 . 0 0 "[ . 1 . 2 .]" 1
526 1 38 PHE QE 1 79 LEU QD . . 11.300 2.532 2.101 3.387 . 0 0 "[ . 1 . 2 .]" 1
527 1 38 PHE QE 1 79 LEU HG . . 7.800 3.635 2.653 4.765 . 0 0 "[ . 1 . 2 .]" 1
528 1 38 PHE HZ 1 77 TRP HA . . 6.500 6.409 5.917 6.570 0.070 8 0 "[ . 1 . 2 .]" 1
529 1 38 PHE HZ 1 80 ILE H . . 4.500 3.624 3.136 4.516 0.016 2 0 "[ . 1 . 2 .]" 1
530 1 38 PHE HZ 1 80 ILE MG . . 7.000 2.256 2.050 2.566 . 0 0 "[ . 1 . 2 .]" 1
531 1 39 LYS H 1 40 GLU H . . 5.300 2.859 2.526 3.057 . 0 0 "[ . 1 . 2 .]" 1
532 1 39 LYS H 1 40 GLU HG3 . . 5.200 4.662 4.318 5.295 0.095 6 0 "[ . 1 . 2 .]" 1
533 1 39 LYS H 1 42 VAL QG . . 6.260 4.042 3.803 4.288 . 0 0 "[ . 1 . 2 .]" 1
534 1 39 LYS H 1 63 LEU HG . . 4.900 4.042 3.742 4.746 . 0 0 "[ . 1 . 2 .]" 1
535 1 39 LYS HA 1 40 GLU HA . . 6.100 4.767 4.610 4.952 . 0 0 "[ . 1 . 2 .]" 1
536 1 39 LYS HA 1 42 VAL H . . 6.100 3.735 3.465 4.017 . 0 0 "[ . 1 . 2 .]" 1
537 1 39 LYS HA 1 42 VAL QG . . 7.260 2.184 2.022 2.462 . 0 0 "[ . 1 . 2 .]" 1
538 1 39 LYS HA 1 43 THR H . . 6.100 4.048 3.681 4.566 . 0 0 "[ . 1 . 2 .]" 1
539 1 39 LYS HA 1 43 THR HB . . 6.100 4.979 3.948 6.137 0.037 13 0 "[ . 1 . 2 .]" 1
540 1 39 LYS HA 1 59 LYS QE . . 6.100 4.570 3.127 5.482 . 0 0 "[ . 1 . 2 .]" 1
541 1 39 LYS QB 1 40 GLU H . . 6.900 2.672 2.230 3.430 . 0 0 "[ . 1 . 2 .]" 1
542 1 39 LYS QB 1 42 VAL H . . 7.000 5.242 5.068 5.416 . 0 0 "[ . 1 . 2 .]" 1
543 1 39 LYS QB 1 63 LEU HB2 . . 4.800 4.329 3.800 4.430 . 0 0 "[ . 1 . 2 .]" 1
544 1 39 LYS QB 1 63 LEU HG . . 3.600 2.929 2.356 3.349 . 0 0 "[ . 1 . 2 .]" 1
545 1 39 LYS QB 1 79 LEU QD . . 10.500 4.709 3.479 5.467 . 0 0 "[ . 1 . 2 .]" 1
546 1 39 LYS QD 1 40 GLU H . . 5.400 3.369 2.352 4.850 . 0 0 "[ . 1 . 2 .]" 1
547 1 39 LYS QG 1 40 GLU H . . 6.100 3.915 3.394 4.410 . 0 0 "[ . 1 . 2 .]" 1
548 1 39 LYS QG 1 42 VAL QG . . 5.660 3.487 2.674 3.768 . 0 0 "[ . 1 . 2 .]" 1
549 1 39 LYS QG 1 59 LYS HB3 . . 6.000 4.715 2.355 5.385 . 0 0 "[ . 1 . 2 .]" 1
550 1 39 LYS QG 1 59 LYS QE . . 7.700 4.047 2.440 5.423 . 0 0 "[ . 1 . 2 .]" 1
551 1 39 LYS QG 1 60 MET HA . . 6.600 4.322 3.709 4.842 . 0 0 "[ . 1 . 2 .]" 1
552 1 39 LYS QG 1 63 LEU QD . . 8.500 2.229 2.027 2.870 . 0 0 "[ . 1 . 2 .]" 1
553 1 39 LYS QG 1 63 LEU HG . . 6.600 4.292 3.194 5.206 . 0 0 "[ . 1 . 2 .]" 1
554 1 39 LYS QG 1 79 LEU QD . . 10.500 5.449 3.740 6.393 . 0 0 "[ . 1 . 2 .]" 1
555 1 40 GLU H 1 40 GLU HG2 . . 5.300 3.145 2.183 3.858 . 0 0 "[ . 1 . 2 .]" 1
556 1 40 GLU H 1 40 GLU HG3 . . 4.900 2.331 2.085 3.303 . 0 0 "[ . 1 . 2 .]" 1
557 1 40 GLU H 1 42 VAL H . . 5.500 4.396 4.134 4.825 . 0 0 "[ . 1 . 2 .]" 1
558 1 40 GLU H 1 42 VAL QG . . 7.160 4.333 4.094 4.665 . 0 0 "[ . 1 . 2 .]" 1
559 1 40 GLU HA 1 42 VAL H . . 5.500 4.676 4.195 5.296 . 0 0 "[ . 1 . 2 .]" 1
560 1 40 GLU HA 1 43 THR H . . 6.100 3.608 3.049 4.234 . 0 0 "[ . 1 . 2 .]" 1
561 1 40 GLU HA 1 43 THR HB . . 6.100 3.577 2.223 4.618 . 0 0 "[ . 1 . 2 .]" 1
562 1 40 GLU HA 1 44 GLN H . . 6.100 4.134 3.666 4.785 . 0 0 "[ . 1 . 2 .]" 1
563 1 40 GLU QB 1 42 VAL QG . . 8.860 5.241 5.045 5.558 . 0 0 "[ . 1 . 2 .]" 1
564 1 40 GLU HG2 1 43 THR MG . . 5.400 3.855 3.311 4.734 . 0 0 "[ . 1 . 2 .]" 1
565 1 40 GLU HG3 1 63 LEU QD . . 7.700 5.097 3.595 5.731 . 0 0 "[ . 1 . 2 .]" 1
566 1 42 VAL H 1 43 THR H . . 3.800 2.834 2.388 3.028 . 0 0 "[ . 1 . 2 .]" 1
567 1 42 VAL H 1 43 THR HA . . 6.100 5.396 5.079 5.551 . 0 0 "[ . 1 . 2 .]" 1
568 1 42 VAL H 1 43 THR HB . . 5.900 5.052 3.993 5.728 . 0 0 "[ . 1 . 2 .]" 1
569 1 42 VAL H 1 43 THR MG . . 5.900 4.710 4.081 5.963 0.063 13 0 "[ . 1 . 2 .]" 1
570 1 42 VAL H 1 44 GLN H . . 4.300 4.185 3.686 4.319 0.019 14 0 "[ . 1 . 2 .]" 1
571 1 42 VAL HA 1 45 GLN H . . 6.100 3.194 2.786 3.500 . 0 0 "[ . 1 . 2 .]" 1
572 1 42 VAL HA 1 45 GLN QB . . 7.000 2.458 2.157 4.493 . 0 0 "[ . 1 . 2 .]" 1
573 1 42 VAL HA 1 46 LEU QD . . 6.770 2.866 2.268 3.407 . 0 0 "[ . 1 . 2 .]" 1
574 1 42 VAL HA 2 9 LEU HG . . 5.200 4.760 3.642 5.325 0.125 11 0 "[ . 1 . 2 .]" 1
575 1 42 VAL HB 1 80 ILE HB . . 5.100 5.105 4.564 5.252 0.152 22 0 "[ . 1 . 2 .]" 1
576 1 42 VAL HB 1 80 ILE MG . . 7.000 3.830 3.182 4.548 . 0 0 "[ . 1 . 2 .]" 1
577 1 42 VAL QG 1 43 THR H . . 6.060 2.287 2.163 2.449 . 0 0 "[ . 1 . 2 .]" 1
578 1 42 VAL QG 1 80 ILE HA . . 7.760 3.756 2.925 4.250 . 0 0 "[ . 1 . 2 .]" 1
579 1 42 VAL QG 1 80 ILE MG . . 7.260 2.485 2.061 3.189 . 0 0 "[ . 1 . 2 .]" 1
580 1 42 VAL QG 1 83 LEU QD . . 9.530 2.130 1.822 2.736 . 0 0 "[ . 1 . 2 .]" 1
581 1 42 VAL QG 2 9 LEU HG . . 7.160 4.035 2.549 5.318 . 0 0 "[ . 1 . 2 .]" 1
582 1 43 THR H 1 44 GLN H . . 3.700 2.815 2.720 2.978 . 0 0 "[ . 1 . 2 .]" 1
583 1 43 THR H 1 45 GLN H . . 5.700 4.344 4.048 4.758 . 0 0 "[ . 1 . 2 .]" 1
584 1 43 THR H 1 46 LEU QD . . 6.170 4.368 4.001 4.615 . 0 0 "[ . 1 . 2 .]" 1
585 1 43 THR HA 1 44 GLN HA . . 6.100 4.786 4.679 4.869 . 0 0 "[ . 1 . 2 .]" 1
586 1 43 THR HA 1 45 GLN H . . 6.100 4.609 4.078 4.929 . 0 0 "[ . 1 . 2 .]" 1
587 1 43 THR HA 1 46 LEU H . . 6.100 3.518 3.002 3.910 . 0 0 "[ . 1 . 2 .]" 1
588 1 43 THR HA 1 46 LEU HB2 . . 6.100 3.129 2.160 4.141 . 0 0 "[ . 1 . 2 .]" 1
589 1 43 THR HB 1 44 GLN H . . 5.100 3.773 2.352 4.398 . 0 0 "[ . 1 . 2 .]" 1
590 1 43 THR MG 1 44 GLN H . . 4.500 2.545 2.202 3.483 . 0 0 "[ . 1 . 2 .]" 1
591 1 43 THR MG 1 44 GLN HA . . 4.600 3.421 3.147 3.769 . 0 0 "[ . 1 . 2 .]" 1
592 1 43 THR MG 1 44 GLN QB . . 7.200 3.515 2.912 4.831 . 0 0 "[ . 1 . 2 .]" 1
593 1 43 THR MG 1 44 GLN QG . . 6.080 3.719 2.147 4.472 . 0 0 "[ . 1 . 2 .]" 1
594 1 43 THR MG 1 45 GLN H . . 6.800 4.687 4.306 5.283 . 0 0 "[ . 1 . 2 .]" 1
595 1 44 GLN H 1 45 GLN H . . 5.200 2.615 2.323 2.918 . 0 0 "[ . 1 . 2 .]" 1
596 1 44 GLN H 1 46 LEU H . . 5.900 3.952 3.289 4.209 . 0 0 "[ . 1 . 2 .]" 1
597 1 44 GLN H 1 46 LEU HB2 . . 6.100 5.498 4.708 6.213 0.113 8 0 "[ . 1 . 2 .]" 1
598 1 44 GLN HA 1 46 LEU H . . 6.600 4.246 3.864 4.673 . 0 0 "[ . 1 . 2 .]" 1
599 1 44 GLN QB 1 45 GLN HA . . 7.000 4.062 3.750 4.509 . 0 0 "[ . 1 . 2 .]" 1
600 1 45 GLN H 1 45 GLN HE21 . . 6.100 3.529 2.313 5.161 . 0 0 "[ . 1 . 2 .]" 1
601 1 45 GLN H 1 45 GLN HE22 . . 6.100 3.819 3.272 4.740 . 0 0 "[ . 1 . 2 .]" 1
602 1 45 GLN H 1 45 GLN HG2 . . 5.700 3.641 2.333 4.246 . 0 0 "[ . 1 . 2 .]" 1
603 1 45 GLN H 1 45 GLN HG3 . . 5.700 3.999 3.709 4.280 . 0 0 "[ . 1 . 2 .]" 1
604 1 45 GLN H 1 46 LEU H . . 4.800 2.691 2.362 3.121 . 0 0 "[ . 1 . 2 .]" 1
605 1 45 GLN H 1 46 LEU QD . . 6.170 3.887 3.439 4.577 . 0 0 "[ . 1 . 2 .]" 1
606 1 45 GLN HA 1 45 GLN HE21 . . 6.000 3.376 1.986 5.061 . 0 0 "[ . 1 . 2 .]" 1
607 1 45 GLN HA 1 45 GLN HE22 . . 6.100 4.180 3.140 5.214 . 0 0 "[ . 1 . 2 .]" 1
608 1 45 GLN HA 1 46 LEU HA . . 6.100 4.690 4.584 5.022 . 0 0 "[ . 1 . 2 .]" 1
609 1 45 GLN HA 1 47 PRO QD . . 7.000 3.405 3.000 4.300 . 0 0 "[ . 1 . 2 .]" 1
610 1 45 GLN HA 2 7 THR MG . . 4.700 3.845 2.540 4.649 . 0 0 "[ . 1 . 2 .]" 1
611 1 45 GLN HA 2 10 GLU QB . . 6.500 4.613 3.942 5.842 . 0 0 "[ . 1 . 2 .]" 1
612 1 45 GLN QB 1 46 LEU HA . . 7.000 4.183 3.870 4.567 . 0 0 "[ . 1 . 2 .]" 1
613 1 45 GLN QB 1 46 LEU QD . . 8.470 2.514 2.002 3.474 . 0 0 "[ . 1 . 2 .]" 1
614 1 45 GLN QB 2 7 THR HB . . 6.200 3.010 2.047 5.132 . 0 0 "[ . 1 . 2 .]" 1
615 1 45 GLN QB 2 7 THR MG . . 7.500 3.639 1.986 4.097 . 0 0 "[ . 1 . 2 .]" 1
616 1 45 GLN QB 2 9 LEU H . . 4.300 3.773 3.197 3.948 . 0 0 "[ . 1 . 2 .]" 1
617 1 45 GLN QB 2 9 LEU QB . . 7.500 2.542 2.089 4.152 . 0 0 "[ . 1 . 2 .]" 1
618 1 45 GLN QB 2 9 LEU HG . . 5.400 4.000 2.396 4.876 . 0 0 "[ . 1 . 2 .]" 1
619 1 45 GLN QB 2 10 GLU H . . 4.300 2.939 2.311 3.692 . 0 0 "[ . 1 . 2 .]" 1
620 1 45 GLN QB 2 10 GLU HA . . 6.700 4.588 3.838 5.737 . 0 0 "[ . 1 . 2 .]" 1
621 1 45 GLN QB 2 10 GLU QG . . 5.500 4.172 2.166 4.544 . 0 0 "[ . 1 . 2 .]" 1
622 1 45 GLN HG2 2 7 THR HB . . 4.500 3.889 2.912 4.606 0.106 23 0 "[ . 1 . 2 .]" 1
623 1 45 GLN HG2 2 9 LEU QB . . 5.100 2.668 2.083 4.562 . 0 0 "[ . 1 . 2 .]" 1
624 1 45 GLN HG2 2 9 LEU HG . . 4.000 3.222 2.191 4.095 0.095 20 0 "[ . 1 . 2 .]" 1
625 1 45 GLN HG2 2 10 GLU H . . 4.600 4.416 3.433 4.730 0.130 19 0 "[ . 1 . 2 .]" 1
626 1 45 GLN HG3 2 7 THR HB . . 5.200 2.564 2.019 4.274 . 0 0 "[ . 1 . 2 .]" 1
627 1 45 GLN HG3 2 9 LEU H . . 3.800 3.617 2.697 3.987 0.187 22 0 "[ . 1 . 2 .]" 1
628 1 46 LEU H 1 46 LEU MD1 . . 5.700 2.796 2.289 4.240 . 0 0 "[ . 1 . 2 .]" 1
629 1 46 LEU H 1 46 LEU MD2 . . 5.700 4.145 2.516 4.525 . 0 0 "[ . 1 . 2 .]" 1
630 1 46 LEU H 1 48 HIS H . . 6.100 5.268 4.967 5.679 . 0 0 "[ . 1 . 2 .]" 1
631 1 46 LEU HA 1 48 HIS H . . 6.100 3.487 2.896 4.653 . 0 0 "[ . 1 . 2 .]" 1
632 1 46 LEU QD 1 48 HIS H . . 6.970 4.316 3.383 5.088 . 0 0 "[ . 1 . 2 .]" 1
633 1 46 LEU QD 1 80 ILE MG . . 6.770 4.057 2.812 4.255 . 0 0 "[ . 1 . 2 .]" 1
634 1 46 LEU QD 1 89 LYS QE . . 9.070 4.041 2.869 5.914 . 0 0 "[ . 1 . 2 .]" 1
635 1 46 LEU QD 2 10 GLU HA . . 7.070 3.043 2.162 5.192 . 0 0 "[ . 1 . 2 .]" 1
636 1 46 LEU QD 2 10 GLU QG . . 9.070 2.692 1.832 3.695 . 0 0 "[ . 1 . 2 .]" 1
637 1 46 LEU QD 2 13 ILE MD . . 3.680 2.156 1.931 2.390 . 0 0 "[ . 1 . 2 .]" 1
638 1 46 LEU MD1 2 13 ILE MD . . 4.200 2.514 2.194 2.956 . 0 0 "[ . 1 . 2 .]" 1
639 1 46 LEU MD2 2 13 ILE MD . . 4.200 2.397 2.024 2.922 . 0 0 "[ . 1 . 2 .]" 1
640 1 47 PRO HA 1 50 LEU HB2 . . 6.400 5.458 4.290 6.424 0.024 3 0 "[ . 1 . 2 .]" 1
641 1 47 PRO HA 1 50 LEU HG . . 6.100 4.541 2.347 5.729 . 0 0 "[ . 1 . 2 .]" 1
642 1 47 PRO QD 2 10 GLU QG . . 7.500 3.533 2.374 4.598 . 0 0 "[ . 1 . 2 .]" 1
643 1 48 HIS HA 1 94 LYS HA . . 7.100 7.012 5.611 7.505 0.405 8 0 "[ . 1 . 2 .]" 1
644 1 48 HIS QB 1 87 ILE QG . . 7.880 3.158 2.064 4.861 . 0 0 "[ . 1 . 2 .]" 1
645 1 50 LEU H 1 50 LEU MD1 . . 4.800 3.693 2.640 4.112 . 0 0 "[ . 1 . 2 .]" 1
646 1 50 LEU H 1 50 LEU QD . . 4.380 2.642 2.070 3.375 . 0 0 "[ . 1 . 2 .]" 1
647 1 50 LEU H 1 50 LEU MD2 . . 4.800 2.840 2.079 4.049 . 0 0 "[ . 1 . 2 .]" 1
648 1 50 LEU H 1 51 LYS H . . 5.400 2.789 2.305 3.195 . 0 0 "[ . 1 . 2 .]" 1
649 1 50 LEU H 1 51 LYS HA . . 5.700 5.055 4.660 5.407 . 0 0 "[ . 1 . 2 .]" 1
650 1 50 LEU H 1 51 LYS HG2 . . 5.000 5.069 4.869 5.152 0.152 8 0 "[ . 1 . 2 .]" 1
651 1 50 LEU H 1 87 ILE HB . . 4.800 3.789 3.013 4.747 . 0 0 "[ . 1 . 2 .]" 1
652 1 50 LEU H 1 87 ILE MD . . 7.000 2.694 1.852 3.912 . 0 0 "[ . 1 . 2 .]" 1
653 1 50 LEU H 1 87 ILE QG . . 4.800 2.695 1.874 4.263 . 0 0 "[ . 1 . 2 .]" 1
654 1 50 LEU HA 1 51 LYS HA . . 6.000 4.546 4.438 4.635 . 0 0 "[ . 1 . 2 .]" 1
655 1 50 LEU HA 1 87 ILE HB . . 5.900 3.297 2.324 4.867 . 0 0 "[ . 1 . 2 .]" 1
656 1 51 LYS H 1 51 LYS HD2 . . 6.100 4.127 2.209 4.643 . 0 0 "[ . 1 . 2 .]" 1
657 1 51 LYS H 1 51 LYS HD3 . . 6.100 4.137 2.890 4.284 . 0 0 "[ . 1 . 2 .]" 1
658 1 51 LYS H 1 51 LYS QE . . 7.000 4.887 4.253 5.123 . 0 0 "[ . 1 . 2 .]" 1
659 1 51 LYS H 1 51 LYS HG3 . . 5.700 2.119 1.959 3.914 . 0 0 "[ . 1 . 2 .]" 1
660 1 51 LYS H 1 52 ASP H . . 4.700 2.357 1.927 2.561 . 0 0 "[ . 1 . 2 .]" 1
661 1 51 LYS H 1 87 ILE H . . 5.400 5.399 4.871 5.498 0.098 2 0 "[ . 1 . 2 .]" 1
662 1 51 LYS H 1 87 ILE HA . . 6.100 3.739 3.289 4.847 . 0 0 "[ . 1 . 2 .]" 1
663 1 51 LYS H 1 87 ILE MD . . 4.600 2.890 1.865 3.857 . 0 0 "[ . 1 . 2 .]" 1
664 1 51 LYS H 1 87 ILE QG . . 5.300 3.272 2.027 4.750 . 0 0 "[ . 1 . 2 .]" 1
665 1 51 LYS HA 1 87 ILE HA . . 6.100 6.057 5.786 7.203 1.103 21 1 "[ . 1 . 2+ .]" 1
666 1 51 LYS QB 1 52 ASP H . . 4.150 3.529 3.142 3.632 . 0 0 "[ . 1 . 2 .]" 1
667 1 51 LYS HB2 1 52 ASP H . . 4.800 3.938 3.307 4.086 . 0 0 "[ . 1 . 2 .]" 1
668 1 51 LYS HB3 1 52 ASP H . . 4.800 3.995 3.701 4.126 . 0 0 "[ . 1 . 2 .]" 1
669 1 51 LYS HD2 1 52 ASP H . . 3.300 3.235 2.347 3.483 0.183 21 0 "[ . 1 . 2 .]" 1
670 1 51 LYS HD3 1 52 ASP H . . 3.300 3.203 2.043 3.536 0.236 21 0 "[ . 1 . 2 .]" 1
671 1 51 LYS QE 1 87 ILE H . . 6.600 5.859 5.437 5.965 . 0 0 "[ . 1 . 2 .]" 1
672 1 51 LYS HG2 1 52 ASP H . . 3.900 3.779 1.908 3.938 0.038 18 0 "[ . 1 . 2 .]" 1
673 1 51 LYS HG2 1 87 ILE HA . . 5.500 2.960 2.303 3.846 . 0 0 "[ . 1 . 2 .]" 1
674 1 51 LYS HG2 1 88 ARG H . . 4.700 3.514 2.559 4.259 . 0 0 "[ . 1 . 2 .]" 1
675 1 51 LYS HG3 1 52 ASP H . . 3.800 2.243 2.023 3.490 . 0 0 "[ . 1 . 2 .]" 1
676 1 51 LYS HG3 1 87 ILE H . . 4.800 4.619 3.870 4.980 0.180 21 0 "[ . 1 . 2 .]" 1
677 1 52 ASP H 1 53 VAL H . . 4.000 3.776 3.355 4.005 0.005 3 0 "[ . 1 . 2 .]" 1
678 1 52 ASP H 1 86 GLU HA . . 5.000 4.861 4.225 5.062 0.062 11 0 "[ . 1 . 2 .]" 1
679 1 52 ASP H 1 86 GLU QB . . 7.000 3.404 2.914 4.594 . 0 0 "[ . 1 . 2 .]" 1
680 1 52 ASP HA 1 53 VAL HA . . 6.100 4.329 4.202 4.441 . 0 0 "[ . 1 . 2 .]" 1
681 1 52 ASP HA 1 53 VAL MG1 . . 5.900 4.074 3.762 4.614 . 0 0 "[ . 1 . 2 .]" 1
682 1 52 ASP HA 1 54 GLY H . . 6.800 6.048 3.645 6.301 . 0 0 "[ . 1 . 2 .]" 1
683 1 52 ASP HA 1 55 SER QB . . 7.000 5.679 4.366 6.296 . 0 0 "[ . 1 . 2 .]" 1
684 1 52 ASP HA 1 86 GLU HA . . 5.800 3.599 2.598 4.599 . 0 0 "[ . 1 . 2 .]" 1
685 1 52 ASP QB 1 55 SER H . . 7.000 6.155 5.296 6.349 . 0 0 "[ . 1 . 2 .]" 1
686 1 52 ASP QB 1 86 GLU HA . . 7.000 5.249 3.888 6.260 . 0 0 "[ . 1 . 2 .]" 1
687 1 52 ASP QB 1 86 GLU QB . . 7.800 3.526 1.984 5.683 . 0 0 "[ . 1 . 2 .]" 1
688 1 53 VAL H 1 53 VAL MG1 . . 4.600 2.521 2.281 3.165 . 0 0 "[ . 1 . 2 .]" 1
689 1 53 VAL H 1 53 VAL MG2 . . 4.800 3.622 2.129 4.040 . 0 0 "[ . 1 . 2 .]" 1
690 1 53 VAL H 1 54 GLY H . . 5.300 4.347 2.557 4.577 . 0 0 "[ . 1 . 2 .]" 1
691 1 53 VAL H 1 54 GLY QA . . 6.980 4.885 4.043 5.364 . 0 0 "[ . 1 . 2 .]" 1
692 1 53 VAL H 1 55 SER H . . 6.100 4.242 3.811 5.342 . 0 0 "[ . 1 . 2 .]" 1
693 1 53 VAL H 1 56 LEU HB2 . . 6.100 3.845 2.771 5.626 . 0 0 "[ . 1 . 2 .]" 1
694 1 53 VAL H 1 86 GLU HA . . 4.000 2.909 2.576 3.221 . 0 0 "[ . 1 . 2 .]" 1
695 1 53 VAL H 1 86 GLU QB . . 4.600 3.246 2.335 4.188 . 0 0 "[ . 1 . 2 .]" 1
696 1 53 VAL HA 1 54 GLY QA . . 6.880 3.999 3.841 4.084 . 0 0 "[ . 1 . 2 .]" 1
697 1 53 VAL HA 1 56 LEU HB2 . . 6.100 3.919 2.379 5.417 . 0 0 "[ . 1 . 2 .]" 1
698 1 53 VAL HA 1 56 LEU HB3 . . 6.100 3.112 2.198 5.048 . 0 0 "[ . 1 . 2 .]" 1
699 1 53 VAL HA 1 56 LEU HG . . 6.300 4.500 3.133 6.388 0.088 7 0 "[ . 1 . 2 .]" 1
700 1 53 VAL HA 1 86 GLU HA . . 5.400 5.429 5.006 5.556 0.156 17 0 "[ . 1 . 2 .]" 1
701 1 53 VAL HB 1 54 GLY H . . 5.400 3.720 2.263 4.421 . 0 0 "[ . 1 . 2 .]" 1
702 1 53 VAL HB 1 57 ASP H . . 6.800 6.643 6.004 6.938 0.138 14 0 "[ . 1 . 2 .]" 1
703 1 53 VAL MG1 1 54 GLY H . . 4.600 3.519 2.535 3.948 . 0 0 "[ . 1 . 2 .]" 1
704 1 54 GLY H 1 55 SER H . . 5.500 3.702 3.096 4.253 . 0 0 "[ . 1 . 2 .]" 1
705 1 54 GLY QA 1 57 ASP H . . 6.980 3.657 2.795 4.518 . 0 0 "[ . 1 . 2 .]" 1
706 1 54 GLY QA 1 57 ASP QB . . 7.850 3.307 2.342 4.615 . 0 0 "[ . 1 . 2 .]" 1
707 1 55 SER H 1 56 LEU H . . 5.900 2.450 2.132 3.008 . 0 0 "[ . 1 . 2 .]" 1
708 1 55 SER H 1 56 LEU HB2 . . 6.100 5.014 4.510 5.976 . 0 0 "[ . 1 . 2 .]" 1
709 1 55 SER H 1 57 ASP H . . 6.100 4.278 3.992 4.871 . 0 0 "[ . 1 . 2 .]" 1
710 1 55 SER H 1 85 LYS QB . . 6.900 5.278 3.145 6.174 . 0 0 "[ . 1 . 2 .]" 1
711 1 55 SER HA 1 56 LEU HA . . 6.100 4.887 4.765 5.086 . 0 0 "[ . 1 . 2 .]" 1
712 1 55 SER HA 1 57 ASP H . . 5.700 4.108 3.411 4.730 . 0 0 "[ . 1 . 2 .]" 1
713 1 55 SER HA 1 58 GLU H . . 6.100 3.029 2.628 3.856 . 0 0 "[ . 1 . 2 .]" 1
714 1 55 SER HA 1 58 GLU QB . . 7.000 2.411 2.028 3.546 . 0 0 "[ . 1 . 2 .]" 1
715 1 55 SER HA 1 59 LYS H . . 6.100 3.843 3.113 4.964 . 0 0 "[ . 1 . 2 .]" 1
716 1 55 SER HA 1 82 GLU QB . . 7.000 4.282 2.431 5.321 . 0 0 "[ . 1 . 2 .]" 1
717 1 55 SER HA 1 85 LYS QD . . 6.300 4.789 3.928 5.686 . 0 0 "[ . 1 . 2 .]" 1
718 1 55 SER QB 1 58 GLU H . . 7.000 4.734 3.972 5.515 . 0 0 "[ . 1 . 2 .]" 1
719 1 55 SER QB 1 82 GLU HA . . 5.300 3.460 2.905 4.249 . 0 0 "[ . 1 . 2 .]" 1
720 1 55 SER QB 1 82 GLU QG . . 7.800 3.078 2.089 5.317 . 0 0 "[ . 1 . 2 .]" 1
721 1 55 SER QB 1 83 LEU HA . . 6.300 4.728 3.074 5.623 . 0 0 "[ . 1 . 2 .]" 1
722 1 55 SER QB 1 85 LYS QB . . 7.400 3.578 2.386 5.259 . 0 0 "[ . 1 . 2 .]" 1
723 1 55 SER QB 1 86 GLU H . . 5.100 3.715 2.764 4.504 . 0 0 "[ . 1 . 2 .]" 1
724 1 55 SER QB 1 86 GLU QG . . 7.800 2.257 1.973 3.495 . 0 0 "[ . 1 . 2 .]" 1
725 1 56 LEU H 1 57 ASP H . . 5.700 2.845 2.550 3.065 . 0 0 "[ . 1 . 2 .]" 1
726 1 56 LEU H 1 59 LYS H . . 6.100 4.799 4.636 5.247 . 0 0 "[ . 1 . 2 .]" 1
727 1 56 LEU H 1 86 GLU HA . . 6.100 4.597 3.897 5.206 . 0 0 "[ . 1 . 2 .]" 1
728 1 56 LEU HA 1 57 ASP HA . . 6.100 4.819 4.691 4.992 . 0 0 "[ . 1 . 2 .]" 1
729 1 56 LEU HA 1 59 LYS H . . 5.700 3.764 3.424 4.037 . 0 0 "[ . 1 . 2 .]" 1
730 1 56 LEU HA 1 59 LYS HB2 . . 6.100 3.547 2.432 4.334 . 0 0 "[ . 1 . 2 .]" 1
731 1 56 LEU HA 1 59 LYS HB3 . . 6.100 3.573 2.979 5.183 . 0 0 "[ . 1 . 2 .]" 1
732 1 56 LEU HA 1 59 LYS QD . . 5.880 4.817 3.879 5.324 . 0 0 "[ . 1 . 2 .]" 1
733 1 56 LEU HA 1 60 MET H . . 5.700 3.927 3.477 4.276 . 0 0 "[ . 1 . 2 .]" 1
734 1 56 LEU HA 1 86 GLU QG . . 6.600 3.488 2.721 4.023 . 0 0 "[ . 1 . 2 .]" 1
735 1 56 LEU HB2 1 57 ASP H . . 5.400 3.770 3.479 4.319 . 0 0 "[ . 1 . 2 .]" 1
736 1 56 LEU HB2 1 58 GLU H . . 6.700 6.163 5.873 6.583 . 0 0 "[ . 1 . 2 .]" 1
737 1 56 LEU HB2 1 86 GLU QG . . 7.000 3.046 2.210 4.405 . 0 0 "[ . 1 . 2 .]" 1
738 1 56 LEU HB3 1 57 ASP H . . 5.100 2.548 2.159 3.944 . 0 0 "[ . 1 . 2 .]" 1
739 1 56 LEU MD1 1 57 ASP H . . 4.500 3.160 2.108 3.907 . 0 0 "[ . 1 . 2 .]" 1
740 1 56 LEU HG 1 57 ASP H . . 4.500 3.869 2.443 4.518 0.018 23 0 "[ . 1 . 2 .]" 1
741 1 56 LEU HG 1 57 ASP HA . . 5.200 4.549 2.684 5.272 0.072 22 0 "[ . 1 . 2 .]" 1
742 1 57 ASP H 1 58 GLU H . . 5.200 2.957 2.638 3.298 . 0 0 "[ . 1 . 2 .]" 1
743 1 57 ASP H 1 59 LYS H . . 5.700 4.289 4.094 4.472 . 0 0 "[ . 1 . 2 .]" 1
744 1 57 ASP H 1 60 MET H . . 5.900 4.663 4.478 4.885 . 0 0 "[ . 1 . 2 .]" 1
745 1 57 ASP H 1 86 GLU QG . . 5.600 4.880 4.614 5.126 . 0 0 "[ . 1 . 2 .]" 1
746 1 57 ASP HA 1 58 GLU HA . . 6.100 4.948 4.744 5.071 . 0 0 "[ . 1 . 2 .]" 1
747 1 57 ASP HA 1 59 LYS H . . 5.500 4.470 4.247 4.722 . 0 0 "[ . 1 . 2 .]" 1
748 1 57 ASP HA 1 60 MET H . . 6.100 3.508 3.241 4.052 . 0 0 "[ . 1 . 2 .]" 1
749 1 57 ASP HA 1 60 MET QB . . 7.000 2.472 2.226 3.100 . 0 0 "[ . 1 . 2 .]" 1
750 1 57 ASP HA 1 61 LYS H . . 5.500 3.867 3.194 5.013 . 0 0 "[ . 1 . 2 .]" 1
751 1 58 GLU H 1 59 LYS H . . 3.800 3.002 2.857 3.123 . 0 0 "[ . 1 . 2 .]" 1
752 1 58 GLU H 1 60 MET H . . 5.600 4.441 4.078 4.771 . 0 0 "[ . 1 . 2 .]" 1
753 1 58 GLU H 1 61 LYS QD . . 5.680 4.319 3.433 5.102 . 0 0 "[ . 1 . 2 .]" 1
754 1 58 GLU H 1 61 LYS QE . . 5.900 4.551 3.464 5.314 . 0 0 "[ . 1 . 2 .]" 1
755 1 58 GLU HA 1 61 LYS H . . 5.200 4.035 3.419 4.535 . 0 0 "[ . 1 . 2 .]" 1
756 1 58 GLU HA 1 61 LYS HB2 . . 6.100 4.968 2.627 6.119 0.019 19 0 "[ . 1 . 2 .]" 1
757 1 58 GLU HA 1 61 LYS HB3 . . 6.100 4.831 4.105 5.610 . 0 0 "[ . 1 . 2 .]" 1
758 1 58 GLU HA 1 61 LYS QD . . 5.380 2.478 1.912 3.900 . 0 0 "[ . 1 . 2 .]" 1
759 1 58 GLU QB 1 82 GLU QB . . 6.100 4.271 2.842 4.918 . 0 0 "[ . 1 . 2 .]" 1
760 1 59 LYS H 1 59 LYS HD2 . . 6.100 5.523 4.834 5.876 . 0 0 "[ . 1 . 2 .]" 1
761 1 59 LYS H 1 59 LYS QD . . 5.740 4.289 3.585 4.616 . 0 0 "[ . 1 . 2 .]" 1
762 1 59 LYS H 1 59 LYS HD3 . . 6.100 4.498 3.680 5.401 . 0 0 "[ . 1 . 2 .]" 1
763 1 59 LYS H 1 59 LYS QE . . 7.000 4.969 4.224 5.493 . 0 0 "[ . 1 . 2 .]" 1
764 1 59 LYS H 1 60 MET H . . 5.100 2.655 2.344 2.809 . 0 0 "[ . 1 . 2 .]" 1
765 1 59 LYS H 1 61 LYS H . . 4.300 4.324 4.192 4.387 0.087 14 0 "[ . 1 . 2 .]" 1
766 1 59 LYS H 1 82 GLU QB . . 5.400 4.681 4.259 4.899 . 0 0 "[ . 1 . 2 .]" 1
767 1 59 LYS HA 1 60 MET HA . . 5.200 4.885 4.795 4.938 . 0 0 "[ . 1 . 2 .]" 1
768 1 59 LYS HA 1 62 SER H . . 5.400 3.484 2.873 3.996 . 0 0 "[ . 1 . 2 .]" 1
769 1 59 LYS HA 1 62 SER QB . . 7.000 2.514 2.179 3.405 . 0 0 "[ . 1 . 2 .]" 1
770 1 59 LYS HA 1 79 LEU HG . . 4.900 4.111 3.459 4.633 . 0 0 "[ . 1 . 2 .]" 1
771 1 59 LYS HB2 1 60 MET H . . 5.300 3.391 2.444 3.968 . 0 0 "[ . 1 . 2 .]" 1
772 1 59 LYS HB2 1 63 LEU QD . . 6.600 4.294 3.568 4.908 . 0 0 "[ . 1 . 2 .]" 1
773 1 59 LYS HB3 1 60 MET H . . 5.700 2.751 2.436 3.599 . 0 0 "[ . 1 . 2 .]" 1
774 1 59 LYS QD 1 79 LEU HA . . 6.980 2.428 2.168 3.187 . 0 0 "[ . 1 . 2 .]" 1
775 1 59 LYS QD 1 79 LEU HG . . 3.280 2.365 2.105 2.943 . 0 0 "[ . 1 . 2 .]" 1
776 1 59 LYS QD 1 82 GLU H . . 4.780 4.125 3.802 4.431 . 0 0 "[ . 1 . 2 .]" 1
777 1 59 LYS QD 1 83 LEU H . . 4.580 3.630 3.106 4.096 . 0 0 "[ . 1 . 2 .]" 1
778 1 59 LYS QD 1 83 LEU HA . . 6.780 4.726 3.798 5.554 . 0 0 "[ . 1 . 2 .]" 1
779 1 59 LYS QD 1 83 LEU QD . . 8.750 3.779 2.202 4.881 . 0 0 "[ . 1 . 2 .]" 1
780 1 59 LYS HD2 1 80 ILE HA . . 5.400 4.736 4.430 5.187 . 0 0 "[ . 1 . 2 .]" 1
781 1 59 LYS HD3 1 80 ILE HA . . 5.400 5.232 4.040 5.565 0.165 1 0 "[ . 1 . 2 .]" 1
782 1 59 LYS QE 1 79 LEU QB . . 4.100 3.328 3.255 3.384 . 0 0 "[ . 1 . 2 .]" 1
783 1 59 LYS QE 1 79 LEU QD . . 10.500 3.972 3.307 4.225 . 0 0 "[ . 1 . 2 .]" 1
784 1 59 LYS HG2 1 60 MET H . . 4.700 4.552 4.067 4.808 0.108 8 0 "[ . 1 . 2 .]" 1
785 1 59 LYS HG2 1 79 LEU QD . . 7.000 3.191 2.334 3.660 . 0 0 "[ . 1 . 2 .]" 1
786 1 59 LYS HG2 1 79 LEU HG . . 2.900 2.745 2.136 3.032 0.132 13 0 "[ . 1 . 2 .]" 1
787 1 60 MET H 1 61 LYS H . . 4.800 2.909 2.687 3.162 . 0 0 "[ . 1 . 2 .]" 1
788 1 60 MET H 1 61 LYS QG . . 6.180 4.590 4.035 5.575 . 0 0 "[ . 1 . 2 .]" 1
789 1 60 MET H 1 62 SER H . . 6.100 4.303 4.006 4.636 . 0 0 "[ . 1 . 2 .]" 1
790 1 60 MET H 1 63 LEU QD . . 6.600 3.823 3.364 4.549 . 0 0 "[ . 1 . 2 .]" 1
791 1 60 MET HA 1 62 SER H . . 5.100 4.683 4.350 5.005 . 0 0 "[ . 1 . 2 .]" 1
792 1 60 MET HA 1 63 LEU H . . 5.900 3.485 3.201 3.676 . 0 0 "[ . 1 . 2 .]" 1
793 1 60 MET HA 1 63 LEU HB2 . . 6.100 2.999 2.427 5.238 . 0 0 "[ . 1 . 2 .]" 1
794 1 60 MET HA 1 63 LEU QD . . 7.100 2.431 2.012 2.837 . 0 0 "[ . 1 . 2 .]" 1
795 1 60 MET HA 1 64 ASP H . . 6.100 3.948 3.801 4.046 . 0 0 "[ . 1 . 2 .]" 1
796 1 60 MET QG 1 61 LYS H . . 5.000 3.715 3.444 4.462 . 0 0 "[ . 1 . 2 .]" 1
797 1 61 LYS H 1 61 LYS HB3 . . 4.100 2.864 2.336 3.709 . 0 0 "[ . 1 . 2 .]" 1
798 1 61 LYS H 1 61 LYS HD2 . . 6.100 3.723 2.071 4.728 . 0 0 "[ . 1 . 2 .]" 1
799 1 61 LYS H 1 61 LYS HD3 . . 6.100 3.982 2.115 4.805 . 0 0 "[ . 1 . 2 .]" 1
800 1 61 LYS H 1 61 LYS QE . . 7.000 4.148 3.050 5.156 . 0 0 "[ . 1 . 2 .]" 1
801 1 61 LYS H 1 62 SER H . . 4.800 2.731 2.442 2.969 . 0 0 "[ . 1 . 2 .]" 1
802 1 61 LYS H 1 63 LEU H . . 6.100 4.192 3.918 4.438 . 0 0 "[ . 1 . 2 .]" 1
803 1 61 LYS HA 1 62 SER QB . . 6.300 5.397 5.193 5.594 . 0 0 "[ . 1 . 2 .]" 1
804 1 61 LYS HA 1 63 LEU H . . 6.100 4.303 3.934 4.620 . 0 0 "[ . 1 . 2 .]" 1
805 1 61 LYS HA 1 64 ASP H . . 6.000 3.266 2.949 3.643 . 0 0 "[ . 1 . 2 .]" 1
806 1 61 LYS HA 1 64 ASP HB2 . . 6.100 3.068 2.472 3.548 . 0 0 "[ . 1 . 2 .]" 1
807 1 61 LYS HA 1 64 ASP HB3 . . 6.100 2.344 2.181 2.674 . 0 0 "[ . 1 . 2 .]" 1
808 1 61 LYS HA 1 65 VAL H . . 5.600 3.821 3.477 4.219 . 0 0 "[ . 1 . 2 .]" 1
809 1 61 LYS HB2 1 62 SER H . . 4.800 3.423 2.155 4.166 . 0 0 "[ . 1 . 2 .]" 1
810 1 61 LYS HB3 1 62 SER H . . 4.800 3.805 3.088 4.266 . 0 0 "[ . 1 . 2 .]" 1
811 1 61 LYS QD 1 62 SER H . . 4.260 3.832 3.623 3.943 . 0 0 "[ . 1 . 2 .]" 1
812 1 61 LYS HD2 1 62 SER H . . 4.500 4.286 3.799 4.582 0.082 19 0 "[ . 1 . 2 .]" 1
813 1 61 LYS HD3 1 62 SER H . . 4.500 4.379 3.877 4.573 0.073 18 0 "[ . 1 . 2 .]" 1
814 1 62 SER H 1 63 LEU H . . 4.300 2.933 2.603 3.121 . 0 0 "[ . 1 . 2 .]" 1
815 1 62 SER H 1 63 LEU QD . . 6.800 4.152 3.704 5.116 . 0 0 "[ . 1 . 2 .]" 1
816 1 62 SER H 1 64 ASP H . . 4.400 4.404 4.267 4.462 0.062 19 0 "[ . 1 . 2 .]" 1
817 1 62 SER H 1 65 VAL QG . . 6.960 4.357 3.964 4.674 . 0 0 "[ . 1 . 2 .]" 1
818 1 62 SER HA 1 64 ASP H . . 6.100 4.805 4.602 5.066 . 0 0 "[ . 1 . 2 .]" 1
819 1 62 SER HA 1 65 VAL H . . 6.100 3.915 3.286 4.269 . 0 0 "[ . 1 . 2 .]" 1
820 1 62 SER HA 1 65 VAL HB . . 6.100 3.907 2.689 5.673 . 0 0 "[ . 1 . 2 .]" 1
821 1 62 SER HA 1 65 VAL QG . . 7.660 2.802 2.457 3.377 . 0 0 "[ . 1 . 2 .]" 1
822 1 62 SER QB 1 79 LEU QD . . 10.500 3.373 2.993 3.924 . 0 0 "[ . 1 . 2 .]" 1
823 1 63 LEU H 1 63 LEU HG . . 5.600 4.168 3.943 4.548 . 0 0 "[ . 1 . 2 .]" 1
824 1 63 LEU H 1 64 ASP H . . 4.800 2.675 2.506 2.860 . 0 0 "[ . 1 . 2 .]" 1
825 1 63 LEU H 1 65 VAL H . . 6.100 4.347 4.192 4.558 . 0 0 "[ . 1 . 2 .]" 1
826 1 63 LEU HA 1 65 VAL H . . 4.500 4.536 4.481 4.597 0.097 2 0 "[ . 1 . 2 .]" 1
827 1 63 LEU HA 1 66 ASN H . . 6.100 4.186 3.788 4.784 . 0 0 "[ . 1 . 2 .]" 1
828 1 63 LEU HA 1 67 GLN HA . . 6.100 3.099 2.310 4.130 . 0 0 "[ . 1 . 2 .]" 1
829 1 63 LEU HB2 1 64 ASP H . . 5.400 2.653 2.402 3.816 . 0 0 "[ . 1 . 2 .]" 1
830 1 63 LEU HB3 1 64 ASP H . . 5.400 3.313 2.396 4.322 . 0 0 "[ . 1 . 2 .]" 1
831 1 63 LEU QD 1 64 ASP H . . 5.900 3.652 2.267 3.841 . 0 0 "[ . 1 . 2 .]" 1
832 1 64 ASP H 1 65 VAL H . . 4.700 2.974 2.804 3.080 . 0 0 "[ . 1 . 2 .]" 1
833 1 64 ASP HA 1 65 VAL H . . 3.600 3.554 3.505 3.610 0.010 22 0 "[ . 1 . 2 .]" 1
834 1 64 ASP HA 1 66 ASN H . . 5.900 4.904 4.454 5.258 . 0 0 "[ . 1 . 2 .]" 1
835 1 64 ASP HA 1 67 GLN QB . . 6.980 3.910 2.327 4.663 . 0 0 "[ . 1 . 2 .]" 1
836 1 64 ASP HB2 1 65 VAL H . . 5.800 3.836 3.749 3.933 . 0 0 "[ . 1 . 2 .]" 1
837 1 64 ASP HB3 1 65 VAL H . . 5.800 2.499 2.378 2.630 . 0 0 "[ . 1 . 2 .]" 1
838 1 65 VAL H 1 65 VAL QG . . 4.240 2.112 1.890 2.339 . 0 0 "[ . 1 . 2 .]" 1
839 1 65 VAL H 1 66 ASN H . . 5.600 3.080 2.843 3.294 . 0 0 "[ . 1 . 2 .]" 1
840 1 65 VAL H 1 67 GLN H . . 6.100 4.525 4.314 4.760 . 0 0 "[ . 1 . 2 .]" 1
841 1 65 VAL HB 1 66 ASN H . . 5.600 2.923 2.186 4.065 . 0 0 "[ . 1 . 2 .]" 1
842 1 65 VAL QG 1 66 ASN H . . 3.660 2.412 1.942 2.738 . 0 0 "[ . 1 . 2 .]" 1
843 1 65 VAL MG1 1 66 ASN H . . 4.400 2.802 2.148 3.830 . 0 0 "[ . 1 . 2 .]" 1
844 1 65 VAL MG2 1 66 ASN H . . 4.400 3.401 1.948 3.805 . 0 0 "[ . 1 . 2 .]" 1
845 1 66 ASN H 1 66 ASN HD21 . . 6.100 4.368 3.103 5.305 . 0 0 "[ . 1 . 2 .]" 1
846 1 66 ASN H 1 66 ASN HD22 . . 6.100 5.371 4.556 6.103 0.003 22 0 "[ . 1 . 2 .]" 1
847 1 66 ASN H 1 67 GLN H . . 3.600 2.711 2.430 2.977 . 0 0 "[ . 1 . 2 .]" 1
848 1 66 ASN H 1 67 GLN HA . . 4.200 3.991 3.629 4.228 0.028 16 0 "[ . 1 . 2 .]" 1
849 1 66 ASN H 1 69 SER QB . . 7.000 5.447 4.889 6.079 . 0 0 "[ . 1 . 2 .]" 1
850 1 66 ASN HA 1 69 SER H . . 5.500 4.316 3.862 4.765 . 0 0 "[ . 1 . 2 .]" 1
851 1 66 ASN QB 1 69 SER H . . 7.000 3.347 2.915 3.983 . 0 0 "[ . 1 . 2 .]" 1
852 1 66 ASN QB 1 70 GLU H . . 7.000 6.163 5.216 6.316 . 0 0 "[ . 1 . 2 .]" 1
853 1 67 GLN H 1 67 GLN HE21 . . 6.100 2.964 1.995 4.800 . 0 0 "[ . 1 . 2 .]" 1
854 1 67 GLN H 1 67 GLN HE22 . . 6.100 3.674 2.548 5.780 . 0 0 "[ . 1 . 2 .]" 1
855 1 67 GLN H 1 68 ASP H . . 5.000 2.952 2.756 3.260 . 0 0 "[ . 1 . 2 .]" 1
856 1 67 GLN H 1 69 SER H . . 4.800 4.528 4.368 4.840 0.040 16 0 "[ . 1 . 2 .]" 1
857 1 67 GLN HA 1 67 GLN HE21 . . 6.100 4.681 3.691 5.525 . 0 0 "[ . 1 . 2 .]" 1
858 1 67 GLN HA 1 67 GLN HE22 . . 6.100 5.447 4.952 6.241 0.141 6 0 "[ . 1 . 2 .]" 1
859 1 67 GLN HA 1 69 SER H . . 6.100 3.778 3.543 4.088 . 0 0 "[ . 1 . 2 .]" 1
860 1 67 GLN QB 1 69 SER H . . 6.980 4.776 4.543 5.056 . 0 0 "[ . 1 . 2 .]" 1
861 1 67 GLN HB2 1 68 ASP H . . 5.300 3.748 3.394 4.021 . 0 0 "[ . 1 . 2 .]" 1
862 1 67 GLN HB3 1 68 ASP H . . 5.300 4.181 4.000 4.399 . 0 0 "[ . 1 . 2 .]" 1
863 1 67 GLN QE 1 68 ASP H . . 4.370 3.029 2.199 3.954 . 0 0 "[ . 1 . 2 .]" 1
864 1 67 GLN HG2 1 68 ASP H . . 4.000 2.849 2.082 4.102 0.102 3 0 "[ . 1 . 2 .]" 1
865 1 67 GLN HG3 1 68 ASP H . . 4.000 3.492 2.134 4.050 0.050 14 0 "[ . 1 . 2 .]" 1
866 1 68 ASP H 1 69 SER H . . 4.700 2.777 2.618 2.993 . 0 0 "[ . 1 . 2 .]" 1
867 1 68 ASP H 1 69 SER HA . . 6.100 5.300 5.147 5.450 . 0 0 "[ . 1 . 2 .]" 1
868 1 68 ASP HA 1 69 SER HA . . 6.100 4.842 4.616 5.092 . 0 0 "[ . 1 . 2 .]" 1
869 1 68 ASP HA 1 69 SER QB . . 7.000 5.261 4.856 5.530 . 0 0 "[ . 1 . 2 .]" 1
870 1 68 ASP HB2 1 69 SER H . . 6.100 3.928 3.011 4.566 . 0 0 "[ . 1 . 2 .]" 1
871 1 68 ASP HB3 1 69 SER H . . 6.100 3.423 2.681 4.566 . 0 0 "[ . 1 . 2 .]" 1
872 1 69 SER H 1 70 GLU H . . 5.400 4.087 2.716 4.699 . 0 0 "[ . 1 . 2 .]" 1
873 1 69 SER HA 1 70 GLU QB . . 7.000 4.442 3.941 5.038 . 0 0 "[ . 1 . 2 .]" 1
874 1 69 SER HA 1 70 GLU QG . . 6.380 4.456 3.167 5.761 . 0 0 "[ . 1 . 2 .]" 1
875 1 69 SER QB 1 70 GLU HA . . 7.000 4.556 4.006 5.205 . 0 0 "[ . 1 . 2 .]" 1
876 1 70 GLU H 1 71 LEU H . . 5.900 4.412 4.048 4.634 . 0 0 "[ . 1 . 2 .]" 1
877 1 70 GLU QB 1 71 LEU HA . . 7.000 4.279 3.203 5.045 . 0 0 "[ . 1 . 2 .]" 1
878 1 70 GLU HG2 1 71 LEU H . . 4.400 3.698 2.273 4.501 0.101 23 0 "[ . 1 . 2 .]" 1
879 1 70 GLU HG3 1 71 LEU H . . 4.400 4.072 2.397 4.582 0.182 19 0 "[ . 1 . 2 .]" 1
880 1 71 LEU H 1 72 LYS H . . 6.100 4.467 4.311 4.596 . 0 0 "[ . 1 . 2 .]" 1
881 1 71 LEU HA 1 75 GLU H . . 6.100 5.472 4.792 5.878 . 0 0 "[ . 1 . 2 .]" 1
882 1 71 LEU HA 1 75 GLU QB . . 7.000 3.375 2.618 4.042 . 0 0 "[ . 1 . 2 .]" 1
883 1 71 LEU HB3 1 72 LYS H . . 6.100 3.316 2.122 4.153 . 0 0 "[ . 1 . 2 .]" 1
884 1 71 LEU QD 1 72 LYS H . . 6.500 2.899 2.042 3.526 . 0 0 "[ . 1 . 2 .]" 1
885 1 71 LEU QD 1 75 GLU H . . 7.300 4.339 3.702 5.248 . 0 0 "[ . 1 . 2 .]" 1
886 1 72 LYS H 1 72 LYS QE . . 7.000 4.658 2.523 5.825 . 0 0 "[ . 1 . 2 .]" 1
887 1 72 LYS H 1 73 PHE H . . 6.100 4.354 4.253 4.553 . 0 0 "[ . 1 . 2 .]" 1
888 1 72 LYS H 1 75 GLU H . . 6.100 3.412 2.819 3.884 . 0 0 "[ . 1 . 2 .]" 1
889 1 72 LYS H 1 75 GLU HA . . 6.100 5.156 4.524 5.721 . 0 0 "[ . 1 . 2 .]" 1
890 1 72 LYS H 1 75 GLU QB . . 7.000 2.352 1.799 3.010 . 0 0 "[ . 1 . 2 .]" 1
891 1 72 LYS H 1 75 GLU QG . . 5.600 3.696 2.521 4.945 . 0 0 "[ . 1 . 2 .]" 1
892 1 72 LYS HA 1 74 ASN H . . 6.100 4.669 4.448 5.061 . 0 0 "[ . 1 . 2 .]" 1
893 1 72 LYS QB 1 73 PHE H . . 7.000 2.522 2.248 2.845 . 0 0 "[ . 1 . 2 .]" 1
894 1 72 LYS QB 1 74 ASN H . . 7.000 3.148 2.858 3.919 . 0 0 "[ . 1 . 2 .]" 1
895 1 72 LYS QB 1 75 GLU H . . 7.000 3.232 2.577 3.658 . 0 0 "[ . 1 . 2 .]" 1
896 1 73 PHE H 1 74 ASN H . . 5.900 3.100 2.854 3.362 . 0 0 "[ . 1 . 2 .]" 1
897 1 73 PHE H 1 75 GLU H . . 6.100 4.602 4.290 5.055 . 0 0 "[ . 1 . 2 .]" 1
898 1 74 ASN H 1 74 ASN HD21 . . 6.100 3.956 1.973 4.951 . 0 0 "[ . 1 . 2 .]" 1
899 1 74 ASN H 1 74 ASN HD22 . . 6.100 4.646 2.980 5.912 . 0 0 "[ . 1 . 2 .]" 1
900 1 74 ASN H 1 75 GLU H . . 5.400 2.803 2.565 3.058 . 0 0 "[ . 1 . 2 .]" 1
901 1 74 ASN HA 1 77 TRP H . . 6.100 3.566 3.085 4.126 . 0 0 "[ . 1 . 2 .]" 1
902 1 74 ASN HA 1 77 TRP QB . . 7.000 2.519 2.126 3.275 . 0 0 "[ . 1 . 2 .]" 1
903 1 74 ASN HA 2 81 GLY HA2 . . 5.800 3.624 3.028 4.468 . 0 0 "[ . 1 . 2 .]" 1
904 1 74 ASN HA 2 84 ALA MB . . 6.000 4.000 3.415 4.640 . 0 0 "[ . 1 . 2 .]" 1
905 1 74 ASN HA 2 85 LYS QG . . 5.600 4.629 3.906 5.037 . 0 0 "[ . 1 . 2 .]" 1
906 1 74 ASN QB 2 82 GLU HA . . 6.700 3.710 2.720 4.866 . 0 0 "[ . 1 . 2 .]" 1
907 1 74 ASN QB 2 85 LYS QB . . 7.500 3.040 2.094 4.989 . 0 0 "[ . 1 . 2 .]" 1
908 1 74 ASN QB 2 85 LYS QE . . 5.300 3.165 2.010 4.237 . 0 0 "[ . 1 . 2 .]" 1
909 1 75 GLU H 1 77 TRP H . . 6.100 3.969 3.649 4.458 . 0 0 "[ . 1 . 2 .]" 1
910 1 75 GLU H 1 78 ARG QG . . 5.800 4.746 4.021 5.195 . 0 0 "[ . 1 . 2 .]" 1
911 1 75 GLU HA 1 77 TRP H . . 6.100 4.378 3.982 4.682 . 0 0 "[ . 1 . 2 .]" 1
912 1 75 GLU HA 1 78 ARG H . . 5.000 3.826 3.093 4.736 . 0 0 "[ . 1 . 2 .]" 1
913 1 75 GLU HA 1 78 ARG QB . . 7.000 3.888 2.496 5.253 . 0 0 "[ . 1 . 2 .]" 1
914 1 75 GLU HA 1 78 ARG QG . . 6.000 2.614 2.149 3.705 . 0 0 "[ . 1 . 2 .]" 1
915 1 75 GLU HA 1 79 LEU QB . . 7.000 5.143 4.697 5.865 . 0 0 "[ . 1 . 2 .]" 1
916 1 77 TRP H 1 77 TRP HE3 . . 6.100 3.568 3.212 3.994 . 0 0 "[ . 1 . 2 .]" 1
917 1 77 TRP H 1 78 ARG H . . 5.500 3.389 3.208 3.726 . 0 0 "[ . 1 . 2 .]" 1
918 1 77 TRP HA 1 77 TRP HE1 . . 6.100 4.807 4.696 4.921 . 0 0 "[ . 1 . 2 .]" 1
919 1 77 TRP HA 1 77 TRP HZ2 . . 6.500 6.125 6.016 6.187 . 0 0 "[ . 1 . 2 .]" 1
920 1 77 TRP HA 1 77 TRP HZ3 . . 6.100 5.866 5.624 6.065 . 0 0 "[ . 1 . 2 .]" 1
921 1 77 TRP HA 1 80 ILE H . . 5.900 3.619 3.472 3.762 . 0 0 "[ . 1 . 2 .]" 1
922 1 77 TRP HA 1 80 ILE HB . . 6.100 5.507 5.203 5.914 . 0 0 "[ . 1 . 2 .]" 1
923 1 77 TRP HA 1 80 ILE MD . . 5.900 3.422 3.031 3.815 . 0 0 "[ . 1 . 2 .]" 1
924 1 77 TRP HA 1 80 ILE MG . . 5.600 3.513 3.020 4.002 . 0 0 "[ . 1 . 2 .]" 1
925 1 77 TRP HA 1 81 GLY H . . 6.100 4.111 3.834 4.659 . 0 0 "[ . 1 . 2 .]" 1
926 1 77 TRP QB 1 78 ARG H . . 6.900 2.030 1.928 2.176 . 0 0 "[ . 1 . 2 .]" 1
927 1 77 TRP QB 2 80 ILE MG . . 8.500 6.385 6.314 6.458 . 0 0 "[ . 1 . 2 .]" 1
928 1 77 TRP QB 2 81 GLY H . . 6.600 3.755 3.511 3.955 . 0 0 "[ . 1 . 2 .]" 1
929 1 77 TRP HD1 1 78 ARG H . . 4.900 3.798 3.349 4.138 . 0 0 "[ . 1 . 2 .]" 1
930 1 77 TRP HD1 1 78 ARG HA . . 6.100 3.978 3.473 4.337 . 0 0 "[ . 1 . 2 .]" 1
931 1 77 TRP HD1 1 78 ARG QB . . 7.000 5.065 4.249 5.875 . 0 0 "[ . 1 . 2 .]" 1
932 1 77 TRP HD1 1 78 ARG QD . . 7.300 6.421 5.567 6.702 . 0 0 "[ . 1 . 2 .]" 1
933 1 77 TRP HD1 2 77 TRP QB . . 6.700 3.573 2.993 4.000 . 0 0 "[ . 1 . 2 .]" 1
934 1 77 TRP HD1 2 78 ARG H . . 4.400 4.140 3.723 4.434 0.034 25 0 "[ . 1 . 2 .]" 1
935 1 77 TRP HD1 2 78 ARG HA . . 5.800 3.333 2.861 3.841 . 0 0 "[ . 1 . 2 .]" 1
936 1 77 TRP HD1 2 81 GLY H . . 3.700 2.912 2.718 3.173 . 0 0 "[ . 1 . 2 .]" 1
937 1 77 TRP HE1 2 80 ILE H . . 4.900 4.469 4.216 4.685 . 0 0 "[ . 1 . 2 .]" 1
938 1 77 TRP HE1 2 81 GLY H . . 3.500 3.472 3.185 3.552 0.052 24 0 "[ . 1 . 2 .]" 1
939 1 77 TRP HE3 1 80 ILE MG . . 7.500 6.080 5.761 6.280 . 0 0 "[ . 1 . 2 .]" 1
940 1 77 TRP HZ2 1 80 ILE MD . . 7.200 5.376 5.049 5.588 . 0 0 "[ . 1 . 2 .]" 1
941 1 77 TRP HZ2 2 80 ILE MD . . 6.700 2.127 2.064 2.212 . 0 0 "[ . 1 . 2 .]" 1
942 1 77 TRP HZ3 2 84 ALA H . . 5.400 5.662 5.242 6.298 0.898 25 2 "[ . - . 2 +]" 1
943 1 78 ARG H 1 79 LEU H . . 6.100 3.123 2.922 3.345 . 0 0 "[ . 1 . 2 .]" 1
944 1 78 ARG H 1 80 ILE H . . 5.500 4.696 4.509 4.943 . 0 0 "[ . 1 . 2 .]" 1
945 1 78 ARG H 2 78 ARG HA . . 3.200 3.312 3.270 3.359 0.159 16 0 "[ . 1 . 2 .]" 1
946 1 78 ARG HA 1 82 GLU H . . 6.100 4.155 3.601 5.129 . 0 0 "[ . 1 . 2 .]" 1
947 1 78 ARG HA 2 78 ARG H . . 3.200 3.312 3.248 3.398 0.198 22 0 "[ . 1 . 2 .]" 1
948 1 78 ARG HA 2 78 ARG QB . . 6.300 3.332 2.348 4.297 . 0 0 "[ . 1 . 2 .]" 1
949 1 78 ARG QB 2 78 ARG HA . . 6.300 3.052 2.211 4.338 . 0 0 "[ . 1 . 2 .]" 1
950 1 79 LEU H 1 80 ILE H . . 4.600 2.938 2.679 3.086 . 0 0 "[ . 1 . 2 .]" 1
951 1 79 LEU H 1 81 GLY H . . 6.100 4.026 3.831 4.186 . 0 0 "[ . 1 . 2 .]" 1
952 1 79 LEU QD 1 81 GLY H . . 7.400 5.119 4.919 5.377 . 0 0 "[ . 1 . 2 .]" 1
953 1 80 ILE H 1 80 ILE MD . . 5.000 4.069 3.883 4.182 . 0 0 "[ . 1 . 2 .]" 1
954 1 80 ILE H 1 81 GLY H . . 5.500 2.527 2.398 2.652 . 0 0 "[ . 1 . 2 .]" 1
955 1 80 ILE H 1 83 LEU H . . 6.100 4.653 4.398 4.971 . 0 0 "[ . 1 . 2 .]" 1
956 1 80 ILE H 2 77 TRP HE1 . . 4.900 4.497 4.190 4.751 . 0 0 "[ . 1 . 2 .]" 1
957 1 80 ILE HA 1 82 GLU H . . 6.100 4.258 3.798 4.625 . 0 0 "[ . 1 . 2 .]" 1
958 1 80 ILE HA 1 83 LEU H . . 6.100 2.821 2.435 3.215 . 0 0 "[ . 1 . 2 .]" 1
959 1 80 ILE HA 1 83 LEU QD . . 7.970 2.958 2.141 3.880 . 0 0 "[ . 1 . 2 .]" 1
960 1 80 ILE HA 1 84 ALA H . . 6.100 3.989 3.561 4.824 . 0 0 "[ . 1 . 2 .]" 1
961 1 80 ILE HB 1 81 GLY H . . 5.600 4.196 3.970 4.379 . 0 0 "[ . 1 . 2 .]" 1
962 1 80 ILE HB 1 83 LEU H . . 5.600 4.731 4.369 4.974 . 0 0 "[ . 1 . 2 .]" 1
963 1 80 ILE HB 2 13 ILE QG . . 6.000 3.372 2.678 4.473 . 0 0 "[ . 1 . 2 .]" 1
964 1 80 ILE HB 2 13 ILE MG . . 5.600 4.382 3.836 4.723 . 0 0 "[ . 1 . 2 .]" 1
965 1 80 ILE MD 2 13 ILE QG . . 5.600 2.285 1.967 4.012 . 0 0 "[ . 1 . 2 .]" 1
966 1 80 ILE MD 2 13 ILE MG . . 5.500 3.794 3.334 3.864 . 0 0 "[ . 1 . 2 .]" 1
967 1 80 ILE MD 2 77 TRP HZ2 . . 6.700 2.149 2.038 2.286 . 0 0 "[ . 1 . 2 .]" 1
968 1 80 ILE MG 1 81 GLY H . . 4.700 3.864 3.667 3.963 . 0 0 "[ . 1 . 2 .]" 1
969 1 80 ILE MG 2 77 TRP QB . . 8.500 6.371 6.313 6.427 . 0 0 "[ . 1 . 2 .]" 1
970 1 81 GLY H 1 82 GLU H . . 4.300 2.876 2.533 3.173 . 0 0 "[ . 1 . 2 .]" 1
971 1 81 GLY H 2 77 TRP QB . . 6.600 3.709 3.517 3.891 . 0 0 "[ . 1 . 2 .]" 1
972 1 81 GLY H 2 77 TRP HE1 . . 3.500 3.479 3.239 3.573 0.073 23 0 "[ . 1 . 2 .]" 1
973 1 81 GLY HA2 1 84 ALA H . . 6.100 3.532 3.224 3.943 . 0 0 "[ . 1 . 2 .]" 1
974 1 81 GLY HA2 2 74 ASN HA . . 5.800 3.592 2.974 4.265 . 0 0 "[ . 1 . 2 .]" 1
975 1 82 GLU H 1 83 LEU H . . 5.000 2.800 2.312 3.010 . 0 0 "[ . 1 . 2 .]" 1
976 1 82 GLU H 1 84 ALA H . . 6.100 4.419 4.069 4.629 . 0 0 "[ . 1 . 2 .]" 1
977 1 82 GLU HA 1 83 LEU HA . . 6.100 4.814 4.670 4.964 . 0 0 "[ . 1 . 2 .]" 1
978 1 82 GLU HA 1 84 ALA H . . 6.100 4.600 4.090 4.959 . 0 0 "[ . 1 . 2 .]" 1
979 1 82 GLU HA 1 85 LYS H . . 6.100 3.306 2.981 3.606 . 0 0 "[ . 1 . 2 .]" 1
980 1 82 GLU HA 1 85 LYS QB . . 7.000 2.935 2.157 4.491 . 0 0 "[ . 1 . 2 .]" 1
981 1 82 GLU HA 2 74 ASN QB . . 6.700 3.725 2.395 4.569 . 0 0 "[ . 1 . 2 .]" 1
982 1 82 GLU QG 1 83 LEU H . . 5.800 4.210 2.143 4.692 . 0 0 "[ . 1 . 2 .]" 1
983 1 83 LEU H 1 83 LEU MD1 . . 5.000 3.869 2.340 4.257 . 0 0 "[ . 1 . 2 .]" 1
984 1 83 LEU H 1 83 LEU MD2 . . 5.000 3.814 2.958 4.242 . 0 0 "[ . 1 . 2 .]" 1
985 1 83 LEU H 1 84 ALA H . . 5.200 2.999 2.672 3.185 . 0 0 "[ . 1 . 2 .]" 1
986 1 83 LEU H 1 86 GLU H . . 6.100 4.701 4.444 4.877 . 0 0 "[ . 1 . 2 .]" 1
987 1 83 LEU HA 1 86 GLU H . . 6.100 3.240 2.842 3.605 . 0 0 "[ . 1 . 2 .]" 1
988 1 83 LEU QD 1 84 ALA H . . 5.870 3.724 2.925 4.201 . 0 0 "[ . 1 . 2 .]" 1
989 1 84 ALA H 1 84 ALA MB . . 3.200 2.213 2.157 2.262 . 0 0 "[ . 1 . 2 .]" 1
990 1 84 ALA H 1 85 LYS H . . 5.400 2.936 2.711 3.149 . 0 0 "[ . 1 . 2 .]" 1
991 1 84 ALA H 1 86 GLU H . . 6.100 4.405 4.221 4.755 . 0 0 "[ . 1 . 2 .]" 1
992 1 84 ALA H 2 77 TRP HZ3 . . 5.400 5.630 5.172 6.186 0.786 7 3 "[ .-+ 1 . 2 * .]" 1
993 1 84 ALA HA 1 86 GLU H . . 6.100 4.638 4.299 5.105 . 0 0 "[ . 1 . 2 .]" 1
994 1 84 ALA HA 1 87 ILE H . . 6.100 4.118 3.751 4.633 . 0 0 "[ . 1 . 2 .]" 1
995 1 84 ALA HA 1 87 ILE HB . . 6.100 5.639 3.938 6.146 0.046 17 0 "[ . 1 . 2 .]" 1
996 1 84 ALA MB 1 85 LYS H . . 4.000 2.737 2.538 3.168 . 0 0 "[ . 1 . 2 .]" 1
997 1 84 ALA MB 2 13 ILE MG . . 4.500 2.404 1.943 3.154 . 0 0 "[ . 1 . 2 .]" 1
998 1 84 ALA MB 2 74 ASN HA . . 6.000 4.130 3.649 4.608 . 0 0 "[ . 1 . 2 .]" 1
999 1 85 LYS H 1 85 LYS QE . . 7.000 5.424 4.023 6.123 . 0 0 "[ . 1 . 2 .]" 1
1000 1 85 LYS H 1 86 GLU H . . 5.400 2.514 2.281 2.814 . 0 0 "[ . 1 . 2 .]" 1
1001 1 85 LYS H 1 86 GLU QG . . 6.600 4.788 3.669 5.884 . 0 0 "[ . 1 . 2 .]" 1
1002 1 85 LYS HA 1 88 ARG H . . 6.700 5.714 4.978 6.504 . 0 0 "[ . 1 . 2 .]" 1
1003 1 85 LYS QB 2 74 ASN QB . . 7.500 2.938 1.989 4.315 . 0 0 "[ . 1 . 2 .]" 1
1004 1 85 LYS QD 1 86 GLU H . . 5.100 3.793 2.412 4.617 . 0 0 "[ . 1 . 2 .]" 1
1005 1 85 LYS QE 2 74 ASN QB . . 5.300 3.663 2.398 4.270 . 0 0 "[ . 1 . 2 .]" 1
1006 1 85 LYS QG 2 74 ASN HA . . 5.600 4.678 3.667 5.056 . 0 0 "[ . 1 . 2 .]" 1
1007 1 86 GLU H 1 87 ILE H . . 4.800 3.111 2.934 3.319 . 0 0 "[ . 1 . 2 .]" 1
1008 1 86 GLU HA 1 88 ARG H . . 6.100 4.864 4.238 5.521 . 0 0 "[ . 1 . 2 .]" 1
1009 1 87 ILE H 1 87 ILE MD . . 5.300 4.307 4.222 4.549 . 0 0 "[ . 1 . 2 .]" 1
1010 1 87 ILE H 1 87 ILE MG . . 4.800 2.309 1.932 3.712 . 0 0 "[ . 1 . 2 .]" 1
1011 1 87 ILE H 1 88 ARG H . . 5.200 4.095 3.744 4.394 . 0 0 "[ . 1 . 2 .]" 1
1012 1 87 ILE HA 1 89 LYS H . . 6.100 4.684 3.701 5.878 . 0 0 "[ . 1 . 2 .]" 1
1013 1 87 ILE MD 1 88 ARG H . . 4.800 3.071 2.519 4.039 . 0 0 "[ . 1 . 2 .]" 1
1014 1 87 ILE MG 1 89 LYS H . . 5.100 3.762 3.047 4.350 . 0 0 "[ . 1 . 2 .]" 1
1015 1 88 ARG H 1 89 LYS H . . 4.500 3.915 3.533 4.516 0.016 8 0 "[ . 1 . 2 .]" 1
1016 1 89 LYS H 1 89 LYS HD2 . . 6.100 2.682 1.982 4.251 . 0 0 "[ . 1 . 2 .]" 1
1017 1 89 LYS H 1 89 LYS QD . . 5.940 2.429 1.854 3.717 . 0 0 "[ . 1 . 2 .]" 1
1018 1 89 LYS H 1 89 LYS HD3 . . 6.100 3.274 2.071 4.687 . 0 0 "[ . 1 . 2 .]" 1
1019 1 89 LYS H 1 89 LYS QE . . 7.000 3.887 2.469 4.972 . 0 0 "[ . 1 . 2 .]" 1
1020 1 89 LYS HA 1 92 ASP H . . 6.100 5.799 4.797 6.179 0.079 25 0 "[ . 1 . 2 .]" 1
1021 1 89 LYS QB 1 89 LYS QD . . 3.220 2.273 2.062 2.500 . 0 0 "[ . 1 . 2 .]" 1
1022 1 89 LYS QB 1 93 LEU H . . 6.980 4.137 3.084 5.679 . 0 0 "[ . 1 . 2 .]" 1
1023 1 89 LYS QB 1 93 LEU QD . . 7.250 2.672 1.966 3.895 . 0 0 "[ . 1 . 2 .]" 1
1024 1 89 LYS HB2 1 93 LEU HA . . 6.100 5.116 2.920 6.162 0.062 14 0 "[ . 1 . 2 .]" 1
1025 1 89 LYS HB3 1 93 LEU HA . . 6.100 4.500 3.962 5.381 . 0 0 "[ . 1 . 2 .]" 1
1026 1 89 LYS QD 2 17 VAL QG . . 4.580 2.609 1.861 3.204 . 0 0 "[ . 1 . 2 .]" 1
1027 1 89 LYS QE 2 13 ILE MG . . 7.100 2.688 2.031 4.190 . 0 0 "[ . 1 . 2 .]" 1
1028 1 89 LYS QE 2 14 GLU HA . . 5.700 4.003 2.560 5.183 . 0 0 "[ . 1 . 2 .]" 1
1029 1 89 LYS QG 1 93 LEU HA . . 5.250 4.276 2.616 4.712 . 0 0 "[ . 1 . 2 .]" 1
1030 1 89 LYS QG 1 93 LEU HG . . 4.180 3.395 2.352 3.854 . 0 0 "[ . 1 . 2 .]" 1
1031 1 89 LYS HG2 1 93 LEU HA . . 6.100 4.863 3.063 6.141 0.041 9 0 "[ . 1 . 2 .]" 1
1032 1 89 LYS HG3 1 93 LEU HA . . 6.100 5.062 2.839 6.148 0.048 2 0 "[ . 1 . 2 .]" 1
1033 1 92 ASP H 1 93 LEU H . . 3.700 3.543 2.905 3.934 0.234 13 0 "[ . 1 . 2 .]" 1
1034 1 92 ASP H 1 93 LEU HA . . 4.600 4.327 3.613 4.694 0.094 14 0 "[ . 1 . 2 .]" 1
1035 1 92 ASP H 1 93 LEU QB . . 7.000 4.866 3.666 5.599 . 0 0 "[ . 1 . 2 .]" 1
1036 1 92 ASP H 1 95 ILE HB . . 6.100 5.275 4.444 6.290 0.190 16 0 "[ . 1 . 2 .]" 1
1037 1 92 ASP HA 1 95 ILE HB . . 6.100 4.531 2.177 6.196 0.096 16 0 "[ . 1 . 2 .]" 1
1038 1 92 ASP QB 1 95 ILE H . . 7.000 3.744 2.553 4.489 . 0 0 "[ . 1 . 2 .]" 1
1039 1 93 LEU HA 1 96 ARG QB . . 7.200 6.308 4.361 6.576 . 0 0 "[ . 1 . 2 .]" 1
1040 1 93 LEU QD 2 14 GLU QG . . 7.770 3.100 1.911 4.042 . 0 0 "[ . 1 . 2 .]" 1
1041 1 93 LEU QD 2 17 VAL QG . . 5.370 2.875 2.239 3.314 . 0 0 "[ . 1 . 2 .]" 1
1042 1 93 LEU HG 2 14 GLU QG . . 5.500 4.289 3.186 4.957 . 0 0 "[ . 1 . 2 .]" 1
1043 1 94 LYS H 1 94 LYS HD2 . . 6.100 4.388 1.991 5.326 . 0 0 "[ . 1 . 2 .]" 1
1044 1 94 LYS H 1 94 LYS HD3 . . 6.100 4.651 2.437 5.620 . 0 0 "[ . 1 . 2 .]" 1
1045 1 94 LYS H 1 95 ILE H . . 3.900 2.761 2.238 3.196 . 0 0 "[ . 1 . 2 .]" 1
1046 1 94 LYS QB 1 95 ILE H . . 5.900 3.292 2.509 4.155 . 0 0 "[ . 1 . 2 .]" 1
1047 1 94 LYS QB 2 3 ALA H . . 4.500 4.263 2.986 4.513 0.013 12 0 "[ . 1 . 2 .]" 1
1048 1 94 LYS QD 2 4 GLU H . . 5.380 4.644 3.505 5.267 . 0 0 "[ . 1 . 2 .]" 1
1049 1 94 LYS QG 2 3 ALA H . . 5.380 4.498 3.579 4.931 . 0 0 "[ . 1 . 2 .]" 1
1050 1 95 ILE H 1 95 ILE MD . . 4.900 3.802 1.978 4.135 . 0 0 "[ . 1 . 2 .]" 1
1051 1 95 ILE HA 2 4 GLU HB3 . . 5.200 5.184 4.403 5.385 0.185 16 0 "[ . 1 . 2 .]" 1
1052 1 95 ILE HB 1 96 ARG H . . 6.100 3.782 3.022 4.345 . 0 0 "[ . 1 . 2 .]" 1
1053 1 96 ARG H 2 4 GLU QG . . 5.700 4.614 3.312 5.148 . 0 0 "[ . 1 . 2 .]" 1
1054 1 96 ARG HA 2 4 GLU HA . . 5.800 5.536 3.427 6.029 0.229 17 0 "[ . 1 . 2 .]" 1
1055 1 96 ARG HA 2 4 GLU QG . . 6.500 4.405 2.770 5.778 . 0 0 "[ . 1 . 2 .]" 1
1056 1 96 ARG HA 2 5 PRO HD3 . . 5.600 5.607 4.508 5.783 0.183 12 0 "[ . 1 . 2 .]" 1
1057 1 96 ARG QG 2 4 GLU HB2 . . 3.400 2.595 1.998 3.107 . 0 0 "[ . 1 . 2 .]" 1
1058 2 2 ALA H 2 2 ALA MB . . 3.600 2.920 2.340 3.091 . 0 0 "[ . 1 . 2 .]" 1
1059 2 2 ALA H 2 3 ALA H . . 4.800 4.414 4.018 4.855 0.055 7 0 "[ . 1 . 2 .]" 1
1060 2 2 ALA HA 2 3 ALA HA . . 4.900 4.369 2.351 5.167 0.267 15 0 "[ . 1 . 2 .]" 1
1061 2 2 ALA HA 2 4 GLU H . . 4.700 4.085 2.849 4.898 0.198 24 0 "[ . 1 . 2 .]" 1
1062 2 2 ALA HA 2 4 GLU QG . . 6.300 5.161 4.187 5.837 . 0 0 "[ . 1 . 2 .]" 1
1063 2 2 ALA MB 2 6 LEU QD . . 8.370 3.220 1.858 4.591 . 0 0 "[ . 1 . 2 .]" 1
1064 2 3 ALA H 2 4 GLU H . . 6.100 2.994 1.977 4.450 . 0 0 "[ . 1 . 2 .]" 1
1065 2 3 ALA HA 2 4 GLU HA . . 5.400 4.062 2.106 4.866 . 0 0 "[ . 1 . 2 .]" 1
1066 2 4 GLU H 2 6 LEU H . . 6.100 3.388 2.061 4.713 . 0 0 "[ . 1 . 2 .]" 1
1067 2 4 GLU HA 2 6 LEU H . . 6.100 4.296 2.685 5.868 . 0 0 "[ . 1 . 2 .]" 1
1068 2 4 GLU HB3 2 5 PRO HD3 . . 5.100 4.188 2.444 5.158 0.058 18 0 "[ . 1 . 2 .]" 1
1069 2 4 GLU HB3 2 6 LEU H . . 4.800 4.757 4.159 5.063 0.263 12 0 "[ . 1 . 2 .]" 1
1070 2 4 GLU QG 2 6 LEU H . . 5.600 3.001 1.935 5.150 . 0 0 "[ . 1 . 2 .]" 1
1071 2 5 PRO HA 2 6 LEU QB . . 7.000 4.899 4.165 5.435 . 0 0 "[ . 1 . 2 .]" 1
1072 2 6 LEU H 2 6 LEU MD1 . . 5.200 3.371 1.892 4.312 . 0 0 "[ . 1 . 2 .]" 1
1073 2 6 LEU H 2 6 LEU QD . . 4.700 2.607 1.881 3.508 . 0 0 "[ . 1 . 2 .]" 1
1074 2 6 LEU H 2 6 LEU MD2 . . 5.200 3.236 1.923 4.268 . 0 0 "[ . 1 . 2 .]" 1
1075 2 6 LEU H 2 7 THR H . . 6.100 4.465 3.907 4.701 . 0 0 "[ . 1 . 2 .]" 1
1076 2 6 LEU HA 2 7 THR HA . . 6.100 4.500 4.165 4.637 . 0 0 "[ . 1 . 2 .]" 1
1077 2 6 LEU HA 2 10 GLU QB . . 7.000 3.910 2.429 5.514 . 0 0 "[ . 1 . 2 .]" 1
1078 2 6 LEU QB 2 7 THR H . . 7.000 2.631 1.831 4.008 . 0 0 "[ . 1 . 2 .]" 1
1079 2 6 LEU QB 2 11 GLU H . . 5.300 4.271 3.370 4.902 . 0 0 "[ . 1 . 2 .]" 1
1080 2 6 LEU QB 2 11 GLU QB . . 7.800 4.693 3.192 6.127 . 0 0 "[ . 1 . 2 .]" 1
1081 2 6 LEU QD 2 7 THR H . . 6.870 3.160 2.390 4.273 . 0 0 "[ . 1 . 2 .]" 1
1082 2 6 LEU QD 2 11 GLU H . . 5.970 2.938 1.945 3.932 . 0 0 "[ . 1 . 2 .]" 1
1083 2 6 LEU MD1 2 11 GLU QB . . 7.800 3.433 1.958 4.849 . 0 0 "[ . 1 . 2 .]" 1
1084 2 6 LEU MD2 2 11 GLU QB . . 7.800 3.303 1.975 5.359 . 0 0 "[ . 1 . 2 .]" 1
1085 2 7 THR H 2 7 THR MG . . 4.800 3.864 3.437 4.110 . 0 0 "[ . 1 . 2 .]" 1
1086 2 7 THR H 2 8 GLU H . . 6.100 4.442 3.828 4.644 . 0 0 "[ . 1 . 2 .]" 1
1087 2 7 THR H 2 10 GLU H . . 6.100 3.508 3.037 4.325 . 0 0 "[ . 1 . 2 .]" 1
1088 2 7 THR H 2 10 GLU QB . . 7.000 2.758 2.122 4.541 . 0 0 "[ . 1 . 2 .]" 1
1089 2 7 THR H 2 10 GLU QG . . 7.000 3.728 1.834 4.810 . 0 0 "[ . 1 . 2 .]" 1
1090 2 7 THR H 2 11 GLU H . . 6.100 3.910 3.169 4.991 . 0 0 "[ . 1 . 2 .]" 1
1091 2 7 THR H 2 11 GLU QB . . 7.000 4.933 3.885 6.237 . 0 0 "[ . 1 . 2 .]" 1
1092 2 7 THR HA 2 8 GLU HA . . 6.100 4.281 3.851 4.853 . 0 0 "[ . 1 . 2 .]" 1
1093 2 7 THR HA 2 8 GLU QB . . 7.000 4.617 3.722 4.895 . 0 0 "[ . 1 . 2 .]" 1
1094 2 7 THR HA 2 8 GLU QG . . 7.000 4.519 3.214 6.053 . 0 0 "[ . 1 . 2 .]" 1
1095 2 7 THR HA 2 9 LEU H . . 6.100 4.434 2.984 4.850 . 0 0 "[ . 1 . 2 .]" 1
1096 2 7 THR HA 2 10 GLU H . . 6.100 4.781 2.770 5.258 . 0 0 "[ . 1 . 2 .]" 1
1097 2 7 THR HA 2 10 GLU QB . . 7.000 4.867 3.064 6.374 . 0 0 "[ . 1 . 2 .]" 1
1098 2 7 THR HA 2 11 GLU H . . 6.100 4.703 4.312 5.006 . 0 0 "[ . 1 . 2 .]" 1
1099 2 7 THR HB 2 8 GLU H . . 4.600 3.623 2.176 4.446 . 0 0 "[ . 1 . 2 .]" 1
1100 2 7 THR HB 2 8 GLU QB . . 6.300 5.031 4.284 5.721 . 0 0 "[ . 1 . 2 .]" 1
1101 2 7 THR HB 2 9 LEU H . . 5.900 3.703 2.612 4.820 . 0 0 "[ . 1 . 2 .]" 1
1102 2 7 THR HB 2 10 GLU H . . 6.100 3.886 2.956 5.228 . 0 0 "[ . 1 . 2 .]" 1
1103 2 7 THR HB 2 10 GLU QB . . 6.400 4.256 3.086 5.717 . 0 0 "[ . 1 . 2 .]" 1
1104 2 7 THR HB 2 10 GLU QG . . 7.000 5.467 3.402 6.352 . 0 0 "[ . 1 . 2 .]" 1
1105 2 7 THR MG 2 8 GLU H . . 4.800 2.132 1.835 3.627 . 0 0 "[ . 1 . 2 .]" 1
1106 2 7 THR MG 2 8 GLU QB . . 7.800 3.057 2.483 4.020 . 0 0 "[ . 1 . 2 .]" 1
1107 2 7 THR MG 2 9 LEU H . . 4.000 2.674 1.990 3.211 . 0 0 "[ . 1 . 2 .]" 1
1108 2 7 THR MG 2 9 LEU QD . . 5.670 2.690 2.037 3.398 . 0 0 "[ . 1 . 2 .]" 1
1109 2 7 THR MG 2 10 GLU H . . 5.800 4.195 3.472 4.626 . 0 0 "[ . 1 . 2 .]" 1
1110 2 7 THR MG 2 11 GLU H . . 6.100 5.092 4.808 5.311 . 0 0 "[ . 1 . 2 .]" 1
1111 2 8 GLU H 2 9 LEU H . . 5.300 3.169 2.897 3.608 . 0 0 "[ . 1 . 2 .]" 1
1112 2 8 GLU H 2 9 LEU QD . . 6.370 3.992 3.511 4.749 . 0 0 "[ . 1 . 2 .]" 1
1113 2 8 GLU H 2 10 GLU H . . 6.100 4.655 4.306 5.172 . 0 0 "[ . 1 . 2 .]" 1
1114 2 8 GLU H 2 11 GLU H . . 6.100 4.508 3.371 4.812 . 0 0 "[ . 1 . 2 .]" 1
1115 2 8 GLU HA 2 9 LEU HA . . 5.100 4.832 4.657 5.075 . 0 0 "[ . 1 . 2 .]" 1
1116 2 8 GLU HA 2 11 GLU H . . 6.100 3.283 2.107 3.789 . 0 0 "[ . 1 . 2 .]" 1
1117 2 8 GLU HA 2 11 GLU QB . . 7.000 2.596 1.997 4.203 . 0 0 "[ . 1 . 2 .]" 1
1118 2 8 GLU HA 2 12 SER H . . 5.500 4.202 3.070 5.492 . 0 0 "[ . 1 . 2 .]" 1
1119 2 8 GLU HA 2 12 SER QB . . 7.000 5.571 4.789 6.298 . 0 0 "[ . 1 . 2 .]" 1
1120 2 8 GLU QB 2 10 GLU H . . 6.800 4.890 4.493 5.283 . 0 0 "[ . 1 . 2 .]" 1
1121 2 8 GLU QG 2 9 LEU H . . 5.800 4.289 2.613 4.835 . 0 0 "[ . 1 . 2 .]" 1
1122 2 8 GLU QG 2 9 LEU QD . . 9.370 4.199 2.434 5.103 . 0 0 "[ . 1 . 2 .]" 1
1123 2 9 LEU H 2 10 GLU H . . 5.500 2.707 2.368 2.960 . 0 0 "[ . 1 . 2 .]" 1
1124 2 9 LEU H 2 11 GLU H . . 4.400 4.006 3.628 4.440 0.040 4 0 "[ . 1 . 2 .]" 1
1125 2 9 LEU H 2 12 SER H . . 6.100 4.870 4.470 5.866 . 0 0 "[ . 1 . 2 .]" 1
1126 2 9 LEU HA 2 10 GLU HA . . 6.100 4.785 4.135 5.251 . 0 0 "[ . 1 . 2 .]" 1
1127 2 9 LEU HA 2 12 SER H . . 6.100 3.727 3.167 4.946 . 0 0 "[ . 1 . 2 .]" 1
1128 2 9 LEU HA 2 12 SER QB . . 7.000 3.549 2.604 5.310 . 0 0 "[ . 1 . 2 .]" 1
1129 2 9 LEU HA 2 13 ILE H . . 6.100 4.920 3.947 6.147 0.047 10 0 "[ . 1 . 2 .]" 1
1130 2 9 LEU HA 2 13 ILE MD . . 6.100 4.452 3.802 5.461 . 0 0 "[ . 1 . 2 .]" 1
1131 2 9 LEU QB 2 10 GLU H . . 6.900 2.550 2.186 3.787 . 0 0 "[ . 1 . 2 .]" 1
1132 2 9 LEU QD 2 10 GLU H . . 5.260 3.770 3.261 3.951 . 0 0 "[ . 1 . 2 .]" 1
1133 2 9 LEU MD1 2 10 GLU H . . 6.100 4.481 3.618 5.180 . 0 0 "[ . 1 . 2 .]" 1
1134 2 9 LEU MD2 2 10 GLU H . . 6.100 4.183 3.646 4.765 . 0 0 "[ . 1 . 2 .]" 1
1135 2 10 GLU H 2 11 GLU H . . 5.400 2.640 2.371 3.137 . 0 0 "[ . 1 . 2 .]" 1
1136 2 10 GLU H 2 12 SER H . . 5.300 4.106 3.789 4.826 . 0 0 "[ . 1 . 2 .]" 1
1137 2 10 GLU HA 2 11 GLU HA . . 6.100 4.774 4.194 5.182 . 0 0 "[ . 1 . 2 .]" 1
1138 2 10 GLU HA 2 13 ILE H . . 6.100 3.385 2.531 5.861 . 0 0 "[ . 1 . 2 .]" 1
1139 2 10 GLU HA 2 13 ILE HB . . 6.100 3.088 2.042 6.188 0.088 22 0 "[ . 1 . 2 .]" 1
1140 2 10 GLU HA 2 13 ILE MD . . 6.100 2.441 1.956 5.362 . 0 0 "[ . 1 . 2 .]" 1
1141 2 10 GLU HA 2 14 GLU H . . 6.100 4.225 2.996 6.341 0.241 22 0 "[ . 1 . 2 .]" 1
1142 2 11 GLU H 2 12 SER H . . 5.300 2.945 2.642 3.544 . 0 0 "[ . 1 . 2 .]" 1
1143 2 11 GLU H 2 12 SER QB . . 7.000 5.017 4.502 5.784 . 0 0 "[ . 1 . 2 .]" 1
1144 2 11 GLU H 2 13 ILE H . . 6.100 4.390 4.033 5.941 . 0 0 "[ . 1 . 2 .]" 1
1145 2 11 GLU HA 2 12 SER HA . . 6.100 4.738 3.852 5.020 . 0 0 "[ . 1 . 2 .]" 1
1146 2 11 GLU HA 2 13 ILE H . . 6.100 4.301 3.547 5.442 . 0 0 "[ . 1 . 2 .]" 1
1147 2 11 GLU HA 2 14 GLU H . . 5.900 3.616 2.604 6.015 0.115 22 0 "[ . 1 . 2 .]" 1
1148 2 11 GLU HA 2 14 GLU QB . . 7.000 3.686 2.199 6.167 . 0 0 "[ . 1 . 2 .]" 1
1149 2 11 GLU QG 2 12 SER H . . 5.280 4.182 2.800 4.706 . 0 0 "[ . 1 . 2 .]" 1
1150 2 12 SER H 2 13 ILE H . . 5.400 2.492 2.218 3.083 . 0 0 "[ . 1 . 2 .]" 1
1151 2 12 SER H 2 13 ILE HB . . 6.000 4.671 4.219 6.020 0.020 6 0 "[ . 1 . 2 .]" 1
1152 2 12 SER H 2 13 ILE MD . . 5.200 4.422 4.063 4.515 . 0 0 "[ . 1 . 2 .]" 1
1153 2 12 SER H 2 14 GLU H . . 6.100 4.208 3.852 4.826 . 0 0 "[ . 1 . 2 .]" 1
1154 2 12 SER HA 2 14 GLU QG . . 6.300 5.056 4.408 5.788 . 0 0 "[ . 1 . 2 .]" 1
1155 2 12 SER HA 2 15 THR H . . 6.100 3.745 2.916 4.759 . 0 0 "[ . 1 . 2 .]" 1
1156 2 12 SER HA 2 15 THR HB . . 6.100 3.129 2.590 5.424 . 0 0 "[ . 1 . 2 .]" 1
1157 2 12 SER QB 2 13 ILE HB . . 6.100 4.778 4.501 5.475 . 0 0 "[ . 1 . 2 .]" 1
1158 2 12 SER QB 2 13 ILE MD . . 7.800 3.975 2.501 5.116 . 0 0 "[ . 1 . 2 .]" 1
1159 2 12 SER QB 2 13 ILE QG . . 7.800 3.167 2.590 4.112 . 0 0 "[ . 1 . 2 .]" 1
1160 2 12 SER QB 2 13 ILE MG . . 7.000 5.105 4.739 5.462 . 0 0 "[ . 1 . 2 .]" 1
1161 2 13 ILE H 2 13 ILE MD . . 4.500 3.066 2.194 3.509 . 0 0 "[ . 1 . 2 .]" 1
1162 2 13 ILE H 2 13 ILE MG . . 4.800 3.762 3.530 3.938 . 0 0 "[ . 1 . 2 .]" 1
1163 2 13 ILE H 2 14 GLU H . . 4.000 2.683 2.328 3.434 . 0 0 "[ . 1 . 2 .]" 1
1164 2 13 ILE H 2 15 THR H . . 5.600 4.087 3.711 4.336 . 0 0 "[ . 1 . 2 .]" 1
1165 2 13 ILE HA 2 15 THR H . . 6.100 4.399 3.494 4.847 . 0 0 "[ . 1 . 2 .]" 1
1166 2 13 ILE HA 2 16 VAL H . . 6.100 3.487 3.257 4.467 . 0 0 "[ . 1 . 2 .]" 1
1167 2 13 ILE HA 2 16 VAL HB . . 6.100 3.051 2.463 6.229 0.129 9 0 "[ . 1 . 2 .]" 1
1168 2 13 ILE HA 2 77 TRP HZ3 . . 6.100 4.548 4.303 7.080 0.980 9 1 "[ . +1 . 2 .]" 1
1169 2 13 ILE HB 2 14 GLU H . . 5.400 2.513 2.199 3.448 . 0 0 "[ . 1 . 2 .]" 1
1170 2 13 ILE HB 2 14 GLU QG . . 5.400 4.246 3.185 4.961 . 0 0 "[ . 1 . 2 .]" 1
1171 2 13 ILE HB 2 15 THR H . . 6.100 4.989 4.753 5.229 . 0 0 "[ . 1 . 2 .]" 1
1172 2 13 ILE MD 2 77 TRP HH2 . . 7.000 4.336 3.653 4.730 . 0 0 "[ . 1 . 2 .]" 1
1173 2 13 ILE MD 2 77 TRP HZ2 . . 7.000 3.581 2.141 3.945 . 0 0 "[ . 1 . 2 .]" 1
1174 2 13 ILE MD 2 77 TRP HZ3 . . 8.000 5.895 5.385 5.981 . 0 0 "[ . 1 . 2 .]" 1
1175 2 13 ILE QG 2 77 TRP HH2 . . 7.000 3.286 2.602 5.048 . 0 0 "[ . 1 . 2 .]" 1
1176 2 13 ILE MG 2 14 GLU HA . . 5.300 3.600 3.103 4.489 . 0 0 "[ . 1 . 2 .]" 1
1177 2 13 ILE MG 2 17 VAL QG . . 5.300 2.561 2.070 2.913 . 0 0 "[ . 1 . 2 .]" 1
1178 2 14 GLU H 2 15 THR H . . 5.300 2.790 2.506 3.059 . 0 0 "[ . 1 . 2 .]" 1
1179 2 14 GLU H 2 16 VAL H . . 5.900 4.408 4.146 4.609 . 0 0 "[ . 1 . 2 .]" 1
1180 2 14 GLU HA 2 16 VAL H . . 6.100 4.589 4.086 4.855 . 0 0 "[ . 1 . 2 .]" 1
1181 2 14 GLU HA 2 17 VAL H . . 6.100 3.666 3.286 5.069 . 0 0 "[ . 1 . 2 .]" 1
1182 2 14 GLU HA 2 17 VAL QG . . 5.000 2.062 1.912 3.634 . 0 0 "[ . 1 . 2 .]" 1
1183 2 14 GLU QB 2 15 THR HA . . 7.000 4.412 3.639 4.836 . 0 0 "[ . 1 . 2 .]" 1
1184 2 14 GLU QG 2 15 THR H . . 4.700 2.818 1.982 4.234 . 0 0 "[ . 1 . 2 .]" 1
1185 2 15 THR H 2 16 VAL H . . 5.400 2.877 2.494 3.104 . 0 0 "[ . 1 . 2 .]" 1
1186 2 15 THR H 2 16 VAL HA . . 6.100 5.431 5.098 5.587 . 0 0 "[ . 1 . 2 .]" 1
1187 2 15 THR H 2 16 VAL HB . . 6.100 4.937 4.561 5.228 . 0 0 "[ . 1 . 2 .]" 1
1188 2 15 THR H 2 17 VAL H . . 6.100 4.422 3.501 4.666 . 0 0 "[ . 1 . 2 .]" 1
1189 2 15 THR H 2 17 VAL QG . . 5.100 4.174 3.985 4.312 . 0 0 "[ . 1 . 2 .]" 1
1190 2 15 THR HA 2 16 VAL HA . . 6.100 4.811 4.764 4.869 . 0 0 "[ . 1 . 2 .]" 1
1191 2 15 THR HA 2 18 THR H . . 6.100 3.654 3.381 3.874 . 0 0 "[ . 1 . 2 .]" 1
1192 2 15 THR HA 2 18 THR HB . . 6.100 3.273 2.216 4.430 . 0 0 "[ . 1 . 2 .]" 1
1193 2 15 THR HA 2 19 THR H . . 6.100 3.934 3.827 4.239 . 0 0 "[ . 1 . 2 .]" 1
1194 2 15 THR HB 2 16 VAL H . . 6.100 2.743 2.404 4.181 . 0 0 "[ . 1 . 2 .]" 1
1195 2 15 THR HB 2 16 VAL HA . . 6.100 4.480 4.041 4.848 . 0 0 "[ . 1 . 2 .]" 1
1196 2 15 THR HB 2 16 VAL HB . . 6.100 4.987 4.554 6.175 0.075 19 0 "[ . 1 . 2 .]" 1
1197 2 15 THR MG 2 16 VAL H . . 5.200 3.441 2.430 3.807 . 0 0 "[ . 1 . 2 .]" 1
1198 2 15 THR MG 2 19 THR H . . 5.100 4.074 3.902 4.249 . 0 0 "[ . 1 . 2 .]" 1
1199 2 16 VAL H 2 16 VAL MG1 . . 4.400 3.646 2.007 3.737 . 0 0 "[ . 1 . 2 .]" 1
1200 2 16 VAL H 2 16 VAL MG2 . . 4.500 2.354 2.146 3.735 . 0 0 "[ . 1 . 2 .]" 1
1201 2 16 VAL H 2 17 VAL H . . 5.700 2.854 1.973 3.040 . 0 0 "[ . 1 . 2 .]" 1
1202 2 16 VAL H 2 17 VAL QG . . 5.400 3.821 3.414 4.061 . 0 0 "[ . 1 . 2 .]" 1
1203 2 16 VAL HA 2 17 VAL HA . . 6.100 4.720 4.634 5.169 . 0 0 "[ . 1 . 2 .]" 1
1204 2 16 VAL HA 2 19 THR H . . 6.100 3.415 3.116 3.605 . 0 0 "[ . 1 . 2 .]" 1
1205 2 16 VAL HA 2 19 THR HB . . 6.100 2.584 2.225 3.047 . 0 0 "[ . 1 . 2 .]" 1
1206 2 16 VAL HA 2 20 PHE H . . 6.100 4.307 3.922 4.829 . 0 0 "[ . 1 . 2 .]" 1
1207 2 16 VAL HB 2 17 VAL H . . 6.100 2.552 2.232 4.025 . 0 0 "[ . 1 . 2 .]" 1
1208 2 16 VAL HB 2 17 VAL QG . . 7.000 3.249 2.941 4.661 . 0 0 "[ . 1 . 2 .]" 1
1209 2 16 VAL HB 2 77 TRP HE3 . . 5.400 5.047 4.444 5.487 0.087 9 0 "[ . 1 . 2 .]" 1
1210 2 16 VAL MG1 2 17 VAL H . . 3.600 2.955 2.166 3.078 . 0 0 "[ . 1 . 2 .]" 1
1211 2 16 VAL MG1 2 19 THR H . . 5.500 4.613 4.366 5.242 . 0 0 "[ . 1 . 2 .]" 1
1212 2 16 VAL MG1 2 20 PHE H . . 5.200 4.168 3.709 5.570 0.370 9 0 "[ . 1 . 2 .]" 1
1213 2 16 VAL MG1 2 77 TRP HE3 . . 7.000 3.208 2.751 4.108 . 0 0 "[ . 1 . 2 .]" 1
1214 2 16 VAL MG2 2 77 TRP HE3 . . 6.000 4.729 2.961 5.025 . 0 0 "[ . 1 . 2 .]" 1
1215 2 17 VAL H 2 18 THR H . . 5.800 2.844 2.714 3.250 . 0 0 "[ . 1 . 2 .]" 1
1216 2 17 VAL H 2 18 THR HB . . 6.100 4.951 4.525 5.684 . 0 0 "[ . 1 . 2 .]" 1
1217 2 17 VAL H 2 19 THR H . . 6.100 4.221 4.057 4.362 . 0 0 "[ . 1 . 2 .]" 1
1218 2 17 VAL HA 2 20 PHE H . . 6.100 3.569 3.025 5.209 . 0 0 "[ . 1 . 2 .]" 1
1219 2 17 VAL HA 2 20 PHE QB . . 7.000 3.355 2.409 5.415 . 0 0 "[ . 1 . 2 .]" 1
1220 2 17 VAL HB 2 18 THR H . . 6.100 3.950 3.716 4.504 . 0 0 "[ . 1 . 2 .]" 1
1221 2 17 VAL HB 2 20 PHE H . . 6.100 5.443 4.918 5.928 . 0 0 "[ . 1 . 2 .]" 1
1222 2 17 VAL HB 2 77 TRP HH2 . . 6.100 5.875 3.300 6.163 0.063 16 0 "[ . 1 . 2 .]" 1
1223 2 17 VAL QG 2 18 THR H . . 5.100 2.381 2.149 3.587 . 0 0 "[ . 1 . 2 .]" 1
1224 2 17 VAL QG 2 18 THR HA . . 7.000 3.662 3.300 4.227 . 0 0 "[ . 1 . 2 .]" 1
1225 2 17 VAL QG 2 20 PHE QD . . 8.700 3.536 2.109 4.502 . 0 0 "[ . 1 . 2 .]" 1
1226 2 17 VAL QG 2 73 PHE QB . . 7.800 3.394 2.848 4.825 . 0 0 "[ . 1 . 2 .]" 1
1227 2 18 THR H 2 19 THR H . . 5.900 2.721 2.569 2.873 . 0 0 "[ . 1 . 2 .]" 1
1228 2 18 THR H 2 19 THR HA . . 5.300 5.283 5.133 5.353 0.053 16 0 "[ . 1 . 2 .]" 1
1229 2 18 THR H 2 19 THR HB . . 5.500 4.791 4.498 5.126 . 0 0 "[ . 1 . 2 .]" 1
1230 2 18 THR H 2 20 PHE H . . 6.100 4.372 4.230 4.643 . 0 0 "[ . 1 . 2 .]" 1
1231 2 18 THR HA 2 20 PHE H . . 6.100 4.421 4.083 4.774 . 0 0 "[ . 1 . 2 .]" 1
1232 2 18 THR HA 2 21 PHE H . . 6.100 3.476 2.901 4.037 . 0 0 "[ . 1 . 2 .]" 1
1233 2 18 THR HA 2 21 PHE QB . . 7.000 3.055 2.442 3.762 . 0 0 "[ . 1 . 2 .]" 1
1234 2 18 THR HB 2 19 THR H . . 5.000 3.314 2.401 4.164 . 0 0 "[ . 1 . 2 .]" 1
1235 2 18 THR HB 2 19 THR HA . . 6.100 5.106 4.243 5.803 . 0 0 "[ . 1 . 2 .]" 1
1236 2 18 THR MG 2 19 THR H . . 4.800 2.585 2.319 3.044 . 0 0 "[ . 1 . 2 .]" 1
1237 2 18 THR MG 2 19 THR HA . . 4.700 3.051 2.688 3.368 . 0 0 "[ . 1 . 2 .]" 1
1238 2 18 THR MG 2 19 THR HB . . 5.200 4.234 4.158 4.295 . 0 0 "[ . 1 . 2 .]" 1
1239 2 18 THR MG 2 21 PHE H . . 5.700 4.582 4.120 4.944 . 0 0 "[ . 1 . 2 .]" 1
1240 2 18 THR MG 2 21 PHE QB . . 7.800 4.072 3.395 4.828 . 0 0 "[ . 1 . 2 .]" 1
1241 2 19 THR H 2 20 PHE H . . 5.700 2.875 2.574 3.052 . 0 0 "[ . 1 . 2 .]" 1
1242 2 19 THR H 2 20 PHE QB . . 7.000 4.801 4.418 5.126 . 0 0 "[ . 1 . 2 .]" 1
1243 2 19 THR H 2 21 PHE H . . 6.100 4.224 3.987 4.491 . 0 0 "[ . 1 . 2 .]" 1
1244 2 19 THR HA 2 20 PHE HA . . 6.100 4.880 4.789 5.045 . 0 0 "[ . 1 . 2 .]" 1
1245 2 19 THR HA 2 21 PHE H . . 6.100 3.917 3.535 4.269 . 0 0 "[ . 1 . 2 .]" 1
1246 2 19 THR HA 2 22 THR H . . 6.100 3.152 2.691 3.553 . 0 0 "[ . 1 . 2 .]" 1
1247 2 19 THR HB 2 20 PHE H . . 5.500 2.904 2.673 3.172 . 0 0 "[ . 1 . 2 .]" 1
1248 2 19 THR HB 2 20 PHE HA . . 6.100 4.768 4.502 5.247 . 0 0 "[ . 1 . 2 .]" 1
1249 2 19 THR MG 2 20 PHE H . . 4.600 3.481 2.709 3.802 . 0 0 "[ . 1 . 2 .]" 1
1250 2 19 THR MG 2 22 THR H . . 5.800 4.459 3.835 4.977 . 0 0 "[ . 1 . 2 .]" 1
1251 2 20 PHE H 2 20 PHE QE . . 7.000 4.594 4.062 5.000 . 0 0 "[ . 1 . 2 .]" 1
1252 2 20 PHE H 2 20 PHE HZ . . 6.400 6.069 5.537 6.458 0.058 25 0 "[ . 1 . 2 .]" 1
1253 2 20 PHE H 2 21 PHE H . . 5.500 2.875 2.737 3.065 . 0 0 "[ . 1 . 2 .]" 1
1254 2 20 PHE H 2 21 PHE QB . . 7.000 4.676 4.442 5.079 . 0 0 "[ . 1 . 2 .]" 1
1255 2 20 PHE HA 2 20 PHE HZ . . 6.100 6.034 5.671 6.141 0.041 14 0 "[ . 1 . 2 .]" 1
1256 2 20 PHE HA 2 21 PHE HA . . 5.500 4.792 4.712 4.920 . 0 0 "[ . 1 . 2 .]" 1
1257 2 20 PHE HA 2 32 SER HA . . 6.800 4.780 3.842 6.196 . 0 0 "[ . 1 . 2 .]" 1
1258 2 20 PHE QB 2 21 PHE HA . . 7.000 3.958 3.736 4.232 . 0 0 "[ . 1 . 2 .]" 1
1259 2 20 PHE QB 2 21 PHE QB . . 7.100 4.090 3.705 4.666 . 0 0 "[ . 1 . 2 .]" 1
1260 2 20 PHE QB 2 22 THR H . . 7.000 4.808 4.613 5.163 . 0 0 "[ . 1 . 2 .]" 1
1261 2 20 PHE QD 2 31 ASP HA . . 7.800 4.848 2.223 5.920 . 0 0 "[ . 1 . 2 .]" 1
1262 2 20 PHE QD 2 32 SER H . . 5.900 5.092 4.088 5.302 . 0 0 "[ . 1 . 2 .]" 1
1263 2 20 PHE QD 2 32 SER HA . . 7.800 2.887 2.392 4.237 . 0 0 "[ . 1 . 2 .]" 1
1264 2 20 PHE QD 2 32 SER QB . . 8.680 3.724 2.305 4.804 . 0 0 "[ . 1 . 2 .]" 1
1265 2 20 PHE QE 2 32 SER H . . 6.200 5.179 3.852 5.585 . 0 0 "[ . 1 . 2 .]" 1
1266 2 20 PHE QE 2 32 SER HA . . 7.700 3.315 2.303 4.651 . 0 0 "[ . 1 . 2 .]" 1
1267 2 20 PHE QE 2 32 SER QB . . 8.680 2.671 2.194 4.207 . 0 0 "[ . 1 . 2 .]" 1
1268 2 20 PHE QE 2 33 LEU MD2 . . 8.700 3.699 2.283 5.547 . 0 0 "[ . 1 . 2 .]" 1
1269 2 20 PHE QE 2 71 LEU QD . . 11.300 3.987 2.448 5.029 . 0 0 "[ . 1 . 2 .]" 1
1270 2 20 PHE QE 2 72 LYS HA . . 7.800 5.157 2.977 6.335 . 0 0 "[ . 1 . 2 .]" 1
1271 2 20 PHE QE 2 73 PHE QB . . 8.700 2.921 2.101 4.141 . 0 0 "[ . 1 . 2 .]" 1
1272 2 20 PHE HZ 2 32 SER HA . . 6.100 5.064 4.180 6.128 0.028 18 0 "[ . 1 . 2 .]" 1
1273 2 20 PHE HZ 2 71 LEU QD . . 8.200 4.570 2.969 6.093 . 0 0 "[ . 1 . 2 .]" 1
1274 2 20 PHE HZ 2 73 PHE QB . . 7.000 3.526 2.505 4.608 . 0 0 "[ . 1 . 2 .]" 1
1275 2 20 PHE HZ 2 77 TRP H . . 4.500 4.444 3.795 4.634 0.134 20 0 "[ . 1 . 2 .]" 1
1276 2 21 PHE H 2 22 THR H . . 6.100 2.569 2.306 2.787 . 0 0 "[ . 1 . 2 .]" 1
1277 2 21 PHE H 2 29 ARG QB . . 5.900 4.786 2.502 5.354 . 0 0 "[ . 1 . 2 .]" 1
1278 2 21 PHE HA 2 22 THR HA . . 6.100 4.702 4.586 4.814 . 0 0 "[ . 1 . 2 .]" 1
1279 2 21 PHE HA 2 22 THR HB . . 6.100 5.934 5.151 6.233 0.133 15 0 "[ . 1 . 2 .]" 1
1280 2 21 PHE QB 2 22 THR HA . . 7.000 4.126 3.720 4.706 . 0 0 "[ . 1 . 2 .]" 1
1281 2 22 THR H 2 23 PHE H . . 6.100 3.686 3.444 4.349 . 0 0 "[ . 1 . 2 .]" 1
1282 2 22 THR HA 2 23 PHE HA . . 6.100 4.535 4.316 4.658 . 0 0 "[ . 1 . 2 .]" 1
1283 2 22 THR HB 2 23 PHE H . . 6.100 4.393 3.762 4.664 . 0 0 "[ . 1 . 2 .]" 1
1284 2 22 THR MG 2 23 PHE H . . 5.900 4.058 2.043 4.403 . 0 0 "[ . 1 . 2 .]" 1
1285 2 28 GLY H 2 29 ARG H . . 5.400 4.100 2.277 4.697 . 0 0 "[ . 1 . 2 .]" 1
1286 2 28 GLY H 2 29 ARG QB . . 7.000 5.121 3.280 6.033 . 0 0 "[ . 1 . 2 .]" 1
1287 2 28 GLY QA 2 29 ARG HA . . 6.980 4.055 3.912 4.169 . 0 0 "[ . 1 . 2 .]" 1
1288 2 29 ARG H 2 30 LYS H . . 4.800 4.119 3.365 4.649 . 0 0 "[ . 1 . 2 .]" 1
1289 2 29 ARG H 2 30 LYS HA . . 6.100 4.717 3.981 5.417 . 0 0 "[ . 1 . 2 .]" 1
1290 2 29 ARG HA 2 30 LYS HA . . 5.000 4.489 4.272 4.605 . 0 0 "[ . 1 . 2 .]" 1
1291 2 29 ARG HA 2 31 ASP H . . 5.800 4.746 3.562 5.809 0.009 17 0 "[ . 1 . 2 .]" 1
1292 2 29 ARG QB 2 31 ASP H . . 7.000 4.564 3.208 6.276 . 0 0 "[ . 1 . 2 .]" 1
1293 2 29 ARG QG 2 30 LYS H . . 5.000 3.747 2.373 4.527 . 0 0 "[ . 1 . 2 .]" 1
1294 2 29 ARG QG 2 31 ASP H . . 5.600 4.505 2.306 5.032 . 0 0 "[ . 1 . 2 .]" 1
1295 2 30 LYS H 2 30 LYS HD2 . . 6.100 4.765 2.586 6.087 . 0 0 "[ . 1 . 2 .]" 1
1296 2 30 LYS H 2 30 LYS HD3 . . 6.100 4.434 2.225 6.083 . 0 0 "[ . 1 . 2 .]" 1
1297 2 30 LYS H 2 30 LYS QE . . 7.000 4.264 2.131 6.139 . 0 0 "[ . 1 . 2 .]" 1
1298 2 30 LYS H 2 31 ASP H . . 4.000 3.050 2.384 3.554 . 0 0 "[ . 1 . 2 .]" 1
1299 2 30 LYS H 2 31 ASP HA . . 5.000 4.949 4.368 5.085 0.085 15 0 "[ . 1 . 2 .]" 1
1300 2 30 LYS HA 2 31 ASP HA . . 5.900 4.704 4.494 4.885 . 0 0 "[ . 1 . 2 .]" 1
1301 2 30 LYS QB 2 31 ASP HA . . 6.980 4.559 4.059 5.500 . 0 0 "[ . 1 . 2 .]" 1
1302 2 30 LYS HB2 2 31 ASP H . . 5.300 2.988 1.933 4.560 . 0 0 "[ . 1 . 2 .]" 1
1303 2 30 LYS HB2 2 32 SER H . . 6.100 4.784 3.396 6.151 0.051 21 0 "[ . 1 . 2 .]" 1
1304 2 30 LYS HB3 2 31 ASP H . . 5.300 2.742 1.990 4.446 . 0 0 "[ . 1 . 2 .]" 1
1305 2 30 LYS HB3 2 32 SER H . . 6.100 4.330 3.279 5.911 . 0 0 "[ . 1 . 2 .]" 1
1306 2 30 LYS QE 2 31 ASP H . . 5.700 4.243 3.297 5.161 . 0 0 "[ . 1 . 2 .]" 1
1307 2 30 LYS QG 2 31 ASP H . . 5.680 3.771 2.072 4.861 . 0 0 "[ . 1 . 2 .]" 1
1308 2 31 ASP H 2 32 SER H . . 5.000 2.815 1.979 4.084 . 0 0 "[ . 1 . 2 .]" 1
1309 2 31 ASP HA 2 32 SER HA . . 6.100 4.649 4.456 4.760 . 0 0 "[ . 1 . 2 .]" 1
1310 2 31 ASP HA 2 32 SER HB2 . . 6.500 5.041 4.310 5.853 . 0 0 "[ . 1 . 2 .]" 1
1311 2 31 ASP HA 2 32 SER QB . . 6.240 4.745 4.153 5.449 . 0 0 "[ . 1 . 2 .]" 1
1312 2 31 ASP HA 2 32 SER HB3 . . 6.500 5.798 5.288 6.495 . 0 0 "[ . 1 . 2 .]" 1
1313 2 31 ASP HA 2 72 LYS HA . . 6.000 4.896 4.029 5.785 . 0 0 "[ . 1 . 2 .]" 1
1314 2 31 ASP HA 2 72 LYS QB . . 7.000 5.647 4.569 6.296 . 0 0 "[ . 1 . 2 .]" 1
1315 2 31 ASP HA 2 72 LYS QG . . 7.000 5.451 3.870 6.305 . 0 0 "[ . 1 . 2 .]" 1
1316 2 31 ASP HA 2 73 PHE H . . 6.100 4.820 3.878 6.102 0.002 18 0 "[ . 1 . 2 .]" 1
1317 2 31 ASP QB 2 33 LEU H . . 6.680 5.589 4.697 5.901 . 0 0 "[ . 1 . 2 .]" 1
1318 2 31 ASP QB 2 70 GLU QB . . 8.080 4.839 3.803 6.030 . 0 0 "[ . 1 . 2 .]" 1
1319 2 31 ASP QB 2 71 LEU QD . . 10.180 5.423 4.495 6.468 . 0 0 "[ . 1 . 2 .]" 1
1320 2 31 ASP QB 2 72 LYS H . . 6.680 5.131 4.295 5.999 . 0 0 "[ . 1 . 2 .]" 1
1321 2 31 ASP QB 2 72 LYS QB . . 7.880 3.468 2.568 4.347 . 0 0 "[ . 1 . 2 .]" 1
1322 2 31 ASP QB 2 72 LYS QD . . 7.880 4.191 2.171 5.271 . 0 0 "[ . 1 . 2 .]" 1
1323 2 31 ASP QB 2 72 LYS QG . . 7.880 2.905 2.003 3.657 . 0 0 "[ . 1 . 2 .]" 1
1324 2 31 ASP HB2 2 72 LYS HA . . 6.100 3.489 2.166 5.093 . 0 0 "[ . 1 . 2 .]" 1
1325 2 31 ASP HB3 2 72 LYS HA . . 6.100 2.818 2.139 3.796 . 0 0 "[ . 1 . 2 .]" 1
1326 2 32 SER H 2 33 LEU H . . 6.100 4.092 3.621 4.444 . 0 0 "[ . 1 . 2 .]" 1
1327 2 32 SER H 2 34 SER H . . 7.800 7.123 6.730 7.760 . 0 0 "[ . 1 . 2 .]" 1
1328 2 32 SER H 2 71 LEU QD . . 8.200 5.128 4.386 6.087 . 0 0 "[ . 1 . 2 .]" 1
1329 2 32 SER H 2 72 LYS QG . . 6.000 4.336 3.611 5.359 . 0 0 "[ . 1 . 2 .]" 1
1330 2 32 SER H 2 73 PHE H . . 6.100 4.961 4.226 6.012 . 0 0 "[ . 1 . 2 .]" 1
1331 2 32 SER HA 2 72 LYS HA . . 6.100 5.048 4.570 5.770 . 0 0 "[ . 1 . 2 .]" 1
1332 2 32 SER QB 2 33 LEU HA . . 6.980 4.547 4.300 4.757 . 0 0 "[ . 1 . 2 .]" 1
1333 2 32 SER QB 2 33 LEU MD2 . . 6.180 3.539 2.573 4.623 . 0 0 "[ . 1 . 2 .]" 1
1334 2 32 SER QB 2 71 LEU H . . 5.780 3.684 3.023 4.191 . 0 0 "[ . 1 . 2 .]" 1
1335 2 32 SER QB 2 71 LEU HA . . 5.680 4.271 3.921 4.678 . 0 0 "[ . 1 . 2 .]" 1
1336 2 32 SER QB 2 71 LEU HB2 . . 5.640 3.547 2.111 4.374 . 0 0 "[ . 1 . 2 .]" 1
1337 2 32 SER QB 2 71 LEU HG . . 6.170 3.355 2.090 4.715 . 0 0 "[ . 1 . 2 .]" 1
1338 2 32 SER QB 2 72 LYS H . . 4.370 3.718 3.458 3.964 . 0 0 "[ . 1 . 2 .]" 1
1339 2 32 SER QB 2 72 LYS HA . . 6.980 2.753 2.209 3.458 . 0 0 "[ . 1 . 2 .]" 1
1340 2 32 SER QB 2 73 PHE HA . . 6.680 3.661 2.571 4.859 . 0 0 "[ . 1 . 2 .]" 1
1341 2 32 SER HB2 2 33 LEU H . . 6.100 3.247 2.311 3.510 . 0 0 "[ . 1 . 2 .]" 1
1342 2 32 SER HB2 2 71 LEU HB2 . . 6.000 4.688 2.286 5.889 . 0 0 "[ . 1 . 2 .]" 1
1343 2 32 SER HB2 2 71 LEU QD . . 8.200 3.499 2.467 4.442 . 0 0 "[ . 1 . 2 .]" 1
1344 2 32 SER HB2 2 71 LEU HG . . 6.800 4.376 2.607 6.306 . 0 0 "[ . 1 . 2 .]" 1
1345 2 32 SER HB2 2 72 LYS H . . 4.700 4.412 3.561 4.760 0.060 1 0 "[ . 1 . 2 .]" 1
1346 2 32 SER HB3 2 33 LEU H . . 6.100 2.355 1.994 2.713 . 0 0 "[ . 1 . 2 .]" 1
1347 2 32 SER HB3 2 71 LEU HB2 . . 6.000 3.788 2.124 4.786 . 0 0 "[ . 1 . 2 .]" 1
1348 2 32 SER HB3 2 71 LEU QD . . 8.200 2.869 2.164 3.899 . 0 0 "[ . 1 . 2 .]" 1
1349 2 32 SER HB3 2 71 LEU HG . . 6.800 3.564 2.103 5.376 . 0 0 "[ . 1 . 2 .]" 1
1350 2 32 SER HB3 2 72 LYS H . . 4.700 4.176 3.657 4.774 0.074 25 0 "[ . 1 . 2 .]" 1
1351 2 33 LEU H 2 33 LEU MD1 . . 5.600 3.400 3.002 3.913 . 0 0 "[ . 1 . 2 .]" 1
1352 2 33 LEU H 2 34 SER H . . 6.100 4.364 4.185 4.506 . 0 0 "[ . 1 . 2 .]" 1
1353 2 33 LEU H 2 34 SER HA . . 5.200 5.194 5.011 5.328 0.128 10 0 "[ . 1 . 2 .]" 1
1354 2 33 LEU H 2 70 GLU QB . . 7.300 5.708 5.021 6.538 . 0 0 "[ . 1 . 2 .]" 1
1355 2 33 LEU H 2 71 LEU H . . 4.700 4.136 3.345 4.692 . 0 0 "[ . 1 . 2 .]" 1
1356 2 33 LEU H 2 71 LEU HB2 . . 5.300 4.127 2.559 5.328 0.028 18 0 "[ . 1 . 2 .]" 1
1357 2 33 LEU H 2 71 LEU QD . . 8.100 2.869 2.027 3.725 . 0 0 "[ . 1 . 2 .]" 1
1358 2 33 LEU H 2 72 LYS HA . . 6.100 5.500 4.858 6.146 0.046 17 0 "[ . 1 . 2 .]" 1
1359 2 33 LEU HA 2 34 SER HA . . 6.100 4.511 4.371 4.672 . 0 0 "[ . 1 . 2 .]" 1
1360 2 33 LEU HA 2 34 SER QB . . 7.000 4.808 4.373 5.198 . 0 0 "[ . 1 . 2 .]" 1
1361 2 33 LEU HA 2 37 GLU QB . . 7.000 4.972 4.239 6.207 . 0 0 "[ . 1 . 2 .]" 1
1362 2 33 LEU HA 2 38 PHE QB . . 7.000 5.197 4.932 5.793 . 0 0 "[ . 1 . 2 .]" 1
1363 2 33 LEU HA 2 70 GLU QB . . 7.000 5.435 4.635 6.269 . 0 0 "[ . 1 . 2 .]" 1
1364 2 33 LEU HA 2 71 LEU H . . 4.800 4.757 4.306 4.876 0.076 6 0 "[ . 1 . 2 .]" 1
1365 2 33 LEU HB2 2 34 SER H . . 6.100 2.859 2.477 3.484 . 0 0 "[ . 1 . 2 .]" 1
1366 2 33 LEU HB2 2 37 GLU H . . 6.100 5.762 5.093 6.129 0.029 11 0 "[ . 1 . 2 .]" 1
1367 2 33 LEU HB2 2 37 GLU QB . . 6.300 3.725 2.842 5.048 . 0 0 "[ . 1 . 2 .]" 1
1368 2 33 LEU HB2 2 37 GLU QG . . 7.000 4.121 2.857 6.053 . 0 0 "[ . 1 . 2 .]" 1
1369 2 33 LEU HB2 2 38 PHE H . . 4.700 3.380 2.752 3.861 . 0 0 "[ . 1 . 2 .]" 1
1370 2 33 LEU HB2 2 38 PHE HA . . 5.900 3.565 3.094 4.349 . 0 0 "[ . 1 . 2 .]" 1
1371 2 33 LEU HB2 2 71 LEU HB2 . . 6.000 4.959 3.903 6.075 0.075 20 0 "[ . 1 . 2 .]" 1
1372 2 33 LEU HB3 2 34 SER H . . 5.900 2.034 1.929 2.445 . 0 0 "[ . 1 . 2 .]" 1
1373 2 33 LEU HB3 2 37 GLU QB . . 5.200 3.187 2.256 4.553 . 0 0 "[ . 1 . 2 .]" 1
1374 2 33 LEU HB3 2 37 GLU QG . . 6.300 3.277 2.167 4.977 . 0 0 "[ . 1 . 2 .]" 1
1375 2 33 LEU HB3 2 38 PHE H . . 4.100 3.880 3.074 4.154 0.054 11 0 "[ . 1 . 2 .]" 1
1376 2 33 LEU HB3 2 38 PHE HA . . 5.900 4.419 3.653 5.177 . 0 0 "[ . 1 . 2 .]" 1
1377 2 33 LEU HB3 2 71 LEU QD . . 7.400 4.554 3.376 5.508 . 0 0 "[ . 1 . 2 .]" 1
1378 2 33 LEU MD1 2 34 SER H . . 5.700 3.861 2.998 4.380 . 0 0 "[ . 1 . 2 .]" 1
1379 2 33 LEU MD1 2 37 GLU QB . . 7.800 4.604 2.720 5.797 . 0 0 "[ . 1 . 2 .]" 1
1380 2 33 LEU MD1 2 37 GLU QG . . 7.800 4.137 2.252 5.792 . 0 0 "[ . 1 . 2 .]" 1
1381 2 33 LEU MD2 2 34 SER H . . 5.300 4.370 3.573 4.531 . 0 0 "[ . 1 . 2 .]" 1
1382 2 33 LEU MD2 2 38 PHE HA . . 5.000 3.713 2.702 4.245 . 0 0 "[ . 1 . 2 .]" 1
1383 2 33 LEU MD2 2 71 LEU QD . . 6.800 3.444 2.505 4.231 . 0 0 "[ . 1 . 2 .]" 1
1384 2 34 SER H 2 35 VAL H . . 6.100 4.606 4.402 4.742 . 0 0 "[ . 1 . 2 .]" 1
1385 2 34 SER H 2 37 GLU H . . 6.100 4.690 4.239 5.017 . 0 0 "[ . 1 . 2 .]" 1
1386 2 34 SER H 2 37 GLU QB . . 7.000 2.703 2.139 3.471 . 0 0 "[ . 1 . 2 .]" 1
1387 2 34 SER H 2 37 GLU QG . . 5.900 3.566 2.657 4.407 . 0 0 "[ . 1 . 2 .]" 1
1388 2 34 SER H 2 38 PHE H . . 6.100 3.886 3.291 4.567 . 0 0 "[ . 1 . 2 .]" 1
1389 2 34 SER H 2 38 PHE QB . . 7.000 4.388 3.730 4.985 . 0 0 "[ . 1 . 2 .]" 1
1390 2 34 SER H 2 70 GLU HA . . 5.900 4.785 4.102 5.250 . 0 0 "[ . 1 . 2 .]" 1
1391 2 34 SER HA 2 35 VAL HA . . 6.100 4.166 3.825 4.337 . 0 0 "[ . 1 . 2 .]" 1
1392 2 34 SER HA 2 35 VAL QG . . 6.660 3.392 3.046 3.731 . 0 0 "[ . 1 . 2 .]" 1
1393 2 34 SER HA 2 37 GLU H . . 5.300 5.118 4.719 5.329 0.029 18 0 "[ . 1 . 2 .]" 1
1394 2 34 SER HA 2 38 PHE H . . 5.600 4.947 4.709 5.602 0.002 18 0 "[ . 1 . 2 .]" 1
1395 2 34 SER HA 2 68 ASP HA . . 6.100 5.599 4.702 6.121 0.021 15 0 "[ . 1 . 2 .]" 1
1396 2 34 SER HA 2 70 GLU HA . . 6.100 2.215 2.034 2.465 . 0 0 "[ . 1 . 2 .]" 1
1397 2 34 SER HA 2 70 GLU QG . . 5.980 3.530 2.166 5.160 . 0 0 "[ . 1 . 2 .]" 1
1398 2 34 SER HA 2 71 LEU H . . 5.100 3.034 2.333 4.191 . 0 0 "[ . 1 . 2 .]" 1
1399 2 34 SER QB 2 36 ASN H . . 7.000 3.768 3.096 4.626 . 0 0 "[ . 1 . 2 .]" 1
1400 2 34 SER QB 2 37 GLU H . . 7.000 3.057 2.475 3.845 . 0 0 "[ . 1 . 2 .]" 1
1401 2 34 SER QB 2 37 GLU QB . . 7.300 2.388 1.980 3.855 . 0 0 "[ . 1 . 2 .]" 1
1402 2 34 SER QB 2 38 PHE H . . 7.000 4.049 3.670 5.204 . 0 0 "[ . 1 . 2 .]" 1
1403 2 34 SER QB 2 68 ASP HA . . 6.400 4.007 2.999 5.372 . 0 0 "[ . 1 . 2 .]" 1
1404 2 34 SER QB 2 70 GLU HA . . 6.900 3.780 3.261 4.288 . 0 0 "[ . 1 . 2 .]" 1
1405 2 34 SER QB 2 70 GLU QG . . 7.880 4.242 3.050 6.255 . 0 0 "[ . 1 . 2 .]" 1
1406 2 35 VAL H 2 35 VAL MG1 . . 4.800 3.738 3.680 3.816 . 0 0 "[ . 1 . 2 .]" 1
1407 2 35 VAL H 2 35 VAL MG2 . . 4.800 2.011 1.931 2.155 . 0 0 "[ . 1 . 2 .]" 1
1408 2 35 VAL H 2 36 ASN H . . 5.700 2.837 2.539 3.071 . 0 0 "[ . 1 . 2 .]" 1
1409 2 35 VAL H 2 36 ASN QB . . 7.000 4.794 4.383 5.309 . 0 0 "[ . 1 . 2 .]" 1
1410 2 35 VAL H 2 37 GLU H . . 6.100 4.273 3.941 4.798 . 0 0 "[ . 1 . 2 .]" 1
1411 2 35 VAL H 2 67 GLN HA . . 4.900 4.108 3.876 4.293 . 0 0 "[ . 1 . 2 .]" 1
1412 2 35 VAL H 2 68 ASP H . . 6.100 5.537 5.140 5.873 . 0 0 "[ . 1 . 2 .]" 1
1413 2 35 VAL H 2 68 ASP HA . . 5.000 4.631 3.965 5.031 0.031 13 0 "[ . 1 . 2 .]" 1
1414 2 35 VAL H 2 69 SER H . . 5.900 4.733 4.093 5.512 . 0 0 "[ . 1 . 2 .]" 1
1415 2 35 VAL H 2 69 SER QB . . 6.000 4.879 4.161 5.433 . 0 0 "[ . 1 . 2 .]" 1
1416 2 35 VAL H 2 70 GLU HA . . 3.900 3.509 2.515 3.950 0.050 15 0 "[ . 1 . 2 .]" 1
1417 2 35 VAL H 2 71 LEU H . . 5.900 4.344 3.548 5.474 . 0 0 "[ . 1 . 2 .]" 1
1418 2 35 VAL H 2 71 LEU QD . . 6.900 4.009 3.077 4.707 . 0 0 "[ . 1 . 2 .]" 1
1419 2 35 VAL HA 2 36 ASN HA . . 6.100 4.787 4.639 4.998 . 0 0 "[ . 1 . 2 .]" 1
1420 2 35 VAL HA 2 38 PHE H . . 6.100 3.675 3.456 3.987 . 0 0 "[ . 1 . 2 .]" 1
1421 2 35 VAL HA 2 38 PHE QB . . 7.000 2.601 2.205 3.332 . 0 0 "[ . 1 . 2 .]" 1
1422 2 35 VAL HA 2 38 PHE QD . . 7.800 3.685 2.962 5.138 . 0 0 "[ . 1 . 2 .]" 1
1423 2 35 VAL HA 2 39 LYS H . . 6.100 4.305 3.989 4.944 . 0 0 "[ . 1 . 2 .]" 1
1424 2 35 VAL HA 2 63 LEU HA . . 6.100 5.601 5.251 6.142 0.042 5 0 "[ . 1 . 2 .]" 1
1425 2 35 VAL HA 2 70 GLU HA . . 6.100 5.229 4.208 5.975 . 0 0 "[ . 1 . 2 .]" 1
1426 2 35 VAL HA 2 71 LEU H . . 6.100 4.768 4.025 5.586 . 0 0 "[ . 1 . 2 .]" 1
1427 2 35 VAL HA 2 71 LEU HB2 . . 5.800 3.560 2.256 5.190 . 0 0 "[ . 1 . 2 .]" 1
1428 2 35 VAL HA 2 71 LEU HB3 . . 6.100 4.148 2.677 5.464 . 0 0 "[ . 1 . 2 .]" 1
1429 2 35 VAL HA 2 71 LEU QD . . 7.500 2.317 2.031 3.177 . 0 0 "[ . 1 . 2 .]" 1
1430 2 35 VAL HB 2 36 ASN H . . 6.100 2.357 2.109 2.856 . 0 0 "[ . 1 . 2 .]" 1
1431 2 35 VAL HB 2 37 GLU H . . 6.100 4.953 4.610 5.422 . 0 0 "[ . 1 . 2 .]" 1
1432 2 35 VAL HB 2 63 LEU HA . . 6.100 3.757 2.893 4.514 . 0 0 "[ . 1 . 2 .]" 1
1433 2 35 VAL HB 2 63 LEU HB3 . . 4.800 4.305 2.868 4.753 . 0 0 "[ . 1 . 2 .]" 1
1434 2 35 VAL HB 2 63 LEU QD . . 8.200 3.974 3.343 4.442 . 0 0 "[ . 1 . 2 .]" 1
1435 2 35 VAL HB 2 63 LEU HG . . 4.700 3.930 2.556 4.334 . 0 0 "[ . 1 . 2 .]" 1
1436 2 35 VAL HB 2 67 GLN H . . 5.900 4.643 4.479 4.747 . 0 0 "[ . 1 . 2 .]" 1
1437 2 35 VAL HB 2 67 GLN HA . . 5.300 2.046 1.957 2.149 . 0 0 "[ . 1 . 2 .]" 1
1438 2 35 VAL HB 2 67 GLN HB2 . . 3.300 2.752 2.314 3.185 . 0 0 "[ . 1 . 2 .]" 1
1439 2 35 VAL HB 2 67 GLN QB . . 2.980 2.604 2.271 2.762 . 0 0 "[ . 1 . 2 .]" 1
1440 2 35 VAL HB 2 67 GLN HB3 . . 3.300 3.279 2.983 3.423 0.123 17 0 "[ . 1 . 2 .]" 1
1441 2 35 VAL HB 2 68 ASP H . . 6.100 4.851 4.721 5.063 . 0 0 "[ . 1 . 2 .]" 1
1442 2 35 VAL HB 2 68 ASP HA . . 5.300 5.243 4.924 5.409 0.109 17 0 "[ . 1 . 2 .]" 1
1443 2 35 VAL HB 2 69 SER H . . 4.800 4.686 4.205 4.845 0.045 23 0 "[ . 1 . 2 .]" 1
1444 2 35 VAL HB 2 69 SER QB . . 6.600 4.895 4.305 5.531 . 0 0 "[ . 1 . 2 .]" 1
1445 2 35 VAL QG 2 36 ASN H . . 4.890 3.100 2.789 3.467 . 0 0 "[ . 1 . 2 .]" 1
1446 2 35 VAL QG 2 39 LYS H . . 7.560 4.200 3.760 4.654 . 0 0 "[ . 1 . 2 .]" 1
1447 2 35 VAL QG 2 62 SER QB . . 9.360 4.265 2.911 4.834 . 0 0 "[ . 1 . 2 .]" 1
1448 2 35 VAL QG 2 63 LEU HB2 . . 7.160 3.937 3.537 4.462 . 0 0 "[ . 1 . 2 .]" 1
1449 2 35 VAL QG 2 63 LEU HB3 . . 7.160 3.058 2.260 4.071 . 0 0 "[ . 1 . 2 .]" 1
1450 2 35 VAL QG 2 63 LEU HG . . 6.160 2.130 2.001 2.371 . 0 0 "[ . 1 . 2 .]" 1
1451 2 35 VAL QG 2 66 ASN H . . 7.060 4.452 3.951 5.135 . 0 0 "[ . 1 . 2 .]" 1
1452 2 35 VAL QG 2 66 ASN QB . . 7.860 4.476 3.840 5.090 . 0 0 "[ . 1 . 2 .]" 1
1453 2 35 VAL QG 2 67 GLN HA . . 5.240 2.450 2.194 2.753 . 0 0 "[ . 1 . 2 .]" 1
1454 2 35 VAL QG 2 69 SER H . . 6.860 3.473 2.871 3.918 . 0 0 "[ . 1 . 2 .]" 1
1455 2 35 VAL QG 2 69 SER QB . . 8.560 2.852 2.349 3.484 . 0 0 "[ . 1 . 2 .]" 1
1456 2 35 VAL QG 2 70 GLU HA . . 8.360 3.331 2.393 4.216 . 0 0 "[ . 1 . 2 .]" 1
1457 2 35 VAL QG 2 71 LEU HB3 . . 5.960 3.558 2.124 4.429 . 0 0 "[ . 1 . 2 .]" 1
1458 2 35 VAL QG 2 79 LEU QD . . 9.160 2.803 2.163 3.677 . 0 0 "[ . 1 . 2 .]" 1
1459 2 35 VAL MG1 2 36 ASN H . . 5.700 3.361 2.888 3.881 . 0 0 "[ . 1 . 2 .]" 1
1460 2 35 VAL MG1 2 67 GLN HA . . 5.900 2.808 2.325 3.195 . 0 0 "[ . 1 . 2 .]" 1
1461 2 35 VAL MG2 2 36 ASN H . . 5.700 3.726 3.338 3.904 . 0 0 "[ . 1 . 2 .]" 1
1462 2 35 VAL MG2 2 67 GLN HA . . 5.900 2.747 2.394 3.060 . 0 0 "[ . 1 . 2 .]" 1
1463 2 36 ASN H 2 36 ASN HD21 . . 6.100 3.862 2.002 4.592 . 0 0 "[ . 1 . 2 .]" 1
1464 2 36 ASN H 2 36 ASN HD22 . . 6.100 4.841 2.895 5.723 . 0 0 "[ . 1 . 2 .]" 1
1465 2 36 ASN H 2 37 GLU H . . 4.100 2.782 2.591 3.024 . 0 0 "[ . 1 . 2 .]" 1
1466 2 36 ASN H 2 38 PHE H . . 6.100 4.349 4.011 4.606 . 0 0 "[ . 1 . 2 .]" 1
1467 2 36 ASN H 2 63 LEU HG . . 4.300 4.243 3.566 4.410 0.110 18 0 "[ . 1 . 2 .]" 1
1468 2 36 ASN H 2 67 GLN HA . . 6.000 3.607 3.261 4.083 . 0 0 "[ . 1 . 2 .]" 1
1469 2 36 ASN H 2 67 GLN QB . . 4.480 2.215 1.919 2.634 . 0 0 "[ . 1 . 2 .]" 1
1470 2 36 ASN H 2 68 ASP HA . . 6.100 4.897 4.135 5.334 . 0 0 "[ . 1 . 2 .]" 1
1471 2 36 ASN HA 2 39 LYS H . . 6.100 3.407 3.037 3.881 . 0 0 "[ . 1 . 2 .]" 1
1472 2 36 ASN HA 2 39 LYS QB . . 7.000 2.774 2.274 3.565 . 0 0 "[ . 1 . 2 .]" 1
1473 2 36 ASN HA 2 40 GLU H . . 6.100 4.501 4.014 5.068 . 0 0 "[ . 1 . 2 .]" 1
1474 2 36 ASN HA 2 63 LEU HA . . 5.100 5.046 4.600 5.168 0.068 10 0 "[ . 1 . 2 .]" 1
1475 2 36 ASN HA 2 63 LEU HB2 . . 4.600 4.534 3.463 4.767 0.167 21 0 "[ . 1 . 2 .]" 1
1476 2 36 ASN HA 2 63 LEU HB3 . . 5.300 3.289 2.921 3.861 . 0 0 "[ . 1 . 2 .]" 1
1477 2 36 ASN HA 2 63 LEU QD . . 7.400 3.205 2.001 3.801 . 0 0 "[ . 1 . 2 .]" 1
1478 2 36 ASN HA 2 63 LEU HG . . 5.100 2.920 2.425 3.332 . 0 0 "[ . 1 . 2 .]" 1
1479 2 36 ASN HA 2 67 GLN HA . . 6.100 5.173 4.435 5.431 . 0 0 "[ . 1 . 2 .]" 1
1480 2 36 ASN HA 2 67 GLN QB . . 6.880 3.323 2.543 3.786 . 0 0 "[ . 1 . 2 .]" 1
1481 2 36 ASN QB 2 37 GLU HA . . 7.000 4.000 3.696 4.364 . 0 0 "[ . 1 . 2 .]" 1
1482 2 36 ASN QB 2 67 GLN QB . . 7.880 2.111 1.968 2.603 . 0 0 "[ . 1 . 2 .]" 1
1483 2 36 ASN QB 2 68 ASP HA . . 5.800 5.024 3.660 5.296 . 0 0 "[ . 1 . 2 .]" 1
1484 2 36 ASN QD 2 67 GLN H . . 5.270 4.697 4.267 4.799 . 0 0 "[ . 1 . 2 .]" 1
1485 2 37 GLU H 2 38 PHE H . . 5.300 2.976 2.760 3.136 . 0 0 "[ . 1 . 2 .]" 1
1486 2 37 GLU H 2 38 PHE QB . . 7.000 4.529 4.299 4.742 . 0 0 "[ . 1 . 2 .]" 1
1487 2 37 GLU H 2 39 LYS H . . 6.100 4.350 4.083 4.615 . 0 0 "[ . 1 . 2 .]" 1
1488 2 37 GLU H 2 40 GLU H . . 5.600 4.948 4.598 5.261 . 0 0 "[ . 1 . 2 .]" 1
1489 2 37 GLU HA 2 38 PHE HA . . 5.200 4.897 4.755 4.970 . 0 0 "[ . 1 . 2 .]" 1
1490 2 37 GLU HA 2 39 LYS H . . 6.100 4.612 4.239 4.813 . 0 0 "[ . 1 . 2 .]" 1
1491 2 37 GLU HA 2 40 GLU H . . 6.100 3.637 3.305 4.029 . 0 0 "[ . 1 . 2 .]" 1
1492 2 37 GLU HA 2 40 GLU QB . . 7.000 3.077 2.528 3.631 . 0 0 "[ . 1 . 2 .]" 1
1493 2 37 GLU HA 2 40 GLU HG3 . . 5.000 3.979 3.147 4.938 . 0 0 "[ . 1 . 2 .]" 1
1494 2 37 GLU QG 2 38 PHE H . . 5.400 3.468 2.799 4.427 . 0 0 "[ . 1 . 2 .]" 1
1495 2 38 PHE H 2 38 PHE QE . . 7.000 6.142 5.988 6.257 . 0 0 "[ . 1 . 2 .]" 1
1496 2 38 PHE H 2 39 LYS H . . 5.900 3.059 2.919 3.194 . 0 0 "[ . 1 . 2 .]" 1
1497 2 38 PHE H 2 40 GLU H . . 6.100 4.461 4.191 4.713 . 0 0 "[ . 1 . 2 .]" 1
1498 2 38 PHE HA 2 38 PHE HZ . . 6.800 6.283 5.777 6.640 . 0 0 "[ . 1 . 2 .]" 1
1499 2 38 PHE HA 2 39 LYS HA . . 6.100 4.840 4.695 5.046 . 0 0 "[ . 1 . 2 .]" 1
1500 2 38 PHE HA 2 42 VAL H . . 5.900 3.683 3.487 3.954 . 0 0 "[ . 1 . 2 .]" 1
1501 2 38 PHE QB 2 63 LEU HG . . 7.000 4.964 4.571 5.378 . 0 0 "[ . 1 . 2 .]" 1
1502 2 38 PHE QB 2 71 LEU HB3 . . 7.000 4.287 3.136 5.332 . 0 0 "[ . 1 . 2 .]" 1
1503 2 38 PHE QB 2 71 LEU QD . . 10.500 2.054 1.879 2.611 . 0 0 "[ . 1 . 2 .]" 1
1504 2 38 PHE QB 2 79 LEU QD . . 10.500 4.220 3.052 5.487 . 0 0 "[ . 1 . 2 .]" 1
1505 2 38 PHE QD 2 39 LYS H . . 6.500 2.952 2.500 4.158 . 0 0 "[ . 1 . 2 .]" 1
1506 2 38 PHE QD 2 42 VAL QG . . 10.260 3.007 2.451 3.746 . 0 0 "[ . 1 . 2 .]" 1
1507 2 38 PHE QD 2 71 LEU QD . . 11.300 2.550 2.101 2.935 . 0 0 "[ . 1 . 2 .]" 1
1508 2 38 PHE QE 2 59 LYS QE . . 8.700 3.998 2.907 6.053 . 0 0 "[ . 1 . 2 .]" 1
1509 2 38 PHE QE 2 71 LEU QD . . 11.300 3.383 2.793 4.011 . 0 0 "[ . 1 . 2 .]" 1
1510 2 38 PHE QE 2 79 LEU QB . . 8.700 2.482 2.146 4.320 . 0 0 "[ . 1 . 2 .]" 1
1511 2 38 PHE QE 2 79 LEU QD . . 11.300 2.557 2.102 5.056 . 0 0 "[ . 1 . 2 .]" 1
1512 2 38 PHE QE 2 79 LEU HG . . 7.800 4.012 2.994 6.515 . 0 0 "[ . 1 . 2 .]" 1
1513 2 38 PHE HZ 2 77 TRP HA . . 6.500 6.141 4.551 6.537 0.037 11 0 "[ . 1 . 2 .]" 1
1514 2 38 PHE HZ 2 80 ILE H . . 4.500 3.732 3.171 4.552 0.052 18 0 "[ . 1 . 2 .]" 1
1515 2 38 PHE HZ 2 80 ILE MG . . 7.000 2.210 1.990 2.418 . 0 0 "[ . 1 . 2 .]" 1
1516 2 39 LYS H 2 40 GLU H . . 5.300 2.857 2.455 3.011 . 0 0 "[ . 1 . 2 .]" 1
1517 2 39 LYS H 2 40 GLU HG3 . . 5.200 4.665 4.326 5.308 0.108 14 0 "[ . 1 . 2 .]" 1
1518 2 39 LYS H 2 42 VAL QG . . 6.260 4.069 3.902 4.229 . 0 0 "[ . 1 . 2 .]" 1
1519 2 39 LYS H 2 63 LEU HG . . 4.900 4.082 3.618 4.442 . 0 0 "[ . 1 . 2 .]" 1
1520 2 39 LYS HA 2 40 GLU HA . . 6.100 4.752 4.550 4.875 . 0 0 "[ . 1 . 2 .]" 1
1521 2 39 LYS HA 2 42 VAL H . . 6.100 3.859 3.579 4.303 . 0 0 "[ . 1 . 2 .]" 1
1522 2 39 LYS HA 2 42 VAL QG . . 7.260 2.252 2.063 2.697 . 0 0 "[ . 1 . 2 .]" 1
1523 2 39 LYS HA 2 43 THR H . . 6.100 4.172 3.668 5.503 . 0 0 "[ . 1 . 2 .]" 1
1524 2 39 LYS HA 2 43 THR HB . . 6.100 5.038 4.304 6.156 0.056 8 0 "[ . 1 . 2 .]" 1
1525 2 39 LYS HA 2 59 LYS QE . . 6.100 4.374 2.864 5.663 . 0 0 "[ . 1 . 2 .]" 1
1526 2 39 LYS QB 2 40 GLU H . . 6.900 2.782 2.337 3.473 . 0 0 "[ . 1 . 2 .]" 1
1527 2 39 LYS QB 2 42 VAL H . . 7.000 5.325 5.045 5.596 . 0 0 "[ . 1 . 2 .]" 1
1528 2 39 LYS QB 2 63 LEU HB2 . . 4.800 4.365 4.312 4.443 . 0 0 "[ . 1 . 2 .]" 1
1529 2 39 LYS QB 2 63 LEU HG . . 3.600 2.887 2.457 3.315 . 0 0 "[ . 1 . 2 .]" 1
1530 2 39 LYS QB 2 79 LEU QD . . 10.500 4.411 2.628 5.897 . 0 0 "[ . 1 . 2 .]" 1
1531 2 39 LYS QD 2 40 GLU H . . 5.400 3.342 2.367 4.813 . 0 0 "[ . 1 . 2 .]" 1
1532 2 39 LYS QG 2 40 GLU H . . 6.100 3.916 2.742 4.489 . 0 0 "[ . 1 . 2 .]" 1
1533 2 39 LYS QG 2 42 VAL QG . . 5.660 3.573 3.188 3.812 . 0 0 "[ . 1 . 2 .]" 1
1534 2 39 LYS QG 2 59 LYS HB3 . . 6.000 4.536 2.643 5.379 . 0 0 "[ . 1 . 2 .]" 1
1535 2 39 LYS QG 2 59 LYS QE . . 7.700 3.736 2.645 5.262 . 0 0 "[ . 1 . 2 .]" 1
1536 2 39 LYS QG 2 60 MET HA . . 6.600 4.441 3.657 5.417 . 0 0 "[ . 1 . 2 .]" 1
1537 2 39 LYS QG 2 63 LEU QD . . 8.500 2.188 1.964 3.238 . 0 0 "[ . 1 . 2 .]" 1
1538 2 39 LYS QG 2 63 LEU HG . . 6.600 4.236 3.810 5.072 . 0 0 "[ . 1 . 2 .]" 1
1539 2 39 LYS QG 2 79 LEU QD . . 10.500 5.144 2.968 6.050 . 0 0 "[ . 1 . 2 .]" 1
1540 2 40 GLU H 2 40 GLU HG2 . . 5.300 3.307 2.293 4.069 . 0 0 "[ . 1 . 2 .]" 1
1541 2 40 GLU H 2 40 GLU HG3 . . 4.900 2.372 2.133 3.376 . 0 0 "[ . 1 . 2 .]" 1
1542 2 40 GLU H 2 42 VAL H . . 5.500 4.325 4.087 4.575 . 0 0 "[ . 1 . 2 .]" 1
1543 2 40 GLU H 2 42 VAL QG . . 7.160 4.255 3.920 4.551 . 0 0 "[ . 1 . 2 .]" 1
1544 2 40 GLU HA 2 42 VAL H . . 5.500 4.677 4.341 5.031 . 0 0 "[ . 1 . 2 .]" 1
1545 2 40 GLU HA 2 43 THR H . . 6.100 3.645 3.154 4.258 . 0 0 "[ . 1 . 2 .]" 1
1546 2 40 GLU HA 2 43 THR HB . . 6.100 3.646 2.271 4.467 . 0 0 "[ . 1 . 2 .]" 1
1547 2 40 GLU HA 2 44 GLN H . . 6.100 4.216 3.774 5.488 . 0 0 "[ . 1 . 2 .]" 1
1548 2 40 GLU QB 2 42 VAL QG . . 8.860 5.169 4.705 5.511 . 0 0 "[ . 1 . 2 .]" 1
1549 2 40 GLU HG2 2 43 THR MG . . 5.400 4.001 3.295 5.275 . 0 0 "[ . 1 . 2 .]" 1
1550 2 40 GLU HG3 2 63 LEU QD . . 7.700 5.278 3.608 5.732 . 0 0 "[ . 1 . 2 .]" 1
1551 2 42 VAL H 2 43 THR H . . 3.800 2.848 2.403 2.979 . 0 0 "[ . 1 . 2 .]" 1
1552 2 42 VAL H 2 43 THR HA . . 6.100 5.394 5.059 5.519 . 0 0 "[ . 1 . 2 .]" 1
1553 2 42 VAL H 2 43 THR HB . . 5.900 5.065 4.006 5.542 . 0 0 "[ . 1 . 2 .]" 1
1554 2 42 VAL H 2 43 THR MG . . 5.900 4.779 4.042 6.016 0.116 24 0 "[ . 1 . 2 .]" 1
1555 2 42 VAL H 2 44 GLN H . . 4.300 4.248 3.932 4.346 0.046 7 0 "[ . 1 . 2 .]" 1
1556 2 42 VAL HA 2 45 GLN H . . 6.100 3.255 2.839 3.730 . 0 0 "[ . 1 . 2 .]" 1
1557 2 42 VAL HA 2 45 GLN QB . . 7.000 2.519 2.152 4.891 . 0 0 "[ . 1 . 2 .]" 1
1558 2 42 VAL HA 2 46 LEU QD . . 6.770 2.977 2.373 3.629 . 0 0 "[ . 1 . 2 .]" 1
1559 2 42 VAL HB 2 80 ILE HB . . 5.100 5.082 4.279 5.244 0.144 7 0 "[ . 1 . 2 .]" 1
1560 2 42 VAL HB 2 80 ILE MG . . 7.000 3.778 3.146 4.439 . 0 0 "[ . 1 . 2 .]" 1
1561 2 42 VAL QG 2 43 THR H . . 6.060 2.241 2.048 2.389 . 0 0 "[ . 1 . 2 .]" 1
1562 2 42 VAL QG 2 80 ILE HA . . 7.760 3.734 2.909 4.357 . 0 0 "[ . 1 . 2 .]" 1
1563 2 42 VAL QG 2 80 ILE MG . . 7.260 2.459 1.955 2.965 . 0 0 "[ . 1 . 2 .]" 1
1564 2 42 VAL QG 2 83 LEU QD . . 9.530 2.088 1.667 2.847 . 0 0 "[ . 1 . 2 .]" 1
1565 2 43 THR H 2 44 GLN H . . 3.700 2.816 2.698 3.019 . 0 0 "[ . 1 . 2 .]" 1
1566 2 43 THR H 2 45 GLN H . . 5.700 4.326 4.079 4.662 . 0 0 "[ . 1 . 2 .]" 1
1567 2 43 THR H 2 46 LEU QD . . 6.170 4.455 4.235 4.621 . 0 0 "[ . 1 . 2 .]" 1
1568 2 43 THR HA 2 44 GLN HA . . 6.100 4.801 4.680 4.901 . 0 0 "[ . 1 . 2 .]" 1
1569 2 43 THR HA 2 45 GLN H . . 6.100 4.556 4.250 4.899 . 0 0 "[ . 1 . 2 .]" 1
1570 2 43 THR HA 2 46 LEU H . . 6.100 3.466 3.031 3.905 . 0 0 "[ . 1 . 2 .]" 1
1571 2 43 THR HA 2 46 LEU HB2 . . 6.100 3.092 2.358 3.857 . 0 0 "[ . 1 . 2 .]" 1
1572 2 43 THR HB 2 44 GLN H . . 5.100 3.783 2.576 4.442 . 0 0 "[ . 1 . 2 .]" 1
1573 2 43 THR MG 2 44 GLN H . . 4.500 2.583 2.211 3.550 . 0 0 "[ . 1 . 2 .]" 1
1574 2 43 THR MG 2 44 GLN HA . . 4.600 3.465 3.119 3.917 . 0 0 "[ . 1 . 2 .]" 1
1575 2 43 THR MG 2 44 GLN QB . . 7.200 3.876 3.042 4.855 . 0 0 "[ . 1 . 2 .]" 1
1576 2 43 THR MG 2 44 GLN QG . . 6.080 3.101 2.319 4.421 . 0 0 "[ . 1 . 2 .]" 1
1577 2 43 THR MG 2 45 GLN H . . 6.800 4.725 4.380 5.439 . 0 0 "[ . 1 . 2 .]" 1
1578 2 44 GLN H 2 45 GLN H . . 5.200 2.650 2.279 2.882 . 0 0 "[ . 1 . 2 .]" 1
1579 2 44 GLN H 2 46 LEU H . . 5.900 4.000 3.655 4.317 . 0 0 "[ . 1 . 2 .]" 1
1580 2 44 GLN H 2 46 LEU HB2 . . 6.100 5.528 5.101 6.031 . 0 0 "[ . 1 . 2 .]" 1
1581 2 44 GLN HA 2 46 LEU H . . 6.600 4.173 3.758 4.442 . 0 0 "[ . 1 . 2 .]" 1
1582 2 44 GLN QB 2 45 GLN HA . . 7.000 3.976 3.730 4.372 . 0 0 "[ . 1 . 2 .]" 1
1583 2 45 GLN H 2 45 GLN HE21 . . 6.100 3.485 2.174 4.681 . 0 0 "[ . 1 . 2 .]" 1
1584 2 45 GLN H 2 45 GLN HE22 . . 6.100 3.725 2.971 4.636 . 0 0 "[ . 1 . 2 .]" 1
1585 2 45 GLN H 2 45 GLN HG2 . . 5.700 3.913 2.387 4.460 . 0 0 "[ . 1 . 2 .]" 1
1586 2 45 GLN H 2 45 GLN HG3 . . 5.700 4.003 3.606 4.266 . 0 0 "[ . 1 . 2 .]" 1
1587 2 45 GLN H 2 46 LEU H . . 4.800 2.745 2.402 2.949 . 0 0 "[ . 1 . 2 .]" 1
1588 2 45 GLN H 2 46 LEU QD . . 6.170 3.856 3.528 4.424 . 0 0 "[ . 1 . 2 .]" 1
1589 2 45 GLN HA 2 45 GLN HE21 . . 6.000 3.120 2.045 4.906 . 0 0 "[ . 1 . 2 .]" 1
1590 2 45 GLN HA 2 45 GLN HE22 . . 6.100 4.220 3.289 5.094 . 0 0 "[ . 1 . 2 .]" 1
1591 2 45 GLN HA 2 46 LEU HA . . 6.100 4.616 4.544 4.682 . 0 0 "[ . 1 . 2 .]" 1
1592 2 45 GLN HA 2 47 PRO QD . . 7.000 3.213 2.896 3.634 . 0 0 "[ . 1 . 2 .]" 1
1593 2 45 GLN QB 2 46 LEU HA . . 7.000 4.167 3.817 4.612 . 0 0 "[ . 1 . 2 .]" 1
1594 2 45 GLN QB 2 46 LEU QD . . 8.470 2.499 2.020 3.837 . 0 0 "[ . 1 . 2 .]" 1
1595 2 46 LEU H 2 46 LEU MD1 . . 5.700 2.889 2.312 4.274 . 0 0 "[ . 1 . 2 .]" 1
1596 2 46 LEU H 2 46 LEU MD2 . . 5.700 4.032 2.475 4.438 . 0 0 "[ . 1 . 2 .]" 1
1597 2 46 LEU H 2 48 HIS H . . 6.100 5.291 4.924 5.859 . 0 0 "[ . 1 . 2 .]" 1
1598 2 46 LEU HA 2 48 HIS H . . 6.100 3.464 3.011 4.004 . 0 0 "[ . 1 . 2 .]" 1
1599 2 46 LEU QD 2 48 HIS H . . 6.970 4.624 4.133 5.179 . 0 0 "[ . 1 . 2 .]" 1
1600 2 46 LEU QD 2 80 ILE MG . . 6.770 4.050 3.611 4.248 . 0 0 "[ . 1 . 2 .]" 1
1601 2 46 LEU QD 2 89 LYS QE . . 9.070 3.645 2.192 5.963 . 0 0 "[ . 1 . 2 .]" 1
1602 2 47 PRO HA 2 50 LEU HB2 . . 6.400 5.311 3.411 6.403 0.003 15 0 "[ . 1 . 2 .]" 1
1603 2 47 PRO HA 2 50 LEU HG . . 6.100 4.281 2.623 5.993 . 0 0 "[ . 1 . 2 .]" 1
1604 2 48 HIS HA 2 94 LYS HA . . 7.100 7.032 6.261 7.220 0.120 24 0 "[ . 1 . 2 .]" 1
1605 2 48 HIS QB 2 87 ILE QG . . 7.880 3.385 2.217 5.969 . 0 0 "[ . 1 . 2 .]" 1
1606 2 50 LEU H 2 50 LEU MD1 . . 4.800 3.586 2.586 4.095 . 0 0 "[ . 1 . 2 .]" 1
1607 2 50 LEU H 2 50 LEU QD . . 4.380 2.952 2.175 3.369 . 0 0 "[ . 1 . 2 .]" 1
1608 2 50 LEU H 2 50 LEU MD2 . . 4.800 3.340 2.185 4.097 . 0 0 "[ . 1 . 2 .]" 1
1609 2 50 LEU H 2 51 LYS H . . 5.400 2.728 2.468 3.268 . 0 0 "[ . 1 . 2 .]" 1
1610 2 50 LEU H 2 51 LYS HA . . 5.700 5.046 4.624 5.411 . 0 0 "[ . 1 . 2 .]" 1
1611 2 50 LEU H 2 51 LYS HG2 . . 5.000 5.069 4.975 5.117 0.117 5 0 "[ . 1 . 2 .]" 1
1612 2 50 LEU H 2 87 ILE HB . . 4.800 4.029 2.950 4.938 0.138 3 0 "[ . 1 . 2 .]" 1
1613 2 50 LEU H 2 87 ILE MD . . 7.000 2.921 1.850 4.041 . 0 0 "[ . 1 . 2 .]" 1
1614 2 50 LEU H 2 87 ILE QG . . 4.800 2.555 1.842 4.308 . 0 0 "[ . 1 . 2 .]" 1
1615 2 50 LEU HA 2 51 LYS HA . . 6.000 4.581 4.501 4.655 . 0 0 "[ . 1 . 2 .]" 1
1616 2 50 LEU HA 2 87 ILE HB . . 5.900 3.679 2.587 5.893 . 0 0 "[ . 1 . 2 .]" 1
1617 2 51 LYS H 2 51 LYS HD2 . . 6.100 4.113 2.144 4.473 . 0 0 "[ . 1 . 2 .]" 1
1618 2 51 LYS H 2 51 LYS HD3 . . 6.100 4.146 2.771 4.341 . 0 0 "[ . 1 . 2 .]" 1
1619 2 51 LYS H 2 51 LYS QE . . 7.000 4.880 4.175 5.198 . 0 0 "[ . 1 . 2 .]" 1
1620 2 51 LYS H 2 51 LYS HG3 . . 5.700 2.135 1.911 3.807 . 0 0 "[ . 1 . 2 .]" 1
1621 2 51 LYS H 2 52 ASP H . . 4.700 2.415 1.906 2.817 . 0 0 "[ . 1 . 2 .]" 1
1622 2 51 LYS H 2 87 ILE H . . 5.400 5.436 5.105 5.566 0.166 19 0 "[ . 1 . 2 .]" 1
1623 2 51 LYS H 2 87 ILE HA . . 6.100 3.712 3.045 4.676 . 0 0 "[ . 1 . 2 .]" 1
1624 2 51 LYS H 2 87 ILE MD . . 4.600 3.167 1.874 3.889 . 0 0 "[ . 1 . 2 .]" 1
1625 2 51 LYS H 2 87 ILE QG . . 5.300 2.837 1.906 4.724 . 0 0 "[ . 1 . 2 .]" 1
1626 2 51 LYS HA 2 87 ILE HA . . 6.100 5.945 5.455 6.203 0.103 10 0 "[ . 1 . 2 .]" 1
1627 2 51 LYS QB 2 52 ASP H . . 4.150 3.521 3.229 3.633 . 0 0 "[ . 1 . 2 .]" 1
1628 2 51 LYS HB2 2 52 ASP H . . 4.800 3.915 3.428 4.065 . 0 0 "[ . 1 . 2 .]" 1
1629 2 51 LYS HB3 2 52 ASP H . . 4.800 4.007 3.758 4.172 . 0 0 "[ . 1 . 2 .]" 1
1630 2 51 LYS HD2 2 52 ASP H . . 3.300 3.161 2.438 3.491 0.191 2 0 "[ . 1 . 2 .]" 1
1631 2 51 LYS HD3 2 52 ASP H . . 3.300 3.123 2.114 3.451 0.151 19 0 "[ . 1 . 2 .]" 1
1632 2 51 LYS QE 2 87 ILE H . . 6.600 5.689 5.012 6.039 . 0 0 "[ . 1 . 2 .]" 1
1633 2 51 LYS HG2 2 52 ASP H . . 3.900 3.779 1.856 3.970 0.070 15 0 "[ . 1 . 2 .]" 1
1634 2 51 LYS HG2 2 87 ILE HA . . 5.500 2.789 2.019 3.404 . 0 0 "[ . 1 . 2 .]" 1
1635 2 51 LYS HG2 2 88 ARG H . . 4.700 3.248 2.447 3.983 . 0 0 "[ . 1 . 2 .]" 1
1636 2 51 LYS HG3 2 52 ASP H . . 3.800 2.248 1.995 3.465 . 0 0 "[ . 1 . 2 .]" 1
1637 2 51 LYS HG3 2 87 ILE H . . 4.800 4.494 3.959 5.020 0.220 19 0 "[ . 1 . 2 .]" 1
1638 2 52 ASP H 2 53 VAL H . . 4.000 3.677 3.250 3.946 . 0 0 "[ . 1 . 2 .]" 1
1639 2 52 ASP H 2 86 GLU HA . . 5.000 4.940 4.576 5.103 0.103 9 0 "[ . 1 . 2 .]" 1
1640 2 52 ASP H 2 86 GLU QB . . 7.000 3.358 2.818 4.801 . 0 0 "[ . 1 . 2 .]" 1
1641 2 52 ASP HA 2 53 VAL HA . . 6.100 4.269 4.043 4.452 . 0 0 "[ . 1 . 2 .]" 1
1642 2 52 ASP HA 2 53 VAL MG1 . . 5.900 4.209 3.780 4.790 . 0 0 "[ . 1 . 2 .]" 1
1643 2 52 ASP HA 2 54 GLY H . . 6.800 5.995 5.293 6.330 . 0 0 "[ . 1 . 2 .]" 1
1644 2 52 ASP HA 2 55 SER QB . . 7.000 5.786 4.378 6.374 . 0 0 "[ . 1 . 2 .]" 1
1645 2 52 ASP HA 2 86 GLU HA . . 5.800 3.637 2.954 4.818 . 0 0 "[ . 1 . 2 .]" 1
1646 2 52 ASP QB 2 55 SER H . . 7.000 6.217 5.756 6.339 . 0 0 "[ . 1 . 2 .]" 1
1647 2 52 ASP QB 2 86 GLU HA . . 7.000 5.291 4.481 6.263 . 0 0 "[ . 1 . 2 .]" 1
1648 2 52 ASP QB 2 86 GLU QB . . 7.800 3.530 2.233 6.051 . 0 0 "[ . 1 . 2 .]" 1
1649 2 53 VAL H 2 53 VAL MG1 . . 4.600 2.810 2.304 3.430 . 0 0 "[ . 1 . 2 .]" 1
1650 2 53 VAL H 2 53 VAL MG2 . . 4.800 3.273 1.956 4.035 . 0 0 "[ . 1 . 2 .]" 1
1651 2 53 VAL H 2 54 GLY H . . 5.300 4.332 4.081 4.574 . 0 0 "[ . 1 . 2 .]" 1
1652 2 53 VAL H 2 54 GLY QA . . 6.980 4.681 4.166 5.408 . 0 0 "[ . 1 . 2 .]" 1
1653 2 53 VAL H 2 55 SER H . . 6.100 4.504 3.743 5.670 . 0 0 "[ . 1 . 2 .]" 1
1654 2 53 VAL H 2 56 LEU HB2 . . 6.100 3.865 2.834 5.334 . 0 0 "[ . 1 . 2 .]" 1
1655 2 53 VAL H 2 86 GLU HA . . 4.000 3.036 2.714 3.623 . 0 0 "[ . 1 . 2 .]" 1
1656 2 53 VAL H 2 86 GLU QB . . 4.600 3.252 1.927 4.205 . 0 0 "[ . 1 . 2 .]" 1
1657 2 53 VAL HA 2 54 GLY QA . . 6.880 4.024 3.935 4.087 . 0 0 "[ . 1 . 2 .]" 1
1658 2 53 VAL HA 2 56 LEU HB2 . . 6.100 3.571 2.321 6.149 0.049 15 0 "[ . 1 . 2 .]" 1
1659 2 53 VAL HA 2 56 LEU HB3 . . 6.100 2.783 2.052 5.039 . 0 0 "[ . 1 . 2 .]" 1
1660 2 53 VAL HA 2 56 LEU HG . . 6.300 4.053 2.648 6.363 0.063 1 0 "[ . 1 . 2 .]" 1
1661 2 53 VAL HA 2 86 GLU HA . . 5.400 5.395 4.839 5.549 0.149 4 0 "[ . 1 . 2 .]" 1
1662 2 53 VAL HB 2 54 GLY H . . 5.400 3.427 2.110 4.282 . 0 0 "[ . 1 . 2 .]" 1
1663 2 53 VAL HB 2 57 ASP H . . 6.800 6.353 4.897 6.926 0.126 1 0 "[ . 1 . 2 .]" 1
1664 2 53 VAL MG1 2 54 GLY H . . 4.600 3.597 2.303 3.866 . 0 0 "[ . 1 . 2 .]" 1
1665 2 54 GLY H 2 55 SER H . . 5.500 3.788 3.063 4.257 . 0 0 "[ . 1 . 2 .]" 1
1666 2 54 GLY QA 2 57 ASP H . . 6.980 3.952 2.855 5.340 . 0 0 "[ . 1 . 2 .]" 1
1667 2 54 GLY QA 2 57 ASP QB . . 7.850 3.896 2.179 5.713 . 0 0 "[ . 1 . 2 .]" 1
1668 2 55 SER H 2 56 LEU H . . 5.900 2.473 2.042 2.842 . 0 0 "[ . 1 . 2 .]" 1
1669 2 55 SER H 2 56 LEU HB2 . . 6.100 5.009 4.414 6.130 0.030 15 0 "[ . 1 . 2 .]" 1
1670 2 55 SER H 2 57 ASP H . . 6.100 4.393 3.660 5.074 . 0 0 "[ . 1 . 2 .]" 1
1671 2 55 SER H 2 85 LYS QB . . 6.900 4.849 3.541 5.860 . 0 0 "[ . 1 . 2 .]" 1
1672 2 55 SER HA 2 56 LEU HA . . 6.100 4.929 4.786 5.026 . 0 0 "[ . 1 . 2 .]" 1
1673 2 55 SER HA 2 57 ASP H . . 5.700 3.981 3.243 4.693 . 0 0 "[ . 1 . 2 .]" 1
1674 2 55 SER HA 2 58 GLU H . . 6.100 3.136 2.578 4.213 . 0 0 "[ . 1 . 2 .]" 1
1675 2 55 SER HA 2 58 GLU QB . . 7.000 2.744 1.887 4.655 . 0 0 "[ . 1 . 2 .]" 1
1676 2 55 SER HA 2 59 LYS H . . 6.100 4.130 3.574 6.000 . 0 0 "[ . 1 . 2 .]" 1
1677 2 55 SER HA 2 82 GLU QB . . 7.000 4.457 3.221 5.628 . 0 0 "[ . 1 . 2 .]" 1
1678 2 55 SER HA 2 85 LYS QD . . 6.300 4.560 3.358 5.714 . 0 0 "[ . 1 . 2 .]" 1
1679 2 55 SER QB 2 58 GLU H . . 7.000 4.552 4.123 5.214 . 0 0 "[ . 1 . 2 .]" 1
1680 2 55 SER QB 2 82 GLU HA . . 5.300 3.434 2.460 4.392 . 0 0 "[ . 1 . 2 .]" 1
1681 2 55 SER QB 2 82 GLU QG . . 7.800 3.200 2.179 4.738 . 0 0 "[ . 1 . 2 .]" 1
1682 2 55 SER QB 2 83 LEU HA . . 6.300 4.775 3.552 5.663 . 0 0 "[ . 1 . 2 .]" 1
1683 2 55 SER QB 2 85 LYS QB . . 7.400 3.609 2.284 5.253 . 0 0 "[ . 1 . 2 .]" 1
1684 2 55 SER QB 2 86 GLU H . . 5.100 3.758 2.748 4.556 . 0 0 "[ . 1 . 2 .]" 1
1685 2 55 SER QB 2 86 GLU QG . . 7.800 2.679 1.957 3.957 . 0 0 "[ . 1 . 2 .]" 1
1686 2 56 LEU H 2 57 ASP H . . 5.700 2.898 2.585 3.240 . 0 0 "[ . 1 . 2 .]" 1
1687 2 56 LEU H 2 59 LYS H . . 6.100 4.787 4.505 5.421 . 0 0 "[ . 1 . 2 .]" 1
1688 2 56 LEU H 2 86 GLU HA . . 6.100 4.514 3.756 5.185 . 0 0 "[ . 1 . 2 .]" 1
1689 2 56 LEU HA 2 57 ASP HA . . 6.100 4.827 4.719 5.049 . 0 0 "[ . 1 . 2 .]" 1
1690 2 56 LEU HA 2 59 LYS H . . 5.700 3.607 3.077 4.052 . 0 0 "[ . 1 . 2 .]" 1
1691 2 56 LEU HA 2 59 LYS HB2 . . 6.100 3.114 2.404 4.322 . 0 0 "[ . 1 . 2 .]" 1
1692 2 56 LEU HA 2 59 LYS HB3 . . 6.100 3.403 2.397 4.847 . 0 0 "[ . 1 . 2 .]" 1
1693 2 56 LEU HA 2 59 LYS QD . . 5.880 4.363 3.563 5.266 . 0 0 "[ . 1 . 2 .]" 1
1694 2 56 LEU HA 2 60 MET H . . 5.700 3.837 3.297 4.255 . 0 0 "[ . 1 . 2 .]" 1
1695 2 56 LEU HA 2 86 GLU QG . . 6.600 3.432 2.528 4.079 . 0 0 "[ . 1 . 2 .]" 1
1696 2 56 LEU HB2 2 57 ASP H . . 5.400 3.812 3.597 4.312 . 0 0 "[ . 1 . 2 .]" 1
1697 2 56 LEU HB2 2 58 GLU H . . 6.700 6.177 5.707 6.713 0.013 23 0 "[ . 1 . 2 .]" 1
1698 2 56 LEU HB2 2 86 GLU QG . . 7.000 2.923 2.092 4.160 . 0 0 "[ . 1 . 2 .]" 1
1699 2 56 LEU HB3 2 57 ASP H . . 5.100 2.615 2.127 3.796 . 0 0 "[ . 1 . 2 .]" 1
1700 2 56 LEU MD1 2 57 ASP H . . 4.500 3.046 2.070 3.838 . 0 0 "[ . 1 . 2 .]" 1
1701 2 56 LEU HG 2 57 ASP H . . 4.500 4.086 2.361 4.548 0.048 7 0 "[ . 1 . 2 .]" 1
1702 2 56 LEU HG 2 57 ASP HA . . 5.200 4.800 2.914 5.291 0.091 25 0 "[ . 1 . 2 .]" 1
1703 2 57 ASP H 2 58 GLU H . . 5.200 2.992 2.708 3.196 . 0 0 "[ . 1 . 2 .]" 1
1704 2 57 ASP H 2 59 LYS H . . 5.700 4.225 3.920 4.461 . 0 0 "[ . 1 . 2 .]" 1
1705 2 57 ASP H 2 60 MET H . . 5.900 4.687 4.478 4.909 . 0 0 "[ . 1 . 2 .]" 1
1706 2 57 ASP H 2 86 GLU QG . . 5.600 4.889 4.387 5.125 . 0 0 "[ . 1 . 2 .]" 1
1707 2 57 ASP HA 2 58 GLU HA . . 6.100 4.973 4.806 5.117 . 0 0 "[ . 1 . 2 .]" 1
1708 2 57 ASP HA 2 59 LYS H . . 5.500 4.464 4.136 5.001 . 0 0 "[ . 1 . 2 .]" 1
1709 2 57 ASP HA 2 60 MET H . . 6.100 3.598 3.109 4.521 . 0 0 "[ . 1 . 2 .]" 1
1710 2 57 ASP HA 2 60 MET QB . . 7.000 2.690 2.266 3.801 . 0 0 "[ . 1 . 2 .]" 1
1711 2 57 ASP HA 2 61 LYS H . . 5.500 3.972 3.449 5.485 . 0 0 "[ . 1 . 2 .]" 1
1712 2 58 GLU H 2 59 LYS H . . 3.800 2.930 2.345 3.248 . 0 0 "[ . 1 . 2 .]" 1
1713 2 58 GLU H 2 60 MET H . . 5.600 4.472 4.046 4.881 . 0 0 "[ . 1 . 2 .]" 1
1714 2 58 GLU H 2 61 LYS QD . . 5.680 3.847 3.322 5.105 . 0 0 "[ . 1 . 2 .]" 1
1715 2 58 GLU H 2 61 LYS QE . . 5.900 4.872 3.544 5.330 . 0 0 "[ . 1 . 2 .]" 1
1716 2 58 GLU HA 2 61 LYS H . . 5.200 4.043 3.322 4.668 . 0 0 "[ . 1 . 2 .]" 1
1717 2 58 GLU HA 2 61 LYS HB2 . . 6.100 4.619 2.541 6.122 0.022 25 0 "[ . 1 . 2 .]" 1
1718 2 58 GLU HA 2 61 LYS HB3 . . 6.100 4.843 4.080 5.506 . 0 0 "[ . 1 . 2 .]" 1
1719 2 58 GLU HA 2 61 LYS QD . . 5.380 2.268 1.918 3.311 . 0 0 "[ . 1 . 2 .]" 1
1720 2 58 GLU QB 2 82 GLU QB . . 6.100 4.169 3.432 4.919 . 0 0 "[ . 1 . 2 .]" 1
1721 2 59 LYS H 2 59 LYS HD2 . . 6.100 5.409 4.227 5.952 . 0 0 "[ . 1 . 2 .]" 1
1722 2 59 LYS H 2 59 LYS QD . . 5.740 4.238 3.799 4.668 . 0 0 "[ . 1 . 2 .]" 1
1723 2 59 LYS H 2 59 LYS HD3 . . 6.100 4.502 3.942 5.424 . 0 0 "[ . 1 . 2 .]" 1
1724 2 59 LYS H 2 59 LYS QE . . 7.000 5.051 3.748 5.522 . 0 0 "[ . 1 . 2 .]" 1
1725 2 59 LYS H 2 60 MET H . . 5.100 2.700 2.366 2.908 . 0 0 "[ . 1 . 2 .]" 1
1726 2 59 LYS H 2 61 LYS H . . 4.300 4.327 4.186 4.364 0.064 13 0 "[ . 1 . 2 .]" 1
1727 2 59 LYS H 2 82 GLU QB . . 5.400 4.552 3.818 4.860 . 0 0 "[ . 1 . 2 .]" 1
1728 2 59 LYS HA 2 60 MET HA . . 5.200 4.867 4.739 4.949 . 0 0 "[ . 1 . 2 .]" 1
1729 2 59 LYS HA 2 62 SER H . . 5.400 3.592 3.207 4.027 . 0 0 "[ . 1 . 2 .]" 1
1730 2 59 LYS HA 2 62 SER QB . . 7.000 2.617 2.232 3.038 . 0 0 "[ . 1 . 2 .]" 1
1731 2 59 LYS HA 2 79 LEU HG . . 4.900 3.826 3.113 4.478 . 0 0 "[ . 1 . 2 .]" 1
1732 2 59 LYS HB2 2 60 MET H . . 5.300 3.292 2.490 3.891 . 0 0 "[ . 1 . 2 .]" 1
1733 2 59 LYS HB2 2 63 LEU QD . . 6.600 4.213 3.518 4.897 . 0 0 "[ . 1 . 2 .]" 1
1734 2 59 LYS HB3 2 60 MET H . . 5.700 2.717 2.324 3.612 . 0 0 "[ . 1 . 2 .]" 1
1735 2 59 LYS QD 2 79 LEU HA . . 6.980 2.577 2.134 3.298 . 0 0 "[ . 1 . 2 .]" 1
1736 2 59 LYS QD 2 79 LEU HG . . 3.280 2.545 2.117 2.965 . 0 0 "[ . 1 . 2 .]" 1
1737 2 59 LYS QD 2 82 GLU H . . 4.780 4.100 3.789 4.405 . 0 0 "[ . 1 . 2 .]" 1
1738 2 59 LYS QD 2 83 LEU H . . 4.580 3.326 2.922 3.776 . 0 0 "[ . 1 . 2 .]" 1
1739 2 59 LYS QD 2 83 LEU HA . . 6.780 4.296 3.610 4.867 . 0 0 "[ . 1 . 2 .]" 1
1740 2 59 LYS QD 2 83 LEU QD . . 8.750 3.676 2.056 4.552 . 0 0 "[ . 1 . 2 .]" 1
1741 2 59 LYS HD2 2 80 ILE HA . . 5.400 4.624 4.119 5.429 0.029 14 0 "[ . 1 . 2 .]" 1
1742 2 59 LYS HD3 2 80 ILE HA . . 5.400 5.156 4.241 5.522 0.122 4 0 "[ . 1 . 2 .]" 1
1743 2 59 LYS QE 2 79 LEU QB . . 4.100 3.329 3.261 3.385 . 0 0 "[ . 1 . 2 .]" 1
1744 2 59 LYS QE 2 79 LEU QD . . 10.500 3.874 2.734 4.369 . 0 0 "[ . 1 . 2 .]" 1
1745 2 59 LYS HG2 2 60 MET H . . 4.700 4.552 3.899 4.788 0.088 5 0 "[ . 1 . 2 .]" 1
1746 2 59 LYS HG2 2 79 LEU QD . . 7.000 3.150 2.186 3.645 . 0 0 "[ . 1 . 2 .]" 1
1747 2 59 LYS HG2 2 79 LEU HG . . 2.900 2.645 2.119 3.092 0.192 19 0 "[ . 1 . 2 .]" 1
1748 2 60 MET H 2 61 LYS H . . 4.800 2.887 2.622 3.072 . 0 0 "[ . 1 . 2 .]" 1
1749 2 60 MET H 2 61 LYS QG . . 6.180 4.620 4.126 5.586 . 0 0 "[ . 1 . 2 .]" 1
1750 2 60 MET H 2 62 SER H . . 6.100 4.326 3.906 4.648 . 0 0 "[ . 1 . 2 .]" 1
1751 2 60 MET H 2 63 LEU QD . . 6.600 3.814 3.326 4.498 . 0 0 "[ . 1 . 2 .]" 1
1752 2 60 MET HA 2 62 SER H . . 5.100 4.708 4.414 5.064 . 0 0 "[ . 1 . 2 .]" 1
1753 2 60 MET HA 2 63 LEU H . . 5.900 3.547 3.226 3.829 . 0 0 "[ . 1 . 2 .]" 1
1754 2 60 MET HA 2 63 LEU HB2 . . 6.100 2.998 2.596 3.516 . 0 0 "[ . 1 . 2 .]" 1
1755 2 60 MET HA 2 63 LEU QD . . 7.100 2.515 2.102 3.164 . 0 0 "[ . 1 . 2 .]" 1
1756 2 60 MET HA 2 64 ASP H . . 6.100 3.934 3.741 4.152 . 0 0 "[ . 1 . 2 .]" 1
1757 2 60 MET QG 2 61 LYS H . . 5.000 3.851 3.385 4.360 . 0 0 "[ . 1 . 2 .]" 1
1758 2 61 LYS H 2 61 LYS HB3 . . 4.100 2.978 2.312 3.679 . 0 0 "[ . 1 . 2 .]" 1
1759 2 61 LYS H 2 61 LYS HD2 . . 6.100 3.268 2.203 4.677 . 0 0 "[ . 1 . 2 .]" 1
1760 2 61 LYS H 2 61 LYS HD3 . . 6.100 3.940 2.377 4.797 . 0 0 "[ . 1 . 2 .]" 1
1761 2 61 LYS H 2 61 LYS QE . . 7.000 4.328 3.730 5.110 . 0 0 "[ . 1 . 2 .]" 1
1762 2 61 LYS H 2 62 SER H . . 4.800 2.757 2.480 2.904 . 0 0 "[ . 1 . 2 .]" 1
1763 2 61 LYS H 2 63 LEU H . . 6.100 4.227 4.078 4.408 . 0 0 "[ . 1 . 2 .]" 1
1764 2 61 LYS HA 2 62 SER QB . . 6.300 5.339 5.209 5.602 . 0 0 "[ . 1 . 2 .]" 1
1765 2 61 LYS HA 2 63 LEU H . . 6.100 4.364 4.018 4.590 . 0 0 "[ . 1 . 2 .]" 1
1766 2 61 LYS HA 2 64 ASP H . . 6.000 3.353 2.925 3.823 . 0 0 "[ . 1 . 2 .]" 1
1767 2 61 LYS HA 2 64 ASP HB2 . . 6.100 3.091 2.612 3.666 . 0 0 "[ . 1 . 2 .]" 1
1768 2 61 LYS HA 2 64 ASP HB3 . . 6.100 2.391 2.139 2.799 . 0 0 "[ . 1 . 2 .]" 1
1769 2 61 LYS HA 2 65 VAL H . . 5.600 3.896 3.471 4.972 . 0 0 "[ . 1 . 2 .]" 1
1770 2 61 LYS HB2 2 62 SER H . . 4.800 3.198 2.077 4.171 . 0 0 "[ . 1 . 2 .]" 1
1771 2 61 LYS HB3 2 62 SER H . . 4.800 3.696 3.135 4.282 . 0 0 "[ . 1 . 2 .]" 1
1772 2 61 LYS QD 2 62 SER H . . 4.260 3.822 3.650 3.901 . 0 0 "[ . 1 . 2 .]" 1
1773 2 61 LYS HD2 2 62 SER H . . 4.500 4.262 3.829 4.625 0.125 6 0 "[ . 1 . 2 .]" 1
1774 2 61 LYS HD3 2 62 SER H . . 4.500 4.387 4.107 4.604 0.104 17 0 "[ . 1 . 2 .]" 1
1775 2 62 SER H 2 63 LEU H . . 4.300 2.938 2.639 3.078 . 0 0 "[ . 1 . 2 .]" 1
1776 2 62 SER H 2 63 LEU QD . . 6.800 4.031 3.708 4.366 . 0 0 "[ . 1 . 2 .]" 1
1777 2 62 SER H 2 64 ASP H . . 4.400 4.373 4.035 4.456 0.056 10 0 "[ . 1 . 2 .]" 1
1778 2 62 SER H 2 65 VAL QG . . 6.960 4.397 4.109 4.887 . 0 0 "[ . 1 . 2 .]" 1
1779 2 62 SER HA 2 64 ASP H . . 6.100 4.766 4.390 4.975 . 0 0 "[ . 1 . 2 .]" 1
1780 2 62 SER HA 2 65 VAL H . . 6.100 3.953 3.584 4.309 . 0 0 "[ . 1 . 2 .]" 1
1781 2 62 SER HA 2 65 VAL HB . . 6.100 3.700 2.884 5.836 . 0 0 "[ . 1 . 2 .]" 1
1782 2 62 SER HA 2 65 VAL QG . . 7.660 2.922 2.397 3.238 . 0 0 "[ . 1 . 2 .]" 1
1783 2 62 SER QB 2 79 LEU QD . . 10.500 3.143 2.157 4.546 . 0 0 "[ . 1 . 2 .]" 1
1784 2 63 LEU H 2 63 LEU HG . . 5.600 4.156 3.964 4.348 . 0 0 "[ . 1 . 2 .]" 1
1785 2 63 LEU H 2 64 ASP H . . 4.800 2.633 2.276 2.756 . 0 0 "[ . 1 . 2 .]" 1
1786 2 63 LEU H 2 65 VAL H . . 6.100 4.344 4.116 4.553 . 0 0 "[ . 1 . 2 .]" 1
1787 2 63 LEU HA 2 65 VAL H . . 4.500 4.508 4.099 4.555 0.055 10 0 "[ . 1 . 2 .]" 1
1788 2 63 LEU HA 2 66 ASN H . . 6.100 4.231 3.833 4.613 . 0 0 "[ . 1 . 2 .]" 1
1789 2 63 LEU HA 2 67 GLN HA . . 6.100 3.216 2.387 3.820 . 0 0 "[ . 1 . 2 .]" 1
1790 2 63 LEU HB2 2 64 ASP H . . 5.400 2.636 2.357 2.963 . 0 0 "[ . 1 . 2 .]" 1
1791 2 63 LEU HB3 2 64 ASP H . . 5.400 3.445 3.003 3.782 . 0 0 "[ . 1 . 2 .]" 1
1792 2 63 LEU QD 2 64 ASP H . . 5.900 3.744 3.246 3.895 . 0 0 "[ . 1 . 2 .]" 1
1793 2 64 ASP H 2 65 VAL H . . 4.700 2.951 2.773 3.113 . 0 0 "[ . 1 . 2 .]" 1
1794 2 64 ASP HA 2 65 VAL H . . 3.600 3.554 3.508 3.592 . 0 0 "[ . 1 . 2 .]" 1
1795 2 64 ASP HA 2 66 ASN H . . 5.900 4.949 4.219 5.381 . 0 0 "[ . 1 . 2 .]" 1
1796 2 64 ASP HA 2 67 GLN QB . . 6.980 3.925 2.472 4.456 . 0 0 "[ . 1 . 2 .]" 1
1797 2 64 ASP HB2 2 65 VAL H . . 5.800 3.833 3.745 4.057 . 0 0 "[ . 1 . 2 .]" 1
1798 2 64 ASP HB3 2 65 VAL H . . 5.800 2.511 2.387 2.876 . 0 0 "[ . 1 . 2 .]" 1
1799 2 65 VAL H 2 65 VAL QG . . 4.240 2.106 1.883 2.277 . 0 0 "[ . 1 . 2 .]" 1
1800 2 65 VAL H 2 66 ASN H . . 5.600 3.159 2.868 3.444 . 0 0 "[ . 1 . 2 .]" 1
1801 2 65 VAL H 2 67 GLN H . . 6.100 4.577 4.446 4.814 . 0 0 "[ . 1 . 2 .]" 1
1802 2 65 VAL HB 2 66 ASN H . . 5.600 2.497 2.139 4.086 . 0 0 "[ . 1 . 2 .]" 1
1803 2 65 VAL QG 2 66 ASN H . . 3.660 2.523 1.793 2.726 . 0 0 "[ . 1 . 2 .]" 1
1804 2 65 VAL MG1 2 66 ASN H . . 4.400 2.790 2.241 3.807 . 0 0 "[ . 1 . 2 .]" 1
1805 2 65 VAL MG2 2 66 ASN H . . 4.400 3.548 1.797 3.800 . 0 0 "[ . 1 . 2 .]" 1
1806 2 66 ASN H 2 66 ASN HD21 . . 6.100 4.562 3.314 5.431 . 0 0 "[ . 1 . 2 .]" 1
1807 2 66 ASN H 2 66 ASN HD22 . . 6.100 5.474 4.633 6.243 0.143 14 0 "[ . 1 . 2 .]" 1
1808 2 66 ASN H 2 67 GLN H . . 3.600 2.765 2.462 3.033 . 0 0 "[ . 1 . 2 .]" 1
1809 2 66 ASN H 2 67 GLN HA . . 4.200 3.999 3.441 4.233 0.033 12 0 "[ . 1 . 2 .]" 1
1810 2 66 ASN H 2 69 SER QB . . 7.000 5.382 4.848 6.251 . 0 0 "[ . 1 . 2 .]" 1
1811 2 66 ASN HA 2 69 SER H . . 5.500 4.323 4.101 5.003 . 0 0 "[ . 1 . 2 .]" 1
1812 2 66 ASN QB 2 69 SER H . . 7.000 3.384 3.000 4.497 . 0 0 "[ . 1 . 2 .]" 1
1813 2 66 ASN QB 2 70 GLU H . . 7.000 6.161 5.610 6.339 . 0 0 "[ . 1 . 2 .]" 1
1814 2 67 GLN H 2 67 GLN HE21 . . 6.100 3.322 1.979 4.830 . 0 0 "[ . 1 . 2 .]" 1
1815 2 67 GLN H 2 67 GLN HE22 . . 6.100 4.076 2.530 5.848 . 0 0 "[ . 1 . 2 .]" 1
1816 2 67 GLN H 2 68 ASP H . . 5.000 2.908 2.642 3.061 . 0 0 "[ . 1 . 2 .]" 1
1817 2 67 GLN H 2 69 SER H . . 4.800 4.515 4.326 4.831 0.031 19 0 "[ . 1 . 2 .]" 1
1818 2 67 GLN HA 2 67 GLN HE21 . . 6.100 4.715 3.459 5.721 . 0 0 "[ . 1 . 2 .]" 1
1819 2 67 GLN HA 2 67 GLN HE22 . . 6.100 5.519 4.864 6.159 0.059 10 0 "[ . 1 . 2 .]" 1
1820 2 67 GLN HA 2 69 SER H . . 6.100 3.792 3.541 4.110 . 0 0 "[ . 1 . 2 .]" 1
1821 2 67 GLN QB 2 69 SER H . . 6.980 4.765 4.547 4.996 . 0 0 "[ . 1 . 2 .]" 1
1822 2 67 GLN HB2 2 68 ASP H . . 5.300 3.693 3.236 3.980 . 0 0 "[ . 1 . 2 .]" 1
1823 2 67 GLN HB3 2 68 ASP H . . 5.300 4.156 3.963 4.381 . 0 0 "[ . 1 . 2 .]" 1
1824 2 67 GLN QE 2 68 ASP H . . 4.370 2.902 2.206 3.958 . 0 0 "[ . 1 . 2 .]" 1
1825 2 67 GLN HG2 2 68 ASP H . . 4.000 3.179 2.042 4.137 0.137 7 0 "[ . 1 . 2 .]" 1
1826 2 67 GLN HG3 2 68 ASP H . . 4.000 3.287 2.041 4.061 0.061 13 0 "[ . 1 . 2 .]" 1
1827 2 68 ASP H 2 69 SER H . . 4.700 2.811 2.599 3.008 . 0 0 "[ . 1 . 2 .]" 1
1828 2 68 ASP H 2 69 SER HA . . 6.100 5.322 5.007 5.564 . 0 0 "[ . 1 . 2 .]" 1
1829 2 68 ASP HA 2 69 SER HA . . 6.100 4.851 4.553 5.025 . 0 0 "[ . 1 . 2 .]" 1
1830 2 68 ASP HA 2 69 SER QB . . 7.000 5.214 4.997 5.521 . 0 0 "[ . 1 . 2 .]" 1
1831 2 68 ASP HB2 2 69 SER H . . 6.100 3.812 2.905 4.270 . 0 0 "[ . 1 . 2 .]" 1
1832 2 68 ASP HB3 2 69 SER H . . 6.100 3.510 2.744 4.473 . 0 0 "[ . 1 . 2 .]" 1
1833 2 69 SER H 2 70 GLU H . . 5.400 3.939 2.740 4.663 . 0 0 "[ . 1 . 2 .]" 1
1834 2 69 SER HA 2 70 GLU QB . . 7.000 4.411 3.814 5.018 . 0 0 "[ . 1 . 2 .]" 1
1835 2 69 SER HA 2 70 GLU QG . . 6.380 4.348 3.272 5.790 . 0 0 "[ . 1 . 2 .]" 1
1836 2 69 SER QB 2 70 GLU HA . . 7.000 4.667 4.325 5.147 . 0 0 "[ . 1 . 2 .]" 1
1837 2 70 GLU H 2 71 LEU H . . 5.900 4.423 4.181 4.664 . 0 0 "[ . 1 . 2 .]" 1
1838 2 70 GLU QB 2 71 LEU HA . . 7.000 4.213 3.610 5.203 . 0 0 "[ . 1 . 2 .]" 1
1839 2 70 GLU HG2 2 71 LEU H . . 4.400 3.675 2.518 4.545 0.145 6 0 "[ . 1 . 2 .]" 1
1840 2 70 GLU HG3 2 71 LEU H . . 4.400 4.266 2.815 4.597 0.197 9 0 "[ . 1 . 2 .]" 1
1841 2 71 LEU H 2 72 LYS H . . 6.100 4.511 4.361 4.654 . 0 0 "[ . 1 . 2 .]" 1
1842 2 71 LEU HA 2 75 GLU H . . 6.100 5.591 5.268 6.113 0.013 22 0 "[ . 1 . 2 .]" 1
1843 2 71 LEU HA 2 75 GLU QB . . 7.000 3.497 2.956 4.020 . 0 0 "[ . 1 . 2 .]" 1
1844 2 71 LEU HB3 2 72 LYS H . . 6.100 3.475 2.356 4.019 . 0 0 "[ . 1 . 2 .]" 1
1845 2 71 LEU QD 2 72 LYS H . . 6.500 2.743 1.844 3.472 . 0 0 "[ . 1 . 2 .]" 1
1846 2 71 LEU QD 2 75 GLU H . . 7.300 4.207 3.637 4.972 . 0 0 "[ . 1 . 2 .]" 1
1847 2 72 LYS H 2 72 LYS QE . . 7.000 4.528 2.873 5.978 . 0 0 "[ . 1 . 2 .]" 1
1848 2 72 LYS H 2 73 PHE H . . 6.100 4.377 4.237 4.511 . 0 0 "[ . 1 . 2 .]" 1
1849 2 72 LYS H 2 75 GLU H . . 6.100 3.558 3.087 4.098 . 0 0 "[ . 1 . 2 .]" 1
1850 2 72 LYS H 2 75 GLU HA . . 6.100 5.258 4.825 5.683 . 0 0 "[ . 1 . 2 .]" 1
1851 2 72 LYS H 2 75 GLU QB . . 7.000 2.423 1.903 2.986 . 0 0 "[ . 1 . 2 .]" 1
1852 2 72 LYS H 2 75 GLU QG . . 5.600 3.710 2.340 5.018 . 0 0 "[ . 1 . 2 .]" 1
1853 2 72 LYS HA 2 74 ASN H . . 6.100 4.741 4.365 5.335 . 0 0 "[ . 1 . 2 .]" 1
1854 2 72 LYS QB 2 73 PHE H . . 7.000 2.483 2.181 3.146 . 0 0 "[ . 1 . 2 .]" 1
1855 2 72 LYS QB 2 74 ASN H . . 7.000 3.255 2.846 4.002 . 0 0 "[ . 1 . 2 .]" 1
1856 2 72 LYS QB 2 75 GLU H . . 7.000 3.363 2.846 3.798 . 0 0 "[ . 1 . 2 .]" 1
1857 2 73 PHE H 2 74 ASN H . . 5.900 3.084 2.848 3.457 . 0 0 "[ . 1 . 2 .]" 1
1858 2 73 PHE H 2 75 GLU H . . 6.100 4.576 4.258 5.053 . 0 0 "[ . 1 . 2 .]" 1
1859 2 74 ASN H 2 74 ASN HD21 . . 6.100 4.140 2.015 4.965 . 0 0 "[ . 1 . 2 .]" 1
1860 2 74 ASN H 2 74 ASN HD22 . . 6.100 5.011 3.088 5.903 . 0 0 "[ . 1 . 2 .]" 1
1861 2 74 ASN H 2 75 GLU H . . 5.400 2.848 2.540 3.187 . 0 0 "[ . 1 . 2 .]" 1
1862 2 74 ASN HA 2 77 TRP H . . 6.100 3.612 3.259 4.151 . 0 0 "[ . 1 . 2 .]" 1
1863 2 74 ASN HA 2 77 TRP QB . . 7.000 2.533 2.037 3.077 . 0 0 "[ . 1 . 2 .]" 1
1864 2 75 GLU H 2 77 TRP H . . 6.100 3.982 3.634 4.446 . 0 0 "[ . 1 . 2 .]" 1
1865 2 75 GLU H 2 78 ARG QG . . 5.800 4.839 4.097 5.223 . 0 0 "[ . 1 . 2 .]" 1
1866 2 75 GLU HA 2 77 TRP H . . 6.100 4.376 3.999 4.623 . 0 0 "[ . 1 . 2 .]" 1
1867 2 75 GLU HA 2 78 ARG H . . 5.000 3.829 2.946 4.880 . 0 0 "[ . 1 . 2 .]" 1
1868 2 75 GLU HA 2 78 ARG QB . . 7.000 3.716 2.519 5.015 . 0 0 "[ . 1 . 2 .]" 1
1869 2 75 GLU HA 2 78 ARG QG . . 6.000 2.833 2.154 3.749 . 0 0 "[ . 1 . 2 .]" 1
1870 2 75 GLU HA 2 79 LEU QB . . 7.000 5.192 4.225 6.259 . 0 0 "[ . 1 . 2 .]" 1
1871 2 77 TRP H 2 77 TRP HE3 . . 6.100 3.463 3.119 3.800 . 0 0 "[ . 1 . 2 .]" 1
1872 2 77 TRP H 2 78 ARG H . . 5.500 3.334 3.113 3.571 . 0 0 "[ . 1 . 2 .]" 1
1873 2 77 TRP HA 2 77 TRP HE1 . . 6.100 4.792 4.636 4.985 . 0 0 "[ . 1 . 2 .]" 1
1874 2 77 TRP HA 2 77 TRP HZ2 . . 6.500 6.102 5.959 6.294 . 0 0 "[ . 1 . 2 .]" 1
1875 2 77 TRP HA 2 77 TRP HZ3 . . 6.100 5.850 5.681 6.020 . 0 0 "[ . 1 . 2 .]" 1
1876 2 77 TRP HA 2 80 ILE H . . 5.900 3.618 3.453 3.916 . 0 0 "[ . 1 . 2 .]" 1
1877 2 77 TRP HA 2 80 ILE HB . . 6.100 5.483 5.120 5.746 . 0 0 "[ . 1 . 2 .]" 1
1878 2 77 TRP HA 2 80 ILE MD . . 5.900 3.415 3.215 3.688 . 0 0 "[ . 1 . 2 .]" 1
1879 2 77 TRP HA 2 80 ILE MG . . 5.600 3.486 2.842 3.914 . 0 0 "[ . 1 . 2 .]" 1
1880 2 77 TRP HA 2 81 GLY H . . 6.100 4.076 3.891 4.252 . 0 0 "[ . 1 . 2 .]" 1
1881 2 77 TRP QB 2 78 ARG H . . 6.900 2.044 1.951 2.161 . 0 0 "[ . 1 . 2 .]" 1
1882 2 77 TRP HD1 2 78 ARG H . . 4.900 3.920 3.460 4.290 . 0 0 "[ . 1 . 2 .]" 1
1883 2 77 TRP HD1 2 78 ARG HA . . 6.100 4.103 3.563 4.646 . 0 0 "[ . 1 . 2 .]" 1
1884 2 77 TRP HD1 2 78 ARG QB . . 7.000 5.269 4.359 6.090 . 0 0 "[ . 1 . 2 .]" 1
1885 2 77 TRP HD1 2 78 ARG QD . . 7.300 6.464 6.006 6.635 . 0 0 "[ . 1 . 2 .]" 1
1886 2 77 TRP HE3 2 80 ILE MG . . 7.500 6.017 5.320 6.290 . 0 0 "[ . 1 . 2 .]" 1
1887 2 77 TRP HZ2 2 80 ILE MD . . 7.200 5.354 5.030 5.787 . 0 0 "[ . 1 . 2 .]" 1
1888 2 78 ARG H 2 79 LEU H . . 6.100 3.141 2.995 3.267 . 0 0 "[ . 1 . 2 .]" 1
1889 2 78 ARG H 2 80 ILE H . . 5.500 4.688 4.534 5.086 . 0 0 "[ . 1 . 2 .]" 1
1890 2 78 ARG HA 2 82 GLU H . . 6.100 4.129 3.822 4.935 . 0 0 "[ . 1 . 2 .]" 1
1891 2 79 LEU H 2 80 ILE H . . 4.600 2.924 2.673 3.128 . 0 0 "[ . 1 . 2 .]" 1
1892 2 79 LEU H 2 81 GLY H . . 6.100 4.007 3.653 4.164 . 0 0 "[ . 1 . 2 .]" 1
1893 2 79 LEU QD 2 81 GLY H . . 7.400 5.061 4.595 5.338 . 0 0 "[ . 1 . 2 .]" 1
1894 2 80 ILE H 2 80 ILE MD . . 5.000 4.061 3.933 4.172 . 0 0 "[ . 1 . 2 .]" 1
1895 2 80 ILE H 2 81 GLY H . . 5.500 2.524 2.436 2.642 . 0 0 "[ . 1 . 2 .]" 1
1896 2 80 ILE H 2 83 LEU H . . 6.100 4.587 4.413 4.853 . 0 0 "[ . 1 . 2 .]" 1
1897 2 80 ILE HA 2 82 GLU H . . 6.100 4.240 3.621 4.519 . 0 0 "[ . 1 . 2 .]" 1
1898 2 80 ILE HA 2 83 LEU H . . 6.100 2.769 2.475 2.987 . 0 0 "[ . 1 . 2 .]" 1
1899 2 80 ILE HA 2 83 LEU QD . . 7.970 2.870 2.100 3.785 . 0 0 "[ . 1 . 2 .]" 1
1900 2 80 ILE HA 2 84 ALA H . . 6.100 3.915 3.636 4.084 . 0 0 "[ . 1 . 2 .]" 1
1901 2 80 ILE HB 2 81 GLY H . . 5.600 4.227 4.025 4.401 . 0 0 "[ . 1 . 2 .]" 1
1902 2 80 ILE HB 2 83 LEU H . . 5.600 4.745 4.440 4.986 . 0 0 "[ . 1 . 2 .]" 1
1903 2 80 ILE MG 2 81 GLY H . . 4.700 3.847 3.699 3.974 . 0 0 "[ . 1 . 2 .]" 1
1904 2 81 GLY H 2 82 GLU H . . 4.300 2.819 2.661 3.028 . 0 0 "[ . 1 . 2 .]" 1
1905 2 81 GLY HA2 2 84 ALA H . . 6.100 3.502 3.013 3.941 . 0 0 "[ . 1 . 2 .]" 1
1906 2 82 GLU H 2 83 LEU H . . 5.000 2.821 2.340 2.957 . 0 0 "[ . 1 . 2 .]" 1
1907 2 82 GLU H 2 84 ALA H . . 6.100 4.397 4.099 4.557 . 0 0 "[ . 1 . 2 .]" 1
1908 2 82 GLU HA 2 83 LEU HA . . 6.100 4.807 4.660 4.899 . 0 0 "[ . 1 . 2 .]" 1
1909 2 82 GLU HA 2 84 ALA H . . 6.100 4.574 4.362 4.855 . 0 0 "[ . 1 . 2 .]" 1
1910 2 82 GLU HA 2 85 LYS H . . 6.100 3.270 2.944 3.711 . 0 0 "[ . 1 . 2 .]" 1
1911 2 82 GLU HA 2 85 LYS QB . . 7.000 3.246 2.189 4.353 . 0 0 "[ . 1 . 2 .]" 1
1912 2 82 GLU QG 2 83 LEU H . . 5.800 4.290 4.111 4.689 . 0 0 "[ . 1 . 2 .]" 1
1913 2 83 LEU H 2 83 LEU MD1 . . 5.000 3.941 3.021 4.239 . 0 0 "[ . 1 . 2 .]" 1
1914 2 83 LEU H 2 83 LEU MD2 . . 5.000 3.814 2.278 4.240 . 0 0 "[ . 1 . 2 .]" 1
1915 2 83 LEU H 2 84 ALA H . . 5.200 3.029 2.866 3.162 . 0 0 "[ . 1 . 2 .]" 1
1916 2 83 LEU H 2 86 GLU H . . 6.100 4.721 4.551 5.139 . 0 0 "[ . 1 . 2 .]" 1
1917 2 83 LEU HA 2 86 GLU H . . 6.100 3.191 2.710 3.499 . 0 0 "[ . 1 . 2 .]" 1
1918 2 83 LEU QD 2 84 ALA H . . 5.870 3.698 2.902 4.310 . 0 0 "[ . 1 . 2 .]" 1
1919 2 84 ALA H 2 84 ALA MB . . 3.200 2.213 2.118 2.262 . 0 0 "[ . 1 . 2 .]" 1
1920 2 84 ALA H 2 85 LYS H . . 5.400 2.993 2.826 3.137 . 0 0 "[ . 1 . 2 .]" 1
1921 2 84 ALA H 2 86 GLU H . . 6.100 4.447 4.069 4.839 . 0 0 "[ . 1 . 2 .]" 1
1922 2 84 ALA HA 2 86 GLU H . . 6.100 4.652 4.156 5.031 . 0 0 "[ . 1 . 2 .]" 1
1923 2 84 ALA HA 2 87 ILE H . . 6.100 4.180 3.654 4.826 . 0 0 "[ . 1 . 2 .]" 1
1924 2 84 ALA HA 2 87 ILE HB . . 6.100 5.542 4.226 6.119 0.019 18 0 "[ . 1 . 2 .]" 1
1925 2 84 ALA MB 2 85 LYS H . . 4.000 2.866 2.571 3.178 . 0 0 "[ . 1 . 2 .]" 1
1926 2 85 LYS H 2 85 LYS QE . . 7.000 4.953 4.164 6.097 . 0 0 "[ . 1 . 2 .]" 1
1927 2 85 LYS H 2 86 GLU H . . 5.400 2.427 2.219 2.746 . 0 0 "[ . 1 . 2 .]" 1
1928 2 85 LYS H 2 86 GLU QG . . 6.600 4.893 3.643 5.882 . 0 0 "[ . 1 . 2 .]" 1
1929 2 85 LYS HA 2 88 ARG H . . 6.700 6.348 5.516 6.769 0.069 10 0 "[ . 1 . 2 .]" 1
1930 2 85 LYS QD 2 86 GLU H . . 5.100 4.094 2.606 4.651 . 0 0 "[ . 1 . 2 .]" 1
1931 2 86 GLU H 2 87 ILE H . . 4.800 3.111 2.831 3.548 . 0 0 "[ . 1 . 2 .]" 1
1932 2 86 GLU HA 2 88 ARG H . . 6.100 5.376 4.575 6.144 0.044 20 0 "[ . 1 . 2 .]" 1
1933 2 87 ILE H 2 87 ILE MD . . 5.300 4.238 2.833 4.396 . 0 0 "[ . 1 . 2 .]" 1
1934 2 87 ILE H 2 87 ILE MG . . 4.800 2.397 1.948 3.818 . 0 0 "[ . 1 . 2 .]" 1
1935 2 87 ILE H 2 88 ARG H . . 5.200 4.329 3.943 4.578 . 0 0 "[ . 1 . 2 .]" 1
1936 2 87 ILE HA 2 89 LYS H . . 6.100 4.714 4.187 5.855 . 0 0 "[ . 1 . 2 .]" 1
1937 2 87 ILE MD 2 88 ARG H . . 4.800 2.756 2.018 4.052 . 0 0 "[ . 1 . 2 .]" 1
1938 2 87 ILE MG 2 89 LYS H . . 5.100 3.385 2.357 4.301 . 0 0 "[ . 1 . 2 .]" 1
1939 2 88 ARG H 2 89 LYS H . . 4.500 3.809 3.522 4.485 . 0 0 "[ . 1 . 2 .]" 1
1940 2 89 LYS H 2 89 LYS HD2 . . 6.100 3.237 2.009 4.948 . 0 0 "[ . 1 . 2 .]" 1
1941 2 89 LYS H 2 89 LYS QD . . 5.940 2.946 1.904 4.281 . 0 0 "[ . 1 . 2 .]" 1
1942 2 89 LYS H 2 89 LYS HD3 . . 6.100 3.738 2.113 5.696 . 0 0 "[ . 1 . 2 .]" 1
1943 2 89 LYS H 2 89 LYS QE . . 7.000 4.042 2.213 5.544 . 0 0 "[ . 1 . 2 .]" 1
1944 2 89 LYS HA 2 92 ASP H . . 6.100 4.763 3.187 6.143 0.043 7 0 "[ . 1 . 2 .]" 1
1945 2 89 LYS QB 2 89 LYS QD . . 3.220 2.344 2.059 2.623 . 0 0 "[ . 1 . 2 .]" 1
1946 2 89 LYS QB 2 93 LEU H . . 6.980 4.457 3.023 6.267 . 0 0 "[ . 1 . 2 .]" 1
1947 2 89 LYS QB 2 93 LEU QD . . 7.250 2.881 2.056 4.749 . 0 0 "[ . 1 . 2 .]" 1
1948 2 89 LYS HB2 2 93 LEU HA . . 6.100 4.540 2.462 6.200 0.100 19 0 "[ . 1 . 2 .]" 1
1949 2 89 LYS HB3 2 93 LEU HA . . 6.100 4.718 4.063 6.190 0.090 11 0 "[ . 1 . 2 .]" 1
1950 2 89 LYS QG 2 93 LEU HA . . 5.250 4.213 3.453 4.722 . 0 0 "[ . 1 . 2 .]" 1
1951 2 89 LYS QG 2 93 LEU HG . . 4.180 3.354 2.050 3.864 . 0 0 "[ . 1 . 2 .]" 1
1952 2 89 LYS HG2 2 93 LEU HA . . 6.100 5.118 3.704 6.181 0.081 22 0 "[ . 1 . 2 .]" 1
1953 2 89 LYS HG3 2 93 LEU HA . . 6.100 4.760 3.585 6.125 0.025 9 0 "[ . 1 . 2 .]" 1
1954 2 92 ASP H 2 93 LEU H . . 3.700 3.301 2.480 3.756 0.056 15 0 "[ . 1 . 2 .]" 1
1955 2 92 ASP H 2 93 LEU HA . . 4.600 4.433 3.385 4.689 0.089 14 0 "[ . 1 . 2 .]" 1
1956 2 92 ASP H 2 93 LEU QB . . 7.000 4.838 3.968 5.590 . 0 0 "[ . 1 . 2 .]" 1
1957 2 92 ASP H 2 95 ILE HB . . 6.100 5.384 3.789 6.209 0.109 17 0 "[ . 1 . 2 .]" 1
1958 2 92 ASP HA 2 95 ILE HB . . 6.100 4.291 2.539 6.325 0.225 17 0 "[ . 1 . 2 .]" 1
1959 2 92 ASP QB 2 95 ILE H . . 7.000 3.741 3.243 4.467 . 0 0 "[ . 1 . 2 .]" 1
1960 2 93 LEU HA 2 96 ARG QB . . 7.200 6.217 4.666 6.573 . 0 0 "[ . 1 . 2 .]" 1
1961 2 94 LYS H 2 94 LYS HD2 . . 6.100 4.632 3.187 5.402 . 0 0 "[ . 1 . 2 .]" 1
1962 2 94 LYS H 2 94 LYS HD3 . . 6.100 4.548 2.818 5.823 . 0 0 "[ . 1 . 2 .]" 1
1963 2 94 LYS H 2 95 ILE H . . 3.900 2.774 2.374 3.209 . 0 0 "[ . 1 . 2 .]" 1
1964 2 94 LYS HB2 2 95 ILE H . . 6.100 3.760 3.033 4.622 . 0 0 "[ . 1 . 2 .]" 1
1965 2 94 LYS HB3 2 94 LYS QD . . 3.730 2.877 2.233 3.435 . 0 0 "[ . 1 . 2 .]" 1
1966 2 94 LYS HB3 2 95 ILE H . . 5.900 3.999 2.998 4.507 . 0 0 "[ . 1 . 2 .]" 1
1967 2 95 ILE H 2 95 ILE MD . . 4.900 3.498 2.001 4.155 . 0 0 "[ . 1 . 2 .]" 1
1968 2 95 ILE HB 2 96 ARG H . . 6.100 3.481 2.779 4.244 . 0 0 "[ . 1 . 2 .]" 1
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