NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397768 |
1t17   |
6120 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1t17
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 2204
_Distance_constraint_stats_list.Viol_count 2816
_Distance_constraint_stats_list.Viol_total 2092.138
_Distance_constraint_stats_list.Viol_max 0.516
_Distance_constraint_stats_list.Viol_rms 0.0129
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0024
_Distance_constraint_stats_list.Viol_average_violations_only 0.0371
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 1.526 0.234 1 0 "[ . 1 . 2]"
1 2 HIS 0.351 0.068 11 0 "[ . 1 . 2]"
1 3 ARG 0.126 0.058 20 0 "[ . 1 . 2]"
1 4 HIS 0.671 0.058 20 0 "[ . 1 . 2]"
1 5 VAL 0.620 0.082 5 0 "[ . 1 . 2]"
1 6 VAL 1.204 0.124 10 0 "[ . 1 . 2]"
1 7 THR 0.068 0.029 16 0 "[ . 1 . 2]"
1 8 LYS 1.456 0.175 15 0 "[ . 1 . 2]"
1 9 VAL 1.183 0.175 15 0 "[ . 1 . 2]"
1 10 LEU 0.127 0.050 10 0 "[ . 1 . 2]"
1 11 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 TYR 0.191 0.051 6 0 "[ . 1 . 2]"
1 13 THR 0.219 0.039 18 0 "[ . 1 . 2]"
1 14 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ASP 1.241 0.087 18 0 "[ . 1 . 2]"
1 16 GLN 0.530 0.087 18 0 "[ . 1 . 2]"
1 17 LEU 2.165 0.199 20 0 "[ . 1 . 2]"
1 18 PHE 0.236 0.043 7 0 "[ . 1 . 2]"
1 19 GLU 3.154 0.160 19 0 "[ . 1 . 2]"
1 20 LEU 3.525 0.199 20 0 "[ . 1 . 2]"
1 21 VAL 2.991 0.138 6 0 "[ . 1 . 2]"
1 22 GLY 1.920 0.113 17 0 "[ . 1 . 2]"
1 23 ASP 2.471 0.183 17 0 "[ . 1 . 2]"
1 24 VAL 2.393 0.194 9 0 "[ . 1 . 2]"
1 25 ASP 1.150 0.194 9 0 "[ . 1 . 2]"
1 26 ALA 0.585 0.259 11 0 "[ . 1 . 2]"
1 27 TYR 3.333 0.259 11 0 "[ . 1 . 2]"
1 28 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 VAL 2.614 0.226 19 0 "[ . 1 . 2]"
1 32 PRO 0.345 0.082 17 0 "[ . 1 . 2]"
1 33 TRP 5.918 0.350 8 0 "[ . 1 . 2]"
1 34 ILE 0.153 0.049 3 0 "[ . 1 . 2]"
1 35 THR 2.323 0.140 18 0 "[ . 1 . 2]"
1 36 GLY 2.619 0.165 5 0 "[ . 1 . 2]"
1 37 MET 1.228 0.086 6 0 "[ . 1 . 2]"
1 38 ARG 1.380 0.068 6 0 "[ . 1 . 2]"
1 39 THR 0.706 0.068 6 0 "[ . 1 . 2]"
1 40 TRP 0.641 0.071 13 0 "[ . 1 . 2]"
1 41 ASN 0.591 0.055 4 0 "[ . 1 . 2]"
1 42 GLY 1.278 0.100 4 0 "[ . 1 . 2]"
1 43 ARG 0.258 0.076 10 0 "[ . 1 . 2]"
1 44 VAL 0.123 0.039 15 0 "[ . 1 . 2]"
1 45 ASP 1.227 0.131 11 0 "[ . 1 . 2]"
1 46 GLY 1.184 0.079 10 0 "[ . 1 . 2]"
1 47 ALA 0.908 0.079 10 0 "[ . 1 . 2]"
1 48 VAL 0.802 0.062 4 0 "[ . 1 . 2]"
1 49 SER 1.129 0.088 10 0 "[ . 1 . 2]"
1 50 THR 0.131 0.076 10 0 "[ . 1 . 2]"
1 51 VAL 3.230 0.100 4 0 "[ . 1 . 2]"
1 52 ASP 0.497 0.063 5 0 "[ . 1 . 2]"
1 53 ALA 0.615 0.071 13 0 "[ . 1 . 2]"
1 54 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ALA 1.028 0.049 14 0 "[ . 1 . 2]"
1 56 GLN 1.934 0.165 5 0 "[ . 1 . 2]"
1 57 VAL 1.139 0.099 10 0 "[ . 1 . 2]"
1 58 GLY 1.680 0.140 18 0 "[ . 1 . 2]"
1 60 SER 0.507 0.048 7 0 "[ . 1 . 2]"
1 61 PHE 0.507 0.048 7 0 "[ . 1 . 2]"
1 62 LEU 1.239 0.214 13 0 "[ . 1 . 2]"
1 63 ARG 0.072 0.036 6 0 "[ . 1 . 2]"
1 64 GLU 0.716 0.065 1 0 "[ . 1 . 2]"
1 65 LYS 2.495 0.140 17 0 "[ . 1 . 2]"
1 66 PHE 3.038 0.140 17 0 "[ . 1 . 2]"
1 67 ALA 0.534 0.044 2 0 "[ . 1 . 2]"
1 68 THR 1.180 0.175 6 0 "[ . 1 . 2]"
1 69 ARG 0.120 0.052 14 0 "[ . 1 . 2]"
1 70 VAL 1.124 0.090 12 0 "[ . 1 . 2]"
1 71 ARG 0.974 0.090 3 0 "[ . 1 . 2]"
1 72 ARG 0.378 0.078 17 0 "[ . 1 . 2]"
1 73 ASP 1.368 0.088 10 0 "[ . 1 . 2]"
1 74 LYS 0.229 0.061 12 0 "[ . 1 . 2]"
1 75 ASP 0.800 0.117 4 0 "[ . 1 . 2]"
1 76 ALA 0.752 0.117 4 0 "[ . 1 . 2]"
1 77 ARG 1.456 0.097 6 0 "[ . 1 . 2]"
1 78 SER 3.884 0.097 6 0 "[ . 1 . 2]"
1 79 ILE 3.128 0.142 9 0 "[ . 1 . 2]"
1 80 ASP 2.472 0.142 9 0 "[ . 1 . 2]"
1 81 VAL 0.991 0.084 2 0 "[ . 1 . 2]"
1 82 SER 0.467 0.061 8 0 "[ . 1 . 2]"
1 83 LEU 1.614 0.175 6 0 "[ . 1 . 2]"
1 84 LEU 1.620 0.276 15 0 "[ . 1 . 2]"
1 85 TYR 3.153 0.276 15 0 "[ . 1 . 2]"
1 86 GLY 0.873 0.105 15 0 "[ . 1 . 2]"
1 87 PRO 0.186 0.167 20 0 "[ . 1 . 2]"
1 88 PHE 0.561 0.167 20 0 "[ . 1 . 2]"
1 89 LYS 0.466 0.089 7 0 "[ . 1 . 2]"
1 90 ARG 0.921 0.084 19 0 "[ . 1 . 2]"
1 91 LEU 0.186 0.056 19 0 "[ . 1 . 2]"
1 92 ASN 1.071 0.117 11 0 "[ . 1 . 2]"
1 93 ASN 0.888 0.084 2 0 "[ . 1 . 2]"
1 94 GLY 0.956 0.167 17 0 "[ . 1 . 2]"
1 95 TRP 1.255 0.167 17 0 "[ . 1 . 2]"
1 96 ARG 0.943 0.115 8 0 "[ . 1 . 2]"
1 97 PHE 0.656 0.081 17 0 "[ . 1 . 2]"
1 98 MET 0.312 0.072 10 0 "[ . 1 . 2]"
1 99 PRO 1.159 0.115 12 0 "[ . 1 . 2]"
1 100 GLU 2.235 0.152 6 0 "[ . 1 . 2]"
1 101 GLY 1.733 0.143 2 0 "[ . 1 . 2]"
1 102 ASP 1.970 0.143 2 0 "[ . 1 . 2]"
1 103 ALA 0.749 0.042 10 0 "[ . 1 . 2]"
1 104 THR 1.815 0.152 6 0 "[ . 1 . 2]"
1 105 ARG 0.885 0.305 10 0 "[ . 1 . 2]"
1 106 VAL 0.371 0.042 20 0 "[ . 1 . 2]"
1 107 GLU 1.246 0.196 10 0 "[ . 1 . 2]"
1 108 PHE 1.878 0.196 10 0 "[ . 1 . 2]"
1 109 VAL 0.942 0.074 2 0 "[ . 1 . 2]"
1 110 ILE 0.705 0.101 2 0 "[ . 1 . 2]"
1 111 GLU 0.397 0.059 8 0 "[ . 1 . 2]"
1 112 PHE 0.694 0.117 15 0 "[ . 1 . 2]"
1 113 ALA 1.903 0.234 1 0 "[ . 1 . 2]"
1 114 PHE 0.564 0.083 19 0 "[ . 1 . 2]"
1 115 LYS 1.589 0.127 13 0 "[ . 1 . 2]"
1 116 SER 0.956 0.063 3 0 "[ . 1 . 2]"
1 117 ALA 1.292 0.082 13 0 "[ . 1 . 2]"
1 118 LEU 1.131 0.082 13 0 "[ . 1 . 2]"
1 119 LEU 0.813 0.054 13 0 "[ . 1 . 2]"
1 120 ASP 1.782 0.116 8 0 "[ . 1 . 2]"
1 121 ALA 1.070 0.116 8 0 "[ . 1 . 2]"
1 122 MET 0.873 0.083 8 0 "[ . 1 . 2]"
1 123 LEU 0.644 0.083 8 0 "[ . 1 . 2]"
1 124 ALA 0.003 0.003 5 0 "[ . 1 . 2]"
1 125 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 ASN 0.941 0.066 10 0 "[ . 1 . 2]"
1 127 VAL 1.271 0.076 3 0 "[ . 1 . 2]"
1 128 ASP 1.729 0.076 3 0 "[ . 1 . 2]"
1 129 ARG 0.530 0.061 20 0 "[ . 1 . 2]"
1 130 ALA 2.945 0.125 8 0 "[ . 1 . 2]"
1 131 ALA 1.277 0.073 2 0 "[ . 1 . 2]"
1 132 GLY 1.108 0.099 18 0 "[ . 1 . 2]"
1 133 LYS 5.925 0.232 13 0 "[ . 1 . 2]"
1 134 LEU 3.392 0.516 19 1 "[ . 1 . +2]"
1 135 ILE 3.460 0.516 19 1 "[ . 1 . +2]"
1 136 ALA 0.086 0.031 2 0 "[ . 1 . 2]"
1 137 CYS 2.135 0.188 18 0 "[ . 1 . 2]"
1 138 PHE 0.481 0.128 19 0 "[ . 1 . 2]"
1 139 GLU 1.183 0.105 6 0 "[ . 1 . 2]"
1 140 ALA 2.129 0.105 6 0 "[ . 1 . 2]"
1 141 ARG 1.480 0.088 18 0 "[ . 1 . 2]"
1 142 ALA 0.518 0.046 9 0 "[ . 1 . 2]"
1 143 GLN 0.983 0.084 18 0 "[ . 1 . 2]"
1 144 GLN 0.408 0.048 3 0 "[ . 1 . 2]"
1 145 LEU 0.616 0.038 9 0 "[ . 1 . 2]"
1 146 HIS 0.673 0.118 3 0 "[ . 1 . 2]"
1 147 GLY 0.228 0.090 3 0 "[ . 1 . 2]"
1 148 ALA 0.174 0.050 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 HIS H . . 2.830 2.719 2.335 2.898 0.068 11 0 "[ . 1 . 2]" 1
2 1 1 MET HA 1 113 ALA HA . . 4.790 4.607 2.543 5.024 0.234 1 0 "[ . 1 . 2]" 1
3 1 1 MET HA 1 113 ALA MB . . 6.220 4.482 2.929 5.058 . 0 0 "[ . 1 . 2]" 1
4 1 1 MET QB 1 2 HIS H . . 3.430 2.172 1.929 2.839 . 0 0 "[ . 1 . 2]" 1
5 1 1 MET HB2 1 2 HIS H . . 3.800 3.551 2.922 3.822 0.022 18 0 "[ . 1 . 2]" 1
6 1 1 MET HB3 1 2 HIS H . . 3.800 2.242 1.938 3.853 0.053 16 0 "[ . 1 . 2]" 1
7 1 1 MET QG 1 2 HIS H . . 5.570 3.192 1.916 4.596 . 0 0 "[ . 1 . 2]" 1
8 1 2 HIS H 1 2 HIS HD2 . . 4.690 2.369 1.977 3.869 . 0 0 "[ . 1 . 2]" 1
9 1 2 HIS H 1 3 ARG H . . 5.030 4.505 4.097 4.648 . 0 0 "[ . 1 . 2]" 1
10 1 2 HIS H 1 112 PHE H . . 4.630 4.377 3.776 4.682 0.052 5 0 "[ . 1 . 2]" 1
11 1 2 HIS H 1 113 ALA MB . . 6.530 4.752 3.949 5.354 . 0 0 "[ . 1 . 2]" 1
12 1 2 HIS H 1 124 ALA MB . . 6.530 5.395 5.185 5.475 . 0 0 "[ . 1 . 2]" 1
13 1 2 HIS HA 1 3 ARG H . . 2.430 2.238 2.186 2.428 . 0 0 "[ . 1 . 2]" 1
14 1 2 HIS QB 1 3 ARG H . . 6.380 3.230 2.549 3.490 . 0 0 "[ . 1 . 2]" 1
15 1 2 HIS QB 1 112 PHE H . . 6.380 4.349 3.534 5.745 . 0 0 "[ . 1 . 2]" 1
16 1 2 HIS HD2 1 113 ALA HA . . 5.500 4.344 4.032 4.614 . 0 0 "[ . 1 . 2]" 1
17 1 2 HIS HD2 1 113 ALA MB . . 6.530 5.263 4.834 5.411 . 0 0 "[ . 1 . 2]" 1
18 1 3 ARG H 1 3 ARG HB2 . . 3.730 3.168 2.896 3.333 . 0 0 "[ . 1 . 2]" 1
19 1 3 ARG H 1 3 ARG QB . . 3.380 2.478 2.332 2.577 . 0 0 "[ . 1 . 2]" 1
20 1 3 ARG H 1 3 ARG HB3 . . 3.730 2.590 2.451 2.709 . 0 0 "[ . 1 . 2]" 1
21 1 3 ARG H 1 3 ARG HG2 . . 5.500 4.317 4.180 4.474 . 0 0 "[ . 1 . 2]" 1
22 1 3 ARG H 1 3 ARG HG3 . . 5.500 4.736 4.548 4.999 . 0 0 "[ . 1 . 2]" 1
23 1 3 ARG H 1 4 HIS H . . 4.940 4.334 4.146 4.467 . 0 0 "[ . 1 . 2]" 1
24 1 3 ARG HA 1 4 HIS H . . 2.400 2.270 2.225 2.405 0.005 18 0 "[ . 1 . 2]" 1
25 1 3 ARG HA 1 110 ILE H . . 5.500 4.716 4.131 5.030 . 0 0 "[ . 1 . 2]" 1
26 1 3 ARG HA 1 111 GLU HA . . 3.420 2.574 2.280 2.764 . 0 0 "[ . 1 . 2]" 1
27 1 3 ARG HA 1 111 GLU QB . . 6.380 4.078 2.421 4.542 . 0 0 "[ . 1 . 2]" 1
28 1 3 ARG HA 1 111 GLU HG2 . . 5.500 2.777 1.993 4.751 . 0 0 "[ . 1 . 2]" 1
29 1 3 ARG HA 1 111 GLU HG3 . . 5.500 3.535 2.679 5.291 . 0 0 "[ . 1 . 2]" 1
30 1 3 ARG HA 1 112 PHE H . . 4.540 3.936 3.508 4.366 . 0 0 "[ . 1 . 2]" 1
31 1 3 ARG QB 1 4 HIS H . . 4.310 3.781 3.492 3.921 . 0 0 "[ . 1 . 2]" 1
32 1 3 ARG HB2 1 4 HIS H . . 4.510 4.229 3.843 4.392 . 0 0 "[ . 1 . 2]" 1
33 1 3 ARG HB3 1 4 HIS H . . 4.510 4.263 3.989 4.453 . 0 0 "[ . 1 . 2]" 1
34 1 3 ARG QG 1 4 HIS H . . 3.200 2.573 1.912 2.989 . 0 0 "[ . 1 . 2]" 1
35 1 3 ARG QG 1 5 VAL QG . . 7.530 3.268 2.446 4.619 . 0 0 "[ . 1 . 2]" 1
36 1 3 ARG QG 1 111 GLU HA . . 6.380 3.599 3.051 4.069 . 0 0 "[ . 1 . 2]" 1
37 1 3 ARG QG 1 111 GLU QB . . 6.670 3.776 2.426 4.290 . 0 0 "[ . 1 . 2]" 1
38 1 3 ARG QG 1 111 GLU QG . . 6.320 2.021 1.774 3.570 . 0 0 "[ . 1 . 2]" 1
39 1 3 ARG HG2 1 4 HIS H . . 3.610 2.879 1.918 3.528 . 0 0 "[ . 1 . 2]" 1
40 1 3 ARG HG2 1 5 VAL MG1 . . 9.430 4.668 3.693 5.774 . 0 0 "[ . 1 . 2]" 1
41 1 3 ARG HG2 1 5 VAL MG2 . . 9.430 3.973 2.495 6.013 . 0 0 "[ . 1 . 2]" 1
42 1 3 ARG HG2 1 111 GLU HG2 . . 7.250 3.876 2.684 5.423 . 0 0 "[ . 1 . 2]" 1
43 1 3 ARG HG2 1 111 GLU HG3 . . 7.250 3.776 2.525 6.676 . 0 0 "[ . 1 . 2]" 1
44 1 3 ARG HG3 1 4 HIS H . . 3.610 3.222 2.106 3.668 0.058 20 0 "[ . 1 . 2]" 1
45 1 3 ARG HG3 1 5 VAL MG1 . . 9.430 5.645 5.053 6.167 . 0 0 "[ . 1 . 2]" 1
46 1 3 ARG HG3 1 5 VAL MG2 . . 9.430 4.988 3.677 6.669 . 0 0 "[ . 1 . 2]" 1
47 1 3 ARG HG3 1 111 GLU HG2 . . 7.250 2.533 1.987 3.733 . 0 0 "[ . 1 . 2]" 1
48 1 3 ARG HG3 1 111 GLU HG3 . . 7.250 2.346 2.008 5.021 . 0 0 "[ . 1 . 2]" 1
49 1 4 HIS H 1 4 HIS HA . . 2.900 2.920 2.900 2.930 0.030 10 0 "[ . 1 . 2]" 1
50 1 4 HIS H 1 4 HIS HB2 . . 3.980 2.396 2.152 2.680 . 0 0 "[ . 1 . 2]" 1
51 1 4 HIS H 1 4 HIS HB3 . . 3.980 3.321 3.214 3.455 . 0 0 "[ . 1 . 2]" 1
52 1 4 HIS H 1 110 ILE H . . 3.920 3.134 2.734 3.636 . 0 0 "[ . 1 . 2]" 1
53 1 4 HIS H 1 110 ILE MG . . 6.530 4.225 3.831 4.507 . 0 0 "[ . 1 . 2]" 1
54 1 4 HIS H 1 111 GLU HA . . 3.860 3.712 3.070 3.910 0.050 18 0 "[ . 1 . 2]" 1
55 1 4 HIS H 1 127 VAL MG1 . . 5.810 4.625 4.347 4.733 . 0 0 "[ . 1 . 2]" 1
56 1 4 HIS H 1 127 VAL MG2 . . 6.530 5.134 4.764 5.319 . 0 0 "[ . 1 . 2]" 1
57 1 4 HIS HA 1 5 VAL H . . 2.590 2.229 2.204 2.282 . 0 0 "[ . 1 . 2]" 1
58 1 4 HIS HA 1 5 VAL MG1 . . 6.530 4.550 3.208 5.408 . 0 0 "[ . 1 . 2]" 1
59 1 4 HIS HA 1 5 VAL QG . . 5.370 3.225 3.035 3.483 . 0 0 "[ . 1 . 2]" 1
60 1 4 HIS HA 1 5 VAL MG2 . . 6.530 4.065 3.053 5.418 . 0 0 "[ . 1 . 2]" 1
61 1 4 HIS QB 1 5 VAL H . . 4.990 3.389 3.204 3.490 . 0 0 "[ . 1 . 2]" 1
62 1 4 HIS QB 1 5 VAL QG . . 7.030 4.329 4.224 4.404 . 0 0 "[ . 1 . 2]" 1
63 1 4 HIS QB 1 6 VAL MG1 . . 7.410 5.198 5.095 5.243 . 0 0 "[ . 1 . 2]" 1
64 1 4 HIS QB 1 110 ILE MD . . 6.150 1.987 1.684 2.615 . 0 0 "[ . 1 . 2]" 1
65 1 4 HIS QB 1 127 VAL MG1 . . 6.630 2.327 2.136 2.535 . 0 0 "[ . 1 . 2]" 1
66 1 4 HIS QB 1 127 VAL MG2 . . 4.780 3.251 2.888 3.463 . 0 0 "[ . 1 . 2]" 1
67 1 4 HIS HB2 1 5 VAL MG1 . . 8.280 6.319 5.484 6.895 . 0 0 "[ . 1 . 2]" 1
68 1 4 HIS HB2 1 5 VAL MG2 . . 8.280 5.952 5.238 6.965 . 0 0 "[ . 1 . 2]" 1
69 1 4 HIS HB2 1 110 ILE MD . . 6.370 2.023 1.776 2.658 . 0 0 "[ . 1 . 2]" 1
70 1 4 HIS HB2 1 110 ILE MG . . 5.010 4.040 3.901 4.133 . 0 0 "[ . 1 . 2]" 1
71 1 4 HIS HB2 1 127 VAL MG2 . . 5.010 3.508 3.029 3.819 . 0 0 "[ . 1 . 2]" 1
72 1 4 HIS HB3 1 5 VAL MG1 . . 8.280 5.468 4.695 5.943 . 0 0 "[ . 1 . 2]" 1
73 1 4 HIS HB3 1 5 VAL MG2 . . 8.280 5.265 4.716 5.955 . 0 0 "[ . 1 . 2]" 1
74 1 4 HIS HB3 1 110 ILE MD . . 6.370 3.033 2.093 3.880 . 0 0 "[ . 1 . 2]" 1
75 1 4 HIS HB3 1 110 ILE MG . . 5.010 3.573 3.291 3.757 . 0 0 "[ . 1 . 2]" 1
76 1 4 HIS HB3 1 127 VAL MG2 . . 5.010 3.855 3.635 4.014 . 0 0 "[ . 1 . 2]" 1
77 1 4 HIS HD2 1 6 VAL MG1 . . 6.530 5.198 4.857 5.315 . 0 0 "[ . 1 . 2]" 1
78 1 4 HIS HD2 1 6 VAL MG2 . . 6.530 3.806 3.519 4.133 . 0 0 "[ . 1 . 2]" 1
79 1 4 HIS HD2 1 127 VAL MG1 . . 6.400 2.165 1.972 2.368 . 0 0 "[ . 1 . 2]" 1
80 1 4 HIS HD2 1 127 VAL MG2 . . 5.500 4.397 4.197 4.550 . 0 0 "[ . 1 . 2]" 1
81 1 4 HIS HD2 1 131 ALA MB . . 6.530 4.656 4.126 5.036 . 0 0 "[ . 1 . 2]" 1
82 1 5 VAL H 1 5 VAL HB . . 3.210 2.871 2.559 3.266 0.056 5 0 "[ . 1 . 2]" 1
83 1 5 VAL H 1 5 VAL MG1 . . 4.760 3.040 1.844 3.845 . 0 0 "[ . 1 . 2]" 1
84 1 5 VAL H 1 5 VAL QG . . 4.030 2.068 1.838 2.419 . 0 0 "[ . 1 . 2]" 1
85 1 5 VAL H 1 5 VAL MG2 . . 4.760 2.788 1.987 3.710 . 0 0 "[ . 1 . 2]" 1
86 1 5 VAL H 1 6 VAL H . . 4.790 4.517 4.468 4.574 . 0 0 "[ . 1 . 2]" 1
87 1 5 VAL H 1 127 VAL MG1 . . 6.340 5.274 5.099 5.350 . 0 0 "[ . 1 . 2]" 1
88 1 5 VAL HA 1 6 VAL H . . 2.400 2.279 2.208 2.355 . 0 0 "[ . 1 . 2]" 1
89 1 5 VAL HA 1 6 VAL MG1 . . 6.530 5.278 5.143 5.393 . 0 0 "[ . 1 . 2]" 1
90 1 5 VAL HA 1 6 VAL MG2 . . 4.510 3.063 2.934 3.247 . 0 0 "[ . 1 . 2]" 1
91 1 5 VAL HA 1 109 VAL HA . . 3.080 2.739 2.371 3.080 . 0 0 "[ . 1 . 2]" 1
92 1 5 VAL HA 1 110 ILE H . . 4.040 3.622 3.453 3.897 . 0 0 "[ . 1 . 2]" 1
93 1 5 VAL HB 1 6 VAL H . . 3.860 3.879 3.834 3.942 0.082 5 0 "[ . 1 . 2]" 1
94 1 5 VAL HB 1 6 VAL MG2 . . 6.530 4.704 4.456 5.032 . 0 0 "[ . 1 . 2]" 1
95 1 5 VAL QG 1 6 VAL H . . 4.890 2.298 1.969 2.656 . 0 0 "[ . 1 . 2]" 1
96 1 5 VAL QG 1 7 THR HA . . 8.090 4.554 4.218 4.871 . 0 0 "[ . 1 . 2]" 1
97 1 5 VAL QG 1 7 THR MG . . 9.120 4.530 4.159 5.034 . 0 0 "[ . 1 . 2]" 1
98 1 5 VAL QG 1 108 PHE H . . 8.090 4.002 3.468 4.326 . 0 0 "[ . 1 . 2]" 1
99 1 5 VAL QG 1 108 PHE QB . . 8.970 4.825 4.446 5.071 . 0 0 "[ . 1 . 2]" 1
100 1 5 VAL QG 1 108 PHE QD . . 10.210 5.840 5.304 6.188 . 0 0 "[ . 1 . 2]" 1
101 1 5 VAL MG1 1 6 VAL H . . 5.230 3.035 1.973 4.322 . 0 0 "[ . 1 . 2]" 1
102 1 5 VAL MG2 1 6 VAL H . . 5.230 3.444 1.974 4.389 . 0 0 "[ . 1 . 2]" 1
103 1 6 VAL H 1 6 VAL HB . . 3.170 3.004 2.776 3.160 . 0 0 "[ . 1 . 2]" 1
104 1 6 VAL H 1 6 VAL MG1 . . 4.790 3.964 3.907 3.999 . 0 0 "[ . 1 . 2]" 1
105 1 6 VAL H 1 6 VAL MG2 . . 4.700 2.537 2.372 2.724 . 0 0 "[ . 1 . 2]" 1
106 1 6 VAL H 1 7 THR H . . 4.910 4.060 3.792 4.317 . 0 0 "[ . 1 . 2]" 1
107 1 6 VAL H 1 108 PHE H . . 3.920 2.968 2.601 3.280 . 0 0 "[ . 1 . 2]" 1
108 1 6 VAL H 1 109 VAL HA . . 3.730 3.719 3.613 3.781 0.051 11 0 "[ . 1 . 2]" 1
109 1 6 VAL H 1 109 VAL QG . . 6.690 3.793 3.156 4.469 . 0 0 "[ . 1 . 2]" 1
110 1 6 VAL HA 1 6 VAL MG2 . . 3.550 2.627 2.543 2.764 . 0 0 "[ . 1 . 2]" 1
111 1 6 VAL HA 1 7 THR H . . 2.400 2.198 2.182 2.254 . 0 0 "[ . 1 . 2]" 1
112 1 6 VAL HA 1 7 THR HA . . 4.910 4.391 4.384 4.410 . 0 0 "[ . 1 . 2]" 1
113 1 6 VAL HA 1 7 THR HB . . 4.970 4.366 4.195 4.524 . 0 0 "[ . 1 . 2]" 1
114 1 6 VAL HA 1 7 THR MG . . 6.530 5.419 5.344 5.468 . 0 0 "[ . 1 . 2]" 1
115 1 6 VAL HB 1 7 THR H . . 4.380 4.175 3.668 4.399 0.019 1 0 "[ . 1 . 2]" 1
116 1 6 VAL HB 1 108 PHE H . . 3.270 3.209 2.850 3.394 0.124 10 0 "[ . 1 . 2]" 1
117 1 6 VAL HB 1 108 PHE HB2 . . 4.290 3.195 1.904 4.231 . 0 0 "[ . 1 . 2]" 1
118 1 6 VAL HB 1 108 PHE QB . . 3.890 2.125 1.852 2.569 . 0 0 "[ . 1 . 2]" 1
119 1 6 VAL HB 1 108 PHE HB3 . . 4.290 2.349 1.988 2.965 . 0 0 "[ . 1 . 2]" 1
120 1 6 VAL MG1 1 7 THR H . . 4.170 3.010 2.535 3.305 . 0 0 "[ . 1 . 2]" 1
121 1 6 VAL MG1 1 7 THR HA . . 6.530 4.313 4.137 4.521 . 0 0 "[ . 1 . 2]" 1
122 1 6 VAL MG1 1 7 THR HB . . 6.530 5.089 4.754 5.298 . 0 0 "[ . 1 . 2]" 1
123 1 6 VAL MG1 1 8 LYS H . . 6.530 4.822 4.555 5.271 . 0 0 "[ . 1 . 2]" 1
124 1 6 VAL MG1 1 8 LYS HB2 . . 6.530 5.255 4.192 5.391 . 0 0 "[ . 1 . 2]" 1
125 1 6 VAL MG1 1 8 LYS HB3 . . 6.530 3.959 3.667 5.215 . 0 0 "[ . 1 . 2]" 1
126 1 6 VAL MG1 1 108 PHE H . . 5.540 4.466 4.171 4.681 . 0 0 "[ . 1 . 2]" 1
127 1 6 VAL MG1 1 108 PHE HB2 . . 6.530 4.347 3.408 5.400 . 0 0 "[ . 1 . 2]" 1
128 1 6 VAL MG1 1 108 PHE QB . . 5.850 3.497 3.122 4.013 . 0 0 "[ . 1 . 2]" 1
129 1 6 VAL MG1 1 108 PHE HB3 . . 6.530 3.806 3.203 4.359 . 0 0 "[ . 1 . 2]" 1
130 1 6 VAL MG1 1 131 ALA H . . 6.090 4.846 4.537 5.003 . 0 0 "[ . 1 . 2]" 1
131 1 6 VAL MG1 1 131 ALA MB . . 6.100 2.108 1.839 2.404 . 0 0 "[ . 1 . 2]" 1
132 1 6 VAL MG2 1 7 THR H . . 5.260 4.400 4.342 4.441 . 0 0 "[ . 1 . 2]" 1
133 1 6 VAL MG2 1 108 PHE H . . 6.030 4.068 3.719 4.456 . 0 0 "[ . 1 . 2]" 1
134 1 6 VAL MG2 1 108 PHE QB . . 6.170 2.897 2.252 3.396 . 0 0 "[ . 1 . 2]" 1
135 1 6 VAL MG2 1 108 PHE QD . . 8.650 3.462 2.448 4.691 . 0 0 "[ . 1 . 2]" 1
136 1 6 VAL MG2 1 131 ALA MB . . 6.350 2.344 1.966 2.620 . 0 0 "[ . 1 . 2]" 1
137 1 6 VAL MG2 1 135 ILE MD . . 7.560 3.962 3.402 5.103 . 0 0 "[ . 1 . 2]" 1
138 1 6 VAL MG2 1 135 ILE QG . . 7.410 4.934 4.317 5.406 . 0 0 "[ . 1 . 2]" 1
139 1 7 THR H 1 7 THR HB . . 3.020 2.429 2.331 2.500 . 0 0 "[ . 1 . 2]" 1
140 1 7 THR H 1 7 THR MG . . 4.760 3.724 3.652 3.778 . 0 0 "[ . 1 . 2]" 1
141 1 7 THR H 1 8 LYS H . . 4.570 4.344 4.187 4.511 . 0 0 "[ . 1 . 2]" 1
142 1 7 THR HA 1 7 THR MG . . 3.610 2.539 2.451 2.660 . 0 0 "[ . 1 . 2]" 1
143 1 7 THR HA 1 8 LYS H . . 2.400 2.166 2.150 2.220 . 0 0 "[ . 1 . 2]" 1
144 1 7 THR HA 1 8 LYS QB . . 5.850 4.345 3.973 4.610 . 0 0 "[ . 1 . 2]" 1
145 1 7 THR HA 1 106 VAL H . . 4.760 4.600 4.419 4.789 0.029 16 0 "[ . 1 . 2]" 1
146 1 7 THR HA 1 107 GLU HA . . 3.050 2.493 2.211 2.933 . 0 0 "[ . 1 . 2]" 1
147 1 7 THR HA 1 108 PHE H . . 3.730 3.508 3.252 3.697 . 0 0 "[ . 1 . 2]" 1
148 1 7 THR HB 1 8 LYS H . . 4.660 4.471 4.218 4.602 . 0 0 "[ . 1 . 2]" 1
149 1 7 THR MG 1 8 LYS H . . 4.570 2.809 2.424 3.224 . 0 0 "[ . 1 . 2]" 1
150 1 7 THR MG 1 9 VAL HA . . 6.160 5.012 4.904 5.070 . 0 0 "[ . 1 . 2]" 1
151 1 7 THR MG 1 108 PHE H . . 6.530 5.237 4.855 5.407 . 0 0 "[ . 1 . 2]" 1
152 1 8 LYS H 1 8 LYS HB2 . . 4.140 3.754 3.068 3.923 . 0 0 "[ . 1 . 2]" 1
153 1 8 LYS H 1 8 LYS QB . . 3.680 3.013 2.598 3.216 . 0 0 "[ . 1 . 2]" 1
154 1 8 LYS H 1 8 LYS HB3 . . 4.140 3.205 2.705 3.899 . 0 0 "[ . 1 . 2]" 1
155 1 8 LYS H 1 106 VAL H . . 3.270 3.061 2.831 3.273 0.003 20 0 "[ . 1 . 2]" 1
156 1 8 LYS H 1 106 VAL HB . . 3.830 3.594 3.062 3.833 0.003 1 0 "[ . 1 . 2]" 1
157 1 8 LYS H 1 106 VAL MG1 . . 5.540 4.326 3.804 4.582 . 0 0 "[ . 1 . 2]" 1
158 1 8 LYS H 1 106 VAL MG2 . . 6.530 4.797 4.496 5.007 . 0 0 "[ . 1 . 2]" 1
159 1 8 LYS H 1 107 GLU HA . . 3.830 3.690 3.507 3.878 0.048 17 0 "[ . 1 . 2]" 1
160 1 8 LYS HA 1 8 LYS QD . . 4.920 3.913 3.516 4.284 . 0 0 "[ . 1 . 2]" 1
161 1 8 LYS HA 1 9 VAL H . . 2.710 2.453 2.349 2.561 . 0 0 "[ . 1 . 2]" 1
162 1 8 LYS HA 1 9 VAL HB . . 4.510 4.278 4.134 4.411 . 0 0 "[ . 1 . 2]" 1
163 1 8 LYS HA 1 9 VAL MG1 . . 6.530 4.451 3.478 5.413 . 0 0 "[ . 1 . 2]" 1
164 1 8 LYS HA 1 9 VAL QG . . 5.430 3.512 3.278 3.786 . 0 0 "[ . 1 . 2]" 1
165 1 8 LYS HA 1 9 VAL MG2 . . 6.530 4.490 3.306 5.396 . 0 0 "[ . 1 . 2]" 1
166 1 8 LYS QB 1 9 VAL H . . 3.540 2.579 2.398 3.533 . 0 0 "[ . 1 . 2]" 1
167 1 8 LYS QB 1 10 LEU H . . 6.380 5.326 4.910 5.620 . 0 0 "[ . 1 . 2]" 1
168 1 8 LYS QB 1 106 VAL HB . . 5.250 4.326 2.677 4.766 . 0 0 "[ . 1 . 2]" 1
169 1 8 LYS QB 1 135 ILE MD . . 5.520 2.322 1.842 3.380 . 0 0 "[ . 1 . 2]" 1
170 1 8 LYS QB 1 135 ILE MG . . 4.150 2.392 1.977 2.736 . 0 0 "[ . 1 . 2]" 1
171 1 8 LYS HB2 1 9 VAL H . . 3.830 2.661 2.422 3.930 0.100 15 0 "[ . 1 . 2]" 1
172 1 8 LYS HB2 1 106 VAL HB . . 5.500 4.872 3.602 5.446 . 0 0 "[ . 1 . 2]" 1
173 1 8 LYS HB2 1 135 ILE HB . . 5.500 5.365 4.553 5.526 0.026 2 0 "[ . 1 . 2]" 1
174 1 8 LYS HB2 1 135 ILE MD . . 6.220 3.420 1.887 4.082 . 0 0 "[ . 1 . 2]" 1
175 1 8 LYS HB2 1 135 ILE MG . . 4.920 2.710 2.278 2.990 . 0 0 "[ . 1 . 2]" 1
176 1 8 LYS HB3 1 9 VAL H . . 3.830 3.821 2.580 4.005 0.175 15 0 "[ . 1 . 2]" 1
177 1 8 LYS HB3 1 106 VAL HB . . 5.500 4.960 2.699 5.340 . 0 0 "[ . 1 . 2]" 1
178 1 8 LYS HB3 1 135 ILE HB . . 5.500 4.907 4.501 5.613 0.113 15 0 "[ . 1 . 2]" 1
179 1 8 LYS HB3 1 135 ILE MD . . 6.220 2.436 1.956 4.340 . 0 0 "[ . 1 . 2]" 1
180 1 8 LYS HB3 1 135 ILE MG . . 4.920 2.701 2.084 3.387 . 0 0 "[ . 1 . 2]" 1
181 1 8 LYS QD 1 9 VAL H . . 5.880 4.268 3.163 5.033 . 0 0 "[ . 1 . 2]" 1
182 1 8 LYS QD 1 106 VAL MG1 . . 5.950 3.486 2.596 4.231 . 0 0 "[ . 1 . 2]" 1
183 1 8 LYS QD 1 106 VAL MG2 . . 5.890 3.744 2.563 4.258 . 0 0 "[ . 1 . 2]" 1
184 1 8 LYS QD 1 135 ILE HA . . 6.380 4.356 3.040 5.586 . 0 0 "[ . 1 . 2]" 1
185 1 8 LYS QD 1 135 ILE MD . . 6.970 2.751 1.933 4.185 . 0 0 "[ . 1 . 2]" 1
186 1 8 LYS QD 1 135 ILE MG . . 5.570 2.624 1.724 3.607 . 0 0 "[ . 1 . 2]" 1
187 1 8 LYS QG 1 9 VAL H . . 4.580 3.658 1.986 4.257 . 0 0 "[ . 1 . 2]" 1
188 1 8 LYS QG 1 106 VAL HB . . 6.380 2.521 1.916 4.909 . 0 0 "[ . 1 . 2]" 1
189 1 8 LYS QG 1 135 ILE MD . . 6.910 2.982 1.927 3.863 . 0 0 "[ . 1 . 2]" 1
190 1 8 LYS QG 1 135 ILE MG . . 6.190 2.853 2.035 3.692 . 0 0 "[ . 1 . 2]" 1
191 1 9 VAL H 1 9 VAL HB . . 3.270 2.925 2.591 3.244 . 0 0 "[ . 1 . 2]" 1
192 1 9 VAL H 1 9 VAL MG1 . . 4.640 2.889 2.043 3.821 . 0 0 "[ . 1 . 2]" 1
193 1 9 VAL H 1 9 VAL QG . . 4.000 2.497 2.036 3.016 . 0 0 "[ . 1 . 2]" 1
194 1 9 VAL H 1 9 VAL MG2 . . 4.640 3.524 2.991 3.940 . 0 0 "[ . 1 . 2]" 1
195 1 9 VAL H 1 10 LEU H . . 4.570 4.230 4.091 4.303 . 0 0 "[ . 1 . 2]" 1
196 1 9 VAL H 1 10 LEU QD . . 8.100 2.888 2.630 3.128 . 0 0 "[ . 1 . 2]" 1
197 1 9 VAL H 1 135 ILE MG . . 6.310 4.699 4.341 4.989 . 0 0 "[ . 1 . 2]" 1
198 1 9 VAL HA 1 10 LEU H . . 2.490 2.194 2.182 2.217 . 0 0 "[ . 1 . 2]" 1
199 1 9 VAL HA 1 104 THR H . . 4.790 4.656 4.406 4.810 0.020 16 0 "[ . 1 . 2]" 1
200 1 9 VAL HA 1 105 ARG HA . . 2.990 2.328 1.991 2.728 . 0 0 "[ . 1 . 2]" 1
201 1 9 VAL HA 1 106 VAL H . . 3.700 3.275 3.096 3.405 . 0 0 "[ . 1 . 2]" 1
202 1 9 VAL HB 1 10 LEU H . . 4.910 4.354 4.208 4.490 . 0 0 "[ . 1 . 2]" 1
203 1 9 VAL QG 1 10 LEU H . . 4.220 2.625 2.464 2.852 . 0 0 "[ . 1 . 2]" 1
204 1 9 VAL QG 1 103 ALA H . . 7.030 4.470 3.817 4.844 . 0 0 "[ . 1 . 2]" 1
205 1 9 VAL QG 1 103 ALA MB . . 6.620 2.164 1.840 2.442 . 0 0 "[ . 1 . 2]" 1
206 1 9 VAL QG 1 104 THR H . . 5.760 3.292 3.043 3.475 . 0 0 "[ . 1 . 2]" 1
207 1 9 VAL QG 1 105 ARG QB . . 7.450 2.861 1.941 3.707 . 0 0 "[ . 1 . 2]" 1
208 1 9 VAL QG 1 106 VAL H . . 8.090 3.998 2.867 4.557 . 0 0 "[ . 1 . 2]" 1
209 1 9 VAL MG1 1 10 LEU H . . 4.950 3.446 2.489 4.107 . 0 0 "[ . 1 . 2]" 1
210 1 9 VAL MG1 1 103 ALA MB . . 7.560 3.043 1.844 3.930 . 0 0 "[ . 1 . 2]" 1
211 1 9 VAL MG2 1 10 LEU H . . 4.950 3.250 2.484 4.070 . 0 0 "[ . 1 . 2]" 1
212 1 9 VAL MG2 1 103 ALA MB . . 7.560 3.049 1.881 4.246 . 0 0 "[ . 1 . 2]" 1
213 1 10 LEU H 1 10 LEU QB . . 3.610 2.744 2.502 2.945 . 0 0 "[ . 1 . 2]" 1
214 1 10 LEU H 1 10 LEU HG . . 3.950 2.828 2.562 3.058 . 0 0 "[ . 1 . 2]" 1
215 1 10 LEU H 1 11 PRO QD . . 6.260 4.019 3.899 4.094 . 0 0 "[ . 1 . 2]" 1
216 1 10 LEU H 1 103 ALA MB . . 6.530 3.731 3.238 4.281 . 0 0 "[ . 1 . 2]" 1
217 1 10 LEU H 1 104 THR H . . 3.270 3.199 2.990 3.320 0.050 10 0 "[ . 1 . 2]" 1
218 1 10 LEU H 1 104 THR MG . . 4.450 2.839 2.600 3.229 . 0 0 "[ . 1 . 2]" 1
219 1 10 LEU H 1 105 ARG HA . . 4.200 3.598 3.268 4.059 . 0 0 "[ . 1 . 2]" 1
220 1 10 LEU HA 1 10 LEU QD . . 4.050 2.060 1.921 2.510 . 0 0 "[ . 1 . 2]" 1
221 1 10 LEU HA 1 10 LEU HG . . 3.920 3.346 3.228 3.462 . 0 0 "[ . 1 . 2]" 1
222 1 10 LEU QB 1 11 PRO QD . . 5.310 2.928 2.674 3.155 . 0 0 "[ . 1 . 2]" 1
223 1 10 LEU QB 1 12 TYR H . . 5.790 3.437 3.166 3.840 . 0 0 "[ . 1 . 2]" 1
224 1 10 LEU QB 1 106 VAL MG2 . . 7.250 4.065 3.534 4.718 . 0 0 "[ . 1 . 2]" 1
225 1 10 LEU HB2 1 11 PRO HD2 . . 5.500 4.331 3.965 4.625 . 0 0 "[ . 1 . 2]" 1
226 1 10 LEU HB2 1 11 PRO HD3 . . 5.500 4.714 4.531 4.839 . 0 0 "[ . 1 . 2]" 1
227 1 10 LEU HB2 1 12 TYR QD . . 7.640 2.832 2.156 3.612 . 0 0 "[ . 1 . 2]" 1
228 1 10 LEU HB2 1 12 TYR QE . . 7.630 4.377 2.211 5.763 . 0 0 "[ . 1 . 2]" 1
229 1 10 LEU HB3 1 11 PRO HD2 . . 5.500 3.126 2.830 3.402 . 0 0 "[ . 1 . 2]" 1
230 1 10 LEU HB3 1 11 PRO HD3 . . 5.500 3.938 3.663 4.173 . 0 0 "[ . 1 . 2]" 1
231 1 10 LEU HB3 1 12 TYR QD . . 7.640 2.271 1.956 3.226 . 0 0 "[ . 1 . 2]" 1
232 1 10 LEU HB3 1 12 TYR QE . . 7.630 3.040 2.058 4.142 . 0 0 "[ . 1 . 2]" 1
233 1 10 LEU QD 1 11 PRO QD . . 5.320 2.975 2.736 3.239 . 0 0 "[ . 1 . 2]" 1
234 1 10 LEU QD 1 12 TYR H . . 8.100 4.812 4.581 5.160 . 0 0 "[ . 1 . 2]" 1
235 1 10 LEU QD 1 12 TYR QD . . 6.930 2.906 2.380 3.828 . 0 0 "[ . 1 . 2]" 1
236 1 10 LEU QD 1 12 TYR QE . . 7.460 3.128 2.263 4.031 . 0 0 "[ . 1 . 2]" 1
237 1 10 LEU QD 1 106 VAL HB . . 6.140 4.300 3.837 4.563 . 0 0 "[ . 1 . 2]" 1
238 1 10 LEU QD 1 106 VAL MG2 . . 8.410 3.496 3.094 3.789 . 0 0 "[ . 1 . 2]" 1
239 1 10 LEU QD 1 139 GLU HA . . 4.780 2.662 2.327 3.138 . 0 0 "[ . 1 . 2]" 1
240 1 10 LEU QD 1 139 GLU HB2 . . 3.860 2.810 2.736 2.913 . 0 0 "[ . 1 . 2]" 1
241 1 10 LEU QD 1 139 GLU HB3 . . 5.460 3.885 3.771 3.971 . 0 0 "[ . 1 . 2]" 1
242 1 10 LEU QD 1 139 GLU QG . . 4.330 1.970 1.795 2.327 . 0 0 "[ . 1 . 2]" 1
243 1 10 LEU QD 1 142 ALA MB . . 9.130 3.236 2.799 3.775 . 0 0 "[ . 1 . 2]" 1
244 1 10 LEU MD1 1 11 PRO HD2 . . 6.530 4.846 4.525 4.998 . 0 0 "[ . 1 . 2]" 1
245 1 10 LEU MD1 1 11 PRO HD3 . . 6.530 5.390 5.165 5.489 . 0 0 "[ . 1 . 2]" 1
246 1 10 LEU MD1 1 12 TYR QD . . 7.270 3.007 2.395 3.984 . 0 0 "[ . 1 . 2]" 1
247 1 10 LEU MD1 1 12 TYR QE . . 7.850 3.444 2.308 4.579 . 0 0 "[ . 1 . 2]" 1
248 1 10 LEU MD1 1 139 GLU H . . 6.530 3.783 3.470 4.215 . 0 0 "[ . 1 . 2]" 1
249 1 10 LEU MD1 1 139 GLU HA . . 5.320 2.727 2.371 3.262 . 0 0 "[ . 1 . 2]" 1
250 1 10 LEU MD1 1 139 GLU HB2 . . 4.260 3.225 3.020 3.385 . 0 0 "[ . 1 . 2]" 1
251 1 10 LEU MD1 1 139 GLU HG2 . . 5.130 3.409 2.432 4.036 . 0 0 "[ . 1 . 2]" 1
252 1 10 LEU MD1 1 139 GLU HG3 . . 5.130 2.905 2.267 3.580 . 0 0 "[ . 1 . 2]" 1
253 1 10 LEU MD2 1 11 PRO HD2 . . 6.530 3.366 3.016 3.646 . 0 0 "[ . 1 . 2]" 1
254 1 10 LEU MD2 1 11 PRO HD3 . . 6.530 3.420 3.214 3.804 . 0 0 "[ . 1 . 2]" 1
255 1 10 LEU MD2 1 12 TYR QD . . 7.270 4.075 3.761 4.957 . 0 0 "[ . 1 . 2]" 1
256 1 10 LEU MD2 1 12 TYR QE . . 7.850 3.754 3.165 4.679 . 0 0 "[ . 1 . 2]" 1
257 1 10 LEU MD2 1 139 GLU H . . 6.530 4.586 4.244 4.929 . 0 0 "[ . 1 . 2]" 1
258 1 10 LEU MD2 1 139 GLU HA . . 5.320 3.781 3.378 4.125 . 0 0 "[ . 1 . 2]" 1
259 1 10 LEU MD2 1 139 GLU HB2 . . 4.260 3.099 3.009 3.225 . 0 0 "[ . 1 . 2]" 1
260 1 10 LEU MD2 1 139 GLU HG2 . . 5.130 3.254 2.523 3.748 . 0 0 "[ . 1 . 2]" 1
261 1 10 LEU MD2 1 139 GLU HG3 . . 5.130 2.074 1.889 2.617 . 0 0 "[ . 1 . 2]" 1
262 1 10 LEU HG 1 104 THR MG . . 5.190 4.112 3.946 4.204 . 0 0 "[ . 1 . 2]" 1
263 1 11 PRO HA 1 12 TYR H . . 2.740 2.520 2.380 2.617 . 0 0 "[ . 1 . 2]" 1
264 1 11 PRO HA 1 103 ALA MB . . 4.230 2.098 1.897 2.597 . 0 0 "[ . 1 . 2]" 1
265 1 11 PRO QB 1 103 ALA MB . . 5.730 2.208 1.892 2.718 . 0 0 "[ . 1 . 2]" 1
266 1 11 PRO HB2 1 103 ALA MB . . 6.160 3.577 3.279 4.123 . 0 0 "[ . 1 . 2]" 1
267 1 11 PRO HB3 1 103 ALA MB . . 6.160 2.230 1.903 2.757 . 0 0 "[ . 1 . 2]" 1
268 1 12 TYR H 1 12 TYR HA . . 2.930 2.925 2.810 2.944 0.014 12 0 "[ . 1 . 2]" 1
269 1 12 TYR H 1 13 THR H . . 4.600 4.427 4.356 4.526 . 0 0 "[ . 1 . 2]" 1
270 1 12 TYR H 1 103 ALA MB . . 5.190 3.900 3.505 4.240 . 0 0 "[ . 1 . 2]" 1
271 1 12 TYR H 1 104 THR H . . 3.170 3.081 2.892 3.221 0.051 6 0 "[ . 1 . 2]" 1
272 1 12 TYR H 1 104 THR MG . . 5.040 3.779 3.267 4.118 . 0 0 "[ . 1 . 2]" 1
273 1 12 TYR HA 1 13 THR H . . 2.870 2.595 2.429 2.715 . 0 0 "[ . 1 . 2]" 1
274 1 12 TYR QB 1 13 THR H . . 4.240 2.265 2.016 2.593 . 0 0 "[ . 1 . 2]" 1
275 1 12 TYR QD 1 13 THR H . . 7.640 3.629 3.093 3.891 . 0 0 "[ . 1 . 2]" 1
276 1 12 TYR QD 1 16 GLN HG2 . . 7.640 5.005 3.505 5.943 . 0 0 "[ . 1 . 2]" 1
277 1 12 TYR QD 1 16 GLN HG3 . . 7.640 4.576 3.382 5.693 . 0 0 "[ . 1 . 2]" 1
278 1 12 TYR QD 1 142 ALA MB . . 6.810 2.847 2.422 3.464 . 0 0 "[ . 1 . 2]" 1
279 1 12 TYR QD 1 146 HIS HB2 . . 7.640 4.666 3.113 6.248 . 0 0 "[ . 1 . 2]" 1
280 1 12 TYR QD 1 146 HIS HB3 . . 7.640 5.098 3.546 6.093 . 0 0 "[ . 1 . 2]" 1
281 1 12 TYR QE 1 16 GLN HG2 . . 7.630 6.201 2.754 7.028 . 0 0 "[ . 1 . 2]" 1
282 1 12 TYR QE 1 16 GLN HG3 . . 7.630 5.697 1.967 6.972 . 0 0 "[ . 1 . 2]" 1
283 1 12 TYR QE 1 139 GLU HA . . 7.630 3.496 2.058 4.905 . 0 0 "[ . 1 . 2]" 1
284 1 12 TYR QE 1 139 GLU HG2 . . 7.630 2.792 1.994 6.033 . 0 0 "[ . 1 . 2]" 1
285 1 12 TYR QE 1 139 GLU QG . . 7.430 2.652 1.921 5.343 . 0 0 "[ . 1 . 2]" 1
286 1 12 TYR QE 1 139 GLU HG3 . . 7.630 3.579 2.309 5.962 . 0 0 "[ . 1 . 2]" 1
287 1 12 TYR QE 1 142 ALA MB . . 6.740 2.568 1.906 3.373 . 0 0 "[ . 1 . 2]" 1
288 1 12 TYR QE 1 143 GLN HA . . 7.260 3.959 2.337 5.677 . 0 0 "[ . 1 . 2]" 1
289 1 12 TYR QE 1 146 HIS HB2 . . 7.630 4.218 2.627 6.352 . 0 0 "[ . 1 . 2]" 1
290 1 12 TYR QE 1 146 HIS HB3 . . 7.630 4.575 2.760 6.190 . 0 0 "[ . 1 . 2]" 1
291 1 13 THR H 1 13 THR MG . . 3.430 2.114 1.905 2.479 . 0 0 "[ . 1 . 2]" 1
292 1 13 THR H 1 14 PRO QD . . 6.380 4.315 4.288 4.329 . 0 0 "[ . 1 . 2]" 1
293 1 13 THR H 1 16 GLN H . . 5.280 4.472 4.091 5.319 0.039 18 0 "[ . 1 . 2]" 1
294 1 13 THR HA 1 13 THR HB . . 2.520 2.502 2.373 2.559 0.039 20 0 "[ . 1 . 2]" 1
295 1 13 THR HA 1 13 THR MG . . 3.520 2.462 2.321 2.651 . 0 0 "[ . 1 . 2]" 1
296 1 13 THR HA 1 15 ASP H . . 5.000 3.862 3.679 4.022 . 0 0 "[ . 1 . 2]" 1
297 1 13 THR MG 1 14 PRO QD . . 6.130 3.195 3.041 3.444 . 0 0 "[ . 1 . 2]" 1
298 1 13 THR MG 1 15 ASP H . . 6.060 4.116 3.984 4.205 . 0 0 "[ . 1 . 2]" 1
299 1 14 PRO HA 1 17 LEU H . . 4.850 3.289 3.062 3.417 . 0 0 "[ . 1 . 2]" 1
300 1 14 PRO QG 1 15 ASP H . . 5.420 3.614 3.224 3.771 . 0 0 "[ . 1 . 2]" 1
301 1 15 ASP H 1 15 ASP HA . . 2.770 2.779 2.696 2.815 0.045 17 0 "[ . 1 . 2]" 1
302 1 15 ASP H 1 15 ASP HB2 . . 2.710 2.536 2.336 2.704 . 0 0 "[ . 1 . 2]" 1
303 1 15 ASP H 1 15 ASP HB3 . . 2.590 2.397 2.259 2.580 . 0 0 "[ . 1 . 2]" 1
304 1 15 ASP H 1 16 GLN H . . 2.740 2.610 2.519 2.827 0.087 18 0 "[ . 1 . 2]" 1
305 1 15 ASP H 1 16 GLN HA . . 5.500 5.122 5.049 5.306 . 0 0 "[ . 1 . 2]" 1
306 1 15 ASP HA 1 18 PHE H . . 3.610 3.240 3.108 3.321 . 0 0 "[ . 1 . 2]" 1
307 1 15 ASP HA 1 18 PHE HA . . 5.500 5.263 5.118 5.538 0.038 16 0 "[ . 1 . 2]" 1
308 1 15 ASP HA 1 18 PHE HB2 . . 5.070 2.813 2.635 3.132 . 0 0 "[ . 1 . 2]" 1
309 1 15 ASP HA 1 18 PHE QB . . 4.560 2.775 2.602 3.090 . 0 0 "[ . 1 . 2]" 1
310 1 15 ASP HA 1 18 PHE HB3 . . 5.070 4.255 3.792 4.729 . 0 0 "[ . 1 . 2]" 1
311 1 15 ASP HA 1 19 GLU H . . 5.310 5.332 5.167 5.395 0.085 20 0 "[ . 1 . 2]" 1
312 1 15 ASP HB2 1 16 GLN H . . 4.450 3.840 3.670 3.989 . 0 0 "[ . 1 . 2]" 1
313 1 15 ASP HB3 1 16 GLN H . . 3.800 2.483 2.348 2.648 . 0 0 "[ . 1 . 2]" 1
314 1 16 GLN H 1 16 GLN HB2 . . 3.170 2.202 2.025 2.497 . 0 0 "[ . 1 . 2]" 1
315 1 16 GLN H 1 16 GLN HB3 . . 3.890 3.445 3.266 3.551 . 0 0 "[ . 1 . 2]" 1
316 1 16 GLN H 1 16 GLN HG2 . . 4.140 3.185 2.196 3.992 . 0 0 "[ . 1 . 2]" 1
317 1 16 GLN H 1 16 GLN QG . . 3.940 2.861 2.179 3.545 . 0 0 "[ . 1 . 2]" 1
318 1 16 GLN H 1 16 GLN HG3 . . 4.140 3.615 2.592 4.174 0.034 12 0 "[ . 1 . 2]" 1
319 1 16 GLN H 1 17 LEU H . . 3.170 2.767 2.724 2.825 . 0 0 "[ . 1 . 2]" 1
320 1 16 GLN HA 1 16 GLN HB3 . . 2.930 2.723 2.539 2.887 . 0 0 "[ . 1 . 2]" 1
321 1 16 GLN HA 1 19 GLU H . . 3.860 3.569 3.442 3.673 . 0 0 "[ . 1 . 2]" 1
322 1 16 GLN HA 1 19 GLU QB . . 4.420 3.513 3.223 3.628 . 0 0 "[ . 1 . 2]" 1
323 1 16 GLN HA 1 19 GLU HG2 . . 5.500 4.845 4.579 5.114 . 0 0 "[ . 1 . 2]" 1
324 1 16 GLN HA 1 19 GLU HG3 . . 5.500 3.373 3.000 3.664 . 0 0 "[ . 1 . 2]" 1
325 1 16 GLN HA 1 20 LEU H . . 4.970 4.912 4.587 5.023 0.053 12 0 "[ . 1 . 2]" 1
326 1 16 GLN HB3 1 17 LEU H . . 3.800 3.652 3.228 3.848 0.048 9 0 "[ . 1 . 2]" 1
327 1 17 LEU H 1 17 LEU HB2 . . 3.050 2.434 2.357 2.551 . 0 0 "[ . 1 . 2]" 1
328 1 17 LEU H 1 17 LEU MD1 . . 4.570 3.172 2.883 3.366 . 0 0 "[ . 1 . 2]" 1
329 1 17 LEU H 1 17 LEU QD . . 3.900 2.991 2.809 3.057 . 0 0 "[ . 1 . 2]" 1
330 1 17 LEU H 1 17 LEU MD2 . . 4.570 3.689 3.434 3.875 . 0 0 "[ . 1 . 2]" 1
331 1 17 LEU H 1 17 LEU HG . . 2.960 2.273 2.011 2.454 . 0 0 "[ . 1 . 2]" 1
332 1 17 LEU H 1 18 PHE H . . 2.740 2.597 2.471 2.684 . 0 0 "[ . 1 . 2]" 1
333 1 17 LEU HA 1 17 LEU MD1 . . 4.790 3.912 3.845 3.959 . 0 0 "[ . 1 . 2]" 1
334 1 17 LEU HA 1 17 LEU QD . . 4.160 2.415 2.263 2.724 . 0 0 "[ . 1 . 2]" 1
335 1 17 LEU HA 1 17 LEU MD2 . . 4.790 2.440 2.277 2.786 . 0 0 "[ . 1 . 2]" 1
336 1 17 LEU HA 1 19 GLU H . . 4.630 3.936 3.828 4.084 . 0 0 "[ . 1 . 2]" 1
337 1 17 LEU HA 1 20 LEU H . . 3.140 2.864 2.831 2.913 . 0 0 "[ . 1 . 2]" 1
338 1 17 LEU HA 1 20 LEU HB2 . . 3.210 2.080 1.957 2.305 . 0 0 "[ . 1 . 2]" 1
339 1 17 LEU HA 1 20 LEU HB3 . . 3.490 3.393 3.200 3.543 0.053 20 0 "[ . 1 . 2]" 1
340 1 17 LEU HA 1 21 VAL H . . 4.260 3.859 3.672 4.053 . 0 0 "[ . 1 . 2]" 1
341 1 17 LEU HB2 1 18 PHE H . . 3.860 2.734 2.567 2.824 . 0 0 "[ . 1 . 2]" 1
342 1 17 LEU HB2 1 21 VAL H . . 5.190 5.153 4.911 5.305 0.115 6 0 "[ . 1 . 2]" 1
343 1 17 LEU HB3 1 21 VAL H . . 5.500 4.232 4.108 4.385 . 0 0 "[ . 1 . 2]" 1
344 1 17 LEU QD 1 18 PHE H . . 8.100 4.027 3.891 4.132 . 0 0 "[ . 1 . 2]" 1
345 1 17 LEU HG 1 20 LEU H . . 5.500 5.572 5.391 5.699 0.199 20 0 "[ . 1 . 2]" 1
346 1 17 LEU HG 1 21 VAL MG2 . . 6.530 5.275 4.930 5.450 . 0 0 "[ . 1 . 2]" 1
347 1 18 PHE H 1 18 PHE HA . . 2.740 2.698 2.692 2.709 . 0 0 "[ . 1 . 2]" 1
348 1 18 PHE H 1 18 PHE HB2 . . 3.550 1.937 1.902 2.045 . 0 0 "[ . 1 . 2]" 1
349 1 18 PHE H 1 18 PHE QB . . 3.070 1.913 1.886 1.993 . 0 0 "[ . 1 . 2]" 1
350 1 18 PHE H 1 18 PHE HB3 . . 3.550 2.987 2.756 3.206 . 0 0 "[ . 1 . 2]" 1
351 1 18 PHE H 1 19 GLU H . . 2.990 2.898 2.865 2.918 . 0 0 "[ . 1 . 2]" 1
352 1 18 PHE HA 1 18 PHE HB2 . . 3.020 2.785 2.665 2.901 . 0 0 "[ . 1 . 2]" 1
353 1 18 PHE HA 1 18 PHE HB3 . . 3.020 3.010 2.931 3.063 0.043 7 0 "[ . 1 . 2]" 1
354 1 18 PHE HA 1 19 GLU H . . 3.610 3.589 3.570 3.605 . 0 0 "[ . 1 . 2]" 1
355 1 18 PHE HA 1 19 GLU QG . . 6.380 5.049 4.951 5.118 . 0 0 "[ . 1 . 2]" 1
356 1 18 PHE HA 1 20 LEU H . . 4.630 4.278 4.182 4.429 . 0 0 "[ . 1 . 2]" 1
357 1 18 PHE HA 1 21 VAL H . . 5.500 3.522 3.445 3.595 . 0 0 "[ . 1 . 2]" 1
358 1 18 PHE HA 1 21 VAL HB . . 4.170 2.933 2.683 3.262 . 0 0 "[ . 1 . 2]" 1
359 1 18 PHE HA 1 97 PHE QD . . 7.620 6.521 5.801 7.055 . 0 0 "[ . 1 . 2]" 1
360 1 18 PHE QB 1 19 GLU H . . 3.930 2.627 2.491 2.777 . 0 0 "[ . 1 . 2]" 1
361 1 18 PHE QB 1 19 GLU QG . . 5.200 3.005 2.881 3.157 . 0 0 "[ . 1 . 2]" 1
362 1 18 PHE HB2 1 19 GLU H . . 4.600 3.426 3.197 3.632 . 0 0 "[ . 1 . 2]" 1
363 1 18 PHE HB3 1 19 GLU H . . 4.600 2.739 2.549 3.027 . 0 0 "[ . 1 . 2]" 1
364 1 18 PHE QD 1 19 GLU H . . 7.620 4.354 3.977 4.679 . 0 0 "[ . 1 . 2]" 1
365 1 18 PHE QD 1 19 GLU HA . . 7.620 4.162 3.687 5.018 . 0 0 "[ . 1 . 2]" 1
366 1 18 PHE QD 1 19 GLU QB . . 8.500 5.472 4.902 5.958 . 0 0 "[ . 1 . 2]" 1
367 1 18 PHE QD 1 19 GLU HG2 . . 6.600 4.163 3.148 4.894 . 0 0 "[ . 1 . 2]" 1
368 1 18 PHE QD 1 19 GLU QG . . 6.340 4.016 3.085 4.644 . 0 0 "[ . 1 . 2]" 1
369 1 18 PHE QD 1 19 GLU HG3 . . 6.600 5.310 4.435 5.777 . 0 0 "[ . 1 . 2]" 1
370 1 18 PHE QD 1 74 LYS QG . . 8.500 6.750 6.233 6.992 . 0 0 "[ . 1 . 2]" 1
371 1 18 PHE QE 1 74 LYS HA . . 5.730 4.896 3.911 5.458 . 0 0 "[ . 1 . 2]" 1
372 1 18 PHE QE 1 74 LYS QB . . 8.340 3.502 2.520 4.101 . 0 0 "[ . 1 . 2]" 1
373 1 18 PHE QE 1 74 LYS HG2 . . 7.620 6.074 5.331 6.745 . 0 0 "[ . 1 . 2]" 1
374 1 18 PHE QE 1 74 LYS HG3 . . 7.620 5.606 4.955 6.526 . 0 0 "[ . 1 . 2]" 1
375 1 19 GLU H 1 19 GLU HA . . 2.900 2.840 2.830 2.844 . 0 0 "[ . 1 . 2]" 1
376 1 19 GLU H 1 19 GLU QB . . 3.560 2.327 2.277 2.394 . 0 0 "[ . 1 . 2]" 1
377 1 19 GLU H 1 19 GLU HG2 . . 3.050 2.920 2.776 3.051 0.001 11 0 "[ . 1 . 2]" 1
378 1 19 GLU H 1 19 GLU QG . . 2.860 2.586 2.470 2.684 . 0 0 "[ . 1 . 2]" 1
379 1 19 GLU H 1 19 GLU HG3 . . 3.050 2.888 2.692 3.038 . 0 0 "[ . 1 . 2]" 1
380 1 19 GLU H 1 20 LEU H . . 2.620 2.409 2.389 2.446 . 0 0 "[ . 1 . 2]" 1
381 1 19 GLU H 1 21 VAL H . . 4.850 4.017 3.845 4.168 . 0 0 "[ . 1 . 2]" 1
382 1 19 GLU H 1 21 VAL HB . . 5.500 5.241 5.063 5.474 . 0 0 "[ . 1 . 2]" 1
383 1 19 GLU HA 1 19 GLU HG2 . . 3.580 2.278 2.221 2.344 . 0 0 "[ . 1 . 2]" 1
384 1 19 GLU HA 1 19 GLU QG . . 3.300 2.251 2.196 2.313 . 0 0 "[ . 1 . 2]" 1
385 1 19 GLU HA 1 19 GLU HG3 . . 3.580 3.520 3.465 3.565 . 0 0 "[ . 1 . 2]" 1
386 1 19 GLU HA 1 20 LEU H . . 3.520 3.544 3.521 3.581 0.061 19 0 "[ . 1 . 2]" 1
387 1 19 GLU HA 1 20 LEU HA . . 5.500 4.738 4.716 4.761 . 0 0 "[ . 1 . 2]" 1
388 1 19 GLU HA 1 21 VAL H . . 4.660 4.407 4.202 4.609 . 0 0 "[ . 1 . 2]" 1
389 1 19 GLU HA 1 22 GLY H . . 3.360 3.393 3.302 3.469 0.109 12 0 "[ . 1 . 2]" 1
390 1 19 GLU HA 1 23 ASP H . . 5.500 4.871 4.351 5.314 . 0 0 "[ . 1 . 2]" 1
391 1 19 GLU HA 1 27 TYR H . . 5.100 5.163 5.056 5.260 0.160 19 0 "[ . 1 . 2]" 1
392 1 19 GLU QB 1 20 LEU H . . 3.870 2.897 2.756 2.976 . 0 0 "[ . 1 . 2]" 1
393 1 19 GLU QB 1 20 LEU HB3 . . 6.380 5.492 5.386 5.590 . 0 0 "[ . 1 . 2]" 1
394 1 19 GLU QB 1 20 LEU HG . . 5.480 4.420 4.198 4.857 . 0 0 "[ . 1 . 2]" 1
395 1 19 GLU QB 1 21 VAL H . . 6.380 4.864 4.738 5.003 . 0 0 "[ . 1 . 2]" 1
396 1 19 GLU QB 1 26 ALA MB . . 7.400 3.189 2.688 3.783 . 0 0 "[ . 1 . 2]" 1
397 1 19 GLU QG 1 20 LEU H . . 5.150 4.229 4.120 4.306 . 0 0 "[ . 1 . 2]" 1
398 1 19 GLU HG2 1 20 LEU H . . 5.500 4.742 4.678 4.817 . 0 0 "[ . 1 . 2]" 1
399 1 19 GLU HG3 1 20 LEU H . . 5.500 4.754 4.566 4.887 . 0 0 "[ . 1 . 2]" 1
400 1 20 LEU H 1 20 LEU HB2 . . 2.710 2.033 2.006 2.106 . 0 0 "[ . 1 . 2]" 1
401 1 20 LEU H 1 20 LEU HB3 . . 3.240 3.246 3.163 3.409 0.169 20 0 "[ . 1 . 2]" 1
402 1 20 LEU H 1 20 LEU HG . . 3.610 3.573 3.460 3.663 0.053 5 0 "[ . 1 . 2]" 1
403 1 20 LEU H 1 21 VAL H . . 2.800 2.489 2.415 2.580 . 0 0 "[ . 1 . 2]" 1
404 1 20 LEU H 1 21 VAL HB . . 5.410 4.625 4.476 4.834 . 0 0 "[ . 1 . 2]" 1
405 1 20 LEU H 1 21 VAL MG2 . . 4.950 3.847 3.638 3.976 . 0 0 "[ . 1 . 2]" 1
406 1 20 LEU HA 1 20 LEU HB3 . . 2.960 2.803 2.683 2.856 . 0 0 "[ . 1 . 2]" 1
407 1 20 LEU HA 1 20 LEU HG . . 3.550 2.728 2.246 3.570 0.020 20 0 "[ . 1 . 2]" 1
408 1 20 LEU HA 1 23 ASP H . . 3.730 3.249 2.860 3.510 . 0 0 "[ . 1 . 2]" 1
409 1 20 LEU HA 1 23 ASP HB2 . . 3.980 2.072 1.973 2.314 . 0 0 "[ . 1 . 2]" 1
410 1 20 LEU HA 1 23 ASP HB3 . . 4.380 3.552 2.512 4.038 . 0 0 "[ . 1 . 2]" 1
411 1 20 LEU HB2 1 21 VAL H . . 3.170 3.156 2.863 3.248 0.078 6 0 "[ . 1 . 2]" 1
412 1 20 LEU HB2 1 21 VAL MG2 . . 6.530 3.830 3.495 4.026 . 0 0 "[ . 1 . 2]" 1
413 1 20 LEU HB3 1 21 VAL H . . 3.520 3.163 2.924 3.471 . 0 0 "[ . 1 . 2]" 1
414 1 20 LEU HB3 1 21 VAL MG2 . . 6.530 3.487 3.168 3.854 . 0 0 "[ . 1 . 2]" 1
415 1 20 LEU QD 1 21 VAL H . . 7.600 4.103 3.983 4.280 . 0 0 "[ . 1 . 2]" 1
416 1 20 LEU QD 1 21 VAL HA . . 8.100 4.546 4.301 4.900 . 0 0 "[ . 1 . 2]" 1
417 1 20 LEU QD 1 135 ILE MG . . 9.130 4.926 4.302 5.439 . 0 0 "[ . 1 . 2]" 1
418 1 20 LEU QD 1 138 PHE QD . . 10.220 2.562 2.070 3.128 . 0 0 "[ . 1 . 2]" 1
419 1 20 LEU HG 1 21 VAL H . . 5.500 5.118 5.031 5.225 . 0 0 "[ . 1 . 2]" 1
420 1 20 LEU HG 1 138 PHE QD . . 7.620 3.051 2.323 4.355 . 0 0 "[ . 1 . 2]" 1
421 1 21 VAL H 1 21 VAL HA . . 2.830 2.789 2.772 2.800 . 0 0 "[ . 1 . 2]" 1
422 1 21 VAL H 1 21 VAL HB . . 2.460 2.434 2.342 2.598 0.138 6 0 "[ . 1 . 2]" 1
423 1 21 VAL H 1 21 VAL MG1 . . 4.610 3.698 3.689 3.702 . 0 0 "[ . 1 . 2]" 1
424 1 21 VAL H 1 21 VAL MG2 . . 3.430 2.105 1.963 2.313 . 0 0 "[ . 1 . 2]" 1
425 1 21 VAL H 1 22 GLY H . . 2.590 2.648 2.604 2.703 0.113 17 0 "[ . 1 . 2]" 1
426 1 21 VAL H 1 23 ASP H . . 4.790 3.962 3.738 4.168 . 0 0 "[ . 1 . 2]" 1
427 1 21 VAL HA 1 21 VAL MG2 . . 3.430 2.362 2.246 2.456 . 0 0 "[ . 1 . 2]" 1
428 1 21 VAL HA 1 22 GLY QA . . 5.020 4.342 4.313 4.368 . 0 0 "[ . 1 . 2]" 1
429 1 21 VAL HA 1 24 VAL H . . 5.500 5.481 4.907 5.617 0.117 8 0 "[ . 1 . 2]" 1
430 1 21 VAL HB 1 22 GLY H . . 4.480 2.846 2.638 3.042 . 0 0 "[ . 1 . 2]" 1
431 1 21 VAL HB 1 97 PHE QE . . 7.620 4.698 4.010 5.310 . 0 0 "[ . 1 . 2]" 1
432 1 21 VAL MG1 1 79 ILE MG . . 7.180 3.707 3.405 4.600 . 0 0 "[ . 1 . 2]" 1
433 1 21 VAL MG1 1 95 TRP HD1 . . 6.530 4.987 3.826 5.416 . 0 0 "[ . 1 . 2]" 1
434 1 21 VAL MG1 1 97 PHE QE . . 8.650 3.293 2.670 4.506 . 0 0 "[ . 1 . 2]" 1
435 1 21 VAL MG2 1 97 PHE QE . . 8.650 2.167 1.816 2.822 . 0 0 "[ . 1 . 2]" 1
436 1 22 GLY H 1 23 ASP H . . 3.330 2.564 2.204 2.769 . 0 0 "[ . 1 . 2]" 1
437 1 22 GLY QA 1 24 VAL MG1 . . 7.410 4.200 3.789 4.545 . 0 0 "[ . 1 . 2]" 1
438 1 23 ASP H 1 23 ASP HA . . 2.870 2.736 2.648 2.797 . 0 0 "[ . 1 . 2]" 1
439 1 23 ASP H 1 23 ASP HB2 . . 2.830 2.367 2.162 2.850 0.020 12 0 "[ . 1 . 2]" 1
440 1 23 ASP H 1 23 ASP HB3 . . 2.620 2.579 2.164 2.803 0.183 17 0 "[ . 1 . 2]" 1
441 1 23 ASP H 1 24 VAL H . . 3.670 2.691 2.575 2.903 . 0 0 "[ . 1 . 2]" 1
442 1 23 ASP H 1 24 VAL MG1 . . 6.530 4.039 3.618 4.449 . 0 0 "[ . 1 . 2]" 1
443 1 23 ASP HA 1 23 ASP HB2 . . 2.960 2.534 2.302 2.635 . 0 0 "[ . 1 . 2]" 1
444 1 23 ASP HA 1 23 ASP HB3 . . 3.020 3.039 2.971 3.055 0.035 1 0 "[ . 1 . 2]" 1
445 1 23 ASP HA 1 24 VAL H . . 3.610 3.478 3.390 3.625 0.015 18 0 "[ . 1 . 2]" 1
446 1 23 ASP HA 1 24 VAL MG1 . . 6.530 4.992 4.818 5.371 . 0 0 "[ . 1 . 2]" 1
447 1 23 ASP HA 1 24 VAL MG2 . . 6.310 4.761 4.454 4.874 . 0 0 "[ . 1 . 2]" 1
448 1 23 ASP HA 1 25 ASP H . . 3.800 3.544 3.261 3.721 . 0 0 "[ . 1 . 2]" 1
449 1 23 ASP HA 1 26 ALA H . . 4.450 2.969 2.634 3.653 . 0 0 "[ . 1 . 2]" 1
450 1 23 ASP HB2 1 24 VAL H . . 4.040 4.078 3.746 4.144 0.104 9 0 "[ . 1 . 2]" 1
451 1 23 ASP HB3 1 24 VAL H . . 4.230 3.151 2.761 3.423 . 0 0 "[ . 1 . 2]" 1
452 1 23 ASP HB3 1 26 ALA MB . . 6.530 4.773 4.408 5.287 . 0 0 "[ . 1 . 2]" 1
453 1 24 VAL H 1 24 VAL HA . . 2.930 2.834 2.695 2.895 . 0 0 "[ . 1 . 2]" 1
454 1 24 VAL H 1 24 VAL HB . . 3.580 3.535 3.500 3.572 . 0 0 "[ . 1 . 2]" 1
455 1 24 VAL H 1 24 VAL MG1 . . 3.430 2.419 1.997 2.699 . 0 0 "[ . 1 . 2]" 1
456 1 24 VAL H 1 24 VAL MG2 . . 3.430 1.986 1.847 2.413 . 0 0 "[ . 1 . 2]" 1
457 1 24 VAL H 1 25 ASP H . . 2.740 2.495 2.258 2.844 0.104 12 0 "[ . 1 . 2]" 1
458 1 24 VAL H 1 25 ASP HA . . 5.470 5.063 4.884 5.337 . 0 0 "[ . 1 . 2]" 1
459 1 24 VAL H 1 25 ASP QB . . 6.250 4.295 4.013 4.684 . 0 0 "[ . 1 . 2]" 1
460 1 24 VAL H 1 70 VAL QG . . 7.750 4.842 4.488 5.096 . 0 0 "[ . 1 . 2]" 1
461 1 24 VAL HA 1 24 VAL HB . . 2.560 2.492 2.423 2.587 0.027 17 0 "[ . 1 . 2]" 1
462 1 24 VAL HA 1 24 VAL MG1 . . 3.430 2.253 2.076 2.351 . 0 0 "[ . 1 . 2]" 1
463 1 24 VAL HA 1 27 TYR QD . . 7.640 4.478 2.826 6.154 . 0 0 "[ . 1 . 2]" 1
464 1 24 VAL HB 1 25 ASP H . . 4.230 4.144 3.846 4.424 0.194 9 0 "[ . 1 . 2]" 1
465 1 24 VAL HB 1 25 ASP HA . . 5.500 4.837 4.542 5.059 . 0 0 "[ . 1 . 2]" 1
466 1 24 VAL HB 1 39 THR MG . . 4.920 1.864 1.755 2.117 . 0 0 "[ . 1 . 2]" 1
467 1 24 VAL HB 1 70 VAL HB . . 5.500 5.056 4.493 5.405 . 0 0 "[ . 1 . 2]" 1
468 1 24 VAL MG1 1 25 ASP H . . 4.980 4.179 4.018 4.264 . 0 0 "[ . 1 . 2]" 1
469 1 24 VAL MG1 1 25 ASP QB . . 7.400 4.991 4.861 5.092 . 0 0 "[ . 1 . 2]" 1
470 1 24 VAL MG1 1 27 TYR QD . . 8.670 5.525 4.635 6.324 . 0 0 "[ . 1 . 2]" 1
471 1 24 VAL MG1 1 27 TYR QE . . 8.660 5.626 3.830 6.560 . 0 0 "[ . 1 . 2]" 1
472 1 24 VAL MG1 1 37 MET HG2 . . 6.530 4.875 3.935 5.438 . 0 0 "[ . 1 . 2]" 1
473 1 24 VAL MG1 1 37 MET HG3 . . 6.530 4.825 4.334 5.277 . 0 0 "[ . 1 . 2]" 1
474 1 24 VAL MG1 1 39 THR MG . . 5.420 3.071 2.807 3.374 . 0 0 "[ . 1 . 2]" 1
475 1 24 VAL MG1 1 53 ALA HA . . 6.530 5.329 5.275 5.387 . 0 0 "[ . 1 . 2]" 1
476 1 24 VAL MG1 1 53 ALA MB . . 6.660 3.377 3.224 3.560 . 0 0 "[ . 1 . 2]" 1
477 1 24 VAL MG1 1 70 VAL HB . . 5.410 4.061 3.432 4.326 . 0 0 "[ . 1 . 2]" 1
478 1 24 VAL MG2 1 25 ASP H . . 4.050 2.529 2.180 3.163 . 0 0 "[ . 1 . 2]" 1
479 1 24 VAL MG2 1 25 ASP HA . . 6.530 4.013 3.665 4.275 . 0 0 "[ . 1 . 2]" 1
480 1 24 VAL MG2 1 25 ASP QB . . 7.400 2.623 2.454 3.049 . 0 0 "[ . 1 . 2]" 1
481 1 24 VAL MG2 1 39 THR MG . . 4.670 1.973 1.711 2.709 . 0 0 "[ . 1 . 2]" 1
482 1 24 VAL MG2 1 70 VAL HB . . 5.380 4.221 4.011 4.376 . 0 0 "[ . 1 . 2]" 1
483 1 24 VAL MG2 1 70 VAL QG . . 6.730 2.405 2.119 2.570 . 0 0 "[ . 1 . 2]" 1
484 1 25 ASP H 1 25 ASP HA . . 2.870 2.896 2.849 2.917 0.047 18 0 "[ . 1 . 2]" 1
485 1 25 ASP H 1 25 ASP QB . . 3.340 2.578 2.419 2.762 . 0 0 "[ . 1 . 2]" 1
486 1 25 ASP H 1 26 ALA H . . 2.830 1.905 1.674 2.323 . 0 0 "[ . 1 . 2]" 1
487 1 25 ASP H 1 26 ALA HA . . 4.790 4.379 4.153 4.758 . 0 0 "[ . 1 . 2]" 1
488 1 25 ASP H 1 26 ALA MB . . 5.040 3.323 2.997 3.580 . 0 0 "[ . 1 . 2]" 1
489 1 25 ASP H 1 39 THR MG . . 5.750 3.978 3.395 4.251 . 0 0 "[ . 1 . 2]" 1
490 1 25 ASP HA 1 26 ALA MB . . 6.530 4.829 4.677 5.037 . 0 0 "[ . 1 . 2]" 1
491 1 25 ASP HA 1 37 MET HG2 . . 4.260 3.893 3.509 4.276 0.016 1 0 "[ . 1 . 2]" 1
492 1 25 ASP HA 1 37 MET QG . . 3.850 3.482 3.347 3.557 . 0 0 "[ . 1 . 2]" 1
493 1 25 ASP HA 1 37 MET HG3 . . 4.260 4.014 3.535 4.278 0.018 17 0 "[ . 1 . 2]" 1
494 1 25 ASP HA 1 39 THR MG . . 5.540 3.698 2.998 4.030 . 0 0 "[ . 1 . 2]" 1
495 1 25 ASP QB 1 26 ALA H . . 3.930 3.206 1.987 3.746 . 0 0 "[ . 1 . 2]" 1
496 1 25 ASP QB 1 26 ALA HA . . 4.890 4.044 3.537 4.260 . 0 0 "[ . 1 . 2]" 1
497 1 25 ASP QB 1 26 ALA MB . . 6.290 3.846 3.523 4.255 . 0 0 "[ . 1 . 2]" 1
498 1 25 ASP QB 1 39 THR MG . . 7.400 3.142 2.692 3.514 . 0 0 "[ . 1 . 2]" 1
499 1 26 ALA H 1 26 ALA HA . . 2.930 2.873 2.637 2.942 0.012 8 0 "[ . 1 . 2]" 1
500 1 26 ALA H 1 26 ALA MB . . 3.430 2.265 1.947 2.525 . 0 0 "[ . 1 . 2]" 1
501 1 26 ALA H 1 27 TYR H . . 3.610 3.216 2.550 3.869 0.259 11 0 "[ . 1 . 2]" 1
502 1 26 ALA MB 1 27 TYR H . . 4.390 1.910 1.801 2.234 . 0 0 "[ . 1 . 2]" 1
503 1 26 ALA MB 1 27 TYR HA . . 6.530 3.655 3.560 3.815 . 0 0 "[ . 1 . 2]" 1
504 1 26 ALA MB 1 27 TYR QD . . 7.120 3.356 2.133 4.399 . 0 0 "[ . 1 . 2]" 1
505 1 26 ALA MB 1 27 TYR QE . . 6.610 4.581 3.704 5.073 . 0 0 "[ . 1 . 2]" 1
506 1 27 TYR H 1 27 TYR HB2 . . 3.830 3.480 2.189 3.942 0.112 14 0 "[ . 1 . 2]" 1
507 1 27 TYR H 1 27 TYR QB . . 3.660 2.835 2.166 3.289 . 0 0 "[ . 1 . 2]" 1
508 1 27 TYR H 1 27 TYR HB3 . . 3.830 3.303 2.820 4.036 0.206 16 0 "[ . 1 . 2]" 1
509 1 27 TYR HA 1 31 VAL QG . . 6.750 3.950 3.194 4.882 . 0 0 "[ . 1 . 2]" 1
510 1 27 TYR QB 1 31 VAL QG . . 7.650 2.463 1.902 3.643 . 0 0 "[ . 1 . 2]" 1
511 1 27 TYR HB2 1 31 VAL MG1 . . 9.650 3.540 2.084 7.106 . 0 0 "[ . 1 . 2]" 1
512 1 27 TYR HB2 1 31 VAL MG2 . . 9.650 3.686 2.093 4.950 . 0 0 "[ . 1 . 2]" 1
513 1 27 TYR HB3 1 31 VAL MG1 . . 9.650 3.566 2.110 6.121 . 0 0 "[ . 1 . 2]" 1
514 1 27 TYR HB3 1 31 VAL MG2 . . 9.650 3.774 2.303 5.308 . 0 0 "[ . 1 . 2]" 1
515 1 27 TYR QD 1 31 VAL QG . . 8.400 2.429 1.771 3.912 . 0 0 "[ . 1 . 2]" 1
516 1 27 TYR QE 1 31 VAL QG . . 9.070 3.370 1.901 5.237 . 0 0 "[ . 1 . 2]" 1
517 1 28 PRO QG 1 29 LYS QB . . 7.250 4.368 3.325 5.708 . 0 0 "[ . 1 . 2]" 1
518 1 28 PRO QG 1 29 LYS QG . . 7.250 4.903 3.122 5.716 . 0 0 "[ . 1 . 2]" 1
519 1 30 PHE QD 1 33 TRP H . . 7.620 5.961 5.228 6.824 . 0 0 "[ . 1 . 2]" 1
520 1 30 PHE QE 1 31 VAL QG . . 7.920 4.703 2.514 5.329 . 0 0 "[ . 1 . 2]" 1
521 1 30 PHE QE 1 33 TRP QB . . 8.500 6.495 5.323 6.960 . 0 0 "[ . 1 . 2]" 1
522 1 30 PHE QE 1 137 CYS HB2 . . 7.620 3.849 2.724 6.012 . 0 0 "[ . 1 . 2]" 1
523 1 30 PHE QE 1 137 CYS HB3 . . 7.620 4.774 1.967 6.890 . 0 0 "[ . 1 . 2]" 1
524 1 31 VAL H 1 31 VAL HB . . 3.730 3.716 2.731 3.956 0.226 19 0 "[ . 1 . 2]" 1
525 1 31 VAL H 1 31 VAL QG . . 4.130 2.361 2.049 3.213 . 0 0 "[ . 1 . 2]" 1
526 1 31 VAL H 1 33 TRP H . . 5.500 5.465 4.851 5.647 0.147 11 0 "[ . 1 . 2]" 1
527 1 31 VAL HA 1 34 ILE H . . 5.000 4.030 3.805 4.284 . 0 0 "[ . 1 . 2]" 1
528 1 31 VAL HB 1 34 ILE H . . 4.570 3.398 3.049 3.967 . 0 0 "[ . 1 . 2]" 1
529 1 31 VAL HB 1 34 ILE HB . . 5.500 3.608 3.225 4.228 . 0 0 "[ . 1 . 2]" 1
530 1 31 VAL HB 1 34 ILE MD . . 5.380 4.358 4.219 4.465 . 0 0 "[ . 1 . 2]" 1
531 1 31 VAL HB 1 34 ILE MG . . 6.530 2.162 1.843 3.370 . 0 0 "[ . 1 . 2]" 1
532 1 31 VAL QG 1 33 TRP H . . 8.090 4.204 2.406 4.791 . 0 0 "[ . 1 . 2]" 1
533 1 31 VAL QG 1 33 TRP HE3 . . 6.850 3.526 2.280 4.778 . 0 0 "[ . 1 . 2]" 1
534 1 31 VAL QG 1 33 TRP HZ3 . . 7.620 2.464 1.824 4.391 . 0 0 "[ . 1 . 2]" 1
535 1 31 VAL QG 1 34 ILE H . . 5.630 3.456 1.880 4.007 . 0 0 "[ . 1 . 2]" 1
536 1 31 VAL QG 1 34 ILE MD . . 9.120 3.757 3.029 4.187 . 0 0 "[ . 1 . 2]" 1
537 1 31 VAL QG 1 34 ILE QG . . 8.960 4.395 3.615 5.057 . 0 0 "[ . 1 . 2]" 1
538 1 31 VAL QG 1 34 ILE MG . . 7.180 2.080 1.734 2.775 . 0 0 "[ . 1 . 2]" 1
539 1 31 VAL QG 1 137 CYS HB2 . . 7.560 4.802 3.818 5.594 . 0 0 "[ . 1 . 2]" 1
540 1 31 VAL QG 1 137 CYS HB3 . . 8.090 4.312 3.578 4.976 . 0 0 "[ . 1 . 2]" 1
541 1 31 VAL MG1 1 34 ILE H . . 6.190 4.103 1.882 4.954 . 0 0 "[ . 1 . 2]" 1
542 1 31 VAL MG1 1 34 ILE MG . . 7.560 2.869 1.823 4.080 . 0 0 "[ . 1 . 2]" 1
543 1 31 VAL MG2 1 34 ILE H . . 6.190 4.202 3.502 5.031 . 0 0 "[ . 1 . 2]" 1
544 1 31 VAL MG2 1 34 ILE MG . . 7.560 2.482 1.742 3.490 . 0 0 "[ . 1 . 2]" 1
545 1 32 PRO HA 1 34 ILE MG . . 5.790 4.623 4.438 4.706 . 0 0 "[ . 1 . 2]" 1
546 1 32 PRO QB 1 133 LYS QD . . 5.800 3.169 2.823 3.632 . 0 0 "[ . 1 . 2]" 1
547 1 32 PRO QD 1 33 TRP H . . 3.880 2.260 2.233 2.390 . 0 0 "[ . 1 . 2]" 1
548 1 32 PRO QD 1 34 ILE MG . . 7.410 4.834 4.633 5.424 . 0 0 "[ . 1 . 2]" 1
549 1 32 PRO QD 1 133 LYS QD . . 6.080 3.548 1.901 4.384 . 0 0 "[ . 1 . 2]" 1
550 1 32 PRO HD2 1 33 TRP H . . 4.040 2.280 2.253 2.416 . 0 0 "[ . 1 . 2]" 1
551 1 32 PRO HD2 1 133 LYS HD2 . . 7.250 4.056 2.406 4.763 . 0 0 "[ . 1 . 2]" 1
552 1 32 PRO HD2 1 133 LYS HD3 . . 7.250 4.644 2.010 6.181 . 0 0 "[ . 1 . 2]" 1
553 1 32 PRO HD3 1 33 TRP H . . 4.040 3.689 3.656 3.790 . 0 0 "[ . 1 . 2]" 1
554 1 32 PRO HD3 1 133 LYS HD2 . . 7.250 5.166 3.583 5.697 . 0 0 "[ . 1 . 2]" 1
555 1 32 PRO HD3 1 133 LYS HD3 . . 7.250 5.927 3.712 7.290 0.040 2 0 "[ . 1 . 2]" 1
556 1 32 PRO HG2 1 33 TRP H . . 3.360 2.744 2.426 3.040 . 0 0 "[ . 1 . 2]" 1
557 1 32 PRO HG2 1 133 LYS HB3 . . 5.500 5.404 4.982 5.582 0.082 17 0 "[ . 1 . 2]" 1
558 1 32 PRO HG2 1 133 LYS HD2 . . 5.500 2.542 1.996 3.077 . 0 0 "[ . 1 . 2]" 1
559 1 32 PRO HG2 1 133 LYS QD . . 4.750 2.409 1.857 2.814 . 0 0 "[ . 1 . 2]" 1
560 1 32 PRO HG2 1 133 LYS HD3 . . 5.500 3.377 1.972 4.439 . 0 0 "[ . 1 . 2]" 1
561 1 32 PRO HG3 1 33 TRP H . . 5.500 4.022 3.824 4.210 . 0 0 "[ . 1 . 2]" 1
562 1 32 PRO HG3 1 133 LYS QD . . 5.020 3.821 3.227 4.277 . 0 0 "[ . 1 . 2]" 1
563 1 33 TRP H 1 33 TRP HA . . 2.800 2.738 2.666 2.799 . 0 0 "[ . 1 . 2]" 1
564 1 33 TRP H 1 33 TRP HB2 . . 3.360 3.419 3.321 3.515 0.155 16 0 "[ . 1 . 2]" 1
565 1 33 TRP H 1 33 TRP QB . . 3.070 2.213 2.019 2.779 . 0 0 "[ . 1 . 2]" 1
566 1 33 TRP H 1 33 TRP HB3 . . 3.360 2.253 2.036 2.924 . 0 0 "[ . 1 . 2]" 1
567 1 33 TRP H 1 34 ILE H . . 3.550 2.712 2.586 2.875 . 0 0 "[ . 1 . 2]" 1
568 1 33 TRP H 1 133 LYS QD . . 5.360 2.910 1.896 3.979 . 0 0 "[ . 1 . 2]" 1
569 1 33 TRP H 1 133 LYS HG2 . . 4.230 4.195 3.830 4.388 0.158 16 0 "[ . 1 . 2]" 1
570 1 33 TRP H 1 134 LEU H . . 5.500 5.581 5.369 5.850 0.350 8 0 "[ . 1 . 2]" 1
571 1 33 TRP HA 1 33 TRP HB2 . . 2.960 2.323 2.217 2.645 . 0 0 "[ . 1 . 2]" 1
572 1 33 TRP HA 1 33 TRP QB . . 2.640 2.132 2.125 2.147 . 0 0 "[ . 1 . 2]" 1
573 1 33 TRP HA 1 33 TRP HB3 . . 2.960 2.578 2.249 2.723 . 0 0 "[ . 1 . 2]" 1
574 1 33 TRP HA 1 133 LYS QE . . 6.380 3.116 1.912 5.264 . 0 0 "[ . 1 . 2]" 1
575 1 33 TRP QB 1 133 LYS QD . . 6.320 2.698 1.932 3.649 . 0 0 "[ . 1 . 2]" 1
576 1 33 TRP QB 1 133 LYS HG2 . . 4.260 2.658 1.979 2.978 . 0 0 "[ . 1 . 2]" 1
577 1 33 TRP QB 1 133 LYS HG3 . . 4.290 2.990 2.496 3.456 . 0 0 "[ . 1 . 2]" 1
578 1 33 TRP HB2 1 133 LYS HD2 . . 7.250 4.560 2.826 5.323 . 0 0 "[ . 1 . 2]" 1
579 1 33 TRP HB2 1 133 LYS HD3 . . 7.250 4.361 2.773 5.988 . 0 0 "[ . 1 . 2]" 1
580 1 33 TRP HB2 1 133 LYS HG2 . . 4.660 3.508 2.936 4.298 . 0 0 "[ . 1 . 2]" 1
581 1 33 TRP HB2 1 133 LYS HG3 . . 4.600 4.195 2.974 4.773 0.173 16 0 "[ . 1 . 2]" 1
582 1 33 TRP HB3 1 133 LYS HD2 . . 7.250 3.503 1.992 4.210 . 0 0 "[ . 1 . 2]" 1
583 1 33 TRP HB3 1 133 LYS HD3 . . 7.250 3.455 1.957 4.866 . 0 0 "[ . 1 . 2]" 1
584 1 33 TRP HB3 1 133 LYS HG2 . . 4.660 2.798 1.991 3.382 . 0 0 "[ . 1 . 2]" 1
585 1 33 TRP HB3 1 133 LYS HG3 . . 4.600 3.072 2.572 3.558 . 0 0 "[ . 1 . 2]" 1
586 1 33 TRP HE1 1 34 ILE H . . 5.500 5.368 4.884 5.549 0.049 3 0 "[ . 1 . 2]" 1
587 1 33 TRP HH2 1 137 CYS HB3 . . 5.500 5.463 5.072 5.595 0.095 13 0 "[ . 1 . 2]" 1
588 1 34 ILE H 1 34 ILE HB . . 3.360 2.711 2.486 2.815 . 0 0 "[ . 1 . 2]" 1
589 1 34 ILE HA 1 57 VAL HA . . 4.630 3.492 3.120 3.854 . 0 0 "[ . 1 . 2]" 1
590 1 34 ILE HB 1 34 ILE MD . . 3.740 2.322 2.084 2.631 . 0 0 "[ . 1 . 2]" 1
591 1 34 ILE MD 1 37 MET QB . . 5.950 3.065 2.464 3.794 . 0 0 "[ . 1 . 2]" 1
592 1 34 ILE QG 1 35 THR H . . 6.160 1.999 1.901 2.569 . 0 0 "[ . 1 . 2]" 1
593 1 34 ILE QG 1 57 VAL MG1 . . 7.400 3.460 2.930 3.947 . 0 0 "[ . 1 . 2]" 1
594 1 34 ILE MG 1 35 THR H . . 4.510 2.249 2.086 2.595 . 0 0 "[ . 1 . 2]" 1
595 1 34 ILE MG 1 36 GLY H . . 5.570 4.149 3.934 4.347 . 0 0 "[ . 1 . 2]" 1
596 1 34 ILE MG 1 37 MET QB . . 7.380 3.263 3.100 3.393 . 0 0 "[ . 1 . 2]" 1
597 1 34 ILE MG 1 55 ALA HA . . 6.530 5.266 5.059 5.333 . 0 0 "[ . 1 . 2]" 1
598 1 34 ILE MG 1 57 VAL HA . . 6.530 5.311 5.149 5.430 . 0 0 "[ . 1 . 2]" 1
599 1 35 THR H 1 35 THR HB . . 4.070 3.486 3.388 3.599 . 0 0 "[ . 1 . 2]" 1
600 1 35 THR H 1 35 THR MG . . 3.920 1.985 1.882 2.152 . 0 0 "[ . 1 . 2]" 1
601 1 35 THR H 1 36 GLY H . . 3.680 2.962 2.848 3.072 . 0 0 "[ . 1 . 2]" 1
602 1 35 THR H 1 56 GLN QB . . 6.380 3.899 3.629 4.068 . 0 0 "[ . 1 . 2]" 1
603 1 35 THR H 1 57 VAL HA . . 3.780 3.784 3.359 3.879 0.099 10 0 "[ . 1 . 2]" 1
604 1 35 THR HA 1 35 THR HB . . 2.650 2.340 2.327 2.401 . 0 0 "[ . 1 . 2]" 1
605 1 35 THR HA 1 36 GLY H . . 3.610 3.556 3.530 3.580 . 0 0 "[ . 1 . 2]" 1
606 1 35 THR HA 1 58 GLY H . . 4.630 4.702 4.659 4.770 0.140 18 0 "[ . 1 . 2]" 1
607 1 35 THR HA 1 58 GLY QA . . 5.170 4.340 4.215 4.539 . 0 0 "[ . 1 . 2]" 1
608 1 35 THR HB 1 36 GLY H . . 3.860 3.517 3.470 3.565 . 0 0 "[ . 1 . 2]" 1
609 1 35 THR MG 1 36 GLY H . . 3.460 1.806 1.660 1.831 . 0 0 "[ . 1 . 2]" 1
610 1 35 THR MG 1 36 GLY HA2 . . 6.530 4.309 4.058 4.359 . 0 0 "[ . 1 . 2]" 1
611 1 35 THR MG 1 57 VAL HA . . 6.530 1.935 1.890 2.188 . 0 0 "[ . 1 . 2]" 1
612 1 35 THR MG 1 58 GLY H . . 5.970 1.998 1.902 2.251 . 0 0 "[ . 1 . 2]" 1
613 1 35 THR MG 1 58 GLY QA . . 6.440 2.825 2.724 2.889 . 0 0 "[ . 1 . 2]" 1
614 1 36 GLY H 1 36 GLY HA2 . . 2.870 2.929 2.908 2.947 0.077 15 0 "[ . 1 . 2]" 1
615 1 36 GLY H 1 37 MET H . . 4.760 4.595 4.568 4.619 . 0 0 "[ . 1 . 2]" 1
616 1 36 GLY H 1 55 ALA HA . . 5.500 5.082 4.767 5.316 . 0 0 "[ . 1 . 2]" 1
617 1 36 GLY H 1 56 GLN H . . 3.760 3.293 2.865 3.573 . 0 0 "[ . 1 . 2]" 1
618 1 36 GLY H 1 56 GLN HA . . 4.970 4.663 4.528 4.762 . 0 0 "[ . 1 . 2]" 1
619 1 36 GLY H 1 56 GLN HB2 . . 3.580 1.975 1.901 2.106 . 0 0 "[ . 1 . 2]" 1
620 1 36 GLY H 1 56 GLN QB . . 3.330 1.943 1.883 2.061 . 0 0 "[ . 1 . 2]" 1
621 1 36 GLY H 1 56 GLN HB3 . . 3.580 2.900 2.632 3.185 . 0 0 "[ . 1 . 2]" 1
622 1 36 GLY H 1 57 VAL HA . . 5.340 4.932 4.800 5.032 . 0 0 "[ . 1 . 2]" 1
623 1 36 GLY HA2 1 37 MET H . . 3.140 2.333 2.300 2.368 . 0 0 "[ . 1 . 2]" 1
624 1 36 GLY HA2 1 56 GLN HB2 . . 5.500 4.095 3.990 4.165 . 0 0 "[ . 1 . 2]" 1
625 1 36 GLY HA2 1 56 GLN QB . . 5.350 3.990 3.883 4.050 . 0 0 "[ . 1 . 2]" 1
626 1 36 GLY HA2 1 56 GLN HB3 . . 5.500 5.510 5.283 5.665 0.165 5 0 "[ . 1 . 2]" 1
627 1 36 GLY HA2 1 56 GLN QG . . 6.380 5.285 5.022 5.465 . 0 0 "[ . 1 . 2]" 1
628 1 36 GLY HA3 1 37 MET H . . 2.930 2.964 2.912 3.016 0.086 6 0 "[ . 1 . 2]" 1
629 1 36 GLY HA3 1 37 MET HA . . 4.570 4.324 4.311 4.339 . 0 0 "[ . 1 . 2]" 1
630 1 36 GLY HA3 1 37 MET QB . . 5.360 4.666 4.617 4.734 . 0 0 "[ . 1 . 2]" 1
631 1 36 GLY HA3 1 56 GLN QB . . 5.980 2.706 2.558 2.873 . 0 0 "[ . 1 . 2]" 1
632 1 37 MET H 1 37 MET HB2 . . 4.010 3.754 3.385 4.005 . 0 0 "[ . 1 . 2]" 1
633 1 37 MET H 1 37 MET QB . . 3.730 2.934 2.662 3.205 . 0 0 "[ . 1 . 2]" 1
634 1 37 MET H 1 37 MET HB3 . . 4.010 3.065 2.753 3.380 . 0 0 "[ . 1 . 2]" 1
635 1 37 MET H 1 37 MET QG . . 5.050 3.692 2.963 4.204 . 0 0 "[ . 1 . 2]" 1
636 1 37 MET H 1 38 ARG H . . 4.790 4.329 4.289 4.360 . 0 0 "[ . 1 . 2]" 1
637 1 37 MET HA 1 38 ARG H . . 2.400 2.362 2.311 2.378 . 0 0 "[ . 1 . 2]" 1
638 1 37 MET HA 1 38 ARG HB2 . . 4.660 3.987 3.972 4.016 . 0 0 "[ . 1 . 2]" 1
639 1 37 MET HA 1 55 ALA HA . . 2.870 2.265 2.035 2.495 . 0 0 "[ . 1 . 2]" 1
640 1 37 MET HA 1 55 ALA MB . . 6.530 3.538 2.870 3.879 . 0 0 "[ . 1 . 2]" 1
641 1 37 MET HA 1 56 GLN H . . 5.500 3.839 3.770 3.908 . 0 0 "[ . 1 . 2]" 1
642 1 37 MET QB 1 38 ARG H . . 3.890 3.163 2.801 3.633 . 0 0 "[ . 1 . 2]" 1
643 1 37 MET QB 1 39 THR MG . . 7.410 4.198 3.701 4.721 . 0 0 "[ . 1 . 2]" 1
644 1 37 MET HB2 1 38 ARG H . . 4.110 3.370 2.850 4.123 0.013 17 0 "[ . 1 . 2]" 1
645 1 37 MET HB3 1 38 ARG H . . 4.110 4.102 4.013 4.177 0.067 16 0 "[ . 1 . 2]" 1
646 1 37 MET QG 1 38 ARG H . . 4.710 2.911 1.936 3.682 . 0 0 "[ . 1 . 2]" 1
647 1 37 MET QG 1 39 THR MG . . 5.490 3.356 2.681 3.920 . 0 0 "[ . 1 . 2]" 1
648 1 37 MET HG2 1 38 ARG H . . 5.500 3.567 1.943 3.877 . 0 0 "[ . 1 . 2]" 1
649 1 37 MET HG2 1 39 THR MG . . 6.000 3.819 3.002 4.407 . 0 0 "[ . 1 . 2]" 1
650 1 37 MET HG3 1 38 ARG H . . 5.500 3.692 2.075 4.696 . 0 0 "[ . 1 . 2]" 1
651 1 37 MET HG3 1 39 THR MG . . 6.000 3.898 2.777 4.834 . 0 0 "[ . 1 . 2]" 1
652 1 38 ARG H 1 38 ARG HB2 . . 3.300 3.002 2.814 3.073 . 0 0 "[ . 1 . 2]" 1
653 1 38 ARG H 1 38 ARG HB3 . . 3.490 3.487 3.398 3.530 0.040 1 0 "[ . 1 . 2]" 1
654 1 38 ARG H 1 38 ARG QD . . 5.260 4.335 4.011 4.750 . 0 0 "[ . 1 . 2]" 1
655 1 38 ARG H 1 39 THR H . . 5.250 4.148 4.078 4.228 . 0 0 "[ . 1 . 2]" 1
656 1 38 ARG H 1 39 THR MG . . 6.500 3.173 3.017 3.302 . 0 0 "[ . 1 . 2]" 1
657 1 38 ARG H 1 53 ALA MB . . 6.530 4.545 4.293 4.754 . 0 0 "[ . 1 . 2]" 1
658 1 38 ARG H 1 54 GLU H . . 3.640 3.017 2.826 3.325 . 0 0 "[ . 1 . 2]" 1
659 1 38 ARG H 1 55 ALA HA . . 3.830 3.812 3.591 3.879 0.049 14 0 "[ . 1 . 2]" 1
660 1 38 ARG H 1 55 ALA MB . . 6.530 4.343 3.847 4.584 . 0 0 "[ . 1 . 2]" 1
661 1 38 ARG HA 1 39 THR H . . 2.560 2.274 2.254 2.305 . 0 0 "[ . 1 . 2]" 1
662 1 38 ARG HA 1 39 THR MG . . 5.570 3.539 3.147 3.705 . 0 0 "[ . 1 . 2]" 1
663 1 38 ARG HA 1 54 GLU H . . 5.500 4.796 4.691 4.924 . 0 0 "[ . 1 . 2]" 1
664 1 38 ARG HB2 1 39 THR H . . 4.570 4.470 4.404 4.518 . 0 0 "[ . 1 . 2]" 1
665 1 38 ARG HB3 1 39 THR H . . 3.580 3.587 3.487 3.648 0.068 6 0 "[ . 1 . 2]" 1
666 1 38 ARG HB3 1 39 THR MG . . 6.530 4.575 4.497 4.667 . 0 0 "[ . 1 . 2]" 1
667 1 38 ARG QD 1 39 THR H . . 6.380 4.293 2.105 5.160 . 0 0 "[ . 1 . 2]" 1
668 1 39 THR H 1 39 THR HB . . 4.200 3.780 3.758 3.833 . 0 0 "[ . 1 . 2]" 1
669 1 39 THR H 1 39 THR MG . . 3.990 2.924 2.662 3.078 . 0 0 "[ . 1 . 2]" 1
670 1 39 THR H 1 40 TRP H . . 4.570 4.200 4.133 4.271 . 0 0 "[ . 1 . 2]" 1
671 1 39 THR HA 1 39 THR HB . . 2.520 2.523 2.449 2.562 0.042 1 0 "[ . 1 . 2]" 1
672 1 39 THR HA 1 39 THR MG . . 3.430 2.411 2.298 2.583 . 0 0 "[ . 1 . 2]" 1
673 1 39 THR HA 1 40 TRP H . . 2.430 2.151 2.149 2.156 . 0 0 "[ . 1 . 2]" 1
674 1 39 THR HA 1 40 TRP HE3 . . 3.890 3.443 3.058 3.820 . 0 0 "[ . 1 . 2]" 1
675 1 39 THR HA 1 51 VAL MG1 . . 6.530 5.449 5.399 5.491 . 0 0 "[ . 1 . 2]" 1
676 1 39 THR HA 1 52 ASP H . . 5.500 4.853 4.753 4.979 . 0 0 "[ . 1 . 2]" 1
677 1 39 THR HA 1 53 ALA HA . . 2.900 2.628 2.542 2.861 . 0 0 "[ . 1 . 2]" 1
678 1 39 THR HA 1 53 ALA MB . . 4.950 3.720 3.507 3.986 . 0 0 "[ . 1 . 2]" 1
679 1 39 THR HA 1 54 GLU H . . 4.480 3.672 3.490 3.851 . 0 0 "[ . 1 . 2]" 1
680 1 39 THR HB 1 40 TRP H . . 3.700 3.624 3.536 3.710 0.010 14 0 "[ . 1 . 2]" 1
681 1 39 THR HB 1 51 VAL MG1 . . 5.750 4.709 4.631 4.757 . 0 0 "[ . 1 . 2]" 1
682 1 39 THR HB 1 53 ALA MB . . 6.530 3.836 3.501 4.413 . 0 0 "[ . 1 . 2]" 1
683 1 39 THR MG 1 40 TRP H . . 5.190 4.180 4.073 4.298 . 0 0 "[ . 1 . 2]" 1
684 1 39 THR MG 1 40 TRP HE3 . . 6.530 5.021 4.740 5.314 . 0 0 "[ . 1 . 2]" 1
685 1 39 THR MG 1 51 VAL MG2 . . 7.120 3.533 3.417 3.665 . 0 0 "[ . 1 . 2]" 1
686 1 39 THR MG 1 53 ALA HA . . 3.770 2.496 2.033 2.896 . 0 0 "[ . 1 . 2]" 1
687 1 39 THR MG 1 54 GLU H . . 5.500 3.513 3.114 3.861 . 0 0 "[ . 1 . 2]" 1
688 1 40 TRP H 1 40 TRP HE3 . . 5.500 2.903 2.401 3.324 . 0 0 "[ . 1 . 2]" 1
689 1 40 TRP H 1 51 VAL MG1 . . 5.660 4.325 4.243 4.396 . 0 0 "[ . 1 . 2]" 1
690 1 40 TRP H 1 51 VAL MG2 . . 5.720 2.310 1.942 2.556 . 0 0 "[ . 1 . 2]" 1
691 1 40 TRP H 1 52 ASP H . . 4.170 3.361 3.293 3.453 . 0 0 "[ . 1 . 2]" 1
692 1 40 TRP H 1 53 ALA HA . . 4.170 4.096 3.983 4.241 0.071 13 0 "[ . 1 . 2]" 1
693 1 40 TRP HA 1 40 TRP HB2 . . 2.770 2.228 2.212 2.249 . 0 0 "[ . 1 . 2]" 1
694 1 40 TRP HA 1 40 TRP HB3 . . 2.930 2.696 2.648 2.741 . 0 0 "[ . 1 . 2]" 1
695 1 40 TRP HA 1 41 ASN H . . 2.870 2.667 2.630 2.727 . 0 0 "[ . 1 . 2]" 1
696 1 40 TRP HA 1 41 ASN HA . . 4.970 4.635 4.613 4.668 . 0 0 "[ . 1 . 2]" 1
697 1 40 TRP HB2 1 41 ASN H . . 3.550 2.669 2.597 2.774 . 0 0 "[ . 1 . 2]" 1
698 1 40 TRP HB3 1 41 ASN H . . 3.860 3.877 3.807 3.915 0.055 4 0 "[ . 1 . 2]" 1
699 1 40 TRP HD1 1 41 ASN H . . 4.410 2.421 2.007 2.918 . 0 0 "[ . 1 . 2]" 1
700 1 40 TRP HD1 1 41 ASN HB2 . . 4.010 3.864 3.654 4.031 0.021 4 0 "[ . 1 . 2]" 1
701 1 40 TRP HD1 1 41 ASN HB3 . . 5.500 5.194 4.789 5.494 . 0 0 "[ . 1 . 2]" 1
702 1 40 TRP HE1 1 41 ASN H . . 5.500 4.416 4.023 4.763 . 0 0 "[ . 1 . 2]" 1
703 1 40 TRP HE1 1 41 ASN HB2 . . 5.340 3.778 3.609 3.969 . 0 0 "[ . 1 . 2]" 1
704 1 40 TRP HE1 1 41 ASN HB3 . . 5.500 5.076 4.783 5.320 . 0 0 "[ . 1 . 2]" 1
705 1 40 TRP HE1 1 41 ASN HD21 . . 5.130 2.787 1.896 3.984 . 0 0 "[ . 1 . 2]" 1
706 1 40 TRP HE1 1 41 ASN QD . . 4.900 2.455 1.843 3.268 . 0 0 "[ . 1 . 2]" 1
707 1 40 TRP HE1 1 41 ASN HD22 . . 5.130 2.853 2.224 3.616 . 0 0 "[ . 1 . 2]" 1
708 1 41 ASN H 1 41 ASN HA . . 2.400 2.169 2.167 2.173 . 0 0 "[ . 1 . 2]" 1
709 1 41 ASN H 1 41 ASN HB2 . . 3.300 3.217 3.164 3.271 . 0 0 "[ . 1 . 2]" 1
710 1 41 ASN H 1 42 GLY H . . 3.450 3.392 3.184 3.469 0.019 4 0 "[ . 1 . 2]" 1
711 1 41 ASN H 1 51 VAL MG1 . . 6.530 3.838 3.668 4.029 . 0 0 "[ . 1 . 2]" 1
712 1 41 ASN HA 1 41 ASN HB2 . . 2.930 2.891 2.848 2.953 0.023 1 0 "[ . 1 . 2]" 1
713 1 41 ASN HA 1 42 GLY H . . 2.930 2.311 2.286 2.372 . 0 0 "[ . 1 . 2]" 1
714 1 41 ASN HA 1 51 VAL MG1 . . 5.910 4.514 4.422 4.709 . 0 0 "[ . 1 . 2]" 1
715 1 41 ASN HB2 1 42 GLY H . . 4.940 4.722 4.698 4.738 . 0 0 "[ . 1 . 2]" 1
716 1 41 ASN HB2 1 51 VAL MG1 . . 6.530 5.413 5.386 5.433 . 0 0 "[ . 1 . 2]" 1
717 1 41 ASN HB2 1 51 VAL MG2 . . 6.530 5.122 4.803 5.312 . 0 0 "[ . 1 . 2]" 1
718 1 41 ASN HB3 1 42 GLY H . . 4.760 4.129 4.048 4.209 . 0 0 "[ . 1 . 2]" 1
719 1 41 ASN HB3 1 42 GLY HA3 . . 5.500 4.866 4.808 4.944 . 0 0 "[ . 1 . 2]" 1
720 1 41 ASN HB3 1 51 VAL MG1 . . 6.530 5.268 5.199 5.393 . 0 0 "[ . 1 . 2]" 1
721 1 41 ASN HB3 1 51 VAL MG2 . . 6.530 5.387 5.301 5.441 . 0 0 "[ . 1 . 2]" 1
722 1 41 ASN HB3 1 52 ASP H . . 4.720 3.466 3.282 3.619 . 0 0 "[ . 1 . 2]" 1
723 1 42 GLY H 1 42 GLY HA2 . . 2.900 2.795 2.765 2.833 . 0 0 "[ . 1 . 2]" 1
724 1 42 GLY H 1 43 ARG H . . 4.540 4.159 4.073 4.262 . 0 0 "[ . 1 . 2]" 1
725 1 42 GLY H 1 51 VAL HA . . 4.320 4.369 4.338 4.420 0.100 4 0 "[ . 1 . 2]" 1
726 1 42 GLY H 1 51 VAL HB . . 5.500 4.051 3.909 4.149 . 0 0 "[ . 1 . 2]" 1
727 1 42 GLY H 1 51 VAL MG1 . . 4.640 3.342 3.173 3.482 . 0 0 "[ . 1 . 2]" 1
728 1 42 GLY H 1 51 VAL MG2 . . 6.530 5.342 5.202 5.454 . 0 0 "[ . 1 . 2]" 1
729 1 42 GLY H 1 52 ASP H . . 5.500 5.125 5.036 5.232 . 0 0 "[ . 1 . 2]" 1
730 1 42 GLY HA2 1 43 ARG H . . 3.140 3.090 2.986 3.173 0.033 18 0 "[ . 1 . 2]" 1
731 1 42 GLY HA2 1 51 VAL HA . . 3.330 3.130 3.077 3.223 . 0 0 "[ . 1 . 2]" 1
732 1 42 GLY HA2 1 51 VAL HB . . 5.500 4.375 4.255 4.501 . 0 0 "[ . 1 . 2]" 1
733 1 42 GLY HA2 1 51 VAL MG1 . . 4.760 3.598 3.554 3.648 . 0 0 "[ . 1 . 2]" 1
734 1 42 GLY HA2 1 51 VAL MG2 . . 6.530 5.505 5.433 5.584 . 0 0 "[ . 1 . 2]" 1
735 1 42 GLY HA3 1 43 ARG H . . 3.420 2.262 2.225 2.318 . 0 0 "[ . 1 . 2]" 1
736 1 42 GLY HA3 1 50 THR H . . 4.970 4.655 4.516 4.793 . 0 0 "[ . 1 . 2]" 1
737 1 42 GLY HA3 1 50 THR HB . . 5.500 4.808 4.656 5.015 . 0 0 "[ . 1 . 2]" 1
738 1 42 GLY HA3 1 50 THR MG . . 5.470 4.314 4.061 4.435 . 0 0 "[ . 1 . 2]" 1
739 1 42 GLY HA3 1 51 VAL H . . 4.410 4.414 4.395 4.446 0.036 10 0 "[ . 1 . 2]" 1
740 1 42 GLY HA3 1 51 VAL HA . . 3.020 2.003 1.956 2.053 . 0 0 "[ . 1 . 2]" 1
741 1 42 GLY HA3 1 51 VAL HB . . 4.200 3.095 2.973 3.190 . 0 0 "[ . 1 . 2]" 1
742 1 42 GLY HA3 1 51 VAL MG1 . . 4.390 2.004 1.961 2.085 . 0 0 "[ . 1 . 2]" 1
743 1 42 GLY HA3 1 51 VAL MG2 . . 5.130 4.280 4.237 4.336 . 0 0 "[ . 1 . 2]" 1
744 1 42 GLY HA3 1 52 ASP H . . 5.130 3.972 3.880 4.036 . 0 0 "[ . 1 . 2]" 1
745 1 43 ARG H 1 43 ARG QB . . 3.760 3.182 3.011 3.280 . 0 0 "[ . 1 . 2]" 1
746 1 43 ARG H 1 43 ARG QG . . 4.670 2.216 1.957 2.365 . 0 0 "[ . 1 . 2]" 1
747 1 43 ARG H 1 44 VAL H . . 4.450 4.420 4.374 4.477 0.027 11 0 "[ . 1 . 2]" 1
748 1 43 ARG H 1 49 SER HA . . 5.500 5.048 4.884 5.457 . 0 0 "[ . 1 . 2]" 1
749 1 43 ARG H 1 50 THR H . . 3.360 3.157 3.006 3.436 0.076 10 0 "[ . 1 . 2]" 1
750 1 43 ARG H 1 50 THR HA . . 5.500 4.787 4.738 4.912 . 0 0 "[ . 1 . 2]" 1
751 1 43 ARG H 1 50 THR HB . . 4.850 3.398 3.037 3.597 . 0 0 "[ . 1 . 2]" 1
752 1 43 ARG H 1 50 THR MG . . 5.540 4.005 3.723 4.272 . 0 0 "[ . 1 . 2]" 1
753 1 43 ARG H 1 51 VAL HA . . 3.700 3.667 3.549 3.704 0.004 14 0 "[ . 1 . 2]" 1
754 1 43 ARG H 1 51 VAL HB . . 5.500 4.924 4.683 5.114 . 0 0 "[ . 1 . 2]" 1
755 1 43 ARG H 1 51 VAL MG1 . . 4.230 2.735 2.434 2.988 . 0 0 "[ . 1 . 2]" 1
756 1 43 ARG H 1 51 VAL MG2 . . 6.530 5.289 5.084 5.472 . 0 0 "[ . 1 . 2]" 1
757 1 43 ARG HA 1 43 ARG HB2 . . 2.990 2.579 2.512 2.621 . 0 0 "[ . 1 . 2]" 1
758 1 43 ARG HA 1 43 ARG QB . . 2.700 2.210 2.206 2.215 . 0 0 "[ . 1 . 2]" 1
759 1 43 ARG HA 1 43 ARG HB3 . . 2.990 2.405 2.373 2.462 . 0 0 "[ . 1 . 2]" 1
760 1 43 ARG HA 1 43 ARG QD . . 4.980 4.286 3.935 4.403 . 0 0 "[ . 1 . 2]" 1
761 1 43 ARG HA 1 44 VAL H . . 2.900 2.458 2.391 2.530 . 0 0 "[ . 1 . 2]" 1
762 1 43 ARG QB 1 44 VAL MG2 . . 7.410 5.399 5.366 5.421 . 0 0 "[ . 1 . 2]" 1
763 1 43 ARG QB 1 50 THR HB . . 6.380 4.658 4.309 4.899 . 0 0 "[ . 1 . 2]" 1
764 1 43 ARG HB2 1 44 VAL H . . 3.920 2.593 2.423 2.780 . 0 0 "[ . 1 . 2]" 1
765 1 43 ARG HB3 1 44 VAL H . . 3.920 3.779 3.695 3.854 . 0 0 "[ . 1 . 2]" 1
766 1 43 ARG QD 1 44 VAL H . . 6.380 4.242 3.240 4.660 . 0 0 "[ . 1 . 2]" 1
767 1 43 ARG QD 1 50 THR HB . . 6.380 3.768 3.236 4.338 . 0 0 "[ . 1 . 2]" 1
768 1 43 ARG QD 1 50 THR MG . . 7.400 4.499 4.016 5.004 . 0 0 "[ . 1 . 2]" 1
769 1 43 ARG QG 1 44 VAL H . . 5.350 3.981 3.697 4.226 . 0 0 "[ . 1 . 2]" 1
770 1 43 ARG QG 1 50 THR H . . 5.970 3.185 2.897 3.424 . 0 0 "[ . 1 . 2]" 1
771 1 43 ARG QG 1 50 THR HB . . 5.350 2.431 2.008 2.703 . 0 0 "[ . 1 . 2]" 1
772 1 43 ARG QG 1 50 THR MG . . 7.400 3.416 2.933 3.644 . 0 0 "[ . 1 . 2]" 1
773 1 43 ARG QG 1 51 VAL H . . 6.380 5.608 5.443 5.732 . 0 0 "[ . 1 . 2]" 1
774 1 43 ARG QG 1 51 VAL MG1 . . 6.820 4.250 4.162 4.354 . 0 0 "[ . 1 . 2]" 1
775 1 44 VAL H 1 44 VAL HB . . 3.080 3.054 2.978 3.119 0.039 15 0 "[ . 1 . 2]" 1
776 1 44 VAL H 1 44 VAL MG2 . . 4.610 3.887 3.801 3.935 . 0 0 "[ . 1 . 2]" 1
777 1 44 VAL H 1 45 ASP H . . 4.480 4.275 4.183 4.452 . 0 0 "[ . 1 . 2]" 1
778 1 44 VAL HA 1 44 VAL HB . . 2.740 2.474 2.396 2.523 . 0 0 "[ . 1 . 2]" 1
779 1 44 VAL HA 1 44 VAL MG2 . . 3.430 2.277 2.143 2.424 . 0 0 "[ . 1 . 2]" 1
780 1 44 VAL HA 1 45 ASP H . . 2.400 2.192 2.182 2.227 . 0 0 "[ . 1 . 2]" 1
781 1 44 VAL HA 1 49 SER HA . . 4.350 2.304 2.126 2.481 . 0 0 "[ . 1 . 2]" 1
782 1 44 VAL HA 1 49 SER QB . . 6.380 3.870 3.211 4.301 . 0 0 "[ . 1 . 2]" 1
783 1 44 VAL HA 1 50 THR H . . 4.010 3.245 3.082 3.365 . 0 0 "[ . 1 . 2]" 1
784 1 44 VAL HB 1 45 ASP H . . 4.630 4.365 4.182 4.451 . 0 0 "[ . 1 . 2]" 1
785 1 44 VAL HB 1 49 SER HA . . 5.500 3.950 3.475 4.325 . 0 0 "[ . 1 . 2]" 1
786 1 44 VAL HB 1 50 THR H . . 5.500 4.638 4.453 4.854 . 0 0 "[ . 1 . 2]" 1
787 1 44 VAL MG2 1 45 ASP H . . 4.390 2.717 2.301 2.902 . 0 0 "[ . 1 . 2]" 1
788 1 44 VAL MG2 1 45 ASP HA . . 6.530 3.868 3.626 4.080 . 0 0 "[ . 1 . 2]" 1
789 1 44 VAL MG2 1 45 ASP HB2 . . 6.530 5.013 4.814 5.130 . 0 0 "[ . 1 . 2]" 1
790 1 44 VAL MG2 1 45 ASP HB3 . . 6.530 5.040 4.512 5.238 . 0 0 "[ . 1 . 2]" 1
791 1 44 VAL MG2 1 46 GLY H . . 5.940 4.626 4.337 4.823 . 0 0 "[ . 1 . 2]" 1
792 1 44 VAL MG2 1 48 VAL H . . 5.010 3.848 3.540 4.060 . 0 0 "[ . 1 . 2]" 1
793 1 44 VAL MG2 1 49 SER HA . . 4.230 2.974 2.784 3.438 . 0 0 "[ . 1 . 2]" 1
794 1 44 VAL MG2 1 49 SER QB . . 5.270 3.112 2.097 3.588 . 0 0 "[ . 1 . 2]" 1
795 1 44 VAL MG2 1 50 THR H . . 5.750 4.516 4.315 4.726 . 0 0 "[ . 1 . 2]" 1
796 1 45 ASP H 1 45 ASP HA . . 2.900 2.910 2.904 2.915 0.015 20 0 "[ . 1 . 2]" 1
797 1 45 ASP H 1 45 ASP HB2 . . 3.050 2.947 2.798 3.181 0.131 11 0 "[ . 1 . 2]" 1
798 1 45 ASP H 1 45 ASP HB3 . . 2.800 2.797 2.548 2.845 0.045 4 0 "[ . 1 . 2]" 1
799 1 45 ASP H 1 46 GLY H . . 5.500 4.331 4.291 4.460 . 0 0 "[ . 1 . 2]" 1
800 1 45 ASP H 1 48 VAL H . . 3.610 3.489 3.424 3.554 . 0 0 "[ . 1 . 2]" 1
801 1 45 ASP H 1 48 VAL HB . . 3.860 3.745 3.400 3.864 0.004 13 0 "[ . 1 . 2]" 1
802 1 45 ASP H 1 49 SER HA . . 3.270 3.074 2.717 3.175 . 0 0 "[ . 1 . 2]" 1
803 1 45 ASP H 1 49 SER QB . . 5.630 4.770 4.109 5.030 . 0 0 "[ . 1 . 2]" 1
804 1 45 ASP HA 1 45 ASP HB2 . . 2.680 2.596 2.439 2.640 . 0 0 "[ . 1 . 2]" 1
805 1 45 ASP HA 1 45 ASP HB3 . . 3.050 3.044 3.037 3.049 . 0 0 "[ . 1 . 2]" 1
806 1 45 ASP HA 1 46 GLY H . . 2.490 2.302 2.272 2.454 . 0 0 "[ . 1 . 2]" 1
807 1 45 ASP HB2 1 46 GLY H . . 4.600 4.351 3.898 4.457 . 0 0 "[ . 1 . 2]" 1
808 1 45 ASP HB3 1 46 GLY H . . 3.980 3.984 3.858 4.020 0.040 5 0 "[ . 1 . 2]" 1
809 1 46 GLY H 1 46 GLY HA2 . . 2.680 2.300 2.253 2.684 0.004 10 0 "[ . 1 . 2]" 1
810 1 46 GLY H 1 46 GLY QA . . 2.400 2.152 2.151 2.153 . 0 0 "[ . 1 . 2]" 1
811 1 46 GLY H 1 46 GLY HA3 . . 2.680 2.665 2.266 2.727 0.047 16 0 "[ . 1 . 2]" 1
812 1 46 GLY H 1 47 ALA H . . 4.690 4.594 4.547 4.614 . 0 0 "[ . 1 . 2]" 1
813 1 46 GLY QA 1 47 ALA H . . 2.950 2.175 2.169 2.183 . 0 0 "[ . 1 . 2]" 1
814 1 46 GLY QA 1 47 ALA HA . . 5.700 3.958 3.937 4.132 . 0 0 "[ . 1 . 2]" 1
815 1 46 GLY QA 1 47 ALA MB . . 5.600 3.662 3.471 3.696 . 0 0 "[ . 1 . 2]" 1
816 1 46 GLY QA 1 48 VAL H . . 4.300 3.463 3.321 3.550 . 0 0 "[ . 1 . 2]" 1
817 1 46 GLY HA2 1 47 ALA H . . 3.210 3.113 2.201 3.259 0.049 15 0 "[ . 1 . 2]" 1
818 1 46 GLY HA2 1 47 ALA MB . . 6.430 4.349 3.949 4.425 . 0 0 "[ . 1 . 2]" 1
819 1 46 GLY HA2 1 48 VAL H . . 5.070 4.271 3.669 4.433 . 0 0 "[ . 1 . 2]" 1
820 1 46 GLY HA3 1 47 ALA H . . 3.210 2.320 2.204 3.289 0.079 10 0 "[ . 1 . 2]" 1
821 1 46 GLY HA3 1 47 ALA MB . . 6.430 3.943 3.848 3.968 . 0 0 "[ . 1 . 2]" 1
822 1 46 GLY HA3 1 48 VAL H . . 5.070 3.708 3.466 4.374 . 0 0 "[ . 1 . 2]" 1
823 1 47 ALA H 1 47 ALA HA . . 2.900 2.849 2.243 2.926 0.026 18 0 "[ . 1 . 2]" 1
824 1 47 ALA H 1 47 ALA MB . . 3.430 2.157 2.077 2.694 . 0 0 "[ . 1 . 2]" 1
825 1 47 ALA H 1 48 VAL H . . 2.990 2.978 2.847 3.019 0.029 7 0 "[ . 1 . 2]" 1
826 1 47 ALA H 1 48 VAL MG2 . . 5.570 3.687 3.488 4.548 . 0 0 "[ . 1 . 2]" 1
827 1 47 ALA HA 1 48 VAL H . . 3.170 2.902 2.857 2.995 . 0 0 "[ . 1 . 2]" 1
828 1 47 ALA HA 1 74 LYS H . . 4.070 3.986 3.554 4.085 0.015 4 0 "[ . 1 . 2]" 1
829 1 47 ALA HA 1 74 LYS QB . . 6.380 4.438 3.869 4.684 . 0 0 "[ . 1 . 2]" 1
830 1 47 ALA HA 1 74 LYS HD2 . . 5.500 3.954 2.758 5.008 . 0 0 "[ . 1 . 2]" 1
831 1 47 ALA HA 1 74 LYS QD . . 5.200 3.002 1.984 4.172 . 0 0 "[ . 1 . 2]" 1
832 1 47 ALA HA 1 74 LYS HD3 . . 5.500 3.298 1.993 5.122 . 0 0 "[ . 1 . 2]" 1
833 1 47 ALA HA 1 74 LYS HG2 . . 5.500 2.889 1.987 3.467 . 0 0 "[ . 1 . 2]" 1
834 1 47 ALA HA 1 74 LYS QG . . 4.850 2.794 1.971 3.345 . 0 0 "[ . 1 . 2]" 1
835 1 47 ALA HA 1 74 LYS HG3 . . 5.500 3.861 2.821 4.745 . 0 0 "[ . 1 . 2]" 1
836 1 47 ALA MB 1 48 VAL H . . 4.420 3.729 3.681 3.747 . 0 0 "[ . 1 . 2]" 1
837 1 47 ALA MB 1 48 VAL HB . . 6.530 4.869 4.714 4.918 . 0 0 "[ . 1 . 2]" 1
838 1 47 ALA MB 1 48 VAL MG2 . . 7.310 3.271 3.017 3.409 . 0 0 "[ . 1 . 2]" 1
839 1 47 ALA MB 1 73 ASP HA . . 5.320 4.158 4.047 4.278 . 0 0 "[ . 1 . 2]" 1
840 1 47 ALA MB 1 74 LYS H . . 4.480 2.809 2.658 2.979 . 0 0 "[ . 1 . 2]" 1
841 1 47 ALA MB 1 74 LYS QB . . 5.170 3.646 3.467 3.759 . 0 0 "[ . 1 . 2]" 1
842 1 47 ALA MB 1 74 LYS QD . . 5.270 2.586 1.859 3.323 . 0 0 "[ . 1 . 2]" 1
843 1 47 ALA MB 1 74 LYS QE . . 7.060 2.709 1.848 3.748 . 0 0 "[ . 1 . 2]" 1
844 1 47 ALA MB 1 74 LYS QG . . 5.080 1.815 1.720 1.885 . 0 0 "[ . 1 . 2]" 1
845 1 47 ALA MB 1 75 ASP H . . 3.460 2.383 2.077 2.545 . 0 0 "[ . 1 . 2]" 1
846 1 47 ALA MB 1 75 ASP HB2 . . 4.610 1.946 1.827 2.053 . 0 0 "[ . 1 . 2]" 1
847 1 47 ALA MB 1 75 ASP QB . . 4.280 1.935 1.818 2.039 . 0 0 "[ . 1 . 2]" 1
848 1 47 ALA MB 1 75 ASP HB3 . . 4.610 3.389 3.211 3.505 . 0 0 "[ . 1 . 2]" 1
849 1 47 ALA MB 1 76 ALA H . . 6.340 4.207 3.976 4.326 . 0 0 "[ . 1 . 2]" 1
850 1 48 VAL H 1 48 VAL HB . . 3.050 2.624 2.515 2.773 . 0 0 "[ . 1 . 2]" 1
851 1 48 VAL H 1 48 VAL MG1 . . 4.610 3.753 3.709 3.829 . 0 0 "[ . 1 . 2]" 1
852 1 48 VAL H 1 48 VAL MG2 . . 4.050 3.184 3.101 3.245 . 0 0 "[ . 1 . 2]" 1
853 1 48 VAL H 1 49 SER H . . 4.510 4.404 4.373 4.447 . 0 0 "[ . 1 . 2]" 1
854 1 48 VAL HA 1 49 SER H . . 2.400 2.328 2.306 2.409 0.009 10 0 "[ . 1 . 2]" 1
855 1 48 VAL HA 1 49 SER QB . . 6.160 4.059 3.815 4.396 . 0 0 "[ . 1 . 2]" 1
856 1 48 VAL HA 1 73 ASP HA . . 2.960 2.119 2.006 2.278 . 0 0 "[ . 1 . 2]" 1
857 1 48 VAL HA 1 73 ASP QB . . 6.380 3.778 3.631 4.215 . 0 0 "[ . 1 . 2]" 1
858 1 48 VAL HA 1 74 LYS H . . 3.490 3.406 3.266 3.515 0.025 4 0 "[ . 1 . 2]" 1
859 1 48 VAL HB 1 49 SER H . . 4.070 4.078 3.883 4.132 0.062 4 0 "[ . 1 . 2]" 1
860 1 48 VAL MG1 1 49 SER H . . 3.680 2.055 1.949 2.272 . 0 0 "[ . 1 . 2]" 1
861 1 48 VAL MG1 1 71 ARG QG . . 7.410 3.726 2.872 5.031 . 0 0 "[ . 1 . 2]" 1
862 1 48 VAL MG1 1 72 ARG H . . 5.290 3.535 3.179 3.896 . 0 0 "[ . 1 . 2]" 1
863 1 48 VAL MG1 1 73 ASP HA . . 6.370 3.556 3.337 3.782 . 0 0 "[ . 1 . 2]" 1
864 1 48 VAL MG1 1 73 ASP HB2 . . 6.530 3.589 3.317 4.216 . 0 0 "[ . 1 . 2]" 1
865 1 48 VAL MG1 1 73 ASP HB3 . . 6.530 4.988 4.779 5.334 . 0 0 "[ . 1 . 2]" 1
866 1 48 VAL MG2 1 49 SER H . . 4.510 3.736 3.684 3.798 . 0 0 "[ . 1 . 2]" 1
867 1 48 VAL MG2 1 73 ASP HA . . 4.880 2.554 2.277 2.813 . 0 0 "[ . 1 . 2]" 1
868 1 48 VAL MG2 1 73 ASP HB2 . . 6.530 2.519 2.026 3.232 . 0 0 "[ . 1 . 2]" 1
869 1 48 VAL MG2 1 73 ASP QB . . 6.390 2.466 2.009 3.081 . 0 0 "[ . 1 . 2]" 1
870 1 48 VAL MG2 1 73 ASP HB3 . . 6.530 3.595 3.304 3.882 . 0 0 "[ . 1 . 2]" 1
871 1 48 VAL MG2 1 74 LYS H . . 6.530 3.564 3.306 3.746 . 0 0 "[ . 1 . 2]" 1
872 1 49 SER H 1 50 THR H . . 4.510 4.240 4.047 4.357 . 0 0 "[ . 1 . 2]" 1
873 1 49 SER H 1 72 ARG H . . 3.920 2.837 2.688 3.069 . 0 0 "[ . 1 . 2]" 1
874 1 49 SER H 1 72 ARG QB . . 5.260 3.933 2.777 4.395 . 0 0 "[ . 1 . 2]" 1
875 1 49 SER H 1 73 ASP HA . . 3.550 3.578 3.543 3.638 0.088 10 0 "[ . 1 . 2]" 1
876 1 49 SER HA 1 50 THR H . . 2.400 2.253 2.215 2.325 . 0 0 "[ . 1 . 2]" 1
877 1 49 SER HA 1 50 THR HB . . 4.820 4.457 4.323 4.554 . 0 0 "[ . 1 . 2]" 1
878 1 49 SER HA 1 50 THR MG . . 6.530 5.419 5.395 5.451 . 0 0 "[ . 1 . 2]" 1
879 1 49 SER QB 1 50 THR H . . 4.020 3.338 2.977 3.538 . 0 0 "[ . 1 . 2]" 1
880 1 50 THR H 1 50 THR HB . . 2.960 2.609 2.426 2.757 . 0 0 "[ . 1 . 2]" 1
881 1 50 THR H 1 50 THR MG . . 4.510 3.847 3.751 3.908 . 0 0 "[ . 1 . 2]" 1
882 1 50 THR H 1 51 VAL H . . 4.510 4.298 4.187 4.453 . 0 0 "[ . 1 . 2]" 1
883 1 50 THR HA 1 51 VAL H . . 2.400 2.161 2.150 2.193 . 0 0 "[ . 1 . 2]" 1
884 1 50 THR HA 1 51 VAL MG1 . . 5.940 3.379 3.294 3.469 . 0 0 "[ . 1 . 2]" 1
885 1 50 THR HA 1 51 VAL MG2 . . 5.570 3.951 3.866 4.078 . 0 0 "[ . 1 . 2]" 1
886 1 50 THR HA 1 71 ARG HA . . 2.990 2.393 2.111 2.494 . 0 0 "[ . 1 . 2]" 1
887 1 50 THR HA 1 71 ARG QG . . 6.380 2.994 2.498 4.889 . 0 0 "[ . 1 . 2]" 1
888 1 50 THR HA 1 72 ARG H . . 3.860 3.502 3.031 3.697 . 0 0 "[ . 1 . 2]" 1
889 1 50 THR HB 1 51 VAL H . . 4.480 4.380 4.296 4.457 . 0 0 "[ . 1 . 2]" 1
890 1 50 THR MG 1 51 VAL H . . 3.800 2.750 2.652 2.896 . 0 0 "[ . 1 . 2]" 1
891 1 50 THR MG 1 70 VAL H . . 6.000 4.040 3.652 4.263 . 0 0 "[ . 1 . 2]" 1
892 1 50 THR MG 1 71 ARG HA . . 4.390 3.228 2.774 3.473 . 0 0 "[ . 1 . 2]" 1
893 1 50 THR MG 1 71 ARG HB2 . . 5.660 4.242 3.905 4.525 . 0 0 "[ . 1 . 2]" 1
894 1 51 VAL H 1 51 VAL MG2 . . 3.610 2.523 2.441 2.624 . 0 0 "[ . 1 . 2]" 1
895 1 51 VAL H 1 52 ASP H . . 4.510 4.377 4.374 4.380 . 0 0 "[ . 1 . 2]" 1
896 1 51 VAL H 1 70 VAL H . . 3.210 3.263 3.217 3.300 0.090 12 0 "[ . 1 . 2]" 1
897 1 51 VAL H 1 70 VAL HB . . 5.070 4.989 4.674 5.108 0.038 14 0 "[ . 1 . 2]" 1
898 1 51 VAL H 1 71 ARG HA . . 3.730 3.770 3.573 3.820 0.090 3 0 "[ . 1 . 2]" 1
899 1 51 VAL HA 1 51 VAL HB . . 2.680 2.354 2.331 2.366 . 0 0 "[ . 1 . 2]" 1
900 1 51 VAL HA 1 51 VAL MG1 . . 3.430 2.469 2.442 2.513 . 0 0 "[ . 1 . 2]" 1
901 1 51 VAL HA 1 52 ASP H . . 2.710 2.565 2.551 2.573 . 0 0 "[ . 1 . 2]" 1
902 1 51 VAL HB 1 52 ASP H . . 3.210 2.406 2.376 2.467 . 0 0 "[ . 1 . 2]" 1
903 1 51 VAL MG1 1 52 ASP H . . 4.670 3.899 3.872 3.949 . 0 0 "[ . 1 . 2]" 1
904 1 51 VAL MG2 1 52 ASP H . . 4.790 2.953 2.875 3.071 . 0 0 "[ . 1 . 2]" 1
905 1 51 VAL MG2 1 70 VAL H . . 5.850 3.727 3.552 3.904 . 0 0 "[ . 1 . 2]" 1
906 1 51 VAL MG2 1 70 VAL HB . . 6.500 4.326 4.018 4.539 . 0 0 "[ . 1 . 2]" 1
907 1 52 ASP H 1 52 ASP HB2 . . 3.550 2.849 2.681 2.947 . 0 0 "[ . 1 . 2]" 1
908 1 52 ASP H 1 52 ASP QB . . 3.180 2.732 2.608 2.801 . 0 0 "[ . 1 . 2]" 1
909 1 52 ASP H 1 52 ASP HB3 . . 3.550 3.522 3.491 3.571 0.021 11 0 "[ . 1 . 2]" 1
910 1 52 ASP HA 1 53 ALA H . . 2.710 2.338 2.304 2.395 . 0 0 "[ . 1 . 2]" 1
911 1 52 ASP HA 1 53 ALA MB . . 4.950 3.879 3.797 3.955 . 0 0 "[ . 1 . 2]" 1
912 1 52 ASP HA 1 69 ARG HA . . 2.900 2.439 2.233 2.760 . 0 0 "[ . 1 . 2]" 1
913 1 52 ASP HA 1 70 VAL H . . 3.830 3.132 2.987 3.310 . 0 0 "[ . 1 . 2]" 1
914 1 52 ASP QB 1 53 ALA H . . 3.410 2.967 2.773 3.085 . 0 0 "[ . 1 . 2]" 1
915 1 52 ASP HB2 1 53 ALA H . . 3.640 3.661 3.617 3.703 0.063 5 0 "[ . 1 . 2]" 1
916 1 52 ASP HB3 1 53 ALA H . . 3.640 3.141 2.874 3.319 . 0 0 "[ . 1 . 2]" 1
917 1 53 ALA H 1 53 ALA MB . . 3.610 2.360 2.259 2.473 . 0 0 "[ . 1 . 2]" 1
918 1 53 ALA H 1 54 GLU H . . 4.600 4.129 4.034 4.210 . 0 0 "[ . 1 . 2]" 1
919 1 53 ALA H 1 68 THR H . . 3.270 2.470 2.268 2.661 . 0 0 "[ . 1 . 2]" 1
920 1 53 ALA H 1 69 ARG HA . . 3.700 3.344 3.194 3.515 . 0 0 "[ . 1 . 2]" 1
921 1 53 ALA HA 1 54 GLU H . . 2.650 2.198 2.188 2.204 . 0 0 "[ . 1 . 2]" 1
922 1 53 ALA MB 1 54 GLU H . . 4.300 3.476 3.389 3.509 . 0 0 "[ . 1 . 2]" 1
923 1 53 ALA MB 1 55 ALA MB . . 7.560 3.781 3.606 3.904 . 0 0 "[ . 1 . 2]" 1
924 1 53 ALA MB 1 68 THR H . . 4.950 3.168 2.944 3.468 . 0 0 "[ . 1 . 2]" 1
925 1 53 ALA MB 1 70 VAL HB . . 6.530 1.932 1.787 2.131 . 0 0 "[ . 1 . 2]" 1
926 1 53 ALA MB 1 70 VAL MG1 . . 7.560 2.089 1.865 2.568 . 0 0 "[ . 1 . 2]" 1
927 1 53 ALA MB 1 70 VAL QG . . 7.240 2.042 1.848 2.401 . 0 0 "[ . 1 . 2]" 1
928 1 53 ALA MB 1 70 VAL MG2 . . 7.560 2.997 2.660 3.193 . 0 0 "[ . 1 . 2]" 1
929 1 54 GLU H 1 54 GLU HG2 . . 5.500 4.466 4.311 4.738 . 0 0 "[ . 1 . 2]" 1
930 1 54 GLU H 1 54 GLU HG3 . . 5.500 4.508 4.004 4.743 . 0 0 "[ . 1 . 2]" 1
931 1 54 GLU HA 1 55 ALA H . . 2.650 2.231 2.209 2.238 . 0 0 "[ . 1 . 2]" 1
932 1 54 GLU HA 1 67 ALA HA . . 3.020 2.096 1.970 2.397 . 0 0 "[ . 1 . 2]" 1
933 1 54 GLU HA 1 67 ALA MB . . 4.110 2.928 2.672 3.246 . 0 0 "[ . 1 . 2]" 1
934 1 54 GLU HA 1 68 THR H . . 4.070 3.602 3.395 3.841 . 0 0 "[ . 1 . 2]" 1
935 1 54 GLU QB 1 67 ALA HA . . 6.380 3.842 3.434 4.163 . 0 0 "[ . 1 . 2]" 1
936 1 54 GLU QB 1 67 ALA MB . . 7.250 3.119 2.746 3.803 . 0 0 "[ . 1 . 2]" 1
937 1 54 GLU QG 1 55 ALA H . . 5.250 3.361 3.017 3.775 . 0 0 "[ . 1 . 2]" 1
938 1 54 GLU QG 1 55 ALA HA . . 6.220 4.591 3.963 5.381 . 0 0 "[ . 1 . 2]" 1
939 1 54 GLU QG 1 55 ALA MB . . 7.410 4.789 4.506 5.258 . 0 0 "[ . 1 . 2]" 1
940 1 54 GLU QG 1 65 LYS QB . . 7.250 3.437 2.907 4.262 . 0 0 "[ . 1 . 2]" 1
941 1 54 GLU QG 1 65 LYS QD . . 6.320 3.864 3.021 5.048 . 0 0 "[ . 1 . 2]" 1
942 1 54 GLU QG 1 67 ALA HA . . 6.380 3.131 2.482 3.712 . 0 0 "[ . 1 . 2]" 1
943 1 54 GLU QG 1 67 ALA MB . . 5.540 2.404 1.758 3.088 . 0 0 "[ . 1 . 2]" 1
944 1 54 GLU HG2 1 55 ALA H . . 5.500 3.653 3.061 4.245 . 0 0 "[ . 1 . 2]" 1
945 1 54 GLU HG2 1 65 LYS HD2 . . 7.250 4.774 3.549 6.568 . 0 0 "[ . 1 . 2]" 1
946 1 54 GLU HG2 1 65 LYS HD3 . . 7.250 5.039 3.403 6.627 . 0 0 "[ . 1 . 2]" 1
947 1 54 GLU HG2 1 67 ALA MB . . 5.810 3.377 2.048 4.438 . 0 0 "[ . 1 . 2]" 1
948 1 54 GLU HG3 1 55 ALA H . . 5.500 4.329 3.401 5.239 . 0 0 "[ . 1 . 2]" 1
949 1 54 GLU HG3 1 65 LYS HD2 . . 7.250 5.029 3.550 6.354 . 0 0 "[ . 1 . 2]" 1
950 1 54 GLU HG3 1 65 LYS HD3 . . 7.250 5.340 3.623 7.001 . 0 0 "[ . 1 . 2]" 1
951 1 54 GLU HG3 1 67 ALA MB . . 5.810 2.582 1.915 3.409 . 0 0 "[ . 1 . 2]" 1
952 1 55 ALA H 1 55 ALA HA . . 2.900 2.935 2.921 2.941 0.041 6 0 "[ . 1 . 2]" 1
953 1 55 ALA H 1 56 GLN H . . 5.100 4.536 4.467 4.561 . 0 0 "[ . 1 . 2]" 1
954 1 55 ALA H 1 66 PHE H . . 3.890 3.615 3.340 3.788 . 0 0 "[ . 1 . 2]" 1
955 1 55 ALA H 1 67 ALA HA . . 3.760 3.229 2.973 3.555 . 0 0 "[ . 1 . 2]" 1
956 1 55 ALA H 1 67 ALA MB . . 6.160 4.458 4.184 4.804 . 0 0 "[ . 1 . 2]" 1
957 1 55 ALA HA 1 56 GLN H . . 2.620 2.395 2.327 2.555 . 0 0 "[ . 1 . 2]" 1
958 1 55 ALA MB 1 56 GLN H . . 4.080 2.700 2.464 2.863 . 0 0 "[ . 1 . 2]" 1
959 1 55 ALA MB 1 56 GLN HG2 . . 6.530 5.339 5.117 5.563 . 0 0 "[ . 1 . 2]" 1
960 1 55 ALA MB 1 56 GLN HG3 . . 6.530 5.151 4.545 5.391 . 0 0 "[ . 1 . 2]" 1
961 1 56 GLN H 1 56 GLN HA . . 2.870 2.915 2.902 2.918 0.048 19 0 "[ . 1 . 2]" 1
962 1 56 GLN H 1 56 GLN HB2 . . 3.700 2.514 2.449 2.662 . 0 0 "[ . 1 . 2]" 1
963 1 56 GLN H 1 56 GLN QB . . 3.490 2.468 2.406 2.609 . 0 0 "[ . 1 . 2]" 1
964 1 56 GLN H 1 56 GLN HB3 . . 3.700 3.595 3.522 3.756 0.056 20 0 "[ . 1 . 2]" 1
965 1 56 GLN H 1 56 GLN HG2 . . 5.250 4.170 3.916 4.484 . 0 0 "[ . 1 . 2]" 1
966 1 56 GLN H 1 56 GLN QG . . 4.700 3.465 3.239 3.565 . 0 0 "[ . 1 . 2]" 1
967 1 56 GLN H 1 56 GLN HG3 . . 5.250 3.719 3.333 3.891 . 0 0 "[ . 1 . 2]" 1
968 1 56 GLN HA 1 56 GLN QG . . 3.660 2.087 2.015 2.337 . 0 0 "[ . 1 . 2]" 1
969 1 56 GLN HA 1 57 VAL MG1 . . 5.230 3.891 3.572 4.252 . 0 0 "[ . 1 . 2]" 1
970 1 56 GLN HA 1 57 VAL MG2 . . 4.390 3.214 2.990 3.491 . 0 0 "[ . 1 . 2]" 1
971 1 56 GLN HA 1 65 LYS HA . . 3.920 2.439 2.269 2.678 . 0 0 "[ . 1 . 2]" 1
972 1 56 GLN HA 1 65 LYS QB . . 6.130 3.649 3.365 4.246 . 0 0 "[ . 1 . 2]" 1
973 1 56 GLN QG 1 57 VAL H . . 5.070 3.414 3.269 3.632 . 0 0 "[ . 1 . 2]" 1
974 1 56 GLN QG 1 65 LYS QB . . 7.060 1.977 1.827 2.668 . 0 0 "[ . 1 . 2]" 1
975 1 56 GLN QG 1 65 LYS QG . . 5.090 3.580 1.966 3.812 . 0 0 "[ . 1 . 2]" 1
976 1 56 GLN HG2 1 57 VAL H . . 5.500 3.523 3.358 3.794 . 0 0 "[ . 1 . 2]" 1
977 1 56 GLN HG2 1 65 LYS HG2 . . 5.760 4.013 2.012 4.337 . 0 0 "[ . 1 . 2]" 1
978 1 56 GLN HG2 1 65 LYS HG3 . . 5.760 4.498 2.964 4.787 . 0 0 "[ . 1 . 2]" 1
979 1 56 GLN HG3 1 57 VAL H . . 5.500 4.589 4.489 4.666 . 0 0 "[ . 1 . 2]" 1
980 1 56 GLN HG3 1 65 LYS HG2 . . 5.760 4.970 3.351 5.476 . 0 0 "[ . 1 . 2]" 1
981 1 56 GLN HG3 1 65 LYS HG3 . . 5.760 5.633 4.649 5.822 0.062 7 0 "[ . 1 . 2]" 1
982 1 57 VAL H 1 57 VAL HB . . 4.070 3.656 3.510 3.759 . 0 0 "[ . 1 . 2]" 1
983 1 57 VAL H 1 57 VAL MG2 . . 3.680 2.058 1.892 2.201 . 0 0 "[ . 1 . 2]" 1
984 1 57 VAL H 1 64 GLU H . . 3.520 3.369 3.004 3.501 . 0 0 "[ . 1 . 2]" 1
985 1 57 VAL HA 1 57 VAL HB . . 2.930 2.621 2.544 2.714 . 0 0 "[ . 1 . 2]" 1
986 1 57 VAL HA 1 58 GLY H . . 2.830 2.191 2.185 2.198 . 0 0 "[ . 1 . 2]" 1
987 1 57 VAL HA 1 58 GLY QA . . 6.380 3.902 3.897 3.908 . 0 0 "[ . 1 . 2]" 1
988 1 57 VAL HB 1 58 GLY H . . 3.490 3.480 3.378 3.578 0.088 18 0 "[ . 1 . 2]" 1
989 1 57 VAL HB 1 66 PHE QD . . 7.620 6.106 5.720 6.666 . 0 0 "[ . 1 . 2]" 1
990 1 57 VAL MG1 1 58 GLY H . . 5.850 3.712 3.530 3.876 . 0 0 "[ . 1 . 2]" 1
991 1 57 VAL MG1 1 66 PHE QD . . 8.120 3.629 3.334 4.020 . 0 0 "[ . 1 . 2]" 1
992 1 57 VAL MG2 1 58 GLY H . . 5.720 4.323 4.221 4.417 . 0 0 "[ . 1 . 2]" 1
993 1 57 VAL MG2 1 62 LEU QB . . 7.190 3.427 3.026 4.311 . 0 0 "[ . 1 . 2]" 1
994 1 57 VAL MG2 1 64 GLU HB2 . . 5.500 2.801 2.298 3.200 . 0 0 "[ . 1 . 2]" 1
995 1 57 VAL MG2 1 66 PHE QD . . 7.560 3.485 2.773 4.290 . 0 0 "[ . 1 . 2]" 1
996 1 58 GLY QA 1 63 ARG HA . . 5.110 4.140 3.561 4.326 . 0 0 "[ . 1 . 2]" 1
997 1 60 SER HA 1 61 PHE HA . . 5.030 5.055 5.030 5.078 0.048 7 0 "[ . 1 . 2]" 1
998 1 60 SER QB 1 61 PHE HA . . 6.380 5.071 4.945 5.561 . 0 0 "[ . 1 . 2]" 1
999 1 60 SER QB 1 62 LEU H . . 6.070 2.761 2.485 3.629 . 0 0 "[ . 1 . 2]" 1
1000 1 61 PHE H 1 61 PHE HA . . 2.460 2.205 2.203 2.222 . 0 0 "[ . 1 . 2]" 1
1001 1 61 PHE H 1 62 LEU H . . 2.830 2.716 2.684 2.741 . 0 0 "[ . 1 . 2]" 1
1002 1 61 PHE HA 1 62 LEU H . . 3.420 3.223 3.169 3.383 . 0 0 "[ . 1 . 2]" 1
1003 1 61 PHE QD 1 62 LEU H . . 7.620 4.519 4.090 4.814 . 0 0 "[ . 1 . 2]" 1
1004 1 61 PHE QD 1 62 LEU HB2 . . 7.620 3.804 3.098 5.121 . 0 0 "[ . 1 . 2]" 1
1005 1 61 PHE QD 1 62 LEU HB3 . . 7.620 4.986 3.953 6.022 . 0 0 "[ . 1 . 2]" 1
1006 1 61 PHE QD 1 62 LEU MD1 . . 8.650 4.052 2.694 6.280 . 0 0 "[ . 1 . 2]" 1
1007 1 61 PHE QD 1 62 LEU QD . . 8.240 3.885 2.681 5.265 . 0 0 "[ . 1 . 2]" 1
1008 1 61 PHE QD 1 62 LEU MD2 . . 8.650 5.348 4.519 6.076 . 0 0 "[ . 1 . 2]" 1
1009 1 61 PHE QD 1 62 LEU HG . . 7.620 5.945 3.319 7.160 . 0 0 "[ . 1 . 2]" 1
1010 1 61 PHE QD 1 119 LEU MD1 . . 8.650 4.167 2.657 5.060 . 0 0 "[ . 1 . 2]" 1
1011 1 61 PHE QD 1 119 LEU MD2 . . 8.650 4.076 2.637 4.966 . 0 0 "[ . 1 . 2]" 1
1012 1 61 PHE QE 1 123 LEU MD1 . . 8.650 5.286 4.072 5.704 . 0 0 "[ . 1 . 2]" 1
1013 1 61 PHE QE 1 123 LEU MD2 . . 8.650 5.845 4.556 6.293 . 0 0 "[ . 1 . 2]" 1
1014 1 62 LEU H 1 62 LEU HA . . 2.900 2.917 2.894 2.938 0.038 4 0 "[ . 1 . 2]" 1
1015 1 62 LEU H 1 62 LEU HB2 . . 3.360 3.139 2.637 3.574 0.214 13 0 "[ . 1 . 2]" 1
1016 1 62 LEU H 1 62 LEU QB . . 3.070 2.597 2.441 2.693 . 0 0 "[ . 1 . 2]" 1
1017 1 62 LEU H 1 62 LEU HB3 . . 3.360 2.879 2.538 3.422 0.062 16 0 "[ . 1 . 2]" 1
1018 1 62 LEU H 1 62 LEU MD1 . . 5.690 4.447 3.922 4.792 . 0 0 "[ . 1 . 2]" 1
1019 1 62 LEU H 1 62 LEU QD . . 4.970 3.808 3.690 3.926 . 0 0 "[ . 1 . 2]" 1
1020 1 62 LEU H 1 62 LEU MD2 . . 5.690 4.278 3.844 4.724 . 0 0 "[ . 1 . 2]" 1
1021 1 62 LEU H 1 62 LEU HG . . 5.160 4.499 4.020 4.851 . 0 0 "[ . 1 . 2]" 1
1022 1 62 LEU H 1 63 ARG H . . 4.600 3.857 3.647 4.229 . 0 0 "[ . 1 . 2]" 1
1023 1 62 LEU HA 1 63 ARG H . . 2.680 2.227 2.179 2.253 . 0 0 "[ . 1 . 2]" 1
1024 1 62 LEU QB 1 63 ARG H . . 4.540 3.984 3.529 4.069 . 0 0 "[ . 1 . 2]" 1
1025 1 62 LEU HB2 1 63 ARG H . . 4.850 4.552 4.257 4.706 . 0 0 "[ . 1 . 2]" 1
1026 1 62 LEU HB3 1 63 ARG H . . 4.850 4.439 3.675 4.665 . 0 0 "[ . 1 . 2]" 1
1027 1 62 LEU QD 1 63 ARG H . . 5.620 3.819 2.885 4.124 . 0 0 "[ . 1 . 2]" 1
1028 1 62 LEU QD 1 64 GLU QG . . 6.690 2.440 1.752 3.212 . 0 0 "[ . 1 . 2]" 1
1029 1 62 LEU QD 1 114 PHE QE . . 7.490 2.777 2.504 3.085 . 0 0 "[ . 1 . 2]" 1
1030 1 62 LEU MD1 1 63 ARG H . . 5.910 4.297 3.268 5.024 . 0 0 "[ . 1 . 2]" 1
1031 1 62 LEU MD1 1 64 GLU HB2 . . 6.530 4.592 3.427 5.543 . 0 0 "[ . 1 . 2]" 1
1032 1 62 LEU MD1 1 64 GLU HG2 . . 8.280 4.583 2.277 5.529 . 0 0 "[ . 1 . 2]" 1
1033 1 62 LEU MD1 1 64 GLU HG3 . . 8.280 3.362 1.942 4.267 . 0 0 "[ . 1 . 2]" 1
1034 1 62 LEU MD1 1 114 PHE QE . . 8.250 3.923 2.647 5.334 . 0 0 "[ . 1 . 2]" 1
1035 1 62 LEU MD2 1 63 ARG H . . 5.910 4.629 2.903 5.025 . 0 0 "[ . 1 . 2]" 1
1036 1 62 LEU MD2 1 64 GLU HB2 . . 6.530 2.808 1.841 4.187 . 0 0 "[ . 1 . 2]" 1
1037 1 62 LEU MD2 1 64 GLU HG2 . . 8.280 4.012 3.246 4.931 . 0 0 "[ . 1 . 2]" 1
1038 1 62 LEU MD2 1 64 GLU HG3 . . 8.280 2.681 1.903 3.510 . 0 0 "[ . 1 . 2]" 1
1039 1 62 LEU MD2 1 114 PHE QE . . 8.250 3.027 2.635 4.814 . 0 0 "[ . 1 . 2]" 1
1040 1 62 LEU HG 1 63 ARG H . . 4.140 3.678 3.367 4.112 . 0 0 "[ . 1 . 2]" 1
1041 1 62 LEU HG 1 114 PHE QE . . 7.620 5.660 5.327 6.015 . 0 0 "[ . 1 . 2]" 1
1042 1 63 ARG H 1 63 ARG HB2 . . 3.390 2.186 2.042 2.397 . 0 0 "[ . 1 . 2]" 1
1043 1 63 ARG H 1 63 ARG QB . . 3.210 2.118 2.020 2.225 . 0 0 "[ . 1 . 2]" 1
1044 1 63 ARG H 1 63 ARG HB3 . . 3.390 2.980 2.592 3.386 . 0 0 "[ . 1 . 2]" 1
1045 1 63 ARG H 1 63 ARG HG2 . . 5.070 4.354 3.703 4.665 . 0 0 "[ . 1 . 2]" 1
1046 1 63 ARG H 1 63 ARG QG . . 4.780 3.814 3.223 4.053 . 0 0 "[ . 1 . 2]" 1
1047 1 63 ARG H 1 63 ARG HG3 . . 5.070 4.244 3.544 4.568 . 0 0 "[ . 1 . 2]" 1
1048 1 63 ARG H 1 64 GLU H . . 4.600 4.207 4.145 4.287 . 0 0 "[ . 1 . 2]" 1
1049 1 63 ARG HA 1 63 ARG QD . . 3.750 2.945 2.240 3.391 . 0 0 "[ . 1 . 2]" 1
1050 1 63 ARG HA 1 63 ARG HG2 . . 3.640 2.967 1.988 3.676 0.036 6 0 "[ . 1 . 2]" 1
1051 1 63 ARG HA 1 63 ARG QG . . 3.300 2.177 1.970 2.522 . 0 0 "[ . 1 . 2]" 1
1052 1 63 ARG HA 1 63 ARG HG3 . . 3.640 2.715 2.099 3.542 . 0 0 "[ . 1 . 2]" 1
1053 1 63 ARG HA 1 64 GLU H . . 2.990 2.299 2.261 2.311 . 0 0 "[ . 1 . 2]" 1
1054 1 63 ARG QB 1 64 GLU QG . . 7.250 3.959 3.912 4.060 . 0 0 "[ . 1 . 2]" 1
1055 1 63 ARG HB2 1 64 GLU H . . 5.500 4.715 4.667 4.742 . 0 0 "[ . 1 . 2]" 1
1056 1 63 ARG HB3 1 64 GLU H . . 5.500 4.281 4.003 4.473 . 0 0 "[ . 1 . 2]" 1
1057 1 63 ARG QG 1 64 GLU H . . 5.110 3.780 3.401 4.080 . 0 0 "[ . 1 . 2]" 1
1058 1 63 ARG QG 1 64 GLU QG . . 7.250 5.098 4.479 5.401 . 0 0 "[ . 1 . 2]" 1
1059 1 63 ARG HG2 1 64 GLU H . . 5.500 4.680 3.777 5.520 0.020 9 0 "[ . 1 . 2]" 1
1060 1 63 ARG HG3 1 64 GLU H . . 5.500 4.440 3.481 5.474 . 0 0 "[ . 1 . 2]" 1
1061 1 64 GLU H 1 64 GLU HA . . 2.900 2.884 2.882 2.897 . 0 0 "[ . 1 . 2]" 1
1062 1 64 GLU H 1 64 GLU HB2 . . 3.110 2.802 2.743 2.826 . 0 0 "[ . 1 . 2]" 1
1063 1 64 GLU H 1 64 GLU HB3 . . 3.830 3.842 3.814 3.862 0.032 15 0 "[ . 1 . 2]" 1
1064 1 64 GLU H 1 64 GLU HG2 . . 4.040 3.821 3.351 3.911 . 0 0 "[ . 1 . 2]" 1
1065 1 64 GLU H 1 64 GLU QG . . 3.560 3.295 3.191 3.393 . 0 0 "[ . 1 . 2]" 1
1066 1 64 GLU H 1 64 GLU HG3 . . 4.040 3.618 3.480 4.008 . 0 0 "[ . 1 . 2]" 1
1067 1 64 GLU H 1 65 LYS H . . 5.500 4.365 4.259 4.415 . 0 0 "[ . 1 . 2]" 1
1068 1 64 GLU HA 1 64 GLU HB3 . . 2.830 2.561 2.539 2.598 . 0 0 "[ . 1 . 2]" 1
1069 1 64 GLU HA 1 64 GLU HG2 . . 3.980 2.259 2.194 2.460 . 0 0 "[ . 1 . 2]" 1
1070 1 64 GLU HA 1 64 GLU QG . . 3.680 2.226 2.169 2.425 . 0 0 "[ . 1 . 2]" 1
1071 1 64 GLU HA 1 64 GLU HG3 . . 3.980 3.365 3.289 3.676 . 0 0 "[ . 1 . 2]" 1
1072 1 64 GLU HA 1 65 LYS H . . 2.460 2.382 2.243 2.525 0.065 1 0 "[ . 1 . 2]" 1
1073 1 64 GLU HB2 1 65 LYS H . . 4.170 3.952 3.676 4.231 0.061 4 0 "[ . 1 . 2]" 1
1074 1 64 GLU HB3 1 65 LYS H . . 3.800 2.779 2.398 3.225 . 0 0 "[ . 1 . 2]" 1
1075 1 64 GLU QG 1 65 LYS H . . 5.050 3.999 3.892 4.312 . 0 0 "[ . 1 . 2]" 1
1076 1 64 GLU HG2 1 65 LYS H . . 5.500 4.168 4.054 4.555 . 0 0 "[ . 1 . 2]" 1
1077 1 64 GLU HG3 1 65 LYS H . . 5.500 5.148 4.984 5.350 . 0 0 "[ . 1 . 2]" 1
1078 1 65 LYS H 1 65 LYS HB2 . . 3.700 3.572 2.575 3.782 0.082 17 0 "[ . 1 . 2]" 1
1079 1 65 LYS H 1 65 LYS HB3 . . 3.700 3.263 2.959 3.711 0.011 11 0 "[ . 1 . 2]" 1
1080 1 65 LYS H 1 65 LYS QD . . 5.360 3.908 3.369 4.151 . 0 0 "[ . 1 . 2]" 1
1081 1 65 LYS H 1 65 LYS HG2 . . 4.380 2.771 2.019 3.842 . 0 0 "[ . 1 . 2]" 1
1082 1 65 LYS H 1 65 LYS QG . . 4.010 1.971 1.834 2.374 . 0 0 "[ . 1 . 2]" 1
1083 1 65 LYS H 1 65 LYS HG3 . . 4.380 2.085 1.911 2.589 . 0 0 "[ . 1 . 2]" 1
1084 1 65 LYS H 1 66 PHE H . . 5.340 4.510 4.448 4.588 . 0 0 "[ . 1 . 2]" 1
1085 1 65 LYS HA 1 66 PHE H . . 2.960 2.360 2.295 2.456 . 0 0 "[ . 1 . 2]" 1
1086 1 65 LYS QB 1 66 PHE H . . 3.550 2.718 2.510 2.879 . 0 0 "[ . 1 . 2]" 1
1087 1 65 LYS HB2 1 66 PHE H . . 3.760 2.876 2.543 3.816 0.056 11 0 "[ . 1 . 2]" 1
1088 1 65 LYS HB3 1 66 PHE H . . 3.760 3.740 2.819 3.900 0.140 17 0 "[ . 1 . 2]" 1
1089 1 65 LYS QD 1 66 PHE H . . 5.760 4.279 3.100 5.203 . 0 0 "[ . 1 . 2]" 1
1090 1 65 LYS QG 1 66 PHE H . . 5.220 4.213 4.057 4.339 . 0 0 "[ . 1 . 2]" 1
1091 1 65 LYS HG2 1 66 PHE H . . 5.500 5.125 4.528 5.344 . 0 0 "[ . 1 . 2]" 1
1092 1 65 LYS HG3 1 66 PHE H . . 5.500 4.507 4.296 5.014 . 0 0 "[ . 1 . 2]" 1
1093 1 66 PHE HA 1 66 PHE HB2 . . 3.020 3.051 2.965 3.075 0.055 18 0 "[ . 1 . 2]" 1
1094 1 66 PHE HA 1 66 PHE HB3 . . 2.930 2.431 2.329 2.500 . 0 0 "[ . 1 . 2]" 1
1095 1 66 PHE HA 1 67 ALA H . . 2.590 2.363 2.292 2.474 . 0 0 "[ . 1 . 2]" 1
1096 1 66 PHE HA 1 86 GLY HA2 . . 3.670 2.959 2.353 3.649 . 0 0 "[ . 1 . 2]" 1
1097 1 66 PHE HA 1 86 GLY HA3 . . 4.290 4.171 3.746 4.328 0.038 13 0 "[ . 1 . 2]" 1
1098 1 66 PHE HA 1 87 PRO QD . . 6.380 4.451 3.354 5.298 . 0 0 "[ . 1 . 2]" 1
1099 1 66 PHE HB2 1 67 ALA H . . 3.670 3.633 3.019 3.714 0.044 2 0 "[ . 1 . 2]" 1
1100 1 66 PHE HB2 1 86 GLY HA2 . . 5.100 4.519 3.564 5.173 0.073 14 0 "[ . 1 . 2]" 1
1101 1 66 PHE HB2 1 86 GLY HA3 . . 5.500 4.674 3.492 5.161 . 0 0 "[ . 1 . 2]" 1
1102 1 66 PHE HB2 1 87 PRO QD . . 6.380 4.708 3.513 5.739 . 0 0 "[ . 1 . 2]" 1
1103 1 66 PHE HB3 1 67 ALA H . . 3.270 2.916 2.705 3.153 . 0 0 "[ . 1 . 2]" 1
1104 1 66 PHE HB3 1 86 GLY HA2 . . 5.220 2.925 1.972 3.731 . 0 0 "[ . 1 . 2]" 1
1105 1 66 PHE HB3 1 86 GLY HA3 . . 5.500 3.093 2.051 3.475 . 0 0 "[ . 1 . 2]" 1
1106 1 66 PHE HB3 1 87 PRO HD2 . . 5.500 4.335 3.644 5.038 . 0 0 "[ . 1 . 2]" 1
1107 1 66 PHE HB3 1 87 PRO QD . . 5.170 3.269 2.520 4.231 . 0 0 "[ . 1 . 2]" 1
1108 1 66 PHE HB3 1 87 PRO HD3 . . 5.500 3.534 2.550 5.266 . 0 0 "[ . 1 . 2]" 1
1109 1 66 PHE QD 1 68 THR MG . . 7.560 5.151 4.952 5.310 . 0 0 "[ . 1 . 2]" 1
1110 1 67 ALA H 1 84 LEU QB . . 6.380 5.045 4.570 5.485 . 0 0 "[ . 1 . 2]" 1
1111 1 67 ALA H 1 85 TYR H . . 4.040 3.803 3.390 4.070 0.030 16 0 "[ . 1 . 2]" 1
1112 1 67 ALA HA 1 68 THR H . . 2.400 2.274 2.255 2.287 . 0 0 "[ . 1 . 2]" 1
1113 1 67 ALA MB 1 68 THR H . . 3.610 2.944 2.886 3.042 . 0 0 "[ . 1 . 2]" 1
1114 1 67 ALA MB 1 68 THR HA . . 5.230 3.958 3.896 4.010 . 0 0 "[ . 1 . 2]" 1
1115 1 67 ALA MB 1 84 LEU QB . . 6.500 3.470 2.975 4.044 . 0 0 "[ . 1 . 2]" 1
1116 1 67 ALA MB 1 85 TYR H . . 5.780 3.270 2.958 3.792 . 0 0 "[ . 1 . 2]" 1
1117 1 67 ALA MB 1 85 TYR QD . . 7.400 3.830 3.242 4.455 . 0 0 "[ . 1 . 2]" 1
1118 1 68 THR H 1 68 THR HA . . 2.930 2.897 2.881 2.911 . 0 0 "[ . 1 . 2]" 1
1119 1 68 THR H 1 68 THR MG . . 4.420 3.429 3.331 3.514 . 0 0 "[ . 1 . 2]" 1
1120 1 68 THR H 1 69 ARG H . . 4.820 4.385 4.361 4.410 . 0 0 "[ . 1 . 2]" 1
1121 1 68 THR H 1 70 VAL QG . . 7.190 5.080 4.772 5.329 . 0 0 "[ . 1 . 2]" 1
1122 1 68 THR HA 1 68 THR HB . . 2.930 2.671 2.622 2.720 . 0 0 "[ . 1 . 2]" 1
1123 1 68 THR HA 1 69 ARG H . . 2.770 2.397 2.319 2.610 . 0 0 "[ . 1 . 2]" 1
1124 1 68 THR HA 1 83 LEU HA . . 3.270 3.298 3.082 3.445 0.175 6 0 "[ . 1 . 2]" 1
1125 1 68 THR HB 1 69 ARG H . . 2.900 2.725 2.235 2.952 0.052 14 0 "[ . 1 . 2]" 1
1126 1 68 THR MG 1 69 ARG H . . 4.300 3.568 3.489 3.623 . 0 0 "[ . 1 . 2]" 1
1127 1 68 THR MG 1 83 LEU QB . . 7.410 3.139 2.798 3.791 . 0 0 "[ . 1 . 2]" 1
1128 1 68 THR MG 1 84 LEU QB . . 6.040 3.346 3.122 3.601 . 0 0 "[ . 1 . 2]" 1
1129 1 68 THR MG 1 84 LEU MD1 . . 7.560 5.009 4.081 5.181 . 0 0 "[ . 1 . 2]" 1
1130 1 68 THR MG 1 84 LEU MD2 . . 7.560 4.696 4.281 5.203 . 0 0 "[ . 1 . 2]" 1
1131 1 69 ARG H 1 82 SER H . . 4.820 3.051 2.823 3.253 . 0 0 "[ . 1 . 2]" 1
1132 1 69 ARG H 1 83 LEU HA . . 4.320 4.048 3.867 4.271 . 0 0 "[ . 1 . 2]" 1
1133 1 69 ARG HA 1 70 VAL H . . 2.830 2.230 2.225 2.239 . 0 0 "[ . 1 . 2]" 1
1134 1 69 ARG HA 1 70 VAL HB . . 5.470 4.619 4.375 4.779 . 0 0 "[ . 1 . 2]" 1
1135 1 69 ARG HA 1 70 VAL QG . . 7.500 3.702 3.501 4.027 . 0 0 "[ . 1 . 2]" 1
1136 1 69 ARG QB 1 70 VAL QG . . 8.470 4.664 4.355 4.940 . 0 0 "[ . 1 . 2]" 1
1137 1 69 ARG QD 1 70 VAL QG . . 8.960 5.001 4.026 5.797 . 0 0 "[ . 1 . 2]" 1
1138 1 70 VAL H 1 70 VAL HB . . 3.240 2.735 2.436 2.904 . 0 0 "[ . 1 . 2]" 1
1139 1 70 VAL H 1 70 VAL MG1 . . 4.730 2.015 1.860 2.286 . 0 0 "[ . 1 . 2]" 1
1140 1 70 VAL H 1 70 VAL QG . . 4.130 2.007 1.855 2.267 . 0 0 "[ . 1 . 2]" 1
1141 1 70 VAL H 1 70 VAL MG2 . . 4.730 3.743 3.694 3.791 . 0 0 "[ . 1 . 2]" 1
1142 1 70 VAL HA 1 71 ARG H . . 2.740 2.230 2.184 2.269 . 0 0 "[ . 1 . 2]" 1
1143 1 70 VAL HA 1 71 ARG HA . . 4.630 4.345 4.327 4.366 . 0 0 "[ . 1 . 2]" 1
1144 1 70 VAL HA 1 81 VAL HA . . 3.390 2.473 2.276 2.687 . 0 0 "[ . 1 . 2]" 1
1145 1 70 VAL HA 1 81 VAL MG2 . . 6.190 2.018 1.778 2.300 . 0 0 "[ . 1 . 2]" 1
1146 1 70 VAL HB 1 71 ARG H . . 5.190 4.200 4.005 4.382 . 0 0 "[ . 1 . 2]" 1
1147 1 70 VAL HB 1 81 VAL MG1 . . 5.010 3.243 2.376 3.830 . 0 0 "[ . 1 . 2]" 1
1148 1 70 VAL QG 1 71 ARG H . . 5.530 2.383 2.088 2.682 . 0 0 "[ . 1 . 2]" 1
1149 1 70 VAL QG 1 71 ARG HA . . 8.090 3.401 3.182 3.535 . 0 0 "[ . 1 . 2]" 1
1150 1 70 VAL QG 1 71 ARG HB3 . . 8.090 4.910 4.755 5.058 . 0 0 "[ . 1 . 2]" 1
1151 1 70 VAL QG 1 71 ARG QD . . 8.960 4.974 4.638 5.443 . 0 0 "[ . 1 . 2]" 1
1152 1 70 VAL QG 1 71 ARG QG . . 6.490 4.104 3.774 4.178 . 0 0 "[ . 1 . 2]" 1
1153 1 70 VAL QG 1 72 ARG H . . 8.090 3.884 3.507 4.254 . 0 0 "[ . 1 . 2]" 1
1154 1 70 VAL QG 1 79 ILE HA . . 7.810 4.683 4.352 4.981 . 0 0 "[ . 1 . 2]" 1
1155 1 70 VAL QG 1 81 VAL HA . . 8.090 3.907 3.560 4.166 . 0 0 "[ . 1 . 2]" 1
1156 1 70 VAL QG 1 81 VAL HB . . 6.690 4.532 4.121 4.711 . 0 0 "[ . 1 . 2]" 1
1157 1 70 VAL QG 1 81 VAL MG1 . . 6.890 3.498 2.856 3.930 . 0 0 "[ . 1 . 2]" 1
1158 1 70 VAL QG 1 81 VAL MG2 . . 6.270 2.105 1.768 2.293 . 0 0 "[ . 1 . 2]" 1
1159 1 70 VAL MG1 1 71 ARG H . . 6.370 3.988 3.721 4.209 . 0 0 "[ . 1 . 2]" 1
1160 1 70 VAL MG1 1 81 VAL MG1 . . 7.560 4.336 3.656 4.787 . 0 0 "[ . 1 . 2]" 1
1161 1 70 VAL MG1 1 81 VAL MG2 . . 6.720 3.782 3.467 3.971 . 0 0 "[ . 1 . 2]" 1
1162 1 70 VAL MG2 1 71 ARG H . . 6.370 2.403 2.096 2.714 . 0 0 "[ . 1 . 2]" 1
1163 1 70 VAL MG2 1 81 VAL MG1 . . 7.560 3.707 2.921 4.176 . 0 0 "[ . 1 . 2]" 1
1164 1 70 VAL MG2 1 81 VAL MG2 . . 6.720 2.117 1.773 2.315 . 0 0 "[ . 1 . 2]" 1
1165 1 71 ARG H 1 71 ARG HB2 . . 3.760 2.574 2.408 3.588 . 0 0 "[ . 1 . 2]" 1
1166 1 71 ARG H 1 71 ARG HB3 . . 3.830 3.586 3.363 3.763 . 0 0 "[ . 1 . 2]" 1
1167 1 71 ARG H 1 72 ARG H . . 4.480 4.250 4.087 4.460 . 0 0 "[ . 1 . 2]" 1
1168 1 71 ARG H 1 80 ASP H . . 4.600 2.855 2.454 3.105 . 0 0 "[ . 1 . 2]" 1
1169 1 71 ARG H 1 81 VAL HA . . 3.890 3.303 3.081 3.554 . 0 0 "[ . 1 . 2]" 1
1170 1 71 ARG HA 1 72 ARG H . . 2.560 2.234 2.225 2.275 . 0 0 "[ . 1 . 2]" 1
1171 1 71 ARG HA 1 72 ARG QD . . 6.380 5.217 3.475 5.771 . 0 0 "[ . 1 . 2]" 1
1172 1 71 ARG HB2 1 80 ASP H . . 4.380 3.297 2.934 4.197 . 0 0 "[ . 1 . 2]" 1
1173 1 71 ARG HB3 1 72 ARG H . . 5.280 3.613 3.311 3.932 . 0 0 "[ . 1 . 2]" 1
1174 1 71 ARG HB3 1 72 ARG QB . . 6.380 5.437 5.196 5.794 . 0 0 "[ . 1 . 2]" 1
1175 1 71 ARG HB3 1 80 ASP H . . 5.100 3.976 3.581 4.999 . 0 0 "[ . 1 . 2]" 1
1176 1 71 ARG QD 1 72 ARG H . . 6.380 5.547 5.261 5.703 . 0 0 "[ . 1 . 2]" 1
1177 1 71 ARG QG 1 72 ARG H . . 5.040 3.931 3.666 4.422 . 0 0 "[ . 1 . 2]" 1
1178 1 71 ARG QG 1 72 ARG QB . . 7.250 5.728 5.321 5.802 . 0 0 "[ . 1 . 2]" 1
1179 1 71 ARG HG2 1 72 ARG H . . 5.500 4.390 3.995 5.229 . 0 0 "[ . 1 . 2]" 1
1180 1 71 ARG HG3 1 72 ARG H . . 5.500 4.469 4.107 5.392 . 0 0 "[ . 1 . 2]" 1
1181 1 72 ARG H 1 72 ARG QB . . 3.890 2.688 2.270 3.094 . 0 0 "[ . 1 . 2]" 1
1182 1 72 ARG H 1 73 ASP H . . 4.690 4.512 4.450 4.565 . 0 0 "[ . 1 . 2]" 1
1183 1 72 ARG HA 1 73 ASP H . . 2.680 2.386 2.340 2.433 . 0 0 "[ . 1 . 2]" 1
1184 1 72 ARG HA 1 78 SER H . . 5.500 5.095 4.847 5.405 . 0 0 "[ . 1 . 2]" 1
1185 1 72 ARG HA 1 79 ILE HA . . 3.240 2.767 2.325 2.931 . 0 0 "[ . 1 . 2]" 1
1186 1 72 ARG HA 1 80 ASP H . . 3.860 3.853 3.657 3.938 0.078 17 0 "[ . 1 . 2]" 1
1187 1 73 ASP H 1 73 ASP HA . . 2.870 2.890 2.883 2.905 0.035 20 0 "[ . 1 . 2]" 1
1188 1 73 ASP H 1 73 ASP HB2 . . 3.110 3.073 2.741 3.153 0.043 10 0 "[ . 1 . 2]" 1
1189 1 73 ASP H 1 73 ASP HB3 . . 3.110 2.903 2.804 3.105 . 0 0 "[ . 1 . 2]" 1
1190 1 73 ASP H 1 74 LYS H . . 4.630 4.159 4.061 4.294 . 0 0 "[ . 1 . 2]" 1
1191 1 73 ASP H 1 78 SER H . . 3.730 3.431 3.163 3.731 0.001 15 0 "[ . 1 . 2]" 1
1192 1 73 ASP HA 1 74 LYS H . . 2.520 2.265 2.252 2.285 . 0 0 "[ . 1 . 2]" 1
1193 1 73 ASP HA 1 74 LYS HA . . 5.500 4.421 4.411 4.430 . 0 0 "[ . 1 . 2]" 1
1194 1 73 ASP HA 1 74 LYS QB . . 5.230 4.272 4.107 4.358 . 0 0 "[ . 1 . 2]" 1
1195 1 73 ASP HA 1 75 ASP H . . 4.410 3.469 3.372 3.585 . 0 0 "[ . 1 . 2]" 1
1196 1 73 ASP HA 1 76 ALA H . . 5.410 4.129 4.034 4.235 . 0 0 "[ . 1 . 2]" 1
1197 1 73 ASP QB 1 74 LYS H . . 4.300 3.795 3.575 3.899 . 0 0 "[ . 1 . 2]" 1
1198 1 73 ASP QB 1 74 LYS QB . . 7.260 5.308 5.099 5.403 . 0 0 "[ . 1 . 2]" 1
1199 1 73 ASP QB 1 76 ALA H . . 6.380 2.590 2.093 2.750 . 0 0 "[ . 1 . 2]" 1
1200 1 73 ASP QB 1 78 SER H . . 6.380 2.496 2.243 2.801 . 0 0 "[ . 1 . 2]" 1
1201 1 73 ASP HB2 1 74 LYS H . . 4.480 4.458 4.366 4.541 0.061 12 0 "[ . 1 . 2]" 1
1202 1 73 ASP HB2 1 76 ALA MB . . 4.640 3.026 2.797 3.326 . 0 0 "[ . 1 . 2]" 1
1203 1 73 ASP HB3 1 74 LYS H . . 4.480 4.117 3.758 4.275 . 0 0 "[ . 1 . 2]" 1
1204 1 73 ASP HB3 1 76 ALA MB . . 4.640 2.031 1.957 2.270 . 0 0 "[ . 1 . 2]" 1
1205 1 74 LYS H 1 74 LYS HA . . 2.930 2.906 2.879 2.929 . 0 0 "[ . 1 . 2]" 1
1206 1 74 LYS H 1 74 LYS QB . . 3.680 2.535 2.388 2.658 . 0 0 "[ . 1 . 2]" 1
1207 1 74 LYS H 1 74 LYS HD2 . . 5.500 4.147 2.968 4.961 . 0 0 "[ . 1 . 2]" 1
1208 1 74 LYS H 1 74 LYS HD3 . . 5.500 4.241 2.958 4.988 . 0 0 "[ . 1 . 2]" 1
1209 1 74 LYS H 1 74 LYS HG2 . . 4.110 2.491 2.046 3.363 . 0 0 "[ . 1 . 2]" 1
1210 1 74 LYS H 1 74 LYS QG . . 3.950 2.317 1.963 2.612 . 0 0 "[ . 1 . 2]" 1
1211 1 74 LYS H 1 74 LYS HG3 . . 4.110 3.252 1.977 3.953 . 0 0 "[ . 1 . 2]" 1
1212 1 74 LYS H 1 75 ASP H . . 2.560 2.245 2.058 2.392 . 0 0 "[ . 1 . 2]" 1
1213 1 74 LYS H 1 76 ALA H . . 4.290 3.800 3.613 3.946 . 0 0 "[ . 1 . 2]" 1
1214 1 74 LYS HA 1 76 ALA MB . . 6.530 5.358 5.314 5.435 . 0 0 "[ . 1 . 2]" 1
1215 1 74 LYS HA 1 77 ARG H . . 3.730 3.195 3.131 3.305 . 0 0 "[ . 1 . 2]" 1
1216 1 74 LYS QB 1 75 ASP H . . 4.950 3.854 3.761 3.924 . 0 0 "[ . 1 . 2]" 1
1217 1 74 LYS QD 1 75 ASP H . . 6.380 4.542 2.858 5.037 . 0 0 "[ . 1 . 2]" 1
1218 1 74 LYS QE 1 75 ASP H . . 6.380 5.050 4.061 5.687 . 0 0 "[ . 1 . 2]" 1
1219 1 74 LYS QG 1 75 ASP H . . 3.340 2.743 2.570 2.989 . 0 0 "[ . 1 . 2]" 1
1220 1 75 ASP H 1 75 ASP HB2 . . 3.240 2.152 2.092 2.196 . 0 0 "[ . 1 . 2]" 1
1221 1 75 ASP H 1 75 ASP QB . . 3.020 2.119 2.070 2.150 . 0 0 "[ . 1 . 2]" 1
1222 1 75 ASP H 1 75 ASP HB3 . . 3.240 3.186 3.059 3.294 0.054 4 0 "[ . 1 . 2]" 1
1223 1 75 ASP H 1 76 ALA H . . 2.400 2.114 2.071 2.216 . 0 0 "[ . 1 . 2]" 1
1224 1 75 ASP H 1 76 ALA HA . . 4.760 4.793 4.755 4.877 0.117 4 0 "[ . 1 . 2]" 1
1225 1 75 ASP H 1 76 ALA MB . . 5.570 3.853 3.739 3.939 . 0 0 "[ . 1 . 2]" 1
1226 1 75 ASP H 1 77 ARG H . . 4.410 3.345 3.271 3.449 . 0 0 "[ . 1 . 2]" 1
1227 1 75 ASP HA 1 75 ASP HB2 . . 3.020 2.890 2.829 2.944 . 0 0 "[ . 1 . 2]" 1
1228 1 75 ASP HA 1 75 ASP HB3 . . 3.020 2.886 2.826 2.942 . 0 0 "[ . 1 . 2]" 1
1229 1 75 ASP HA 1 76 ALA HA . . 5.500 4.626 4.600 4.656 . 0 0 "[ . 1 . 2]" 1
1230 1 75 ASP QB 1 76 ALA H . . 3.250 2.991 2.924 3.019 . 0 0 "[ . 1 . 2]" 1
1231 1 75 ASP QB 1 76 ALA MB . . 5.970 3.507 3.390 3.553 . 0 0 "[ . 1 . 2]" 1
1232 1 75 ASP HB2 1 76 ALA H . . 3.490 3.371 3.189 3.505 0.015 14 0 "[ . 1 . 2]" 1
1233 1 75 ASP HB2 1 76 ALA MB . . 6.530 4.300 4.130 4.490 . 0 0 "[ . 1 . 2]" 1
1234 1 75 ASP HB3 1 76 ALA H . . 3.490 3.353 3.231 3.467 . 0 0 "[ . 1 . 2]" 1
1235 1 75 ASP HB3 1 76 ALA MB . . 6.530 3.724 3.538 3.859 . 0 0 "[ . 1 . 2]" 1
1236 1 76 ALA H 1 76 ALA HA . . 2.930 2.932 2.920 2.939 0.009 2 0 "[ . 1 . 2]" 1
1237 1 76 ALA H 1 76 ALA MB . . 3.430 2.296 2.197 2.382 . 0 0 "[ . 1 . 2]" 1
1238 1 76 ALA H 1 77 ARG H . . 2.520 1.986 1.887 2.094 . 0 0 "[ . 1 . 2]" 1
1239 1 76 ALA H 1 78 SER H . . 4.230 3.808 3.699 3.968 . 0 0 "[ . 1 . 2]" 1
1240 1 76 ALA HA 1 77 ARG H . . 3.640 3.511 3.496 3.540 . 0 0 "[ . 1 . 2]" 1
1241 1 76 ALA MB 1 77 ARG H . . 3.830 2.971 2.880 3.051 . 0 0 "[ . 1 . 2]" 1
1242 1 76 ALA MB 1 77 ARG HA . . 5.440 4.440 4.352 4.490 . 0 0 "[ . 1 . 2]" 1
1243 1 76 ALA MB 1 78 SER H . . 4.950 2.744 2.607 2.995 . 0 0 "[ . 1 . 2]" 1
1244 1 76 ALA MB 1 78 SER HB2 . . 4.700 3.767 3.634 3.815 . 0 0 "[ . 1 . 2]" 1
1245 1 76 ALA MB 1 78 SER HB3 . . 5.190 4.188 4.061 4.247 . 0 0 "[ . 1 . 2]" 1
1246 1 77 ARG H 1 77 ARG HA . . 2.490 2.160 2.159 2.162 . 0 0 "[ . 1 . 2]" 1
1247 1 77 ARG H 1 78 SER H . . 2.650 2.660 2.595 2.690 0.040 3 0 "[ . 1 . 2]" 1
1248 1 77 ARG HA 1 78 SER H . . 2.830 2.885 2.812 2.927 0.097 6 0 "[ . 1 . 2]" 1
1249 1 77 ARG HA 1 97 PHE QD . . 7.620 4.670 3.554 5.780 . 0 0 "[ . 1 . 2]" 1
1250 1 77 ARG HA 1 97 PHE QE . . 7.620 4.672 3.331 6.028 . 0 0 "[ . 1 . 2]" 1
1251 1 77 ARG QB 1 78 SER HA . . 6.380 4.242 4.207 4.327 . 0 0 "[ . 1 . 2]" 1
1252 1 78 SER H 1 78 SER HB2 . . 3.420 3.376 3.287 3.431 0.011 6 0 "[ . 1 . 2]" 1
1253 1 78 SER H 1 78 SER HB3 . . 3.950 3.741 3.725 3.766 . 0 0 "[ . 1 . 2]" 1
1254 1 78 SER H 1 79 ILE H . . 4.380 4.455 4.446 4.468 0.088 17 0 "[ . 1 . 2]" 1
1255 1 78 SER HA 1 78 SER HB2 . . 2.930 2.865 2.842 2.903 . 0 0 "[ . 1 . 2]" 1
1256 1 78 SER HA 1 78 SER HB3 . . 2.800 2.256 2.255 2.260 . 0 0 "[ . 1 . 2]" 1
1257 1 78 SER HA 1 79 ILE H . . 2.460 2.481 2.403 2.549 0.089 13 0 "[ . 1 . 2]" 1
1258 1 78 SER HA 1 96 ARG HA . . 3.270 3.046 2.110 3.312 0.042 4 0 "[ . 1 . 2]" 1
1259 1 78 SER HA 1 96 ARG HD2 . . 5.500 4.815 3.971 5.503 0.003 7 0 "[ . 1 . 2]" 1
1260 1 78 SER HA 1 96 ARG HD3 . . 5.500 4.490 3.060 5.489 . 0 0 "[ . 1 . 2]" 1
1261 1 78 SER HA 1 96 ARG QG . . 6.380 4.142 2.952 4.862 . 0 0 "[ . 1 . 2]" 1
1262 1 78 SER HA 1 97 PHE H . . 3.950 3.816 2.950 3.984 0.034 20 0 "[ . 1 . 2]" 1
1263 1 78 SER HA 1 97 PHE QD . . 7.620 3.448 2.457 4.688 . 0 0 "[ . 1 . 2]" 1
1264 1 78 SER HA 1 97 PHE QE . . 7.620 3.363 2.583 4.851 . 0 0 "[ . 1 . 2]" 1
1265 1 78 SER HB2 1 79 ILE H . . 3.020 2.832 2.636 3.032 0.012 8 0 "[ . 1 . 2]" 1
1266 1 78 SER HB2 1 96 ARG HA . . 5.500 4.512 3.459 4.895 . 0 0 "[ . 1 . 2]" 1
1267 1 78 SER HB2 1 96 ARG HD2 . . 5.500 4.619 3.918 5.285 . 0 0 "[ . 1 . 2]" 1
1268 1 78 SER HB2 1 96 ARG QD . . 4.930 3.444 2.537 4.310 . 0 0 "[ . 1 . 2]" 1
1269 1 78 SER HB2 1 96 ARG HD3 . . 5.500 3.665 2.557 5.510 0.010 16 0 "[ . 1 . 2]" 1
1270 1 78 SER HB2 1 97 PHE QD . . 7.620 6.055 5.054 6.861 . 0 0 "[ . 1 . 2]" 1
1271 1 78 SER HB3 1 79 ILE H . . 3.170 3.132 3.044 3.253 0.083 8 0 "[ . 1 . 2]" 1
1272 1 78 SER HB3 1 96 ARG HD2 . . 5.380 3.254 2.746 4.052 . 0 0 "[ . 1 . 2]" 1
1273 1 78 SER HB3 1 96 ARG QD . . 4.760 2.441 1.969 3.858 . 0 0 "[ . 1 . 2]" 1
1274 1 78 SER HB3 1 96 ARG HD3 . . 5.380 2.689 1.995 4.841 . 0 0 "[ . 1 . 2]" 1
1275 1 78 SER HB3 1 97 PHE QE . . 7.620 5.331 4.425 6.399 . 0 0 "[ . 1 . 2]" 1
1276 1 79 ILE H 1 79 ILE HB . . 2.710 2.592 2.478 2.699 . 0 0 "[ . 1 . 2]" 1
1277 1 79 ILE H 1 80 ASP H . . 5.500 4.397 4.314 4.461 . 0 0 "[ . 1 . 2]" 1
1278 1 79 ILE H 1 95 TRP H . . 3.490 3.040 2.574 3.453 . 0 0 "[ . 1 . 2]" 1
1279 1 79 ILE H 1 95 TRP QB . . 4.950 3.888 2.770 4.558 . 0 0 "[ . 1 . 2]" 1
1280 1 79 ILE H 1 96 ARG HA . . 4.290 3.500 3.157 3.866 . 0 0 "[ . 1 . 2]" 1
1281 1 79 ILE HA 1 79 ILE MG . . 3.580 2.691 2.485 3.105 . 0 0 "[ . 1 . 2]" 1
1282 1 79 ILE HA 1 80 ASP H . . 2.400 2.271 2.227 2.355 . 0 0 "[ . 1 . 2]" 1
1283 1 79 ILE HA 1 80 ASP HA . . 5.500 4.382 4.359 4.423 . 0 0 "[ . 1 . 2]" 1
1284 1 79 ILE HA 1 80 ASP HB3 . . 5.500 4.550 4.501 4.928 . 0 0 "[ . 1 . 2]" 1
1285 1 79 ILE HB 1 80 ASP H . . 4.230 4.273 4.138 4.372 0.142 9 0 "[ . 1 . 2]" 1
1286 1 79 ILE HB 1 95 TRP H . . 4.850 3.145 2.528 4.614 . 0 0 "[ . 1 . 2]" 1
1287 1 79 ILE HB 1 95 TRP QB . . 5.380 2.618 1.950 4.918 . 0 0 "[ . 1 . 2]" 1
1288 1 79 ILE HB 1 95 TRP HD1 . . 4.140 2.834 1.931 3.870 . 0 0 "[ . 1 . 2]" 1
1289 1 79 ILE HB 1 97 PHE QE . . 7.620 3.639 2.410 5.815 . 0 0 "[ . 1 . 2]" 1
1290 1 79 ILE MD 1 80 ASP H . . 4.300 2.892 2.084 3.269 . 0 0 "[ . 1 . 2]" 1
1291 1 79 ILE MD 1 80 ASP HA . . 6.530 5.007 3.932 5.453 . 0 0 "[ . 1 . 2]" 1
1292 1 79 ILE MD 1 95 TRP HD1 . . 4.950 4.005 3.623 4.299 . 0 0 "[ . 1 . 2]" 1
1293 1 79 ILE MG 1 80 ASP H . . 4.670 2.460 2.205 3.108 . 0 0 "[ . 1 . 2]" 1
1294 1 79 ILE MG 1 95 TRP H . . 5.780 2.557 1.917 3.404 . 0 0 "[ . 1 . 2]" 1
1295 1 79 ILE MG 1 95 TRP HD1 . . 4.260 2.259 1.757 3.654 . 0 0 "[ . 1 . 2]" 1
1296 1 79 ILE MG 1 97 PHE QE . . 8.650 4.688 3.866 5.885 . 0 0 "[ . 1 . 2]" 1
1297 1 80 ASP H 1 80 ASP HB2 . . 3.420 3.187 2.828 3.286 . 0 0 "[ . 1 . 2]" 1
1298 1 80 ASP H 1 80 ASP HB3 . . 2.900 2.814 2.740 2.994 0.094 17 0 "[ . 1 . 2]" 1
1299 1 80 ASP H 1 81 VAL H . . 4.450 4.310 4.242 4.401 . 0 0 "[ . 1 . 2]" 1
1300 1 80 ASP HA 1 80 ASP HB3 . . 3.050 3.054 3.016 3.056 0.006 15 0 "[ . 1 . 2]" 1
1301 1 80 ASP HA 1 81 VAL H . . 2.400 2.330 2.305 2.387 . 0 0 "[ . 1 . 2]" 1
1302 1 80 ASP HA 1 81 VAL HB . . 5.000 4.473 4.274 4.684 . 0 0 "[ . 1 . 2]" 1
1303 1 80 ASP HA 1 94 GLY HA2 . . 3.920 2.323 2.168 2.783 . 0 0 "[ . 1 . 2]" 1
1304 1 80 ASP HA 1 94 GLY QA . . 3.400 2.223 1.941 2.514 . 0 0 "[ . 1 . 2]" 1
1305 1 80 ASP HA 1 94 GLY HA3 . . 3.920 3.170 1.981 3.901 . 0 0 "[ . 1 . 2]" 1
1306 1 80 ASP HA 1 95 TRP H . . 3.760 3.566 3.285 3.863 0.103 8 0 "[ . 1 . 2]" 1
1307 1 80 ASP HB2 1 81 VAL H . . 4.200 4.220 4.142 4.266 0.066 17 0 "[ . 1 . 2]" 1
1308 1 80 ASP HB3 1 81 VAL H . . 4.010 3.989 3.542 4.067 0.057 20 0 "[ . 1 . 2]" 1
1309 1 80 ASP HB3 1 81 VAL HA . . 4.880 4.510 4.138 4.576 . 0 0 "[ . 1 . 2]" 1
1310 1 81 VAL H 1 81 VAL HB . . 2.830 2.689 2.605 2.840 0.010 19 0 "[ . 1 . 2]" 1
1311 1 81 VAL H 1 81 VAL MG2 . . 4.540 3.028 2.666 3.326 . 0 0 "[ . 1 . 2]" 1
1312 1 81 VAL H 1 93 ASN H . . 3.830 3.011 2.627 3.503 . 0 0 "[ . 1 . 2]" 1
1313 1 81 VAL H 1 94 GLY QA . . 5.110 3.155 2.782 3.491 . 0 0 "[ . 1 . 2]" 1
1314 1 81 VAL HA 1 82 SER H . . 2.560 2.226 2.184 2.306 . 0 0 "[ . 1 . 2]" 1
1315 1 81 VAL HB 1 93 ASN H . . 4.630 2.975 2.185 3.443 . 0 0 "[ . 1 . 2]" 1
1316 1 81 VAL HB 1 93 ASN HB2 . . 3.550 2.595 1.974 3.634 0.084 2 0 "[ . 1 . 2]" 1
1317 1 81 VAL HB 1 93 ASN QB . . 3.280 2.035 1.845 2.392 . 0 0 "[ . 1 . 2]" 1
1318 1 81 VAL HB 1 93 ASN HB3 . . 3.550 2.370 1.928 3.316 . 0 0 "[ . 1 . 2]" 1
1319 1 81 VAL MG1 1 82 SER H . . 4.170 2.488 2.076 2.899 . 0 0 "[ . 1 . 2]" 1
1320 1 81 VAL MG1 1 91 LEU QD . . 8.780 3.475 3.067 3.768 . 0 0 "[ . 1 . 2]" 1
1321 1 81 VAL MG1 1 93 ASN H . . 5.010 3.592 3.080 4.103 . 0 0 "[ . 1 . 2]" 1
1322 1 81 VAL MG1 1 93 ASN HB2 . . 5.600 3.014 1.997 3.729 . 0 0 "[ . 1 . 2]" 1
1323 1 81 VAL MG1 1 93 ASN QB . . 5.210 2.727 1.978 3.204 . 0 0 "[ . 1 . 2]" 1
1324 1 81 VAL MG1 1 93 ASN HB3 . . 5.600 3.432 2.536 4.423 . 0 0 "[ . 1 . 2]" 1
1325 1 81 VAL MG2 1 82 SER H . . 5.940 4.006 3.776 4.249 . 0 0 "[ . 1 . 2]" 1
1326 1 81 VAL MG2 1 93 ASN HB2 . . 5.940 3.807 3.002 4.754 . 0 0 "[ . 1 . 2]" 1
1327 1 81 VAL MG2 1 93 ASN QB . . 5.680 2.903 2.201 3.363 . 0 0 "[ . 1 . 2]" 1
1328 1 81 VAL MG2 1 93 ASN HB3 . . 5.940 3.056 2.264 3.724 . 0 0 "[ . 1 . 2]" 1
1329 1 82 SER HA 1 83 LEU H . . 2.590 2.465 2.377 2.623 0.033 16 0 "[ . 1 . 2]" 1
1330 1 82 SER HA 1 92 ASN HA . . 3.140 2.845 2.474 3.183 0.043 1 0 "[ . 1 . 2]" 1
1331 1 82 SER HA 1 92 ASN HB2 . . 5.500 5.141 4.404 5.522 0.022 18 0 "[ . 1 . 2]" 1
1332 1 82 SER HA 1 92 ASN HB3 . . 5.500 4.653 3.197 5.490 . 0 0 "[ . 1 . 2]" 1
1333 1 82 SER HA 1 93 ASN H . . 3.760 3.742 3.590 3.821 0.061 8 0 "[ . 1 . 2]" 1
1334 1 82 SER QB 1 83 LEU H . . 4.270 2.560 2.269 2.760 . 0 0 "[ . 1 . 2]" 1
1335 1 82 SER QB 1 83 LEU HA . . 4.860 4.433 4.359 4.516 . 0 0 "[ . 1 . 2]" 1
1336 1 82 SER QB 1 92 ASN HA . . 6.380 4.689 4.382 4.981 . 0 0 "[ . 1 . 2]" 1
1337 1 82 SER QB 1 92 ASN HD21 . . 6.380 4.772 3.437 5.459 . 0 0 "[ . 1 . 2]" 1
1338 1 82 SER QB 1 92 ASN HD22 . . 6.380 3.746 2.518 4.429 . 0 0 "[ . 1 . 2]" 1
1339 1 82 SER QB 1 93 ASN H . . 6.380 5.530 5.329 5.662 . 0 0 "[ . 1 . 2]" 1
1340 1 83 LEU H 1 83 LEU HB2 . . 3.860 2.829 2.123 3.231 . 0 0 "[ . 1 . 2]" 1
1341 1 83 LEU H 1 83 LEU QB . . 3.310 2.101 1.970 2.526 . 0 0 "[ . 1 . 2]" 1
1342 1 83 LEU H 1 83 LEU HB3 . . 3.860 2.318 1.993 3.536 . 0 0 "[ . 1 . 2]" 1
1343 1 83 LEU H 1 91 LEU H . . 4.450 4.347 3.936 4.506 0.056 19 0 "[ . 1 . 2]" 1
1344 1 83 LEU HA 1 83 LEU QD . . 3.930 2.514 1.947 3.213 . 0 0 "[ . 1 . 2]" 1
1345 1 83 LEU HA 1 85 TYR H . . 5.030 4.270 4.202 4.386 . 0 0 "[ . 1 . 2]" 1
1346 1 83 LEU QB 1 84 LEU H . . 4.050 3.550 2.906 3.731 . 0 0 "[ . 1 . 2]" 1
1347 1 83 LEU QB 1 91 LEU H . . 5.540 3.179 2.029 4.397 . 0 0 "[ . 1 . 2]" 1
1348 1 83 LEU HB2 1 84 LEU H . . 4.410 3.936 3.688 4.380 . 0 0 "[ . 1 . 2]" 1
1349 1 83 LEU HB2 1 84 LEU QB . . 6.380 5.707 5.483 5.818 . 0 0 "[ . 1 . 2]" 1
1350 1 83 LEU HB3 1 84 LEU H . . 4.410 4.196 2.982 4.510 0.100 6 0 "[ . 1 . 2]" 1
1351 1 83 LEU HB3 1 84 LEU QB . . 6.380 5.674 5.010 5.896 . 0 0 "[ . 1 . 2]" 1
1352 1 83 LEU QD 1 85 TYR H . . 7.070 3.220 2.240 5.191 . 0 0 "[ . 1 . 2]" 1
1353 1 83 LEU QD 1 88 PHE H . . 8.100 3.235 1.698 4.365 . 0 0 "[ . 1 . 2]" 1
1354 1 83 LEU QD 1 91 LEU H . . 7.070 3.268 1.729 4.595 . 0 0 "[ . 1 . 2]" 1
1355 1 83 LEU QD 1 92 ASN QD . . 8.970 4.846 2.211 5.864 . 0 0 "[ . 1 . 2]" 1
1356 1 83 LEU HG 1 84 LEU H . . 4.660 3.840 2.490 4.733 0.073 13 0 "[ . 1 . 2]" 1
1357 1 84 LEU H 1 84 LEU HG . . 5.500 4.508 3.628 4.863 . 0 0 "[ . 1 . 2]" 1
1358 1 84 LEU QB 1 85 TYR H . . 3.870 2.449 2.282 2.862 . 0 0 "[ . 1 . 2]" 1
1359 1 84 LEU QB 1 85 TYR QD . . 8.520 4.601 3.798 5.626 . 0 0 "[ . 1 . 2]" 1
1360 1 84 LEU QD 1 88 PHE QD . . 10.220 6.308 4.457 6.875 . 0 0 "[ . 1 . 2]" 1
1361 1 84 LEU QD 1 88 PHE QE . . 10.220 5.452 4.518 6.235 . 0 0 "[ . 1 . 2]" 1
1362 1 84 LEU HG 1 85 TYR H . . 4.040 3.986 2.364 4.316 0.276 15 0 "[ . 1 . 2]" 1
1363 1 85 TYR H 1 86 GLY H . . 5.500 1.775 1.724 1.837 . 0 0 "[ . 1 . 2]" 1
1364 1 85 TYR HA 1 85 TYR HB2 . . 2.900 2.881 2.549 2.968 0.068 18 0 "[ . 1 . 2]" 1
1365 1 85 TYR HA 1 85 TYR HB3 . . 2.900 2.945 2.869 3.084 0.184 14 0 "[ . 1 . 2]" 1
1366 1 85 TYR HA 1 86 GLY H . . 3.520 3.425 3.331 3.600 0.080 1 0 "[ . 1 . 2]" 1
1367 1 85 TYR QB 1 86 GLY H . . 3.550 3.113 2.645 3.338 . 0 0 "[ . 1 . 2]" 1
1368 1 85 TYR HB2 1 86 GLY H . . 3.950 3.614 2.961 4.055 0.105 15 0 "[ . 1 . 2]" 1
1369 1 85 TYR HB3 1 86 GLY H . . 3.950 3.431 2.689 3.761 . 0 0 "[ . 1 . 2]" 1
1370 1 85 TYR QD 1 86 GLY H . . 7.640 4.731 3.719 4.906 . 0 0 "[ . 1 . 2]" 1
1371 1 86 GLY HA2 1 87 PRO QD . . 3.800 2.677 1.854 3.211 . 0 0 "[ . 1 . 2]" 1
1372 1 86 GLY HA3 1 87 PRO QD . . 3.660 2.134 1.854 3.140 . 0 0 "[ . 1 . 2]" 1
1373 1 87 PRO HA 1 88 PHE H . . 3.330 2.763 2.148 3.497 0.167 20 0 "[ . 1 . 2]" 1
1374 1 87 PRO HA 1 88 PHE HA . . 5.500 4.640 4.264 5.199 . 0 0 "[ . 1 . 2]" 1
1375 1 88 PHE H 1 89 LYS H . . 5.500 3.662 2.551 4.651 . 0 0 "[ . 1 . 2]" 1
1376 1 88 PHE HA 1 89 LYS H . . 2.770 2.611 2.229 2.859 0.089 7 0 "[ . 1 . 2]" 1
1377 1 88 PHE QB 1 90 ARG H . . 6.220 5.226 3.270 5.645 . 0 0 "[ . 1 . 2]" 1
1378 1 89 LYS H 1 89 LYS HB2 . . 3.300 3.110 2.606 3.322 0.022 3 0 "[ . 1 . 2]" 1
1379 1 89 LYS H 1 89 LYS HB3 . . 3.300 3.009 2.346 3.335 0.035 13 0 "[ . 1 . 2]" 1
1380 1 89 LYS H 1 89 LYS QE . . 6.380 5.402 5.041 5.731 . 0 0 "[ . 1 . 2]" 1
1381 1 89 LYS H 1 89 LYS HG2 . . 5.160 4.533 4.392 4.644 . 0 0 "[ . 1 . 2]" 1
1382 1 89 LYS H 1 89 LYS QG . . 4.770 4.194 4.012 4.278 . 0 0 "[ . 1 . 2]" 1
1383 1 89 LYS H 1 89 LYS HG3 . . 5.160 4.954 4.638 5.158 . 0 0 "[ . 1 . 2]" 1
1384 1 89 LYS H 1 90 ARG H . . 2.900 2.197 1.895 2.895 . 0 0 "[ . 1 . 2]" 1
1385 1 89 LYS HA 1 89 LYS QB . . 2.710 2.436 2.316 2.521 . 0 0 "[ . 1 . 2]" 1
1386 1 89 LYS HA 1 89 LYS HG2 . . 3.670 2.224 2.020 2.534 . 0 0 "[ . 1 . 2]" 1
1387 1 89 LYS HA 1 89 LYS HG3 . . 3.670 3.153 2.505 3.577 . 0 0 "[ . 1 . 2]" 1
1388 1 89 LYS QB 1 90 ARG H . . 3.660 2.398 2.014 2.630 . 0 0 "[ . 1 . 2]" 1
1389 1 89 LYS QB 1 90 ARG HA . . 6.380 4.541 4.378 4.628 . 0 0 "[ . 1 . 2]" 1
1390 1 89 LYS QB 1 113 ALA MB . . 5.270 2.488 1.763 3.170 . 0 0 "[ . 1 . 2]" 1
1391 1 89 LYS HB2 1 90 ARG H . . 4.010 3.623 3.358 3.829 . 0 0 "[ . 1 . 2]" 1
1392 1 89 LYS HB3 1 90 ARG H . . 4.010 2.438 2.025 2.691 . 0 0 "[ . 1 . 2]" 1
1393 1 89 LYS QD 1 90 ARG H . . 5.260 3.505 1.950 4.395 . 0 0 "[ . 1 . 2]" 1
1394 1 89 LYS QD 1 113 ALA H . . 6.380 5.247 4.934 5.672 . 0 0 "[ . 1 . 2]" 1
1395 1 89 LYS QE 1 90 ARG H . . 5.230 4.493 3.921 4.720 . 0 0 "[ . 1 . 2]" 1
1396 1 89 LYS QE 1 113 ALA MB . . 6.500 2.718 1.879 4.388 . 0 0 "[ . 1 . 2]" 1
1397 1 89 LYS QG 1 90 ARG H . . 4.930 4.084 3.382 4.421 . 0 0 "[ . 1 . 2]" 1
1398 1 89 LYS QG 1 90 ARG QB . . 7.260 3.831 3.408 4.189 . 0 0 "[ . 1 . 2]" 1
1399 1 89 LYS HG2 1 90 ARG H . . 5.500 4.356 3.618 4.755 . 0 0 "[ . 1 . 2]" 1
1400 1 89 LYS HG3 1 90 ARG H . . 5.500 4.943 4.042 5.263 . 0 0 "[ . 1 . 2]" 1
1401 1 90 ARG H 1 90 ARG HG2 . . 4.630 4.641 4.456 4.714 0.084 19 0 "[ . 1 . 2]" 1
1402 1 90 ARG H 1 90 ARG HG3 . . 4.630 4.504 3.782 4.703 0.073 19 0 "[ . 1 . 2]" 1
1403 1 90 ARG H 1 91 LEU H . . 5.500 4.033 3.738 4.494 . 0 0 "[ . 1 . 2]" 1
1404 1 90 ARG H 1 113 ALA H . . 4.410 4.320 3.898 4.451 0.041 15 0 "[ . 1 . 2]" 1
1405 1 90 ARG H 1 113 ALA MB . . 4.880 2.683 1.907 3.323 . 0 0 "[ . 1 . 2]" 1
1406 1 90 ARG HA 1 90 ARG QG . . 4.020 2.216 2.058 2.562 . 0 0 "[ . 1 . 2]" 1
1407 1 90 ARG HA 1 91 LEU H . . 2.400 2.259 2.226 2.363 . 0 0 "[ . 1 . 2]" 1
1408 1 90 ARG QB 1 91 LEU H . . 4.050 3.581 3.328 3.782 . 0 0 "[ . 1 . 2]" 1
1409 1 90 ARG QB 1 111 GLU QB . . 7.250 5.030 4.080 5.769 . 0 0 "[ . 1 . 2]" 1
1410 1 90 ARG QB 1 113 ALA H . . 5.380 4.235 3.461 4.731 . 0 0 "[ . 1 . 2]" 1
1411 1 90 ARG QB 1 113 ALA MB . . 6.040 2.175 1.830 2.855 . 0 0 "[ . 1 . 2]" 1
1412 1 90 ARG QD 1 91 LEU H . . 6.380 4.641 4.142 5.363 . 0 0 "[ . 1 . 2]" 1
1413 1 90 ARG QD 1 111 GLU QB . . 7.250 4.678 3.563 5.314 . 0 0 "[ . 1 . 2]" 1
1414 1 90 ARG QD 1 113 ALA MB . . 6.970 3.708 3.134 4.545 . 0 0 "[ . 1 . 2]" 1
1415 1 90 ARG QG 1 91 LEU H . . 3.900 2.911 1.990 3.491 . 0 0 "[ . 1 . 2]" 1
1416 1 90 ARG QG 1 111 GLU QB . . 6.980 4.926 3.543 5.340 . 0 0 "[ . 1 . 2]" 1
1417 1 90 ARG HG2 1 91 LEU H . . 4.480 3.127 2.494 3.672 . 0 0 "[ . 1 . 2]" 1
1418 1 90 ARG HG3 1 91 LEU H . . 4.480 4.027 2.021 4.500 0.020 2 0 "[ . 1 . 2]" 1
1419 1 91 LEU H 1 91 LEU QB . . 3.850 2.905 2.754 2.954 . 0 0 "[ . 1 . 2]" 1
1420 1 91 LEU H 1 91 LEU HG . . 4.720 4.567 3.928 4.732 0.012 13 0 "[ . 1 . 2]" 1
1421 1 91 LEU H 1 92 ASN H . . 4.820 3.954 3.610 4.271 . 0 0 "[ . 1 . 2]" 1
1422 1 91 LEU H 1 113 ALA MB . . 5.940 4.713 4.217 4.829 . 0 0 "[ . 1 . 2]" 1
1423 1 91 LEU HA 1 91 LEU HG . . 4.140 2.609 2.192 3.468 . 0 0 "[ . 1 . 2]" 1
1424 1 91 LEU HA 1 92 ASN H . . 2.400 2.213 2.176 2.366 . 0 0 "[ . 1 . 2]" 1
1425 1 91 LEU HA 1 112 PHE QB . . 6.380 3.801 3.369 4.796 . 0 0 "[ . 1 . 2]" 1
1426 1 91 LEU HA 1 113 ALA H . . 4.850 3.831 3.318 4.676 . 0 0 "[ . 1 . 2]" 1
1427 1 91 LEU QB 1 92 ASN H . . 5.790 3.803 3.508 4.004 . 0 0 "[ . 1 . 2]" 1
1428 1 91 LEU QD 1 92 ASN H . . 5.020 3.383 2.029 3.879 . 0 0 "[ . 1 . 2]" 1
1429 1 91 LEU QD 1 112 PHE HA . . 6.200 2.574 2.156 3.152 . 0 0 "[ . 1 . 2]" 1
1430 1 91 LEU QD 1 112 PHE QB . . 7.390 2.150 1.721 3.456 . 0 0 "[ . 1 . 2]" 1
1431 1 91 LEU MD1 1 92 ASN H . . 5.320 4.052 2.032 4.423 . 0 0 "[ . 1 . 2]" 1
1432 1 91 LEU MD1 1 112 PHE HA . . 6.530 2.597 2.161 3.197 . 0 0 "[ . 1 . 2]" 1
1433 1 91 LEU MD1 1 112 PHE HB2 . . 9.670 2.714 2.007 4.231 . 0 0 "[ . 1 . 2]" 1
1434 1 91 LEU MD1 1 112 PHE HB3 . . 9.670 2.339 1.792 3.962 . 0 0 "[ . 1 . 2]" 1
1435 1 91 LEU MD2 1 92 ASN H . . 5.320 3.818 2.784 4.585 . 0 0 "[ . 1 . 2]" 1
1436 1 91 LEU MD2 1 112 PHE HA . . 6.530 4.407 3.889 4.933 . 0 0 "[ . 1 . 2]" 1
1437 1 91 LEU MD2 1 112 PHE HB2 . . 9.670 5.251 4.235 6.580 . 0 0 "[ . 1 . 2]" 1
1438 1 91 LEU MD2 1 112 PHE HB3 . . 9.670 4.520 3.358 6.540 . 0 0 "[ . 1 . 2]" 1
1439 1 91 LEU HG 1 92 ASN H . . 3.830 2.857 2.006 3.474 . 0 0 "[ . 1 . 2]" 1
1440 1 91 LEU HG 1 92 ASN HA . . 5.500 4.109 3.291 4.843 . 0 0 "[ . 1 . 2]" 1
1441 1 92 ASN H 1 92 ASN HB2 . . 3.730 2.697 2.329 2.924 . 0 0 "[ . 1 . 2]" 1
1442 1 92 ASN H 1 92 ASN QB . . 3.260 2.620 2.289 2.780 . 0 0 "[ . 1 . 2]" 1
1443 1 92 ASN H 1 92 ASN HB3 . . 3.730 3.586 3.230 3.847 0.117 11 0 "[ . 1 . 2]" 1
1444 1 92 ASN H 1 111 GLU H . . 3.980 3.333 2.648 3.773 . 0 0 "[ . 1 . 2]" 1
1445 1 92 ASN H 1 111 GLU QB . . 6.380 2.409 1.933 3.637 . 0 0 "[ . 1 . 2]" 1
1446 1 92 ASN H 1 112 PHE HA . . 4.170 3.490 3.041 4.156 . 0 0 "[ . 1 . 2]" 1
1447 1 92 ASN HA 1 92 ASN HB2 . . 2.990 2.976 2.867 3.065 0.075 11 0 "[ . 1 . 2]" 1
1448 1 92 ASN HA 1 92 ASN HB3 . . 2.990 2.771 2.533 2.925 . 0 0 "[ . 1 . 2]" 1
1449 1 92 ASN HA 1 92 ASN HD22 . . 5.500 3.888 3.378 4.568 . 0 0 "[ . 1 . 2]" 1
1450 1 92 ASN HA 1 93 ASN H . . 2.710 2.397 2.274 2.553 . 0 0 "[ . 1 . 2]" 1
1451 1 92 ASN HA 1 93 ASN QB . . 5.420 3.993 3.894 4.194 . 0 0 "[ . 1 . 2]" 1
1452 1 92 ASN QB 1 93 ASN H . . 4.010 2.936 2.422 3.225 . 0 0 "[ . 1 . 2]" 1
1453 1 92 ASN QB 1 111 GLU H . . 6.380 4.122 3.754 4.306 . 0 0 "[ . 1 . 2]" 1
1454 1 92 ASN QB 1 111 GLU QB . . 5.660 2.297 1.880 3.924 . 0 0 "[ . 1 . 2]" 1
1455 1 92 ASN QB 1 111 GLU QG . . 7.250 3.671 2.055 4.311 . 0 0 "[ . 1 . 2]" 1
1456 1 92 ASN HB2 1 93 ASN H . . 4.260 4.174 3.609 4.328 0.068 12 0 "[ . 1 . 2]" 1
1457 1 92 ASN HB2 1 111 GLU QB . . 6.380 2.399 1.960 4.018 . 0 0 "[ . 1 . 2]" 1
1458 1 92 ASN HB3 1 93 ASN H . . 4.260 3.001 2.461 3.327 . 0 0 "[ . 1 . 2]" 1
1459 1 92 ASN HB3 1 111 GLU QB . . 6.380 3.107 2.147 5.490 . 0 0 "[ . 1 . 2]" 1
1460 1 92 ASN HD21 1 111 GLU QB . . 6.380 4.350 3.481 5.280 . 0 0 "[ . 1 . 2]" 1
1461 1 92 ASN HD22 1 111 GLU QB . . 6.380 5.498 4.887 5.726 . 0 0 "[ . 1 . 2]" 1
1462 1 93 ASN H 1 94 GLY H . . 4.970 4.220 3.954 4.404 . 0 0 "[ . 1 . 2]" 1
1463 1 93 ASN HA 1 94 GLY H . . 2.520 2.337 2.252 2.495 . 0 0 "[ . 1 . 2]" 1
1464 1 93 ASN HA 1 94 GLY QA . . 5.670 3.979 3.959 4.021 . 0 0 "[ . 1 . 2]" 1
1465 1 93 ASN HA 1 110 ILE HA . . 3.170 2.910 2.498 3.202 0.032 10 0 "[ . 1 . 2]" 1
1466 1 93 ASN HA 1 110 ILE HB . . 5.500 4.830 4.000 5.319 . 0 0 "[ . 1 . 2]" 1
1467 1 93 ASN HA 1 111 GLU H . . 3.830 3.194 2.894 3.642 . 0 0 "[ . 1 . 2]" 1
1468 1 94 GLY H 1 95 TRP H . . 4.450 4.353 4.231 4.496 0.046 12 0 "[ . 1 . 2]" 1
1469 1 94 GLY H 1 109 VAL H . . 5.500 3.415 2.993 3.744 . 0 0 "[ . 1 . 2]" 1
1470 1 94 GLY H 1 109 VAL HB . . 5.500 4.557 3.036 5.490 . 0 0 "[ . 1 . 2]" 1
1471 1 94 GLY H 1 109 VAL QG . . 7.100 2.327 1.885 3.744 . 0 0 "[ . 1 . 2]" 1
1472 1 94 GLY QA 1 95 TRP H . . 2.810 2.227 2.181 2.297 . 0 0 "[ . 1 . 2]" 1
1473 1 94 GLY QA 1 95 TRP HD1 . . 6.380 4.347 2.838 5.700 . 0 0 "[ . 1 . 2]" 1
1474 1 94 GLY HA2 1 95 TRP H . . 3.020 2.295 2.220 2.430 . 0 0 "[ . 1 . 2]" 1
1475 1 94 GLY HA3 1 95 TRP H . . 3.020 3.034 2.830 3.187 0.167 17 0 "[ . 1 . 2]" 1
1476 1 95 TRP H 1 95 TRP HD1 . . 4.940 3.402 2.215 4.052 . 0 0 "[ . 1 . 2]" 1
1477 1 95 TRP H 1 96 ARG H . . 4.630 4.251 4.026 4.491 . 0 0 "[ . 1 . 2]" 1
1478 1 95 TRP HA 1 96 ARG H . . 2.400 2.271 2.207 2.515 0.115 8 0 "[ . 1 . 2]" 1
1479 1 95 TRP HA 1 107 GLU H . . 5.500 4.899 4.515 5.236 . 0 0 "[ . 1 . 2]" 1
1480 1 95 TRP HA 1 108 PHE HA . . 3.240 2.613 2.252 3.245 0.005 16 0 "[ . 1 . 2]" 1
1481 1 95 TRP QB 1 96 ARG H . . 4.050 3.295 2.397 3.733 . 0 0 "[ . 1 . 2]" 1
1482 1 95 TRP QB 1 97 PHE QE . . 8.500 3.479 1.972 5.996 . 0 0 "[ . 1 . 2]" 1
1483 1 95 TRP HE3 1 106 VAL MG1 . . 5.750 3.415 2.225 4.109 . 0 0 "[ . 1 . 2]" 1
1484 1 95 TRP HZ3 1 106 VAL MG1 . . 6.030 3.855 1.918 5.170 . 0 0 "[ . 1 . 2]" 1
1485 1 96 ARG H 1 96 ARG HB2 . . 3.890 2.583 2.300 2.777 . 0 0 "[ . 1 . 2]" 1
1486 1 96 ARG H 1 96 ARG QB . . 3.480 2.536 2.270 2.716 . 0 0 "[ . 1 . 2]" 1
1487 1 96 ARG H 1 96 ARG HB3 . . 3.890 3.707 3.503 3.839 . 0 0 "[ . 1 . 2]" 1
1488 1 96 ARG H 1 96 ARG HD2 . . 5.500 5.087 4.235 5.458 . 0 0 "[ . 1 . 2]" 1
1489 1 96 ARG H 1 96 ARG QD . . 5.260 4.572 2.518 4.857 . 0 0 "[ . 1 . 2]" 1
1490 1 96 ARG H 1 96 ARG HD3 . . 5.500 5.262 2.537 5.516 0.016 12 0 "[ . 1 . 2]" 1
1491 1 96 ARG H 1 96 ARG HG2 . . 4.450 3.431 3.065 4.439 . 0 0 "[ . 1 . 2]" 1
1492 1 96 ARG H 1 96 ARG QG . . 4.060 3.159 2.843 3.813 . 0 0 "[ . 1 . 2]" 1
1493 1 96 ARG H 1 96 ARG HG3 . . 4.450 3.755 3.289 4.451 0.001 2 0 "[ . 1 . 2]" 1
1494 1 96 ARG H 1 97 PHE H . . 5.000 4.459 4.374 4.571 . 0 0 "[ . 1 . 2]" 1
1495 1 96 ARG H 1 106 VAL HA . . 5.190 4.867 4.472 5.197 0.007 9 0 "[ . 1 . 2]" 1
1496 1 96 ARG H 1 106 VAL MG1 . . 6.530 3.553 3.120 4.029 . 0 0 "[ . 1 . 2]" 1
1497 1 96 ARG H 1 108 PHE HA . . 4.110 3.595 3.119 3.990 . 0 0 "[ . 1 . 2]" 1
1498 1 96 ARG HA 1 96 ARG HD2 . . 5.500 3.333 2.367 4.376 . 0 0 "[ . 1 . 2]" 1
1499 1 96 ARG HA 1 96 ARG QD . . 4.790 2.972 2.286 3.519 . 0 0 "[ . 1 . 2]" 1
1500 1 96 ARG HA 1 96 ARG HD3 . . 5.500 3.525 2.846 4.127 . 0 0 "[ . 1 . 2]" 1
1501 1 96 ARG HA 1 96 ARG HG2 . . 4.230 2.445 2.135 3.557 . 0 0 "[ . 1 . 2]" 1
1502 1 96 ARG HA 1 96 ARG HG3 . . 4.230 3.539 2.259 3.675 . 0 0 "[ . 1 . 2]" 1
1503 1 96 ARG HA 1 97 PHE H . . 2.430 2.374 2.310 2.468 0.038 7 0 "[ . 1 . 2]" 1
1504 1 96 ARG HA 1 107 GLU H . . 4.790 4.697 4.500 4.842 0.052 13 0 "[ . 1 . 2]" 1
1505 1 96 ARG QB 1 97 PHE H . . 3.670 2.787 2.527 2.964 . 0 0 "[ . 1 . 2]" 1
1506 1 96 ARG QB 1 97 PHE QB . . 7.250 4.812 4.367 4.992 . 0 0 "[ . 1 . 2]" 1
1507 1 96 ARG QB 1 107 GLU H . . 6.380 3.291 2.677 4.284 . 0 0 "[ . 1 . 2]" 1
1508 1 96 ARG HB2 1 97 PHE H . . 4.070 4.008 3.700 4.151 0.081 17 0 "[ . 1 . 2]" 1
1509 1 96 ARG HB3 1 97 PHE H . . 4.070 2.844 2.573 3.035 . 0 0 "[ . 1 . 2]" 1
1510 1 96 ARG QD 1 97 PHE H . . 5.290 3.674 2.861 4.676 . 0 0 "[ . 1 . 2]" 1
1511 1 96 ARG HD2 1 97 PHE H . . 5.500 3.938 2.899 5.541 0.041 16 0 "[ . 1 . 2]" 1
1512 1 96 ARG HD3 1 97 PHE H . . 5.500 4.731 3.151 5.407 . 0 0 "[ . 1 . 2]" 1
1513 1 96 ARG QG 1 97 PHE H . . 4.750 4.150 3.390 4.290 . 0 0 "[ . 1 . 2]" 1
1514 1 96 ARG HG2 1 97 PHE H . . 5.500 4.424 3.927 4.633 . 0 0 "[ . 1 . 2]" 1
1515 1 96 ARG HG3 1 97 PHE H . . 5.500 5.121 3.507 5.360 . 0 0 "[ . 1 . 2]" 1
1516 1 97 PHE H 1 98 MET H . . 4.820 4.150 3.774 4.613 . 0 0 "[ . 1 . 2]" 1
1517 1 97 PHE H 1 98 MET QG . . 6.380 4.608 3.923 5.433 . 0 0 "[ . 1 . 2]" 1
1518 1 97 PHE H 1 106 VAL MG2 . . 6.530 5.154 4.670 5.325 . 0 0 "[ . 1 . 2]" 1
1519 1 97 PHE HA 1 98 MET H . . 2.960 2.240 2.193 2.383 . 0 0 "[ . 1 . 2]" 1
1520 1 97 PHE HA 1 98 MET HA . . 4.760 4.374 4.340 4.460 . 0 0 "[ . 1 . 2]" 1
1521 1 97 PHE HA 1 104 THR MG . . 6.530 4.330 3.905 4.778 . 0 0 "[ . 1 . 2]" 1
1522 1 97 PHE HA 1 106 VAL HA . . 3.520 2.293 1.968 2.732 . 0 0 "[ . 1 . 2]" 1
1523 1 97 PHE HA 1 107 GLU H . . 4.200 3.380 3.013 3.798 . 0 0 "[ . 1 . 2]" 1
1524 1 97 PHE QB 1 104 THR MG . . 5.960 3.546 3.010 3.907 . 0 0 "[ . 1 . 2]" 1
1525 1 97 PHE HB2 1 104 THR MG . . 6.530 4.644 3.104 5.305 . 0 0 "[ . 1 . 2]" 1
1526 1 97 PHE HB3 1 104 THR MG . . 6.530 3.892 3.572 4.524 . 0 0 "[ . 1 . 2]" 1
1527 1 97 PHE QD 1 106 VAL MG1 . . 8.000 2.359 1.855 3.358 . 0 0 "[ . 1 . 2]" 1
1528 1 97 PHE QD 1 106 VAL MG2 . . 5.740 2.589 1.934 3.698 . 0 0 "[ . 1 . 2]" 1
1529 1 97 PHE QE 1 106 VAL MG1 . . 7.380 3.025 1.866 5.083 . 0 0 "[ . 1 . 2]" 1
1530 1 97 PHE QE 1 106 VAL MG2 . . 6.910 4.000 2.479 5.304 . 0 0 "[ . 1 . 2]" 1
1531 1 98 MET H 1 98 MET HB2 . . 3.420 2.630 2.328 2.885 . 0 0 "[ . 1 . 2]" 1
1532 1 98 MET H 1 98 MET HB3 . . 3.420 3.334 3.041 3.484 0.064 9 0 "[ . 1 . 2]" 1
1533 1 98 MET H 1 98 MET QG . . 4.580 3.920 3.601 4.092 . 0 0 "[ . 1 . 2]" 1
1534 1 98 MET H 1 104 THR MG . . 5.630 3.981 3.416 4.398 . 0 0 "[ . 1 . 2]" 1
1535 1 98 MET H 1 105 ARG H . . 3.580 3.456 3.095 3.652 0.072 10 0 "[ . 1 . 2]" 1
1536 1 98 MET H 1 105 ARG QB . . 5.670 3.632 2.995 4.894 . 0 0 "[ . 1 . 2]" 1
1537 1 98 MET H 1 105 ARG QG . . 6.380 4.631 2.866 5.682 . 0 0 "[ . 1 . 2]" 1
1538 1 98 MET H 1 106 VAL HA . . 3.920 3.338 2.966 3.932 0.012 17 0 "[ . 1 . 2]" 1
1539 1 98 MET H 1 106 VAL MG2 . . 5.570 3.737 3.253 4.089 . 0 0 "[ . 1 . 2]" 1
1540 1 98 MET HA 1 98 MET HB2 . . 2.990 2.894 2.796 2.964 . 0 0 "[ . 1 . 2]" 1
1541 1 98 MET HA 1 98 MET HB3 . . 2.990 2.908 2.832 2.990 . 0 0 "[ . 1 . 2]" 1
1542 1 98 MET QB 1 105 ARG H . . 5.280 4.199 3.564 4.556 . 0 0 "[ . 1 . 2]" 1
1543 1 98 MET HB2 1 105 ARG H . . 5.500 5.047 4.547 5.391 . 0 0 "[ . 1 . 2]" 1
1544 1 98 MET HB3 1 105 ARG H . . 5.500 4.503 3.724 4.914 . 0 0 "[ . 1 . 2]" 1
1545 1 99 PRO HA 1 100 GLU QB . . 5.910 4.245 4.050 4.542 . 0 0 "[ . 1 . 2]" 1
1546 1 99 PRO HA 1 100 GLU QG . . 6.380 3.610 3.130 3.996 . 0 0 "[ . 1 . 2]" 1
1547 1 99 PRO HA 1 105 ARG QB . . 6.380 4.498 3.823 5.415 . 0 0 "[ . 1 . 2]" 1
1548 1 99 PRO HB2 1 100 GLU QG . . 5.260 4.720 4.643 4.848 . 0 0 "[ . 1 . 2]" 1
1549 1 99 PRO HB3 1 100 GLU H . . 3.580 3.633 3.507 3.695 0.115 12 0 "[ . 1 . 2]" 1
1550 1 100 GLU H 1 101 GLY H . . 4.600 3.268 2.811 4.358 . 0 0 "[ . 1 . 2]" 1
1551 1 100 GLU H 1 103 ALA H . . 5.500 4.348 4.041 4.741 . 0 0 "[ . 1 . 2]" 1
1552 1 100 GLU H 1 104 THR H . . 4.760 4.807 4.761 4.912 0.152 6 0 "[ . 1 . 2]" 1
1553 1 100 GLU H 1 104 THR HA . . 3.800 2.551 2.425 2.943 . 0 0 "[ . 1 . 2]" 1
1554 1 100 GLU H 1 104 THR MG . . 6.530 5.113 4.992 5.333 . 0 0 "[ . 1 . 2]" 1
1555 1 100 GLU H 1 105 ARG H . . 4.760 3.881 3.607 4.430 . 0 0 "[ . 1 . 2]" 1
1556 1 100 GLU HA 1 101 GLY H . . 2.590 2.476 2.261 2.647 0.057 7 0 "[ . 1 . 2]" 1
1557 1 100 GLU HA 1 101 GLY HA2 . . 5.030 4.446 4.387 4.591 . 0 0 "[ . 1 . 2]" 1
1558 1 100 GLU HA 1 101 GLY HA3 . . 4.970 4.431 4.365 4.754 . 0 0 "[ . 1 . 2]" 1
1559 1 100 GLU QG 1 101 GLY H . . 6.380 4.317 4.010 4.496 . 0 0 "[ . 1 . 2]" 1
1560 1 101 GLY H 1 101 GLY HA2 . . 2.740 2.333 2.272 2.441 . 0 0 "[ . 1 . 2]" 1
1561 1 101 GLY H 1 101 GLY HA3 . . 2.900 2.903 2.669 2.960 0.060 6 0 "[ . 1 . 2]" 1
1562 1 101 GLY H 1 102 ASP H . . 5.500 4.538 4.413 4.597 . 0 0 "[ . 1 . 2]" 1
1563 1 101 GLY HA2 1 102 ASP H . . 3.140 3.187 3.070 3.283 0.143 2 0 "[ . 1 . 2]" 1
1564 1 101 GLY HA2 1 103 ALA H . . 4.660 4.575 4.493 4.673 0.013 17 0 "[ . 1 . 2]" 1
1565 1 101 GLY HA3 1 102 ASP H . . 2.770 2.222 2.200 2.270 . 0 0 "[ . 1 . 2]" 1
1566 1 101 GLY HA3 1 103 ALA H . . 3.520 3.349 3.294 3.446 . 0 0 "[ . 1 . 2]" 1
1567 1 102 ASP H 1 102 ASP HA . . 2.900 2.842 2.785 2.902 0.002 17 0 "[ . 1 . 2]" 1
1568 1 102 ASP H 1 102 ASP HB2 . . 3.700 3.573 3.530 3.662 . 0 0 "[ . 1 . 2]" 1
1569 1 102 ASP H 1 102 ASP HB3 . . 3.240 2.440 2.340 2.626 . 0 0 "[ . 1 . 2]" 1
1570 1 102 ASP H 1 103 ALA H . . 2.620 2.313 2.007 2.518 . 0 0 "[ . 1 . 2]" 1
1571 1 102 ASP H 1 103 ALA MB . . 6.220 4.024 3.888 4.214 . 0 0 "[ . 1 . 2]" 1
1572 1 102 ASP HA 1 102 ASP HB2 . . 2.710 2.386 2.367 2.418 . 0 0 "[ . 1 . 2]" 1
1573 1 102 ASP HA 1 102 ASP HB3 . . 2.560 2.572 2.533 2.599 0.039 10 0 "[ . 1 . 2]" 1
1574 1 102 ASP HB2 1 103 ALA H . . 4.260 4.217 4.063 4.302 0.042 10 0 "[ . 1 . 2]" 1
1575 1 102 ASP HB3 1 103 ALA H . . 3.950 3.966 3.908 3.991 0.041 15 0 "[ . 1 . 2]" 1
1576 1 103 ALA H 1 103 ALA HA . . 2.930 2.935 2.923 2.942 0.012 10 0 "[ . 1 . 2]" 1
1577 1 103 ALA H 1 103 ALA MB . . 3.430 2.337 2.120 2.525 . 0 0 "[ . 1 . 2]" 1
1578 1 103 ALA H 1 104 THR H . . 4.660 4.518 4.454 4.563 . 0 0 "[ . 1 . 2]" 1
1579 1 103 ALA HA 1 104 THR H . . 3.110 2.488 2.412 2.515 . 0 0 "[ . 1 . 2]" 1
1580 1 103 ALA HA 1 104 THR HA . . 5.070 4.407 4.350 4.457 . 0 0 "[ . 1 . 2]" 1
1581 1 103 ALA MB 1 104 THR H . . 3.430 2.519 2.372 2.674 . 0 0 "[ . 1 . 2]" 1
1582 1 103 ALA MB 1 104 THR HA . . 5.190 4.104 3.987 4.216 . 0 0 "[ . 1 . 2]" 1
1583 1 103 ALA MB 1 104 THR HB . . 6.000 4.535 4.408 4.650 . 0 0 "[ . 1 . 2]" 1
1584 1 104 THR H 1 104 THR HA . . 2.930 2.943 2.920 2.949 0.019 11 0 "[ . 1 . 2]" 1
1585 1 104 THR H 1 104 THR HB . . 2.650 2.454 2.248 2.625 . 0 0 "[ . 1 . 2]" 1
1586 1 104 THR H 1 104 THR MG . . 4.300 2.856 2.784 3.233 . 0 0 "[ . 1 . 2]" 1
1587 1 104 THR H 1 105 ARG H . . 4.850 4.521 4.450 4.600 . 0 0 "[ . 1 . 2]" 1
1588 1 104 THR H 1 105 ARG HA . . 4.970 4.875 4.722 5.097 0.127 7 0 "[ . 1 . 2]" 1
1589 1 104 THR HA 1 105 ARG H . . 2.430 2.280 2.270 2.287 . 0 0 "[ . 1 . 2]" 1
1590 1 104 THR HB 1 105 ARG H . . 4.350 4.352 4.337 4.374 0.024 6 0 "[ . 1 . 2]" 1
1591 1 104 THR MG 1 105 ARG H . . 3.800 2.908 2.634 3.005 . 0 0 "[ . 1 . 2]" 1
1592 1 104 THR MG 1 105 ARG HB2 . . 6.530 4.908 4.773 5.172 . 0 0 "[ . 1 . 2]" 1
1593 1 104 THR MG 1 105 ARG QB . . 5.990 4.326 4.199 4.408 . 0 0 "[ . 1 . 2]" 1
1594 1 104 THR MG 1 105 ARG HB3 . . 6.530 4.812 4.604 4.949 . 0 0 "[ . 1 . 2]" 1
1595 1 105 ARG H 1 105 ARG HB2 . . 3.420 2.850 2.554 3.725 0.305 10 0 "[ . 1 . 2]" 1
1596 1 105 ARG H 1 105 ARG QB . . 3.080 2.418 2.362 2.625 . 0 0 "[ . 1 . 2]" 1
1597 1 105 ARG H 1 105 ARG HB3 . . 3.420 2.653 2.471 2.886 . 0 0 "[ . 1 . 2]" 1
1598 1 105 ARG H 1 106 VAL H . . 4.940 4.453 4.343 4.499 . 0 0 "[ . 1 . 2]" 1
1599 1 105 ARG HA 1 106 VAL H . . 2.430 2.264 2.239 2.309 . 0 0 "[ . 1 . 2]" 1
1600 1 105 ARG HA 1 106 VAL HB . . 4.970 4.553 4.465 4.630 . 0 0 "[ . 1 . 2]" 1
1601 1 105 ARG HA 1 106 VAL MG2 . . 4.510 3.564 3.392 3.686 . 0 0 "[ . 1 . 2]" 1
1602 1 105 ARG HB2 1 106 VAL H . . 5.500 4.281 3.150 4.450 . 0 0 "[ . 1 . 2]" 1
1603 1 105 ARG HB3 1 106 VAL H . . 5.500 4.097 3.852 4.313 . 0 0 "[ . 1 . 2]" 1
1604 1 105 ARG QG 1 106 VAL H . . 6.380 2.627 2.303 4.046 . 0 0 "[ . 1 . 2]" 1
1605 1 106 VAL H 1 106 VAL HB . . 2.560 2.558 2.484 2.602 0.042 20 0 "[ . 1 . 2]" 1
1606 1 106 VAL H 1 106 VAL MG1 . . 4.730 3.811 3.762 3.836 . 0 0 "[ . 1 . 2]" 1
1607 1 106 VAL H 1 106 VAL MG2 . . 3.460 2.771 2.495 2.903 . 0 0 "[ . 1 . 2]" 1
1608 1 106 VAL H 1 107 GLU H . . 5.070 4.426 4.344 4.511 . 0 0 "[ . 1 . 2]" 1
1609 1 106 VAL HA 1 106 VAL MG1 . . 3.490 2.372 2.295 2.475 . 0 0 "[ . 1 . 2]" 1
1610 1 106 VAL HA 1 106 VAL MG2 . . 3.490 2.346 2.231 2.489 . 0 0 "[ . 1 . 2]" 1
1611 1 106 VAL HA 1 107 GLU H . . 2.400 2.238 2.190 2.268 . 0 0 "[ . 1 . 2]" 1
1612 1 106 VAL HB 1 107 GLU H . . 4.910 4.149 4.025 4.361 . 0 0 "[ . 1 . 2]" 1
1613 1 106 VAL MG1 1 107 GLU H . . 4.300 2.346 2.055 2.856 . 0 0 "[ . 1 . 2]" 1
1614 1 106 VAL MG1 1 107 GLU HA . . 5.570 3.741 3.542 3.908 . 0 0 "[ . 1 . 2]" 1
1615 1 106 VAL MG1 1 108 PHE H . . 6.340 4.255 3.958 4.507 . 0 0 "[ . 1 . 2]" 1
1616 1 106 VAL MG2 1 107 GLU H . . 5.380 4.039 3.981 4.084 . 0 0 "[ . 1 . 2]" 1
1617 1 106 VAL MG2 1 107 GLU QG . . 6.630 4.907 4.727 4.950 . 0 0 "[ . 1 . 2]" 1
1618 1 107 GLU H 1 107 GLU HB2 . . 3.140 2.781 2.727 2.907 . 0 0 "[ . 1 . 2]" 1
1619 1 107 GLU H 1 108 PHE H . . 4.940 4.343 4.270 4.423 . 0 0 "[ . 1 . 2]" 1
1620 1 107 GLU HA 1 108 PHE H . . 2.400 2.219 2.203 2.260 . 0 0 "[ . 1 . 2]" 1
1621 1 107 GLU HB2 1 108 PHE H . . 4.540 4.151 3.987 4.238 . 0 0 "[ . 1 . 2]" 1
1622 1 107 GLU HB3 1 108 PHE H . . 3.420 3.412 3.173 3.616 0.196 10 0 "[ . 1 . 2]" 1
1623 1 107 GLU HB3 1 109 VAL H . . 5.500 5.409 5.242 5.515 0.015 3 0 "[ . 1 . 2]" 1
1624 1 108 PHE H 1 108 PHE HB2 . . 3.240 2.673 2.079 3.094 . 0 0 "[ . 1 . 2]" 1
1625 1 108 PHE H 1 108 PHE QB . . 2.840 2.269 2.058 2.378 . 0 0 "[ . 1 . 2]" 1
1626 1 108 PHE H 1 108 PHE HB3 . . 3.240 2.733 2.319 3.390 0.150 11 0 "[ . 1 . 2]" 1
1627 1 108 PHE HA 1 109 VAL H . . 2.990 2.199 2.193 2.212 . 0 0 "[ . 1 . 2]" 1
1628 1 108 PHE QB 1 109 VAL QG . . 8.970 4.334 4.131 4.541 . 0 0 "[ . 1 . 2]" 1
1629 1 108 PHE HB2 1 135 ILE MD . . 6.530 4.650 3.608 5.320 . 0 0 "[ . 1 . 2]" 1
1630 1 108 PHE HB3 1 135 ILE MD . . 6.530 4.620 4.109 5.307 . 0 0 "[ . 1 . 2]" 1
1631 1 108 PHE QD 1 109 VAL QG . . 10.210 3.867 3.287 4.904 . 0 0 "[ . 1 . 2]" 1
1632 1 108 PHE QD 1 110 ILE HB . . 7.620 5.659 4.965 6.691 . 0 0 "[ . 1 . 2]" 1
1633 1 108 PHE QD 1 110 ILE MG . . 6.110 3.180 2.673 3.940 . 0 0 "[ . 1 . 2]" 1
1634 1 108 PHE QD 1 131 ALA MB . . 8.650 3.657 2.218 5.649 . 0 0 "[ . 1 . 2]" 1
1635 1 108 PHE QD 1 134 LEU QD . . 8.760 3.037 2.261 4.320 . 0 0 "[ . 1 . 2]" 1
1636 1 109 VAL H 1 109 VAL HB . . 3.610 3.563 2.589 3.684 0.074 8 0 "[ . 1 . 2]" 1
1637 1 109 VAL HA 1 110 ILE H . . 2.400 2.198 2.182 2.282 . 0 0 "[ . 1 . 2]" 1
1638 1 109 VAL HB 1 110 ILE H . . 3.890 3.519 3.064 3.964 0.074 2 0 "[ . 1 . 2]" 1
1639 1 109 VAL QG 1 110 ILE H . . 5.790 3.507 2.158 3.702 . 0 0 "[ . 1 . 2]" 1
1640 1 110 ILE H 1 110 ILE MD . . 4.950 3.251 1.899 3.988 . 0 0 "[ . 1 . 2]" 1
1641 1 110 ILE H 1 110 ILE HG12 . . 4.170 3.723 3.506 4.016 . 0 0 "[ . 1 . 2]" 1
1642 1 110 ILE H 1 110 ILE QG . . 3.890 2.642 2.096 3.631 . 0 0 "[ . 1 . 2]" 1
1643 1 110 ILE H 1 110 ILE HG13 . . 4.170 2.818 2.112 4.271 0.101 2 0 "[ . 1 . 2]" 1
1644 1 110 ILE H 1 110 ILE MG . . 4.330 2.401 1.968 2.780 . 0 0 "[ . 1 . 2]" 1
1645 1 110 ILE H 1 111 GLU H . . 5.030 4.376 4.265 4.511 . 0 0 "[ . 1 . 2]" 1
1646 1 110 ILE HA 1 110 ILE HB . . 2.830 2.295 2.213 2.374 . 0 0 "[ . 1 . 2]" 1
1647 1 110 ILE HA 1 111 GLU H . . 2.560 2.201 2.176 2.243 . 0 0 "[ . 1 . 2]" 1
1648 1 110 ILE HA 1 111 GLU QB . . 5.660 4.213 3.951 4.526 . 0 0 "[ . 1 . 2]" 1
1649 1 110 ILE HB 1 111 GLU H . . 4.010 3.425 3.241 3.645 . 0 0 "[ . 1 . 2]" 1
1650 1 110 ILE MD 1 111 GLU H . . 5.290 3.484 2.720 4.143 . 0 0 "[ . 1 . 2]" 1
1651 1 110 ILE MD 1 111 GLU HA . . 6.530 3.069 2.624 3.601 . 0 0 "[ . 1 . 2]" 1
1652 1 110 ILE MD 1 111 GLU QB . . 7.160 4.572 4.088 5.056 . 0 0 "[ . 1 . 2]" 1
1653 1 110 ILE MD 1 111 GLU HG2 . . 6.190 4.525 4.105 4.894 . 0 0 "[ . 1 . 2]" 1
1654 1 110 ILE MD 1 111 GLU QG . . 5.810 4.019 3.819 4.229 . 0 0 "[ . 1 . 2]" 1
1655 1 110 ILE MD 1 111 GLU HG3 . . 6.190 4.561 4.028 4.972 . 0 0 "[ . 1 . 2]" 1
1656 1 110 ILE MD 1 112 PHE QD . . 8.650 2.691 1.813 3.802 . 0 0 "[ . 1 . 2]" 1
1657 1 110 ILE MD 1 112 PHE QE . . 8.650 2.125 1.761 3.439 . 0 0 "[ . 1 . 2]" 1
1658 1 110 ILE QG 1 111 GLU H . . 5.230 4.074 3.107 4.525 . 0 0 "[ . 1 . 2]" 1
1659 1 110 ILE QG 1 112 PHE QD . . 8.500 3.901 2.077 4.807 . 0 0 "[ . 1 . 2]" 1
1660 1 110 ILE HG12 1 111 GLU H . . 5.500 4.868 3.158 5.559 0.059 8 0 "[ . 1 . 2]" 1
1661 1 110 ILE HG13 1 111 GLU H . . 5.500 4.633 4.198 4.804 . 0 0 "[ . 1 . 2]" 1
1662 1 110 ILE MG 1 111 GLU H . . 6.470 4.286 4.172 4.388 . 0 0 "[ . 1 . 2]" 1
1663 1 110 ILE MG 1 112 PHE QE . . 8.400 4.363 3.347 5.384 . 0 0 "[ . 1 . 2]" 1
1664 1 111 GLU H 1 111 GLU HG2 . . 4.720 4.197 2.104 4.630 . 0 0 "[ . 1 . 2]" 1
1665 1 111 GLU H 1 111 GLU QG . . 4.380 3.344 2.055 3.969 . 0 0 "[ . 1 . 2]" 1
1666 1 111 GLU H 1 111 GLU HG3 . . 4.720 3.577 2.850 4.391 . 0 0 "[ . 1 . 2]" 1
1667 1 111 GLU HA 1 111 GLU HG2 . . 4.260 2.412 2.010 3.589 . 0 0 "[ . 1 . 2]" 1
1668 1 111 GLU HA 1 111 GLU HG3 . . 4.260 2.924 2.519 3.854 . 0 0 "[ . 1 . 2]" 1
1669 1 111 GLU HA 1 112 PHE H . . 2.520 2.238 2.202 2.343 . 0 0 "[ . 1 . 2]" 1
1670 1 111 GLU QB 1 112 PHE H . . 4.300 3.303 2.843 3.708 . 0 0 "[ . 1 . 2]" 1
1671 1 111 GLU QG 1 112 PHE H . . 4.800 3.803 3.184 4.339 . 0 0 "[ . 1 . 2]" 1
1672 1 111 GLU HG2 1 112 PHE H . . 5.500 4.016 3.268 5.142 . 0 0 "[ . 1 . 2]" 1
1673 1 111 GLU HG3 1 112 PHE H . . 5.500 4.885 4.373 5.240 . 0 0 "[ . 1 . 2]" 1
1674 1 112 PHE H 1 113 ALA H . . 4.940 4.385 4.318 4.447 . 0 0 "[ . 1 . 2]" 1
1675 1 112 PHE HA 1 112 PHE HB2 . . 2.990 2.694 2.527 3.033 0.043 8 0 "[ . 1 . 2]" 1
1676 1 112 PHE HA 1 112 PHE QB . . 2.760 2.281 2.233 2.587 . 0 0 "[ . 1 . 2]" 1
1677 1 112 PHE HA 1 112 PHE HB3 . . 2.990 2.478 2.379 2.839 . 0 0 "[ . 1 . 2]" 1
1678 1 112 PHE HA 1 113 ALA H . . 2.560 2.441 2.372 2.574 0.014 16 0 "[ . 1 . 2]" 1
1679 1 112 PHE HA 1 113 ALA MB . . 4.950 3.835 3.759 3.923 . 0 0 "[ . 1 . 2]" 1
1680 1 112 PHE QB 1 113 ALA H . . 3.170 2.602 2.313 2.806 . 0 0 "[ . 1 . 2]" 1
1681 1 112 PHE QB 1 113 ALA MB . . 6.910 4.329 4.236 4.395 . 0 0 "[ . 1 . 2]" 1
1682 1 112 PHE HB2 1 113 ALA H . . 3.830 2.879 2.335 3.947 0.117 15 0 "[ . 1 . 2]" 1
1683 1 112 PHE HB3 1 113 ALA H . . 3.830 3.555 2.537 3.921 0.091 13 0 "[ . 1 . 2]" 1
1684 1 112 PHE QD 1 113 ALA HA . . 6.690 3.878 2.826 5.905 . 0 0 "[ . 1 . 2]" 1
1685 1 112 PHE QD 1 113 ALA MB . . 8.150 4.670 4.087 5.705 . 0 0 "[ . 1 . 2]" 1
1686 1 112 PHE QD 1 124 ALA HA . . 7.620 5.469 4.772 6.044 . 0 0 "[ . 1 . 2]" 1
1687 1 112 PHE QD 1 127 VAL MG2 . . 8.650 3.918 3.000 4.540 . 0 0 "[ . 1 . 2]" 1
1688 1 112 PHE QE 1 124 ALA HA . . 7.620 4.111 3.270 6.532 . 0 0 "[ . 1 . 2]" 1
1689 1 112 PHE QE 1 124 ALA MB . . 8.650 3.376 2.076 6.491 . 0 0 "[ . 1 . 2]" 1
1690 1 112 PHE QE 1 127 VAL MG1 . . 8.650 3.982 3.074 5.796 . 0 0 "[ . 1 . 2]" 1
1691 1 112 PHE QE 1 127 VAL MG2 . . 7.970 2.413 1.944 3.655 . 0 0 "[ . 1 . 2]" 1
1692 1 113 ALA H 1 114 PHE H . . 4.720 4.316 4.147 4.515 . 0 0 "[ . 1 . 2]" 1
1693 1 113 ALA H 1 114 PHE QB . . 6.380 5.512 5.088 5.649 . 0 0 "[ . 1 . 2]" 1
1694 1 113 ALA HA 1 114 PHE H . . 2.620 2.194 2.187 2.238 . 0 0 "[ . 1 . 2]" 1
1695 1 113 ALA MB 1 114 PHE H . . 3.950 3.262 3.022 3.345 . 0 0 "[ . 1 . 2]" 1
1696 1 114 PHE H 1 114 PHE HB2 . . 4.040 2.108 2.030 2.411 . 0 0 "[ . 1 . 2]" 1
1697 1 114 PHE H 1 114 PHE QB . . 3.770 2.086 2.012 2.377 . 0 0 "[ . 1 . 2]" 1
1698 1 114 PHE H 1 114 PHE HB3 . . 4.040 3.343 3.248 3.605 . 0 0 "[ . 1 . 2]" 1
1699 1 114 PHE HA 1 115 LYS H . . 2.680 2.521 2.408 2.584 . 0 0 "[ . 1 . 2]" 1
1700 1 114 PHE HA 1 115 LYS HB2 . . 4.970 4.909 4.619 5.025 0.055 11 0 "[ . 1 . 2]" 1
1701 1 114 PHE HA 1 115 LYS HD2 . . 3.980 3.704 2.858 4.008 0.028 9 0 "[ . 1 . 2]" 1
1702 1 114 PHE HA 1 115 LYS QD . . 3.770 3.175 2.804 3.405 . 0 0 "[ . 1 . 2]" 1
1703 1 114 PHE HA 1 115 LYS HD3 . . 3.980 3.605 3.065 4.063 0.083 19 0 "[ . 1 . 2]" 1
1704 1 114 PHE QB 1 116 SER H . . 5.050 3.043 2.774 3.312 . 0 0 "[ . 1 . 2]" 1
1705 1 114 PHE QB 1 120 ASP HB2 . . 6.380 3.156 2.928 3.395 . 0 0 "[ . 1 . 2]" 1
1706 1 114 PHE HB2 1 115 LYS H . . 4.070 3.923 3.783 4.079 0.009 20 0 "[ . 1 . 2]" 1
1707 1 114 PHE HB3 1 115 LYS H . . 4.070 2.539 2.343 2.754 . 0 0 "[ . 1 . 2]" 1
1708 1 114 PHE QD 1 115 LYS H . . 7.620 2.638 2.175 3.344 . 0 0 "[ . 1 . 2]" 1
1709 1 114 PHE QD 1 119 LEU MD1 . . 8.650 4.623 4.173 5.256 . 0 0 "[ . 1 . 2]" 1
1710 1 114 PHE QD 1 119 LEU MD2 . . 8.650 5.938 5.716 6.225 . 0 0 "[ . 1 . 2]" 1
1711 1 114 PHE QD 1 120 ASP HA . . 6.600 2.247 2.008 2.891 . 0 0 "[ . 1 . 2]" 1
1712 1 114 PHE QE 1 119 LEU MD1 . . 8.650 4.801 4.254 5.170 . 0 0 "[ . 1 . 2]" 1
1713 1 114 PHE QE 1 119 LEU MD2 . . 7.780 5.768 5.491 5.878 . 0 0 "[ . 1 . 2]" 1
1714 1 114 PHE QE 1 123 LEU QB . . 8.500 2.342 1.848 2.794 . 0 0 "[ . 1 . 2]" 1
1715 1 114 PHE QE 1 123 LEU MD1 . . 6.360 2.199 1.945 2.519 . 0 0 "[ . 1 . 2]" 1
1716 1 114 PHE QE 1 123 LEU MD2 . . 8.150 3.500 3.147 3.984 . 0 0 "[ . 1 . 2]" 1
1717 1 114 PHE QE 1 123 LEU HG . . 7.620 4.539 4.341 4.871 . 0 0 "[ . 1 . 2]" 1
1718 1 114 PHE QE 1 124 ALA HA . . 6.130 4.187 4.058 4.431 . 0 0 "[ . 1 . 2]" 1
1719 1 114 PHE QE 1 124 ALA MB . . 7.350 3.666 3.518 3.885 . 0 0 "[ . 1 . 2]" 1
1720 1 115 LYS H 1 115 LYS HB2 . . 3.240 2.520 2.338 2.639 . 0 0 "[ . 1 . 2]" 1
1721 1 115 LYS H 1 115 LYS HB3 . . 3.830 3.611 3.569 3.664 . 0 0 "[ . 1 . 2]" 1
1722 1 115 LYS H 1 115 LYS QD . . 4.740 1.960 1.888 2.140 . 0 0 "[ . 1 . 2]" 1
1723 1 115 LYS H 1 115 LYS QE . . 6.070 3.585 2.713 4.039 . 0 0 "[ . 1 . 2]" 1
1724 1 115 LYS H 1 115 LYS HG2 . . 3.890 3.924 3.829 4.017 0.127 13 0 "[ . 1 . 2]" 1
1725 1 115 LYS H 1 115 LYS HG3 . . 4.410 2.971 2.635 3.871 . 0 0 "[ . 1 . 2]" 1
1726 1 115 LYS H 1 116 SER H . . 3.330 2.372 2.266 2.478 . 0 0 "[ . 1 . 2]" 1
1727 1 115 LYS HA 1 115 LYS HB3 . . 2.620 2.435 2.376 2.551 . 0 0 "[ . 1 . 2]" 1
1728 1 115 LYS HA 1 115 LYS HG2 . . 3.550 3.437 3.360 3.623 0.073 13 0 "[ . 1 . 2]" 1
1729 1 115 LYS HA 1 115 LYS HG3 . . 2.650 2.433 2.372 2.529 . 0 0 "[ . 1 . 2]" 1
1730 1 115 LYS HB2 1 115 LYS QD . . 3.280 2.306 2.154 2.535 . 0 0 "[ . 1 . 2]" 1
1731 1 115 LYS HB2 1 116 SER H . . 4.230 2.520 2.441 2.772 . 0 0 "[ . 1 . 2]" 1
1732 1 115 LYS HB3 1 116 SER H . . 5.100 3.672 3.401 3.899 . 0 0 "[ . 1 . 2]" 1
1733 1 115 LYS QD 1 116 SER H . . 6.040 3.504 3.220 3.823 . 0 0 "[ . 1 . 2]" 1
1734 1 115 LYS QE 1 116 SER H . . 5.050 4.328 3.759 4.579 . 0 0 "[ . 1 . 2]" 1
1735 1 116 SER H 1 116 SER HA . . 2.830 2.860 2.830 2.893 0.063 3 0 "[ . 1 . 2]" 1
1736 1 116 SER H 1 116 SER HB2 . . 3.580 2.331 2.122 3.175 . 0 0 "[ . 1 . 2]" 1
1737 1 116 SER H 1 116 SER HB3 . . 3.580 3.256 2.088 3.585 0.005 11 0 "[ . 1 . 2]" 1
1738 1 116 SER HA 1 117 ALA MB . . 6.530 3.942 3.898 3.992 . 0 0 "[ . 1 . 2]" 1
1739 1 116 SER HA 1 119 LEU H . . 4.320 4.337 4.314 4.367 0.047 18 0 "[ . 1 . 2]" 1
1740 1 116 SER QB 1 117 ALA H . . 4.150 3.477 3.290 3.712 . 0 0 "[ . 1 . 2]" 1
1741 1 116 SER QB 1 119 LEU H . . 4.440 2.140 1.914 3.013 . 0 0 "[ . 1 . 2]" 1
1742 1 116 SER QB 1 119 LEU HA . . 6.380 4.261 4.082 4.796 . 0 0 "[ . 1 . 2]" 1
1743 1 116 SER QB 1 119 LEU HB2 . . 6.380 2.050 1.871 2.446 . 0 0 "[ . 1 . 2]" 1
1744 1 116 SER QB 1 119 LEU HG . . 6.380 2.589 2.246 3.122 . 0 0 "[ . 1 . 2]" 1
1745 1 116 SER HB2 1 117 ALA H . . 4.690 4.418 3.916 4.614 . 0 0 "[ . 1 . 2]" 1
1746 1 116 SER HB2 1 119 LEU H . . 4.660 3.089 2.473 3.761 . 0 0 "[ . 1 . 2]" 1
1747 1 116 SER HB2 1 119 LEU MD1 . . 6.530 2.692 2.075 3.718 . 0 0 "[ . 1 . 2]" 1
1748 1 116 SER HB3 1 117 ALA H . . 4.690 3.706 3.400 4.532 . 0 0 "[ . 1 . 2]" 1
1749 1 116 SER HB3 1 119 LEU H . . 4.660 2.205 1.927 3.196 . 0 0 "[ . 1 . 2]" 1
1750 1 116 SER HB3 1 119 LEU MD1 . . 6.530 3.300 2.587 3.792 . 0 0 "[ . 1 . 2]" 1
1751 1 117 ALA HA 1 118 LEU H . . 3.520 3.560 3.513 3.602 0.082 13 0 "[ . 1 . 2]" 1
1752 1 117 ALA HA 1 118 LEU HA . . 5.500 4.753 4.724 4.772 . 0 0 "[ . 1 . 2]" 1
1753 1 117 ALA HA 1 120 ASP H . . 3.860 3.289 3.203 3.416 . 0 0 "[ . 1 . 2]" 1
1754 1 117 ALA HA 1 120 ASP HB2 . . 3.140 2.041 1.988 2.143 . 0 0 "[ . 1 . 2]" 1
1755 1 117 ALA HA 1 120 ASP HB3 . . 3.210 3.232 3.167 3.260 0.050 8 0 "[ . 1 . 2]" 1
1756 1 117 ALA HA 1 121 ALA H . . 4.790 4.451 4.375 4.537 . 0 0 "[ . 1 . 2]" 1
1757 1 117 ALA MB 1 118 LEU H . . 4.140 2.844 2.644 3.002 . 0 0 "[ . 1 . 2]" 1
1758 1 117 ALA MB 1 118 LEU HA . . 4.950 3.848 3.763 3.925 . 0 0 "[ . 1 . 2]" 1
1759 1 117 ALA MB 1 118 LEU QD . . 9.130 2.860 2.644 3.012 . 0 0 "[ . 1 . 2]" 1
1760 1 117 ALA MB 1 120 ASP HB2 . . 6.530 3.706 3.643 3.812 . 0 0 "[ . 1 . 2]" 1
1761 1 117 ALA MB 1 120 ASP HB3 . . 5.660 4.300 4.172 4.377 . 0 0 "[ . 1 . 2]" 1
1762 1 118 LEU H 1 118 LEU HB2 . . 3.360 2.034 2.008 2.057 . 0 0 "[ . 1 . 2]" 1
1763 1 118 LEU H 1 118 LEU QB . . 3.130 2.016 1.991 2.039 . 0 0 "[ . 1 . 2]" 1
1764 1 118 LEU H 1 118 LEU HB3 . . 3.360 3.321 3.275 3.369 0.009 13 0 "[ . 1 . 2]" 1
1765 1 118 LEU H 1 118 LEU HG . . 4.140 4.116 4.030 4.147 0.007 19 0 "[ . 1 . 2]" 1
1766 1 118 LEU H 1 119 LEU H . . 2.650 2.645 2.579 2.704 0.054 13 0 "[ . 1 . 2]" 1
1767 1 118 LEU HA 1 118 LEU HB2 . . 3.020 2.923 2.898 2.944 . 0 0 "[ . 1 . 2]" 1
1768 1 118 LEU HA 1 118 LEU HB3 . . 3.020 2.761 2.728 2.795 . 0 0 "[ . 1 . 2]" 1
1769 1 118 LEU HA 1 118 LEU MD1 . . 3.770 2.112 2.003 2.341 . 0 0 "[ . 1 . 2]" 1
1770 1 118 LEU HA 1 118 LEU QD . . 3.340 1.958 1.871 2.068 . 0 0 "[ . 1 . 2]" 1
1771 1 118 LEU HA 1 118 LEU MD2 . . 3.770 2.332 2.166 2.506 . 0 0 "[ . 1 . 2]" 1
1772 1 118 LEU HA 1 118 LEU HG . . 3.730 3.622 3.615 3.636 . 0 0 "[ . 1 . 2]" 1
1773 1 118 LEU HA 1 119 LEU MD2 . . 6.530 5.234 5.095 5.307 . 0 0 "[ . 1 . 2]" 1
1774 1 118 LEU HA 1 120 ASP H . . 4.010 4.002 3.925 4.056 0.046 8 0 "[ . 1 . 2]" 1
1775 1 118 LEU HA 1 121 ALA H . . 3.760 3.630 3.535 3.683 . 0 0 "[ . 1 . 2]" 1
1776 1 118 LEU HA 1 121 ALA MB . . 4.540 3.510 3.362 3.647 . 0 0 "[ . 1 . 2]" 1
1777 1 118 LEU HA 1 122 MET H . . 4.570 4.174 4.062 4.342 . 0 0 "[ . 1 . 2]" 1
1778 1 118 LEU QB 1 118 LEU HG . . 2.590 2.166 2.164 2.166 . 0 0 "[ . 1 . 2]" 1
1779 1 118 LEU QB 1 120 ASP H . . 6.130 4.341 4.258 4.398 . 0 0 "[ . 1 . 2]" 1
1780 1 118 LEU HB2 1 119 LEU H . . 3.580 2.901 2.804 3.033 . 0 0 "[ . 1 . 2]" 1
1781 1 118 LEU HB2 1 119 LEU HG . . 5.500 4.094 3.739 4.389 . 0 0 "[ . 1 . 2]" 1
1782 1 118 LEU HB3 1 119 LEU H . . 3.580 3.001 2.836 3.119 . 0 0 "[ . 1 . 2]" 1
1783 1 118 LEU HB3 1 119 LEU HG . . 5.500 3.809 3.514 3.981 . 0 0 "[ . 1 . 2]" 1
1784 1 118 LEU QD 1 119 LEU H . . 8.100 3.966 3.918 4.010 . 0 0 "[ . 1 . 2]" 1
1785 1 118 LEU QD 1 119 LEU MD2 . . 9.130 4.406 4.257 4.520 . 0 0 "[ . 1 . 2]" 1
1786 1 118 LEU HG 1 119 LEU H . . 5.500 5.076 4.946 5.175 . 0 0 "[ . 1 . 2]" 1
1787 1 119 LEU H 1 119 LEU HA . . 2.800 2.811 2.786 2.831 0.031 5 0 "[ . 1 . 2]" 1
1788 1 119 LEU H 1 119 LEU HB2 . . 2.770 2.314 2.199 2.521 . 0 0 "[ . 1 . 2]" 1
1789 1 119 LEU H 1 119 LEU HB3 . . 3.670 3.511 3.479 3.546 . 0 0 "[ . 1 . 2]" 1
1790 1 119 LEU H 1 119 LEU MD1 . . 5.070 3.762 3.428 3.933 . 0 0 "[ . 1 . 2]" 1
1791 1 119 LEU H 1 119 LEU MD2 . . 5.160 3.327 3.218 3.453 . 0 0 "[ . 1 . 2]" 1
1792 1 119 LEU H 1 119 LEU HG . . 3.360 2.482 2.066 2.771 . 0 0 "[ . 1 . 2]" 1
1793 1 119 LEU H 1 120 ASP H . . 2.960 2.564 2.504 2.637 . 0 0 "[ . 1 . 2]" 1
1794 1 119 LEU HA 1 119 LEU HB3 . . 2.990 2.538 2.419 2.604 . 0 0 "[ . 1 . 2]" 1
1795 1 119 LEU HA 1 119 LEU MD2 . . 3.430 1.959 1.896 2.089 . 0 0 "[ . 1 . 2]" 1
1796 1 119 LEU HA 1 119 LEU HG . . 3.450 3.092 3.065 3.146 . 0 0 "[ . 1 . 2]" 1
1797 1 119 LEU HA 1 120 ASP H . . 3.610 3.516 3.503 3.538 . 0 0 "[ . 1 . 2]" 1
1798 1 119 LEU HA 1 120 ASP HB2 . . 5.500 5.494 5.464 5.528 0.028 8 0 "[ . 1 . 2]" 1
1799 1 119 LEU HA 1 122 MET H . . 3.330 3.035 2.998 3.092 . 0 0 "[ . 1 . 2]" 1
1800 1 119 LEU HA 1 122 MET HB2 . . 3.490 2.004 1.965 2.064 . 0 0 "[ . 1 . 2]" 1
1801 1 119 LEU HA 1 122 MET QB . . 3.240 1.912 1.857 1.965 . 0 0 "[ . 1 . 2]" 1
1802 1 119 LEU HA 1 122 MET HB3 . . 3.490 2.425 2.251 2.623 . 0 0 "[ . 1 . 2]" 1
1803 1 119 LEU HA 1 122 MET QG . . 6.380 3.714 3.596 3.879 . 0 0 "[ . 1 . 2]" 1
1804 1 119 LEU HB2 1 120 ASP H . . 3.490 3.145 3.065 3.209 . 0 0 "[ . 1 . 2]" 1
1805 1 119 LEU HB3 1 120 ASP H . . 5.500 3.960 3.841 4.126 . 0 0 "[ . 1 . 2]" 1
1806 1 119 LEU HG 1 120 ASP H . . 5.500 4.691 4.342 4.881 . 0 0 "[ . 1 . 2]" 1
1807 1 120 ASP H 1 120 ASP HB2 . . 2.680 2.023 2.009 2.040 . 0 0 "[ . 1 . 2]" 1
1808 1 120 ASP H 1 120 ASP HB3 . . 3.170 3.069 3.015 3.125 . 0 0 "[ . 1 . 2]" 1
1809 1 120 ASP HA 1 120 ASP HB3 . . 3.020 2.972 2.951 2.993 . 0 0 "[ . 1 . 2]" 1
1810 1 120 ASP HA 1 123 LEU H . . 4.140 3.888 3.774 3.986 . 0 0 "[ . 1 . 2]" 1
1811 1 120 ASP HA 1 124 ALA H . . 5.500 3.814 3.616 4.078 . 0 0 "[ . 1 . 2]" 1
1812 1 120 ASP HB2 1 121 ALA H . . 3.110 3.163 3.100 3.226 0.116 8 0 "[ . 1 . 2]" 1
1813 1 120 ASP HB2 1 121 ALA MB . . 6.530 4.492 4.379 4.566 . 0 0 "[ . 1 . 2]" 1
1814 1 120 ASP HB3 1 121 ALA H . . 2.960 2.466 2.382 2.569 . 0 0 "[ . 1 . 2]" 1
1815 1 120 ASP HB3 1 121 ALA MB . . 5.260 3.491 3.372 3.590 . 0 0 "[ . 1 . 2]" 1
1816 1 121 ALA H 1 121 ALA HA . . 2.900 2.858 2.843 2.869 . 0 0 "[ . 1 . 2]" 1
1817 1 121 ALA H 1 121 ALA MB . . 3.430 2.075 1.973 2.198 . 0 0 "[ . 1 . 2]" 1
1818 1 121 ALA H 1 122 MET H . . 3.020 2.427 2.369 2.494 . 0 0 "[ . 1 . 2]" 1
1819 1 121 ALA H 1 124 ALA MB . . 6.530 4.272 4.124 4.478 . 0 0 "[ . 1 . 2]" 1
1820 1 121 ALA HA 1 124 ALA H . . 3.950 3.434 3.244 3.618 . 0 0 "[ . 1 . 2]" 1
1821 1 121 ALA HA 1 124 ALA MB . . 3.920 2.230 2.031 2.401 . 0 0 "[ . 1 . 2]" 1
1822 1 121 ALA MB 1 122 MET H . . 4.170 2.750 2.616 2.889 . 0 0 "[ . 1 . 2]" 1
1823 1 121 ALA MB 1 122 MET HA . . 5.500 3.783 3.685 3.843 . 0 0 "[ . 1 . 2]" 1
1824 1 121 ALA MB 1 122 MET QB . . 6.350 4.014 3.938 4.099 . 0 0 "[ . 1 . 2]" 1
1825 1 121 ALA MB 1 122 MET HG2 . . 6.530 5.105 4.783 5.355 . 0 0 "[ . 1 . 2]" 1
1826 1 121 ALA MB 1 122 MET QG . . 6.390 4.522 4.372 4.655 . 0 0 "[ . 1 . 2]" 1
1827 1 121 ALA MB 1 122 MET HG3 . . 6.530 5.077 4.754 5.328 . 0 0 "[ . 1 . 2]" 1
1828 1 121 ALA MB 1 123 LEU H . . 6.530 4.735 4.604 4.818 . 0 0 "[ . 1 . 2]" 1
1829 1 121 ALA MB 1 124 ALA H . . 6.530 4.669 4.517 4.825 . 0 0 "[ . 1 . 2]" 1
1830 1 121 ALA MB 1 124 ALA MB . . 7.340 3.737 3.534 3.876 . 0 0 "[ . 1 . 2]" 1
1831 1 122 MET H 1 122 MET HB2 . . 3.240 1.984 1.970 2.001 . 0 0 "[ . 1 . 2]" 1
1832 1 122 MET H 1 122 MET QB . . 3.020 1.961 1.951 1.974 . 0 0 "[ . 1 . 2]" 1
1833 1 122 MET H 1 122 MET HB3 . . 3.240 3.075 3.016 3.143 . 0 0 "[ . 1 . 2]" 1
1834 1 122 MET H 1 122 MET HG2 . . 4.630 4.003 3.805 4.152 . 0 0 "[ . 1 . 2]" 1
1835 1 122 MET H 1 122 MET QG . . 4.230 3.485 3.397 3.559 . 0 0 "[ . 1 . 2]" 1
1836 1 122 MET H 1 122 MET HG3 . . 4.630 3.848 3.609 3.981 . 0 0 "[ . 1 . 2]" 1
1837 1 122 MET H 1 123 LEU H . . 2.770 2.783 2.743 2.853 0.083 8 0 "[ . 1 . 2]" 1
1838 1 122 MET H 1 123 LEU HG . . 5.500 5.486 5.382 5.582 0.082 4 0 "[ . 1 . 2]" 1
1839 1 122 MET H 1 124 ALA H . . 4.940 4.100 3.933 4.315 . 0 0 "[ . 1 . 2]" 1
1840 1 122 MET HA 1 122 MET HB2 . . 2.960 2.825 2.799 2.860 . 0 0 "[ . 1 . 2]" 1
1841 1 122 MET HA 1 122 MET HB3 . . 2.960 2.970 2.943 2.988 0.028 4 0 "[ . 1 . 2]" 1
1842 1 122 MET HA 1 122 MET HG2 . . 3.890 2.080 2.021 2.228 . 0 0 "[ . 1 . 2]" 1
1843 1 122 MET HA 1 122 MET QG . . 3.620 2.046 1.999 2.141 . 0 0 "[ . 1 . 2]" 1
1844 1 122 MET HA 1 122 MET HG3 . . 3.890 3.109 2.772 3.366 . 0 0 "[ . 1 . 2]" 1
1845 1 122 MET HA 1 123 LEU H . . 3.640 3.624 3.611 3.630 . 0 0 "[ . 1 . 2]" 1
1846 1 122 MET HA 1 125 ALA H . . 3.730 3.655 3.568 3.713 . 0 0 "[ . 1 . 2]" 1
1847 1 122 MET HA 1 125 ALA MB . . 4.880 2.473 2.369 2.637 . 0 0 "[ . 1 . 2]" 1
1848 1 122 MET QB 1 123 LEU H . . 3.810 2.520 2.451 2.630 . 0 0 "[ . 1 . 2]" 1
1849 1 122 MET QB 1 123 LEU HG . . 4.680 3.330 3.224 3.438 . 0 0 "[ . 1 . 2]" 1
1850 1 122 MET QB 1 125 ALA MB . . 7.410 4.197 4.127 4.325 . 0 0 "[ . 1 . 2]" 1
1851 1 122 MET HB2 1 123 LEU H . . 4.010 3.225 3.161 3.313 . 0 0 "[ . 1 . 2]" 1
1852 1 122 MET HB3 1 123 LEU H . . 4.010 2.633 2.543 2.782 . 0 0 "[ . 1 . 2]" 1
1853 1 122 MET HG2 1 123 LEU H . . 5.500 4.784 4.687 4.872 . 0 0 "[ . 1 . 2]" 1
1854 1 122 MET HG3 1 123 LEU H . . 5.500 5.133 5.095 5.199 . 0 0 "[ . 1 . 2]" 1
1855 1 123 LEU H 1 123 LEU HB2 . . 3.860 2.137 2.099 2.174 . 0 0 "[ . 1 . 2]" 1
1856 1 123 LEU H 1 123 LEU QB . . 3.480 2.117 2.080 2.153 . 0 0 "[ . 1 . 2]" 1
1857 1 123 LEU H 1 123 LEU HB3 . . 3.860 3.437 3.400 3.465 . 0 0 "[ . 1 . 2]" 1
1858 1 123 LEU H 1 123 LEU MD1 . . 5.190 3.381 3.238 3.587 . 0 0 "[ . 1 . 2]" 1
1859 1 123 LEU H 1 123 LEU HG . . 4.910 3.073 2.978 3.161 . 0 0 "[ . 1 . 2]" 1
1860 1 123 LEU H 1 124 ALA H . . 2.870 2.513 2.459 2.597 . 0 0 "[ . 1 . 2]" 1
1861 1 123 LEU HA 1 123 LEU MD2 . . 3.800 2.518 2.344 2.645 . 0 0 "[ . 1 . 2]" 1
1862 1 123 LEU HA 1 123 LEU HG . . 4.200 2.475 2.418 2.575 . 0 0 "[ . 1 . 2]" 1
1863 1 123 LEU HA 1 126 ASN H . . 4.140 3.309 3.236 3.395 . 0 0 "[ . 1 . 2]" 1
1864 1 123 LEU HA 1 126 ASN HB3 . . 4.200 3.927 3.688 4.080 . 0 0 "[ . 1 . 2]" 1
1865 1 123 LEU QB 1 124 ALA H . . 4.300 2.667 2.539 2.768 . 0 0 "[ . 1 . 2]" 1
1866 1 123 LEU QB 1 124 ALA HA . . 4.950 3.887 3.827 3.932 . 0 0 "[ . 1 . 2]" 1
1867 1 123 LEU HB2 1 124 ALA HA . . 5.500 4.723 4.654 4.803 . 0 0 "[ . 1 . 2]" 1
1868 1 123 LEU HB3 1 124 ALA HA . . 5.500 4.137 4.036 4.202 . 0 0 "[ . 1 . 2]" 1
1869 1 123 LEU MD1 1 124 ALA H . . 6.530 4.473 4.352 4.610 . 0 0 "[ . 1 . 2]" 1
1870 1 123 LEU MD2 1 124 ALA H . . 6.530 4.781 4.643 4.867 . 0 0 "[ . 1 . 2]" 1
1871 1 123 LEU MD2 1 127 VAL HA . . 6.530 5.277 5.117 5.344 . 0 0 "[ . 1 . 2]" 1
1872 1 123 LEU MD2 1 127 VAL HB . . 6.530 5.160 5.005 5.318 . 0 0 "[ . 1 . 2]" 1
1873 1 123 LEU HG 1 124 ALA H . . 5.310 4.831 4.781 4.885 . 0 0 "[ . 1 . 2]" 1
1874 1 124 ALA H 1 124 ALA HA . . 2.830 2.802 2.770 2.833 0.003 5 0 "[ . 1 . 2]" 1
1875 1 124 ALA H 1 124 ALA MB . . 3.430 2.162 2.149 2.174 . 0 0 "[ . 1 . 2]" 1
1876 1 124 ALA H 1 125 ALA H . . 3.240 2.619 2.533 2.689 . 0 0 "[ . 1 . 2]" 1
1877 1 124 ALA H 1 125 ALA MB . . 6.530 4.146 4.073 4.250 . 0 0 "[ . 1 . 2]" 1
1878 1 124 ALA H 1 126 ASN H . . 5.500 4.616 4.567 4.655 . 0 0 "[ . 1 . 2]" 1
1879 1 124 ALA HA 1 125 ALA HA . . 4.970 4.708 4.679 4.731 . 0 0 "[ . 1 . 2]" 1
1880 1 124 ALA HA 1 125 ALA MB . . 6.530 4.919 4.911 4.941 . 0 0 "[ . 1 . 2]" 1
1881 1 124 ALA HA 1 127 VAL H . . 4.200 3.306 3.262 3.375 . 0 0 "[ . 1 . 2]" 1
1882 1 124 ALA HA 1 127 VAL HB . . 3.550 1.977 1.949 2.032 . 0 0 "[ . 1 . 2]" 1
1883 1 124 ALA HA 1 127 VAL MG1 . . 4.110 2.726 2.487 2.994 . 0 0 "[ . 1 . 2]" 1
1884 1 124 ALA HA 1 127 VAL MG2 . . 4.820 2.943 2.731 3.088 . 0 0 "[ . 1 . 2]" 1
1885 1 124 ALA MB 1 125 ALA H . . 3.950 3.120 3.057 3.165 . 0 0 "[ . 1 . 2]" 1
1886 1 125 ALA H 1 125 ALA MB . . 3.430 2.071 1.982 2.192 . 0 0 "[ . 1 . 2]" 1
1887 1 125 ALA H 1 126 ASN H . . 2.900 2.525 2.463 2.570 . 0 0 "[ . 1 . 2]" 1
1888 1 125 ALA HA 1 127 VAL H . . 5.340 4.048 3.735 4.214 . 0 0 "[ . 1 . 2]" 1
1889 1 125 ALA MB 1 126 ASN H . . 3.740 2.458 2.311 2.540 . 0 0 "[ . 1 . 2]" 1
1890 1 125 ALA MB 1 126 ASN QD . . 6.440 4.259 4.147 4.522 . 0 0 "[ . 1 . 2]" 1
1891 1 126 ASN H 1 126 ASN HB2 . . 3.490 3.537 3.517 3.556 0.066 10 0 "[ . 1 . 2]" 1
1892 1 126 ASN H 1 126 ASN HB3 . . 3.080 2.367 2.280 2.492 . 0 0 "[ . 1 . 2]" 1
1893 1 126 ASN H 1 127 VAL H . . 2.870 2.512 2.469 2.557 . 0 0 "[ . 1 . 2]" 1
1894 1 126 ASN H 1 127 VAL MG1 . . 6.530 4.694 4.624 4.884 . 0 0 "[ . 1 . 2]" 1
1895 1 126 ASN HA 1 126 ASN HB2 . . 2.590 2.421 2.378 2.478 . 0 0 "[ . 1 . 2]" 1
1896 1 126 ASN HA 1 126 ASN HB3 . . 2.650 2.574 2.510 2.629 . 0 0 "[ . 1 . 2]" 1
1897 1 126 ASN HA 1 128 ASP H . . 4.290 3.851 3.609 4.011 . 0 0 "[ . 1 . 2]" 1
1898 1 126 ASN HA 1 129 ARG H . . 3.520 2.953 2.911 3.050 . 0 0 "[ . 1 . 2]" 1
1899 1 126 ASN HA 1 129 ARG HB2 . . 4.170 2.889 2.704 3.125 . 0 0 "[ . 1 . 2]" 1
1900 1 126 ASN HA 1 129 ARG HB3 . . 4.970 4.420 4.173 4.730 . 0 0 "[ . 1 . 2]" 1
1901 1 126 ASN HB2 1 127 VAL H . . 5.220 4.205 4.129 4.344 . 0 0 "[ . 1 . 2]" 1
1902 1 126 ASN HB3 1 127 VAL H . . 4.350 3.999 3.892 4.249 . 0 0 "[ . 1 . 2]" 1
1903 1 127 VAL H 1 127 VAL HB . . 2.490 2.016 1.995 2.046 . 0 0 "[ . 1 . 2]" 1
1904 1 127 VAL H 1 127 VAL MG1 . . 3.680 2.885 2.749 3.013 . 0 0 "[ . 1 . 2]" 1
1905 1 127 VAL H 1 127 VAL MG2 . . 4.140 3.445 3.364 3.511 . 0 0 "[ . 1 . 2]" 1
1906 1 127 VAL H 1 128 ASP H . . 2.900 2.898 2.755 2.946 0.046 6 0 "[ . 1 . 2]" 1
1907 1 127 VAL HA 1 127 VAL HB . . 2.900 2.684 2.651 2.715 . 0 0 "[ . 1 . 2]" 1
1908 1 127 VAL HA 1 127 VAL MG2 . . 3.430 2.051 1.957 2.174 . 0 0 "[ . 1 . 2]" 1
1909 1 127 VAL HA 1 130 ALA H . . 3.890 3.454 3.328 3.588 . 0 0 "[ . 1 . 2]" 1
1910 1 127 VAL HA 1 130 ALA HA . . 5.440 5.432 5.352 5.467 0.027 14 0 "[ . 1 . 2]" 1
1911 1 127 VAL HA 1 130 ALA MB . . 3.490 2.596 2.399 2.785 . 0 0 "[ . 1 . 2]" 1
1912 1 127 VAL HA 1 131 ALA H . . 4.230 4.009 3.714 4.228 . 0 0 "[ . 1 . 2]" 1
1913 1 127 VAL HB 1 128 ASP H . . 3.520 3.560 3.535 3.596 0.076 3 0 "[ . 1 . 2]" 1
1914 1 127 VAL MG1 1 128 ASP H . . 3.520 1.969 1.903 2.132 . 0 0 "[ . 1 . 2]" 1
1915 1 127 VAL MG1 1 128 ASP HA . . 6.530 2.881 2.816 2.919 . 0 0 "[ . 1 . 2]" 1
1916 1 127 VAL MG1 1 128 ASP QB . . 7.030 2.956 2.862 3.044 . 0 0 "[ . 1 . 2]" 1
1917 1 127 VAL MG1 1 129 ARG H . . 6.530 4.287 4.108 4.493 . 0 0 "[ . 1 . 2]" 1
1918 1 127 VAL MG1 1 130 ALA MB . . 7.560 4.533 4.327 4.681 . 0 0 "[ . 1 . 2]" 1
1919 1 127 VAL MG1 1 131 ALA H . . 6.530 4.442 4.329 4.534 . 0 0 "[ . 1 . 2]" 1
1920 1 127 VAL MG2 1 128 ASP H . . 5.380 4.135 4.040 4.250 . 0 0 "[ . 1 . 2]" 1
1921 1 127 VAL MG2 1 128 ASP HA . . 6.220 4.588 4.474 4.732 . 0 0 "[ . 1 . 2]" 1
1922 1 127 VAL MG2 1 128 ASP QB . . 7.310 5.181 5.047 5.291 . 0 0 "[ . 1 . 2]" 1
1923 1 128 ASP H 1 128 ASP HA . . 2.740 2.757 2.743 2.768 0.028 5 0 "[ . 1 . 2]" 1
1924 1 128 ASP H 1 128 ASP QB . . 3.310 2.112 1.990 2.188 . 0 0 "[ . 1 . 2]" 1
1925 1 128 ASP H 1 129 ARG H . . 2.680 2.682 2.594 2.741 0.061 20 0 "[ . 1 . 2]" 1
1926 1 128 ASP H 1 131 ALA MB . . 6.500 4.521 4.276 4.732 . 0 0 "[ . 1 . 2]" 1
1927 1 128 ASP HA 1 131 ALA H . . 3.670 3.475 3.378 3.631 . 0 0 "[ . 1 . 2]" 1
1928 1 128 ASP HA 1 131 ALA MB . . 4.820 2.554 2.266 2.812 . 0 0 "[ . 1 . 2]" 1
1929 1 128 ASP HA 1 132 GLY H . . 4.630 4.272 3.838 4.443 . 0 0 "[ . 1 . 2]" 1
1930 1 128 ASP QB 1 129 ARG H . . 3.830 2.448 2.222 2.679 . 0 0 "[ . 1 . 2]" 1
1931 1 129 ARG H 1 129 ARG HA . . 2.800 2.744 2.718 2.788 . 0 0 "[ . 1 . 2]" 1
1932 1 129 ARG H 1 129 ARG HB2 . . 2.960 2.426 2.387 2.482 . 0 0 "[ . 1 . 2]" 1
1933 1 129 ARG H 1 129 ARG HB3 . . 3.610 3.545 3.540 3.549 . 0 0 "[ . 1 . 2]" 1
1934 1 129 ARG H 1 129 ARG HG2 . . 3.920 2.471 2.067 3.879 . 0 0 "[ . 1 . 2]" 1
1935 1 129 ARG H 1 129 ARG QG . . 3.540 2.255 2.053 2.729 . 0 0 "[ . 1 . 2]" 1
1936 1 129 ARG H 1 129 ARG HG3 . . 3.920 3.194 2.613 3.495 . 0 0 "[ . 1 . 2]" 1
1937 1 129 ARG H 1 130 ALA H . . 2.800 2.780 2.631 2.828 0.028 20 0 "[ . 1 . 2]" 1
1938 1 129 ARG H 1 130 ALA MB . . 6.530 4.289 4.192 4.375 . 0 0 "[ . 1 . 2]" 1
1939 1 129 ARG H 1 131 ALA H . . 5.100 4.074 3.870 4.242 . 0 0 "[ . 1 . 2]" 1
1940 1 129 ARG HA 1 129 ARG HB3 . . 2.680 2.573 2.543 2.600 . 0 0 "[ . 1 . 2]" 1
1941 1 129 ARG HA 1 129 ARG HG2 . . 4.040 2.770 2.428 3.309 . 0 0 "[ . 1 . 2]" 1
1942 1 129 ARG HA 1 129 ARG QG . . 3.730 2.565 2.200 2.867 . 0 0 "[ . 1 . 2]" 1
1943 1 129 ARG HA 1 129 ARG HG3 . . 4.040 3.511 2.234 3.763 . 0 0 "[ . 1 . 2]" 1
1944 1 129 ARG HA 1 131 ALA H . . 5.070 4.370 4.093 4.707 . 0 0 "[ . 1 . 2]" 1
1945 1 129 ARG HA 1 132 GLY H . . 3.550 3.213 3.115 3.367 . 0 0 "[ . 1 . 2]" 1
1946 1 129 ARG HB2 1 130 ALA H . . 3.420 2.464 2.368 2.542 . 0 0 "[ . 1 . 2]" 1
1947 1 129 ARG HB2 1 130 ALA HA . . 5.000 4.252 4.187 4.324 . 0 0 "[ . 1 . 2]" 1
1948 1 129 ARG HB2 1 130 ALA MB . . 4.790 3.856 3.771 3.987 . 0 0 "[ . 1 . 2]" 1
1949 1 129 ARG HB3 1 129 ARG QG . . 2.740 2.446 2.179 2.562 . 0 0 "[ . 1 . 2]" 1
1950 1 129 ARG HB3 1 130 ALA H . . 3.520 3.470 3.328 3.554 0.034 18 0 "[ . 1 . 2]" 1
1951 1 129 ARG QG 1 130 ALA H . . 6.380 4.070 3.966 4.377 . 0 0 "[ . 1 . 2]" 1
1952 1 130 ALA H 1 130 ALA HA . . 2.770 2.773 2.757 2.791 0.021 19 0 "[ . 1 . 2]" 1
1953 1 130 ALA H 1 130 ALA MB . . 3.430 2.034 1.933 2.157 . 0 0 "[ . 1 . 2]" 1
1954 1 130 ALA H 1 131 ALA H . . 2.710 2.729 2.635 2.771 0.061 1 0 "[ . 1 . 2]" 1
1955 1 130 ALA H 1 131 ALA MB . . 6.530 4.296 4.172 4.374 . 0 0 "[ . 1 . 2]" 1
1956 1 130 ALA HA 1 131 ALA H . . 3.580 3.602 3.566 3.630 0.050 13 0 "[ . 1 . 2]" 1
1957 1 130 ALA HA 1 131 ALA HA . . 5.500 4.768 4.741 4.792 . 0 0 "[ . 1 . 2]" 1
1958 1 130 ALA HA 1 131 ALA MB . . 6.530 5.010 4.985 5.032 . 0 0 "[ . 1 . 2]" 1
1959 1 130 ALA HA 1 133 LYS H . . 3.390 3.368 3.297 3.479 0.089 2 0 "[ . 1 . 2]" 1
1960 1 130 ALA HA 1 133 LYS HB2 . . 4.760 4.808 4.604 4.885 0.125 8 0 "[ . 1 . 2]" 1
1961 1 130 ALA HA 1 133 LYS HB3 . . 4.480 3.450 3.080 3.815 . 0 0 "[ . 1 . 2]" 1
1962 1 130 ALA HA 1 133 LYS HG2 . . 4.850 2.746 2.063 3.413 . 0 0 "[ . 1 . 2]" 1
1963 1 130 ALA MB 1 131 ALA H . . 3.860 2.668 2.459 2.886 . 0 0 "[ . 1 . 2]" 1
1964 1 130 ALA MB 1 133 LYS H . . 6.530 4.602 4.536 4.700 . 0 0 "[ . 1 . 2]" 1
1965 1 131 ALA H 1 131 ALA MB . . 3.430 2.070 1.943 2.170 . 0 0 "[ . 1 . 2]" 1
1966 1 131 ALA H 1 132 GLY H . . 2.710 2.567 2.478 2.663 . 0 0 "[ . 1 . 2]" 1
1967 1 131 ALA HA 1 132 GLY H . . 3.550 3.562 3.529 3.623 0.073 2 0 "[ . 1 . 2]" 1
1968 1 131 ALA HA 1 133 LYS H . . 4.690 4.483 4.217 4.693 0.003 8 0 "[ . 1 . 2]" 1
1969 1 131 ALA HA 1 134 LEU H . . 4.350 3.367 3.241 3.511 . 0 0 "[ . 1 . 2]" 1
1970 1 131 ALA HA 1 134 LEU HB2 . . 4.410 4.121 3.889 4.340 . 0 0 "[ . 1 . 2]" 1
1971 1 131 ALA HA 1 134 LEU HB3 . . 3.700 2.705 2.316 3.195 . 0 0 "[ . 1 . 2]" 1
1972 1 131 ALA HA 1 134 LEU QD . . 6.180 2.190 1.832 3.101 . 0 0 "[ . 1 . 2]" 1
1973 1 131 ALA MB 1 132 GLY H . . 3.740 2.819 2.450 2.952 . 0 0 "[ . 1 . 2]" 1
1974 1 131 ALA MB 1 134 LEU HB2 . . 6.530 5.440 5.218 5.559 . 0 0 "[ . 1 . 2]" 1
1975 1 132 GLY H 1 132 GLY HA3 . . 2.560 2.252 2.246 2.260 . 0 0 "[ . 1 . 2]" 1
1976 1 132 GLY H 1 133 LYS H . . 2.990 2.654 2.565 2.848 . 0 0 "[ . 1 . 2]" 1
1977 1 132 GLY HA2 1 135 ILE H . . 3.730 3.516 3.377 3.695 . 0 0 "[ . 1 . 2]" 1
1978 1 132 GLY HA2 1 135 ILE HB . . 4.040 2.744 2.644 2.862 . 0 0 "[ . 1 . 2]" 1
1979 1 132 GLY HA2 1 135 ILE MD . . 5.440 3.051 2.183 4.657 . 0 0 "[ . 1 . 2]" 1
1980 1 132 GLY HA2 1 135 ILE MG . . 5.570 3.960 3.796 4.175 . 0 0 "[ . 1 . 2]" 1
1981 1 132 GLY HA2 1 136 ALA H . . 4.320 4.168 3.884 4.351 0.031 2 0 "[ . 1 . 2]" 1
1982 1 132 GLY HA3 1 133 LYS H . . 2.930 2.846 2.774 2.943 0.013 1 0 "[ . 1 . 2]" 1
1983 1 132 GLY HA3 1 135 ILE HB . . 4.290 4.323 4.260 4.389 0.099 18 0 "[ . 1 . 2]" 1
1984 1 133 LYS H 1 133 LYS HA . . 2.870 2.826 2.790 2.855 . 0 0 "[ . 1 . 2]" 1
1985 1 133 LYS H 1 133 LYS HB2 . . 3.490 3.477 3.398 3.547 0.057 10 0 "[ . 1 . 2]" 1
1986 1 133 LYS H 1 133 LYS HB3 . . 2.520 2.214 2.087 2.397 . 0 0 "[ . 1 . 2]" 1
1987 1 133 LYS H 1 133 LYS HD2 . . 5.500 4.985 4.812 5.175 . 0 0 "[ . 1 . 2]" 1
1988 1 133 LYS H 1 133 LYS QD . . 5.100 4.115 3.597 4.503 . 0 0 "[ . 1 . 2]" 1
1989 1 133 LYS H 1 133 LYS HD3 . . 5.500 4.467 3.703 5.193 . 0 0 "[ . 1 . 2]" 1
1990 1 133 LYS H 1 133 LYS HG2 . . 2.960 2.919 2.681 3.192 0.232 13 0 "[ . 1 . 2]" 1
1991 1 133 LYS H 1 133 LYS HG3 . . 4.010 3.554 2.559 4.133 0.123 5 0 "[ . 1 . 2]" 1
1992 1 133 LYS H 1 134 LEU H . . 3.450 2.559 2.487 2.680 . 0 0 "[ . 1 . 2]" 1
1993 1 133 LYS H 1 135 ILE H . . 4.910 4.044 3.927 4.209 . 0 0 "[ . 1 . 2]" 1
1994 1 133 LYS HA 1 133 LYS HB2 . . 2.930 2.284 2.240 2.358 . 0 0 "[ . 1 . 2]" 1
1995 1 133 LYS HA 1 133 LYS HB3 . . 2.650 2.645 2.531 2.731 0.081 20 0 "[ . 1 . 2]" 1
1996 1 133 LYS HA 1 133 LYS HD2 . . 5.500 4.874 4.269 5.427 . 0 0 "[ . 1 . 2]" 1
1997 1 133 LYS HA 1 133 LYS QD . . 5.140 4.262 4.086 4.384 . 0 0 "[ . 1 . 2]" 1
1998 1 133 LYS HA 1 133 LYS HD3 . . 5.500 4.850 4.570 5.321 . 0 0 "[ . 1 . 2]" 1
1999 1 133 LYS HA 1 133 LYS HG2 . . 4.110 3.859 3.646 4.182 0.072 13 0 "[ . 1 . 2]" 1
2000 1 133 LYS HA 1 135 ILE H . . 4.320 4.329 4.114 4.540 0.220 19 0 "[ . 1 . 2]" 1
2001 1 133 LYS HA 1 136 ALA H . . 3.490 3.257 3.115 3.468 . 0 0 "[ . 1 . 2]" 1
2002 1 133 LYS HA 1 136 ALA MB . . 3.920 2.439 2.254 2.643 . 0 0 "[ . 1 . 2]" 1
2003 1 133 LYS HA 1 137 CYS H . . 4.350 4.085 3.798 4.270 . 0 0 "[ . 1 . 2]" 1
2004 1 133 LYS HB2 1 134 LEU H . . 4.410 4.148 4.078 4.216 . 0 0 "[ . 1 . 2]" 1
2005 1 133 LYS HB2 1 137 CYS H . . 5.410 5.283 4.938 5.442 0.032 12 0 "[ . 1 . 2]" 1
2006 1 133 LYS HB3 1 134 LEU H . . 4.200 3.709 3.483 3.976 . 0 0 "[ . 1 . 2]" 1
2007 1 133 LYS QD 1 133 LYS HG2 . . 2.600 2.398 2.193 2.558 . 0 0 "[ . 1 . 2]" 1
2008 1 133 LYS QD 1 133 LYS HG3 . . 2.620 2.314 2.197 2.490 . 0 0 "[ . 1 . 2]" 1
2009 1 133 LYS QE 1 134 LEU HB3 . . 5.910 3.834 3.483 4.480 . 0 0 "[ . 1 . 2]" 1
2010 1 133 LYS QE 1 134 LEU QD . . 8.980 4.318 3.432 4.937 . 0 0 "[ . 1 . 2]" 1
2011 1 133 LYS QE 1 134 LEU HG . . 6.380 5.537 4.569 5.865 . 0 0 "[ . 1 . 2]" 1
2012 1 134 LEU H 1 134 LEU HB2 . . 4.010 3.264 2.954 3.447 . 0 0 "[ . 1 . 2]" 1
2013 1 134 LEU H 1 134 LEU HB3 . . 3.170 2.063 1.988 2.148 . 0 0 "[ . 1 . 2]" 1
2014 1 134 LEU H 1 134 LEU MD1 . . 5.440 4.036 3.254 4.362 . 0 0 "[ . 1 . 2]" 1
2015 1 134 LEU H 1 134 LEU QD . . 5.080 3.420 3.149 3.696 . 0 0 "[ . 1 . 2]" 1
2016 1 134 LEU H 1 134 LEU MD2 . . 5.440 3.739 3.276 4.197 . 0 0 "[ . 1 . 2]" 1
2017 1 134 LEU H 1 135 ILE H . . 3.700 2.659 2.520 2.751 . 0 0 "[ . 1 . 2]" 1
2018 1 134 LEU HA 1 137 CYS H . . 3.760 3.261 3.176 3.429 . 0 0 "[ . 1 . 2]" 1
2019 1 134 LEU HA 1 137 CYS HB2 . . 3.980 2.850 2.578 3.103 . 0 0 "[ . 1 . 2]" 1
2020 1 134 LEU HA 1 137 CYS HB3 . . 3.860 2.782 2.610 3.151 . 0 0 "[ . 1 . 2]" 1
2021 1 134 LEU HA 1 138 PHE H . . 4.510 4.163 3.674 4.334 . 0 0 "[ . 1 . 2]" 1
2022 1 134 LEU HB2 1 135 ILE H . . 5.220 4.187 4.077 4.321 . 0 0 "[ . 1 . 2]" 1
2023 1 134 LEU HB3 1 135 ILE H . . 3.520 3.415 2.938 3.705 0.185 17 0 "[ . 1 . 2]" 1
2024 1 134 LEU QD 1 135 ILE H . . 5.470 2.928 1.858 3.651 . 0 0 "[ . 1 . 2]" 1
2025 1 134 LEU QD 1 135 ILE HA . . 8.100 2.525 2.004 3.373 . 0 0 "[ . 1 . 2]" 1
2026 1 134 LEU QD 1 135 ILE MG . . 8.750 4.076 3.598 4.777 . 0 0 "[ . 1 . 2]" 1
2027 1 134 LEU MD1 1 135 ILE H . . 6.030 3.169 1.863 4.663 . 0 0 "[ . 1 . 2]" 1
2028 1 134 LEU MD2 1 135 ILE H . . 6.030 3.879 2.481 4.469 . 0 0 "[ . 1 . 2]" 1
2029 1 134 LEU HG 1 135 ILE H . . 3.760 2.570 2.119 4.276 0.516 19 1 "[ . 1 . +2]" 1
2030 1 135 ILE H 1 135 ILE HA . . 2.830 2.808 2.777 2.854 0.024 18 0 "[ . 1 . 2]" 1
2031 1 135 ILE H 1 135 ILE HB . . 2.490 2.246 2.149 2.409 . 0 0 "[ . 1 . 2]" 1
2032 1 135 ILE H 1 135 ILE MD . . 5.320 3.444 3.157 3.656 . 0 0 "[ . 1 . 2]" 1
2033 1 135 ILE H 1 135 ILE HG12 . . 3.760 3.516 2.059 3.828 0.068 15 0 "[ . 1 . 2]" 1
2034 1 135 ILE H 1 135 ILE QG . . 3.600 2.390 2.043 2.588 . 0 0 "[ . 1 . 2]" 1
2035 1 135 ILE H 1 135 ILE HG13 . . 3.760 2.621 2.362 3.615 . 0 0 "[ . 1 . 2]" 1
2036 1 135 ILE H 1 136 ALA H . . 2.830 2.645 2.481 2.782 . 0 0 "[ . 1 . 2]" 1
2037 1 135 ILE H 1 137 CYS H . . 4.910 3.873 3.741 4.003 . 0 0 "[ . 1 . 2]" 1
2038 1 135 ILE HA 1 138 PHE H . . 3.450 3.373 3.222 3.459 0.009 10 0 "[ . 1 . 2]" 1
2039 1 135 ILE HA 1 138 PHE HB3 . . 4.450 2.796 2.265 3.110 . 0 0 "[ . 1 . 2]" 1
2040 1 135 ILE HB 1 136 ALA H . . 3.300 2.767 2.510 2.941 . 0 0 "[ . 1 . 2]" 1
2041 1 135 ILE HB 1 136 ALA MB . . 5.190 4.098 3.901 4.251 . 0 0 "[ . 1 . 2]" 1
2042 1 135 ILE QG 1 136 ALA H . . 5.200 4.263 3.976 4.377 . 0 0 "[ . 1 . 2]" 1
2043 1 135 ILE MG 1 136 ALA H . . 4.980 3.228 2.894 3.603 . 0 0 "[ . 1 . 2]" 1
2044 1 136 ALA H 1 136 ALA HA . . 2.870 2.805 2.762 2.843 . 0 0 "[ . 1 . 2]" 1
2045 1 136 ALA H 1 136 ALA MB . . 3.430 2.060 1.942 2.164 . 0 0 "[ . 1 . 2]" 1
2046 1 136 ALA H 1 137 CYS H . . 2.680 2.588 2.458 2.707 0.027 1 0 "[ . 1 . 2]" 1
2047 1 136 ALA HA 1 139 GLU H . . 3.830 3.284 3.185 3.505 . 0 0 "[ . 1 . 2]" 1
2048 1 136 ALA HA 1 139 GLU HB2 . . 4.200 2.849 2.685 3.216 . 0 0 "[ . 1 . 2]" 1
2049 1 136 ALA HA 1 139 GLU HB3 . . 4.010 2.794 2.609 3.000 . 0 0 "[ . 1 . 2]" 1
2050 1 136 ALA HA 1 139 GLU QG . . 6.380 4.457 4.100 4.816 . 0 0 "[ . 1 . 2]" 1
2051 1 136 ALA HA 1 140 ALA H . . 4.010 3.731 3.378 3.893 . 0 0 "[ . 1 . 2]" 1
2052 1 136 ALA MB 1 137 CYS H . . 3.490 2.823 2.704 2.908 . 0 0 "[ . 1 . 2]" 1
2053 1 136 ALA MB 1 139 GLU H . . 6.530 4.535 4.452 4.661 . 0 0 "[ . 1 . 2]" 1
2054 1 136 ALA MB 1 139 GLU HB2 . . 6.530 4.451 4.312 4.760 . 0 0 "[ . 1 . 2]" 1
2055 1 136 ALA MB 1 139 GLU HB3 . . 6.250 4.092 3.909 4.409 . 0 0 "[ . 1 . 2]" 1
2056 1 137 CYS H 1 137 CYS HA . . 2.770 2.789 2.775 2.842 0.072 18 0 "[ . 1 . 2]" 1
2057 1 137 CYS H 1 137 CYS HB2 . . 2.900 2.384 2.206 2.592 . 0 0 "[ . 1 . 2]" 1
2058 1 137 CYS H 1 137 CYS HB3 . . 2.740 2.637 2.413 2.928 0.188 18 0 "[ . 1 . 2]" 1
2059 1 137 CYS H 1 138 PHE H . . 2.710 2.685 2.505 2.727 0.017 3 0 "[ . 1 . 2]" 1
2060 1 137 CYS H 1 139 GLU H . . 3.950 3.960 3.758 4.000 0.050 13 0 "[ . 1 . 2]" 1
2061 1 137 CYS HA 1 137 CYS HB2 . . 2.990 2.533 2.412 2.709 . 0 0 "[ . 1 . 2]" 1
2062 1 137 CYS HA 1 140 ALA H . . 3.700 3.607 3.444 3.728 0.028 6 0 "[ . 1 . 2]" 1
2063 1 137 CYS HA 1 140 ALA MB . . 4.050 2.767 2.569 3.006 . 0 0 "[ . 1 . 2]" 1
2064 1 137 CYS HB2 1 138 PHE H . . 3.760 3.718 3.429 3.888 0.128 19 0 "[ . 1 . 2]" 1
2065 1 137 CYS HB3 1 138 PHE H . . 3.390 2.484 2.456 2.609 . 0 0 "[ . 1 . 2]" 1
2066 1 138 PHE H 1 138 PHE HB2 . . 2.830 2.430 2.250 2.673 . 0 0 "[ . 1 . 2]" 1
2067 1 138 PHE H 1 138 PHE HB3 . . 2.590 2.273 2.063 2.450 . 0 0 "[ . 1 . 2]" 1
2068 1 138 PHE H 1 139 GLU H . . 2.830 2.715 2.664 2.786 . 0 0 "[ . 1 . 2]" 1
2069 1 138 PHE H 1 140 ALA H . . 5.130 4.360 4.174 4.454 . 0 0 "[ . 1 . 2]" 1
2070 1 138 PHE H 1 140 ALA MB . . 6.530 4.928 4.726 5.057 . 0 0 "[ . 1 . 2]" 1
2071 1 138 PHE HA 1 141 ARG H . . 3.860 3.475 3.405 3.786 . 0 0 "[ . 1 . 2]" 1
2072 1 138 PHE HA 1 141 ARG HB2 . . 5.500 2.557 2.422 3.016 . 0 0 "[ . 1 . 2]" 1
2073 1 138 PHE HA 1 141 ARG HB3 . . 4.290 3.584 3.436 3.863 . 0 0 "[ . 1 . 2]" 1
2074 1 138 PHE HA 1 142 ALA H . . 4.260 4.174 3.809 4.290 0.030 9 0 "[ . 1 . 2]" 1
2075 1 138 PHE HB2 1 139 GLU H . . 4.230 3.904 3.769 4.059 . 0 0 "[ . 1 . 2]" 1
2076 1 138 PHE HB3 1 139 GLU H . . 3.640 2.555 2.411 2.722 . 0 0 "[ . 1 . 2]" 1
2077 1 139 GLU H 1 139 GLU HB2 . . 3.240 2.185 2.117 2.284 . 0 0 "[ . 1 . 2]" 1
2078 1 139 GLU H 1 139 GLU HB3 . . 3.450 2.820 2.736 2.927 . 0 0 "[ . 1 . 2]" 1
2079 1 139 GLU H 1 139 GLU HG2 . . 5.280 4.316 4.167 4.465 . 0 0 "[ . 1 . 2]" 1
2080 1 139 GLU H 1 139 GLU QG . . 4.860 3.796 3.710 3.871 . 0 0 "[ . 1 . 2]" 1
2081 1 139 GLU H 1 139 GLU HG3 . . 5.280 4.224 4.080 4.409 . 0 0 "[ . 1 . 2]" 1
2082 1 139 GLU H 1 140 ALA H . . 2.770 2.736 2.612 2.793 0.023 10 0 "[ . 1 . 2]" 1
2083 1 139 GLU H 1 140 ALA MB . . 6.530 4.257 4.080 4.355 . 0 0 "[ . 1 . 2]" 1
2084 1 139 GLU HA 1 139 GLU HB2 . . 2.960 2.655 2.610 2.715 . 0 0 "[ . 1 . 2]" 1
2085 1 139 GLU HA 1 139 GLU HG2 . . 3.700 2.326 2.090 2.640 . 0 0 "[ . 1 . 2]" 1
2086 1 139 GLU HA 1 139 GLU QG . . 3.500 2.200 2.067 2.303 . 0 0 "[ . 1 . 2]" 1
2087 1 139 GLU HA 1 139 GLU HG3 . . 3.700 2.917 2.449 3.436 . 0 0 "[ . 1 . 2]" 1
2088 1 139 GLU HA 1 141 ARG H . . 4.970 4.376 4.177 4.712 . 0 0 "[ . 1 . 2]" 1
2089 1 139 GLU HA 1 142 ALA H . . 3.800 3.241 3.155 3.340 . 0 0 "[ . 1 . 2]" 1
2090 1 139 GLU HA 1 142 ALA MB . . 3.920 2.445 2.135 2.608 . 0 0 "[ . 1 . 2]" 1
2091 1 139 GLU HA 1 143 GLN H . . 4.480 4.265 4.007 4.327 . 0 0 "[ . 1 . 2]" 1
2092 1 139 GLU HB2 1 140 ALA H . . 3.520 3.556 3.523 3.625 0.105 6 0 "[ . 1 . 2]" 1
2093 1 139 GLU HB2 1 140 ALA MB . . 6.530 4.983 4.908 5.074 . 0 0 "[ . 1 . 2]" 1
2094 1 139 GLU HB2 1 142 ALA MB . . 6.530 4.730 4.492 4.874 . 0 0 "[ . 1 . 2]" 1
2095 1 139 GLU HB3 1 140 ALA H . . 3.950 2.505 2.439 2.763 . 0 0 "[ . 1 . 2]" 1
2096 1 139 GLU HB3 1 140 ALA MB . . 6.530 3.823 3.709 3.939 . 0 0 "[ . 1 . 2]" 1
2097 1 139 GLU QG 1 140 ALA H . . 5.020 4.202 4.009 4.396 . 0 0 "[ . 1 . 2]" 1
2098 1 139 GLU HG2 1 140 ALA H . . 5.310 4.481 4.220 4.764 . 0 0 "[ . 1 . 2]" 1
2099 1 139 GLU HG3 1 140 ALA H . . 5.310 5.097 5.006 5.281 . 0 0 "[ . 1 . 2]" 1
2100 1 140 ALA H 1 140 ALA HA . . 2.770 2.772 2.757 2.791 0.021 1 0 "[ . 1 . 2]" 1
2101 1 140 ALA H 1 140 ALA MB . . 3.430 2.065 1.935 2.161 . 0 0 "[ . 1 . 2]" 1
2102 1 140 ALA H 1 141 ARG H . . 2.710 2.732 2.703 2.798 0.088 18 0 "[ . 1 . 2]" 1
2103 1 140 ALA H 1 142 ALA MB . . 6.530 4.699 4.444 4.896 . 0 0 "[ . 1 . 2]" 1
2104 1 140 ALA HA 1 142 ALA H . . 5.190 4.273 4.215 4.493 . 0 0 "[ . 1 . 2]" 1
2105 1 140 ALA HA 1 143 GLN H . . 3.330 3.364 3.345 3.414 0.084 18 0 "[ . 1 . 2]" 1
2106 1 140 ALA HA 1 143 GLN HB2 . . 3.610 2.983 2.815 3.052 . 0 0 "[ . 1 . 2]" 1
2107 1 140 ALA HA 1 143 GLN HB3 . . 3.730 3.714 3.553 3.747 0.017 2 0 "[ . 1 . 2]" 1
2108 1 140 ALA HA 1 143 GLN QG . . 5.640 4.926 4.677 5.076 . 0 0 "[ . 1 . 2]" 1
2109 1 140 ALA HA 1 144 GLN H . . 4.290 4.064 3.994 4.110 . 0 0 "[ . 1 . 2]" 1
2110 1 140 ALA MB 1 141 ARG H . . 3.610 2.643 2.439 2.780 . 0 0 "[ . 1 . 2]" 1
2111 1 140 ALA MB 1 141 ARG HA . . 6.530 3.767 3.654 3.836 . 0 0 "[ . 1 . 2]" 1
2112 1 140 ALA MB 1 143 GLN H . . 6.530 4.562 4.533 4.587 . 0 0 "[ . 1 . 2]" 1
2113 1 140 ALA MB 1 144 GLN H . . 6.030 4.488 4.445 4.541 . 0 0 "[ . 1 . 2]" 1
2114 1 141 ARG H 1 141 ARG HB2 . . 2.990 2.027 2.025 2.029 . 0 0 "[ . 1 . 2]" 1
2115 1 141 ARG H 1 141 ARG HB3 . . 3.210 3.249 3.233 3.261 0.051 1 0 "[ . 1 . 2]" 1
2116 1 141 ARG H 1 141 ARG QG . . 4.120 3.336 3.279 3.565 . 0 0 "[ . 1 . 2]" 1
2117 1 141 ARG H 1 142 ALA H . . 2.680 2.633 2.595 2.680 . 9 0 "[ . 1 . 2]" 1
2118 1 141 ARG H 1 142 ALA MB . . 6.530 4.211 4.126 4.253 . 0 0 "[ . 1 . 2]" 1
2119 1 141 ARG HA 1 144 GLN H . . 3.170 3.153 3.114 3.182 0.012 15 0 "[ . 1 . 2]" 1
2120 1 141 ARG HA 1 144 GLN QB . . 3.990 2.168 2.125 2.223 . 0 0 "[ . 1 . 2]" 1
2121 1 141 ARG HA 1 144 GLN HG2 . . 4.940 4.825 4.692 4.988 0.048 3 0 "[ . 1 . 2]" 1
2122 1 141 ARG HA 1 144 GLN QG . . 4.740 4.301 4.190 4.344 . 0 0 "[ . 1 . 2]" 1
2123 1 141 ARG HA 1 144 GLN HG3 . . 4.940 4.850 4.504 4.967 0.027 2 0 "[ . 1 . 2]" 1
2124 1 141 ARG HB2 1 142 ALA H . . 3.360 3.217 3.068 3.256 . 0 0 "[ . 1 . 2]" 1
2125 1 141 ARG HB2 1 143 GLN H . . 5.500 5.418 5.243 5.470 . 0 0 "[ . 1 . 2]" 1
2126 1 141 ARG HB3 1 142 ALA H . . 4.450 3.115 2.905 3.167 . 0 0 "[ . 1 . 2]" 1
2127 1 141 ARG QG 1 142 ALA H . . 6.380 4.558 4.417 4.644 . 0 0 "[ . 1 . 2]" 1
2128 1 142 ALA H 1 142 ALA HA . . 2.800 2.805 2.780 2.812 0.012 18 0 "[ . 1 . 2]" 1
2129 1 142 ALA H 1 142 ALA MB . . 3.430 2.091 1.966 2.164 . 0 0 "[ . 1 . 2]" 1
2130 1 142 ALA H 1 143 GLN H . . 2.650 2.641 2.614 2.696 0.046 9 0 "[ . 1 . 2]" 1
2131 1 142 ALA H 1 144 GLN H . . 4.790 3.852 3.821 3.933 . 0 0 "[ . 1 . 2]" 1
2132 1 142 ALA HA 1 144 GLN H . . 4.910 4.322 4.280 4.348 . 0 0 "[ . 1 . 2]" 1
2133 1 142 ALA HA 1 145 LEU H . . 3.490 3.495 3.414 3.511 0.021 18 0 "[ . 1 . 2]" 1
2134 1 142 ALA HA 1 145 LEU HB2 . . 4.200 3.546 3.172 4.218 0.018 14 0 "[ . 1 . 2]" 1
2135 1 142 ALA HA 1 145 LEU HB3 . . 4.660 3.340 2.817 3.612 . 0 0 "[ . 1 . 2]" 1
2136 1 142 ALA HA 1 146 HIS H . . 4.170 3.892 3.748 4.012 . 0 0 "[ . 1 . 2]" 1
2137 1 142 ALA HA 1 146 HIS HD2 . . 4.320 4.143 3.971 4.342 0.022 5 0 "[ . 1 . 2]" 1
2138 1 142 ALA MB 1 143 GLN H . . 3.610 2.611 2.532 2.718 . 0 0 "[ . 1 . 2]" 1
2139 1 142 ALA MB 1 143 GLN HA . . 6.530 3.814 3.723 3.860 . 0 0 "[ . 1 . 2]" 1
2140 1 142 ALA MB 1 144 GLN H . . 6.530 4.402 4.377 4.429 . 0 0 "[ . 1 . 2]" 1
2141 1 142 ALA MB 1 146 HIS HD2 . . 5.010 3.664 3.285 3.955 . 0 0 "[ . 1 . 2]" 1
2142 1 143 GLN H 1 143 GLN HB2 . . 2.900 2.065 2.053 2.078 . 0 0 "[ . 1 . 2]" 1
2143 1 143 GLN H 1 143 GLN HB3 . . 3.270 3.123 3.102 3.147 . 0 0 "[ . 1 . 2]" 1
2144 1 143 GLN H 1 143 GLN HG2 . . 5.500 4.333 4.071 4.564 . 0 0 "[ . 1 . 2]" 1
2145 1 143 GLN H 1 143 GLN QG . . 4.840 3.557 3.494 3.653 . 0 0 "[ . 1 . 2]" 1
2146 1 143 GLN H 1 143 GLN HG3 . . 5.500 3.789 3.724 3.900 . 0 0 "[ . 1 . 2]" 1
2147 1 143 GLN H 1 144 GLN H . . 2.960 2.483 2.455 2.507 . 0 0 "[ . 1 . 2]" 1
2148 1 143 GLN HA 1 143 GLN HB3 . . 2.930 2.922 2.912 2.931 0.001 1 0 "[ . 1 . 2]" 1
2149 1 143 GLN HA 1 143 GLN HG2 . . 3.300 2.384 2.008 2.887 . 0 0 "[ . 1 . 2]" 1
2150 1 143 GLN HA 1 143 GLN QG . . 2.930 2.090 1.980 2.174 . 0 0 "[ . 1 . 2]" 1
2151 1 143 GLN HA 1 143 GLN HG3 . . 3.300 2.543 2.066 3.010 . 0 0 "[ . 1 . 2]" 1
2152 1 143 GLN HA 1 146 HIS H . . 3.830 3.485 3.370 3.690 . 0 0 "[ . 1 . 2]" 1
2153 1 143 GLN HA 1 147 GLY H . . 4.070 3.412 2.267 3.831 . 0 0 "[ . 1 . 2]" 1
2154 1 143 GLN HA 1 147 GLY QA . . 4.980 4.263 3.012 4.504 . 0 0 "[ . 1 . 2]" 1
2155 1 143 GLN HB2 1 144 GLN H . . 3.450 3.452 3.426 3.471 0.021 16 0 "[ . 1 . 2]" 1
2156 1 143 GLN HB3 1 144 GLN H . . 3.730 3.168 3.147 3.194 . 0 0 "[ . 1 . 2]" 1
2157 1 143 GLN QG 1 144 GLN H . . 5.120 4.546 4.525 4.583 . 0 0 "[ . 1 . 2]" 1
2158 1 143 GLN HG2 1 144 GLN H . . 5.470 5.001 4.948 5.125 . 0 0 "[ . 1 . 2]" 1
2159 1 143 GLN HG3 1 144 GLN H . . 5.470 5.229 5.067 5.368 . 0 0 "[ . 1 . 2]" 1
2160 1 144 GLN H 1 144 GLN QB . . 3.560 2.199 2.175 2.205 . 0 0 "[ . 1 . 2]" 1
2161 1 144 GLN H 1 144 GLN HG2 . . 4.850 4.326 4.319 4.348 . 0 0 "[ . 1 . 2]" 1
2162 1 144 GLN H 1 144 GLN QG . . 4.440 3.945 3.929 3.991 . 0 0 "[ . 1 . 2]" 1
2163 1 144 GLN H 1 144 GLN HG3 . . 4.850 4.551 4.514 4.647 . 0 0 "[ . 1 . 2]" 1
2164 1 144 GLN H 1 145 LEU H . . 2.830 2.555 2.479 2.601 . 0 0 "[ . 1 . 2]" 1
2165 1 144 GLN H 1 146 HIS H . . 4.660 4.306 4.167 4.438 . 0 0 "[ . 1 . 2]" 1
2166 1 144 GLN HA 1 144 GLN HG2 . . 3.420 2.819 2.598 2.974 . 0 0 "[ . 1 . 2]" 1
2167 1 144 GLN HA 1 144 GLN QG . . 2.920 2.539 2.521 2.557 . 0 0 "[ . 1 . 2]" 1
2168 1 144 GLN HA 1 144 GLN HG3 . . 3.420 2.950 2.786 3.439 0.019 3 0 "[ . 1 . 2]" 1
2169 1 144 GLN HA 1 145 LEU H . . 3.640 3.571 3.532 3.589 . 0 0 "[ . 1 . 2]" 1
2170 1 144 GLN HA 1 146 HIS H . . 5.100 4.937 4.744 5.111 0.011 3 0 "[ . 1 . 2]" 1
2171 1 144 GLN HA 1 147 GLY H . . 4.970 3.594 3.415 4.661 . 0 0 "[ . 1 . 2]" 1
2172 1 144 GLN QB 1 145 LEU H . . 4.020 2.822 2.745 2.997 . 0 0 "[ . 1 . 2]" 1
2173 1 144 GLN QB 1 145 LEU HA . . 5.540 4.302 4.277 4.411 . 0 0 "[ . 1 . 2]" 1
2174 1 144 GLN QB 1 146 HIS H . . 6.380 5.086 4.975 5.297 . 0 0 "[ . 1 . 2]" 1
2175 1 144 GLN QG 1 145 LEU H . . 5.050 3.810 3.650 4.071 . 0 0 "[ . 1 . 2]" 1
2176 1 144 GLN QG 1 147 GLY QA . . 7.260 4.834 4.514 5.473 . 0 0 "[ . 1 . 2]" 1
2177 1 144 GLN HG2 1 145 LEU H . . 5.280 3.942 3.764 4.248 . 0 0 "[ . 1 . 2]" 1
2178 1 144 GLN HG2 1 145 LEU HA . . 5.500 3.726 3.546 4.069 . 0 0 "[ . 1 . 2]" 1
2179 1 144 GLN HG3 1 145 LEU H . . 5.280 5.049 4.912 5.216 . 0 0 "[ . 1 . 2]" 1
2180 1 144 GLN HG3 1 145 LEU HA . . 5.500 5.382 5.215 5.508 0.008 3 0 "[ . 1 . 2]" 1
2181 1 145 LEU H 1 145 LEU HB2 . . 3.110 2.312 2.152 2.861 . 0 0 "[ . 1 . 2]" 1
2182 1 145 LEU H 1 145 LEU HB3 . . 2.830 2.699 2.168 2.860 0.030 9 0 "[ . 1 . 2]" 1
2183 1 145 LEU H 1 145 LEU HG . . 4.170 4.178 4.151 4.208 0.038 9 0 "[ . 1 . 2]" 1
2184 1 145 LEU H 1 146 HIS H . . 2.830 2.586 2.511 2.705 . 0 0 "[ . 1 . 2]" 1
2185 1 145 LEU H 1 147 GLY H . . 4.350 3.572 3.365 3.974 . 0 0 "[ . 1 . 2]" 1
2186 1 145 LEU HB2 1 146 HIS H . . 3.950 3.554 3.362 3.968 0.018 1 0 "[ . 1 . 2]" 1
2187 1 145 LEU HB3 1 146 HIS H . . 3.330 2.491 2.316 2.590 . 0 0 "[ . 1 . 2]" 1
2188 1 145 LEU HG 1 146 HIS H . . 5.500 4.556 3.008 5.032 . 0 0 "[ . 1 . 2]" 1
2189 1 146 HIS H 1 146 HIS HA . . 2.870 2.807 2.793 2.864 . 0 0 "[ . 1 . 2]" 1
2190 1 146 HIS H 1 146 HIS HB2 . . 3.360 2.205 2.048 3.478 0.118 3 0 "[ . 1 . 2]" 1
2191 1 146 HIS H 1 146 HIS QB . . 3.120 2.058 2.031 2.172 . 0 0 "[ . 1 . 2]" 1
2192 1 146 HIS H 1 146 HIS HB3 . . 3.360 3.248 2.160 3.405 0.045 18 0 "[ . 1 . 2]" 1
2193 1 146 HIS H 1 146 HIS HD2 . . 5.500 3.480 3.082 3.861 . 0 0 "[ . 1 . 2]" 1
2194 1 146 HIS H 1 147 GLY H . . 2.590 2.574 2.492 2.604 0.014 17 0 "[ . 1 . 2]" 1
2195 1 146 HIS H 1 147 GLY QA . . 5.170 4.392 4.243 4.445 . 0 0 "[ . 1 . 2]" 1
2196 1 146 HIS HA 1 146 HIS HB2 . . 3.020 2.875 2.239 2.968 . 0 0 "[ . 1 . 2]" 1
2197 1 146 HIS HA 1 146 HIS HB3 . . 3.020 2.747 2.689 2.770 . 0 0 "[ . 1 . 2]" 1
2198 1 146 HIS HA 1 147 GLY H . . 3.550 3.540 3.381 3.640 0.090 3 0 "[ . 1 . 2]" 1
2199 1 146 HIS QB 1 147 GLY H . . 5.020 3.037 2.836 3.789 . 0 0 "[ . 1 . 2]" 1
2200 1 146 HIS HB2 1 147 GLY H . . 5.500 3.328 3.061 4.566 . 0 0 "[ . 1 . 2]" 1
2201 1 146 HIS HB3 1 147 GLY H . . 5.500 3.545 3.328 4.047 . 0 0 "[ . 1 . 2]" 1
2202 1 147 GLY H 1 148 ALA H . . 3.080 2.969 2.847 3.090 0.010 19 0 "[ . 1 . 2]" 1
2203 1 148 ALA H 1 148 ALA HA . . 2.770 2.647 2.212 2.820 0.050 3 0 "[ . 1 . 2]" 1
2204 1 148 ALA H 1 148 ALA MB . . 3.430 2.449 1.989 2.893 . 0 0 "[ . 1 . 2]" 1
stop_
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