NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
619639 |
5kqc   |
30131 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5kqc
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 2836
_Distance_constraint_stats_list.Viol_count 3962
_Distance_constraint_stats_list.Viol_total 2673.576
_Distance_constraint_stats_list.Viol_max 0.953
_Distance_constraint_stats_list.Viol_rms 0.0284
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.0450
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 4 TRP 0.323 0.108 2 0 "[ . 1 .]"
1 5 GLU 0.119 0.086 10 0 "[ . 1 .]"
1 6 ASP 0.328 0.140 14 0 "[ . 1 .]"
1 7 PHE 0.616 0.140 14 0 "[ . 1 .]"
1 8 PHE 0.501 0.120 9 0 "[ . 1 .]"
1 9 ARG 0.288 0.064 14 0 "[ . 1 .]"
1 11 SER 0.684 0.106 5 0 "[ . 1 .]"
1 12 ARG 0.298 0.069 1 0 "[ . 1 .]"
1 13 ILE 2.985 0.088 5 0 "[ . 1 .]"
1 14 THR 0.836 0.073 15 0 "[ . 1 .]"
1 15 GLU 0.478 0.073 15 0 "[ . 1 .]"
1 16 THR 1.957 0.111 10 0 "[ . 1 .]"
1 17 PHE 2.747 0.109 13 0 "[ . 1 .]"
1 18 GLY 0.017 0.017 12 0 "[ . 1 .]"
1 19 LYS 0.303 0.045 2 0 "[ . 1 .]"
1 20 TYR 0.770 0.109 9 0 "[ . 1 .]"
1 21 GLN 0.000 0.000 . 0 "[ . 1 .]"
1 23 SER 0.000 0.000 6 0 "[ . 1 .]"
1 24 PRO 0.000 0.000 . 0 "[ . 1 .]"
1 26 ASP 0.065 0.034 10 0 "[ . 1 .]"
1 27 GLY 0.198 0.096 8 0 "[ . 1 .]"
1 28 LYS 1.333 0.109 9 0 "[ . 1 .]"
1 29 HIS 1.134 0.083 14 0 "[ . 1 .]"
1 30 TYR 1.442 0.132 7 0 "[ . 1 .]"
1 31 GLY 0.847 0.076 3 0 "[ . 1 .]"
1 32 ILE 1.839 0.074 10 0 "[ . 1 .]"
1 33 ASP 0.848 0.086 7 0 "[ . 1 .]"
1 34 PHE 2.347 0.290 5 0 "[ . 1 .]"
1 35 ALA 1.034 0.088 5 0 "[ . 1 .]"
1 36 LEU 6.525 0.799 10 1 "[ . + .]"
1 37 PRO 0.754 0.062 9 0 "[ . 1 .]"
1 38 LYS 1.864 0.093 9 0 "[ . 1 .]"
1 39 GLY 1.959 0.093 9 0 "[ . 1 .]"
1 40 THR 3.920 0.119 2 0 "[ . 1 .]"
1 41 PRO 3.368 0.119 2 0 "[ . 1 .]"
1 42 ILE 0.481 0.044 7 0 "[ . 1 .]"
1 43 LYS 4.322 0.149 14 0 "[ . 1 .]"
1 44 ALA 0.893 0.062 9 0 "[ . 1 .]"
1 45 PRO 2.599 0.128 11 0 "[ . 1 .]"
1 46 THR 1.361 0.051 11 0 "[ . 1 .]"
1 47 ASN 2.113 0.159 13 0 "[ . 1 .]"
1 48 GLY 2.259 0.105 6 0 "[ . 1 .]"
1 49 LYS 2.051 0.095 4 0 "[ . 1 .]"
1 50 VAL 4.399 0.135 6 0 "[ . 1 .]"
1 51 THR 0.710 0.072 4 0 "[ . 1 .]"
1 52 ARG 3.393 0.375 14 0 "[ . 1 .]"
1 53 ILE 34.593 0.953 9 12 "[* *-****+** * *]"
1 54 PHE 0.136 0.026 14 0 "[ . 1 .]"
1 55 ASN 1.089 0.092 2 0 "[ . 1 .]"
1 56 ASN 0.781 0.092 2 0 "[ . 1 .]"
1 58 LEU 0.303 0.303 10 0 "[ . 1 .]"
1 59 GLY 0.159 0.060 13 0 "[ . 1 .]"
1 60 GLY 0.253 0.082 4 0 "[ . 1 .]"
1 61 LYS 0.691 0.055 3 0 "[ . 1 .]"
1 62 VAL 0.339 0.041 13 0 "[ . 1 .]"
1 63 LEU 2.547 0.080 11 0 "[ . 1 .]"
1 64 GLN 1.739 0.093 12 0 "[ . 1 .]"
1 65 ILE 2.077 0.090 14 0 "[ . 1 .]"
1 66 ALA 0.158 0.024 9 0 "[ . 1 .]"
1 67 GLU 1.531 0.090 14 0 "[ . 1 .]"
1 68 ASP 0.029 0.023 9 0 "[ . 1 .]"
1 69 ASN 0.144 0.054 12 0 "[ . 1 .]"
1 70 GLY 0.610 0.105 8 0 "[ . 1 .]"
1 71 GLU 3.054 0.143 13 0 "[ . 1 .]"
1 72 TYR 3.652 0.143 13 0 "[ . 1 .]"
1 73 HIS 1.483 0.258 11 0 "[ . 1 .]"
1 74 GLN 1.208 0.054 7 0 "[ . 1 .]"
1 75 TRP 4.835 0.509 10 1 "[ . + .]"
1 76 TYR 2.026 0.080 11 0 "[ . 1 .]"
1 77 LEU 2.410 0.374 14 0 "[ . 1 .]"
1 78 HIS 1.079 0.374 14 0 "[ . 1 .]"
1 79 LEU 9.654 0.655 11 5 "[ **. - *+ .]"
1 80 ASP 4.203 0.222 8 0 "[ . 1 .]"
1 81 LYS 4.394 0.116 14 0 "[ . 1 .]"
1 82 TYR 1.904 0.080 9 0 "[ . 1 .]"
1 83 ASN 1.437 0.053 13 0 "[ . 1 .]"
1 84 VAL 3.304 0.089 3 0 "[ . 1 .]"
1 85 LYS 3.523 0.135 6 0 "[ . 1 .]"
1 86 VAL 38.907 0.953 9 12 "[* *-****+** * *]"
1 87 GLY 2.357 0.281 12 0 "[ . 1 .]"
1 88 ASP 1.447 0.103 13 0 "[ . 1 .]"
1 89 ARG 1.463 0.105 9 0 "[ . 1 .]"
1 90 VAL 5.596 0.131 11 0 "[ . 1 .]"
1 91 LYS 5.538 0.159 13 0 "[ . 1 .]"
1 92 ALA 1.848 0.105 6 0 "[ . 1 .]"
1 93 GLY 1.394 0.120 14 0 "[ . 1 .]"
1 94 ASP 5.234 0.173 14 0 "[ . 1 .]"
1 95 ILE 3.532 0.108 12 0 "[ . 1 .]"
1 96 ILE 2.132 0.065 9 0 "[ . 1 .]"
1 97 ALA 4.248 0.116 14 0 "[ . 1 .]"
1 98 TYR 5.150 0.105 10 0 "[ . 1 .]"
1 99 SER 4.612 0.655 11 5 "[ **. - *+ .]"
1 100 GLY 4.809 0.539 3 1 "[ + . 1 .]"
1 101 ASN 0.837 0.094 15 0 "[ . 1 .]"
1 102 THR 0.934 0.112 7 0 "[ . 1 .]"
1 104 ILE 0.388 0.046 9 0 "[ . 1 .]"
1 106 THR 0.004 0.004 11 0 "[ . 1 .]"
1 107 THR 0.034 0.034 9 0 "[ . 1 .]"
1 108 GLY 0.034 0.034 9 0 "[ . 1 .]"
1 109 ALA 0.688 0.059 1 0 "[ . 1 .]"
1 110 HIS 1.269 0.086 7 0 "[ . 1 .]"
1 111 LEU 1.072 0.102 13 0 "[ . 1 .]"
1 112 HIS 2.677 0.132 7 0 "[ . 1 .]"
1 113 PHE 1.399 0.047 4 0 "[ . 1 .]"
1 114 GLN 0.928 0.075 13 0 "[ . 1 .]"
1 115 ARG 0.669 0.054 7 0 "[ . 1 .]"
1 116 MET 1.405 0.077 14 0 "[ . 1 .]"
1 117 LYS 1.239 0.073 9 0 "[ . 1 .]"
1 118 GLY 0.768 0.073 10 0 "[ . 1 .]"
1 119 GLY 0.853 0.054 15 0 "[ . 1 .]"
1 120 VAL 4.504 0.509 10 1 "[ . + .]"
1 121 GLY 0.265 0.047 5 0 "[ . 1 .]"
1 122 ASN 0.061 0.028 11 0 "[ . 1 .]"
1 123 ALA 0.357 0.050 15 0 "[ . 1 .]"
1 124 TYR 1.819 0.077 14 0 "[ . 1 .]"
1 125 ALA 0.451 0.071 13 0 "[ . 1 .]"
1 126 GLU 1.728 0.147 1 0 "[ . 1 .]"
1 127 ASP 3.383 0.147 1 0 "[ . 1 .]"
1 128 PRO 3.899 0.109 9 0 "[ . 1 .]"
1 129 LYS 3.275 0.111 10 0 "[ . 1 .]"
1 130 PRO 3.099 0.094 13 0 "[ . 1 .]"
1 131 PHE 2.507 0.081 9 0 "[ . 1 .]"
1 132 ILE 4.418 0.156 8 0 "[ . 1 .]"
1 133 ASP 1.196 0.079 15 0 "[ . 1 .]"
1 134 GLN 2.244 0.081 9 0 "[ . 1 .]"
1 135 LEU 3.554 0.068 8 0 "[ . 1 .]"
1 136 PRO 1.538 0.057 9 0 "[ . 1 .]"
1 137 ASP 1.757 0.083 1 0 "[ . 1 .]"
1 138 GLY 1.395 0.075 5 0 "[ . 1 .]"
1 139 GLU 2.589 0.163 3 0 "[ . 1 .]"
1 140 ARG 2.461 0.097 11 0 "[ . 1 .]"
1 141 SER 3.819 0.124 5 0 "[ . 1 .]"
1 142 LEU 2.310 0.290 5 0 "[ . 1 .]"
1 143 TYR 2.228 0.101 5 0 "[ . 1 .]"
1 144 ASP 5.528 0.290 11 0 "[ . 1 .]"
1 145 LEU 13.410 0.799 10 1 "[ . + .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 TRP H 1 4 TRP HB2 . . 4.210 2.984 2.315 3.707 . 0 0 "[ . 1 .]" 1
2 1 4 TRP H 1 4 TRP QB . . 3.610 2.654 2.216 3.438 . 0 0 "[ . 1 .]" 1
3 1 4 TRP H 1 4 TRP HB3 . . 4.210 3.362 2.485 4.068 . 0 0 "[ . 1 .]" 1
4 1 4 TRP HA 1 4 TRP HD1 . . 4.510 4.064 3.134 4.570 0.060 4 0 "[ . 1 .]" 1
5 1 4 TRP HA 1 4 TRP HE3 . . 4.270 3.530 2.676 4.378 0.108 2 0 "[ . 1 .]" 1
6 1 4 TRP QB 1 4 TRP HD1 . . 3.350 2.588 2.477 2.640 . 0 0 "[ . 1 .]" 1
7 1 4 TRP QB 1 4 TRP HE3 . . 3.590 2.692 2.581 2.886 . 0 0 "[ . 1 .]" 1
8 1 5 GLU H 1 5 GLU QB . . 3.670 2.571 2.165 3.359 . 0 0 "[ . 1 .]" 1
9 1 5 GLU H 1 5 GLU QG . . 4.450 3.192 1.914 4.072 . 0 0 "[ . 1 .]" 1
10 1 5 GLU HA 1 6 ASP H . . 3.550 2.551 2.119 3.497 . 0 0 "[ . 1 .]" 1
11 1 5 GLU QB 1 6 ASP H . . 3.870 3.356 2.450 3.956 0.086 10 0 "[ . 1 .]" 1
12 1 5 GLU HB2 1 6 ASP H . . 4.610 3.877 2.485 4.416 . 0 0 "[ . 1 .]" 1
13 1 5 GLU HB3 1 6 ASP H . . 4.610 3.911 2.495 4.505 . 0 0 "[ . 1 .]" 1
14 1 6 ASP H 1 6 ASP QB . . 3.390 2.732 2.177 3.366 . 0 0 "[ . 1 .]" 1
15 1 6 ASP HA 1 7 PHE H . . 3.210 2.426 2.073 3.243 0.033 3 0 "[ . 1 .]" 1
16 1 6 ASP QB 1 7 PHE H . . 3.820 3.109 2.158 3.960 0.140 14 0 "[ . 1 .]" 1
17 1 7 PHE H 1 7 PHE QB . . 3.050 2.571 2.175 3.076 0.026 5 0 "[ . 1 .]" 1
18 1 7 PHE H 1 8 PHE H . . 4.290 3.309 2.101 4.410 0.120 9 0 "[ . 1 .]" 1
19 1 7 PHE HA 1 7 PHE QD . . 4.110 2.862 2.259 3.723 . 0 0 "[ . 1 .]" 1
20 1 7 PHE HA 1 8 PHE H . . 3.400 2.851 2.177 3.456 0.056 3 0 "[ . 1 .]" 1
21 1 7 PHE QB 1 8 PHE H . . 4.090 3.505 2.408 4.060 . 0 0 "[ . 1 .]" 1
22 1 8 PHE H 1 8 PHE QB . . 3.400 2.362 2.182 3.304 . 0 0 "[ . 1 .]" 1
23 1 8 PHE H 1 8 PHE QD . . 4.720 3.975 2.471 4.251 . 0 0 "[ . 1 .]" 1
24 1 8 PHE HA 1 8 PHE QD . . 4.030 2.927 2.506 3.745 . 0 0 "[ . 1 .]" 1
25 1 8 PHE QB 1 9 ARG H . . 4.440 3.567 3.223 3.782 . 0 0 "[ . 1 .]" 1
26 1 8 PHE QD 1 9 ARG QD . . 4.760 4.535 3.216 4.813 0.053 4 0 "[ . 1 .]" 1
27 1 8 PHE QE 1 9 ARG QB . . 5.340 4.165 2.993 5.093 . 0 0 "[ . 1 .]" 1
28 1 9 ARG H 1 9 ARG HB2 . . 4.110 2.625 2.129 3.631 . 0 0 "[ . 1 .]" 1
29 1 9 ARG H 1 9 ARG QB . . 3.480 2.390 2.110 3.403 . 0 0 "[ . 1 .]" 1
30 1 9 ARG H 1 9 ARG HB3 . . 4.110 3.296 2.377 4.109 . 0 0 "[ . 1 .]" 1
31 1 9 ARG H 1 9 ARG QD . . 4.310 3.127 2.225 4.280 . 0 0 "[ . 1 .]" 1
32 1 9 ARG HA 1 9 ARG QD . . 3.860 2.975 2.221 3.924 0.064 14 0 "[ . 1 .]" 1
33 1 9 ARG HA 1 9 ARG QG . . 3.660 2.789 2.194 3.546 . 0 0 "[ . 1 .]" 1
34 1 9 ARG QB 1 9 ARG QD . . 3.250 2.468 2.075 3.002 . 0 0 "[ . 1 .]" 1
35 1 9 ARG QB 1 9 ARG HE . . 4.240 3.692 2.343 4.203 . 0 0 "[ . 1 .]" 1
36 1 9 ARG HB2 1 9 ARG QD . . 3.890 2.796 2.235 3.596 . 0 0 "[ . 1 .]" 1
37 1 9 ARG HB3 1 9 ARG QD . . 3.890 3.013 2.325 3.447 . 0 0 "[ . 1 .]" 1
38 1 11 SER H 1 11 SER HB2 . . 4.100 3.328 2.232 4.089 . 0 0 "[ . 1 .]" 1
39 1 11 SER H 1 11 SER HB3 . . 4.100 3.165 2.431 3.660 . 0 0 "[ . 1 .]" 1
40 1 11 SER HA 1 12 ARG H . . 3.440 2.306 2.083 3.421 . 0 0 "[ . 1 .]" 1
41 1 11 SER HA 1 13 ILE HB . . 5.500 5.190 4.725 5.584 0.084 12 0 "[ . 1 .]" 1
42 1 11 SER HA 1 139 GLU HG2 . . 4.430 4.017 3.470 4.497 0.067 4 0 "[ . 1 .]" 1
43 1 11 SER HA 1 139 GLU HG3 . . 4.420 4.096 2.668 4.526 0.106 5 0 "[ . 1 .]" 1
44 1 11 SER QB 1 12 ARG H . . 4.280 3.044 2.226 3.802 . 0 0 "[ . 1 .]" 1
45 1 11 SER QB 1 12 ARG QG . . 5.340 4.917 4.290 5.348 0.008 9 0 "[ . 1 .]" 1
46 1 11 SER QB 1 13 ILE HB . . 4.500 3.625 2.386 4.499 . 0 0 "[ . 1 .]" 1
47 1 11 SER HB2 1 12 ARG H . . 4.900 3.423 2.244 4.212 . 0 0 "[ . 1 .]" 1
48 1 11 SER HB3 1 12 ARG H . . 4.900 3.818 2.824 4.328 . 0 0 "[ . 1 .]" 1
49 1 12 ARG H 1 12 ARG QG . . 3.980 2.840 2.380 3.746 . 0 0 "[ . 1 .]" 1
50 1 12 ARG H 1 13 ILE H . . 4.140 2.650 2.040 2.972 . 0 0 "[ . 1 .]" 1
51 1 12 ARG HA 1 13 ILE HB . . 5.500 5.270 5.019 5.426 . 0 0 "[ . 1 .]" 1
52 1 12 ARG QB 1 12 ARG QD . . 3.280 2.304 2.118 2.534 . 0 0 "[ . 1 .]" 1
53 1 12 ARG QB 1 34 PHE QD . . 4.770 3.294 2.571 4.784 0.014 5 0 "[ . 1 .]" 1
54 1 12 ARG QB 1 35 ALA H . . 3.940 2.974 2.526 3.399 . 0 0 "[ . 1 .]" 1
55 1 12 ARG QB 1 36 LEU QD . . 4.150 2.961 2.683 3.985 . 0 0 "[ . 1 .]" 1
56 1 12 ARG HB2 1 35 ALA H . . 4.580 3.875 3.133 4.343 . 0 0 "[ . 1 .]" 1
57 1 12 ARG HB3 1 35 ALA H . . 4.580 3.180 2.590 4.613 0.033 5 0 "[ . 1 .]" 1
58 1 12 ARG QD 1 36 LEU QD . . 3.290 2.614 2.065 3.248 . 0 0 "[ . 1 .]" 1
59 1 12 ARG QD 1 143 TYR QE . . 4.060 2.988 2.286 3.934 . 0 0 "[ . 1 .]" 1
60 1 12 ARG QD 1 145 LEU QD . . 3.300 2.302 2.020 2.656 . 0 0 "[ . 1 .]" 1
61 1 12 ARG HD2 1 143 TYR QE . . 4.650 3.333 2.472 4.684 0.034 3 0 "[ . 1 .]" 1
62 1 12 ARG HD3 1 143 TYR QE . . 4.650 3.781 2.346 4.719 0.069 1 0 "[ . 1 .]" 1
63 1 12 ARG QG 1 36 LEU QD . . 4.510 3.423 2.249 4.311 . 0 0 "[ . 1 .]" 1
64 1 13 ILE H 1 13 ILE MD . . 4.750 4.311 4.019 4.553 . 0 0 "[ . 1 .]" 1
65 1 13 ILE H 1 13 ILE HG12 . . 4.820 4.537 3.870 4.702 . 0 0 "[ . 1 .]" 1
66 1 13 ILE H 1 13 ILE QG . . 4.220 3.789 2.766 4.069 . 0 0 "[ . 1 .]" 1
67 1 13 ILE H 1 13 ILE HG13 . . 4.820 4.081 2.832 4.478 . 0 0 "[ . 1 .]" 1
68 1 13 ILE H 1 13 ILE MG . . 4.700 2.646 2.356 3.602 . 0 0 "[ . 1 .]" 1
69 1 13 ILE HA 1 13 ILE MD . . 3.950 3.693 3.620 3.760 . 0 0 "[ . 1 .]" 1
70 1 13 ILE HA 1 13 ILE HG12 . . 3.710 2.793 2.116 2.962 . 0 0 "[ . 1 .]" 1
71 1 13 ILE HA 1 13 ILE HG13 . . 3.710 2.291 2.172 2.604 . 0 0 "[ . 1 .]" 1
72 1 13 ILE HA 1 13 ILE MG . . 3.350 3.201 2.909 3.264 . 0 0 "[ . 1 .]" 1
73 1 13 ILE HA 1 14 THR H . . 3.110 2.194 2.105 2.317 . 0 0 "[ . 1 .]" 1
74 1 13 ILE HA 1 14 THR MG . . 4.110 3.431 3.321 3.710 . 0 0 "[ . 1 .]" 1
75 1 13 ILE HA 1 16 THR MG . . 5.230 5.234 5.033 5.284 0.054 9 0 "[ . 1 .]" 1
76 1 13 ILE HA 1 34 PHE HA . . 3.690 2.371 2.243 2.517 . 0 0 "[ . 1 .]" 1
77 1 13 ILE HA 1 34 PHE QD . . 4.360 2.561 2.372 2.891 . 0 0 "[ . 1 .]" 1
78 1 13 ILE HA 1 35 ALA H . . 4.530 3.363 3.281 3.494 . 0 0 "[ . 1 .]" 1
79 1 13 ILE HA 1 35 ALA MB . . 4.360 4.419 4.376 4.448 0.088 5 0 "[ . 1 .]" 1
80 1 13 ILE HB 1 13 ILE MD . . 2.880 2.433 2.364 2.574 . 0 0 "[ . 1 .]" 1
81 1 13 ILE HB 1 14 THR H . . 4.360 4.162 4.028 4.211 . 0 0 "[ . 1 .]" 1
82 1 13 ILE HB 1 16 THR MG . . 4.510 4.318 4.010 4.443 . 0 0 "[ . 1 .]" 1
83 1 13 ILE HB 1 34 PHE QD . . 5.110 3.430 2.955 4.594 . 0 0 "[ . 1 .]" 1
84 1 13 ILE HB 1 34 PHE QE . . 4.660 3.261 2.715 4.664 0.004 13 0 "[ . 1 .]" 1
85 1 13 ILE MD 1 14 THR H . . 4.060 4.089 4.042 4.122 0.062 13 0 "[ . 1 .]" 1
86 1 13 ILE MD 1 16 THR HB . . 3.380 2.970 2.784 3.400 0.020 13 0 "[ . 1 .]" 1
87 1 13 ILE MD 1 34 PHE QE . . 3.300 2.851 2.725 3.193 . 0 0 "[ . 1 .]" 1
88 1 13 ILE QG 1 13 ILE MG . . 3.140 2.333 2.284 2.482 . 0 0 "[ . 1 .]" 1
89 1 13 ILE QG 1 14 THR H . . 3.630 2.435 2.273 2.984 . 0 0 "[ . 1 .]" 1
90 1 13 ILE QG 1 15 GLU H . . 4.750 3.112 2.612 4.323 . 0 0 "[ . 1 .]" 1
91 1 13 ILE QG 1 32 ILE MD . . 4.260 3.788 3.688 3.926 . 0 0 "[ . 1 .]" 1
92 1 13 ILE QG 1 32 ILE MG . . 3.990 2.354 2.246 2.539 . 0 0 "[ . 1 .]" 1
93 1 13 ILE QG 1 34 PHE H . . 5.340 4.850 4.690 4.954 . 0 0 "[ . 1 .]" 1
94 1 13 ILE QG 1 34 PHE QD . . 4.010 2.985 2.539 3.147 . 0 0 "[ . 1 .]" 1
95 1 13 ILE QG 1 34 PHE QE . . 4.130 3.067 2.312 3.377 . 0 0 "[ . 1 .]" 1
96 1 13 ILE HG12 1 14 THR H . . 4.220 2.560 2.353 3.048 . 0 0 "[ . 1 .]" 1
97 1 13 ILE HG12 1 34 PHE QD . . 4.560 4.401 3.162 4.601 0.041 15 0 "[ . 1 .]" 1
98 1 13 ILE HG12 1 34 PHE QE . . 4.850 4.564 3.292 4.879 0.029 11 0 "[ . 1 .]" 1
99 1 13 ILE HG13 1 14 THR H . . 4.220 3.097 2.808 4.264 0.044 9 0 "[ . 1 .]" 1
100 1 13 ILE HG13 1 34 PHE QD . . 4.560 3.044 2.675 3.204 . 0 0 "[ . 1 .]" 1
101 1 13 ILE HG13 1 34 PHE QE . . 4.850 3.117 2.361 3.446 . 0 0 "[ . 1 .]" 1
102 1 13 ILE MG 1 14 THR H . . 3.600 3.327 2.274 3.619 0.019 5 0 "[ . 1 .]" 1
103 1 13 ILE MG 1 15 GLU H . . 4.790 4.083 2.690 4.800 0.010 1 0 "[ . 1 .]" 1
104 1 13 ILE MG 1 16 THR HB . . 4.370 4.394 4.203 4.434 0.064 4 0 "[ . 1 .]" 1
105 1 13 ILE MG 1 16 THR MG . . 2.690 2.400 2.061 2.542 . 0 0 "[ . 1 .]" 1
106 1 13 ILE MG 1 34 PHE QD . . 4.830 4.639 4.397 4.852 0.022 9 0 "[ . 1 .]" 1
107 1 14 THR H 1 14 THR MG . . 3.950 2.592 2.420 2.813 . 0 0 "[ . 1 .]" 1
108 1 14 THR H 1 15 GLU H . . 4.250 2.246 2.054 2.645 . 0 0 "[ . 1 .]" 1
109 1 14 THR H 1 33 ASP HB2 . . 4.830 3.733 3.497 3.889 . 0 0 "[ . 1 .]" 1
110 1 14 THR H 1 33 ASP HB3 . . 5.330 4.342 4.141 4.569 . 0 0 "[ . 1 .]" 1
111 1 14 THR H 1 34 PHE HA . . 4.100 3.203 3.112 3.340 . 0 0 "[ . 1 .]" 1
112 1 14 THR HA 1 14 THR MG . . 3.090 2.540 2.418 2.620 . 0 0 "[ . 1 .]" 1
113 1 14 THR HB 1 15 GLU H . . 4.520 3.814 3.067 4.160 . 0 0 "[ . 1 .]" 1
114 1 14 THR HB 1 15 GLU QB . . 5.160 4.973 4.256 5.233 0.073 15 0 "[ . 1 .]" 1
115 1 14 THR HB 1 15 GLU QG . . 4.870 4.078 3.243 4.913 0.043 7 0 "[ . 1 .]" 1
116 1 14 THR HB 1 35 ALA MB . . 4.610 4.343 4.196 4.467 . 0 0 "[ . 1 .]" 1
117 1 14 THR MG 1 15 GLU H . . 4.310 3.683 3.528 3.829 . 0 0 "[ . 1 .]" 1
118 1 14 THR MG 1 33 ASP HB2 . . 4.800 4.077 3.820 4.396 . 0 0 "[ . 1 .]" 1
119 1 14 THR MG 1 33 ASP HB3 . . 5.010 3.759 3.414 4.173 . 0 0 "[ . 1 .]" 1
120 1 14 THR MG 1 35 ALA H . . 4.040 2.527 2.340 2.796 . 0 0 "[ . 1 .]" 1
121 1 14 THR MG 1 35 ALA HA . . 3.270 3.070 2.902 3.261 . 0 0 "[ . 1 .]" 1
122 1 14 THR MG 1 35 ALA MB . . 2.710 2.032 1.980 2.090 . 0 0 "[ . 1 .]" 1
123 1 14 THR MG 1 110 HIS HD2 . . 5.500 5.229 4.837 5.523 0.023 1 0 "[ . 1 .]" 1
124 1 15 GLU H 1 15 GLU QB . . 3.450 2.634 2.253 2.800 . 0 0 "[ . 1 .]" 1
125 1 15 GLU H 1 32 ILE MG . . 5.500 4.610 4.255 5.322 . 0 0 "[ . 1 .]" 1
126 1 15 GLU H 1 33 ASP H . . 4.750 3.043 2.770 3.503 . 0 0 "[ . 1 .]" 1
127 1 15 GLU H 1 33 ASP HB2 . . 4.300 2.415 2.060 2.854 . 0 0 "[ . 1 .]" 1
128 1 15 GLU H 1 33 ASP HB3 . . 4.620 3.781 3.365 4.205 . 0 0 "[ . 1 .]" 1
129 1 15 GLU QB 1 20 TYR QD . . 4.880 3.507 2.733 4.159 . 0 0 "[ . 1 .]" 1
130 1 15 GLU QB 1 29 HIS HE1 . . 4.090 2.994 2.446 3.840 . 0 0 "[ . 1 .]" 1
131 1 15 GLU QB 1 33 ASP H . . 4.420 3.398 2.962 3.826 . 0 0 "[ . 1 .]" 1
132 1 15 GLU QB 1 33 ASP HB3 . . 4.420 3.971 3.561 4.296 . 0 0 "[ . 1 .]" 1
133 1 15 GLU HB2 1 29 HIS HE1 . . 4.810 3.266 2.531 4.125 . 0 0 "[ . 1 .]" 1
134 1 15 GLU HB2 1 33 ASP HB2 . . 4.350 2.443 2.259 2.829 . 0 0 "[ . 1 .]" 1
135 1 15 GLU HB3 1 29 HIS HE1 . . 4.810 3.583 2.823 4.859 0.049 12 0 "[ . 1 .]" 1
136 1 15 GLU HB3 1 33 ASP HB2 . . 4.350 4.096 3.505 4.382 0.032 8 0 "[ . 1 .]" 1
137 1 15 GLU QG 1 20 TYR HA . . 4.820 4.002 2.913 4.834 0.014 12 0 "[ . 1 .]" 1
138 1 15 GLU QG 1 20 TYR QE . . 4.970 2.699 2.202 3.879 . 0 0 "[ . 1 .]" 1
139 1 15 GLU HG2 1 20 TYR QD . . 4.540 3.797 2.811 4.569 0.029 5 0 "[ . 1 .]" 1
140 1 15 GLU HG3 1 20 TYR QD . . 4.540 3.392 2.403 4.598 0.058 10 0 "[ . 1 .]" 1
141 1 16 THR H 1 16 THR MG . . 3.750 2.289 2.149 2.471 . 0 0 "[ . 1 .]" 1
142 1 16 THR HB 1 17 PHE H . . 3.340 2.469 2.289 2.658 . 0 0 "[ . 1 .]" 1
143 1 16 THR HB 1 17 PHE HB3 . . 4.940 4.635 4.389 4.814 . 0 0 "[ . 1 .]" 1
144 1 16 THR HB 1 32 ILE MD . . 3.540 3.223 2.643 3.548 0.008 15 0 "[ . 1 .]" 1
145 1 16 THR HB 1 129 LYS HB2 . . 5.110 4.111 3.559 4.751 . 0 0 "[ . 1 .]" 1
146 1 16 THR HB 1 129 LYS QD . . 4.600 4.666 4.618 4.711 0.111 10 0 "[ . 1 .]" 1
147 1 16 THR HB 1 129 LYS HG2 . . 4.360 3.793 2.766 4.386 0.026 5 0 "[ . 1 .]" 1
148 1 16 THR HB 1 129 LYS HG3 . . 4.360 3.056 2.665 3.823 . 0 0 "[ . 1 .]" 1
149 1 16 THR MG 1 17 PHE H . . 4.070 3.958 3.852 4.091 0.021 12 0 "[ . 1 .]" 1
150 1 16 THR MG 1 32 ILE MD . . 4.650 3.910 3.285 4.151 . 0 0 "[ . 1 .]" 1
151 1 16 THR MG 1 32 ILE HG12 . . 4.420 3.996 3.083 4.321 . 0 0 "[ . 1 .]" 1
152 1 17 PHE H 1 17 PHE HB2 . . 4.030 2.563 2.313 2.826 . 0 0 "[ . 1 .]" 1
153 1 17 PHE H 1 17 PHE HB3 . . 4.070 2.398 2.329 2.508 . 0 0 "[ . 1 .]" 1
154 1 17 PHE H 1 17 PHE QD . . 5.150 4.175 4.104 4.225 . 0 0 "[ . 1 .]" 1
155 1 17 PHE H 1 32 ILE MD . . 4.370 3.209 2.730 3.787 . 0 0 "[ . 1 .]" 1
156 1 17 PHE HA 1 17 PHE QE . . 4.640 4.694 4.631 4.749 0.109 13 0 "[ . 1 .]" 1
157 1 17 PHE HA 1 18 GLY H . . 3.370 2.246 2.102 2.409 . 0 0 "[ . 1 .]" 1
158 1 17 PHE HA 1 31 GLY H . . 4.100 3.292 2.712 3.846 . 0 0 "[ . 1 .]" 1
159 1 17 PHE HB2 1 29 HIS HE1 . . 5.500 5.551 5.520 5.574 0.074 12 0 "[ . 1 .]" 1
160 1 17 PHE HB2 1 32 ILE HA . . 4.510 4.405 4.189 4.557 0.047 8 0 "[ . 1 .]" 1
161 1 17 PHE HB2 1 32 ILE MD . . 3.920 3.309 2.870 3.942 0.022 13 0 "[ . 1 .]" 1
162 1 17 PHE HB2 1 127 ASP HA . . 3.930 3.598 3.098 3.948 0.018 2 0 "[ . 1 .]" 1
163 1 17 PHE HB2 1 128 PRO HD2 . . 4.270 2.289 2.176 2.454 . 0 0 "[ . 1 .]" 1
164 1 17 PHE HB3 1 127 ASP HA . . 4.220 3.486 3.119 3.865 . 0 0 "[ . 1 .]" 1
165 1 17 PHE HB3 1 128 PRO HD2 . . 4.000 2.967 2.504 3.278 . 0 0 "[ . 1 .]" 1
166 1 17 PHE HB3 1 129 LYS H . . 4.330 3.959 3.719 4.312 . 0 0 "[ . 1 .]" 1
167 1 17 PHE QD 1 18 GLY H . . 5.230 3.230 2.792 3.545 . 0 0 "[ . 1 .]" 1
168 1 17 PHE QD 1 30 TYR HA . . 4.030 3.811 3.267 4.042 0.012 4 0 "[ . 1 .]" 1
169 1 17 PHE QD 1 31 GLY H . . 4.480 2.736 2.117 3.068 . 0 0 "[ . 1 .]" 1
170 1 17 PHE QD 1 31 GLY HA2 . . 4.640 2.507 2.371 2.865 . 0 0 "[ . 1 .]" 1
171 1 17 PHE QD 1 31 GLY QA . . 3.930 2.477 2.348 2.807 . 0 0 "[ . 1 .]" 1
172 1 17 PHE QD 1 31 GLY HA3 . . 4.640 3.882 3.786 4.057 . 0 0 "[ . 1 .]" 1
173 1 17 PHE QD 1 127 ASP H . . 5.420 4.610 4.175 5.048 . 0 0 "[ . 1 .]" 1
174 1 17 PHE QD 1 127 ASP HA . . 3.900 3.046 2.866 3.219 . 0 0 "[ . 1 .]" 1
175 1 17 PHE QD 1 127 ASP QB . . 4.300 2.825 2.486 3.074 . 0 0 "[ . 1 .]" 1
176 1 17 PHE QD 1 128 PRO HD2 . . 4.360 2.852 2.574 3.445 . 0 0 "[ . 1 .]" 1
177 1 17 PHE QD 1 128 PRO HD3 . . 4.570 2.708 2.385 3.347 . 0 0 "[ . 1 .]" 1
178 1 17 PHE QD 1 128 PRO HG3 . . 4.930 3.510 3.242 4.171 . 0 0 "[ . 1 .]" 1
179 1 17 PHE QE 1 18 GLY HA2 . . 4.680 3.941 3.395 4.325 . 0 0 "[ . 1 .]" 1
180 1 17 PHE QE 1 18 GLY HA3 . . 5.500 4.700 3.870 5.453 . 0 0 "[ . 1 .]" 1
181 1 17 PHE QE 1 30 TYR HA . . 3.590 2.796 2.329 3.102 . 0 0 "[ . 1 .]" 1
182 1 17 PHE QE 1 30 TYR QB . . 4.390 3.739 3.230 3.988 . 0 0 "[ . 1 .]" 1
183 1 17 PHE QE 1 125 ALA MB . . 3.460 2.714 2.246 3.384 . 0 0 "[ . 1 .]" 1
184 1 17 PHE QE 1 127 ASP H . . 4.530 3.828 3.215 4.178 . 0 0 "[ . 1 .]" 1
185 1 17 PHE QE 1 127 ASP HA . . 4.670 3.459 3.210 3.644 . 0 0 "[ . 1 .]" 1
186 1 17 PHE QE 1 127 ASP HB2 . . 4.790 3.251 2.820 4.772 . 0 0 "[ . 1 .]" 1
187 1 17 PHE QE 1 127 ASP QB . . 3.930 3.099 2.792 3.460 . 0 0 "[ . 1 .]" 1
188 1 17 PHE QE 1 127 ASP HB3 . . 4.790 4.561 3.226 4.813 0.023 13 0 "[ . 1 .]" 1
189 1 17 PHE QE 1 128 PRO HD2 . . 5.200 4.365 4.035 4.815 . 0 0 "[ . 1 .]" 1
190 1 17 PHE HZ 1 30 TYR HA . . 4.810 3.815 3.405 4.397 . 0 0 "[ . 1 .]" 1
191 1 17 PHE HZ 1 31 GLY H . . 5.500 5.534 5.197 5.576 0.076 3 0 "[ . 1 .]" 1
192 1 17 PHE HZ 1 125 ALA MB . . 4.310 3.259 2.661 4.056 . 0 0 "[ . 1 .]" 1
193 1 17 PHE HZ 1 126 GLU HA . . 3.980 3.188 2.574 3.516 . 0 0 "[ . 1 .]" 1
194 1 17 PHE HZ 1 127 ASP HA . . 5.380 4.158 3.779 4.559 . 0 0 "[ . 1 .]" 1
195 1 17 PHE HZ 1 127 ASP QB . . 4.560 4.418 3.996 4.584 0.024 5 0 "[ . 1 .]" 1
196 1 17 PHE HZ 1 128 PRO HD3 . . 5.500 4.990 4.652 5.482 . 0 0 "[ . 1 .]" 1
197 1 18 GLY H 1 30 TYR HA . . 4.770 4.104 3.642 4.787 0.017 12 0 "[ . 1 .]" 1
198 1 18 GLY H 1 31 GLY H . . 4.690 3.793 3.335 4.209 . 0 0 "[ . 1 .]" 1
199 1 19 LYS H 1 19 LYS QD . . 4.920 4.022 2.226 4.899 . 0 0 "[ . 1 .]" 1
200 1 19 LYS HA 1 20 TYR H . . 3.470 2.188 2.065 2.290 . 0 0 "[ . 1 .]" 1
201 1 19 LYS HA 1 20 TYR QB . . 4.610 3.854 3.515 4.327 . 0 0 "[ . 1 .]" 1
202 1 19 LYS HA 1 28 LYS HA . . 3.830 2.637 2.064 3.253 . 0 0 "[ . 1 .]" 1
203 1 19 LYS QB 1 20 TYR H . . 4.320 2.844 2.467 3.692 . 0 0 "[ . 1 .]" 1
204 1 19 LYS QB 1 28 LYS HA . . 4.820 4.424 3.580 4.844 0.024 12 0 "[ . 1 .]" 1
205 1 19 LYS HB2 1 19 LYS QD . . 3.330 2.723 2.257 3.366 0.036 5 0 "[ . 1 .]" 1
206 1 19 LYS HB2 1 20 TYR H . . 4.980 3.579 2.509 4.324 . 0 0 "[ . 1 .]" 1
207 1 19 LYS HB3 1 19 LYS QD . . 3.330 2.440 2.282 2.848 . 0 0 "[ . 1 .]" 1
208 1 19 LYS HB3 1 20 TYR H . . 4.980 3.337 2.632 4.220 . 0 0 "[ . 1 .]" 1
209 1 19 LYS QD 1 20 TYR H . . 4.580 4.283 3.169 4.625 0.045 2 0 "[ . 1 .]" 1
210 1 19 LYS QE 1 19 LYS QG . . 2.750 2.348 2.134 2.738 . 0 0 "[ . 1 .]" 1
211 1 20 TYR H 1 20 TYR HB2 . . 4.030 2.736 2.121 3.568 . 0 0 "[ . 1 .]" 1
212 1 20 TYR H 1 20 TYR QB . . 3.540 2.298 2.082 2.653 . 0 0 "[ . 1 .]" 1
213 1 20 TYR H 1 20 TYR HB3 . . 4.030 2.733 2.286 3.564 . 0 0 "[ . 1 .]" 1
214 1 20 TYR H 1 20 TYR QD . . 4.250 3.914 2.615 4.289 0.039 5 0 "[ . 1 .]" 1
215 1 20 TYR H 1 28 LYS HA . . 4.500 3.464 2.776 4.024 . 0 0 "[ . 1 .]" 1
216 1 20 TYR HA 1 20 TYR QD . . 4.380 2.813 2.475 3.383 . 0 0 "[ . 1 .]" 1
217 1 20 TYR QB 1 28 LYS HA . . 4.450 3.949 2.854 4.559 0.109 9 0 "[ . 1 .]" 1
218 1 20 TYR QD 1 23 SER QB . . 4.630 3.111 2.168 4.630 0.000 6 0 "[ . 1 .]" 1
219 1 20 TYR QD 1 29 HIS QB . . 5.200 2.919 2.374 4.131 . 0 0 "[ . 1 .]" 1
220 1 20 TYR QD 1 29 HIS HD2 . . 5.000 3.859 2.946 4.786 . 0 0 "[ . 1 .]" 1
221 1 20 TYR QE 1 29 HIS HD2 . . 4.750 4.031 2.657 4.808 0.058 15 0 "[ . 1 .]" 1
222 1 21 GLN HA 1 21 GLN HG2 . . 4.010 3.100 2.412 3.877 . 0 0 "[ . 1 .]" 1
223 1 21 GLN HA 1 21 GLN QG . . 3.430 2.578 2.249 3.408 . 0 0 "[ . 1 .]" 1
224 1 21 GLN HA 1 21 GLN HG3 . . 4.010 2.934 2.297 3.891 . 0 0 "[ . 1 .]" 1
225 1 23 SER H 1 23 SER QB . . 3.690 2.661 2.247 3.249 . 0 0 "[ . 1 .]" 1
226 1 23 SER HA 1 24 PRO QD . . 3.550 2.101 1.990 2.205 . 0 0 "[ . 1 .]" 1
227 1 26 ASP HA 1 27 GLY H . . 3.510 2.931 2.160 3.544 0.034 10 0 "[ . 1 .]" 1
228 1 26 ASP QB 1 27 GLY H . . 4.230 3.460 2.561 4.063 . 0 0 "[ . 1 .]" 1
229 1 27 GLY QA 1 28 LYS H . . 3.080 2.335 2.107 2.966 . 0 0 "[ . 1 .]" 1
230 1 27 GLY QA 1 28 LYS QB . . 4.250 3.975 3.648 4.346 0.096 8 0 "[ . 1 .]" 1
231 1 28 LYS H 1 28 LYS HB2 . . 4.180 3.292 2.253 3.882 . 0 0 "[ . 1 .]" 1
232 1 28 LYS H 1 28 LYS QB . . 3.470 2.488 2.208 3.083 . 0 0 "[ . 1 .]" 1
233 1 28 LYS H 1 28 LYS HB3 . . 4.180 2.663 2.309 3.543 . 0 0 "[ . 1 .]" 1
234 1 28 LYS HA 1 28 LYS QD . . 4.340 3.907 2.336 4.394 0.054 14 0 "[ . 1 .]" 1
235 1 28 LYS HA 1 28 LYS QG . . 3.680 2.999 2.301 3.400 . 0 0 "[ . 1 .]" 1
236 1 28 LYS HA 1 30 TYR QE . . 5.500 5.320 4.903 5.554 0.054 6 0 "[ . 1 .]" 1
237 1 28 LYS QB 1 30 TYR QD . . 4.560 4.106 2.874 4.605 0.045 2 0 "[ . 1 .]" 1
238 1 28 LYS QB 1 30 TYR QE . . 3.900 3.141 2.629 3.995 0.095 2 0 "[ . 1 .]" 1
239 1 28 LYS HB2 1 30 TYR QE . . 4.630 3.885 2.681 4.642 0.012 1 0 "[ . 1 .]" 1
240 1 28 LYS HB3 1 30 TYR QE . . 4.630 3.727 2.705 4.638 0.008 5 0 "[ . 1 .]" 1
241 1 28 LYS QD 1 30 TYR QD . . 4.700 4.050 2.670 4.722 0.022 6 0 "[ . 1 .]" 1
242 1 28 LYS QD 1 30 TYR QE . . 3.610 2.871 2.004 3.651 0.041 10 0 "[ . 1 .]" 1
243 1 28 LYS QE 1 28 LYS HG2 . . 3.890 2.682 2.236 3.613 . 0 0 "[ . 1 .]" 1
244 1 28 LYS QE 1 28 LYS HG3 . . 3.890 2.852 2.333 3.493 . 0 0 "[ . 1 .]" 1
245 1 28 LYS QE 1 30 TYR QE . . 4.310 3.297 2.167 4.335 0.025 14 0 "[ . 1 .]" 1
246 1 28 LYS QG 1 30 TYR H . . 4.630 4.178 3.671 4.642 0.012 6 0 "[ . 1 .]" 1
247 1 28 LYS QG 1 30 TYR QD . . 4.040 3.194 2.692 3.558 . 0 0 "[ . 1 .]" 1
248 1 28 LYS QG 1 30 TYR QE . . 3.860 2.728 2.093 3.297 . 0 0 "[ . 1 .]" 1
249 1 28 LYS HG2 1 30 TYR QD . . 4.810 4.040 3.227 4.843 0.033 9 0 "[ . 1 .]" 1
250 1 28 LYS HG2 1 30 TYR QE . . 4.490 3.389 2.228 4.363 . 0 0 "[ . 1 .]" 1
251 1 28 LYS HG3 1 30 TYR QD . . 4.810 3.792 2.715 4.815 0.005 7 0 "[ . 1 .]" 1
252 1 28 LYS HG3 1 30 TYR QE . . 4.490 3.412 2.104 4.551 0.061 12 0 "[ . 1 .]" 1
253 1 29 HIS HA 1 29 HIS HD2 . . 4.080 2.519 2.236 2.986 . 0 0 "[ . 1 .]" 1
254 1 29 HIS HA 1 30 TYR QD . . 4.600 3.845 3.098 4.643 0.043 7 0 "[ . 1 .]" 1
255 1 29 HIS QB 1 112 HIS HE1 . . 5.340 5.077 4.681 5.423 0.083 14 0 "[ . 1 .]" 1
256 1 29 HIS HD2 1 30 TYR H . . 5.300 3.551 2.946 4.850 . 0 0 "[ . 1 .]" 1
257 1 29 HIS HE1 1 32 ILE H . . 5.050 3.768 3.142 4.202 . 0 0 "[ . 1 .]" 1
258 1 29 HIS HE1 1 32 ILE HA . . 3.760 2.221 2.048 2.579 . 0 0 "[ . 1 .]" 1
259 1 29 HIS HE1 1 33 ASP H . . 4.390 2.766 2.351 3.493 . 0 0 "[ . 1 .]" 1
260 1 30 TYR H 1 30 TYR QD . . 4.270 2.779 2.253 3.630 . 0 0 "[ . 1 .]" 1
261 1 30 TYR H 1 31 GLY H . . 4.240 3.216 2.862 4.063 . 0 0 "[ . 1 .]" 1
262 1 30 TYR H 1 112 HIS HE1 . . 5.010 3.758 3.294 5.142 0.132 7 0 "[ . 1 .]" 1
263 1 30 TYR HA 1 30 TYR QD . . 3.710 2.703 2.252 3.045 . 0 0 "[ . 1 .]" 1
264 1 30 TYR HA 1 30 TYR QE . . 4.590 4.506 4.368 4.614 0.024 11 0 "[ . 1 .]" 1
265 1 30 TYR HA 1 125 ALA MB . . 4.150 3.486 2.937 4.042 . 0 0 "[ . 1 .]" 1
266 1 30 TYR QB 1 114 GLN QE . . 4.580 2.781 2.395 3.355 . 0 0 "[ . 1 .]" 1
267 1 30 TYR QB 1 122 ASN HA . . 3.960 3.183 2.770 3.691 . 0 0 "[ . 1 .]" 1
268 1 30 TYR QB 1 125 ALA MB . . 3.180 2.494 2.203 2.760 . 0 0 "[ . 1 .]" 1
269 1 30 TYR HB2 1 122 ASN HA . . 4.790 4.138 3.747 4.719 . 0 0 "[ . 1 .]" 1
270 1 30 TYR HB2 1 125 ALA MB . . 3.980 3.902 3.569 4.051 0.071 13 0 "[ . 1 .]" 1
271 1 30 TYR HB3 1 122 ASN HA . . 4.790 3.318 2.839 3.953 . 0 0 "[ . 1 .]" 1
272 1 30 TYR HB3 1 125 ALA MB . . 3.980 2.524 2.224 2.808 . 0 0 "[ . 1 .]" 1
273 1 30 TYR QD 1 114 GLN QE . . 4.930 4.263 3.770 4.920 . 0 0 "[ . 1 .]" 1
274 1 30 TYR QD 1 122 ASN HA . . 4.170 3.519 2.583 4.073 . 0 0 "[ . 1 .]" 1
275 1 30 TYR QD 1 122 ASN HB2 . . 4.660 3.750 2.281 4.609 . 0 0 "[ . 1 .]" 1
276 1 30 TYR QD 1 122 ASN QB . . 3.920 3.066 2.264 3.328 . 0 0 "[ . 1 .]" 1
277 1 30 TYR QD 1 122 ASN HB3 . . 4.660 3.568 3.121 4.205 . 0 0 "[ . 1 .]" 1
278 1 30 TYR QD 1 125 ALA MB . . 3.270 2.223 2.065 2.493 . 0 0 "[ . 1 .]" 1
279 1 30 TYR QE 1 122 ASN HA . . 4.880 4.553 3.940 4.840 . 0 0 "[ . 1 .]" 1
280 1 30 TYR QE 1 122 ASN QB . . 4.190 3.157 2.799 3.413 . 0 0 "[ . 1 .]" 1
281 1 30 TYR QE 1 123 ALA HA . . 4.510 4.319 3.408 4.560 0.050 15 0 "[ . 1 .]" 1
282 1 30 TYR QE 1 125 ALA MB . . 4.140 3.775 2.984 4.163 0.023 8 0 "[ . 1 .]" 1
283 1 31 GLY H 1 32 ILE H . . 5.200 4.306 4.255 4.446 . 0 0 "[ . 1 .]" 1
284 1 31 GLY H 1 32 ILE HA . . 5.390 4.770 4.685 4.988 . 0 0 "[ . 1 .]" 1
285 1 31 GLY H 1 112 HIS HE1 . . 5.310 3.972 3.361 4.576 . 0 0 "[ . 1 .]" 1
286 1 31 GLY H 1 114 GLN HA . . 5.500 5.255 5.048 5.533 0.033 14 0 "[ . 1 .]" 1
287 1 31 GLY QA 1 32 ILE HB . . 4.920 3.914 3.804 4.024 . 0 0 "[ . 1 .]" 1
288 1 31 GLY QA 1 112 HIS HE1 . . 4.750 3.341 2.737 4.030 . 0 0 "[ . 1 .]" 1
289 1 31 GLY QA 1 114 GLN QB . . 4.250 2.384 2.215 2.521 . 0 0 "[ . 1 .]" 1
290 1 31 GLY QA 1 128 PRO HG2 . . 5.340 4.150 3.837 4.448 . 0 0 "[ . 1 .]" 1
291 1 31 GLY QA 1 128 PRO HG3 . . 5.340 2.768 2.477 3.086 . 0 0 "[ . 1 .]" 1
292 1 32 ILE H 1 32 ILE HB . . 3.880 2.610 2.563 2.653 . 0 0 "[ . 1 .]" 1
293 1 32 ILE H 1 32 ILE MD . . 4.800 4.601 4.526 4.646 . 0 0 "[ . 1 .]" 1
294 1 32 ILE H 1 32 ILE HG12 . . 4.730 4.429 4.252 4.566 . 0 0 "[ . 1 .]" 1
295 1 32 ILE H 1 32 ILE HG13 . . 4.570 3.688 3.579 3.805 . 0 0 "[ . 1 .]" 1
296 1 32 ILE H 1 32 ILE MG . . 3.860 3.586 3.518 3.662 . 0 0 "[ . 1 .]" 1
297 1 32 ILE H 1 112 HIS HA . . 4.960 4.318 4.113 4.528 . 0 0 "[ . 1 .]" 1
298 1 32 ILE H 1 113 PHE H . . 3.780 2.829 2.725 3.009 . 0 0 "[ . 1 .]" 1
299 1 32 ILE H 1 113 PHE QB . . 4.430 3.945 3.591 4.315 . 0 0 "[ . 1 .]" 1
300 1 32 ILE H 1 128 PRO HG2 . . 4.680 4.505 4.180 4.700 0.020 7 0 "[ . 1 .]" 1
301 1 32 ILE H 1 128 PRO HG3 . . 4.710 3.514 3.208 3.852 . 0 0 "[ . 1 .]" 1
302 1 32 ILE HA 1 32 ILE HG12 . . 3.690 2.221 2.136 2.331 . 0 0 "[ . 1 .]" 1
303 1 32 ILE HA 1 32 ILE HG13 . . 3.560 2.718 2.534 2.879 . 0 0 "[ . 1 .]" 1
304 1 32 ILE HA 1 32 ILE MG . . 3.380 2.790 2.700 2.864 . 0 0 "[ . 1 .]" 1
305 1 32 ILE HA 1 33 ASP H . . 3.310 2.236 2.161 2.352 . 0 0 "[ . 1 .]" 1
306 1 32 ILE HA 1 33 ASP HA . . 4.760 4.437 4.398 4.517 . 0 0 "[ . 1 .]" 1
307 1 32 ILE HB 1 32 ILE MD . . 3.280 2.555 2.451 2.664 . 0 0 "[ . 1 .]" 1
308 1 32 ILE HB 1 33 ASP H . . 4.490 4.346 4.254 4.440 . 0 0 "[ . 1 .]" 1
309 1 32 ILE HB 1 34 PHE QD . . 5.500 5.488 5.294 5.574 0.074 10 0 "[ . 1 .]" 1
310 1 32 ILE HB 1 34 PHE QE . . 4.630 4.247 4.115 4.378 . 0 0 "[ . 1 .]" 1
311 1 32 ILE HB 1 34 PHE HZ . . 4.610 4.543 4.286 4.643 0.033 14 0 "[ . 1 .]" 1
312 1 32 ILE HB 1 113 PHE H . . 4.570 4.117 3.855 4.396 . 0 0 "[ . 1 .]" 1
313 1 32 ILE HB 1 113 PHE QD . . 4.470 3.295 3.007 3.730 . 0 0 "[ . 1 .]" 1
314 1 32 ILE HB 1 113 PHE QE . . 5.500 5.144 4.730 5.512 0.012 5 0 "[ . 1 .]" 1
315 1 32 ILE HB 1 128 PRO HD2 . . 4.890 4.669 4.322 4.871 . 0 0 "[ . 1 .]" 1
316 1 32 ILE HB 1 128 PRO HG2 . . 4.250 2.820 2.583 3.002 . 0 0 "[ . 1 .]" 1
317 1 32 ILE HB 1 128 PRO HG3 . . 3.860 2.891 2.803 2.983 . 0 0 "[ . 1 .]" 1
318 1 32 ILE MD 1 34 PHE QE . . 4.170 4.052 3.882 4.179 0.009 6 0 "[ . 1 .]" 1
319 1 32 ILE MD 1 127 ASP HA . . 5.250 5.084 4.543 5.269 0.019 3 0 "[ . 1 .]" 1
320 1 32 ILE MD 1 128 PRO HB2 . . 3.900 3.294 2.949 3.706 . 0 0 "[ . 1 .]" 1
321 1 32 ILE MD 1 128 PRO HB3 . . 4.700 4.455 4.224 4.655 . 0 0 "[ . 1 .]" 1
322 1 32 ILE MD 1 128 PRO HD2 . . 3.870 3.284 2.802 3.516 . 0 0 "[ . 1 .]" 1
323 1 32 ILE MD 1 128 PRO HG2 . . 3.330 2.078 2.009 2.133 . 0 0 "[ . 1 .]" 1
324 1 32 ILE MD 1 128 PRO HG3 . . 3.520 3.423 3.320 3.521 0.001 5 0 "[ . 1 .]" 1
325 1 32 ILE MD 1 129 LYS H . . 3.790 2.790 2.616 2.986 . 0 0 "[ . 1 .]" 1
326 1 32 ILE MD 1 129 LYS HA . . 3.210 2.478 2.278 2.767 . 0 0 "[ . 1 .]" 1
327 1 32 ILE MD 1 129 LYS HB2 . . 2.930 2.225 2.037 2.505 . 0 0 "[ . 1 .]" 1
328 1 32 ILE MD 1 129 LYS HB3 . . 3.930 3.605 3.502 3.759 . 0 0 "[ . 1 .]" 1
329 1 32 ILE MD 1 129 LYS QG . . 3.110 2.135 2.021 2.325 . 0 0 "[ . 1 .]" 1
330 1 32 ILE MD 1 130 PRO HD2 . . 5.040 4.640 4.449 4.839 . 0 0 "[ . 1 .]" 1
331 1 32 ILE MD 1 130 PRO HD3 . . 4.830 4.845 4.705 4.894 0.064 7 0 "[ . 1 .]" 1
332 1 32 ILE HG12 1 33 ASP H . . 4.810 3.572 3.396 3.693 . 0 0 "[ . 1 .]" 1
333 1 32 ILE HG12 1 128 PRO HD2 . . 5.200 4.732 4.249 4.992 . 0 0 "[ . 1 .]" 1
334 1 32 ILE HG12 1 128 PRO HG2 . . 4.600 3.882 3.767 3.977 . 0 0 "[ . 1 .]" 1
335 1 32 ILE HG13 1 33 ASP H . . 4.830 4.687 4.464 4.846 0.016 5 0 "[ . 1 .]" 1
336 1 32 ILE HG13 1 128 PRO HB2 . . 5.450 4.625 4.449 4.840 . 0 0 "[ . 1 .]" 1
337 1 32 ILE HG13 1 128 PRO HD2 . . 4.430 3.158 2.743 3.327 . 0 0 "[ . 1 .]" 1
338 1 32 ILE HG13 1 128 PRO HG2 . . 4.070 2.414 2.311 2.533 . 0 0 "[ . 1 .]" 1
339 1 32 ILE MG 1 33 ASP H . . 3.960 2.586 2.398 2.805 . 0 0 "[ . 1 .]" 1
340 1 32 ILE MG 1 33 ASP HA . . 4.770 3.566 3.236 3.776 . 0 0 "[ . 1 .]" 1
341 1 32 ILE MG 1 34 PHE QD . . 3.690 3.266 3.147 3.370 . 0 0 "[ . 1 .]" 1
342 1 32 ILE MG 1 34 PHE QE . . 4.160 2.569 2.355 2.689 . 0 0 "[ . 1 .]" 1
343 1 32 ILE MG 1 113 PHE H . . 4.630 3.701 3.451 3.928 . 0 0 "[ . 1 .]" 1
344 1 32 ILE MG 1 113 PHE QB . . 3.820 3.280 3.005 3.633 . 0 0 "[ . 1 .]" 1
345 1 32 ILE MG 1 113 PHE QD . . 3.850 3.563 3.214 3.856 0.006 5 0 "[ . 1 .]" 1
346 1 32 ILE MG 1 113 PHE QE . . 5.500 5.213 4.804 5.495 . 0 0 "[ . 1 .]" 1
347 1 32 ILE MG 1 128 PRO HB2 . . 4.660 4.518 4.206 4.675 0.015 5 0 "[ . 1 .]" 1
348 1 32 ILE MG 1 128 PRO HD2 . . 5.500 5.463 5.035 5.549 0.049 10 0 "[ . 1 .]" 1
349 1 32 ILE MG 1 128 PRO HG2 . . 3.910 3.833 3.583 3.897 . 0 0 "[ . 1 .]" 1
350 1 32 ILE MG 1 128 PRO HG3 . . 4.340 4.383 4.363 4.397 0.057 14 0 "[ . 1 .]" 1
351 1 33 ASP H 1 33 ASP HB2 . . 4.150 2.672 2.554 2.863 . 0 0 "[ . 1 .]" 1
352 1 33 ASP HA 1 34 PHE H . . 3.090 2.152 2.121 2.213 . 0 0 "[ . 1 .]" 1
353 1 33 ASP HA 1 34 PHE HB2 . . 5.210 4.492 4.348 4.609 . 0 0 "[ . 1 .]" 1
354 1 33 ASP HA 1 34 PHE QD . . 4.650 4.096 3.681 4.481 . 0 0 "[ . 1 .]" 1
355 1 33 ASP HA 1 110 HIS HB2 . . 4.550 3.979 3.683 4.369 . 0 0 "[ . 1 .]" 1
356 1 33 ASP HA 1 110 HIS HD2 . . 4.650 3.544 3.143 4.457 . 0 0 "[ . 1 .]" 1
357 1 33 ASP HA 1 111 LEU H . . 4.750 4.728 4.435 4.780 0.030 13 0 "[ . 1 .]" 1
358 1 33 ASP HA 1 111 LEU HG . . 5.470 4.934 4.440 5.160 . 0 0 "[ . 1 .]" 1
359 1 33 ASP HA 1 112 HIS HA . . 3.540 2.640 2.494 2.720 . 0 0 "[ . 1 .]" 1
360 1 33 ASP HA 1 112 HIS HB2 . . 5.180 4.711 4.420 5.018 . 0 0 "[ . 1 .]" 1
361 1 33 ASP HA 1 113 PHE H . . 4.000 3.545 3.230 3.669 . 0 0 "[ . 1 .]" 1
362 1 33 ASP HA 1 113 PHE QB . . 5.080 4.930 4.481 5.099 0.019 9 0 "[ . 1 .]" 1
363 1 33 ASP HB2 1 34 PHE H . . 4.860 4.206 3.915 4.393 . 0 0 "[ . 1 .]" 1
364 1 33 ASP HB2 1 110 HIS HB3 . . 5.500 5.519 5.376 5.586 0.086 7 0 "[ . 1 .]" 1
365 1 33 ASP HB2 1 110 HIS HD2 . . 4.780 4.210 3.613 4.783 0.003 9 0 "[ . 1 .]" 1
366 1 33 ASP HB3 1 34 PHE H . . 4.080 3.111 2.801 3.435 . 0 0 "[ . 1 .]" 1
367 1 33 ASP HB3 1 110 HIS HB2 . . 4.470 2.957 2.694 3.209 . 0 0 "[ . 1 .]" 1
368 1 33 ASP HB3 1 110 HIS HB3 . . 4.860 4.019 3.885 4.245 . 0 0 "[ . 1 .]" 1
369 1 33 ASP HB3 1 110 HIS HD2 . . 4.610 2.673 2.321 3.311 . 0 0 "[ . 1 .]" 1
370 1 34 PHE H 1 34 PHE HB2 . . 3.740 2.603 2.514 2.793 . 0 0 "[ . 1 .]" 1
371 1 34 PHE H 1 34 PHE HB3 . . 4.150 3.757 3.697 3.858 . 0 0 "[ . 1 .]" 1
372 1 34 PHE H 1 34 PHE QD . . 4.080 3.250 3.100 3.425 . 0 0 "[ . 1 .]" 1
373 1 34 PHE H 1 110 HIS HB2 . . 4.100 2.820 2.513 3.086 . 0 0 "[ . 1 .]" 1
374 1 34 PHE H 1 110 HIS HB3 . . 4.910 4.406 4.105 4.648 . 0 0 "[ . 1 .]" 1
375 1 34 PHE H 1 111 LEU H . . 3.910 2.970 2.706 3.100 . 0 0 "[ . 1 .]" 1
376 1 34 PHE H 1 112 HIS HA . . 4.400 3.959 3.866 4.049 . 0 0 "[ . 1 .]" 1
377 1 34 PHE HA 1 34 PHE QD . . 4.420 2.543 2.410 2.728 . 0 0 "[ . 1 .]" 1
378 1 34 PHE HA 1 35 ALA H . . 3.270 2.136 2.096 2.195 . 0 0 "[ . 1 .]" 1
379 1 34 PHE HA 1 35 ALA MB . . 4.430 3.876 3.723 3.955 . 0 0 "[ . 1 .]" 1
380 1 34 PHE HA 1 36 LEU QD . . 4.560 4.348 3.511 4.535 . 0 0 "[ . 1 .]" 1
381 1 34 PHE HB2 1 35 ALA H . . 4.750 4.205 4.035 4.278 . 0 0 "[ . 1 .]" 1
382 1 34 PHE HB2 1 36 LEU MD1 . . 4.040 2.856 2.535 3.285 . 0 0 "[ . 1 .]" 1
383 1 34 PHE HB2 1 36 LEU QD . . 3.410 2.706 1.950 2.977 . 0 0 "[ . 1 .]" 1
384 1 34 PHE HB2 1 36 LEU MD2 . . 4.040 3.691 1.989 4.045 0.005 11 0 "[ . 1 .]" 1
385 1 34 PHE HB2 1 36 LEU HG . . 4.190 2.954 2.488 4.325 0.135 10 0 "[ . 1 .]" 1
386 1 34 PHE HB2 1 111 LEU H . . 4.130 3.047 2.829 3.451 . 0 0 "[ . 1 .]" 1
387 1 34 PHE HB2 1 111 LEU HB2 . . 4.530 3.900 3.750 4.036 . 0 0 "[ . 1 .]" 1
388 1 34 PHE HB2 1 111 LEU HB3 . . 4.090 2.444 2.325 2.712 . 0 0 "[ . 1 .]" 1
389 1 34 PHE HB2 1 111 LEU QD . . 3.770 3.475 3.368 3.567 . 0 0 "[ . 1 .]" 1
390 1 34 PHE HB2 1 143 TYR QD . . 5.500 4.294 3.876 4.582 . 0 0 "[ . 1 .]" 1
391 1 34 PHE HB3 1 35 ALA H . . 3.860 3.227 3.032 3.324 . 0 0 "[ . 1 .]" 1
392 1 34 PHE HB3 1 36 LEU MD1 . . 4.100 3.111 2.147 3.858 . 0 0 "[ . 1 .]" 1
393 1 34 PHE HB3 1 36 LEU QD . . 3.330 2.659 2.076 2.898 . 0 0 "[ . 1 .]" 1
394 1 34 PHE HB3 1 36 LEU MD2 . . 4.100 2.976 2.703 3.242 . 0 0 "[ . 1 .]" 1
395 1 34 PHE HB3 1 36 LEU HG . . 4.360 2.726 2.315 4.407 0.047 10 0 "[ . 1 .]" 1
396 1 34 PHE HB3 1 111 LEU HB2 . . 5.500 5.368 5.202 5.503 0.003 5 0 "[ . 1 .]" 1
397 1 34 PHE HB3 1 111 LEU HB3 . . 4.440 4.109 3.937 4.441 0.001 10 0 "[ . 1 .]" 1
398 1 34 PHE HB3 1 143 TYR QE . . 4.740 3.597 3.104 4.118 . 0 0 "[ . 1 .]" 1
399 1 34 PHE QD 1 36 LEU QD . . 4.310 3.499 3.156 3.844 . 0 0 "[ . 1 .]" 1
400 1 34 PHE QD 1 111 LEU HB2 . . 4.920 4.354 4.285 4.450 . 0 0 "[ . 1 .]" 1
401 1 34 PHE QD 1 111 LEU HB3 . . 4.280 2.729 2.693 2.795 . 0 0 "[ . 1 .]" 1
402 1 34 PHE QD 1 111 LEU QD . . 3.940 2.440 2.300 2.572 . 0 0 "[ . 1 .]" 1
403 1 34 PHE QD 1 111 LEU HG . . 4.140 3.460 2.768 3.758 . 0 0 "[ . 1 .]" 1
404 1 34 PHE QD 1 143 TYR QD . . 4.930 3.964 3.694 4.215 . 0 0 "[ . 1 .]" 1
405 1 34 PHE QD 1 143 TYR QE . . 4.940 3.297 2.844 3.644 . 0 0 "[ . 1 .]" 1
406 1 34 PHE QE 1 111 LEU HB3 . . 4.900 4.938 4.902 4.969 0.069 10 0 "[ . 1 .]" 1
407 1 34 PHE QE 1 111 LEU QD . . 3.620 3.474 3.283 3.573 . 0 0 "[ . 1 .]" 1
408 1 34 PHE QE 1 113 PHE H . . 4.700 4.650 4.265 4.739 0.039 11 0 "[ . 1 .]" 1
409 1 34 PHE QE 1 113 PHE QB . . 3.480 2.692 2.329 2.886 . 0 0 "[ . 1 .]" 1
410 1 34 PHE QE 1 113 PHE QD . . 3.850 3.346 2.958 3.645 . 0 0 "[ . 1 .]" 1
411 1 34 PHE QE 1 132 ILE MD . . 3.100 2.942 2.645 3.091 . 0 0 "[ . 1 .]" 1
412 1 34 PHE QE 1 139 GLU HB2 . . 4.070 2.958 2.311 3.941 . 0 0 "[ . 1 .]" 1
413 1 34 PHE QE 1 139 GLU HB3 . . 4.170 3.365 2.958 4.171 0.001 4 0 "[ . 1 .]" 1
414 1 34 PHE QE 1 142 LEU QB . . 4.390 3.574 3.327 4.096 . 0 0 "[ . 1 .]" 1
415 1 34 PHE QE 1 142 LEU MD1 . . 4.910 3.850 3.523 4.308 . 0 0 "[ . 1 .]" 1
416 1 34 PHE QE 1 142 LEU QD . . 3.510 3.401 2.488 3.800 0.290 5 0 "[ . 1 .]" 1
417 1 34 PHE QE 1 142 LEU MD2 . . 4.910 3.848 2.543 4.407 . 0 0 "[ . 1 .]" 1
418 1 34 PHE QE 1 142 LEU HG . . 5.310 2.919 2.442 5.366 0.056 11 0 "[ . 1 .]" 1
419 1 35 ALA H 1 35 ALA MB . . 3.380 2.139 2.074 2.180 . 0 0 "[ . 1 .]" 1
420 1 35 ALA HA 1 36 LEU H . . 3.150 2.402 2.129 2.856 . 0 0 "[ . 1 .]" 1
421 1 35 ALA HA 1 110 HIS HA . . 3.550 3.246 2.975 3.492 . 0 0 "[ . 1 .]" 1
422 1 35 ALA HA 1 110 HIS HB2 . . 4.120 3.803 3.525 4.054 . 0 0 "[ . 1 .]" 1
423 1 35 ALA HA 1 110 HIS HB3 . . 3.910 2.963 2.368 3.186 . 0 0 "[ . 1 .]" 1
424 1 35 ALA MB 1 36 LEU H . . 3.940 3.653 3.464 3.760 . 0 0 "[ . 1 .]" 1
425 1 35 ALA MB 1 110 HIS HA . . 5.000 4.783 4.564 4.981 . 0 0 "[ . 1 .]" 1
426 1 35 ALA MB 1 110 HIS HB2 . . 4.970 4.835 4.593 5.004 0.034 14 0 "[ . 1 .]" 1
427 1 35 ALA MB 1 110 HIS HB3 . . 4.330 4.155 3.857 4.348 0.018 7 0 "[ . 1 .]" 1
428 1 36 LEU H 1 36 LEU MD1 . . 4.600 3.793 2.405 4.106 . 0 0 "[ . 1 .]" 1
429 1 36 LEU H 1 36 LEU QD . . 3.800 3.278 2.206 3.629 . 0 0 "[ . 1 .]" 1
430 1 36 LEU H 1 36 LEU MD2 . . 4.600 3.602 2.563 4.042 . 0 0 "[ . 1 .]" 1
431 1 36 LEU H 1 36 LEU HG . . 4.520 2.822 2.132 4.084 . 0 0 "[ . 1 .]" 1
432 1 36 LEU H 1 37 PRO QD . . 4.930 4.358 4.216 4.511 . 0 0 "[ . 1 .]" 1
433 1 36 LEU H 1 110 HIS HA . . 3.450 2.527 2.131 2.948 . 0 0 "[ . 1 .]" 1
434 1 36 LEU H 1 110 HIS HB2 . . 4.730 4.232 3.931 4.556 . 0 0 "[ . 1 .]" 1
435 1 36 LEU H 1 110 HIS HB3 . . 4.530 3.955 3.446 4.325 . 0 0 "[ . 1 .]" 1
436 1 36 LEU H 1 111 LEU H . . 4.370 3.516 3.026 4.206 . 0 0 "[ . 1 .]" 1
437 1 36 LEU HA 1 36 LEU MD1 . . 4.080 3.811 2.190 3.984 . 0 0 "[ . 1 .]" 1
438 1 36 LEU HA 1 36 LEU QD . . 2.970 2.245 2.177 2.322 . 0 0 "[ . 1 .]" 1
439 1 36 LEU HA 1 36 LEU MD2 . . 4.080 2.368 2.212 3.827 . 0 0 "[ . 1 .]" 1
440 1 36 LEU HA 1 36 LEU HG . . 4.240 3.273 3.192 3.417 . 0 0 "[ . 1 .]" 1
441 1 36 LEU HA 1 145 LEU MD1 . . 3.730 3.653 2.849 3.807 0.077 15 0 "[ . 1 .]" 1
442 1 36 LEU HA 1 145 LEU MD2 . . 3.730 3.720 3.409 3.773 0.043 12 0 "[ . 1 .]" 1
443 1 36 LEU HB2 1 37 PRO QD . . 4.450 3.941 3.735 4.190 . 0 0 "[ . 1 .]" 1
444 1 36 LEU HB2 1 40 THR HB . . 4.690 3.605 3.346 3.816 . 0 0 "[ . 1 .]" 1
445 1 36 LEU HB2 1 40 THR HG1 . . 4.630 3.917 3.515 4.106 . 0 0 "[ . 1 .]" 1
446 1 36 LEU HB2 1 99 SER QB . . 4.210 3.121 2.760 3.370 . 0 0 "[ . 1 .]" 1
447 1 36 LEU HB3 1 37 PRO QD . . 4.440 2.772 2.501 3.166 . 0 0 "[ . 1 .]" 1
448 1 36 LEU HB3 1 40 THR HB . . 4.350 2.644 2.354 2.763 . 0 0 "[ . 1 .]" 1
449 1 36 LEU HB3 1 40 THR HG1 . . 4.430 2.802 2.239 2.936 . 0 0 "[ . 1 .]" 1
450 1 36 LEU HB3 1 145 LEU QD . . 3.400 3.609 2.923 3.851 0.451 6 0 "[ . 1 .]" 1
451 1 36 LEU QD 1 37 PRO QD . . 3.500 3.163 3.031 3.303 . 0 0 "[ . 1 .]" 1
452 1 36 LEU QD 1 40 THR H . . 5.440 4.981 4.613 5.437 . 0 0 "[ . 1 .]" 1
453 1 36 LEU QD 1 40 THR HB . . 3.970 2.998 2.608 3.538 . 0 0 "[ . 1 .]" 1
454 1 36 LEU QD 1 40 THR MG . . 2.930 2.278 2.086 2.991 0.061 10 0 "[ . 1 .]" 1
455 1 36 LEU QD 1 42 ILE MD . . 4.590 2.154 2.018 2.394 . 0 0 "[ . 1 .]" 1
456 1 36 LEU QD 1 99 SER QB . . 3.560 2.919 2.451 3.231 . 0 0 "[ . 1 .]" 1
457 1 36 LEU QD 1 110 HIS HA . . 4.410 4.188 3.554 4.467 0.057 4 0 "[ . 1 .]" 1
458 1 36 LEU QD 1 111 LEU H . . 4.130 3.156 2.502 3.394 . 0 0 "[ . 1 .]" 1
459 1 36 LEU QD 1 111 LEU HA . . 4.770 4.335 4.118 4.472 . 0 0 "[ . 1 .]" 1
460 1 36 LEU QD 1 111 LEU HB2 . . 3.510 2.395 2.194 2.525 . 0 0 "[ . 1 .]" 1
461 1 36 LEU QD 1 111 LEU HB3 . . 3.600 2.645 2.482 2.890 . 0 0 "[ . 1 .]" 1
462 1 36 LEU QD 1 111 LEU QD . . 3.140 2.713 2.427 3.092 . 0 0 "[ . 1 .]" 1
463 1 36 LEU QD 1 111 LEU HG . . 5.310 4.436 4.176 4.743 . 0 0 "[ . 1 .]" 1
464 1 36 LEU QD 1 143 TYR HA . . 4.590 3.853 3.632 4.238 . 0 0 "[ . 1 .]" 1
465 1 36 LEU QD 1 143 TYR HB2 . . 3.660 2.411 2.245 2.867 . 0 0 "[ . 1 .]" 1
466 1 36 LEU QD 1 143 TYR HB3 . . 3.410 2.288 2.072 2.648 . 0 0 "[ . 1 .]" 1
467 1 36 LEU QD 1 143 TYR QD . . 3.400 2.438 2.269 2.643 . 0 0 "[ . 1 .]" 1
468 1 36 LEU QD 1 143 TYR QE . . 4.180 3.015 2.715 3.290 . 0 0 "[ . 1 .]" 1
469 1 36 LEU QD 1 144 ASP H . . 5.420 4.310 3.940 4.809 . 0 0 "[ . 1 .]" 1
470 1 36 LEU QD 1 145 LEU HB2 . . 4.180 2.760 2.385 4.277 0.097 10 0 "[ . 1 .]" 1
471 1 36 LEU QD 1 145 LEU HB3 . . 4.940 3.101 2.578 5.128 0.188 10 0 "[ . 1 .]" 1
472 1 36 LEU QD 1 145 LEU QD . . 2.820 2.722 2.069 2.907 0.087 8 0 "[ . 1 .]" 1
473 1 36 LEU QD 1 145 LEU HG . . 3.610 2.333 2.097 4.409 0.799 10 1 "[ . + .]" 1
474 1 36 LEU MD1 1 40 THR HG1 . . 4.500 4.355 3.939 4.574 0.074 10 0 "[ . 1 .]" 1
475 1 36 LEU MD1 1 40 THR MG . . 3.350 2.658 2.325 3.355 0.005 10 0 "[ . 1 .]" 1
476 1 36 LEU MD1 1 143 TYR HA . . 5.410 4.115 3.786 5.413 0.003 10 0 "[ . 1 .]" 1
477 1 36 LEU MD1 1 143 TYR HB2 . . 4.530 2.675 2.421 3.501 . 0 0 "[ . 1 .]" 1
478 1 36 LEU MD1 1 143 TYR HB3 . . 4.540 2.409 2.099 3.662 . 0 0 "[ . 1 .]" 1
479 1 36 LEU MD1 1 143 TYR QD . . 3.930 2.682 2.366 3.106 . 0 0 "[ . 1 .]" 1
480 1 36 LEU MD2 1 40 THR HG1 . . 4.500 4.435 4.333 4.560 0.060 10 0 "[ . 1 .]" 1
481 1 36 LEU MD2 1 40 THR MG . . 3.350 2.500 2.251 3.360 0.010 10 0 "[ . 1 .]" 1
482 1 36 LEU MD2 1 143 TYR HA . . 5.410 4.783 4.356 5.167 . 0 0 "[ . 1 .]" 1
483 1 36 LEU MD2 1 143 TYR HB2 . . 4.530 2.768 2.521 3.087 . 0 0 "[ . 1 .]" 1
484 1 36 LEU MD2 1 143 TYR HB3 . . 4.540 3.271 2.486 3.649 . 0 0 "[ . 1 .]" 1
485 1 36 LEU MD2 1 143 TYR QD . . 3.930 2.854 2.696 2.999 . 0 0 "[ . 1 .]" 1
486 1 36 LEU HG 1 37 PRO QD . . 4.850 4.724 4.211 4.819 . 0 0 "[ . 1 .]" 1
487 1 37 PRO HA 1 38 LYS H . . 2.810 2.323 2.243 2.377 . 0 0 "[ . 1 .]" 1
488 1 37 PRO HA 1 38 LYS HA . . 4.440 4.378 4.313 4.419 . 0 0 "[ . 1 .]" 1
489 1 37 PRO HA 1 38 LYS HB3 . . 4.620 4.579 4.502 4.630 0.010 3 0 "[ . 1 .]" 1
490 1 37 PRO HA 1 38 LYS HG2 . . 4.470 4.395 4.128 4.501 0.031 12 0 "[ . 1 .]" 1
491 1 37 PRO HA 1 109 ALA MB . . 3.850 3.035 2.284 3.799 . 0 0 "[ . 1 .]" 1
492 1 37 PRO HB2 1 38 LYS H . . 2.980 2.860 2.664 2.992 0.012 4 0 "[ . 1 .]" 1
493 1 37 PRO HB2 1 40 THR H . . 5.500 4.905 4.657 5.177 . 0 0 "[ . 1 .]" 1
494 1 37 PRO HB2 1 40 THR HG1 . . 4.270 4.060 3.946 4.268 . 0 0 "[ . 1 .]" 1
495 1 37 PRO HB3 1 38 LYS H . . 3.690 3.631 3.465 3.713 0.023 12 0 "[ . 1 .]" 1
496 1 37 PRO HB3 1 40 THR HG1 . . 4.940 4.830 4.791 4.913 . 0 0 "[ . 1 .]" 1
497 1 37 PRO QD 1 40 THR HG1 . . 3.610 2.736 2.614 2.848 . 0 0 "[ . 1 .]" 1
498 1 37 PRO QD 1 40 THR MG . . 4.010 3.444 3.317 3.582 . 0 0 "[ . 1 .]" 1
499 1 37 PRO QD 1 145 LEU QD . . 2.850 2.139 2.056 2.277 . 0 0 "[ . 1 .]" 1
500 1 37 PRO QD 1 145 LEU HG . . 3.820 2.835 2.514 3.882 0.062 9 0 "[ . 1 .]" 1
501 1 37 PRO HD2 1 40 THR HG1 . . 4.230 2.772 2.645 2.894 . 0 0 "[ . 1 .]" 1
502 1 37 PRO HD2 1 145 LEU MD1 . . 5.120 3.333 2.568 3.765 . 0 0 "[ . 1 .]" 1
503 1 37 PRO HD2 1 145 LEU MD2 . . 5.120 2.270 2.160 2.717 . 0 0 "[ . 1 .]" 1
504 1 37 PRO HD3 1 40 THR HG1 . . 4.230 4.226 4.087 4.262 0.032 12 0 "[ . 1 .]" 1
505 1 37 PRO HD3 1 145 LEU MD1 . . 5.120 3.474 3.135 3.833 . 0 0 "[ . 1 .]" 1
506 1 37 PRO HD3 1 145 LEU MD2 . . 5.120 3.023 2.693 3.280 . 0 0 "[ . 1 .]" 1
507 1 37 PRO QG 1 40 THR HG1 . . 3.780 2.535 2.419 2.666 . 0 0 "[ . 1 .]" 1
508 1 37 PRO QG 1 40 THR MG . . 3.990 3.998 3.890 4.022 0.032 6 0 "[ . 1 .]" 1
509 1 38 LYS H 1 38 LYS HB3 . . 2.980 2.498 2.420 2.641 . 0 0 "[ . 1 .]" 1
510 1 38 LYS H 1 38 LYS HG2 . . 3.880 2.273 2.173 2.408 . 0 0 "[ . 1 .]" 1
511 1 38 LYS H 1 38 LYS HG3 . . 4.450 3.546 3.396 3.706 . 0 0 "[ . 1 .]" 1
512 1 38 LYS H 1 39 GLY H . . 4.500 4.575 4.554 4.593 0.093 9 0 "[ . 1 .]" 1
513 1 38 LYS H 1 109 ALA MB . . 4.300 3.218 2.685 3.828 . 0 0 "[ . 1 .]" 1
514 1 38 LYS HA 1 38 LYS HG2 . . 3.870 3.781 3.746 3.853 . 0 0 "[ . 1 .]" 1
515 1 38 LYS HA 1 38 LYS HG3 . . 3.870 3.805 3.753 3.846 . 0 0 "[ . 1 .]" 1
516 1 38 LYS HA 1 39 GLY H . . 2.800 2.113 2.079 2.164 . 0 0 "[ . 1 .]" 1
517 1 38 LYS HA 1 39 GLY HA3 . . 5.070 4.503 4.469 4.565 . 0 0 "[ . 1 .]" 1
518 1 38 LYS HA 1 40 THR H . . 3.640 3.351 3.164 3.530 . 0 0 "[ . 1 .]" 1
519 1 38 LYS HA 1 100 GLY HA3 . . 4.700 4.334 3.796 4.728 0.028 9 0 "[ . 1 .]" 1
520 1 38 LYS HA 1 109 ALA MB . . 4.180 3.600 3.066 4.194 0.014 12 0 "[ . 1 .]" 1
521 1 38 LYS HB2 1 38 LYS QE . . 3.690 2.664 2.034 3.752 0.062 2 0 "[ . 1 .]" 1
522 1 38 LYS HB2 1 39 GLY H . . 4.130 2.959 2.729 3.142 . 0 0 "[ . 1 .]" 1
523 1 38 LYS HB2 1 39 GLY HA2 . . 4.830 4.735 4.599 4.850 0.020 13 0 "[ . 1 .]" 1
524 1 38 LYS HB2 1 40 THR H . . 5.500 5.148 4.970 5.283 . 0 0 "[ . 1 .]" 1
525 1 38 LYS HB2 1 100 GLY HA3 . . 4.890 4.254 3.772 4.900 0.010 2 0 "[ . 1 .]" 1
526 1 38 LYS HB3 1 38 LYS QE . . 3.960 2.750 1.932 3.986 0.026 2 0 "[ . 1 .]" 1
527 1 38 LYS HB3 1 39 GLY H . . 4.730 4.039 3.929 4.148 . 0 0 "[ . 1 .]" 1
528 1 38 LYS HB3 1 100 GLY HA2 . . 4.480 3.124 2.497 3.668 . 0 0 "[ . 1 .]" 1
529 1 38 LYS QE 1 38 LYS HG3 . . 3.620 2.948 2.119 3.547 . 0 0 "[ . 1 .]" 1
530 1 38 LYS HG2 1 39 GLY H . . 5.490 4.877 4.670 4.984 . 0 0 "[ . 1 .]" 1
531 1 38 LYS HG2 1 39 GLY HA3 . . 5.460 5.417 5.169 5.529 0.069 6 0 "[ . 1 .]" 1
532 1 38 LYS HG3 1 39 GLY H . . 4.750 4.116 3.809 4.290 . 0 0 "[ . 1 .]" 1
533 1 38 LYS HG3 1 39 GLY HA2 . . 5.450 5.164 4.850 5.342 . 0 0 "[ . 1 .]" 1
534 1 38 LYS HG3 1 39 GLY HA3 . . 4.470 4.189 3.905 4.416 . 0 0 "[ . 1 .]" 1
535 1 39 GLY H 1 40 THR H . . 3.380 2.743 2.498 2.909 . 0 0 "[ . 1 .]" 1
536 1 39 GLY H 1 40 THR HG1 . . 4.920 4.707 4.522 4.933 0.013 10 0 "[ . 1 .]" 1
537 1 39 GLY H 1 80 ASP HB2 . . 5.320 3.752 3.250 4.137 . 0 0 "[ . 1 .]" 1
538 1 39 GLY H 1 80 ASP QB . . 4.530 3.506 3.070 3.911 . 0 0 "[ . 1 .]" 1
539 1 39 GLY H 1 80 ASP HB3 . . 5.320 4.217 3.776 4.817 . 0 0 "[ . 1 .]" 1
540 1 39 GLY H 1 98 TYR HB3 . . 4.580 3.807 3.461 4.189 . 0 0 "[ . 1 .]" 1
541 1 39 GLY H 1 99 SER H . . 4.980 4.063 3.595 4.312 . 0 0 "[ . 1 .]" 1
542 1 39 GLY H 1 100 GLY HA2 . . 3.930 3.388 2.967 3.628 . 0 0 "[ . 1 .]" 1
543 1 39 GLY H 1 100 GLY HA3 . . 4.840 4.518 4.261 4.817 . 0 0 "[ . 1 .]" 1
544 1 39 GLY HA2 1 40 THR HA . . 5.100 4.792 4.682 4.845 . 0 0 "[ . 1 .]" 1
545 1 39 GLY HA2 1 80 ASP HB2 . . 4.850 4.671 4.037 4.889 0.039 6 0 "[ . 1 .]" 1
546 1 39 GLY HA2 1 80 ASP HB3 . . 4.850 4.230 3.826 4.460 . 0 0 "[ . 1 .]" 1
547 1 39 GLY HA2 1 81 LYS QD . . 5.500 5.045 4.805 5.210 . 0 0 "[ . 1 .]" 1
548 1 39 GLY HA2 1 98 TYR HA . . 5.150 4.718 4.340 5.038 . 0 0 "[ . 1 .]" 1
549 1 39 GLY HA2 1 98 TYR HB2 . . 4.320 3.830 3.540 4.092 . 0 0 "[ . 1 .]" 1
550 1 39 GLY HA2 1 98 TYR HB3 . . 3.570 2.514 2.281 2.734 . 0 0 "[ . 1 .]" 1
551 1 39 GLY HA2 1 98 TYR QD . . 4.340 3.511 3.340 3.830 . 0 0 "[ . 1 .]" 1
552 1 39 GLY HA3 1 98 TYR HB3 . . 4.580 4.161 3.703 4.400 . 0 0 "[ . 1 .]" 1
553 1 39 GLY HA3 1 98 TYR QD . . 4.430 4.453 4.339 4.490 0.060 6 0 "[ . 1 .]" 1
554 1 40 THR H 1 40 THR HB . . 3.020 2.702 2.528 2.819 . 0 0 "[ . 1 .]" 1
555 1 40 THR H 1 40 THR HG1 . . 3.250 2.279 2.162 2.487 . 0 0 "[ . 1 .]" 1
556 1 40 THR H 1 40 THR MG . . 3.910 3.852 3.806 3.880 . 0 0 "[ . 1 .]" 1
557 1 40 THR H 1 99 SER H . . 4.040 3.532 3.146 3.698 . 0 0 "[ . 1 .]" 1
558 1 40 THR H 1 99 SER QB . . 4.270 2.990 2.584 3.513 . 0 0 "[ . 1 .]" 1
559 1 40 THR HA 1 40 THR HG1 . . 3.780 3.168 3.053 3.397 . 0 0 "[ . 1 .]" 1
560 1 40 THR HA 1 40 THR MG . . 2.910 2.288 2.225 2.408 . 0 0 "[ . 1 .]" 1
561 1 40 THR HA 1 41 PRO HG2 . . 4.450 4.504 4.484 4.526 0.076 1 0 "[ . 1 .]" 1
562 1 40 THR HA 1 41 PRO HG3 . . 4.470 4.060 3.933 4.107 . 0 0 "[ . 1 .]" 1
563 1 40 THR HA 1 99 SER QB . . 5.340 4.770 4.428 5.339 . 0 0 "[ . 1 .]" 1
564 1 40 THR HA 1 144 ASP HB3 . . 5.500 5.142 4.759 5.543 0.043 7 0 "[ . 1 .]" 1
565 1 40 THR HB 1 99 SER H . . 4.020 3.385 3.173 3.629 . 0 0 "[ . 1 .]" 1
566 1 40 THR HG1 1 145 LEU QD . . 5.060 3.370 3.252 3.527 . 0 0 "[ . 1 .]" 1
567 1 40 THR MG 1 41 PRO HB2 . . 5.070 4.236 4.082 4.419 . 0 0 "[ . 1 .]" 1
568 1 40 THR MG 1 41 PRO HB3 . . 5.500 5.015 4.962 5.087 . 0 0 "[ . 1 .]" 1
569 1 40 THR MG 1 41 PRO HD2 . . 2.930 2.193 2.144 2.237 . 0 0 "[ . 1 .]" 1
570 1 40 THR MG 1 41 PRO HD3 . . 3.550 2.970 2.768 3.087 . 0 0 "[ . 1 .]" 1
571 1 40 THR MG 1 41 PRO HG2 . . 4.180 4.172 4.124 4.196 0.016 7 0 "[ . 1 .]" 1
572 1 40 THR MG 1 41 PRO HG3 . . 4.430 4.514 4.477 4.549 0.119 2 0 "[ . 1 .]" 1
573 1 40 THR MG 1 42 ILE HA . . 4.270 4.181 4.002 4.314 0.044 7 0 "[ . 1 .]" 1
574 1 40 THR MG 1 99 SER QB . . 4.510 3.844 3.615 4.227 . 0 0 "[ . 1 .]" 1
575 1 40 THR MG 1 143 TYR HA . . 3.540 3.560 3.442 3.599 0.059 5 0 "[ . 1 .]" 1
576 1 40 THR MG 1 143 TYR HB2 . . 3.250 2.460 2.306 2.619 . 0 0 "[ . 1 .]" 1
577 1 40 THR MG 1 143 TYR QD . . 3.850 3.665 3.298 3.864 0.014 2 0 "[ . 1 .]" 1
578 1 40 THR MG 1 144 ASP H . . 3.410 2.718 2.500 3.024 . 0 0 "[ . 1 .]" 1
579 1 40 THR MG 1 144 ASP HA . . 4.830 4.484 4.325 4.665 . 0 0 "[ . 1 .]" 1
580 1 40 THR MG 1 144 ASP HB2 . . 4.460 4.315 3.795 4.526 0.066 6 0 "[ . 1 .]" 1
581 1 40 THR MG 1 144 ASP HB3 . . 4.200 3.661 3.224 4.205 0.005 3 0 "[ . 1 .]" 1
582 1 40 THR MG 1 145 LEU HA . . 4.310 3.503 2.854 3.972 . 0 0 "[ . 1 .]" 1
583 1 40 THR MG 1 145 LEU QD . . 3.060 2.217 1.974 2.642 . 0 0 "[ . 1 .]" 1
584 1 40 THR MG 1 145 LEU HG . . 3.560 2.917 2.413 3.253 . 0 0 "[ . 1 .]" 1
585 1 41 PRO HA 1 42 ILE H . . 2.890 2.120 2.107 2.148 . 0 0 "[ . 1 .]" 1
586 1 41 PRO HA 1 42 ILE HB . . 5.110 4.568 4.491 4.665 . 0 0 "[ . 1 .]" 1
587 1 41 PRO HA 1 42 ILE MD . . 4.680 4.058 3.830 4.163 . 0 0 "[ . 1 .]" 1
588 1 41 PRO HA 1 95 ILE MD . . 4.850 3.789 3.622 3.937 . 0 0 "[ . 1 .]" 1
589 1 41 PRO HA 1 95 ILE MG . . 3.580 3.283 3.025 3.489 . 0 0 "[ . 1 .]" 1
590 1 41 PRO HA 1 98 TYR HA . . 3.400 2.727 2.634 2.864 . 0 0 "[ . 1 .]" 1
591 1 41 PRO HA 1 98 TYR HB3 . . 4.120 3.988 3.836 4.105 . 0 0 "[ . 1 .]" 1
592 1 41 PRO HA 1 98 TYR QD . . 3.480 2.521 2.427 2.668 . 0 0 "[ . 1 .]" 1
593 1 41 PRO HA 1 98 TYR QE . . 3.900 3.245 3.119 3.361 . 0 0 "[ . 1 .]" 1
594 1 41 PRO HB2 1 95 ILE MD . . 3.250 2.176 2.122 2.232 . 0 0 "[ . 1 .]" 1
595 1 41 PRO HB2 1 95 ILE HG13 . . 4.380 3.955 3.722 4.149 . 0 0 "[ . 1 .]" 1
596 1 41 PRO HB2 1 95 ILE MG . . 3.780 3.412 3.251 3.662 . 0 0 "[ . 1 .]" 1
597 1 41 PRO HB2 1 98 TYR QE . . 4.450 4.118 4.026 4.233 . 0 0 "[ . 1 .]" 1
598 1 41 PRO HB2 1 144 ASP H . . 5.020 3.553 3.367 3.869 . 0 0 "[ . 1 .]" 1
599 1 41 PRO HB2 1 144 ASP HB2 . . 3.790 2.737 2.280 3.086 . 0 0 "[ . 1 .]" 1
600 1 41 PRO HB2 1 144 ASP HB3 . . 4.140 2.934 2.367 3.754 . 0 0 "[ . 1 .]" 1
601 1 41 PRO HB3 1 42 ILE H . . 4.320 3.624 3.509 3.714 . 0 0 "[ . 1 .]" 1
602 1 41 PRO HB3 1 95 ILE MD . . 3.100 2.600 2.474 2.734 . 0 0 "[ . 1 .]" 1
603 1 41 PRO HB3 1 95 ILE HG13 . . 4.130 3.463 3.210 3.770 . 0 0 "[ . 1 .]" 1
604 1 41 PRO HB3 1 95 ILE MG . . 3.380 2.632 2.298 2.857 . 0 0 "[ . 1 .]" 1
605 1 41 PRO HB3 1 98 TYR HA . . 5.050 4.890 4.783 5.022 . 0 0 "[ . 1 .]" 1
606 1 41 PRO HB3 1 98 TYR QD . . 3.540 3.576 3.557 3.594 0.054 6 0 "[ . 1 .]" 1
607 1 41 PRO HB3 1 98 TYR QE . . 3.130 2.509 2.380 2.641 . 0 0 "[ . 1 .]" 1
608 1 41 PRO HB3 1 144 ASP HB3 . . 5.040 4.393 3.959 4.998 . 0 0 "[ . 1 .]" 1
609 1 41 PRO HD2 1 143 TYR HB2 . . 5.260 4.876 4.537 5.162 . 0 0 "[ . 1 .]" 1
610 1 41 PRO HD2 1 144 ASP H . . 4.050 3.157 2.940 3.345 . 0 0 "[ . 1 .]" 1
611 1 41 PRO HD2 1 144 ASP HB2 . . 4.470 3.528 2.581 3.980 . 0 0 "[ . 1 .]" 1
612 1 41 PRO HD2 1 144 ASP HB3 . . 3.690 2.476 2.138 2.997 . 0 0 "[ . 1 .]" 1
613 1 41 PRO HD3 1 98 TYR QD . . 4.090 3.636 3.474 3.868 . 0 0 "[ . 1 .]" 1
614 1 41 PRO HD3 1 98 TYR QE . . 4.050 4.057 3.889 4.089 0.039 14 0 "[ . 1 .]" 1
615 1 41 PRO HD3 1 144 ASP H . . 5.500 4.907 4.720 5.072 . 0 0 "[ . 1 .]" 1
616 1 41 PRO HD3 1 144 ASP HB2 . . 5.500 5.059 4.111 5.522 0.022 14 0 "[ . 1 .]" 1
617 1 41 PRO HD3 1 144 ASP HB3 . . 4.550 3.906 3.629 4.184 . 0 0 "[ . 1 .]" 1
618 1 41 PRO HG2 1 95 ILE MD . . 3.750 3.746 3.647 3.790 0.040 13 0 "[ . 1 .]" 1
619 1 41 PRO HG2 1 95 ILE MG . . 5.220 4.859 4.532 5.114 . 0 0 "[ . 1 .]" 1
620 1 41 PRO HG2 1 98 TYR QD . . 5.450 4.792 4.567 5.017 . 0 0 "[ . 1 .]" 1
621 1 41 PRO HG2 1 144 ASP HB2 . . 3.880 3.245 2.394 3.752 . 0 0 "[ . 1 .]" 1
622 1 41 PRO HG2 1 144 ASP HB3 . . 3.660 2.419 2.279 2.535 . 0 0 "[ . 1 .]" 1
623 1 41 PRO HG3 1 95 ILE MD . . 4.510 4.305 4.225 4.366 . 0 0 "[ . 1 .]" 1
624 1 41 PRO HG3 1 95 ILE MG . . 5.230 4.475 4.089 4.730 . 0 0 "[ . 1 .]" 1
625 1 41 PRO HG3 1 98 TYR QD . . 4.990 3.261 2.961 3.591 . 0 0 "[ . 1 .]" 1
626 1 41 PRO HG3 1 98 TYR QE . . 4.040 2.299 2.159 2.531 . 0 0 "[ . 1 .]" 1
627 1 41 PRO HG3 1 144 ASP HB3 . . 4.110 4.031 3.859 4.169 0.059 8 0 "[ . 1 .]" 1
628 1 42 ILE H 1 42 ILE HB . . 3.120 2.555 2.499 2.595 . 0 0 "[ . 1 .]" 1
629 1 42 ILE H 1 42 ILE MD . . 3.910 3.363 3.159 3.531 . 0 0 "[ . 1 .]" 1
630 1 42 ILE H 1 42 ILE HG12 . . 4.070 2.651 2.526 2.742 . 0 0 "[ . 1 .]" 1
631 1 42 ILE H 1 42 ILE QG . . 3.490 2.617 2.498 2.703 . 0 0 "[ . 1 .]" 1
632 1 42 ILE H 1 42 ILE HG13 . . 4.070 4.039 3.953 4.091 0.021 13 0 "[ . 1 .]" 1
633 1 42 ILE H 1 42 ILE MG . . 4.000 3.854 3.836 3.864 . 0 0 "[ . 1 .]" 1
634 1 42 ILE H 1 95 ILE MD . . 4.020 3.682 3.425 3.895 . 0 0 "[ . 1 .]" 1
635 1 42 ILE H 1 95 ILE MG . . 3.500 2.964 2.824 3.069 . 0 0 "[ . 1 .]" 1
636 1 42 ILE H 1 96 ILE H . . 4.680 4.179 4.036 4.302 . 0 0 "[ . 1 .]" 1
637 1 42 ILE H 1 97 ALA H . . 3.820 3.200 3.070 3.306 . 0 0 "[ . 1 .]" 1
638 1 42 ILE H 1 98 TYR HA . . 3.670 2.797 2.645 2.885 . 0 0 "[ . 1 .]" 1
639 1 42 ILE H 1 98 TYR HB2 . . 5.500 5.453 5.301 5.516 0.016 5 0 "[ . 1 .]" 1
640 1 42 ILE H 1 98 TYR QD . . 4.380 4.177 4.113 4.261 . 0 0 "[ . 1 .]" 1
641 1 42 ILE H 1 99 SER H . . 4.520 4.286 4.161 4.437 . 0 0 "[ . 1 .]" 1
642 1 42 ILE HA 1 42 ILE MD . . 3.130 2.252 2.199 2.332 . 0 0 "[ . 1 .]" 1
643 1 42 ILE HA 1 42 ILE QG . . 3.720 3.138 3.076 3.190 . 0 0 "[ . 1 .]" 1
644 1 42 ILE HA 1 42 ILE MG . . 3.070 2.435 2.375 2.520 . 0 0 "[ . 1 .]" 1
645 1 42 ILE HA 1 43 LYS H . . 3.000 2.195 2.144 2.227 . 0 0 "[ . 1 .]" 1
646 1 42 ILE HA 1 43 LYS HB2 . . 5.380 5.074 4.939 5.236 . 0 0 "[ . 1 .]" 1
647 1 42 ILE HA 1 43 LYS HB3 . . 5.500 5.485 5.430 5.534 0.034 5 0 "[ . 1 .]" 1
648 1 42 ILE HA 1 143 TYR HA . . 3.390 2.528 2.294 2.666 . 0 0 "[ . 1 .]" 1
649 1 42 ILE HB 1 43 LYS H . . 4.760 4.037 3.977 4.153 . 0 0 "[ . 1 .]" 1
650 1 42 ILE HB 1 96 ILE H . . 4.490 4.066 3.854 4.290 . 0 0 "[ . 1 .]" 1
651 1 42 ILE HB 1 96 ILE MD . . 4.750 3.788 3.613 4.004 . 0 0 "[ . 1 .]" 1
652 1 42 ILE HB 1 96 ILE HG13 . . 4.120 2.977 2.732 3.254 . 0 0 "[ . 1 .]" 1
653 1 42 ILE HB 1 97 ALA H . . 3.410 2.995 2.850 3.123 . 0 0 "[ . 1 .]" 1
654 1 42 ILE HB 1 98 TYR HA . . 4.900 3.817 3.492 4.063 . 0 0 "[ . 1 .]" 1
655 1 42 ILE MD 1 76 TYR QD . . 4.870 4.833 4.721 4.883 0.013 11 0 "[ . 1 .]" 1
656 1 42 ILE MD 1 98 TYR HA . . 4.210 3.825 3.509 4.062 . 0 0 "[ . 1 .]" 1
657 1 42 ILE MD 1 98 TYR QD . . 5.500 5.305 4.983 5.499 . 0 0 "[ . 1 .]" 1
658 1 42 ILE MD 1 99 SER H . . 3.940 3.120 2.871 3.328 . 0 0 "[ . 1 .]" 1
659 1 42 ILE MD 1 99 SER HA . . 4.040 3.869 3.532 4.031 . 0 0 "[ . 1 .]" 1
660 1 42 ILE MD 1 99 SER HB2 . . 3.550 2.250 2.065 3.593 0.043 12 0 "[ . 1 .]" 1
661 1 42 ILE MD 1 99 SER HB3 . . 3.550 3.304 2.036 3.570 0.020 14 0 "[ . 1 .]" 1
662 1 42 ILE MD 1 111 LEU HA . . 4.970 4.711 4.077 4.984 0.014 2 0 "[ . 1 .]" 1
663 1 42 ILE MD 1 111 LEU HB2 . . 3.740 2.799 2.440 2.963 . 0 0 "[ . 1 .]" 1
664 1 42 ILE MD 1 111 LEU HB3 . . 3.950 3.813 3.670 3.956 0.006 6 0 "[ . 1 .]" 1
665 1 42 ILE MD 1 143 TYR HA . . 3.720 3.040 2.644 3.368 . 0 0 "[ . 1 .]" 1
666 1 42 ILE MD 1 143 TYR HB2 . . 4.050 3.188 2.897 3.611 . 0 0 "[ . 1 .]" 1
667 1 42 ILE MD 1 143 TYR HB3 . . 3.360 2.544 2.180 2.993 . 0 0 "[ . 1 .]" 1
668 1 42 ILE MD 1 143 TYR QD . . 4.430 3.859 2.844 4.377 . 0 0 "[ . 1 .]" 1
669 1 42 ILE MD 1 144 ASP H . . 4.180 3.817 3.509 4.154 . 0 0 "[ . 1 .]" 1
670 1 42 ILE QG 1 98 TYR HA . . 3.530 2.442 2.251 2.630 . 0 0 "[ . 1 .]" 1
671 1 42 ILE QG 1 99 SER H . . 3.740 2.537 2.350 2.730 . 0 0 "[ . 1 .]" 1
672 1 42 ILE HG12 1 42 ILE MG . . 3.610 3.218 3.209 3.229 . 0 0 "[ . 1 .]" 1
673 1 42 ILE HG13 1 42 ILE MG . . 3.610 2.275 2.257 2.306 . 0 0 "[ . 1 .]" 1
674 1 42 ILE MG 1 43 LYS H . . 3.240 2.512 2.459 2.668 . 0 0 "[ . 1 .]" 1
675 1 42 ILE MG 1 45 PRO HD3 . . 4.730 4.665 4.538 4.750 0.020 8 0 "[ . 1 .]" 1
676 1 42 ILE MG 1 76 TYR QD . . 3.300 2.624 2.508 2.749 . 0 0 "[ . 1 .]" 1
677 1 42 ILE MG 1 76 TYR QE . . 3.540 3.126 2.994 3.440 . 0 0 "[ . 1 .]" 1
678 1 42 ILE MG 1 96 ILE H . . 4.510 4.163 3.997 4.249 . 0 0 "[ . 1 .]" 1
679 1 42 ILE MG 1 96 ILE MD . . 3.170 2.235 2.135 2.325 . 0 0 "[ . 1 .]" 1
680 1 42 ILE MG 1 98 TYR HA . . 5.260 5.009 4.795 5.176 . 0 0 "[ . 1 .]" 1
681 1 42 ILE MG 1 142 LEU QD . . 3.660 3.313 3.182 3.564 . 0 0 "[ . 1 .]" 1
682 1 42 ILE MG 1 143 TYR HA . . 4.190 4.005 3.881 4.098 . 0 0 "[ . 1 .]" 1
683 1 42 ILE MG 1 143 TYR HB3 . . 4.140 3.979 3.636 4.143 0.003 7 0 "[ . 1 .]" 1
684 1 43 LYS H 1 43 LYS HB2 . . 3.580 3.123 3.035 3.240 . 0 0 "[ . 1 .]" 1
685 1 43 LYS H 1 43 LYS HB3 . . 3.870 3.843 3.812 3.873 0.003 10 0 "[ . 1 .]" 1
686 1 43 LYS H 1 43 LYS HG2 . . 4.450 3.165 2.967 3.285 . 0 0 "[ . 1 .]" 1
687 1 43 LYS H 1 43 LYS HG3 . . 3.480 2.426 2.305 2.614 . 0 0 "[ . 1 .]" 1
688 1 43 LYS H 1 44 ALA H . . 4.580 4.525 4.505 4.552 . 0 0 "[ . 1 .]" 1
689 1 43 LYS H 1 143 TYR HA . . 3.750 3.266 3.071 3.578 . 0 0 "[ . 1 .]" 1
690 1 43 LYS H 1 143 TYR HB3 . . 5.210 4.631 4.179 4.988 . 0 0 "[ . 1 .]" 1
691 1 43 LYS HA 1 43 LYS HD2 . . 4.560 4.389 4.144 4.521 . 0 0 "[ . 1 .]" 1
692 1 43 LYS HA 1 43 LYS HG2 . . 3.510 3.013 2.813 3.125 . 0 0 "[ . 1 .]" 1
693 1 43 LYS HA 1 43 LYS HG3 . . 3.880 3.653 3.555 3.749 . 0 0 "[ . 1 .]" 1
694 1 43 LYS HA 1 44 ALA H . . 2.800 2.271 2.237 2.304 . 0 0 "[ . 1 .]" 1
695 1 43 LYS HA 1 44 ALA MB . . 4.150 4.084 4.055 4.117 . 0 0 "[ . 1 .]" 1
696 1 43 LYS HA 1 93 GLY H . . 5.500 5.088 4.898 5.243 . 0 0 "[ . 1 .]" 1
697 1 43 LYS HA 1 94 ASP H . . 4.520 4.608 4.568 4.669 0.149 14 0 "[ . 1 .]" 1
698 1 43 LYS HA 1 95 ILE H . . 4.410 4.410 4.332 4.458 0.048 12 0 "[ . 1 .]" 1
699 1 43 LYS HA 1 95 ILE HA . . 3.260 2.371 2.297 2.437 . 0 0 "[ . 1 .]" 1
700 1 43 LYS HA 1 95 ILE MD . . 3.290 3.263 3.116 3.327 0.037 3 0 "[ . 1 .]" 1
701 1 43 LYS HA 1 95 ILE MG . . 4.260 4.105 3.993 4.179 . 0 0 "[ . 1 .]" 1
702 1 43 LYS HA 1 96 ILE H . . 3.840 2.662 2.512 2.789 . 0 0 "[ . 1 .]" 1
703 1 43 LYS HA 1 96 ILE MD . . 4.390 3.911 3.762 4.103 . 0 0 "[ . 1 .]" 1
704 1 43 LYS HA 1 96 ILE HG12 . . 4.610 2.630 2.484 2.960 . 0 0 "[ . 1 .]" 1
705 1 43 LYS HA 1 96 ILE HG13 . . 4.620 4.187 3.977 4.602 . 0 0 "[ . 1 .]" 1
706 1 43 LYS HA 1 96 ILE MG . . 3.760 3.274 3.203 3.365 . 0 0 "[ . 1 .]" 1
707 1 43 LYS HA 1 97 ALA H . . 4.580 4.486 4.294 4.605 0.025 13 0 "[ . 1 .]" 1
708 1 43 LYS HB2 1 43 LYS HE2 . . 4.100 3.317 3.110 3.571 . 0 0 "[ . 1 .]" 1
709 1 43 LYS HB2 1 43 LYS HE3 . . 3.520 2.378 2.093 2.667 . 0 0 "[ . 1 .]" 1
710 1 43 LYS HB2 1 44 ALA H . . 3.510 3.376 3.277 3.518 0.008 8 0 "[ . 1 .]" 1
711 1 43 LYS HB2 1 93 GLY HA2 . . 3.580 2.915 2.644 3.264 . 0 0 "[ . 1 .]" 1
712 1 43 LYS HB2 1 93 GLY HA3 . . 4.990 4.654 4.395 4.998 0.008 3 0 "[ . 1 .]" 1
713 1 43 LYS HB3 1 43 LYS HE2 . . 4.610 4.237 4.024 4.405 . 0 0 "[ . 1 .]" 1
714 1 43 LYS HB3 1 43 LYS HE3 . . 4.010 3.316 3.055 3.790 . 0 0 "[ . 1 .]" 1
715 1 43 LYS HB3 1 44 ALA H . . 4.470 2.926 2.869 3.052 . 0 0 "[ . 1 .]" 1
716 1 43 LYS HB3 1 93 GLY HA2 . . 3.740 2.808 2.544 3.099 . 0 0 "[ . 1 .]" 1
717 1 43 LYS HB3 1 93 GLY HA3 . . 4.590 4.233 4.020 4.515 . 0 0 "[ . 1 .]" 1
718 1 43 LYS HB3 1 94 ASP H . . 3.660 3.715 3.672 3.765 0.105 3 0 "[ . 1 .]" 1
719 1 43 LYS HB3 1 95 ILE H . . 4.280 4.317 4.284 4.349 0.069 7 0 "[ . 1 .]" 1
720 1 43 LYS HB3 1 95 ILE HA . . 4.190 3.480 3.343 3.583 . 0 0 "[ . 1 .]" 1
721 1 43 LYS HB3 1 95 ILE MD . . 4.160 3.001 2.848 3.141 . 0 0 "[ . 1 .]" 1
722 1 43 LYS HD2 1 93 GLY HA2 . . 4.450 3.080 2.814 3.566 . 0 0 "[ . 1 .]" 1
723 1 43 LYS HD2 1 141 SER HA . . 4.960 4.916 4.582 5.051 0.091 15 0 "[ . 1 .]" 1
724 1 43 LYS HD3 1 93 GLY HA2 . . 5.080 4.696 4.466 5.088 0.008 3 0 "[ . 1 .]" 1
725 1 43 LYS HD3 1 141 SER HA . . 5.290 5.246 5.031 5.358 0.068 1 0 "[ . 1 .]" 1
726 1 43 LYS HD3 1 144 ASP HB2 . . 4.230 2.881 2.352 3.520 . 0 0 "[ . 1 .]" 1
727 1 43 LYS HE2 1 43 LYS HG3 . . 3.720 2.381 2.130 2.587 . 0 0 "[ . 1 .]" 1
728 1 43 LYS HE2 1 141 SER HA . . 4.350 3.154 2.765 3.702 . 0 0 "[ . 1 .]" 1
729 1 43 LYS HE2 1 143 TYR H . . 4.260 3.100 2.491 3.748 . 0 0 "[ . 1 .]" 1
730 1 43 LYS HE2 1 143 TYR HA . . 5.360 3.881 3.204 4.516 . 0 0 "[ . 1 .]" 1
731 1 43 LYS HE2 1 144 ASP HA . . 4.350 4.204 3.858 4.390 0.040 15 0 "[ . 1 .]" 1
732 1 43 LYS HE3 1 43 LYS HG3 . . 4.070 2.947 2.784 3.202 . 0 0 "[ . 1 .]" 1
733 1 43 LYS HE3 1 141 SER HA . . 3.750 2.550 2.386 2.725 . 0 0 "[ . 1 .]" 1
734 1 43 LYS HE3 1 141 SER QB . . 4.700 4.185 3.902 4.547 . 0 0 "[ . 1 .]" 1
735 1 43 LYS HE3 1 143 TYR HA . . 5.500 5.204 4.811 5.529 0.029 9 0 "[ . 1 .]" 1
736 1 43 LYS HG2 1 144 ASP HB2 . . 4.480 3.665 3.123 4.092 . 0 0 "[ . 1 .]" 1
737 1 43 LYS HG3 1 143 TYR H . . 4.420 3.704 3.443 4.125 . 0 0 "[ . 1 .]" 1
738 1 43 LYS HG3 1 144 ASP HB2 . . 4.220 4.070 3.613 4.268 0.048 8 0 "[ . 1 .]" 1
739 1 44 ALA H 1 44 ALA MB . . 2.740 2.249 2.219 2.275 . 0 0 "[ . 1 .]" 1
740 1 44 ALA H 1 93 GLY H . . 4.040 3.509 3.302 3.670 . 0 0 "[ . 1 .]" 1
741 1 44 ALA H 1 94 ASP HB3 . . 4.450 4.204 3.873 4.461 0.011 1 0 "[ . 1 .]" 1
742 1 44 ALA H 1 95 ILE HA . . 4.150 4.067 3.975 4.158 0.008 6 0 "[ . 1 .]" 1
743 1 44 ALA H 1 96 ILE HB . . 5.500 5.369 5.272 5.463 . 0 0 "[ . 1 .]" 1
744 1 44 ALA H 1 96 ILE MD . . 4.180 3.580 3.367 3.714 . 0 0 "[ . 1 .]" 1
745 1 44 ALA H 1 96 ILE HG12 . . 4.530 3.256 3.038 3.549 . 0 0 "[ . 1 .]" 1
746 1 44 ALA H 1 96 ILE HG13 . . 5.500 5.008 4.798 5.279 . 0 0 "[ . 1 .]" 1
747 1 44 ALA H 1 96 ILE MG . . 3.250 2.577 2.491 2.646 . 0 0 "[ . 1 .]" 1
748 1 44 ALA HA 1 45 PRO HD2 . . 3.200 2.226 2.172 2.308 . 0 0 "[ . 1 .]" 1
749 1 44 ALA HA 1 45 PRO HD3 . . 3.340 2.452 2.326 2.526 . 0 0 "[ . 1 .]" 1
750 1 44 ALA HA 1 45 PRO HG3 . . 4.570 4.559 4.505 4.581 0.011 7 0 "[ . 1 .]" 1
751 1 44 ALA HA 1 65 ILE MD . . 4.430 3.762 3.366 4.024 . 0 0 "[ . 1 .]" 1
752 1 44 ALA HA 1 76 TYR QE . . 4.600 4.118 3.830 4.356 . 0 0 "[ . 1 .]" 1
753 1 44 ALA HA 1 96 ILE MD . . 3.180 2.577 2.433 2.709 . 0 0 "[ . 1 .]" 1
754 1 44 ALA MB 1 45 PRO HG3 . . 5.390 5.309 5.139 5.387 . 0 0 "[ . 1 .]" 1
755 1 44 ALA MB 1 46 THR H . . 3.450 3.112 2.796 3.274 . 0 0 "[ . 1 .]" 1
756 1 44 ALA MB 1 47 ASN HA . . 4.520 3.988 3.853 4.128 . 0 0 "[ . 1 .]" 1
757 1 44 ALA MB 1 48 GLY H . . 3.790 3.811 3.523 3.852 0.062 9 0 "[ . 1 .]" 1
758 1 44 ALA MB 1 90 VAL HB . . 3.110 2.921 2.703 3.096 . 0 0 "[ . 1 .]" 1
759 1 44 ALA MB 1 90 VAL MG1 . . 3.680 3.536 3.400 3.684 0.004 6 0 "[ . 1 .]" 1
760 1 44 ALA MB 1 90 VAL MG2 . . 2.710 2.276 2.183 2.363 . 0 0 "[ . 1 .]" 1
761 1 44 ALA MB 1 91 LYS H . . 3.880 3.844 3.496 3.923 0.043 5 0 "[ . 1 .]" 1
762 1 44 ALA MB 1 92 ALA H . . 4.580 4.374 4.164 4.469 . 0 0 "[ . 1 .]" 1
763 1 44 ALA MB 1 92 ALA HA . . 3.120 2.978 2.744 3.135 0.015 8 0 "[ . 1 .]" 1
764 1 44 ALA MB 1 93 GLY H . . 3.320 2.908 2.716 3.127 . 0 0 "[ . 1 .]" 1
765 1 44 ALA MB 1 94 ASP H . . 3.830 2.882 2.651 3.128 . 0 0 "[ . 1 .]" 1
766 1 44 ALA MB 1 94 ASP HB2 . . 4.070 3.421 2.721 4.089 0.019 13 0 "[ . 1 .]" 1
767 1 44 ALA MB 1 94 ASP HB3 . . 4.200 3.843 3.477 4.206 0.006 1 0 "[ . 1 .]" 1
768 1 44 ALA MB 1 96 ILE MD . . 3.090 2.952 2.718 3.107 0.017 2 0 "[ . 1 .]" 1
769 1 44 ALA MB 1 96 ILE MG . . 2.450 2.190 2.094 2.304 . 0 0 "[ . 1 .]" 1
770 1 45 PRO HA 1 135 LEU MD1 . . 3.910 3.123 2.969 3.310 . 0 0 "[ . 1 .]" 1
771 1 45 PRO HA 1 135 LEU MD2 . . 3.670 3.575 3.424 3.691 0.021 14 0 "[ . 1 .]" 1
772 1 45 PRO HA 1 141 SER H . . 5.500 5.567 5.518 5.624 0.124 5 0 "[ . 1 .]" 1
773 1 45 PRO HA 1 141 SER QB . . 3.740 2.373 2.147 3.154 . 0 0 "[ . 1 .]" 1
774 1 45 PRO HB2 1 46 THR H . . 3.470 3.376 3.268 3.492 0.022 12 0 "[ . 1 .]" 1
775 1 45 PRO HB2 1 46 THR MG . . 3.070 2.514 2.416 2.605 . 0 0 "[ . 1 .]" 1
776 1 45 PRO HB2 1 74 GLN QE . . 4.600 4.432 4.262 4.601 0.001 14 0 "[ . 1 .]" 1
777 1 45 PRO HB2 1 113 PHE QE . . 5.250 5.115 4.974 5.254 0.004 2 0 "[ . 1 .]" 1
778 1 45 PRO HB2 1 131 PHE QE . . 3.850 3.426 3.148 3.684 . 0 0 "[ . 1 .]" 1
779 1 45 PRO HB2 1 131 PHE HZ . . 3.630 3.279 2.874 3.547 . 0 0 "[ . 1 .]" 1
780 1 45 PRO HB2 1 135 LEU MD1 . . 3.320 2.315 2.212 2.511 . 0 0 "[ . 1 .]" 1
781 1 45 PRO HB2 1 135 LEU MD2 . . 3.140 2.446 2.297 2.575 . 0 0 "[ . 1 .]" 1
782 1 45 PRO HB3 1 46 THR H . . 4.280 4.122 4.052 4.212 . 0 0 "[ . 1 .]" 1
783 1 45 PRO HB3 1 46 THR MG . . 4.080 4.072 3.992 4.116 0.036 5 0 "[ . 1 .]" 1
784 1 45 PRO HB3 1 113 PHE HZ . . 5.220 4.938 4.760 5.237 0.017 7 0 "[ . 1 .]" 1
785 1 45 PRO HB3 1 131 PHE QE . . 5.120 4.018 3.635 4.358 . 0 0 "[ . 1 .]" 1
786 1 45 PRO HB3 1 131 PHE HZ . . 4.990 4.658 4.277 4.904 . 0 0 "[ . 1 .]" 1
787 1 45 PRO HB3 1 135 LEU MD1 . . 3.310 2.371 2.276 2.475 . 0 0 "[ . 1 .]" 1
788 1 45 PRO HB3 1 135 LEU MD2 . . 3.560 3.551 3.372 3.593 0.033 1 0 "[ . 1 .]" 1
789 1 45 PRO HB3 1 141 SER HA . . 5.500 5.521 5.455 5.559 0.059 7 0 "[ . 1 .]" 1
790 1 45 PRO HB3 1 141 SER QB . . 3.620 3.145 2.986 3.324 . 0 0 "[ . 1 .]" 1
791 1 45 PRO HB3 1 142 LEU QD . . 3.260 1.996 1.933 2.131 . 0 0 "[ . 1 .]" 1
792 1 45 PRO HB3 1 142 LEU HG . . 4.630 4.392 2.323 4.647 0.017 12 0 "[ . 1 .]" 1
793 1 45 PRO HD2 1 46 THR H . . 2.940 2.560 2.428 2.644 . 0 0 "[ . 1 .]" 1
794 1 45 PRO HD2 1 96 ILE MD . . 4.070 3.951 3.786 4.083 0.013 9 0 "[ . 1 .]" 1
795 1 45 PRO HD2 1 142 LEU QD . . 3.770 3.567 3.525 3.898 0.128 11 0 "[ . 1 .]" 1
796 1 45 PRO HD3 1 46 THR H . . 4.030 3.778 3.725 3.826 . 0 0 "[ . 1 .]" 1
797 1 45 PRO HD3 1 46 THR MG . . 5.500 5.196 4.915 5.310 . 0 0 "[ . 1 .]" 1
798 1 45 PRO HD3 1 76 TYR QE . . 4.120 3.197 2.764 3.453 . 0 0 "[ . 1 .]" 1
799 1 45 PRO HD3 1 96 ILE MD . . 4.150 3.799 3.690 3.910 . 0 0 "[ . 1 .]" 1
800 1 45 PRO HD3 1 96 ILE HG12 . . 5.500 5.534 5.504 5.565 0.065 9 0 "[ . 1 .]" 1
801 1 45 PRO HD3 1 142 LEU QD . . 3.310 2.203 2.134 2.838 . 0 0 "[ . 1 .]" 1
802 1 45 PRO HD3 1 142 LEU HG . . 5.500 4.990 2.524 5.268 . 0 0 "[ . 1 .]" 1
803 1 45 PRO HG2 1 46 THR H . . 3.410 2.440 2.288 2.666 . 0 0 "[ . 1 .]" 1
804 1 45 PRO HG2 1 46 THR MG . . 3.130 2.738 2.397 2.910 . 0 0 "[ . 1 .]" 1
805 1 45 PRO HG2 1 74 GLN QE . . 4.080 2.498 2.268 2.651 . 0 0 "[ . 1 .]" 1
806 1 45 PRO HG2 1 113 PHE HZ . . 4.760 3.681 3.279 3.987 . 0 0 "[ . 1 .]" 1
807 1 45 PRO HG2 1 131 PHE QE . . 4.110 3.525 3.152 3.958 . 0 0 "[ . 1 .]" 1
808 1 45 PRO HG2 1 131 PHE HZ . . 3.920 2.868 2.457 3.097 . 0 0 "[ . 1 .]" 1
809 1 45 PRO HG2 1 142 LEU MD1 . . 4.520 3.835 3.718 4.198 . 0 0 "[ . 1 .]" 1
810 1 45 PRO HG2 1 142 LEU QD . . 3.770 3.572 3.527 3.615 . 0 0 "[ . 1 .]" 1
811 1 45 PRO HG2 1 142 LEU MD2 . . 4.520 4.290 3.943 4.428 . 0 0 "[ . 1 .]" 1
812 1 45 PRO HG3 1 46 THR H . . 4.510 3.926 3.812 4.081 . 0 0 "[ . 1 .]" 1
813 1 45 PRO HG3 1 46 THR MG . . 4.530 4.044 3.831 4.188 . 0 0 "[ . 1 .]" 1
814 1 45 PRO HG3 1 113 PHE QD . . 5.030 4.652 4.502 4.866 . 0 0 "[ . 1 .]" 1
815 1 45 PRO HG3 1 113 PHE HZ . . 4.050 2.951 2.683 3.307 . 0 0 "[ . 1 .]" 1
816 1 45 PRO HG3 1 131 PHE QE . . 4.320 3.119 2.694 3.408 . 0 0 "[ . 1 .]" 1
817 1 45 PRO HG3 1 131 PHE HZ . . 5.300 3.726 3.229 4.063 . 0 0 "[ . 1 .]" 1
818 1 45 PRO HG3 1 142 LEU QB . . 5.500 5.335 4.845 5.439 . 0 0 "[ . 1 .]" 1
819 1 45 PRO HG3 1 142 LEU MD1 . . 3.720 2.417 2.297 2.951 . 0 0 "[ . 1 .]" 1
820 1 45 PRO HG3 1 142 LEU QD . . 3.040 2.305 2.241 2.363 . 0 0 "[ . 1 .]" 1
821 1 45 PRO HG3 1 142 LEU MD2 . . 3.720 3.098 2.321 3.340 . 0 0 "[ . 1 .]" 1
822 1 45 PRO HG3 1 142 LEU HG . . 4.880 4.639 2.966 4.837 . 0 0 "[ . 1 .]" 1
823 1 46 THR H 1 46 THR HB . . 3.970 3.820 3.685 3.981 0.011 6 0 "[ . 1 .]" 1
824 1 46 THR H 1 46 THR MG . . 3.400 2.922 2.778 3.089 . 0 0 "[ . 1 .]" 1
825 1 46 THR H 1 47 ASN H . . 4.480 4.477 4.421 4.511 0.031 11 0 "[ . 1 .]" 1
826 1 46 THR H 1 74 GLN QE . . 4.030 3.389 3.197 3.782 . 0 0 "[ . 1 .]" 1
827 1 46 THR H 1 92 ALA HA . . 4.070 3.721 3.421 4.002 . 0 0 "[ . 1 .]" 1
828 1 46 THR H 1 92 ALA MB . . 4.100 3.985 3.839 4.109 0.009 7 0 "[ . 1 .]" 1
829 1 46 THR H 1 93 GLY H . . 5.500 4.863 4.618 5.232 . 0 0 "[ . 1 .]" 1
830 1 46 THR H 1 131 PHE QE . . 5.500 5.356 5.072 5.532 0.032 12 0 "[ . 1 .]" 1
831 1 46 THR H 1 131 PHE HZ . . 4.880 4.491 4.144 4.691 . 0 0 "[ . 1 .]" 1
832 1 46 THR H 1 142 LEU MD1 . . 5.500 5.138 4.943 5.540 0.040 11 0 "[ . 1 .]" 1
833 1 46 THR H 1 142 LEU MD2 . . 5.500 5.530 5.451 5.551 0.051 11 0 "[ . 1 .]" 1
834 1 46 THR HA 1 46 THR MG . . 2.900 2.449 2.341 2.622 . 0 0 "[ . 1 .]" 1
835 1 46 THR HA 1 47 ASN H . . 2.790 2.426 2.349 2.516 . 0 0 "[ . 1 .]" 1
836 1 46 THR HA 1 92 ALA MB . . 2.960 2.274 2.123 2.453 . 0 0 "[ . 1 .]" 1
837 1 46 THR HA 1 135 LEU MD2 . . 4.660 4.076 3.961 4.253 . 0 0 "[ . 1 .]" 1
838 1 46 THR HB 1 47 ASN H . . 3.000 2.549 2.411 2.836 . 0 0 "[ . 1 .]" 1
839 1 46 THR HB 1 92 ALA MB . . 4.460 4.223 3.950 4.467 0.007 7 0 "[ . 1 .]" 1
840 1 46 THR HB 1 131 PHE QE . . 5.500 4.624 4.373 4.927 . 0 0 "[ . 1 .]" 1
841 1 46 THR MG 1 47 ASN H . . 4.160 3.848 3.686 4.130 . 0 0 "[ . 1 .]" 1
842 1 46 THR MG 1 67 GLU QG . . 4.350 4.270 4.014 4.396 0.046 5 0 "[ . 1 .]" 1
843 1 46 THR MG 1 74 GLN HE21 . . 3.830 3.775 3.345 3.862 0.032 6 0 "[ . 1 .]" 1
844 1 46 THR MG 1 74 GLN QE . . 3.210 3.114 2.645 3.256 0.046 11 0 "[ . 1 .]" 1
845 1 46 THR MG 1 74 GLN HE22 . . 3.830 3.326 2.771 3.632 . 0 0 "[ . 1 .]" 1
846 1 46 THR MG 1 131 PHE QE . . 3.000 2.337 2.229 2.480 . 0 0 "[ . 1 .]" 1
847 1 46 THR MG 1 131 PHE HZ . . 2.840 2.169 2.116 2.240 . 0 0 "[ . 1 .]" 1
848 1 46 THR MG 1 135 LEU MD2 . . 3.270 2.411 2.202 2.730 . 0 0 "[ . 1 .]" 1
849 1 47 ASN H 1 47 ASN HB2 . . 3.050 2.523 2.383 2.598 . 0 0 "[ . 1 .]" 1
850 1 47 ASN H 1 47 ASN HB3 . . 3.600 3.605 3.548 3.635 0.035 11 0 "[ . 1 .]" 1
851 1 47 ASN H 1 47 ASN HD21 . . 4.340 3.965 3.209 4.392 0.052 6 0 "[ . 1 .]" 1
852 1 47 ASN H 1 47 ASN HD22 . . 4.340 4.215 3.798 4.437 0.097 6 0 "[ . 1 .]" 1
853 1 47 ASN H 1 91 LYS HA . . 4.870 4.730 4.381 4.895 0.025 13 0 "[ . 1 .]" 1
854 1 47 ASN H 1 92 ALA H . . 4.010 3.822 3.557 4.019 0.009 7 0 "[ . 1 .]" 1
855 1 47 ASN H 1 92 ALA MB . . 3.430 2.879 2.556 3.170 . 0 0 "[ . 1 .]" 1
856 1 47 ASN HA 1 48 GLY H . . 2.810 2.179 2.077 2.323 . 0 0 "[ . 1 .]" 1
857 1 47 ASN HA 1 48 GLY HA2 . . 4.660 4.507 4.439 4.582 . 0 0 "[ . 1 .]" 1
858 1 47 ASN HA 1 90 VAL MG2 . . 3.560 3.517 3.395 3.593 0.033 4 0 "[ . 1 .]" 1
859 1 47 ASN HA 1 91 LYS QG . . 4.820 4.527 4.064 4.979 0.159 13 0 "[ . 1 .]" 1
860 1 47 ASN HA 1 92 ALA MB . . 4.050 3.723 3.532 4.047 . 0 0 "[ . 1 .]" 1
861 1 47 ASN HB2 1 47 ASN HD22 . . 3.690 3.556 3.485 3.664 . 0 0 "[ . 1 .]" 1
862 1 47 ASN HB2 1 48 GLY H . . 4.360 4.280 4.186 4.389 0.029 12 0 "[ . 1 .]" 1
863 1 47 ASN HB2 1 48 GLY HA2 . . 4.890 4.793 4.472 4.928 0.038 12 0 "[ . 1 .]" 1
864 1 47 ASN HB2 1 91 LYS HA . . 4.640 4.628 4.467 4.710 0.070 10 0 "[ . 1 .]" 1
865 1 47 ASN HB2 1 92 ALA H . . 4.800 4.683 4.494 4.819 0.019 2 0 "[ . 1 .]" 1
866 1 47 ASN HB3 1 47 ASN HD22 . . 3.840 3.734 3.567 3.888 0.048 12 0 "[ . 1 .]" 1
867 1 47 ASN HB3 1 48 GLY H . . 4.000 3.484 3.291 4.038 0.038 12 0 "[ . 1 .]" 1
868 1 47 ASN HB3 1 90 VAL MG2 . . 5.100 5.040 4.855 5.125 0.025 8 0 "[ . 1 .]" 1
869 1 47 ASN HB3 1 91 LYS HA . . 4.190 3.441 3.232 3.634 . 0 0 "[ . 1 .]" 1
870 1 47 ASN HB3 1 92 ALA H . . 4.450 4.258 3.931 4.451 0.001 3 0 "[ . 1 .]" 1
871 1 47 ASN HB3 1 92 ALA MB . . 5.390 4.909 4.722 5.105 . 0 0 "[ . 1 .]" 1
872 1 48 GLY H 1 65 ILE MD . . 5.120 5.084 4.673 5.141 0.021 5 0 "[ . 1 .]" 1
873 1 48 GLY H 1 90 VAL HB . . 4.660 4.362 4.210 4.525 . 0 0 "[ . 1 .]" 1
874 1 48 GLY H 1 90 VAL MG2 . . 2.820 2.150 1.976 2.298 . 0 0 "[ . 1 .]" 1
875 1 48 GLY H 1 91 LYS HA . . 3.930 3.705 3.459 3.974 0.044 12 0 "[ . 1 .]" 1
876 1 48 GLY H 1 92 ALA H . . 5.180 4.889 4.750 5.048 . 0 0 "[ . 1 .]" 1
877 1 48 GLY H 1 92 ALA HA . . 5.500 5.561 5.511 5.605 0.105 6 0 "[ . 1 .]" 1
878 1 48 GLY H 1 92 ALA MB . . 5.500 5.436 5.311 5.508 0.008 14 0 "[ . 1 .]" 1
879 1 48 GLY HA2 1 49 LYS H . . 3.060 2.624 2.556 2.706 . 0 0 "[ . 1 .]" 1
880 1 48 GLY HA2 1 49 LYS HA . . 4.800 4.625 4.570 4.687 . 0 0 "[ . 1 .]" 1
881 1 48 GLY HA2 1 49 LYS QB . . 4.150 3.955 3.707 4.076 . 0 0 "[ . 1 .]" 1
882 1 48 GLY HA2 1 65 ILE MG . . 3.550 3.515 3.305 3.567 0.017 14 0 "[ . 1 .]" 1
883 1 48 GLY HA2 1 90 VAL MG2 . . 4.230 4.024 3.885 4.182 . 0 0 "[ . 1 .]" 1
884 1 48 GLY HA3 1 49 LYS H . . 3.110 2.440 2.284 2.573 . 0 0 "[ . 1 .]" 1
885 1 48 GLY HA3 1 49 LYS HA . . 4.350 4.376 4.354 4.401 0.051 4 0 "[ . 1 .]" 1
886 1 48 GLY HA3 1 49 LYS QB . . 4.600 4.478 4.228 4.610 0.010 13 0 "[ . 1 .]" 1
887 1 48 GLY HA3 1 65 ILE HA . . 5.500 5.372 5.216 5.453 . 0 0 "[ . 1 .]" 1
888 1 48 GLY HA3 1 65 ILE HB . . 4.850 4.774 4.550 4.873 0.023 7 0 "[ . 1 .]" 1
889 1 48 GLY HA3 1 65 ILE MG . . 3.170 2.309 2.171 2.358 . 0 0 "[ . 1 .]" 1
890 1 48 GLY HA3 1 90 VAL MG2 . . 3.920 3.102 2.857 3.322 . 0 0 "[ . 1 .]" 1
891 1 49 LYS H 1 49 LYS QB . . 3.030 2.617 2.540 2.678 . 0 0 "[ . 1 .]" 1
892 1 49 LYS H 1 49 LYS QG . . 4.590 4.125 4.049 4.183 . 0 0 "[ . 1 .]" 1
893 1 49 LYS H 1 50 VAL HA . . 5.060 4.821 4.749 4.904 . 0 0 "[ . 1 .]" 1
894 1 49 LYS H 1 50 VAL MG2 . . 5.280 5.147 5.053 5.227 . 0 0 "[ . 1 .]" 1
895 1 49 LYS H 1 51 THR MG . . 5.000 4.183 4.070 4.356 . 0 0 "[ . 1 .]" 1
896 1 49 LYS H 1 65 ILE HA . . 4.280 4.173 3.954 4.293 0.013 13 0 "[ . 1 .]" 1
897 1 49 LYS H 1 65 ILE MG . . 3.000 2.339 2.120 2.536 . 0 0 "[ . 1 .]" 1
898 1 49 LYS H 1 66 ALA H . . 3.320 2.950 2.641 3.066 . 0 0 "[ . 1 .]" 1
899 1 49 LYS H 1 66 ALA MB . . 3.980 3.607 3.391 3.956 . 0 0 "[ . 1 .]" 1
900 1 49 LYS H 1 89 ARG QD . . 4.950 4.543 4.194 4.950 . 14 0 "[ . 1 .]" 1
901 1 49 LYS HA 1 49 LYS QD . . 4.310 4.010 3.931 4.144 . 0 0 "[ . 1 .]" 1
902 1 49 LYS HA 1 49 LYS QE . . 5.080 4.645 4.392 4.868 . 0 0 "[ . 1 .]" 1
903 1 49 LYS HA 1 49 LYS QG . . 3.190 2.475 2.278 2.623 . 0 0 "[ . 1 .]" 1
904 1 49 LYS HA 1 50 VAL H . . 2.770 2.220 2.157 2.275 . 0 0 "[ . 1 .]" 1
905 1 49 LYS HA 1 50 VAL HB . . 5.090 4.989 4.917 5.069 . 0 0 "[ . 1 .]" 1
906 1 49 LYS HA 1 50 VAL MG2 . . 3.620 3.598 3.491 3.639 0.019 4 0 "[ . 1 .]" 1
907 1 49 LYS HA 1 51 THR MG . . 4.980 4.884 4.719 4.977 . 0 0 "[ . 1 .]" 1
908 1 49 LYS HA 1 65 ILE MG . . 4.040 3.428 3.329 3.507 . 0 0 "[ . 1 .]" 1
909 1 49 LYS HA 1 89 ARG HA . . 2.980 2.424 2.282 2.594 . 0 0 "[ . 1 .]" 1
910 1 49 LYS HA 1 89 ARG HB2 . . 5.500 5.178 4.646 5.455 . 0 0 "[ . 1 .]" 1
911 1 49 LYS HA 1 89 ARG HB3 . . 5.500 5.259 4.963 5.539 0.039 14 0 "[ . 1 .]" 1
912 1 49 LYS HA 1 89 ARG HD2 . . 5.000 4.309 2.921 5.075 0.075 6 0 "[ . 1 .]" 1
913 1 49 LYS HA 1 89 ARG QD . . 4.170 3.348 2.890 3.585 . 0 0 "[ . 1 .]" 1
914 1 49 LYS HA 1 89 ARG HD3 . . 5.000 3.932 2.939 5.000 . 0 0 "[ . 1 .]" 1
915 1 49 LYS HA 1 89 ARG QG . . 4.450 4.160 3.862 4.471 0.021 4 0 "[ . 1 .]" 1
916 1 49 LYS HA 1 90 VAL H . . 3.110 2.800 2.672 2.934 . 0 0 "[ . 1 .]" 1
917 1 49 LYS HA 1 90 VAL MG1 . . 3.880 3.576 3.351 3.799 . 0 0 "[ . 1 .]" 1
918 1 49 LYS HA 1 90 VAL MG2 . . 3.680 2.975 2.844 3.216 . 0 0 "[ . 1 .]" 1
919 1 49 LYS QB 1 50 VAL H . . 3.780 3.719 3.681 3.740 . 0 0 "[ . 1 .]" 1
920 1 49 LYS QB 1 50 VAL MG2 . . 5.110 4.994 4.931 5.025 . 0 0 "[ . 1 .]" 1
921 1 49 LYS QB 1 51 THR MG . . 3.720 3.300 2.912 3.512 . 0 0 "[ . 1 .]" 1
922 1 49 LYS QB 1 66 ALA H . . 4.110 3.823 3.339 4.050 . 0 0 "[ . 1 .]" 1
923 1 49 LYS QB 1 89 ARG HA . . 4.020 2.988 2.741 3.306 . 0 0 "[ . 1 .]" 1
924 1 49 LYS QD 1 50 VAL H . . 4.900 4.669 4.606 4.749 . 0 0 "[ . 1 .]" 1
925 1 49 LYS QD 1 87 GLY H . . 5.210 5.071 4.643 5.264 0.054 1 0 "[ . 1 .]" 1
926 1 49 LYS QD 1 89 ARG QD . . 4.210 3.642 2.768 4.263 0.053 5 0 "[ . 1 .]" 1
927 1 49 LYS QD 1 90 VAL H . . 5.500 5.493 5.253 5.595 0.095 4 0 "[ . 1 .]" 1
928 1 49 LYS QE 1 49 LYS QG . . 2.870 2.195 2.075 2.327 . 0 0 "[ . 1 .]" 1
929 1 49 LYS QE 1 51 THR MG . . 3.670 3.321 2.564 3.742 0.072 4 0 "[ . 1 .]" 1
930 1 49 LYS QE 1 87 GLY H . . 4.450 3.863 3.436 4.472 0.022 12 0 "[ . 1 .]" 1
931 1 49 LYS QE 1 87 GLY HA2 . . 3.950 2.671 2.132 3.636 . 0 0 "[ . 1 .]" 1
932 1 49 LYS QE 1 89 ARG QG . . 4.620 4.297 3.371 4.709 0.089 4 0 "[ . 1 .]" 1
933 1 49 LYS QG 1 50 VAL H . . 3.390 2.625 2.550 2.707 . 0 0 "[ . 1 .]" 1
934 1 49 LYS QG 1 65 ILE MG . . 4.630 4.635 4.597 4.652 0.022 4 0 "[ . 1 .]" 1
935 1 49 LYS QG 1 87 GLY H . . 3.990 3.595 3.518 3.856 . 0 0 "[ . 1 .]" 1
936 1 49 LYS QG 1 87 GLY HA2 . . 4.130 3.388 3.184 3.634 . 0 0 "[ . 1 .]" 1
937 1 49 LYS QG 1 88 ASP H . . 4.200 3.985 3.741 4.121 . 0 0 "[ . 1 .]" 1
938 1 49 LYS QG 1 89 ARG HA . . 4.090 2.675 2.217 3.052 . 0 0 "[ . 1 .]" 1
939 1 49 LYS QG 1 89 ARG QD . . 4.330 3.631 2.602 4.318 . 0 0 "[ . 1 .]" 1
940 1 49 LYS QG 1 90 VAL H . . 4.600 4.331 3.993 4.617 0.017 3 0 "[ . 1 .]" 1
941 1 50 VAL H 1 50 VAL HB . . 3.200 2.773 2.733 2.818 . 0 0 "[ . 1 .]" 1
942 1 50 VAL H 1 50 VAL MG2 . . 2.840 2.043 1.997 2.080 . 0 0 "[ . 1 .]" 1
943 1 50 VAL H 1 86 VAL HA . . 4.860 4.685 4.593 4.762 . 0 0 "[ . 1 .]" 1
944 1 50 VAL H 1 87 GLY H . . 4.320 4.138 3.958 4.278 . 0 0 "[ . 1 .]" 1
945 1 50 VAL H 1 88 ASP H . . 3.710 3.733 3.714 3.757 0.047 14 0 "[ . 1 .]" 1
946 1 50 VAL H 1 89 ARG HA . . 4.110 3.818 3.600 3.957 . 0 0 "[ . 1 .]" 1
947 1 50 VAL H 1 90 VAL H . . 4.430 4.457 4.392 4.501 0.071 3 0 "[ . 1 .]" 1
948 1 50 VAL H 1 90 VAL MG2 . . 3.820 3.848 3.832 3.871 0.051 13 0 "[ . 1 .]" 1
949 1 50 VAL HA 1 50 VAL MG1 . . 3.070 2.289 2.257 2.312 . 0 0 "[ . 1 .]" 1
950 1 50 VAL HA 1 50 VAL MG2 . . 3.020 2.529 2.482 2.598 . 0 0 "[ . 1 .]" 1
951 1 50 VAL HA 1 51 THR H . . 2.980 2.141 2.109 2.170 . 0 0 "[ . 1 .]" 1
952 1 50 VAL HA 1 51 THR MG . . 3.750 3.604 3.401 3.759 0.009 5 0 "[ . 1 .]" 1
953 1 50 VAL HA 1 52 ARG H . . 3.790 3.820 3.667 3.911 0.121 14 0 "[ . 1 .]" 1
954 1 50 VAL HA 1 65 ILE HA . . 3.230 2.249 2.194 2.329 . 0 0 "[ . 1 .]" 1
955 1 50 VAL HA 1 65 ILE MD . . 4.210 4.025 3.924 4.106 . 0 0 "[ . 1 .]" 1
956 1 50 VAL HA 1 65 ILE HG12 . . 3.720 2.478 2.422 2.542 . 0 0 "[ . 1 .]" 1
957 1 50 VAL HA 1 65 ILE HG13 . . 3.890 3.909 3.900 3.925 0.035 12 0 "[ . 1 .]" 1
958 1 50 VAL HA 1 66 ALA H . . 3.840 3.689 3.584 3.811 . 0 0 "[ . 1 .]" 1
959 1 50 VAL HA 1 87 GLY H . . 5.380 4.675 4.549 4.762 . 0 0 "[ . 1 .]" 1
960 1 50 VAL HB 1 51 THR H . . 4.830 4.121 4.040 4.190 . 0 0 "[ . 1 .]" 1
961 1 50 VAL HB 1 53 ILE MD . . 4.280 4.214 4.085 4.297 0.017 15 0 "[ . 1 .]" 1
962 1 50 VAL HB 1 63 LEU QD . . 4.330 4.093 4.039 4.149 . 0 0 "[ . 1 .]" 1
963 1 50 VAL HB 1 85 LYS HA . . 4.490 4.577 4.533 4.625 0.135 6 0 "[ . 1 .]" 1
964 1 50 VAL HB 1 86 VAL H . . 4.430 4.239 4.117 4.343 . 0 0 "[ . 1 .]" 1
965 1 50 VAL HB 1 86 VAL HA . . 3.200 2.199 2.118 2.291 . 0 0 "[ . 1 .]" 1
966 1 50 VAL HB 1 87 GLY H . . 3.230 2.846 2.756 2.962 . 0 0 "[ . 1 .]" 1
967 1 50 VAL HB 1 87 GLY HA2 . . 4.980 4.813 4.696 4.902 . 0 0 "[ . 1 .]" 1
968 1 50 VAL HB 1 88 ASP H . . 2.950 2.666 2.576 2.725 . 0 0 "[ . 1 .]" 1
969 1 50 VAL HB 1 88 ASP QB . . 3.630 3.307 3.075 3.631 0.001 4 0 "[ . 1 .]" 1
970 1 50 VAL MG1 1 51 THR H . . 3.740 2.673 2.558 2.776 . 0 0 "[ . 1 .]" 1
971 1 50 VAL MG1 1 52 ARG H . . 3.100 2.526 2.257 2.672 . 0 0 "[ . 1 .]" 1
972 1 50 VAL MG1 1 53 ILE MD . . 3.220 2.226 2.175 2.317 . 0 0 "[ . 1 .]" 1
973 1 50 VAL MG1 1 63 LEU HA . . 4.240 4.165 4.075 4.227 . 0 0 "[ . 1 .]" 1
974 1 50 VAL MG1 1 65 ILE HA . . 4.050 3.708 3.607 3.803 . 0 0 "[ . 1 .]" 1
975 1 50 VAL MG1 1 86 VAL H . . 3.890 3.332 3.182 3.484 . 0 0 "[ . 1 .]" 1
976 1 50 VAL MG1 1 86 VAL HA . . 2.630 2.252 2.216 2.345 . 0 0 "[ . 1 .]" 1
977 1 50 VAL MG1 1 88 ASP H . . 4.170 4.141 4.044 4.189 0.019 1 0 "[ . 1 .]" 1
978 1 50 VAL MG2 1 51 THR H . . 4.260 4.187 4.125 4.232 . 0 0 "[ . 1 .]" 1
979 1 50 VAL MG2 1 65 ILE HA . . 3.910 3.950 3.936 3.980 0.070 4 0 "[ . 1 .]" 1
980 1 50 VAL MG2 1 65 ILE HG13 . . 3.750 3.684 3.600 3.754 0.004 1 0 "[ . 1 .]" 1
981 1 50 VAL MG2 1 66 ALA H . . 5.500 5.241 5.185 5.285 . 0 0 "[ . 1 .]" 1
982 1 50 VAL MG2 1 84 VAL H . . 5.100 4.803 4.710 4.911 . 0 0 "[ . 1 .]" 1
983 1 50 VAL MG2 1 84 VAL HA . . 4.600 4.368 4.266 4.496 . 0 0 "[ . 1 .]" 1
984 1 50 VAL MG2 1 85 LYS H . . 3.390 3.371 3.097 3.415 0.025 12 0 "[ . 1 .]" 1
985 1 50 VAL MG2 1 85 LYS HA . . 4.020 4.012 3.929 4.049 0.029 6 0 "[ . 1 .]" 1
986 1 50 VAL MG2 1 86 VAL HA . . 3.900 3.768 3.707 3.853 . 0 0 "[ . 1 .]" 1
987 1 50 VAL MG2 1 87 GLY H . . 4.590 4.355 4.238 4.465 . 0 0 "[ . 1 .]" 1
988 1 50 VAL MG2 1 88 ASP H . . 3.500 3.434 3.302 3.514 0.014 4 0 "[ . 1 .]" 1
989 1 50 VAL MG2 1 88 ASP QB . . 3.120 2.518 2.253 2.925 . 0 0 "[ . 1 .]" 1
990 1 50 VAL MG2 1 89 ARG H . . 5.500 5.145 4.975 5.274 . 0 0 "[ . 1 .]" 1
991 1 50 VAL MG2 1 89 ARG HA . . 4.990 4.679 4.541 4.817 . 0 0 "[ . 1 .]" 1
992 1 50 VAL MG2 1 90 VAL H . . 5.080 4.746 4.581 4.861 . 0 0 "[ . 1 .]" 1
993 1 51 THR H 1 51 THR HB . . 4.050 3.771 3.636 3.947 . 0 0 "[ . 1 .]" 1
994 1 51 THR H 1 51 THR HG1 . . 4.690 3.570 3.317 3.990 . 0 0 "[ . 1 .]" 1
995 1 51 THR H 1 51 THR MG . . 3.760 2.792 2.520 3.048 . 0 0 "[ . 1 .]" 1
996 1 51 THR H 1 52 ARG H . . 2.830 2.164 2.062 2.303 . 0 0 "[ . 1 .]" 1
997 1 51 THR H 1 65 ILE HA . . 3.410 2.684 2.514 2.846 . 0 0 "[ . 1 .]" 1
998 1 51 THR H 1 65 ILE HG12 . . 4.710 4.060 3.937 4.152 . 0 0 "[ . 1 .]" 1
999 1 51 THR H 1 65 ILE HG13 . . 5.170 4.899 4.809 4.998 . 0 0 "[ . 1 .]" 1
1000 1 51 THR H 1 65 ILE MG . . 5.020 4.507 4.344 4.661 . 0 0 "[ . 1 .]" 1
1001 1 51 THR HA 1 51 THR MG . . 2.860 2.350 2.218 2.534 . 0 0 "[ . 1 .]" 1
1002 1 51 THR HB 1 64 GLN QE . . 4.490 3.445 3.229 3.702 . 0 0 "[ . 1 .]" 1
1003 1 51 THR HB 1 66 ALA MB . . 4.680 3.937 3.728 4.141 . 0 0 "[ . 1 .]" 1
1004 1 51 THR HB 1 86 VAL QG . . 4.570 4.059 3.936 4.196 . 0 0 "[ . 1 .]" 1
1005 1 51 THR HG1 1 51 THR MG . . 3.180 2.360 2.044 2.470 . 0 0 "[ . 1 .]" 1
1006 1 51 THR HG1 1 52 ARG H . . 4.710 4.340 4.033 4.753 0.043 2 0 "[ . 1 .]" 1
1007 1 51 THR HG1 1 64 GLN HE21 . . 4.070 2.274 2.050 2.420 . 0 0 "[ . 1 .]" 1
1008 1 51 THR HG1 1 64 GLN QE . . 3.540 2.259 2.037 2.402 . 0 0 "[ . 1 .]" 1
1009 1 51 THR HG1 1 64 GLN HE22 . . 4.070 3.890 3.509 4.080 0.010 14 0 "[ . 1 .]" 1
1010 1 51 THR HG1 1 64 GLN HG2 . . 4.680 2.751 2.555 3.165 . 0 0 "[ . 1 .]" 1
1011 1 51 THR HG1 1 64 GLN HG3 . . 4.420 4.176 3.922 4.462 0.042 1 0 "[ . 1 .]" 1
1012 1 51 THR HG1 1 66 ALA MB . . 4.050 2.904 2.624 3.464 . 0 0 "[ . 1 .]" 1
1013 1 51 THR MG 1 52 ARG H . . 4.380 4.215 4.000 4.400 0.020 2 0 "[ . 1 .]" 1
1014 1 51 THR MG 1 64 GLN QE . . 4.440 4.030 3.677 4.267 . 0 0 "[ . 1 .]" 1
1015 1 51 THR MG 1 65 ILE HA . . 3.830 3.314 2.816 3.742 . 0 0 "[ . 1 .]" 1
1016 1 51 THR MG 1 65 ILE MG . . 4.910 4.130 3.896 4.375 . 0 0 "[ . 1 .]" 1
1017 1 51 THR MG 1 66 ALA H . . 3.230 2.367 2.129 2.727 . 0 0 "[ . 1 .]" 1
1018 1 51 THR MG 1 66 ALA HA . . 4.380 4.045 3.790 4.313 . 0 0 "[ . 1 .]" 1
1019 1 51 THR MG 1 66 ALA MB . . 2.580 2.038 1.997 2.170 . 0 0 "[ . 1 .]" 1
1020 1 51 THR MG 1 73 HIS HE1 . . 4.760 4.350 3.748 4.769 0.009 1 0 "[ . 1 .]" 1
1021 1 51 THR MG 1 86 VAL HA . . 5.280 5.273 5.131 5.343 0.063 9 0 "[ . 1 .]" 1
1022 1 51 THR MG 1 87 GLY H . . 4.720 4.422 4.111 4.667 . 0 0 "[ . 1 .]" 1
1023 1 52 ARG H 1 52 ARG HB2 . . 3.530 3.338 3.059 3.572 0.042 14 0 "[ . 1 .]" 1
1024 1 52 ARG H 1 52 ARG HB3 . . 3.780 3.419 3.152 3.763 . 0 0 "[ . 1 .]" 1
1025 1 52 ARG H 1 52 ARG QG . . 4.950 4.292 4.187 4.350 . 0 0 "[ . 1 .]" 1
1026 1 52 ARG H 1 53 ILE QG . . 4.530 3.727 3.380 3.877 . 0 0 "[ . 1 .]" 1
1027 1 52 ARG H 1 63 LEU QD . . 4.350 4.162 4.017 4.231 . 0 0 "[ . 1 .]" 1
1028 1 52 ARG H 1 64 GLN H . . 4.170 3.634 3.479 4.003 . 0 0 "[ . 1 .]" 1
1029 1 52 ARG H 1 64 GLN HB2 . . 5.140 4.544 4.328 5.000 . 0 0 "[ . 1 .]" 1
1030 1 52 ARG H 1 64 GLN HB3 . . 3.180 2.798 2.581 3.230 0.050 2 0 "[ . 1 .]" 1
1031 1 52 ARG H 1 64 GLN HG2 . . 4.020 3.614 3.360 4.087 0.067 14 0 "[ . 1 .]" 1
1032 1 52 ARG H 1 65 ILE HA . . 4.950 4.519 4.265 4.963 0.013 2 0 "[ . 1 .]" 1
1033 1 52 ARG H 1 86 VAL HA . . 4.700 4.204 3.569 4.435 . 0 0 "[ . 1 .]" 1
1034 1 52 ARG H 1 86 VAL HB . . 4.180 4.129 3.831 4.555 0.375 14 0 "[ . 1 .]" 1
1035 1 52 ARG H 1 86 VAL QG . . 3.610 2.942 1.956 3.442 . 0 0 "[ . 1 .]" 1
1036 1 52 ARG HA 1 52 ARG HD2 . . 4.580 4.497 4.401 4.575 . 0 0 "[ . 1 .]" 1
1037 1 52 ARG HA 1 52 ARG HD3 . . 4.580 4.599 4.525 4.629 0.049 13 0 "[ . 1 .]" 1
1038 1 52 ARG HA 1 52 ARG HG2 . . 3.560 2.738 2.520 2.934 . 0 0 "[ . 1 .]" 1
1039 1 52 ARG HA 1 52 ARG QG . . 3.080 2.299 2.202 2.446 . 0 0 "[ . 1 .]" 1
1040 1 52 ARG HA 1 52 ARG HG3 . . 3.560 2.475 2.387 2.619 . 0 0 "[ . 1 .]" 1
1041 1 52 ARG HA 1 53 ILE H . . 2.710 2.250 2.180 2.293 . 0 0 "[ . 1 .]" 1
1042 1 52 ARG HA 1 53 ILE QG . . 3.900 3.801 3.708 3.900 . 0 0 "[ . 1 .]" 1
1043 1 52 ARG HA 1 86 VAL MG1 . . 3.610 3.481 2.695 3.677 0.067 9 0 "[ . 1 .]" 1
1044 1 52 ARG HA 1 86 VAL QG . . 2.780 2.360 1.981 2.687 . 0 0 "[ . 1 .]" 1
1045 1 52 ARG HA 1 86 VAL MG2 . . 3.610 2.406 2.039 2.763 . 0 0 "[ . 1 .]" 1
1046 1 52 ARG HB2 1 52 ARG HD2 . . 3.830 2.840 2.384 3.310 . 0 0 "[ . 1 .]" 1
1047 1 52 ARG HB2 1 52 ARG QD . . 3.340 2.697 2.304 3.115 . 0 0 "[ . 1 .]" 1
1048 1 52 ARG HB2 1 52 ARG HD3 . . 3.830 3.380 2.977 3.857 0.027 12 0 "[ . 1 .]" 1
1049 1 52 ARG HB2 1 53 ILE H . . 4.380 4.181 4.114 4.269 . 0 0 "[ . 1 .]" 1
1050 1 52 ARG HB2 1 54 PHE QD . . 4.940 4.394 4.176 4.640 . 0 0 "[ . 1 .]" 1
1051 1 52 ARG HB2 1 54 PHE QE . . 4.610 4.178 3.663 4.607 . 0 0 "[ . 1 .]" 1
1052 1 52 ARG HB2 1 64 GLN HB3 . . 3.960 3.262 2.786 3.695 . 0 0 "[ . 1 .]" 1
1053 1 52 ARG HB2 1 64 GLN QE . . 4.850 2.919 2.475 3.466 . 0 0 "[ . 1 .]" 1
1054 1 52 ARG HB3 1 52 ARG HD2 . . 3.850 2.826 2.403 3.230 . 0 0 "[ . 1 .]" 1
1055 1 52 ARG HB3 1 52 ARG QD . . 3.320 2.400 2.269 2.615 . 0 0 "[ . 1 .]" 1
1056 1 52 ARG HB3 1 52 ARG HD3 . . 3.850 3.020 2.334 3.802 . 0 0 "[ . 1 .]" 1
1057 1 52 ARG HB3 1 53 ILE H . . 3.860 3.559 3.313 3.807 . 0 0 "[ . 1 .]" 1
1058 1 52 ARG HB3 1 54 PHE QD . . 4.050 2.924 2.685 3.353 . 0 0 "[ . 1 .]" 1
1059 1 52 ARG HB3 1 54 PHE QE . . 4.490 2.692 2.343 3.043 . 0 0 "[ . 1 .]" 1
1060 1 52 ARG HB3 1 62 VAL QG . . 5.440 5.079 4.734 5.216 . 0 0 "[ . 1 .]" 1
1061 1 52 ARG HB3 1 64 GLN HA . . 5.460 5.190 4.929 5.446 . 0 0 "[ . 1 .]" 1
1062 1 52 ARG HB3 1 64 GLN HB3 . . 3.960 2.287 2.150 2.502 . 0 0 "[ . 1 .]" 1
1063 1 52 ARG HB3 1 64 GLN QE . . 4.240 3.540 2.837 3.964 . 0 0 "[ . 1 .]" 1
1064 1 52 ARG HB3 1 86 VAL QG . . 5.150 4.596 4.028 4.943 . 0 0 "[ . 1 .]" 1
1065 1 52 ARG QD 1 54 PHE QD . . 3.740 2.622 2.368 2.910 . 0 0 "[ . 1 .]" 1
1066 1 52 ARG QD 1 64 GLN QE . . 4.040 3.602 2.857 4.076 0.036 8 0 "[ . 1 .]" 1
1067 1 52 ARG HD2 1 54 PHE QD . . 4.560 3.471 2.396 4.410 . 0 0 "[ . 1 .]" 1
1068 1 52 ARG HD2 1 54 PHE QE . . 4.460 3.557 2.476 4.467 0.007 14 0 "[ . 1 .]" 1
1069 1 52 ARG HD3 1 54 PHE QD . . 4.560 3.111 2.592 3.706 . 0 0 "[ . 1 .]" 1
1070 1 52 ARG HD3 1 54 PHE QE . . 4.460 3.502 2.484 4.466 0.006 13 0 "[ . 1 .]" 1
1071 1 52 ARG QG 1 53 ILE H . . 3.210 2.246 2.081 2.527 . 0 0 "[ . 1 .]" 1
1072 1 52 ARG QG 1 54 PHE QD . . 3.530 2.467 2.244 2.708 . 0 0 "[ . 1 .]" 1
1073 1 52 ARG QG 1 54 PHE QE . . 4.920 3.865 3.687 4.186 . 0 0 "[ . 1 .]" 1
1074 1 52 ARG HG2 1 53 ILE H . . 3.770 2.291 2.122 2.582 . 0 0 "[ . 1 .]" 1
1075 1 52 ARG HG2 1 54 PHE QD . . 4.270 2.487 2.257 2.738 . 0 0 "[ . 1 .]" 1
1076 1 52 ARG HG3 1 53 ILE H . . 3.770 3.258 3.013 3.598 . 0 0 "[ . 1 .]" 1
1077 1 52 ARG HG3 1 54 PHE QD . . 4.270 4.123 3.943 4.284 0.014 8 0 "[ . 1 .]" 1
1078 1 53 ILE H 1 53 ILE HB . . 3.420 2.846 2.766 2.930 . 0 0 "[ . 1 .]" 1
1079 1 53 ILE H 1 53 ILE MD . . 4.700 4.452 4.364 4.521 . 0 0 "[ . 1 .]" 1
1080 1 53 ILE H 1 53 ILE QG . . 3.830 3.154 3.063 3.270 . 0 0 "[ . 1 .]" 1
1081 1 53 ILE H 1 53 ILE MG . . 3.950 3.911 3.858 3.952 0.002 15 0 "[ . 1 .]" 1
1082 1 53 ILE H 1 54 PHE QD . . 4.510 3.477 3.307 3.676 . 0 0 "[ . 1 .]" 1
1083 1 53 ILE H 1 86 VAL QG . . 3.230 3.315 2.456 3.653 0.423 10 0 "[ . 1 .]" 1
1084 1 53 ILE HA 1 53 ILE MD . . 4.000 3.830 3.759 3.865 . 0 0 "[ . 1 .]" 1
1085 1 53 ILE HA 1 53 ILE QG . . 3.320 2.343 2.276 2.387 . 0 0 "[ . 1 .]" 1
1086 1 53 ILE HA 1 53 ILE MG . . 3.100 2.347 2.310 2.393 . 0 0 "[ . 1 .]" 1
1087 1 53 ILE HA 1 54 PHE H . . 2.840 2.199 2.144 2.264 . 0 0 "[ . 1 .]" 1
1088 1 53 ILE HA 1 54 PHE QD . . 4.290 3.281 2.843 3.713 . 0 0 "[ . 1 .]" 1
1089 1 53 ILE HA 1 62 VAL QG . . 5.000 4.471 4.311 4.714 . 0 0 "[ . 1 .]" 1
1090 1 53 ILE HA 1 63 LEU HA . . 3.710 3.074 2.935 3.243 . 0 0 "[ . 1 .]" 1
1091 1 53 ILE HA 1 63 LEU QD . . 4.080 3.586 3.497 3.776 . 0 0 "[ . 1 .]" 1
1092 1 53 ILE HA 1 64 GLN H . . 4.190 3.306 3.221 3.419 . 0 0 "[ . 1 .]" 1
1093 1 53 ILE HB 1 53 ILE MD . . 2.890 2.528 2.468 2.601 . 0 0 "[ . 1 .]" 1
1094 1 53 ILE HB 1 54 PHE H . . 4.690 4.245 4.107 4.341 . 0 0 "[ . 1 .]" 1
1095 1 53 ILE HB 1 82 TYR QE . . 5.140 5.091 5.053 5.151 0.011 2 0 "[ . 1 .]" 1
1096 1 53 ILE HB 1 86 VAL HB . . 5.190 4.083 3.670 4.978 . 0 0 "[ . 1 .]" 1
1097 1 53 ILE HB 1 86 VAL QG . . 3.270 3.610 2.602 4.064 0.794 9 8 "[* *-.** +* * .]" 1
1098 1 53 ILE MD 1 54 PHE H . . 5.500 5.052 4.943 5.208 . 0 0 "[ . 1 .]" 1
1099 1 53 ILE MD 1 63 LEU HA . . 4.370 4.116 3.881 4.321 . 0 0 "[ . 1 .]" 1
1100 1 53 ILE MD 1 63 LEU QD . . 3.200 2.353 2.202 2.508 . 0 0 "[ . 1 .]" 1
1101 1 53 ILE MD 1 82 TYR HB2 . . 4.520 4.020 3.685 4.187 . 0 0 "[ . 1 .]" 1
1102 1 53 ILE MD 1 82 TYR HB3 . . 3.840 3.298 2.921 3.417 . 0 0 "[ . 1 .]" 1
1103 1 53 ILE MD 1 82 TYR QD . . 3.700 2.892 2.568 3.098 . 0 0 "[ . 1 .]" 1
1104 1 53 ILE MD 1 82 TYR QE . . 3.900 3.390 3.177 3.589 . 0 0 "[ . 1 .]" 1
1105 1 53 ILE MD 1 84 VAL H . . 5.010 4.552 4.376 4.669 . 0 0 "[ . 1 .]" 1
1106 1 53 ILE MD 1 84 VAL MG2 . . 3.440 3.226 3.017 3.432 . 0 0 "[ . 1 .]" 1
1107 1 53 ILE MD 1 85 LYS HA . . 2.860 2.015 1.938 2.105 . 0 0 "[ . 1 .]" 1
1108 1 53 ILE MD 1 85 LYS QB . . 3.550 3.318 2.932 3.575 0.025 6 0 "[ . 1 .]" 1
1109 1 53 ILE MD 1 86 VAL H . . 3.250 2.509 2.355 2.791 . 0 0 "[ . 1 .]" 1
1110 1 53 ILE MD 1 86 VAL HA . . 4.180 3.937 3.797 4.119 . 0 0 "[ . 1 .]" 1
1111 1 53 ILE MD 1 86 VAL HB . . 4.460 3.688 3.280 4.467 0.007 12 0 "[ . 1 .]" 1
1112 1 53 ILE MD 1 86 VAL QG . . 2.930 3.299 2.367 3.883 0.953 9 7 "[* * -** +1 * .]" 1
1113 1 53 ILE MD 1 88 ASP H . . 5.500 5.501 5.373 5.535 0.035 4 0 "[ . 1 .]" 1
1114 1 53 ILE QG 1 53 ILE MG . . 2.960 2.314 2.236 2.392 . 0 0 "[ . 1 .]" 1
1115 1 53 ILE QG 1 63 LEU HA . . 3.720 2.762 2.429 2.942 . 0 0 "[ . 1 .]" 1
1116 1 53 ILE QG 1 82 TYR QD . . 3.950 3.850 3.817 3.870 . 0 0 "[ . 1 .]" 1
1117 1 53 ILE QG 1 82 TYR QE . . 4.560 3.191 2.984 3.275 . 0 0 "[ . 1 .]" 1
1118 1 53 ILE QG 1 86 VAL QG . . 2.830 3.148 1.949 3.596 0.766 13 11 "[ ****-**** + *]" 1
1119 1 53 ILE MG 1 54 PHE H . . 3.550 2.557 2.380 2.713 . 0 0 "[ . 1 .]" 1
1120 1 53 ILE MG 1 54 PHE HA . . 4.100 3.488 3.337 3.634 . 0 0 "[ . 1 .]" 1
1121 1 53 ILE MG 1 54 PHE QB . . 5.340 4.480 4.430 4.564 . 0 0 "[ . 1 .]" 1
1122 1 53 ILE MG 1 54 PHE QD . . 5.410 4.572 4.375 4.713 . 0 0 "[ . 1 .]" 1
1123 1 53 ILE MG 1 61 LYS QE . . 5.500 5.400 4.932 5.530 0.030 12 0 "[ . 1 .]" 1
1124 1 53 ILE MG 1 62 VAL H . . 4.800 4.235 4.077 4.331 . 0 0 "[ . 1 .]" 1
1125 1 53 ILE MG 1 63 LEU H . . 5.310 5.186 5.122 5.267 . 0 0 "[ . 1 .]" 1
1126 1 53 ILE MG 1 63 LEU HA . . 3.790 3.323 3.258 3.369 . 0 0 "[ . 1 .]" 1
1127 1 53 ILE MG 1 63 LEU QD . . 3.580 3.221 3.137 3.309 . 0 0 "[ . 1 .]" 1
1128 1 53 ILE MG 1 64 GLN H . . 4.440 4.505 4.479 4.533 0.093 12 0 "[ . 1 .]" 1
1129 1 53 ILE MG 1 82 TYR HB3 . . 4.570 4.462 4.243 4.600 0.030 15 0 "[ . 1 .]" 1
1130 1 53 ILE MG 1 82 TYR QD . . 3.780 3.448 3.357 3.523 . 0 0 "[ . 1 .]" 1
1131 1 53 ILE MG 1 82 TYR QE . . 3.310 2.487 2.380 2.576 . 0 0 "[ . 1 .]" 1
1132 1 53 ILE MG 1 86 VAL H . . 4.880 4.903 4.879 4.921 0.041 7 0 "[ . 1 .]" 1
1133 1 53 ILE MG 1 86 VAL QG . . 4.070 4.532 3.745 4.880 0.810 9 12 "[* ******+** * -]" 1
1134 1 54 PHE H 1 54 PHE QD . . 3.770 3.101 2.783 3.457 . 0 0 "[ . 1 .]" 1
1135 1 54 PHE H 1 62 VAL H . . 4.460 3.397 3.267 3.530 . 0 0 "[ . 1 .]" 1
1136 1 54 PHE H 1 62 VAL HB . . 4.010 3.271 3.124 3.607 . 0 0 "[ . 1 .]" 1
1137 1 54 PHE H 1 62 VAL QG . . 4.580 3.899 3.805 4.108 . 0 0 "[ . 1 .]" 1
1138 1 54 PHE HA 1 54 PHE QD . . 4.090 3.760 3.718 3.792 . 0 0 "[ . 1 .]" 1
1139 1 54 PHE HA 1 55 ASN H . . 3.110 2.559 2.377 2.879 . 0 0 "[ . 1 .]" 1
1140 1 54 PHE QB 1 55 ASN H . . 3.070 2.151 1.894 2.350 . 0 0 "[ . 1 .]" 1
1141 1 54 PHE QB 1 62 VAL QG . . 5.280 4.287 4.056 4.493 . 0 0 "[ . 1 .]" 1
1142 1 54 PHE HB2 1 55 ASN H . . 3.660 2.170 1.903 2.383 . 0 0 "[ . 1 .]" 1
1143 1 54 PHE HB3 1 55 ASN H . . 3.660 3.555 3.456 3.668 0.008 12 0 "[ . 1 .]" 1
1144 1 54 PHE QD 1 55 ASN H . . 3.800 3.257 2.584 3.817 0.017 4 0 "[ . 1 .]" 1
1145 1 54 PHE QD 1 62 VAL HB . . 4.400 3.292 2.973 3.469 . 0 0 "[ . 1 .]" 1
1146 1 54 PHE QD 1 62 VAL MG1 . . 4.120 3.919 3.812 4.059 . 0 0 "[ . 1 .]" 1
1147 1 54 PHE QD 1 62 VAL MG2 . . 4.120 3.219 2.868 3.601 . 0 0 "[ . 1 .]" 1
1148 1 54 PHE QE 1 62 VAL HA . . 5.500 5.468 5.351 5.526 0.026 14 0 "[ . 1 .]" 1
1149 1 54 PHE QE 1 62 VAL HB . . 4.700 3.259 3.054 3.430 . 0 0 "[ . 1 .]" 1
1150 1 54 PHE QE 1 62 VAL MG1 . . 3.780 2.838 2.605 2.941 . 0 0 "[ . 1 .]" 1
1151 1 54 PHE QE 1 62 VAL QG . . 3.210 2.402 2.236 2.587 . 0 0 "[ . 1 .]" 1
1152 1 54 PHE QE 1 62 VAL MG2 . . 3.780 2.603 2.420 2.920 . 0 0 "[ . 1 .]" 1
1153 1 54 PHE QE 1 64 GLN HB2 . . 4.240 2.577 2.214 3.059 . 0 0 "[ . 1 .]" 1
1154 1 54 PHE QE 1 64 GLN HB3 . . 4.550 3.271 3.036 3.799 . 0 0 "[ . 1 .]" 1
1155 1 54 PHE QE 1 75 TRP HE1 . . 4.180 3.135 2.880 3.423 . 0 0 "[ . 1 .]" 1
1156 1 54 PHE QE 1 77 LEU QD . . 5.440 4.233 3.835 4.510 . 0 0 "[ . 1 .]" 1
1157 1 54 PHE QE 1 120 VAL QG . . 5.440 4.425 4.231 4.616 . 0 0 "[ . 1 .]" 1
1158 1 54 PHE HZ 1 62 VAL HB . . 5.140 3.821 3.417 4.078 . 0 0 "[ . 1 .]" 1
1159 1 54 PHE HZ 1 62 VAL MG1 . . 4.360 2.617 2.404 2.849 . 0 0 "[ . 1 .]" 1
1160 1 54 PHE HZ 1 62 VAL QG . . 3.360 2.567 2.373 2.801 . 0 0 "[ . 1 .]" 1
1161 1 54 PHE HZ 1 62 VAL MG2 . . 4.360 3.735 3.249 4.143 . 0 0 "[ . 1 .]" 1
1162 1 54 PHE HZ 1 75 TRP HE1 . . 4.410 3.112 2.737 3.624 . 0 0 "[ . 1 .]" 1
1163 1 54 PHE HZ 1 75 TRP HZ2 . . 4.120 3.154 2.780 3.456 . 0 0 "[ . 1 .]" 1
1164 1 54 PHE HZ 1 120 VAL QG . . 5.000 4.379 4.096 4.673 . 0 0 "[ . 1 .]" 1
1165 1 55 ASN H 1 55 ASN QB . . 3.410 2.948 2.462 3.317 . 0 0 "[ . 1 .]" 1
1166 1 55 ASN H 1 56 ASN H . . 4.320 4.320 3.711 4.412 0.092 2 0 "[ . 1 .]" 1
1167 1 55 ASN HA 1 56 ASN H . . 3.010 2.258 2.023 2.475 . 0 0 "[ . 1 .]" 1
1168 1 55 ASN HA 1 61 LYS HA . . 3.640 2.619 2.318 2.811 . 0 0 "[ . 1 .]" 1
1169 1 55 ASN HA 1 61 LYS QB . . 4.830 4.713 4.432 4.877 0.047 11 0 "[ . 1 .]" 1
1170 1 55 ASN HA 1 61 LYS QG . . 5.120 4.152 3.688 4.458 . 0 0 "[ . 1 .]" 1
1171 1 55 ASN HA 1 62 VAL H . . 4.060 2.897 2.503 3.272 . 0 0 "[ . 1 .]" 1
1172 1 55 ASN HA 1 62 VAL QG . . 3.810 2.948 2.553 3.535 . 0 0 "[ . 1 .]" 1
1173 1 55 ASN QB 1 56 ASN H . . 3.870 2.833 2.140 3.957 0.087 4 0 "[ . 1 .]" 1
1174 1 55 ASN QB 1 61 LYS HA . . 4.090 2.974 2.208 4.114 0.024 2 0 "[ . 1 .]" 1
1175 1 55 ASN HB2 1 56 ASN H . . 4.720 3.137 2.156 4.466 . 0 0 "[ . 1 .]" 1
1176 1 55 ASN HB3 1 56 ASN H . . 4.720 3.779 2.659 4.418 . 0 0 "[ . 1 .]" 1
1177 1 55 ASN QD 1 61 LYS QG . . 4.730 4.006 2.198 4.785 0.055 3 0 "[ . 1 .]" 1
1178 1 56 ASN H 1 60 GLY H . . 4.720 3.582 3.157 4.561 . 0 0 "[ . 1 .]" 1
1179 1 56 ASN H 1 60 GLY QA . . 4.580 3.524 2.816 4.310 . 0 0 "[ . 1 .]" 1
1180 1 56 ASN H 1 61 LYS HA . . 4.440 4.023 3.388 4.401 . 0 0 "[ . 1 .]" 1
1181 1 56 ASN H 1 62 VAL H . . 4.980 4.623 3.916 4.987 0.007 14 0 "[ . 1 .]" 1
1182 1 56 ASN H 1 62 VAL QG . . 3.940 3.367 2.615 3.832 . 0 0 "[ . 1 .]" 1
1183 1 56 ASN QB 1 62 VAL QG . . 5.280 3.753 2.514 5.032 . 0 0 "[ . 1 .]" 1
1184 1 58 LEU HA 1 58 LEU MD1 . . 4.030 2.748 2.117 3.932 . 0 0 "[ . 1 .]" 1
1185 1 58 LEU HA 1 58 LEU QD . . 2.840 2.238 2.053 3.143 0.303 10 0 "[ . 1 .]" 1
1186 1 58 LEU HA 1 58 LEU MD2 . . 4.030 2.902 2.141 3.950 . 0 0 "[ . 1 .]" 1
1187 1 58 LEU HA 1 58 LEU HG . . 3.890 3.405 2.432 3.871 . 0 0 "[ . 1 .]" 1
1188 1 59 GLY H 1 60 GLY H . . 4.270 2.674 2.105 3.620 . 0 0 "[ . 1 .]" 1
1189 1 59 GLY H 1 77 LEU QD . . 5.310 3.747 2.669 4.732 . 0 0 "[ . 1 .]" 1
1190 1 59 GLY QA 1 62 VAL QG . . 4.390 3.415 2.800 4.033 . 0 0 "[ . 1 .]" 1
1191 1 59 GLY QA 1 77 LEU HB2 . . 5.010 3.708 3.054 4.638 . 0 0 "[ . 1 .]" 1
1192 1 59 GLY QA 1 77 LEU HB3 . . 5.070 2.731 2.223 3.448 . 0 0 "[ . 1 .]" 1
1193 1 59 GLY QA 1 77 LEU MD1 . . 4.180 3.607 2.296 4.240 0.060 13 0 "[ . 1 .]" 1
1194 1 59 GLY QA 1 77 LEU QD . . 3.560 2.228 2.035 2.597 . 0 0 "[ . 1 .]" 1
1195 1 59 GLY QA 1 77 LEU MD2 . . 4.180 2.450 2.040 3.307 . 0 0 "[ . 1 .]" 1
1196 1 60 GLY QA 1 62 VAL QG . . 5.000 4.329 4.140 4.528 . 0 0 "[ . 1 .]" 1
1197 1 60 GLY QA 1 102 THR HA . . 4.870 4.028 3.706 4.328 . 0 0 "[ . 1 .]" 1
1198 1 60 GLY QA 1 102 THR HB . . 3.920 2.898 2.200 3.999 0.079 14 0 "[ . 1 .]" 1
1199 1 60 GLY QA 1 102 THR MG . . 4.100 3.674 2.077 4.182 0.082 4 0 "[ . 1 .]" 1
1200 1 61 LYS H 1 61 LYS HB2 . . 4.040 2.331 2.253 2.414 . 0 0 "[ . 1 .]" 1
1201 1 61 LYS H 1 61 LYS HB3 . . 4.040 3.588 3.547 3.627 . 0 0 "[ . 1 .]" 1
1202 1 61 LYS H 1 61 LYS QD . . 4.890 3.860 3.725 3.966 . 0 0 "[ . 1 .]" 1
1203 1 61 LYS H 1 61 LYS HG2 . . 4.730 3.821 3.556 3.977 . 0 0 "[ . 1 .]" 1
1204 1 61 LYS H 1 61 LYS QG . . 3.940 2.593 2.366 2.768 . 0 0 "[ . 1 .]" 1
1205 1 61 LYS H 1 61 LYS HG3 . . 4.730 2.638 2.402 2.824 . 0 0 "[ . 1 .]" 1
1206 1 61 LYS H 1 79 LEU HB2 . . 5.330 4.471 4.185 4.867 . 0 0 "[ . 1 .]" 1
1207 1 61 LYS H 1 102 THR HA . . 5.500 5.007 4.796 5.520 0.020 7 0 "[ . 1 .]" 1
1208 1 61 LYS H 1 102 THR HB . . 4.290 3.071 2.643 4.187 . 0 0 "[ . 1 .]" 1
1209 1 61 LYS H 1 102 THR MG . . 4.140 3.209 1.828 3.679 . 0 0 "[ . 1 .]" 1
1210 1 61 LYS HA 1 61 LYS HD2 . . 4.890 4.700 4.657 4.746 . 0 0 "[ . 1 .]" 1
1211 1 61 LYS HA 1 61 LYS QD . . 4.260 4.037 3.962 4.085 . 0 0 "[ . 1 .]" 1
1212 1 61 LYS HA 1 61 LYS HD3 . . 4.890 4.400 4.274 4.487 . 0 0 "[ . 1 .]" 1
1213 1 61 LYS HA 1 61 LYS QG . . 3.570 2.372 2.325 2.444 . 0 0 "[ . 1 .]" 1
1214 1 61 LYS HA 1 62 VAL H . . 3.410 2.114 2.066 2.167 . 0 0 "[ . 1 .]" 1
1215 1 61 LYS HA 1 62 VAL MG1 . . 5.500 5.509 5.459 5.541 0.041 13 0 "[ . 1 .]" 1
1216 1 61 LYS HA 1 62 VAL QG . . 4.030 3.539 3.413 3.634 . 0 0 "[ . 1 .]" 1
1217 1 61 LYS HA 1 62 VAL MG2 . . 5.500 3.582 3.448 3.685 . 0 0 "[ . 1 .]" 1
1218 1 61 LYS HA 1 79 LEU HB2 . . 5.500 4.776 4.476 5.044 . 0 0 "[ . 1 .]" 1
1219 1 61 LYS QB 1 61 LYS QD . . 3.230 2.158 2.123 2.217 . 0 0 "[ . 1 .]" 1
1220 1 61 LYS QB 1 62 VAL H . . 3.990 3.215 3.053 3.322 . 0 0 "[ . 1 .]" 1
1221 1 61 LYS QB 1 79 LEU HA . . 4.760 4.341 4.086 4.615 . 0 0 "[ . 1 .]" 1
1222 1 61 LYS QB 1 79 LEU HB2 . . 4.310 2.338 2.126 2.680 . 0 0 "[ . 1 .]" 1
1223 1 61 LYS QB 1 79 LEU HB3 . . 4.370 3.428 2.889 3.789 . 0 0 "[ . 1 .]" 1
1224 1 61 LYS QB 1 79 LEU QD . . 4.160 3.296 3.070 3.603 . 0 0 "[ . 1 .]" 1
1225 1 61 LYS QB 1 82 TYR QE . . 3.190 2.978 2.715 3.196 0.006 14 0 "[ . 1 .]" 1
1226 1 61 LYS HB2 1 61 LYS QE . . 4.550 4.140 4.004 4.257 . 0 0 "[ . 1 .]" 1
1227 1 61 LYS HB3 1 61 LYS QE . . 4.550 3.900 3.788 3.989 . 0 0 "[ . 1 .]" 1
1228 1 61 LYS QD 1 80 ASP H . . 5.010 4.427 4.083 4.999 . 0 0 "[ . 1 .]" 1
1229 1 61 LYS QD 1 80 ASP HA . . 3.520 3.033 2.713 3.535 0.015 4 0 "[ . 1 .]" 1
1230 1 61 LYS QD 1 81 LYS HA . . 5.120 3.795 3.397 4.722 . 0 0 "[ . 1 .]" 1
1231 1 61 LYS QD 1 82 TYR QD . . 4.830 3.711 3.298 4.004 . 0 0 "[ . 1 .]" 1
1232 1 61 LYS QD 1 82 TYR QE . . 4.040 2.502 2.287 2.727 . 0 0 "[ . 1 .]" 1
1233 1 61 LYS QE 1 61 LYS HG2 . . 3.830 2.390 2.279 2.485 . 0 0 "[ . 1 .]" 1
1234 1 61 LYS QE 1 61 LYS QG . . 3.310 2.233 2.075 2.408 . 0 0 "[ . 1 .]" 1
1235 1 61 LYS QE 1 61 LYS HG3 . . 3.830 2.769 2.279 3.224 . 0 0 "[ . 1 .]" 1
1236 1 61 LYS QE 1 82 TYR QE . . 4.060 3.080 2.262 3.394 . 0 0 "[ . 1 .]" 1
1237 1 61 LYS QG 1 82 TYR QE . . 4.480 3.109 2.686 3.681 . 0 0 "[ . 1 .]" 1
1238 1 61 LYS HG2 1 82 TYR QE . . 5.290 3.165 2.717 3.785 . 0 0 "[ . 1 .]" 1
1239 1 61 LYS HG3 1 82 TYR QE . . 5.290 4.585 4.215 5.025 . 0 0 "[ . 1 .]" 1
1240 1 62 VAL H 1 62 VAL HB . . 4.020 2.817 2.769 2.937 . 0 0 "[ . 1 .]" 1
1241 1 62 VAL H 1 62 VAL MG1 . . 4.800 3.968 3.945 4.018 . 0 0 "[ . 1 .]" 1
1242 1 62 VAL H 1 62 VAL QG . . 3.350 2.596 2.496 2.794 . 0 0 "[ . 1 .]" 1
1243 1 62 VAL H 1 62 VAL MG2 . . 4.800 2.632 2.524 2.850 . 0 0 "[ . 1 .]" 1
1244 1 62 VAL HA 1 62 VAL MG1 . . 3.220 2.297 2.251 2.348 . 0 0 "[ . 1 .]" 1
1245 1 62 VAL HA 1 62 VAL MG2 . . 3.220 2.452 2.400 2.539 . 0 0 "[ . 1 .]" 1
1246 1 62 VAL HA 1 63 LEU H . . 3.110 2.137 2.063 2.168 . 0 0 "[ . 1 .]" 1
1247 1 62 VAL HA 1 77 LEU QD . . 4.200 3.648 3.120 4.055 . 0 0 "[ . 1 .]" 1
1248 1 62 VAL HA 1 79 LEU QD . . 3.920 3.279 3.093 3.528 . 0 0 "[ . 1 .]" 1
1249 1 62 VAL QG 1 63 LEU H . . 3.170 2.468 2.404 2.670 . 0 0 "[ . 1 .]" 1
1250 1 62 VAL QG 1 63 LEU HB2 . . 4.800 4.677 4.626 4.739 . 0 0 "[ . 1 .]" 1
1251 1 62 VAL QG 1 63 LEU HB3 . . 4.440 4.300 4.232 4.343 . 0 0 "[ . 1 .]" 1
1252 1 62 VAL QG 1 64 GLN H . . 4.340 3.998 3.852 4.162 . 0 0 "[ . 1 .]" 1
1253 1 62 VAL QG 1 64 GLN HB2 . . 4.190 3.262 3.128 3.410 . 0 0 "[ . 1 .]" 1
1254 1 62 VAL QG 1 64 GLN HB3 . . 4.720 4.442 4.275 4.624 . 0 0 "[ . 1 .]" 1
1255 1 62 VAL QG 1 64 GLN HG3 . . 5.440 4.943 4.830 5.047 . 0 0 "[ . 1 .]" 1
1256 1 62 VAL QG 1 75 TRP HA . . 4.070 3.354 3.236 3.528 . 0 0 "[ . 1 .]" 1
1257 1 62 VAL QG 1 75 TRP QB . . 3.610 2.754 2.616 2.962 . 0 0 "[ . 1 .]" 1
1258 1 62 VAL QG 1 75 TRP HD1 . . 4.110 3.292 3.118 3.396 . 0 0 "[ . 1 .]" 1
1259 1 62 VAL QG 1 75 TRP HE1 . . 4.560 3.873 3.674 4.096 . 0 0 "[ . 1 .]" 1
1260 1 62 VAL QG 1 75 TRP HE3 . . 5.080 4.133 3.918 4.507 . 0 0 "[ . 1 .]" 1
1261 1 62 VAL QG 1 76 TYR H . . 4.330 2.860 2.661 3.002 . 0 0 "[ . 1 .]" 1
1262 1 62 VAL QG 1 76 TYR HB2 . . 4.530 4.254 4.077 4.405 . 0 0 "[ . 1 .]" 1
1263 1 62 VAL QG 1 76 TYR QD . . 4.890 4.586 4.477 4.685 . 0 0 "[ . 1 .]" 1
1264 1 62 VAL QG 1 77 LEU HB2 . . 4.500 4.149 3.834 4.450 . 0 0 "[ . 1 .]" 1
1265 1 62 VAL QG 1 77 LEU HB3 . . 4.040 3.132 2.740 3.441 . 0 0 "[ . 1 .]" 1
1266 1 62 VAL QG 1 77 LEU QD . . 2.950 1.989 1.816 2.132 . 0 0 "[ . 1 .]" 1
1267 1 62 VAL QG 1 77 LEU HG . . 3.820 2.608 1.964 3.829 0.009 3 0 "[ . 1 .]" 1
1268 1 62 VAL QG 1 79 LEU QD . . 4.200 3.910 3.710 4.118 . 0 0 "[ . 1 .]" 1
1269 1 62 VAL QG 1 82 TYR QE . . 5.070 4.726 4.638 4.845 . 0 0 "[ . 1 .]" 1
1270 1 62 VAL QG 1 116 MET ME . . 5.440 4.717 4.673 4.760 . 0 0 "[ . 1 .]" 1
1271 1 62 VAL MG1 1 63 LEU H . . 4.540 2.489 2.423 2.706 . 0 0 "[ . 1 .]" 1
1272 1 62 VAL MG1 1 75 TRP QB . . 4.740 2.781 2.640 2.992 . 0 0 "[ . 1 .]" 1
1273 1 62 VAL MG1 1 77 LEU HB2 . . 5.500 5.000 4.675 5.385 . 0 0 "[ . 1 .]" 1
1274 1 62 VAL MG1 1 77 LEU HB3 . . 5.400 4.434 4.115 4.692 . 0 0 "[ . 1 .]" 1
1275 1 62 VAL MG1 1 77 LEU HG . . 4.360 2.845 2.110 4.234 . 0 0 "[ . 1 .]" 1
1276 1 62 VAL MG2 1 63 LEU H . . 4.540 4.061 4.001 4.142 . 0 0 "[ . 1 .]" 1
1277 1 62 VAL MG2 1 75 TRP QB . . 4.740 4.444 4.273 4.741 0.001 14 0 "[ . 1 .]" 1
1278 1 62 VAL MG2 1 77 LEU HB2 . . 5.500 4.437 4.073 4.749 . 0 0 "[ . 1 .]" 1
1279 1 62 VAL MG2 1 77 LEU HB3 . . 5.400 3.204 2.782 3.569 . 0 0 "[ . 1 .]" 1
1280 1 62 VAL MG2 1 77 LEU HG . . 4.360 3.037 2.285 4.373 0.013 6 0 "[ . 1 .]" 1
1281 1 63 LEU H 1 63 LEU HB2 . . 4.060 2.977 2.785 3.036 . 0 0 "[ . 1 .]" 1
1282 1 63 LEU H 1 63 LEU HB3 . . 4.160 2.616 2.564 2.646 . 0 0 "[ . 1 .]" 1
1283 1 63 LEU H 1 63 LEU QD . . 4.430 3.951 3.876 3.978 . 0 0 "[ . 1 .]" 1
1284 1 63 LEU H 1 76 TYR HB2 . . 4.560 2.872 2.777 2.995 . 0 0 "[ . 1 .]" 1
1285 1 63 LEU H 1 76 TYR HB3 . . 4.700 4.317 4.188 4.504 . 0 0 "[ . 1 .]" 1
1286 1 63 LEU H 1 79 LEU QD . . 3.560 2.786 2.469 3.019 . 0 0 "[ . 1 .]" 1
1287 1 63 LEU H 1 82 TYR QE . . 4.490 3.861 3.554 4.045 . 0 0 "[ . 1 .]" 1
1288 1 63 LEU HA 1 63 LEU MD1 . . 3.870 2.174 2.151 2.220 . 0 0 "[ . 1 .]" 1
1289 1 63 LEU HA 1 63 LEU QD . . 2.910 2.162 2.138 2.206 . 0 0 "[ . 1 .]" 1
1290 1 63 LEU HA 1 63 LEU MD2 . . 3.870 3.799 3.763 3.826 . 0 0 "[ . 1 .]" 1
1291 1 63 LEU HA 1 63 LEU HG . . 3.860 3.215 3.165 3.271 . 0 0 "[ . 1 .]" 1
1292 1 63 LEU HA 1 64 GLN H . . 3.100 2.226 2.199 2.249 . 0 0 "[ . 1 .]" 1
1293 1 63 LEU HA 1 64 GLN HA . . 4.880 4.484 4.470 4.507 . 0 0 "[ . 1 .]" 1
1294 1 63 LEU HA 1 64 GLN HB3 . . 4.570 4.591 4.569 4.619 0.049 11 0 "[ . 1 .]" 1
1295 1 63 LEU HA 1 76 TYR QD . . 4.790 4.749 4.582 4.809 0.019 5 0 "[ . 1 .]" 1
1296 1 63 LEU HA 1 79 LEU QD . . 4.140 3.861 3.825 3.918 . 0 0 "[ . 1 .]" 1
1297 1 63 LEU HA 1 82 TYR QD . . 4.490 4.234 4.105 4.444 . 0 0 "[ . 1 .]" 1
1298 1 63 LEU HA 1 82 TYR QE . . 3.780 2.474 2.391 2.611 . 0 0 "[ . 1 .]" 1
1299 1 63 LEU HA 1 84 VAL MG2 . . 5.500 5.512 5.400 5.567 0.067 14 0 "[ . 1 .]" 1
1300 1 63 LEU HB2 1 63 LEU MD1 . . 3.600 2.551 2.519 2.587 . 0 0 "[ . 1 .]" 1
1301 1 63 LEU HB2 1 63 LEU QD . . 3.040 2.153 2.150 2.163 . 0 0 "[ . 1 .]" 1
1302 1 63 LEU HB2 1 63 LEU MD2 . . 3.600 2.321 2.300 2.356 . 0 0 "[ . 1 .]" 1
1303 1 63 LEU HB2 1 64 GLN H . . 4.970 4.362 4.310 4.395 . 0 0 "[ . 1 .]" 1
1304 1 63 LEU HB2 1 76 TYR H . . 5.000 4.820 4.704 4.928 . 0 0 "[ . 1 .]" 1
1305 1 63 LEU HB2 1 76 TYR HB2 . . 3.860 3.376 3.335 3.429 . 0 0 "[ . 1 .]" 1
1306 1 63 LEU HB2 1 76 TYR HB3 . . 4.720 4.757 4.736 4.800 0.080 11 0 "[ . 1 .]" 1
1307 1 63 LEU HB2 1 76 TYR QD . . 4.120 4.140 4.012 4.169 0.049 2 0 "[ . 1 .]" 1
1308 1 63 LEU HB2 1 79 LEU QD . . 3.210 2.208 2.118 2.278 . 0 0 "[ . 1 .]" 1
1309 1 63 LEU HB2 1 82 TYR QD . . 4.010 3.096 2.892 3.342 . 0 0 "[ . 1 .]" 1
1310 1 63 LEU HB2 1 82 TYR QE . . 3.820 2.196 2.153 2.229 . 0 0 "[ . 1 .]" 1
1311 1 63 LEU HB2 1 84 VAL MG2 . . 4.980 4.855 4.787 4.964 . 0 0 "[ . 1 .]" 1
1312 1 63 LEU HB3 1 64 GLN H . . 4.760 4.208 4.153 4.257 . 0 0 "[ . 1 .]" 1
1313 1 63 LEU HB3 1 76 TYR H . . 4.500 3.400 3.244 3.488 . 0 0 "[ . 1 .]" 1
1314 1 63 LEU HB3 1 76 TYR HB2 . . 3.800 2.103 2.083 2.161 . 0 0 "[ . 1 .]" 1
1315 1 63 LEU HB3 1 76 TYR HB3 . . 4.580 3.712 3.672 3.755 . 0 0 "[ . 1 .]" 1
1316 1 63 LEU HB3 1 76 TYR QD . . 3.620 2.462 2.336 2.484 . 0 0 "[ . 1 .]" 1
1317 1 63 LEU HB3 1 76 TYR QE . . 4.760 4.530 4.412 4.617 . 0 0 "[ . 1 .]" 1
1318 1 63 LEU HB3 1 82 TYR QD . . 5.280 4.652 4.468 4.885 . 0 0 "[ . 1 .]" 1
1319 1 63 LEU HB3 1 82 TYR QE . . 3.780 3.787 3.754 3.811 0.031 11 0 "[ . 1 .]" 1
1320 1 63 LEU QD 1 64 GLN H . . 3.160 2.208 2.129 2.312 . 0 0 "[ . 1 .]" 1
1321 1 63 LEU QD 1 64 GLN HB3 . . 4.630 4.315 4.245 4.416 . 0 0 "[ . 1 .]" 1
1322 1 63 LEU QD 1 65 ILE HG13 . . 3.240 3.132 3.056 3.226 . 0 0 "[ . 1 .]" 1
1323 1 63 LEU QD 1 76 TYR HB2 . . 3.860 3.413 3.239 3.552 . 0 0 "[ . 1 .]" 1
1324 1 63 LEU QD 1 76 TYR HB3 . . 4.700 4.253 4.010 4.388 . 0 0 "[ . 1 .]" 1
1325 1 63 LEU QD 1 76 TYR QD . . 3.630 3.207 3.017 3.305 . 0 0 "[ . 1 .]" 1
1326 1 63 LEU QD 1 76 TYR QE . . 4.360 3.888 3.676 3.979 . 0 0 "[ . 1 .]" 1
1327 1 63 LEU QD 1 82 TYR HA . . 4.120 3.773 3.627 3.938 . 0 0 "[ . 1 .]" 1
1328 1 63 LEU QD 1 82 TYR QD . . 3.120 2.103 2.035 2.202 . 0 0 "[ . 1 .]" 1
1329 1 63 LEU QD 1 82 TYR QE . . 3.390 2.445 2.384 2.505 . 0 0 "[ . 1 .]" 1
1330 1 63 LEU QD 1 86 VAL HA . . 5.440 4.738 4.645 4.834 . 0 0 "[ . 1 .]" 1
1331 1 63 LEU QD 1 96 ILE HA . . 4.180 3.728 3.651 3.815 . 0 0 "[ . 1 .]" 1
1332 1 63 LEU QD 1 96 ILE MD . . 3.140 2.137 2.078 2.189 . 0 0 "[ . 1 .]" 1
1333 1 63 LEU QD 1 97 ALA HA . . 4.820 4.173 4.063 4.291 . 0 0 "[ . 1 .]" 1
1334 1 63 LEU MD1 1 65 ILE HG13 . . 3.720 3.589 3.454 3.720 . 0 0 "[ . 1 .]" 1
1335 1 63 LEU MD1 1 76 TYR HB2 . . 5.230 4.972 4.937 5.032 . 0 0 "[ . 1 .]" 1
1336 1 63 LEU MD1 1 82 TYR HA . . 4.870 4.816 4.675 4.886 0.016 4 0 "[ . 1 .]" 1
1337 1 63 LEU MD1 1 82 TYR QD . . 3.810 2.240 2.186 2.310 . 0 0 "[ . 1 .]" 1
1338 1 63 LEU MD1 1 82 TYR QE . . 4.080 2.493 2.432 2.559 . 0 0 "[ . 1 .]" 1
1339 1 63 LEU MD2 1 65 ILE HG13 . . 3.720 3.458 3.332 3.671 . 0 0 "[ . 1 .]" 1
1340 1 63 LEU MD2 1 76 TYR HB2 . . 5.230 3.477 3.284 3.631 . 0 0 "[ . 1 .]" 1
1341 1 63 LEU MD2 1 82 TYR HA . . 4.870 3.945 3.746 4.156 . 0 0 "[ . 1 .]" 1
1342 1 63 LEU MD2 1 82 TYR QD . . 3.810 2.557 2.407 2.774 . 0 0 "[ . 1 .]" 1
1343 1 63 LEU MD2 1 82 TYR QE . . 4.080 3.532 3.427 3.625 . 0 0 "[ . 1 .]" 1
1344 1 63 LEU HG 1 64 GLN H . . 4.200 3.270 3.098 3.384 . 0 0 "[ . 1 .]" 1
1345 1 63 LEU HG 1 64 GLN HA . . 4.720 4.076 3.880 4.205 . 0 0 "[ . 1 .]" 1
1346 1 63 LEU HG 1 76 TYR QD . . 3.880 3.017 2.821 3.116 . 0 0 "[ . 1 .]" 1
1347 1 63 LEU HG 1 76 TYR QE . . 4.550 3.989 3.642 4.194 . 0 0 "[ . 1 .]" 1
1348 1 63 LEU HG 1 82 TYR QE . . 4.480 4.527 4.507 4.538 0.058 3 0 "[ . 1 .]" 1
1349 1 64 GLN H 1 64 GLN HB2 . . 3.850 3.076 3.033 3.122 . 0 0 "[ . 1 .]" 1
1350 1 64 GLN H 1 64 GLN HB3 . . 3.690 2.562 2.530 2.591 . 0 0 "[ . 1 .]" 1
1351 1 64 GLN H 1 64 GLN HG3 . . 4.800 4.742 4.679 4.780 . 0 0 "[ . 1 .]" 1
1352 1 64 GLN H 1 65 ILE H . . 4.520 4.444 4.395 4.492 . 0 0 "[ . 1 .]" 1
1353 1 64 GLN H 1 65 ILE HG13 . . 4.720 4.322 4.208 4.404 . 0 0 "[ . 1 .]" 1
1354 1 64 GLN H 1 75 TRP HD1 . . 4.880 4.685 4.598 4.802 . 0 0 "[ . 1 .]" 1
1355 1 64 GLN H 1 82 TYR QE . . 4.740 4.558 4.481 4.674 . 0 0 "[ . 1 .]" 1
1356 1 64 GLN HA 1 64 GLN HG2 . . 4.160 3.220 3.131 3.305 . 0 0 "[ . 1 .]" 1
1357 1 64 GLN HA 1 64 GLN HG3 . . 3.890 2.606 2.535 2.669 . 0 0 "[ . 1 .]" 1
1358 1 64 GLN HA 1 65 ILE H . . 3.050 2.112 2.082 2.140 . 0 0 "[ . 1 .]" 1
1359 1 64 GLN HA 1 65 ILE HA . . 4.640 4.463 4.436 4.487 . 0 0 "[ . 1 .]" 1
1360 1 64 GLN HA 1 65 ILE HB . . 4.690 4.536 4.484 4.592 . 0 0 "[ . 1 .]" 1
1361 1 64 GLN HA 1 74 GLN H . . 4.770 4.488 4.349 4.690 . 0 0 "[ . 1 .]" 1
1362 1 64 GLN HA 1 75 TRP HA . . 3.780 2.927 2.870 3.071 . 0 0 "[ . 1 .]" 1
1363 1 64 GLN HA 1 75 TRP QB . . 5.010 4.758 4.696 4.903 . 0 0 "[ . 1 .]" 1
1364 1 64 GLN HA 1 75 TRP HD1 . . 3.370 2.302 2.165 2.422 . 0 0 "[ . 1 .]" 1
1365 1 64 GLN HA 1 75 TRP HE1 . . 4.770 4.113 3.911 4.208 . 0 0 "[ . 1 .]" 1
1366 1 64 GLN HA 1 76 TYR H . . 4.800 4.093 3.953 4.239 . 0 0 "[ . 1 .]" 1
1367 1 64 GLN HA 1 76 TYR QD . . 4.610 3.928 3.716 4.093 . 0 0 "[ . 1 .]" 1
1368 1 64 GLN HB2 1 75 TRP HA . . 5.030 4.203 4.117 4.300 . 0 0 "[ . 1 .]" 1
1369 1 64 GLN HB2 1 75 TRP HD1 . . 3.450 2.526 2.410 2.638 . 0 0 "[ . 1 .]" 1
1370 1 64 GLN HB2 1 75 TRP HE1 . . 3.470 2.632 2.429 2.832 . 0 0 "[ . 1 .]" 1
1371 1 64 GLN HB3 1 65 ILE H . . 4.780 4.268 4.187 4.334 . 0 0 "[ . 1 .]" 1
1372 1 64 GLN HB3 1 75 TRP HD1 . . 5.040 4.063 3.959 4.160 . 0 0 "[ . 1 .]" 1
1373 1 64 GLN HB3 1 75 TRP HE1 . . 4.840 3.999 3.824 4.210 . 0 0 "[ . 1 .]" 1
1374 1 64 GLN QE 1 75 TRP HE1 . . 5.260 3.770 3.537 4.020 . 0 0 "[ . 1 .]" 1
1375 1 64 GLN QE 1 120 VAL QG . . 3.330 2.435 2.156 3.039 . 0 0 "[ . 1 .]" 1
1376 1 64 GLN HE21 1 120 VAL MG1 . . 4.740 3.684 3.367 4.408 . 0 0 "[ . 1 .]" 1
1377 1 64 GLN HE21 1 120 VAL MG2 . . 4.740 3.156 2.594 4.724 . 0 0 "[ . 1 .]" 1
1378 1 64 GLN HE22 1 120 VAL MG1 . . 4.740 3.155 2.811 3.925 . 0 0 "[ . 1 .]" 1
1379 1 64 GLN HE22 1 120 VAL MG2 . . 4.740 2.875 2.377 4.087 . 0 0 "[ . 1 .]" 1
1380 1 64 GLN HG2 1 65 ILE H . . 3.960 3.268 3.047 3.367 . 0 0 "[ . 1 .]" 1
1381 1 64 GLN HG2 1 65 ILE HA . . 4.380 4.012 3.872 4.110 . 0 0 "[ . 1 .]" 1
1382 1 64 GLN HG2 1 75 TRP HE1 . . 4.560 4.034 3.852 4.177 . 0 0 "[ . 1 .]" 1
1383 1 64 GLN HG3 1 65 ILE H . . 4.090 3.034 2.816 3.158 . 0 0 "[ . 1 .]" 1
1384 1 64 GLN HG3 1 75 TRP HD1 . . 4.130 2.606 2.472 2.753 . 0 0 "[ . 1 .]" 1
1385 1 64 GLN HG3 1 75 TRP HE1 . . 4.100 2.724 2.473 2.982 . 0 0 "[ . 1 .]" 1
1386 1 65 ILE H 1 65 ILE HB . . 3.410 2.714 2.666 2.766 . 0 0 "[ . 1 .]" 1
1387 1 65 ILE H 1 65 ILE MD . . 4.310 4.268 4.229 4.314 0.004 11 0 "[ . 1 .]" 1
1388 1 65 ILE H 1 65 ILE HG12 . . 4.490 3.889 3.835 3.936 . 0 0 "[ . 1 .]" 1
1389 1 65 ILE H 1 65 ILE HG13 . . 4.040 2.939 2.892 2.986 . 0 0 "[ . 1 .]" 1
1390 1 65 ILE H 1 65 ILE MG . . 4.270 3.941 3.915 3.965 . 0 0 "[ . 1 .]" 1
1391 1 65 ILE H 1 73 HIS HB3 . . 5.230 4.690 4.499 4.845 . 0 0 "[ . 1 .]" 1
1392 1 65 ILE H 1 74 GLN H . . 3.570 2.938 2.814 3.033 . 0 0 "[ . 1 .]" 1
1393 1 65 ILE H 1 74 GLN HB2 . . 4.380 3.270 3.066 3.742 . 0 0 "[ . 1 .]" 1
1394 1 65 ILE H 1 75 TRP HD1 . . 4.150 3.720 3.530 3.918 . 0 0 "[ . 1 .]" 1
1395 1 65 ILE H 1 76 TYR QE . . 4.750 3.928 3.486 4.167 . 0 0 "[ . 1 .]" 1
1396 1 65 ILE HA 1 65 ILE MD . . 3.930 3.835 3.803 3.863 . 0 0 "[ . 1 .]" 1
1397 1 65 ILE HA 1 65 ILE HG12 . . 3.390 2.485 2.434 2.537 . 0 0 "[ . 1 .]" 1
1398 1 65 ILE HA 1 65 ILE HG13 . . 3.470 3.183 3.143 3.238 . 0 0 "[ . 1 .]" 1
1399 1 65 ILE HA 1 65 ILE MG . . 3.050 2.483 2.439 2.512 . 0 0 "[ . 1 .]" 1
1400 1 65 ILE HA 1 66 ALA H . . 2.820 2.213 2.171 2.294 . 0 0 "[ . 1 .]" 1
1401 1 65 ILE HA 1 66 ALA MB . . 4.130 4.084 4.026 4.134 0.004 6 0 "[ . 1 .]" 1
1402 1 65 ILE HB 1 65 ILE MD . . 3.370 2.562 2.539 2.590 . 0 0 "[ . 1 .]" 1
1403 1 65 ILE HB 1 66 ALA H . . 4.370 4.118 3.950 4.190 . 0 0 "[ . 1 .]" 1
1404 1 65 ILE HB 1 67 GLU H . . 5.500 5.553 5.514 5.590 0.090 14 0 "[ . 1 .]" 1
1405 1 65 ILE HB 1 74 GLN H . . 3.920 3.719 3.532 3.854 . 0 0 "[ . 1 .]" 1
1406 1 65 ILE HB 1 74 GLN HB2 . . 3.540 2.391 2.275 2.607 . 0 0 "[ . 1 .]" 1
1407 1 65 ILE HB 1 76 TYR QE . . 3.460 2.824 2.650 3.015 . 0 0 "[ . 1 .]" 1
1408 1 65 ILE MD 1 66 ALA H . . 5.500 5.042 4.861 5.094 . 0 0 "[ . 1 .]" 1
1409 1 65 ILE MD 1 76 TYR QE . . 3.170 2.323 2.265 2.434 . 0 0 "[ . 1 .]" 1
1410 1 65 ILE MD 1 96 ILE MD . . 2.900 2.267 2.152 2.394 . 0 0 "[ . 1 .]" 1
1411 1 65 ILE HG12 1 65 ILE MG . . 3.020 2.494 2.457 2.517 . 0 0 "[ . 1 .]" 1
1412 1 65 ILE HG12 1 66 ALA H . . 4.450 4.414 4.343 4.464 0.014 13 0 "[ . 1 .]" 1
1413 1 65 ILE HG12 1 76 TYR QE . . 4.690 4.245 3.998 4.494 . 0 0 "[ . 1 .]" 1
1414 1 65 ILE HG12 1 96 ILE MD . . 4.730 4.572 4.384 4.730 0.000 13 0 "[ . 1 .]" 1
1415 1 65 ILE HG13 1 65 ILE MG . . 3.320 3.235 3.227 3.245 . 0 0 "[ . 1 .]" 1
1416 1 65 ILE HG13 1 76 TYR QE . . 4.340 2.754 2.399 3.041 . 0 0 "[ . 1 .]" 1
1417 1 65 ILE HG13 1 96 ILE MD . . 4.440 3.910 3.739 4.096 . 0 0 "[ . 1 .]" 1
1418 1 65 ILE MG 1 66 ALA H . . 2.890 2.596 2.351 2.678 . 0 0 "[ . 1 .]" 1
1419 1 65 ILE MG 1 66 ALA MB . . 4.130 3.896 3.856 3.972 . 0 0 "[ . 1 .]" 1
1420 1 65 ILE MG 1 67 GLU H . . 4.200 4.022 3.944 4.157 . 0 0 "[ . 1 .]" 1
1421 1 65 ILE MG 1 67 GLU HA . . 4.040 3.638 3.441 3.883 . 0 0 "[ . 1 .]" 1
1422 1 65 ILE MG 1 67 GLU HG2 . . 5.010 4.015 3.687 4.299 . 0 0 "[ . 1 .]" 1
1423 1 65 ILE MG 1 67 GLU QG . . 4.380 3.789 3.534 3.972 . 0 0 "[ . 1 .]" 1
1424 1 65 ILE MG 1 67 GLU HG3 . . 5.010 4.668 4.323 4.919 . 0 0 "[ . 1 .]" 1
1425 1 65 ILE MG 1 74 GLN HB2 . . 4.940 3.693 3.588 3.845 . 0 0 "[ . 1 .]" 1
1426 1 65 ILE MG 1 76 TYR QE . . 4.170 3.940 3.841 4.093 . 0 0 "[ . 1 .]" 1
1427 1 66 ALA H 1 66 ALA MB . . 2.960 2.363 2.288 2.475 . 0 0 "[ . 1 .]" 1
1428 1 66 ALA H 1 67 GLU H . . 4.440 4.441 4.378 4.464 0.024 9 0 "[ . 1 .]" 1
1429 1 66 ALA HA 1 67 GLU H . . 2.940 2.160 2.117 2.213 . 0 0 "[ . 1 .]" 1
1430 1 66 ALA HA 1 67 GLU QG . . 4.680 3.899 3.680 4.086 . 0 0 "[ . 1 .]" 1
1431 1 66 ALA HA 1 73 HIS HA . . 3.290 2.323 2.222 2.406 . 0 0 "[ . 1 .]" 1
1432 1 66 ALA HA 1 73 HIS HB3 . . 4.620 4.009 3.890 4.146 . 0 0 "[ . 1 .]" 1
1433 1 66 ALA HA 1 73 HIS HE1 . . 4.910 4.578 4.270 4.916 0.006 11 0 "[ . 1 .]" 1
1434 1 66 ALA HA 1 74 GLN H . . 4.240 3.634 3.524 3.777 . 0 0 "[ . 1 .]" 1
1435 1 66 ALA MB 1 67 GLU H . . 3.540 3.134 3.019 3.253 . 0 0 "[ . 1 .]" 1
1436 1 66 ALA MB 1 67 GLU HA . . 5.240 4.533 4.422 4.606 . 0 0 "[ . 1 .]" 1
1437 1 66 ALA MB 1 73 HIS HA . . 4.160 3.760 3.643 3.889 . 0 0 "[ . 1 .]" 1
1438 1 66 ALA MB 1 73 HIS HE1 . . 3.480 3.008 2.724 3.310 . 0 0 "[ . 1 .]" 1
1439 1 66 ALA MB 1 74 GLN H . . 5.500 4.810 4.683 4.958 . 0 0 "[ . 1 .]" 1
1440 1 67 GLU H 1 67 GLU HB2 . . 3.440 2.530 2.391 2.677 . 0 0 "[ . 1 .]" 1
1441 1 67 GLU H 1 67 GLU HB3 . . 4.050 3.621 3.577 3.664 . 0 0 "[ . 1 .]" 1
1442 1 67 GLU H 1 67 GLU QG . . 3.010 2.310 2.077 2.505 . 0 0 "[ . 1 .]" 1
1443 1 67 GLU H 1 72 TYR HB2 . . 4.550 4.070 3.788 4.268 . 0 0 "[ . 1 .]" 1
1444 1 67 GLU H 1 73 HIS HA . . 3.750 3.062 2.905 3.308 . 0 0 "[ . 1 .]" 1
1445 1 67 GLU H 1 74 GLN H . . 4.750 4.622 4.376 4.764 0.014 7 0 "[ . 1 .]" 1
1446 1 67 GLU H 1 74 GLN HB2 . . 5.500 5.447 5.231 5.516 0.016 12 0 "[ . 1 .]" 1
1447 1 67 GLU HA 1 67 GLU HG2 . . 4.050 2.418 2.308 2.541 . 0 0 "[ . 1 .]" 1
1448 1 67 GLU HA 1 67 GLU QG . . 3.400 2.363 2.270 2.466 . 0 0 "[ . 1 .]" 1
1449 1 67 GLU HA 1 67 GLU HG3 . . 4.050 3.339 3.161 3.512 . 0 0 "[ . 1 .]" 1
1450 1 67 GLU HA 1 68 ASP H . . 3.530 2.288 2.174 2.383 . 0 0 "[ . 1 .]" 1
1451 1 67 GLU HA 1 68 ASP QB . . 4.730 4.335 4.010 4.712 . 0 0 "[ . 1 .]" 1
1452 1 67 GLU HB2 1 68 ASP H . . 4.040 3.857 3.676 4.063 0.023 9 0 "[ . 1 .]" 1
1453 1 67 GLU HB2 1 69 ASN H . . 4.170 3.482 2.543 4.180 0.010 3 0 "[ . 1 .]" 1
1454 1 67 GLU HB2 1 70 GLY H . . 4.580 3.881 3.523 4.326 . 0 0 "[ . 1 .]" 1
1455 1 67 GLU HB2 1 71 GLU H . . 4.570 4.060 3.440 4.413 . 0 0 "[ . 1 .]" 1
1456 1 67 GLU HB2 1 72 TYR H . . 4.080 3.037 2.823 3.338 . 0 0 "[ . 1 .]" 1
1457 1 67 GLU HB2 1 72 TYR HA . . 5.080 4.673 4.455 4.909 . 0 0 "[ . 1 .]" 1
1458 1 67 GLU HB3 1 68 ASP H . . 4.430 2.696 2.380 2.966 . 0 0 "[ . 1 .]" 1
1459 1 67 GLU HB3 1 69 ASN H . . 4.450 2.955 2.218 3.683 . 0 0 "[ . 1 .]" 1
1460 1 67 GLU HB3 1 70 GLY H . . 4.980 4.489 3.689 4.867 . 0 0 "[ . 1 .]" 1
1461 1 67 GLU QG 1 72 TYR H . . 4.330 4.342 4.212 4.373 0.043 14 0 "[ . 1 .]" 1
1462 1 67 GLU QG 1 72 TYR HA . . 4.830 4.552 4.364 4.809 . 0 0 "[ . 1 .]" 1
1463 1 67 GLU QG 1 72 TYR HB2 . . 4.050 2.964 2.807 3.151 . 0 0 "[ . 1 .]" 1
1464 1 67 GLU QG 1 73 HIS HA . . 4.070 3.654 3.312 4.095 0.025 14 0 "[ . 1 .]" 1
1465 1 67 GLU QG 1 74 GLN QE . . 3.420 2.403 2.306 2.526 . 0 0 "[ . 1 .]" 1
1466 1 67 GLU QG 1 115 ARG QG . . 5.180 4.403 4.098 5.050 . 0 0 "[ . 1 .]" 1
1467 1 67 GLU HG2 1 74 GLN HE21 . . 4.500 2.899 2.563 3.732 . 0 0 "[ . 1 .]" 1
1468 1 67 GLU HG2 1 74 GLN HE22 . . 4.500 2.969 2.682 3.100 . 0 0 "[ . 1 .]" 1
1469 1 67 GLU HG3 1 74 GLN HE21 . . 4.500 3.212 2.845 4.023 . 0 0 "[ . 1 .]" 1
1470 1 67 GLU HG3 1 74 GLN HE22 . . 4.500 3.893 2.588 4.339 . 0 0 "[ . 1 .]" 1
1471 1 68 ASP H 1 68 ASP QB . . 3.450 2.346 2.104 2.920 . 0 0 "[ . 1 .]" 1
1472 1 68 ASP H 1 69 ASN H . . 4.210 2.968 2.743 3.241 . 0 0 "[ . 1 .]" 1
1473 1 68 ASP QB 1 69 ASN H . . 4.080 3.258 2.792 3.919 . 0 0 "[ . 1 .]" 1
1474 1 68 ASP QB 1 70 GLY H . . 5.340 4.749 4.538 4.952 . 0 0 "[ . 1 .]" 1
1475 1 69 ASN H 1 69 ASN HB2 . . 4.120 2.372 2.071 3.610 . 0 0 "[ . 1 .]" 1
1476 1 69 ASN H 1 69 ASN QB . . 3.600 2.287 2.048 2.706 . 0 0 "[ . 1 .]" 1
1477 1 69 ASN H 1 69 ASN HB3 . . 4.120 3.484 2.796 3.616 . 0 0 "[ . 1 .]" 1
1478 1 69 ASN H 1 70 GLY H . . 3.540 2.803 2.602 2.981 . 0 0 "[ . 1 .]" 1
1479 1 69 ASN H 1 71 GLU H . . 4.720 4.479 4.024 4.729 0.009 9 0 "[ . 1 .]" 1
1480 1 69 ASN HA 1 69 ASN QB . . 2.620 2.448 2.175 2.582 . 0 0 "[ . 1 .]" 1
1481 1 69 ASN QB 1 70 GLY H . . 3.970 3.381 3.087 3.657 . 0 0 "[ . 1 .]" 1
1482 1 69 ASN QB 1 71 GLU H . . 3.860 3.376 2.694 3.889 0.029 9 0 "[ . 1 .]" 1
1483 1 69 ASN QB 1 72 TYR QD . . 4.860 3.670 2.155 4.864 0.004 3 0 "[ . 1 .]" 1
1484 1 69 ASN HB2 1 70 GLY H . . 4.510 3.631 3.242 3.933 . 0 0 "[ . 1 .]" 1
1485 1 69 ASN HB2 1 71 GLU H . . 4.470 3.781 2.963 4.473 0.003 9 0 "[ . 1 .]" 1
1486 1 69 ASN HB3 1 70 GLY H . . 4.510 4.065 3.523 4.348 . 0 0 "[ . 1 .]" 1
1487 1 69 ASN HB3 1 71 GLU H . . 4.470 3.892 3.094 4.524 0.054 12 0 "[ . 1 .]" 1
1488 1 70 GLY H 1 70 GLY QA . . 2.580 2.215 2.176 2.260 . 0 0 "[ . 1 .]" 1
1489 1 70 GLY H 1 71 GLU H . . 3.120 2.727 2.554 2.911 . 0 0 "[ . 1 .]" 1
1490 1 70 GLY H 1 71 GLU QB . . 5.280 5.314 5.229 5.385 0.105 8 0 "[ . 1 .]" 1
1491 1 70 GLY H 1 71 GLU QG . . 5.330 4.321 3.939 4.706 . 0 0 "[ . 1 .]" 1
1492 1 71 GLU H 1 71 GLU QB . . 3.140 3.097 2.893 3.228 0.088 5 0 "[ . 1 .]" 1
1493 1 71 GLU H 1 71 GLU HG2 . . 3.740 2.349 2.054 2.857 . 0 0 "[ . 1 .]" 1
1494 1 71 GLU H 1 71 GLU QG . . 3.170 2.274 2.017 2.543 . 0 0 "[ . 1 .]" 1
1495 1 71 GLU H 1 71 GLU HG3 . . 3.740 3.257 2.573 3.746 0.006 11 0 "[ . 1 .]" 1
1496 1 71 GLU H 1 72 TYR H . . 2.690 1.974 1.813 2.122 . 0 0 "[ . 1 .]" 1
1497 1 71 GLU H 1 72 TYR HA . . 4.710 4.672 4.495 4.790 0.080 2 0 "[ . 1 .]" 1
1498 1 71 GLU H 1 72 TYR QD . . 4.380 3.984 3.190 4.421 0.041 14 0 "[ . 1 .]" 1
1499 1 71 GLU HA 1 71 GLU QG . . 3.560 3.385 3.345 3.429 . 0 0 "[ . 1 .]" 1
1500 1 71 GLU HA 1 118 GLY H . . 4.580 3.715 3.355 4.005 . 0 0 "[ . 1 .]" 1
1501 1 71 GLU QB 1 72 TYR H . . 3.710 3.686 3.606 3.853 0.143 13 0 "[ . 1 .]" 1
1502 1 71 GLU QB 1 72 TYR HA . . 4.340 4.403 4.355 4.450 0.110 13 0 "[ . 1 .]" 1
1503 1 71 GLU QB 1 72 TYR QD . . 4.130 4.119 3.972 4.160 0.030 2 0 "[ . 1 .]" 1
1504 1 71 GLU QB 1 72 TYR QE . . 4.730 4.721 4.458 4.767 0.037 3 0 "[ . 1 .]" 1
1505 1 71 GLU QB 1 118 GLY H . . 4.010 3.184 2.824 3.525 . 0 0 "[ . 1 .]" 1
1506 1 71 GLU QB 1 118 GLY HA2 . . 4.270 3.354 2.959 3.624 . 0 0 "[ . 1 .]" 1
1507 1 71 GLU QB 1 118 GLY HA3 . . 5.150 4.541 4.139 4.838 . 0 0 "[ . 1 .]" 1
1508 1 71 GLU QG 1 72 TYR H . . 4.080 2.690 2.423 3.356 . 0 0 "[ . 1 .]" 1
1509 1 71 GLU QG 1 72 TYR HA . . 5.040 3.977 3.632 4.315 . 0 0 "[ . 1 .]" 1
1510 1 71 GLU QG 1 72 TYR HB2 . . 4.180 3.798 3.486 4.046 . 0 0 "[ . 1 .]" 1
1511 1 71 GLU QG 1 72 TYR QD . . 3.940 2.210 2.117 2.371 . 0 0 "[ . 1 .]" 1
1512 1 71 GLU QG 1 117 LYS HG3 . . 4.680 3.508 2.507 4.691 0.011 10 0 "[ . 1 .]" 1
1513 1 71 GLU QG 1 118 GLY H . . 4.790 4.324 3.656 4.790 . 0 0 "[ . 1 .]" 1
1514 1 71 GLU QG 1 118 GLY HA2 . . 5.340 5.223 4.761 5.371 0.031 7 0 "[ . 1 .]" 1
1515 1 72 TYR H 1 72 TYR HB2 . . 3.230 2.426 2.347 2.504 . 0 0 "[ . 1 .]" 1
1516 1 72 TYR H 1 72 TYR HB3 . . 3.590 3.629 3.596 3.676 0.086 13 0 "[ . 1 .]" 1
1517 1 72 TYR H 1 72 TYR QD . . 3.620 2.948 2.742 3.248 . 0 0 "[ . 1 .]" 1
1518 1 72 TYR H 1 73 HIS H . . 4.730 4.581 4.504 4.646 . 0 0 "[ . 1 .]" 1
1519 1 72 TYR HA 1 72 TYR QD . . 3.560 2.897 2.673 3.053 . 0 0 "[ . 1 .]" 1
1520 1 72 TYR HA 1 72 TYR QE . . 4.680 4.550 4.387 4.681 0.001 13 0 "[ . 1 .]" 1
1521 1 72 TYR HA 1 73 HIS H . . 2.890 2.186 2.132 2.242 . 0 0 "[ . 1 .]" 1
1522 1 72 TYR HA 1 73 HIS HA . . 4.620 4.470 4.418 4.523 . 0 0 "[ . 1 .]" 1
1523 1 72 TYR HA 1 73 HIS HB2 . . 5.340 4.505 4.397 4.602 . 0 0 "[ . 1 .]" 1
1524 1 72 TYR HA 1 73 HIS HD2 . . 4.130 3.559 3.132 3.951 . 0 0 "[ . 1 .]" 1
1525 1 72 TYR HA 1 116 MET HB2 . . 5.300 5.192 5.041 5.326 0.026 14 0 "[ . 1 .]" 1
1526 1 72 TYR HA 1 117 LYS HA . . 3.390 2.538 2.451 2.740 . 0 0 "[ . 1 .]" 1
1527 1 72 TYR HA 1 117 LYS HB2 . . 4.520 4.456 4.222 4.571 0.051 9 0 "[ . 1 .]" 1
1528 1 72 TYR HA 1 117 LYS HG2 . . 5.310 4.953 4.540 5.346 0.036 14 0 "[ . 1 .]" 1
1529 1 72 TYR HA 1 117 LYS HG3 . . 4.730 4.001 3.528 4.412 . 0 0 "[ . 1 .]" 1
1530 1 72 TYR HA 1 118 GLY H . . 4.100 3.336 3.113 3.519 . 0 0 "[ . 1 .]" 1
1531 1 72 TYR HA 1 118 GLY HA2 . . 5.500 5.438 5.182 5.541 0.041 1 0 "[ . 1 .]" 1
1532 1 72 TYR HB2 1 73 HIS H . . 4.400 4.122 4.004 4.240 . 0 0 "[ . 1 .]" 1
1533 1 72 TYR HB3 1 73 HIS H . . 3.430 2.884 2.693 3.062 . 0 0 "[ . 1 .]" 1
1534 1 72 TYR QD 1 73 HIS H . . 4.130 3.287 3.057 3.640 . 0 0 "[ . 1 .]" 1
1535 1 72 TYR QD 1 115 ARG HA . . 5.470 4.854 4.360 5.476 0.006 13 0 "[ . 1 .]" 1
1536 1 72 TYR QD 1 115 ARG QB . . 5.340 4.552 4.191 4.814 . 0 0 "[ . 1 .]" 1
1537 1 72 TYR QD 1 115 ARG QD . . 4.620 3.774 3.104 4.082 . 0 0 "[ . 1 .]" 1
1538 1 72 TYR QD 1 115 ARG HE . . 4.980 3.959 3.336 4.996 0.016 3 0 "[ . 1 .]" 1
1539 1 72 TYR QD 1 115 ARG HG2 . . 4.230 2.595 2.243 3.144 . 0 0 "[ . 1 .]" 1
1540 1 72 TYR QD 1 115 ARG QG . . 3.470 2.431 2.144 2.711 . 0 0 "[ . 1 .]" 1
1541 1 72 TYR QD 1 115 ARG HG3 . . 4.230 3.042 2.527 3.600 . 0 0 "[ . 1 .]" 1
1542 1 72 TYR QD 1 116 MET H . . 4.580 3.592 3.054 4.437 . 0 0 "[ . 1 .]" 1
1543 1 72 TYR QD 1 117 LYS HA . . 4.010 3.354 3.079 3.536 . 0 0 "[ . 1 .]" 1
1544 1 72 TYR QD 1 117 LYS HB2 . . 4.490 3.380 2.871 3.666 . 0 0 "[ . 1 .]" 1
1545 1 72 TYR QD 1 117 LYS HG2 . . 5.500 4.981 4.760 5.235 . 0 0 "[ . 1 .]" 1
1546 1 72 TYR QD 1 117 LYS HG3 . . 4.610 3.662 3.389 3.978 . 0 0 "[ . 1 .]" 1
1547 1 72 TYR QE 1 115 ARG QD . . 4.560 4.192 3.709 4.516 . 0 0 "[ . 1 .]" 1
1548 1 72 TYR QE 1 115 ARG QG . . 4.460 3.353 2.849 3.927 . 0 0 "[ . 1 .]" 1
1549 1 72 TYR QE 1 117 LYS H . . 5.500 4.735 3.964 5.389 . 0 0 "[ . 1 .]" 1
1550 1 72 TYR QE 1 117 LYS HA . . 4.230 4.023 3.798 4.264 0.034 3 0 "[ . 1 .]" 1
1551 1 72 TYR QE 1 117 LYS HB2 . . 3.420 2.488 2.308 2.659 . 0 0 "[ . 1 .]" 1
1552 1 72 TYR QE 1 117 LYS HB3 . . 4.230 4.089 3.968 4.234 0.004 10 0 "[ . 1 .]" 1
1553 1 72 TYR QE 1 117 LYS QD . . 4.150 3.061 2.557 3.411 . 0 0 "[ . 1 .]" 1
1554 1 72 TYR QE 1 117 LYS QE . . 4.660 3.693 2.680 4.677 0.017 12 0 "[ . 1 .]" 1
1555 1 72 TYR QE 1 117 LYS HG2 . . 4.470 4.489 4.431 4.531 0.061 5 0 "[ . 1 .]" 1
1556 1 72 TYR QE 1 117 LYS HG3 . . 3.860 3.166 3.007 3.267 . 0 0 "[ . 1 .]" 1
1557 1 73 HIS H 1 73 HIS HB2 . . 3.580 2.729 2.662 2.786 . 0 0 "[ . 1 .]" 1
1558 1 73 HIS H 1 73 HIS HD2 . . 3.970 3.197 2.786 3.520 . 0 0 "[ . 1 .]" 1
1559 1 73 HIS H 1 116 MET HB2 . . 4.100 3.487 3.353 3.674 . 0 0 "[ . 1 .]" 1
1560 1 73 HIS H 1 116 MET ME . . 4.520 4.389 4.253 4.523 0.003 9 0 "[ . 1 .]" 1
1561 1 73 HIS H 1 117 LYS HA . . 4.100 3.619 3.426 3.739 . 0 0 "[ . 1 .]" 1
1562 1 73 HIS HA 1 73 HIS HD2 . . 4.870 4.324 4.172 4.433 . 0 0 "[ . 1 .]" 1
1563 1 73 HIS HA 1 74 GLN H . . 3.060 2.256 2.119 2.325 . 0 0 "[ . 1 .]" 1
1564 1 73 HIS HA 1 74 GLN QE . . 5.340 5.341 5.143 5.393 0.053 5 0 "[ . 1 .]" 1
1565 1 73 HIS HA 1 116 MET ME . . 4.700 4.449 4.338 4.591 . 0 0 "[ . 1 .]" 1
1566 1 73 HIS HA 1 120 VAL QG . . 5.440 4.421 4.178 5.081 . 0 0 "[ . 1 .]" 1
1567 1 73 HIS HB2 1 74 GLN H . . 4.420 3.845 3.731 4.096 . 0 0 "[ . 1 .]" 1
1568 1 73 HIS HB2 1 120 VAL MG1 . . 3.850 3.279 2.885 3.880 0.030 11 0 "[ . 1 .]" 1
1569 1 73 HIS HB2 1 120 VAL MG2 . . 3.850 3.035 2.611 3.864 0.014 3 0 "[ . 1 .]" 1
1570 1 73 HIS HB3 1 74 GLN H . . 3.730 2.787 2.606 3.231 . 0 0 "[ . 1 .]" 1
1571 1 73 HIS HB3 1 75 TRP HD1 . . 5.380 5.196 4.976 5.374 . 0 0 "[ . 1 .]" 1
1572 1 73 HIS HB3 1 75 TRP HE1 . . 5.210 5.253 5.215 5.278 0.068 5 0 "[ . 1 .]" 1
1573 1 73 HIS HB3 1 116 MET HB2 . . 4.150 3.852 3.630 4.075 . 0 0 "[ . 1 .]" 1
1574 1 73 HIS HB3 1 116 MET ME . . 3.330 3.143 2.959 3.343 0.013 13 0 "[ . 1 .]" 1
1575 1 73 HIS HB3 1 120 VAL HA . . 4.850 4.482 4.181 4.736 . 0 0 "[ . 1 .]" 1
1576 1 73 HIS HB3 1 120 VAL MG1 . . 3.900 3.050 2.614 3.734 . 0 0 "[ . 1 .]" 1
1577 1 73 HIS HB3 1 120 VAL MG2 . . 3.900 2.917 2.636 3.755 . 0 0 "[ . 1 .]" 1
1578 1 73 HIS HD2 1 116 MET HB2 . . 4.620 3.946 3.777 4.132 . 0 0 "[ . 1 .]" 1
1579 1 73 HIS HD2 1 117 LYS HA . . 4.710 3.940 3.620 4.389 . 0 0 "[ . 1 .]" 1
1580 1 73 HIS HD2 1 118 GLY H . . 4.400 3.499 3.129 4.113 . 0 0 "[ . 1 .]" 1
1581 1 73 HIS HD2 1 118 GLY HA2 . . 5.500 4.683 4.313 5.072 . 0 0 "[ . 1 .]" 1
1582 1 73 HIS HD2 1 119 GLY H . . 3.860 2.887 2.617 3.098 . 0 0 "[ . 1 .]" 1
1583 1 73 HIS HD2 1 119 GLY HA3 . . 4.910 4.622 4.387 4.911 0.001 5 0 "[ . 1 .]" 1
1584 1 73 HIS HD2 1 120 VAL QG . . 4.200 3.377 2.868 4.390 0.190 11 0 "[ . 1 .]" 1
1585 1 73 HIS HE1 1 120 VAL QG . . 4.150 3.824 3.543 4.408 0.258 11 0 "[ . 1 .]" 1
1586 1 74 GLN H 1 74 GLN HG2 . . 4.750 4.328 4.218 4.747 . 0 0 "[ . 1 .]" 1
1587 1 74 GLN H 1 74 GLN QG . . 4.170 3.228 3.036 4.051 . 0 0 "[ . 1 .]" 1
1588 1 74 GLN H 1 74 GLN HG3 . . 4.750 3.349 3.110 4.395 . 0 0 "[ . 1 .]" 1
1589 1 74 GLN H 1 116 MET HB2 . . 5.500 5.261 5.024 5.542 0.042 14 0 "[ . 1 .]" 1
1590 1 74 GLN H 1 116 MET ME . . 4.600 3.663 3.496 4.115 . 0 0 "[ . 1 .]" 1
1591 1 74 GLN HA 1 75 TRP H . . 3.180 2.142 2.119 2.172 . 0 0 "[ . 1 .]" 1
1592 1 74 GLN HA 1 75 TRP QB . . 4.370 4.339 4.262 4.391 0.021 7 0 "[ . 1 .]" 1
1593 1 74 GLN HA 1 76 TYR QE . . 5.110 5.096 4.950 5.136 0.026 5 0 "[ . 1 .]" 1
1594 1 74 GLN HA 1 115 ARG QG . . 4.510 4.025 3.707 4.564 0.054 7 0 "[ . 1 .]" 1
1595 1 74 GLN HA 1 116 MET H . . 4.180 3.558 3.251 3.687 . 0 0 "[ . 1 .]" 1
1596 1 74 GLN HA 1 116 MET HB2 . . 5.320 4.815 4.621 5.146 . 0 0 "[ . 1 .]" 1
1597 1 74 GLN HA 1 116 MET ME . . 3.660 2.886 2.702 3.114 . 0 0 "[ . 1 .]" 1
1598 1 74 GLN HB2 1 75 TRP H . . 4.470 4.160 4.046 4.329 . 0 0 "[ . 1 .]" 1
1599 1 74 GLN HB2 1 76 TYR QE . . 3.700 3.021 2.868 3.377 . 0 0 "[ . 1 .]" 1
1600 1 74 GLN HB3 1 75 TRP H . . 3.790 3.102 2.897 3.233 . 0 0 "[ . 1 .]" 1
1601 1 74 GLN HB3 1 76 TYR QE . . 4.030 2.914 2.666 3.054 . 0 0 "[ . 1 .]" 1
1602 1 74 GLN HB3 1 113 PHE QE . . 4.360 2.416 2.252 3.100 . 0 0 "[ . 1 .]" 1
1603 1 74 GLN HB3 1 113 PHE HZ . . 5.500 4.394 4.194 4.886 . 0 0 "[ . 1 .]" 1
1604 1 74 GLN HB3 1 114 GLN H . . 5.500 4.683 4.503 4.986 . 0 0 "[ . 1 .]" 1
1605 1 74 GLN QE 1 115 ARG QG . . 4.810 3.725 3.398 4.345 . 0 0 "[ . 1 .]" 1
1606 1 74 GLN QE 1 131 PHE QE . . 4.810 3.638 3.364 4.058 . 0 0 "[ . 1 .]" 1
1607 1 74 GLN QE 1 131 PHE HZ . . 4.780 2.794 2.520 3.309 . 0 0 "[ . 1 .]" 1
1608 1 74 GLN QG 1 113 PHE QD . . 4.630 4.468 3.836 4.634 0.004 15 0 "[ . 1 .]" 1
1609 1 74 GLN QG 1 113 PHE QE . . 3.810 2.572 2.057 2.786 . 0 0 "[ . 1 .]" 1
1610 1 74 GLN QG 1 113 PHE HZ . . 4.420 2.947 2.321 3.138 . 0 0 "[ . 1 .]" 1
1611 1 74 GLN QG 1 115 ARG H . . 5.000 5.021 5.003 5.043 0.043 13 0 "[ . 1 .]" 1
1612 1 74 GLN QG 1 115 ARG QB . . 3.880 3.031 2.590 3.502 . 0 0 "[ . 1 .]" 1
1613 1 74 GLN QG 1 115 ARG QG . . 4.290 2.916 2.549 3.639 . 0 0 "[ . 1 .]" 1
1614 1 74 GLN HG2 1 113 PHE HZ . . 5.020 3.025 2.591 3.190 . 0 0 "[ . 1 .]" 1
1615 1 74 GLN HG3 1 113 PHE HZ . . 5.020 4.358 2.620 4.742 . 0 0 "[ . 1 .]" 1
1616 1 75 TRP H 1 113 PHE HA . . 4.730 4.749 4.733 4.777 0.047 4 0 "[ . 1 .]" 1
1617 1 75 TRP H 1 114 GLN H . . 3.960 3.012 2.949 3.060 . 0 0 "[ . 1 .]" 1
1618 1 75 TRP H 1 116 MET ME . . 3.540 2.673 2.475 2.882 . 0 0 "[ . 1 .]" 1
1619 1 75 TRP HA 1 75 TRP HD1 . . 3.320 2.180 2.147 2.204 . 0 0 "[ . 1 .]" 1
1620 1 75 TRP HA 1 75 TRP HE1 . . 4.760 4.684 4.652 4.704 . 0 0 "[ . 1 .]" 1
1621 1 75 TRP HA 1 76 TYR H . . 3.200 2.093 2.054 2.123 . 0 0 "[ . 1 .]" 1
1622 1 75 TRP HA 1 76 TYR HA . . 4.650 4.458 4.437 4.474 . 0 0 "[ . 1 .]" 1
1623 1 75 TRP HA 1 76 TYR HB2 . . 4.820 4.517 4.460 4.568 . 0 0 "[ . 1 .]" 1
1624 1 75 TRP HA 1 76 TYR QD . . 3.860 3.330 3.137 3.511 . 0 0 "[ . 1 .]" 1
1625 1 75 TRP HA 1 76 TYR QE . . 5.100 4.568 4.128 4.747 . 0 0 "[ . 1 .]" 1
1626 1 75 TRP HA 1 77 LEU QD . . 4.630 4.242 4.083 4.556 . 0 0 "[ . 1 .]" 1
1627 1 75 TRP HA 1 116 MET ME . . 4.600 3.816 3.696 3.905 . 0 0 "[ . 1 .]" 1
1628 1 75 TRP QB 1 75 TRP HE3 . . 3.710 2.622 2.569 2.656 . 0 0 "[ . 1 .]" 1
1629 1 75 TRP QB 1 75 TRP HZ3 . . 4.950 4.742 4.719 4.770 . 0 0 "[ . 1 .]" 1
1630 1 75 TRP QB 1 76 TYR H . . 4.020 2.910 2.767 3.011 . 0 0 "[ . 1 .]" 1
1631 1 75 TRP QB 1 77 LEU MD1 . . 4.540 2.858 2.117 4.386 . 0 0 "[ . 1 .]" 1
1632 1 75 TRP QB 1 77 LEU QD . . 3.180 2.318 2.096 2.725 . 0 0 "[ . 1 .]" 1
1633 1 75 TRP QB 1 77 LEU MD2 . . 4.540 3.357 2.428 4.065 . 0 0 "[ . 1 .]" 1
1634 1 75 TRP QB 1 112 HIS HE2 . . 4.810 4.816 4.684 4.862 0.052 2 0 "[ . 1 .]" 1
1635 1 75 TRP QB 1 114 GLN H . . 4.590 3.487 3.286 3.645 . 0 0 "[ . 1 .]" 1
1636 1 75 TRP QB 1 114 GLN QB . . 3.330 2.449 2.349 2.624 . 0 0 "[ . 1 .]" 1
1637 1 75 TRP QB 1 116 MET ME . . 3.170 2.550 2.460 2.697 . 0 0 "[ . 1 .]" 1
1638 1 75 TRP HD1 1 76 TYR H . . 4.330 3.904 3.803 4.009 . 0 0 "[ . 1 .]" 1
1639 1 75 TRP HD1 1 116 MET ME . . 3.890 3.202 3.084 3.308 . 0 0 "[ . 1 .]" 1
1640 1 75 TRP HD1 1 120 VAL QG . . 4.680 3.741 3.494 4.172 . 0 0 "[ . 1 .]" 1
1641 1 75 TRP HE1 1 116 MET ME . . 4.270 3.523 3.315 3.642 . 0 0 "[ . 1 .]" 1
1642 1 75 TRP HE1 1 120 VAL MG1 . . 4.870 2.547 2.157 4.026 . 0 0 "[ . 1 .]" 1
1643 1 75 TRP HE1 1 120 VAL QG . . 3.450 2.307 2.149 2.639 . 0 0 "[ . 1 .]" 1
1644 1 75 TRP HE1 1 120 VAL MG2 . . 4.870 3.943 2.287 4.319 . 0 0 "[ . 1 .]" 1
1645 1 75 TRP HE3 1 77 LEU QD . . 3.650 2.963 2.702 3.504 . 0 0 "[ . 1 .]" 1
1646 1 75 TRP HE3 1 114 GLN HE21 . . 4.890 3.399 2.644 3.945 . 0 0 "[ . 1 .]" 1
1647 1 75 TRP HE3 1 114 GLN HE22 . . 4.890 3.332 2.905 3.825 . 0 0 "[ . 1 .]" 1
1648 1 75 TRP HE3 1 114 GLN QG . . 4.840 3.336 2.832 4.323 . 0 0 "[ . 1 .]" 1
1649 1 75 TRP HE3 1 116 MET ME . . 5.010 3.511 3.213 3.651 . 0 0 "[ . 1 .]" 1
1650 1 75 TRP HH2 1 120 VAL QG . . 3.470 3.681 3.369 3.979 0.509 10 1 "[ . + .]" 1
1651 1 75 TRP HH2 1 121 GLY HA2 . . 3.360 2.577 2.162 3.157 . 0 0 "[ . 1 .]" 1
1652 1 75 TRP HH2 1 121 GLY HA3 . . 4.850 3.977 3.388 4.599 . 0 0 "[ . 1 .]" 1
1653 1 75 TRP HZ2 1 120 VAL HB . . 5.160 3.994 3.586 5.176 0.016 3 0 "[ . 1 .]" 1
1654 1 75 TRP HZ2 1 120 VAL MG1 . . 4.670 2.684 2.135 4.147 . 0 0 "[ . 1 .]" 1
1655 1 75 TRP HZ2 1 120 VAL QG . . 3.150 2.432 2.132 2.628 . 0 0 "[ . 1 .]" 1
1656 1 75 TRP HZ2 1 120 VAL MG2 . . 4.670 4.365 2.263 4.707 0.037 13 0 "[ . 1 .]" 1
1657 1 75 TRP HZ2 1 121 GLY HA2 . . 4.620 4.100 3.622 4.632 0.012 11 0 "[ . 1 .]" 1
1658 1 75 TRP HZ3 1 77 LEU QD . . 5.170 4.207 3.892 4.599 . 0 0 "[ . 1 .]" 1
1659 1 75 TRP HZ3 1 114 GLN HE21 . . 4.850 3.685 3.153 4.172 . 0 0 "[ . 1 .]" 1
1660 1 75 TRP HZ3 1 114 GLN QE . . 4.120 2.953 2.605 3.420 . 0 0 "[ . 1 .]" 1
1661 1 75 TRP HZ3 1 114 GLN HE22 . . 4.850 3.123 2.777 3.633 . 0 0 "[ . 1 .]" 1
1662 1 75 TRP HZ3 1 114 GLN QG . . 5.340 4.804 4.322 5.338 . 0 0 "[ . 1 .]" 1
1663 1 75 TRP HZ3 1 120 VAL QG . . 5.440 4.654 4.303 4.850 . 0 0 "[ . 1 .]" 1
1664 1 75 TRP HZ3 1 121 GLY HA2 . . 4.740 3.320 2.892 3.766 . 0 0 "[ . 1 .]" 1
1665 1 75 TRP HZ3 1 121 GLY HA3 . . 5.500 5.018 4.518 5.503 0.003 5 0 "[ . 1 .]" 1
1666 1 76 TYR H 1 76 TYR HB2 . . 4.150 2.635 2.592 2.700 . 0 0 "[ . 1 .]" 1
1667 1 76 TYR H 1 76 TYR QD . . 3.600 2.629 2.553 2.694 . 0 0 "[ . 1 .]" 1
1668 1 76 TYR H 1 76 TYR QE . . 5.300 4.670 4.589 4.739 . 0 0 "[ . 1 .]" 1
1669 1 76 TYR HA 1 76 TYR QD . . 3.870 3.065 3.024 3.128 . 0 0 "[ . 1 .]" 1
1670 1 76 TYR HA 1 76 TYR QE . . 4.730 4.773 4.746 4.789 0.059 15 0 "[ . 1 .]" 1
1671 1 76 TYR HA 1 77 LEU QD . . 4.460 3.485 2.952 4.197 . 0 0 "[ . 1 .]" 1
1672 1 76 TYR HA 1 77 LEU HG . . 5.260 4.453 3.977 4.857 . 0 0 "[ . 1 .]" 1
1673 1 76 TYR HA 1 79 LEU MD1 . . 5.050 4.309 3.726 4.724 . 0 0 "[ . 1 .]" 1
1674 1 76 TYR HA 1 79 LEU QD . . 4.250 3.897 3.598 4.102 . 0 0 "[ . 1 .]" 1
1675 1 76 TYR HA 1 79 LEU MD2 . . 5.050 4.600 4.300 5.068 0.018 8 0 "[ . 1 .]" 1
1676 1 76 TYR HA 1 111 LEU MD1 . . 4.750 3.036 2.529 3.446 . 0 0 "[ . 1 .]" 1
1677 1 76 TYR HA 1 111 LEU QD . . 3.450 2.981 2.512 3.357 . 0 0 "[ . 1 .]" 1
1678 1 76 TYR HA 1 111 LEU MD2 . . 4.750 4.393 4.167 4.635 . 0 0 "[ . 1 .]" 1
1679 1 76 TYR HA 1 112 HIS HD2 . . 4.940 4.369 4.089 4.569 . 0 0 "[ . 1 .]" 1
1680 1 76 TYR HA 1 114 GLN H . . 4.610 3.974 3.787 4.146 . 0 0 "[ . 1 .]" 1
1681 1 76 TYR HB2 1 79 LEU MD1 . . 3.540 2.481 2.271 2.941 . 0 0 "[ . 1 .]" 1
1682 1 76 TYR HB2 1 79 LEU QD . . 3.060 2.332 2.235 2.513 . 0 0 "[ . 1 .]" 1
1683 1 76 TYR HB2 1 79 LEU MD2 . . 3.540 3.133 2.641 3.504 . 0 0 "[ . 1 .]" 1
1684 1 76 TYR HB2 1 97 ALA MB . . 4.460 4.325 4.151 4.423 . 0 0 "[ . 1 .]" 1
1685 1 76 TYR HB2 1 111 LEU QD . . 4.080 3.725 3.584 3.847 . 0 0 "[ . 1 .]" 1
1686 1 76 TYR HB3 1 79 LEU MD1 . . 3.600 2.563 2.104 2.922 . 0 0 "[ . 1 .]" 1
1687 1 76 TYR HB3 1 79 LEU QD . . 3.060 2.237 2.078 2.366 . 0 0 "[ . 1 .]" 1
1688 1 76 TYR HB3 1 79 LEU MD2 . . 3.600 2.697 2.334 3.297 . 0 0 "[ . 1 .]" 1
1689 1 76 TYR HB3 1 111 LEU QD . . 3.170 2.272 2.177 2.390 . 0 0 "[ . 1 .]" 1
1690 1 76 TYR QD 1 79 LEU MD1 . . 4.260 3.843 3.661 3.988 . 0 0 "[ . 1 .]" 1
1691 1 76 TYR QD 1 79 LEU QD . . 3.740 3.427 3.305 3.478 . 0 0 "[ . 1 .]" 1
1692 1 76 TYR QD 1 79 LEU MD2 . . 4.260 3.885 3.576 4.161 . 0 0 "[ . 1 .]" 1
1693 1 76 TYR QD 1 96 ILE MD . . 4.130 3.132 3.043 3.240 . 0 0 "[ . 1 .]" 1
1694 1 76 TYR QD 1 97 ALA MB . . 4.930 4.673 4.580 4.770 . 0 0 "[ . 1 .]" 1
1695 1 76 TYR QD 1 111 LEU MD1 . . 3.670 2.293 2.205 2.386 . 0 0 "[ . 1 .]" 1
1696 1 76 TYR QD 1 111 LEU QD . . 2.910 2.103 2.033 2.190 . 0 0 "[ . 1 .]" 1
1697 1 76 TYR QD 1 111 LEU MD2 . . 3.670 2.449 2.348 2.599 . 0 0 "[ . 1 .]" 1
1698 1 76 TYR QD 1 111 LEU HG . . 4.360 3.845 3.680 3.998 . 0 0 "[ . 1 .]" 1
1699 1 76 TYR QD 1 114 GLN H . . 5.420 5.152 4.993 5.236 . 0 0 "[ . 1 .]" 1
1700 1 76 TYR QD 1 142 LEU QD . . 4.330 3.595 3.395 3.778 . 0 0 "[ . 1 .]" 1
1701 1 76 TYR QE 1 79 LEU QD . . 5.440 4.890 4.753 4.934 . 0 0 "[ . 1 .]" 1
1702 1 76 TYR QE 1 96 ILE MD . . 3.660 2.725 2.640 2.809 . 0 0 "[ . 1 .]" 1
1703 1 76 TYR QE 1 111 LEU MD1 . . 4.390 4.335 4.255 4.403 0.013 11 0 "[ . 1 .]" 1
1704 1 76 TYR QE 1 111 LEU QD . . 3.810 3.305 3.189 3.429 . 0 0 "[ . 1 .]" 1
1705 1 76 TYR QE 1 111 LEU MD2 . . 4.390 3.429 3.294 3.601 . 0 0 "[ . 1 .]" 1
1706 1 76 TYR QE 1 142 LEU MD1 . . 4.770 2.389 2.164 4.824 0.054 11 0 "[ . 1 .]" 1
1707 1 76 TYR QE 1 142 LEU QD . . 3.350 2.213 2.160 2.283 . 0 0 "[ . 1 .]" 1
1708 1 76 TYR QE 1 142 LEU MD2 . . 4.770 4.581 2.248 4.791 0.021 10 0 "[ . 1 .]" 1
1709 1 76 TYR QE 1 142 LEU HG . . 4.900 4.665 3.938 4.822 . 0 0 "[ . 1 .]" 1
1710 1 77 LEU HA 1 77 LEU MD1 . . 3.990 3.683 3.466 3.980 . 0 0 "[ . 1 .]" 1
1711 1 77 LEU HA 1 77 LEU QD . . 3.490 2.912 2.385 3.198 . 0 0 "[ . 1 .]" 1
1712 1 77 LEU HA 1 77 LEU MD2 . . 3.990 3.181 2.404 3.601 . 0 0 "[ . 1 .]" 1
1713 1 77 LEU HB2 1 78 HIS HE1 . . 5.500 4.449 3.800 5.328 . 0 0 "[ . 1 .]" 1
1714 1 77 LEU HB2 1 112 HIS HA . . 5.190 4.963 4.690 5.128 . 0 0 "[ . 1 .]" 1
1715 1 77 LEU HB2 1 112 HIS HB2 . . 3.860 2.891 2.372 3.326 . 0 0 "[ . 1 .]" 1
1716 1 77 LEU HB2 1 112 HIS HB3 . . 3.800 2.135 2.012 2.244 . 0 0 "[ . 1 .]" 1
1717 1 77 LEU HB2 1 112 HIS HD2 . . 4.610 3.962 3.428 4.283 . 0 0 "[ . 1 .]" 1
1718 1 77 LEU HB3 1 78 HIS HD2 . . 5.090 4.828 4.427 5.120 0.030 4 0 "[ . 1 .]" 1
1719 1 77 LEU HB3 1 78 HIS HE1 . . 5.500 4.280 3.620 5.021 . 0 0 "[ . 1 .]" 1
1720 1 77 LEU HB3 1 112 HIS HB2 . . 4.980 4.474 4.019 4.899 . 0 0 "[ . 1 .]" 1
1721 1 77 LEU HB3 1 112 HIS HB3 . . 3.940 3.782 3.618 3.891 . 0 0 "[ . 1 .]" 1
1722 1 77 LEU HB3 1 112 HIS HD2 . . 5.470 5.288 5.004 5.470 . 2 0 "[ . 1 .]" 1
1723 1 77 LEU QD 1 78 HIS HE1 . . 4.500 3.990 2.942 4.874 0.374 14 0 "[ . 1 .]" 1
1724 1 77 LEU QD 1 112 HIS HD2 . . 3.360 2.268 1.979 2.885 . 0 0 "[ . 1 .]" 1
1725 1 77 LEU MD1 1 112 HIS HB2 . . 4.660 3.380 2.649 3.989 . 0 0 "[ . 1 .]" 1
1726 1 77 LEU MD1 1 112 HIS HD2 . . 4.060 2.311 1.983 3.037 . 0 0 "[ . 1 .]" 1
1727 1 77 LEU MD2 1 112 HIS HB2 . . 4.660 4.691 4.601 4.751 0.091 3 0 "[ . 1 .]" 1
1728 1 77 LEU MD2 1 112 HIS HD2 . . 4.060 3.929 3.553 4.118 0.058 13 0 "[ . 1 .]" 1
1729 1 77 LEU HG 1 112 HIS HB3 . . 4.400 3.698 2.170 4.487 0.087 13 0 "[ . 1 .]" 1
1730 1 77 LEU HG 1 112 HIS HD2 . . 5.110 3.909 2.286 4.786 . 0 0 "[ . 1 .]" 1
1731 1 78 HIS HA 1 102 THR H . . 4.340 3.485 3.091 3.925 . 0 0 "[ . 1 .]" 1
1732 1 78 HIS HB2 1 104 ILE MD . . 4.830 3.065 2.768 3.842 . 0 0 "[ . 1 .]" 1
1733 1 78 HIS HB2 1 111 LEU QD . . 4.440 4.194 3.904 4.418 . 0 0 "[ . 1 .]" 1
1734 1 78 HIS HB3 1 101 ASN HA . . 4.210 3.157 2.645 3.916 . 0 0 "[ . 1 .]" 1
1735 1 78 HIS HB3 1 102 THR H . . 4.200 3.516 2.975 4.204 0.004 14 0 "[ . 1 .]" 1
1736 1 78 HIS HB3 1 104 ILE MD . . 3.930 2.416 2.261 2.926 . 0 0 "[ . 1 .]" 1
1737 1 78 HIS HD2 1 104 ILE MD . . 4.940 3.269 2.357 4.506 . 0 0 "[ . 1 .]" 1
1738 1 78 HIS HD2 1 110 HIS HB2 . . 4.920 4.874 4.584 4.950 0.030 7 0 "[ . 1 .]" 1
1739 1 78 HIS HD2 1 110 HIS HD2 . . 3.880 2.901 2.545 3.704 . 0 0 "[ . 1 .]" 1
1740 1 78 HIS HD2 1 111 LEU QD . . 5.120 4.811 4.446 5.222 0.102 13 0 "[ . 1 .]" 1
1741 1 78 HIS HD2 1 112 HIS HB2 . . 4.530 2.719 2.419 3.152 . 0 0 "[ . 1 .]" 1
1742 1 78 HIS HD2 1 112 HIS HB3 . . 4.990 3.839 3.423 4.387 . 0 0 "[ . 1 .]" 1
1743 1 79 LEU HA 1 79 LEU MD1 . . 4.210 3.354 2.253 3.908 . 0 0 "[ . 1 .]" 1
1744 1 79 LEU HA 1 79 LEU QD . . 3.020 2.220 2.164 2.307 . 0 0 "[ . 1 .]" 1
1745 1 79 LEU HA 1 79 LEU MD2 . . 4.210 2.747 2.176 3.865 . 0 0 "[ . 1 .]" 1
1746 1 79 LEU HA 1 79 LEU HG . . 3.980 2.988 2.554 3.197 . 0 0 "[ . 1 .]" 1
1747 1 79 LEU HA 1 80 ASP H . . 3.320 2.249 2.103 2.319 . 0 0 "[ . 1 .]" 1
1748 1 79 LEU HA 1 80 ASP HA . . 4.610 4.501 4.430 4.551 . 0 0 "[ . 1 .]" 1
1749 1 79 LEU HA 1 81 LYS H . . 4.240 3.816 3.653 3.944 . 0 0 "[ . 1 .]" 1
1750 1 79 LEU HA 1 99 SER H . . 5.010 4.913 4.657 5.069 0.059 4 0 "[ . 1 .]" 1
1751 1 79 LEU HA 1 100 GLY H . . 3.480 2.963 2.423 3.283 . 0 0 "[ . 1 .]" 1
1752 1 79 LEU HB2 1 80 ASP H . . 4.220 3.939 3.782 4.235 0.015 4 0 "[ . 1 .]" 1
1753 1 79 LEU HB2 1 81 LYS H . . 5.200 4.172 3.870 4.734 . 0 0 "[ . 1 .]" 1
1754 1 79 LEU HB3 1 80 ASP H . . 3.870 2.784 2.650 3.096 . 0 0 "[ . 1 .]" 1
1755 1 79 LEU HB3 1 81 LYS H . . 3.670 2.727 2.602 3.060 . 0 0 "[ . 1 .]" 1
1756 1 79 LEU HB3 1 98 TYR H . . 4.310 3.600 3.257 4.092 . 0 0 "[ . 1 .]" 1
1757 1 79 LEU QD 1 80 ASP H . . 3.660 3.546 3.353 3.882 0.222 8 0 "[ . 1 .]" 1
1758 1 79 LEU QD 1 81 LYS H . . 4.690 3.800 3.651 4.095 . 0 0 "[ . 1 .]" 1
1759 1 79 LEU QD 1 82 TYR HA . . 4.150 3.855 3.624 4.040 . 0 0 "[ . 1 .]" 1
1760 1 79 LEU QD 1 82 TYR QD . . 3.760 3.354 3.109 3.480 . 0 0 "[ . 1 .]" 1
1761 1 79 LEU QD 1 82 TYR QE . . 3.260 2.884 2.747 2.953 . 0 0 "[ . 1 .]" 1
1762 1 79 LEU QD 1 97 ALA H . . 5.010 4.624 4.459 4.874 . 0 0 "[ . 1 .]" 1
1763 1 79 LEU QD 1 97 ALA HA . . 4.250 3.929 3.822 4.072 . 0 0 "[ . 1 .]" 1
1764 1 79 LEU QD 1 97 ALA MB . . 3.230 1.921 1.841 2.040 . 0 0 "[ . 1 .]" 1
1765 1 79 LEU QD 1 98 TYR H . . 3.860 3.204 2.834 3.692 . 0 0 "[ . 1 .]" 1
1766 1 79 LEU QD 1 98 TYR HA . . 5.030 4.283 3.823 4.954 . 0 0 "[ . 1 .]" 1
1767 1 79 LEU QD 1 98 TYR QD . . 5.440 5.168 4.829 5.521 0.081 4 0 "[ . 1 .]" 1
1768 1 79 LEU QD 1 99 SER H . . 4.280 4.285 3.834 4.935 0.655 11 5 "[ **. - *+ .]" 1
1769 1 79 LEU QD 1 99 SER HA . . 3.250 2.841 2.542 3.338 0.088 3 0 "[ . 1 .]" 1
1770 1 79 LEU QD 1 99 SER QB . . 4.070 3.950 3.631 4.479 0.409 11 0 "[ . 1 .]" 1
1771 1 79 LEU QD 1 100 GLY H . . 3.820 4.046 3.738 4.359 0.539 3 1 "[ + . 1 .]" 1
1772 1 79 LEU QD 1 111 LEU HA . . 4.990 3.993 3.643 4.222 . 0 0 "[ . 1 .]" 1
1773 1 79 LEU QD 1 111 LEU QD . . 2.980 2.196 2.043 2.348 . 0 0 "[ . 1 .]" 1
1774 1 79 LEU QD 1 111 LEU HG . . 5.440 4.535 4.331 4.708 . 0 0 "[ . 1 .]" 1
1775 1 79 LEU MD1 1 80 ASP H . . 4.590 4.446 4.004 4.643 0.053 7 0 "[ . 1 .]" 1
1776 1 79 LEU MD1 1 81 LYS H . . 5.500 4.524 4.239 4.963 . 0 0 "[ . 1 .]" 1
1777 1 79 LEU MD1 1 98 TYR H . . 4.490 4.112 3.748 4.531 0.041 10 0 "[ . 1 .]" 1
1778 1 79 LEU MD2 1 80 ASP H . . 4.590 3.868 3.446 4.628 0.038 10 0 "[ . 1 .]" 1
1779 1 79 LEU MD2 1 81 LYS H . . 5.500 4.092 3.961 4.364 . 0 0 "[ . 1 .]" 1
1780 1 79 LEU MD2 1 98 TYR H . . 4.490 3.344 2.933 3.912 . 0 0 "[ . 1 .]" 1
1781 1 79 LEU HG 1 80 ASP H . . 5.030 4.532 3.494 5.061 0.031 14 0 "[ . 1 .]" 1
1782 1 80 ASP H 1 80 ASP HB2 . . 3.490 2.653 2.520 2.837 . 0 0 "[ . 1 .]" 1
1783 1 80 ASP H 1 80 ASP HB3 . . 3.490 2.622 2.416 2.999 . 0 0 "[ . 1 .]" 1
1784 1 80 ASP H 1 81 LYS H . . 2.970 2.049 1.905 2.168 . 0 0 "[ . 1 .]" 1
1785 1 80 ASP H 1 81 LYS HB2 . . 4.660 4.355 4.213 4.503 . 0 0 "[ . 1 .]" 1
1786 1 80 ASP H 1 98 TYR H . . 3.740 3.773 3.743 3.788 0.048 12 0 "[ . 1 .]" 1
1787 1 80 ASP H 1 99 SER HA . . 3.960 3.341 2.944 3.589 . 0 0 "[ . 1 .]" 1
1788 1 80 ASP H 1 100 GLY HA2 . . 5.110 4.599 4.293 4.937 . 0 0 "[ . 1 .]" 1
1789 1 80 ASP H 1 102 THR MG . . 5.500 4.511 4.024 4.820 . 0 0 "[ . 1 .]" 1
1790 1 80 ASP HA 1 100 GLY H . . 5.390 5.068 4.696 5.407 0.017 1 0 "[ . 1 .]" 1
1791 1 80 ASP HA 1 100 GLY HA3 . . 4.060 3.260 2.897 3.759 . 0 0 "[ . 1 .]" 1
1792 1 80 ASP HA 1 101 ASN H . . 5.430 4.488 4.062 4.823 . 0 0 "[ . 1 .]" 1
1793 1 80 ASP HA 1 102 THR MG . . 3.460 2.759 2.218 3.534 0.074 14 0 "[ . 1 .]" 1
1794 1 80 ASP QB 1 81 LYS H . . 3.100 2.656 2.467 2.915 . 0 0 "[ . 1 .]" 1
1795 1 80 ASP QB 1 81 LYS HB2 . . 3.840 2.659 2.579 2.733 . 0 0 "[ . 1 .]" 1
1796 1 80 ASP QB 1 81 LYS QD . . 4.000 4.054 4.004 4.097 0.097 15 0 "[ . 1 .]" 1
1797 1 80 ASP QB 1 100 GLY H . . 4.610 3.793 3.500 3.987 . 0 0 "[ . 1 .]" 1
1798 1 80 ASP QB 1 100 GLY HA2 . . 3.510 2.878 2.655 3.209 . 0 0 "[ . 1 .]" 1
1799 1 80 ASP QB 1 100 GLY HA3 . . 3.290 2.219 2.106 2.352 . 0 0 "[ . 1 .]" 1
1800 1 80 ASP QB 1 101 ASN H . . 4.470 4.149 3.819 4.346 . 0 0 "[ . 1 .]" 1
1801 1 80 ASP HB2 1 81 LYS H . . 3.730 3.764 3.689 3.807 0.077 1 0 "[ . 1 .]" 1
1802 1 80 ASP HB2 1 100 GLY HA3 . . 3.850 2.232 2.115 2.371 . 0 0 "[ . 1 .]" 1
1803 1 80 ASP HB3 1 81 LYS H . . 3.730 2.719 2.500 3.054 . 0 0 "[ . 1 .]" 1
1804 1 80 ASP HB3 1 100 GLY HA3 . . 3.850 3.903 3.854 3.945 0.095 15 0 "[ . 1 .]" 1
1805 1 81 LYS H 1 81 LYS HB3 . . 4.110 2.951 2.716 3.070 . 0 0 "[ . 1 .]" 1
1806 1 81 LYS H 1 81 LYS QG . . 4.280 4.210 4.165 4.259 . 0 0 "[ . 1 .]" 1
1807 1 81 LYS H 1 82 TYR H . . 4.660 4.431 4.394 4.478 . 0 0 "[ . 1 .]" 1
1808 1 81 LYS H 1 97 ALA HA . . 5.030 4.895 4.816 4.959 . 0 0 "[ . 1 .]" 1
1809 1 81 LYS H 1 98 TYR H . . 3.530 2.868 2.765 2.935 . 0 0 "[ . 1 .]" 1
1810 1 81 LYS H 1 98 TYR HB2 . . 3.790 3.209 3.002 3.407 . 0 0 "[ . 1 .]" 1
1811 1 81 LYS HA 1 81 LYS QG . . 3.150 2.331 2.210 2.488 . 0 0 "[ . 1 .]" 1
1812 1 81 LYS HA 1 82 TYR H . . 2.740 2.293 2.229 2.346 . 0 0 "[ . 1 .]" 1
1813 1 81 LYS HA 1 82 TYR QD . . 3.990 3.368 3.187 3.570 . 0 0 "[ . 1 .]" 1
1814 1 81 LYS HA 1 98 TYR H . . 4.640 4.720 4.701 4.745 0.105 10 0 "[ . 1 .]" 1
1815 1 81 LYS HB2 1 98 TYR H . . 4.570 4.381 4.239 4.477 . 0 0 "[ . 1 .]" 1
1816 1 81 LYS HB2 1 98 TYR HB2 . . 4.210 2.938 2.658 3.101 . 0 0 "[ . 1 .]" 1
1817 1 81 LYS HB2 1 98 TYR HB3 . . 4.520 4.378 4.068 4.549 0.029 9 0 "[ . 1 .]" 1
1818 1 81 LYS HB3 1 82 TYR H . . 3.430 3.452 3.380 3.510 0.080 9 0 "[ . 1 .]" 1
1819 1 81 LYS HB3 1 97 ALA HA . . 4.080 4.161 4.119 4.196 0.116 14 0 "[ . 1 .]" 1
1820 1 81 LYS HB3 1 98 TYR H . . 3.970 3.121 2.961 3.213 . 0 0 "[ . 1 .]" 1
1821 1 81 LYS HB3 1 98 TYR HB2 . . 4.050 2.157 2.099 2.234 . 0 0 "[ . 1 .]" 1
1822 1 81 LYS HB3 1 98 TYR HB3 . . 4.360 3.852 3.809 3.912 . 0 0 "[ . 1 .]" 1
1823 1 81 LYS HB3 1 98 TYR QD . . 3.200 2.137 2.089 2.209 . 0 0 "[ . 1 .]" 1
1824 1 81 LYS QD 1 82 TYR H . . 4.540 4.348 4.201 4.508 . 0 0 "[ . 1 .]" 1
1825 1 81 LYS QD 1 98 TYR QD . . 4.240 3.059 2.779 3.452 . 0 0 "[ . 1 .]" 1
1826 1 81 LYS QD 1 98 TYR QE . . 5.170 3.770 3.212 4.179 . 0 0 "[ . 1 .]" 1
1827 1 81 LYS QE 1 81 LYS QG . . 3.140 2.246 2.060 2.494 . 0 0 "[ . 1 .]" 1
1828 1 81 LYS QG 1 82 TYR H . . 3.430 2.291 2.141 2.479 . 0 0 "[ . 1 .]" 1
1829 1 81 LYS QG 1 82 TYR HB2 . . 5.070 4.462 4.302 4.758 . 0 0 "[ . 1 .]" 1
1830 1 81 LYS QG 1 83 ASN H . . 5.180 5.052 4.465 5.213 0.033 14 0 "[ . 1 .]" 1
1831 1 81 LYS QG 1 83 ASN HA . . 4.950 4.844 4.419 4.992 0.042 4 0 "[ . 1 .]" 1
1832 1 81 LYS QG 1 98 TYR HB2 . . 4.390 4.176 4.029 4.287 . 0 0 "[ . 1 .]" 1
1833 1 81 LYS QG 1 98 TYR QD . . 3.810 3.220 2.823 3.417 . 0 0 "[ . 1 .]" 1
1834 1 81 LYS QG 1 98 TYR QE . . 4.280 4.108 3.709 4.299 0.019 4 0 "[ . 1 .]" 1
1835 1 82 TYR H 1 82 TYR HB2 . . 3.350 2.610 2.529 2.684 . 0 0 "[ . 1 .]" 1
1836 1 82 TYR H 1 82 TYR HB3 . . 3.860 3.755 3.694 3.803 . 0 0 "[ . 1 .]" 1
1837 1 82 TYR H 1 82 TYR QD . . 3.490 2.861 2.686 3.154 . 0 0 "[ . 1 .]" 1
1838 1 82 TYR H 1 82 TYR QE . . 5.500 4.971 4.772 5.343 . 0 0 "[ . 1 .]" 1
1839 1 82 TYR H 1 83 ASN H . . 4.520 4.401 4.219 4.526 0.006 10 0 "[ . 1 .]" 1
1840 1 82 TYR H 1 97 ALA HA . . 4.500 4.472 4.362 4.525 0.025 5 0 "[ . 1 .]" 1
1841 1 82 TYR H 1 98 TYR QE . . 5.500 5.514 5.403 5.559 0.059 13 0 "[ . 1 .]" 1
1842 1 82 TYR HA 1 83 ASN H . . 2.970 2.180 2.148 2.223 . 0 0 "[ . 1 .]" 1
1843 1 82 TYR HA 1 83 ASN HA . . 5.000 4.491 4.457 4.523 . 0 0 "[ . 1 .]" 1
1844 1 82 TYR HA 1 83 ASN HB2 . . 4.530 4.423 4.249 4.563 0.033 13 0 "[ . 1 .]" 1
1845 1 82 TYR HA 1 97 ALA H . . 4.990 4.917 4.773 5.017 0.027 2 0 "[ . 1 .]" 1
1846 1 82 TYR HA 1 97 ALA HA . . 3.210 2.286 2.140 2.425 . 0 0 "[ . 1 .]" 1
1847 1 82 TYR HA 1 97 ALA MB . . 3.270 2.646 2.582 2.706 . 0 0 "[ . 1 .]" 1
1848 1 82 TYR HA 1 98 TYR H . . 4.030 3.814 3.700 3.958 . 0 0 "[ . 1 .]" 1
1849 1 82 TYR HB2 1 83 ASN H . . 4.560 4.198 4.053 4.424 . 0 0 "[ . 1 .]" 1
1850 1 82 TYR HB2 1 83 ASN HA . . 5.380 4.993 4.766 5.169 . 0 0 "[ . 1 .]" 1
1851 1 82 TYR HB2 1 97 ALA HA . . 5.420 5.222 5.096 5.365 . 0 0 "[ . 1 .]" 1
1852 1 82 TYR HB2 1 97 ALA MB . . 5.470 5.039 4.904 5.125 . 0 0 "[ . 1 .]" 1
1853 1 82 TYR HB3 1 83 ASN H . . 4.070 3.244 3.023 3.580 . 0 0 "[ . 1 .]" 1
1854 1 82 TYR HB3 1 83 ASN HA . . 5.210 4.750 4.543 5.004 . 0 0 "[ . 1 .]" 1
1855 1 82 TYR HB3 1 84 VAL H . . 3.230 2.798 2.701 3.044 . 0 0 "[ . 1 .]" 1
1856 1 82 TYR HB3 1 84 VAL MG2 . . 3.930 3.747 3.483 3.950 0.020 2 0 "[ . 1 .]" 1
1857 1 82 TYR HB3 1 97 ALA HA . . 5.100 4.564 4.400 4.741 . 0 0 "[ . 1 .]" 1
1858 1 82 TYR HB3 1 97 ALA MB . . 4.470 4.197 3.993 4.315 . 0 0 "[ . 1 .]" 1
1859 1 82 TYR QD 1 83 ASN H . . 4.910 4.206 3.952 4.530 . 0 0 "[ . 1 .]" 1
1860 1 82 TYR QD 1 97 ALA MB . . 3.830 3.215 3.053 3.393 . 0 0 "[ . 1 .]" 1
1861 1 82 TYR QE 1 97 ALA MB . . 4.420 4.253 4.141 4.394 . 0 0 "[ . 1 .]" 1
1862 1 83 ASN H 1 83 ASN HB2 . . 3.540 2.640 2.485 2.857 . 0 0 "[ . 1 .]" 1
1863 1 83 ASN H 1 83 ASN HB3 . . 3.850 2.620 2.544 2.765 . 0 0 "[ . 1 .]" 1
1864 1 83 ASN H 1 84 VAL H . . 2.940 2.172 2.028 2.363 . 0 0 "[ . 1 .]" 1
1865 1 83 ASN H 1 84 VAL MG1 . . 4.420 3.963 3.763 4.109 . 0 0 "[ . 1 .]" 1
1866 1 83 ASN H 1 84 VAL MG2 . . 3.810 3.399 3.291 3.579 . 0 0 "[ . 1 .]" 1
1867 1 83 ASN H 1 96 ILE HB . . 5.500 4.810 4.707 4.997 . 0 0 "[ . 1 .]" 1
1868 1 83 ASN H 1 96 ILE HG13 . . 5.500 5.352 5.226 5.471 . 0 0 "[ . 1 .]" 1
1869 1 83 ASN H 1 97 ALA H . . 3.960 3.988 3.967 4.013 0.053 13 0 "[ . 1 .]" 1
1870 1 83 ASN H 1 97 ALA HA . . 3.190 2.318 2.227 2.434 . 0 0 "[ . 1 .]" 1
1871 1 83 ASN H 1 97 ALA MB . . 3.580 3.317 3.242 3.392 . 0 0 "[ . 1 .]" 1
1872 1 83 ASN H 1 98 TYR QE . . 4.850 4.411 4.054 4.791 . 0 0 "[ . 1 .]" 1
1873 1 83 ASN HA 1 83 ASN HB2 . . 3.020 2.583 2.514 2.658 . 0 0 "[ . 1 .]" 1
1874 1 83 ASN HA 1 83 ASN HD21 . . 4.900 4.301 4.116 4.460 . 0 0 "[ . 1 .]" 1
1875 1 83 ASN HA 1 83 ASN HD22 . . 4.880 4.517 4.372 4.615 . 0 0 "[ . 1 .]" 1
1876 1 83 ASN HA 1 84 VAL H . . 3.390 3.407 3.379 3.428 0.038 13 0 "[ . 1 .]" 1
1877 1 83 ASN HA 1 84 VAL HA . . 5.380 4.663 4.619 4.733 . 0 0 "[ . 1 .]" 1
1878 1 83 ASN HA 1 95 ILE MG . . 4.770 4.586 4.469 4.728 . 0 0 "[ . 1 .]" 1
1879 1 83 ASN HA 1 97 ALA HA . . 4.920 4.719 4.495 4.860 . 0 0 "[ . 1 .]" 1
1880 1 83 ASN HA 1 98 TYR QD . . 5.120 4.995 4.598 5.135 0.015 7 0 "[ . 1 .]" 1
1881 1 83 ASN HA 1 98 TYR QE . . 4.210 3.798 3.165 4.197 . 0 0 "[ . 1 .]" 1
1882 1 83 ASN HB2 1 83 ASN HD22 . . 3.990 3.904 3.805 3.995 0.005 5 0 "[ . 1 .]" 1
1883 1 83 ASN HB2 1 84 VAL H . . 4.130 4.107 3.923 4.158 0.028 15 0 "[ . 1 .]" 1
1884 1 83 ASN HB2 1 84 VAL MG1 . . 4.570 4.347 4.218 4.507 . 0 0 "[ . 1 .]" 1
1885 1 83 ASN HB2 1 95 ILE MG . . 3.680 2.379 2.267 2.538 . 0 0 "[ . 1 .]" 1
1886 1 83 ASN HB2 1 96 ILE HA . . 4.320 4.243 3.821 4.349 0.029 4 0 "[ . 1 .]" 1
1887 1 83 ASN HB2 1 97 ALA H . . 4.260 3.906 3.331 4.224 . 0 0 "[ . 1 .]" 1
1888 1 83 ASN HB2 1 97 ALA HA . . 3.950 3.354 2.962 3.597 . 0 0 "[ . 1 .]" 1
1889 1 83 ASN HB2 1 97 ALA MB . . 5.000 4.731 4.337 4.944 . 0 0 "[ . 1 .]" 1
1890 1 83 ASN HB2 1 98 TYR QE . . 3.330 2.589 2.367 2.899 . 0 0 "[ . 1 .]" 1
1891 1 83 ASN HB3 1 83 ASN HD21 . . 3.340 2.225 2.194 2.274 . 0 0 "[ . 1 .]" 1
1892 1 83 ASN HB3 1 83 ASN HD22 . . 3.520 3.521 3.508 3.538 0.018 9 0 "[ . 1 .]" 1
1893 1 83 ASN HB3 1 84 VAL H . . 4.090 3.256 3.143 3.389 . 0 0 "[ . 1 .]" 1
1894 1 83 ASN HB3 1 84 VAL MG1 . . 3.400 2.785 2.635 2.964 . 0 0 "[ . 1 .]" 1
1895 1 83 ASN HB3 1 84 VAL MG2 . . 3.760 3.741 3.606 3.788 0.028 2 0 "[ . 1 .]" 1
1896 1 83 ASN HB3 1 95 ILE MG . . 3.500 2.677 2.479 2.834 . 0 0 "[ . 1 .]" 1
1897 1 83 ASN HB3 1 96 ILE HA . . 3.580 2.723 2.479 2.809 . 0 0 "[ . 1 .]" 1
1898 1 83 ASN HB3 1 97 ALA H . . 4.250 3.816 3.555 4.042 . 0 0 "[ . 1 .]" 1
1899 1 83 ASN HB3 1 97 ALA HA . . 4.140 3.955 3.774 4.078 . 0 0 "[ . 1 .]" 1
1900 1 83 ASN HB3 1 97 ALA MB . . 5.050 4.768 4.637 4.862 . 0 0 "[ . 1 .]" 1
1901 1 83 ASN HB3 1 98 TYR QE . . 5.110 4.302 4.049 4.627 . 0 0 "[ . 1 .]" 1
1902 1 83 ASN HD21 1 95 ILE H . . 4.560 4.086 3.965 4.274 . 0 0 "[ . 1 .]" 1
1903 1 83 ASN HD21 1 95 ILE HB . . 3.620 2.544 2.373 2.683 . 0 0 "[ . 1 .]" 1
1904 1 83 ASN HD21 1 95 ILE MD . . 5.400 5.177 5.026 5.300 . 0 0 "[ . 1 .]" 1
1905 1 83 ASN HD21 1 95 ILE MG . . 3.440 2.946 2.784 3.183 . 0 0 "[ . 1 .]" 1
1906 1 83 ASN HD21 1 96 ILE HA . . 4.450 3.653 3.458 3.788 . 0 0 "[ . 1 .]" 1
1907 1 83 ASN HD22 1 95 ILE H . . 4.670 4.642 4.503 4.694 0.024 13 0 "[ . 1 .]" 1
1908 1 83 ASN HD22 1 95 ILE HB . . 3.670 2.863 2.598 3.166 . 0 0 "[ . 1 .]" 1
1909 1 83 ASN HD22 1 95 ILE MG . . 3.940 3.584 3.292 3.854 . 0 0 "[ . 1 .]" 1
1910 1 83 ASN HD22 1 96 ILE HA . . 5.500 5.384 5.172 5.541 0.041 2 0 "[ . 1 .]" 1
1911 1 84 VAL H 1 84 VAL HB . . 4.030 3.840 3.790 3.894 . 0 0 "[ . 1 .]" 1
1912 1 84 VAL H 1 84 VAL MG1 . . 3.290 2.955 2.772 3.064 . 0 0 "[ . 1 .]" 1
1913 1 84 VAL H 1 84 VAL MG2 . . 2.850 2.293 2.175 2.425 . 0 0 "[ . 1 .]" 1
1914 1 84 VAL H 1 85 LYS H . . 4.720 4.505 4.444 4.562 . 0 0 "[ . 1 .]" 1
1915 1 84 VAL H 1 96 ILE HA . . 4.050 3.719 3.544 3.832 . 0 0 "[ . 1 .]" 1
1916 1 84 VAL H 1 97 ALA HA . . 4.320 4.357 4.314 4.377 0.057 9 0 "[ . 1 .]" 1
1917 1 84 VAL H 1 97 ALA MB . . 4.400 4.416 4.398 4.433 0.033 7 0 "[ . 1 .]" 1
1918 1 84 VAL HA 1 84 VAL MG1 . . 2.850 2.371 2.333 2.405 . 0 0 "[ . 1 .]" 1
1919 1 84 VAL HA 1 84 VAL MG2 . . 3.380 3.265 3.252 3.277 . 0 0 "[ . 1 .]" 1
1920 1 84 VAL HA 1 85 LYS H . . 2.790 2.375 2.326 2.445 . 0 0 "[ . 1 .]" 1
1921 1 84 VAL HA 1 85 LYS HG2 . . 4.650 4.069 3.372 4.653 0.003 7 0 "[ . 1 .]" 1
1922 1 84 VAL HA 1 85 LYS QG . . 3.860 3.349 2.970 3.799 . 0 0 "[ . 1 .]" 1
1923 1 84 VAL HA 1 85 LYS HG3 . . 4.650 3.969 3.031 4.739 0.089 3 0 "[ . 1 .]" 1
1924 1 84 VAL HA 1 88 ASP QB . . 5.160 3.826 3.551 4.060 . 0 0 "[ . 1 .]" 1
1925 1 84 VAL HB 1 85 LYS H . . 2.840 2.327 2.177 2.425 . 0 0 "[ . 1 .]" 1
1926 1 84 VAL HB 1 85 LYS HA . . 4.420 4.458 4.361 4.488 0.068 13 0 "[ . 1 .]" 1
1927 1 84 VAL HB 1 85 LYS QG . . 5.120 4.466 4.108 4.734 . 0 0 "[ . 1 .]" 1
1928 1 84 VAL HB 1 88 ASP H . . 5.040 4.706 4.526 4.956 . 0 0 "[ . 1 .]" 1
1929 1 84 VAL HB 1 88 ASP QB . . 3.700 2.458 2.267 2.919 . 0 0 "[ . 1 .]" 1
1930 1 84 VAL HB 1 96 ILE HB . . 5.170 5.202 5.178 5.226 0.056 9 0 "[ . 1 .]" 1
1931 1 84 VAL MG1 1 85 LYS H . . 3.760 3.638 3.576 3.705 . 0 0 "[ . 1 .]" 1
1932 1 84 VAL MG1 1 88 ASP QB . . 3.770 3.218 2.990 3.697 . 0 0 "[ . 1 .]" 1
1933 1 84 VAL MG1 1 96 ILE HA . . 2.860 2.158 2.110 2.211 . 0 0 "[ . 1 .]" 1
1934 1 84 VAL MG1 1 96 ILE HB . . 3.700 3.680 3.555 3.719 0.019 2 0 "[ . 1 .]" 1
1935 1 84 VAL MG2 1 85 LYS H . . 3.460 3.432 3.290 3.490 0.030 15 0 "[ . 1 .]" 1
1936 1 84 VAL MG2 1 85 LYS HA . . 4.140 3.852 3.555 3.977 . 0 0 "[ . 1 .]" 1
1937 1 84 VAL MG2 1 96 ILE HA . . 3.460 2.387 2.237 2.639 . 0 0 "[ . 1 .]" 1
1938 1 84 VAL MG2 1 96 ILE HB . . 3.350 2.470 2.401 2.579 . 0 0 "[ . 1 .]" 1
1939 1 84 VAL MG2 1 97 ALA HA . . 4.860 4.710 4.623 4.781 . 0 0 "[ . 1 .]" 1
1940 1 85 LYS H 1 85 LYS HB2 . . 4.080 3.264 2.616 3.927 . 0 0 "[ . 1 .]" 1
1941 1 85 LYS H 1 85 LYS QB . . 3.520 2.909 2.569 3.233 . 0 0 "[ . 1 .]" 1
1942 1 85 LYS H 1 85 LYS HB3 . . 4.080 3.609 3.278 3.865 . 0 0 "[ . 1 .]" 1
1943 1 85 LYS H 1 85 LYS QD . . 4.820 4.459 4.188 4.837 0.017 7 0 "[ . 1 .]" 1
1944 1 85 LYS H 1 85 LYS HG2 . . 3.810 3.222 2.265 3.858 0.048 7 0 "[ . 1 .]" 1
1945 1 85 LYS H 1 85 LYS QG . . 3.330 2.587 2.177 2.959 . 0 0 "[ . 1 .]" 1
1946 1 85 LYS H 1 85 LYS HG3 . . 3.810 2.852 2.646 3.073 . 0 0 "[ . 1 .]" 1
1947 1 85 LYS H 1 86 VAL H . . 4.450 4.483 4.459 4.503 0.053 2 0 "[ . 1 .]" 1
1948 1 85 LYS H 1 88 ASP H . . 4.620 3.977 3.866 4.232 . 0 0 "[ . 1 .]" 1
1949 1 85 LYS H 1 88 ASP HB2 . . 3.860 2.722 2.474 3.088 . 0 0 "[ . 1 .]" 1
1950 1 85 LYS H 1 88 ASP QB . . 3.380 2.592 2.336 2.768 . 0 0 "[ . 1 .]" 1
1951 1 85 LYS H 1 88 ASP HB3 . . 3.860 3.472 2.561 3.787 . 0 0 "[ . 1 .]" 1
1952 1 85 LYS HA 1 85 LYS QB . . 2.620 2.276 2.151 2.388 . 0 0 "[ . 1 .]" 1
1953 1 85 LYS HA 1 85 LYS HG2 . . 3.860 3.196 2.462 3.900 0.040 15 0 "[ . 1 .]" 1
1954 1 85 LYS HA 1 85 LYS HG3 . . 3.860 3.518 3.285 3.809 . 0 0 "[ . 1 .]" 1
1955 1 85 LYS HA 1 86 VAL H . . 2.610 2.339 2.253 2.479 . 0 0 "[ . 1 .]" 1
1956 1 85 LYS HA 1 86 VAL HA . . 4.590 4.274 4.139 4.343 . 0 0 "[ . 1 .]" 1
1957 1 85 LYS HA 1 86 VAL QG . . 4.380 3.988 3.508 4.339 . 0 0 "[ . 1 .]" 1
1958 1 85 LYS QB 1 86 VAL H . . 3.300 2.486 2.320 2.689 . 0 0 "[ . 1 .]" 1
1959 1 85 LYS QB 1 86 VAL HA . . 4.900 4.571 4.414 4.719 . 0 0 "[ . 1 .]" 1
1960 1 85 LYS HB2 1 86 VAL H . . 4.010 3.088 2.344 3.855 . 0 0 "[ . 1 .]" 1
1961 1 85 LYS HB3 1 86 VAL H . . 4.010 3.121 2.490 3.836 . 0 0 "[ . 1 .]" 1
1962 1 85 LYS QD 1 86 VAL H . . 4.870 4.566 3.992 4.914 0.044 6 0 "[ . 1 .]" 1
1963 1 85 LYS QE 1 85 LYS HG2 . . 3.680 3.015 2.306 3.605 . 0 0 "[ . 1 .]" 1
1964 1 85 LYS QE 1 85 LYS QG . . 3.160 2.385 2.106 2.959 . 0 0 "[ . 1 .]" 1
1965 1 85 LYS QE 1 85 LYS HG3 . . 3.680 2.567 2.306 3.144 . 0 0 "[ . 1 .]" 1
1966 1 85 LYS QG 1 86 VAL H . . 4.330 3.946 3.736 4.213 . 0 0 "[ . 1 .]" 1
1967 1 86 VAL H 1 86 VAL HB . . 3.200 2.597 2.452 2.794 . 0 0 "[ . 1 .]" 1
1968 1 86 VAL H 1 86 VAL MG1 . . 3.960 2.552 2.043 3.860 . 0 0 "[ . 1 .]" 1
1969 1 86 VAL H 1 86 VAL QG . . 2.720 2.178 2.024 2.554 . 0 0 "[ . 1 .]" 1
1970 1 86 VAL H 1 86 VAL MG2 . . 3.960 3.459 2.032 3.853 . 0 0 "[ . 1 .]" 1
1971 1 86 VAL H 1 87 GLY H . . 4.760 4.640 4.587 4.690 . 0 0 "[ . 1 .]" 1
1972 1 86 VAL HA 1 86 VAL MG1 . . 3.070 3.009 2.250 3.200 0.130 5 0 "[ . 1 .]" 1
1973 1 86 VAL HA 1 86 VAL QG . . 2.680 2.179 2.092 2.279 . 0 0 "[ . 1 .]" 1
1974 1 86 VAL HA 1 86 VAL MG2 . . 3.070 2.283 2.137 2.488 . 0 0 "[ . 1 .]" 1
1975 1 86 VAL HA 1 87 GLY H . . 2.710 2.127 2.074 2.155 . 0 0 "[ . 1 .]" 1
1976 1 86 VAL HA 1 87 GLY HA2 . . 4.560 4.389 4.350 4.421 . 0 0 "[ . 1 .]" 1
1977 1 86 VAL HA 1 87 GLY HA3 . . 4.970 4.453 4.422 4.482 . 0 0 "[ . 1 .]" 1
1978 1 86 VAL HA 1 88 ASP H . . 3.560 3.246 3.157 3.322 . 0 0 "[ . 1 .]" 1
1979 1 86 VAL HA 1 88 ASP QB . . 5.100 4.649 4.500 4.754 . 0 0 "[ . 1 .]" 1
1980 1 86 VAL HB 1 87 GLY H . . 4.320 4.077 3.957 4.175 . 0 0 "[ . 1 .]" 1
1981 1 86 VAL QG 1 87 GLY H . . 2.870 2.399 2.297 2.539 . 0 0 "[ . 1 .]" 1
1982 1 86 VAL QG 1 87 GLY HA2 . . 3.670 3.632 3.510 3.709 0.039 10 0 "[ . 1 .]" 1
1983 1 86 VAL QG 1 87 GLY HA3 . . 3.590 3.691 3.527 3.871 0.281 12 0 "[ . 1 .]" 1
1984 1 86 VAL QG 1 88 ASP H . . 4.580 4.173 4.101 4.248 . 0 0 "[ . 1 .]" 1
1985 1 87 GLY H 1 88 ASP H . . 2.950 2.737 2.648 2.817 . 0 0 "[ . 1 .]" 1
1986 1 87 GLY HA2 1 88 ASP H . . 3.470 3.496 3.464 3.512 0.042 11 0 "[ . 1 .]" 1
1987 1 88 ASP H 1 88 ASP QB . . 2.770 2.399 2.281 2.477 . 0 0 "[ . 1 .]" 1
1988 1 88 ASP H 1 89 ARG H . . 5.150 4.577 4.529 4.630 . 0 0 "[ . 1 .]" 1
1989 1 88 ASP HA 1 89 ARG H . . 2.530 2.110 2.032 2.208 . 0 0 "[ . 1 .]" 1
1990 1 88 ASP QB 1 89 ARG H . . 3.470 3.224 2.961 3.573 0.103 13 0 "[ . 1 .]" 1
1991 1 88 ASP QB 1 90 VAL MG1 . . 4.070 3.095 2.791 3.556 . 0 0 "[ . 1 .]" 1
1992 1 88 ASP QB 1 90 VAL MG2 . . 5.340 4.882 4.549 5.358 0.018 4 0 "[ . 1 .]" 1
1993 1 88 ASP HB2 1 89 ARG H . . 4.270 4.237 4.127 4.317 0.047 2 0 "[ . 1 .]" 1
1994 1 88 ASP HB3 1 89 ARG H . . 4.270 3.364 3.032 3.892 . 0 0 "[ . 1 .]" 1
1995 1 89 ARG H 1 89 ARG HB2 . . 2.870 2.262 2.137 2.614 . 0 0 "[ . 1 .]" 1
1996 1 89 ARG H 1 89 ARG HB3 . . 3.440 3.155 2.551 3.487 0.047 2 0 "[ . 1 .]" 1
1997 1 89 ARG HA 1 89 ARG HD2 . . 3.880 2.870 2.086 3.672 . 0 0 "[ . 1 .]" 1
1998 1 89 ARG HA 1 89 ARG HD3 . . 3.880 2.821 2.131 3.800 . 0 0 "[ . 1 .]" 1
1999 1 89 ARG HA 1 89 ARG HG2 . . 3.710 2.658 2.425 3.748 0.038 4 0 "[ . 1 .]" 1
2000 1 89 ARG HA 1 89 ARG HG3 . . 3.710 3.609 2.978 3.722 0.012 5 0 "[ . 1 .]" 1
2001 1 89 ARG HA 1 90 VAL H . . 2.660 2.159 2.094 2.230 . 0 0 "[ . 1 .]" 1
2002 1 89 ARG HA 1 90 VAL MG1 . . 4.070 3.654 3.540 3.781 . 0 0 "[ . 1 .]" 1
2003 1 89 ARG HA 1 90 VAL MG2 . . 4.160 3.862 3.772 4.001 . 0 0 "[ . 1 .]" 1
2004 1 89 ARG HB3 1 89 ARG QD . . 3.530 2.708 2.241 3.539 0.009 4 0 "[ . 1 .]" 1
2005 1 89 ARG HB3 1 90 VAL HA . . 4.720 4.479 4.155 4.770 0.050 4 0 "[ . 1 .]" 1
2006 1 89 ARG QD 1 90 VAL H . . 3.590 2.573 2.179 3.310 . 0 0 "[ . 1 .]" 1
2007 1 89 ARG HD2 1 90 VAL H . . 4.130 3.042 2.189 4.037 . 0 0 "[ . 1 .]" 1
2008 1 89 ARG HD3 1 90 VAL H . . 4.130 3.321 2.252 4.235 0.105 9 0 "[ . 1 .]" 1
2009 1 90 VAL H 1 90 VAL HB . . 3.760 3.821 3.784 3.854 0.094 1 0 "[ . 1 .]" 1
2010 1 90 VAL H 1 90 VAL MG1 . . 2.870 2.869 2.793 2.898 0.028 4 0 "[ . 1 .]" 1
2011 1 90 VAL H 1 90 VAL MG2 . . 2.980 2.372 2.287 2.445 . 0 0 "[ . 1 .]" 1
2012 1 90 VAL HA 1 90 VAL MG1 . . 2.870 2.360 2.315 2.392 . 0 0 "[ . 1 .]" 1
2013 1 90 VAL HA 1 90 VAL MG2 . . 3.210 3.250 3.244 3.263 0.053 5 0 "[ . 1 .]" 1
2014 1 90 VAL HA 1 91 LYS H . . 2.710 2.231 2.098 2.357 . 0 0 "[ . 1 .]" 1
2015 1 90 VAL HA 1 91 LYS QB . . 4.120 3.737 3.520 3.867 . 0 0 "[ . 1 .]" 1
2016 1 90 VAL HB 1 91 LYS H . . 3.010 2.398 2.096 2.626 . 0 0 "[ . 1 .]" 1
2017 1 90 VAL HB 1 91 LYS HA . . 4.430 4.530 4.501 4.561 0.131 11 0 "[ . 1 .]" 1
2018 1 90 VAL HB 1 94 ASP H . . 4.860 4.496 4.180 4.805 . 0 0 "[ . 1 .]" 1
2019 1 90 VAL HB 1 94 ASP HB2 . . 3.860 3.140 2.363 3.885 0.025 12 0 "[ . 1 .]" 1
2020 1 90 VAL HB 1 94 ASP HB3 . . 4.030 3.153 2.935 3.319 . 0 0 "[ . 1 .]" 1
2021 1 90 VAL MG1 1 91 LYS H . . 3.670 3.658 3.582 3.683 0.013 1 0 "[ . 1 .]" 1
2022 1 90 VAL MG1 1 94 ASP HB3 . . 3.900 3.573 3.225 3.865 . 0 0 "[ . 1 .]" 1
2023 1 90 VAL MG2 1 91 LYS H . . 3.800 3.530 3.249 3.760 . 0 0 "[ . 1 .]" 1
2024 1 90 VAL MG2 1 91 LYS HA . . 4.450 4.047 3.954 4.215 . 0 0 "[ . 1 .]" 1
2025 1 90 VAL MG2 1 92 ALA HA . . 5.330 5.088 4.956 5.300 . 0 0 "[ . 1 .]" 1
2026 1 90 VAL MG2 1 94 ASP HB2 . . 5.010 4.430 3.817 5.069 0.059 13 0 "[ . 1 .]" 1
2027 1 90 VAL MG2 1 94 ASP HB3 . . 4.630 4.545 4.352 4.673 0.043 1 0 "[ . 1 .]" 1
2028 1 90 VAL MG2 1 96 ILE MD . . 4.070 4.078 4.044 4.110 0.040 4 0 "[ . 1 .]" 1
2029 1 91 LYS H 1 91 LYS QB . . 2.820 2.373 2.211 2.504 . 0 0 "[ . 1 .]" 1
2030 1 91 LYS H 1 91 LYS QD . . 4.640 4.321 3.822 4.680 0.040 1 0 "[ . 1 .]" 1
2031 1 91 LYS H 1 91 LYS QG . . 4.320 4.064 3.612 4.271 . 0 0 "[ . 1 .]" 1
2032 1 91 LYS H 1 92 ALA H . . 4.600 4.505 4.471 4.538 . 0 0 "[ . 1 .]" 1
2033 1 91 LYS H 1 92 ALA HA . . 5.500 5.296 5.174 5.441 . 0 0 "[ . 1 .]" 1
2034 1 91 LYS H 1 94 ASP H . . 3.970 3.957 3.848 4.032 0.062 10 0 "[ . 1 .]" 1
2035 1 91 LYS H 1 94 ASP HB2 . . 3.730 2.549 2.254 2.731 . 0 0 "[ . 1 .]" 1
2036 1 91 LYS H 1 94 ASP HB3 . . 3.950 3.272 2.627 3.677 . 0 0 "[ . 1 .]" 1
2037 1 91 LYS HA 1 91 LYS QD . . 3.380 3.216 2.498 3.527 0.147 6 0 "[ . 1 .]" 1
2038 1 91 LYS HA 1 91 LYS QG . . 3.330 2.734 2.329 3.271 . 0 0 "[ . 1 .]" 1
2039 1 91 LYS HA 1 92 ALA H . . 2.610 2.213 2.170 2.256 . 0 0 "[ . 1 .]" 1
2040 1 91 LYS HA 1 92 ALA MB . . 4.150 3.965 3.912 4.046 . 0 0 "[ . 1 .]" 1
2041 1 91 LYS HA 1 93 GLY H . . 5.500 5.548 5.516 5.620 0.120 14 0 "[ . 1 .]" 1
2042 1 91 LYS QB 1 91 LYS QE . . 4.320 3.172 2.103 3.737 . 0 0 "[ . 1 .]" 1
2043 1 91 LYS QB 1 92 ALA H . . 3.770 3.549 3.444 3.605 . 0 0 "[ . 1 .]" 1
2044 1 91 LYS QB 1 92 ALA HA . . 5.500 5.200 5.117 5.275 . 0 0 "[ . 1 .]" 1
2045 1 91 LYS QB 1 94 ASP H . . 4.530 4.380 4.024 4.537 0.007 3 0 "[ . 1 .]" 1
2046 1 91 LYS QD 1 92 ALA H . . 3.100 2.546 1.984 2.999 . 0 0 "[ . 1 .]" 1
2047 1 91 LYS QD 1 92 ALA HA . . 5.500 4.096 3.960 4.503 . 0 0 "[ . 1 .]" 1
2048 1 91 LYS QD 1 92 ALA MB . . 3.480 2.894 2.395 3.506 0.026 11 0 "[ . 1 .]" 1
2049 1 91 LYS QD 1 94 ASP H . . 5.050 4.395 3.180 5.178 0.128 14 0 "[ . 1 .]" 1
2050 1 91 LYS QE 1 92 ALA H . . 4.770 4.198 3.474 4.630 . 0 0 "[ . 1 .]" 1
2051 1 91 LYS QE 1 92 ALA MB . . 5.500 3.969 3.052 4.883 . 0 0 "[ . 1 .]" 1
2052 1 91 LYS QG 1 92 ALA H . . 3.570 2.582 2.294 2.973 . 0 0 "[ . 1 .]" 1
2053 1 91 LYS QG 1 92 ALA MB . . 3.570 3.541 3.395 3.599 0.029 4 0 "[ . 1 .]" 1
2054 1 92 ALA H 1 92 ALA MB . . 2.670 2.157 2.118 2.190 . 0 0 "[ . 1 .]" 1
2055 1 92 ALA H 1 93 GLY H . . 4.420 4.392 4.334 4.432 0.012 7 0 "[ . 1 .]" 1
2056 1 92 ALA H 1 94 ASP H . . 5.200 4.848 4.697 5.012 . 0 0 "[ . 1 .]" 1
2057 1 92 ALA HA 1 93 GLY H . . 2.720 2.115 2.043 2.157 . 0 0 "[ . 1 .]" 1
2058 1 92 ALA HA 1 93 GLY HA3 . . 4.440 4.482 4.452 4.504 0.064 11 0 "[ . 1 .]" 1
2059 1 92 ALA HA 1 94 ASP H . . 3.770 3.703 3.633 3.775 0.005 4 0 "[ . 1 .]" 1
2060 1 92 ALA MB 1 93 GLY H . . 3.510 3.396 3.247 3.483 . 0 0 "[ . 1 .]" 1
2061 1 92 ALA MB 1 93 GLY HA3 . . 4.770 4.301 4.183 4.360 . 0 0 "[ . 1 .]" 1
2062 1 92 ALA MB 1 94 ASP H . . 5.000 4.771 4.689 4.868 . 0 0 "[ . 1 .]" 1
2063 1 93 GLY H 1 94 ASP H . . 3.040 2.394 2.284 2.506 . 0 0 "[ . 1 .]" 1
2064 1 93 GLY H 1 96 ILE MG . . 5.500 5.368 5.233 5.507 0.007 14 0 "[ . 1 .]" 1
2065 1 94 ASP H 1 94 ASP HB2 . . 2.820 2.273 2.140 2.494 . 0 0 "[ . 1 .]" 1
2066 1 94 ASP H 1 94 ASP HB3 . . 3.280 3.173 2.817 3.453 0.173 14 0 "[ . 1 .]" 1
2067 1 94 ASP H 1 96 ILE MG . . 4.470 4.462 4.358 4.499 0.029 8 0 "[ . 1 .]" 1
2068 1 94 ASP HA 1 95 ILE H . . 2.710 2.230 2.171 2.279 . 0 0 "[ . 1 .]" 1
2069 1 94 ASP HA 1 95 ILE MD . . 4.300 4.201 4.051 4.317 0.017 11 0 "[ . 1 .]" 1
2070 1 94 ASP HB2 1 95 ILE H . . 4.590 4.403 4.321 4.485 . 0 0 "[ . 1 .]" 1
2071 1 94 ASP HB3 1 95 ILE H . . 3.620 3.526 3.316 3.728 0.108 12 0 "[ . 1 .]" 1
2072 1 94 ASP HB3 1 96 ILE MG . . 3.560 3.439 3.289 3.574 0.014 6 0 "[ . 1 .]" 1
2073 1 95 ILE H 1 95 ILE HB . . 2.980 2.578 2.485 2.654 . 0 0 "[ . 1 .]" 1
2074 1 95 ILE H 1 95 ILE MD . . 3.630 3.006 2.823 3.233 . 0 0 "[ . 1 .]" 1
2075 1 95 ILE H 1 95 ILE HG12 . . 3.370 2.164 2.140 2.213 . 0 0 "[ . 1 .]" 1
2076 1 95 ILE H 1 95 ILE HG13 . . 3.610 3.651 3.639 3.673 0.063 8 0 "[ . 1 .]" 1
2077 1 95 ILE H 1 95 ILE MG . . 3.850 3.813 3.802 3.832 . 0 0 "[ . 1 .]" 1
2078 1 95 ILE HA 1 95 ILE MD . . 3.050 2.203 2.138 2.253 . 0 0 "[ . 1 .]" 1
2079 1 95 ILE HA 1 95 ILE HG12 . . 3.700 3.286 3.156 3.343 . 0 0 "[ . 1 .]" 1
2080 1 95 ILE HA 1 95 ILE HG13 . . 3.770 3.777 3.748 3.790 0.020 1 0 "[ . 1 .]" 1
2081 1 95 ILE HA 1 95 ILE MG . . 3.260 2.378 2.328 2.433 . 0 0 "[ . 1 .]" 1
2082 1 95 ILE HA 1 96 ILE H . . 3.000 2.076 2.055 2.097 . 0 0 "[ . 1 .]" 1
2083 1 95 ILE HA 1 96 ILE HG12 . . 4.310 3.719 3.609 3.796 . 0 0 "[ . 1 .]" 1
2084 1 95 ILE HA 1 96 ILE HG13 . . 5.150 4.728 4.651 4.919 . 0 0 "[ . 1 .]" 1
2085 1 95 ILE HA 1 97 ALA H . . 3.690 3.715 3.653 3.735 0.045 12 0 "[ . 1 .]" 1
2086 1 95 ILE HB 1 95 ILE MD . . 3.260 3.260 3.242 3.277 0.017 13 0 "[ . 1 .]" 1
2087 1 95 ILE MD 1 96 ILE H . . 3.760 3.760 3.660 3.795 0.035 5 0 "[ . 1 .]" 1
2088 1 95 ILE MD 1 98 TYR QD . . 5.500 5.332 5.185 5.459 . 0 0 "[ . 1 .]" 1
2089 1 95 ILE MD 1 98 TYR QE . . 4.490 4.503 4.353 4.536 0.046 3 0 "[ . 1 .]" 1
2090 1 95 ILE MD 1 144 ASP HB2 . . 4.510 3.158 2.690 3.495 . 0 0 "[ . 1 .]" 1
2091 1 95 ILE MD 1 144 ASP HB3 . . 4.640 3.971 3.416 4.543 . 0 0 "[ . 1 .]" 1
2092 1 95 ILE HG12 1 95 ILE MG . . 3.290 3.231 3.202 3.242 . 0 0 "[ . 1 .]" 1
2093 1 95 ILE HG13 1 95 ILE MG . . 3.380 2.286 2.239 2.322 . 0 0 "[ . 1 .]" 1
2094 1 95 ILE MG 1 96 ILE H . . 3.330 2.746 2.671 2.866 . 0 0 "[ . 1 .]" 1
2095 1 95 ILE MG 1 96 ILE HA . . 4.030 3.879 3.798 3.989 . 0 0 "[ . 1 .]" 1
2096 1 95 ILE MG 1 97 ALA H . . 3.160 2.663 2.564 2.743 . 0 0 "[ . 1 .]" 1
2097 1 95 ILE MG 1 97 ALA MB . . 4.410 4.402 4.328 4.429 0.019 10 0 "[ . 1 .]" 1
2098 1 95 ILE MG 1 98 TYR HA . . 4.650 4.590 4.490 4.658 0.008 4 0 "[ . 1 .]" 1
2099 1 95 ILE MG 1 98 TYR QD . . 4.160 3.902 3.798 3.978 . 0 0 "[ . 1 .]" 1
2100 1 95 ILE MG 1 98 TYR QE . . 3.610 3.004 2.797 3.133 . 0 0 "[ . 1 .]" 1
2101 1 96 ILE H 1 96 ILE HB . . 4.160 3.713 3.693 3.735 . 0 0 "[ . 1 .]" 1
2102 1 96 ILE H 1 96 ILE MD . . 3.790 3.801 3.791 3.815 0.025 11 0 "[ . 1 .]" 1
2103 1 96 ILE H 1 96 ILE HG12 . . 3.050 2.143 2.097 2.186 . 0 0 "[ . 1 .]" 1
2104 1 96 ILE H 1 96 ILE HG13 . . 3.540 2.757 2.695 2.909 . 0 0 "[ . 1 .]" 1
2105 1 96 ILE H 1 96 ILE MG . . 3.450 2.873 2.785 2.935 . 0 0 "[ . 1 .]" 1
2106 1 96 ILE H 1 97 ALA H . . 2.870 2.140 2.085 2.211 . 0 0 "[ . 1 .]" 1
2107 1 96 ILE H 1 97 ALA MB . . 4.340 4.229 4.197 4.290 . 0 0 "[ . 1 .]" 1
2108 1 96 ILE HA 1 96 ILE MG . . 2.920 2.218 2.196 2.251 . 0 0 "[ . 1 .]" 1
2109 1 96 ILE HB 1 96 ILE MD . . 3.090 2.455 2.430 2.489 . 0 0 "[ . 1 .]" 1
2110 1 96 ILE HB 1 97 ALA H . . 4.130 3.940 3.879 4.001 . 0 0 "[ . 1 .]" 1
2111 1 96 ILE MD 1 96 ILE MG . . 2.900 2.179 2.147 2.228 . 0 0 "[ . 1 .]" 1
2112 1 96 ILE MD 1 97 ALA H . . 4.310 4.188 4.124 4.275 . 0 0 "[ . 1 .]" 1
2113 1 96 ILE MD 1 97 ALA MB . . 3.850 3.470 3.370 3.609 . 0 0 "[ . 1 .]" 1
2114 1 96 ILE MD 1 111 LEU MD1 . . 5.500 4.590 4.486 4.696 . 0 0 "[ . 1 .]" 1
2115 1 96 ILE MD 1 111 LEU QD . . 4.450 4.046 4.020 4.081 . 0 0 "[ . 1 .]" 1
2116 1 96 ILE MD 1 111 LEU MD2 . . 5.500 4.499 4.430 4.591 . 0 0 "[ . 1 .]" 1
2117 1 96 ILE HG12 1 97 ALA H . . 3.300 3.278 3.128 3.316 0.016 12 0 "[ . 1 .]" 1
2118 1 96 ILE HG13 1 97 ALA H . . 4.050 2.553 2.472 2.656 . 0 0 "[ . 1 .]" 1
2119 1 96 ILE HG13 1 97 ALA MB . . 4.320 2.612 2.452 2.689 . 0 0 "[ . 1 .]" 1
2120 1 97 ALA H 1 97 ALA MB . . 3.470 2.766 2.731 2.784 . 0 0 "[ . 1 .]" 1
2121 1 97 ALA H 1 98 TYR H . . 4.430 4.398 4.364 4.419 . 0 0 "[ . 1 .]" 1
2122 1 97 ALA HA 1 98 TYR H . . 2.980 2.581 2.545 2.624 . 0 0 "[ . 1 .]" 1
2123 1 97 ALA HA 1 98 TYR QD . . 4.150 3.033 2.888 3.190 . 0 0 "[ . 1 .]" 1
2124 1 97 ALA MB 1 98 TYR H . . 2.870 2.071 2.022 2.105 . 0 0 "[ . 1 .]" 1
2125 1 97 ALA MB 1 98 TYR HB2 . . 4.390 4.461 4.446 4.471 0.081 2 0 "[ . 1 .]" 1
2126 1 97 ALA MB 1 98 TYR QD . . 4.340 4.121 4.002 4.207 . 0 0 "[ . 1 .]" 1
2127 1 98 TYR H 1 98 TYR HB2 . . 3.430 2.666 2.629 2.722 . 0 0 "[ . 1 .]" 1
2128 1 98 TYR H 1 98 TYR HB3 . . 4.010 3.823 3.804 3.854 . 0 0 "[ . 1 .]" 1
2129 1 98 TYR H 1 98 TYR QD . . 3.680 2.921 2.800 2.990 . 0 0 "[ . 1 .]" 1
2130 1 98 TYR H 1 99 SER H . . 4.530 4.401 4.300 4.456 . 0 0 "[ . 1 .]" 1
2131 1 98 TYR HA 1 98 TYR QD . . 3.690 3.050 2.967 3.132 . 0 0 "[ . 1 .]" 1
2132 1 98 TYR HA 1 98 TYR QE . . 4.730 4.711 4.634 4.746 0.016 11 0 "[ . 1 .]" 1
2133 1 98 TYR HA 1 99 SER H . . 3.070 2.212 2.165 2.272 . 0 0 "[ . 1 .]" 1
2134 1 98 TYR HA 1 99 SER HA . . 4.670 4.401 4.348 4.468 . 0 0 "[ . 1 .]" 1
2135 1 98 TYR HA 1 99 SER QB . . 4.410 4.121 4.029 4.393 . 0 0 "[ . 1 .]" 1
2136 1 98 TYR HB2 1 99 SER H . . 4.680 4.085 4.033 4.195 . 0 0 "[ . 1 .]" 1
2137 1 98 TYR HB3 1 99 SER H . . 4.110 3.069 2.954 3.326 . 0 0 "[ . 1 .]" 1
2138 1 98 TYR QD 1 99 SER H . . 5.100 4.119 3.991 4.345 . 0 0 "[ . 1 .]" 1
2139 1 99 SER H 1 99 SER HB2 . . 3.610 2.621 2.173 3.596 . 0 0 "[ . 1 .]" 1
2140 1 99 SER H 1 99 SER QB . . 3.160 2.266 2.151 2.525 . 0 0 "[ . 1 .]" 1
2141 1 99 SER H 1 99 SER HB3 . . 3.610 2.587 2.325 3.442 . 0 0 "[ . 1 .]" 1
2142 1 99 SER H 1 100 GLY H . . 4.740 4.693 4.647 4.734 . 0 0 "[ . 1 .]" 1
2143 1 99 SER HA 1 100 GLY H . . 3.110 2.278 2.204 2.351 . 0 0 "[ . 1 .]" 1
2144 1 99 SER HA 1 111 LEU QD . . 4.180 3.680 3.264 4.122 . 0 0 "[ . 1 .]" 1
2145 1 99 SER QB 1 100 GLY H . . 3.770 3.437 2.829 3.612 . 0 0 "[ . 1 .]" 1
2146 1 99 SER HB2 1 100 GLY H . . 4.510 3.947 2.890 4.248 . 0 0 "[ . 1 .]" 1
2147 1 99 SER HB3 1 100 GLY H . . 4.510 3.860 2.883 4.123 . 0 0 "[ . 1 .]" 1
2148 1 100 GLY H 1 101 ASN H . . 4.110 4.127 3.949 4.204 0.094 15 0 "[ . 1 .]" 1
2149 1 100 GLY HA2 1 101 ASN H . . 3.450 2.913 2.769 3.077 . 0 0 "[ . 1 .]" 1
2150 1 100 GLY HA2 1 102 THR H . . 5.220 4.690 4.512 4.958 . 0 0 "[ . 1 .]" 1
2151 1 100 GLY HA3 1 101 ASN H . . 3.400 2.301 2.147 2.456 . 0 0 "[ . 1 .]" 1
2152 1 100 GLY HA3 1 102 THR H . . 4.660 3.442 3.251 3.732 . 0 0 "[ . 1 .]" 1
2153 1 101 ASN H 1 102 THR H . . 3.390 2.362 2.134 2.538 . 0 0 "[ . 1 .]" 1
2154 1 101 ASN H 1 102 THR MG . . 4.030 3.067 2.769 3.686 . 0 0 "[ . 1 .]" 1
2155 1 101 ASN HA 1 104 ILE MD . . 3.650 2.118 1.950 2.307 . 0 0 "[ . 1 .]" 1
2156 1 101 ASN HA 1 109 ALA HA . . 4.130 3.225 2.155 3.790 . 0 0 "[ . 1 .]" 1
2157 1 101 ASN HA 1 109 ALA MB . . 4.150 3.486 3.014 3.756 . 0 0 "[ . 1 .]" 1
2158 1 101 ASN QB 1 104 ILE HB . . 4.330 3.049 2.174 4.364 0.034 11 0 "[ . 1 .]" 1
2159 1 101 ASN QB 1 104 ILE MD . . 3.640 2.768 2.167 3.200 . 0 0 "[ . 1 .]" 1
2160 1 101 ASN QB 1 104 ILE QG . . 5.040 4.026 3.363 4.529 . 0 0 "[ . 1 .]" 1
2161 1 101 ASN QB 1 109 ALA MB . . 3.110 2.367 2.131 2.650 . 0 0 "[ . 1 .]" 1
2162 1 101 ASN HB2 1 104 ILE MD . . 4.200 2.928 2.244 3.420 . 0 0 "[ . 1 .]" 1
2163 1 101 ASN HB2 1 109 ALA HA . . 4.200 3.517 2.517 4.217 0.017 7 0 "[ . 1 .]" 1
2164 1 101 ASN HB2 1 109 ALA MB . . 3.680 3.512 2.470 3.722 0.042 6 0 "[ . 1 .]" 1
2165 1 101 ASN HB3 1 104 ILE MD . . 4.200 3.456 2.666 4.200 . 0 0 "[ . 1 .]" 1
2166 1 101 ASN HB3 1 109 ALA HA . . 4.200 3.234 2.426 4.225 0.025 11 0 "[ . 1 .]" 1
2167 1 101 ASN HB3 1 109 ALA MB . . 3.680 2.484 2.160 3.682 0.002 11 0 "[ . 1 .]" 1
2168 1 101 ASN QD 1 104 ILE HB . . 5.340 4.640 3.436 5.370 0.030 9 0 "[ . 1 .]" 1
2169 1 101 ASN QD 1 109 ALA MB . . 4.880 4.156 3.001 4.938 0.058 7 0 "[ . 1 .]" 1
2170 1 102 THR H 1 102 THR MG . . 3.460 2.150 1.895 2.497 . 0 0 "[ . 1 .]" 1
2171 1 102 THR H 1 109 ALA MB . . 5.500 5.475 5.265 5.559 0.059 1 0 "[ . 1 .]" 1
2172 1 102 THR HA 1 102 THR MG . . 3.090 2.509 2.330 3.202 0.112 7 0 "[ . 1 .]" 1
2173 1 104 ILE HA 1 104 ILE QG . . 3.990 2.453 2.244 2.775 . 0 0 "[ . 1 .]" 1
2174 1 104 ILE HA 1 104 ILE MG . . 3.370 2.433 2.260 2.547 . 0 0 "[ . 1 .]" 1
2175 1 104 ILE HA 1 110 HIS HE1 . . 5.120 4.491 3.839 4.945 . 0 0 "[ . 1 .]" 1
2176 1 104 ILE HB 1 104 ILE MD . . 3.650 2.398 2.286 2.498 . 0 0 "[ . 1 .]" 1
2177 1 104 ILE HB 1 110 HIS HE1 . . 5.000 4.991 4.822 5.046 0.046 9 0 "[ . 1 .]" 1
2178 1 104 ILE MD 1 109 ALA HA . . 3.700 2.195 2.058 2.530 . 0 0 "[ . 1 .]" 1
2179 1 104 ILE MD 1 109 ALA MB . . 3.960 3.333 3.098 3.673 . 0 0 "[ . 1 .]" 1
2180 1 104 ILE MD 1 110 HIS HE1 . . 5.090 2.992 2.703 3.271 . 0 0 "[ . 1 .]" 1
2181 1 104 ILE MG 1 110 HIS HE1 . . 4.600 2.470 2.219 2.889 . 0 0 "[ . 1 .]" 1
2182 1 106 THR MG 1 110 HIS HE1 . . 5.030 3.788 2.292 5.034 0.004 11 0 "[ . 1 .]" 1
2183 1 107 THR HA 1 107 THR MG . . 3.350 2.436 2.159 3.258 . 0 0 "[ . 1 .]" 1
2184 1 107 THR HB 1 108 GLY H . . 4.510 3.940 2.985 4.544 0.034 9 0 "[ . 1 .]" 1
2185 1 109 ALA MB 1 110 HIS HA . . 4.010 3.865 3.495 4.064 0.054 9 0 "[ . 1 .]" 1
2186 1 110 HIS HA 1 111 LEU H . . 3.470 2.308 2.216 2.519 . 0 0 "[ . 1 .]" 1
2187 1 110 HIS HB2 1 111 LEU H . . 3.740 2.737 2.229 2.972 . 0 0 "[ . 1 .]" 1
2188 1 110 HIS HB3 1 111 LEU H . . 3.970 3.868 3.529 3.979 0.009 9 0 "[ . 1 .]" 1
2189 1 110 HIS HD2 1 112 HIS HA . . 4.570 3.702 3.401 4.581 0.011 10 0 "[ . 1 .]" 1
2190 1 110 HIS HD2 1 112 HIS HB2 . . 4.280 3.608 3.100 4.147 . 0 0 "[ . 1 .]" 1
2191 1 111 LEU H 1 111 LEU HB2 . . 3.710 2.850 2.674 3.078 . 0 0 "[ . 1 .]" 1
2192 1 111 LEU H 1 111 LEU HB3 . . 3.680 2.464 2.334 2.560 . 0 0 "[ . 1 .]" 1
2193 1 111 LEU HA 1 111 LEU MD1 . . 4.000 2.234 2.183 2.336 . 0 0 "[ . 1 .]" 1
2194 1 111 LEU HA 1 111 LEU QD . . 3.330 2.222 2.172 2.321 . 0 0 "[ . 1 .]" 1
2195 1 111 LEU HA 1 111 LEU MD2 . . 4.000 3.948 3.929 3.984 . 0 0 "[ . 1 .]" 1
2196 1 111 LEU HA 1 111 LEU HG . . 4.260 3.158 3.097 3.331 . 0 0 "[ . 1 .]" 1
2197 1 111 LEU HB3 1 111 LEU MD1 . . 3.440 3.237 3.207 3.248 . 0 0 "[ . 1 .]" 1
2198 1 111 LEU HB3 1 111 LEU QD . . 2.930 2.246 2.218 2.260 . 0 0 "[ . 1 .]" 1
2199 1 111 LEU HB3 1 111 LEU MD2 . . 3.440 2.291 2.262 2.307 . 0 0 "[ . 1 .]" 1
2200 1 111 LEU QD 1 112 HIS HA . . 5.170 4.262 4.119 4.401 . 0 0 "[ . 1 .]" 1
2201 1 111 LEU QD 1 113 PHE H . . 5.440 4.241 4.035 4.646 . 0 0 "[ . 1 .]" 1
2202 1 111 LEU QD 1 113 PHE HA . . 4.420 3.818 3.523 4.246 . 0 0 "[ . 1 .]" 1
2203 1 111 LEU QD 1 113 PHE QB . . 3.630 2.611 2.365 3.006 . 0 0 "[ . 1 .]" 1
2204 1 111 LEU QD 1 113 PHE QD . . 4.840 3.811 3.296 4.224 . 0 0 "[ . 1 .]" 1
2205 1 111 LEU QD 1 143 TYR QD . . 4.380 3.491 2.446 3.943 . 0 0 "[ . 1 .]" 1
2206 1 111 LEU HG 1 112 HIS HA . . 4.740 3.821 3.647 3.936 . 0 0 "[ . 1 .]" 1
2207 1 111 LEU HG 1 113 PHE H . . 4.400 3.816 3.489 4.385 . 0 0 "[ . 1 .]" 1
2208 1 112 HIS HA 1 112 HIS HE1 . . 5.230 5.204 4.957 5.297 0.067 9 0 "[ . 1 .]" 1
2209 1 112 HIS HA 1 113 PHE H . . 3.080 2.205 2.166 2.246 . 0 0 "[ . 1 .]" 1
2210 1 112 HIS HA 1 113 PHE QB . . 4.800 4.232 4.119 4.288 . 0 0 "[ . 1 .]" 1
2211 1 112 HIS HB2 1 112 HIS HE1 . . 5.040 4.893 4.823 4.964 . 0 0 "[ . 1 .]" 1
2212 1 112 HIS HB2 1 113 PHE H . . 4.810 4.407 4.241 4.515 . 0 0 "[ . 1 .]" 1
2213 1 112 HIS HD2 1 113 PHE HA . . 4.620 3.550 3.305 3.682 . 0 0 "[ . 1 .]" 1
2214 1 112 HIS HD2 1 114 GLN HB2 . . 3.880 3.029 2.891 3.351 . 0 0 "[ . 1 .]" 1
2215 1 112 HIS HD2 1 114 GLN HB3 . . 3.880 2.787 2.641 3.497 . 0 0 "[ . 1 .]" 1
2216 1 112 HIS HD2 1 114 GLN QG . . 5.340 4.615 4.525 4.803 . 0 0 "[ . 1 .]" 1
2217 1 112 HIS HE1 1 114 GLN HB2 . . 5.500 4.317 4.220 4.495 . 0 0 "[ . 1 .]" 1
2218 1 112 HIS HE1 1 114 GLN QB . . 4.750 4.172 4.095 4.310 . 0 0 "[ . 1 .]" 1
2219 1 112 HIS HE1 1 114 GLN HB3 . . 5.500 5.529 5.506 5.559 0.059 13 0 "[ . 1 .]" 1
2220 1 112 HIS HE2 1 114 GLN HB2 . . 4.800 2.154 2.009 2.312 . 0 0 "[ . 1 .]" 1
2221 1 112 HIS HE2 1 114 GLN QB . . 4.130 2.114 1.983 2.255 . 0 0 "[ . 1 .]" 1
2222 1 112 HIS HE2 1 114 GLN HB3 . . 4.800 3.089 3.039 3.145 . 0 0 "[ . 1 .]" 1
2223 1 113 PHE H 1 113 PHE QB . . 3.230 2.586 2.451 2.743 . 0 0 "[ . 1 .]" 1
2224 1 113 PHE H 1 113 PHE QD . . 4.870 4.298 4.209 4.409 . 0 0 "[ . 1 .]" 1
2225 1 113 PHE H 1 114 GLN H . . 4.560 4.405 4.348 4.469 . 0 0 "[ . 1 .]" 1
2226 1 113 PHE HA 1 113 PHE QD . . 3.570 2.655 2.508 2.804 . 0 0 "[ . 1 .]" 1
2227 1 113 PHE HA 1 114 GLN H . . 3.130 2.098 2.058 2.140 . 0 0 "[ . 1 .]" 1
2228 1 113 PHE QB 1 114 GLN H . . 4.130 3.695 3.605 3.818 . 0 0 "[ . 1 .]" 1
2229 1 113 PHE QB 1 142 LEU MD1 . . 4.830 3.214 2.955 4.551 . 0 0 "[ . 1 .]" 1
2230 1 113 PHE QB 1 142 LEU QD . . 3.830 3.055 2.814 3.248 . 0 0 "[ . 1 .]" 1
2231 1 113 PHE QB 1 142 LEU MD2 . . 4.830 4.514 2.841 4.853 0.023 4 0 "[ . 1 .]" 1
2232 1 113 PHE QD 1 114 GLN H . . 4.310 2.993 2.756 3.258 . 0 0 "[ . 1 .]" 1
2233 1 113 PHE QD 1 128 PRO HB2 . . 3.880 3.070 2.749 3.350 . 0 0 "[ . 1 .]" 1
2234 1 113 PHE QD 1 128 PRO HB3 . . 4.190 3.971 3.707 4.197 0.007 1 0 "[ . 1 .]" 1
2235 1 113 PHE QD 1 128 PRO HG2 . . 4.360 4.197 3.938 4.376 0.016 12 0 "[ . 1 .]" 1
2236 1 113 PHE QD 1 128 PRO HG3 . . 4.500 3.857 3.612 4.045 . 0 0 "[ . 1 .]" 1
2237 1 113 PHE QD 1 132 ILE MD . . 3.810 2.454 2.239 2.951 . 0 0 "[ . 1 .]" 1
2238 1 113 PHE QD 1 132 ILE HG13 . . 5.070 4.349 4.008 4.698 . 0 0 "[ . 1 .]" 1
2239 1 113 PHE QD 1 142 LEU MD1 . . 4.620 3.218 2.835 4.182 . 0 0 "[ . 1 .]" 1
2240 1 113 PHE QD 1 142 LEU QD . . 3.600 3.031 2.789 3.150 . 0 0 "[ . 1 .]" 1
2241 1 113 PHE QD 1 142 LEU MD2 . . 4.620 3.998 2.832 4.281 . 0 0 "[ . 1 .]" 1
2242 1 113 PHE QD 1 142 LEU HG . . 5.190 3.886 3.593 5.207 0.017 11 0 "[ . 1 .]" 1
2243 1 113 PHE QE 1 114 GLN H . . 5.360 4.277 4.076 4.646 . 0 0 "[ . 1 .]" 1
2244 1 113 PHE QE 1 115 ARG HB2 . . 4.600 3.544 3.312 3.682 . 0 0 "[ . 1 .]" 1
2245 1 113 PHE QE 1 115 ARG QB . . 3.940 3.424 3.229 3.533 . 0 0 "[ . 1 .]" 1
2246 1 113 PHE QE 1 115 ARG HB3 . . 4.600 4.542 4.208 4.628 0.028 4 0 "[ . 1 .]" 1
2247 1 113 PHE QE 1 115 ARG QG . . 5.340 4.769 4.289 5.085 . 0 0 "[ . 1 .]" 1
2248 1 113 PHE QE 1 128 PRO HB2 . . 3.670 2.519 2.361 2.701 . 0 0 "[ . 1 .]" 1
2249 1 113 PHE QE 1 128 PRO HB3 . . 4.000 3.199 2.958 3.464 . 0 0 "[ . 1 .]" 1
2250 1 113 PHE QE 1 132 ILE MD . . 4.350 2.734 2.418 3.254 . 0 0 "[ . 1 .]" 1
2251 1 113 PHE QE 1 132 ILE HG13 . . 3.840 3.166 2.966 3.550 . 0 0 "[ . 1 .]" 1
2252 1 113 PHE QE 1 135 LEU MD1 . . 4.430 4.459 4.445 4.474 0.044 4 0 "[ . 1 .]" 1
2253 1 113 PHE QE 1 142 LEU QD . . 3.650 2.990 2.789 3.139 . 0 0 "[ . 1 .]" 1
2254 1 113 PHE QE 1 142 LEU HG . . 4.930 4.537 4.153 4.743 . 0 0 "[ . 1 .]" 1
2255 1 113 PHE HZ 1 115 ARG HA . . 5.340 4.818 4.414 5.344 0.004 11 0 "[ . 1 .]" 1
2256 1 113 PHE HZ 1 115 ARG HB2 . . 4.720 3.118 2.938 3.342 . 0 0 "[ . 1 .]" 1
2257 1 113 PHE HZ 1 115 ARG QB . . 4.070 3.075 2.905 3.277 . 0 0 "[ . 1 .]" 1
2258 1 113 PHE HZ 1 115 ARG HB3 . . 4.720 4.694 4.522 4.737 0.017 14 0 "[ . 1 .]" 1
2259 1 113 PHE HZ 1 115 ARG HD2 . . 4.850 3.678 2.986 4.871 0.021 10 0 "[ . 1 .]" 1
2260 1 113 PHE HZ 1 115 ARG QD . . 4.070 3.270 2.930 3.818 . 0 0 "[ . 1 .]" 1
2261 1 113 PHE HZ 1 115 ARG HD3 . . 4.850 4.314 3.254 4.889 0.039 7 0 "[ . 1 .]" 1
2262 1 113 PHE HZ 1 132 ILE HG13 . . 5.500 5.211 4.977 5.500 . 0 0 "[ . 1 .]" 1
2263 1 113 PHE HZ 1 142 LEU MD1 . . 5.230 3.695 3.400 4.229 . 0 0 "[ . 1 .]" 1
2264 1 113 PHE HZ 1 142 LEU QD . . 4.500 3.474 3.144 3.740 . 0 0 "[ . 1 .]" 1
2265 1 113 PHE HZ 1 142 LEU MD2 . . 5.230 4.383 3.242 4.640 . 0 0 "[ . 1 .]" 1
2266 1 114 GLN H 1 114 GLN HB2 . . 4.030 3.394 3.275 3.461 . 0 0 "[ . 1 .]" 1
2267 1 114 GLN H 1 114 GLN QB . . 3.450 2.523 2.443 2.695 . 0 0 "[ . 1 .]" 1
2268 1 114 GLN H 1 114 GLN HB3 . . 4.030 2.604 2.511 2.867 . 0 0 "[ . 1 .]" 1
2269 1 114 GLN HA 1 114 GLN HG2 . . 4.210 3.522 2.484 3.653 . 0 0 "[ . 1 .]" 1
2270 1 114 GLN HA 1 114 GLN HG3 . . 4.210 2.857 2.742 3.610 . 0 0 "[ . 1 .]" 1
2271 1 114 GLN HA 1 115 ARG H . . 3.270 2.109 2.051 2.179 . 0 0 "[ . 1 .]" 1
2272 1 114 GLN HA 1 115 ARG HB2 . . 4.910 4.496 4.317 4.628 . 0 0 "[ . 1 .]" 1
2273 1 114 GLN HA 1 115 ARG HB3 . . 4.910 4.435 4.207 4.613 . 0 0 "[ . 1 .]" 1
2274 1 114 GLN HA 1 116 MET ME . . 4.760 4.786 4.763 4.835 0.075 13 0 "[ . 1 .]" 1
2275 1 114 GLN QE 1 116 MET ME . . 3.810 3.404 2.531 3.744 . 0 0 "[ . 1 .]" 1
2276 1 114 GLN QE 1 116 MET HG2 . . 4.500 3.242 2.891 3.584 . 0 0 "[ . 1 .]" 1
2277 1 114 GLN QE 1 116 MET HG3 . . 4.700 3.362 2.965 3.624 . 0 0 "[ . 1 .]" 1
2278 1 114 GLN QE 1 122 ASN HA . . 3.290 2.792 2.258 3.318 0.028 11 0 "[ . 1 .]" 1
2279 1 114 GLN QE 1 125 ALA MB . . 3.460 2.732 2.385 3.212 . 0 0 "[ . 1 .]" 1
2280 1 114 GLN HE21 1 122 ASN HA . . 3.770 3.191 2.678 3.792 0.022 13 0 "[ . 1 .]" 1
2281 1 114 GLN HE21 1 125 ALA MB . . 4.020 2.855 2.445 3.423 . 0 0 "[ . 1 .]" 1
2282 1 114 GLN HE22 1 122 ASN HA . . 3.770 3.109 2.397 3.781 0.011 11 0 "[ . 1 .]" 1
2283 1 114 GLN HE22 1 125 ALA MB . . 4.020 3.609 3.071 4.010 . 0 0 "[ . 1 .]" 1
2284 1 114 GLN QG 1 115 ARG H . . 4.100 3.142 2.724 3.480 . 0 0 "[ . 1 .]" 1
2285 1 114 GLN QG 1 116 MET ME . . 4.630 2.348 2.131 4.026 . 0 0 "[ . 1 .]" 1
2286 1 114 GLN QG 1 125 ALA MB . . 3.660 2.843 2.629 3.043 . 0 0 "[ . 1 .]" 1
2287 1 115 ARG HA 1 115 ARG HD2 . . 4.950 4.386 4.118 4.815 . 0 0 "[ . 1 .]" 1
2288 1 115 ARG HA 1 115 ARG HD3 . . 4.950 4.596 4.274 4.776 . 0 0 "[ . 1 .]" 1
2289 1 115 ARG HA 1 115 ARG HG2 . . 3.630 3.244 3.097 3.421 . 0 0 "[ . 1 .]" 1
2290 1 115 ARG HA 1 115 ARG HG3 . . 3.630 2.569 2.476 2.750 . 0 0 "[ . 1 .]" 1
2291 1 115 ARG HA 1 116 MET H . . 3.170 2.167 2.117 2.214 . 0 0 "[ . 1 .]" 1
2292 1 115 ARG HA 1 116 MET ME . . 3.740 3.401 3.057 3.751 0.011 10 0 "[ . 1 .]" 1
2293 1 115 ARG HA 1 116 MET HG3 . . 4.190 3.676 3.356 4.189 . 0 0 "[ . 1 .]" 1
2294 1 115 ARG QB 1 115 ARG QD . . 3.250 2.135 2.048 2.302 . 0 0 "[ . 1 .]" 1
2295 1 115 ARG QB 1 128 PRO HB2 . . 5.340 3.902 3.575 4.121 . 0 0 "[ . 1 .]" 1
2296 1 115 ARG QB 1 128 PRO HB3 . . 4.020 2.540 2.150 2.864 . 0 0 "[ . 1 .]" 1
2297 1 115 ARG QB 1 131 PHE QD . . 5.340 4.171 3.956 4.441 . 0 0 "[ . 1 .]" 1
2298 1 115 ARG QD 1 131 PHE QE . . 4.670 3.106 2.935 3.579 . 0 0 "[ . 1 .]" 1
2299 1 115 ARG HD2 1 131 PHE QD . . 4.300 3.544 3.177 4.005 . 0 0 "[ . 1 .]" 1
2300 1 115 ARG HD3 1 131 PHE QD . . 4.300 3.416 3.162 3.631 . 0 0 "[ . 1 .]" 1
2301 1 115 ARG QG 1 128 PRO HB3 . . 5.340 4.569 4.082 4.984 . 0 0 "[ . 1 .]" 1
2302 1 115 ARG HG2 1 116 MET H . . 4.250 3.028 2.790 3.221 . 0 0 "[ . 1 .]" 1
2303 1 115 ARG HG3 1 116 MET H . . 4.250 2.845 2.599 3.184 . 0 0 "[ . 1 .]" 1
2304 1 116 MET H 1 116 MET HB2 . . 3.800 2.695 2.545 2.774 . 0 0 "[ . 1 .]" 1
2305 1 116 MET H 1 116 MET HB3 . . 4.010 3.804 3.722 3.850 . 0 0 "[ . 1 .]" 1
2306 1 116 MET H 1 116 MET ME . . 3.490 3.224 2.636 3.402 . 0 0 "[ . 1 .]" 1
2307 1 116 MET H 1 116 MET HG2 . . 4.710 4.369 4.244 4.455 . 0 0 "[ . 1 .]" 1
2308 1 116 MET H 1 116 MET HG3 . . 4.010 3.162 3.045 3.241 . 0 0 "[ . 1 .]" 1
2309 1 116 MET H 1 117 LYS H . . 4.650 4.454 4.424 4.508 . 0 0 "[ . 1 .]" 1
2310 1 116 MET HA 1 116 MET HG2 . . 3.960 2.849 2.752 3.042 . 0 0 "[ . 1 .]" 1
2311 1 116 MET HA 1 116 MET HG3 . . 4.000 2.840 2.516 2.925 . 0 0 "[ . 1 .]" 1
2312 1 116 MET HA 1 117 LYS H . . 3.280 2.260 2.197 2.336 . 0 0 "[ . 1 .]" 1
2313 1 116 MET HA 1 126 GLU H . . 3.850 2.989 2.706 3.184 . 0 0 "[ . 1 .]" 1
2314 1 116 MET HB2 1 116 MET ME . . 3.890 2.388 2.268 2.647 . 0 0 "[ . 1 .]" 1
2315 1 116 MET HB2 1 117 LYS H . . 4.720 3.973 3.813 4.187 . 0 0 "[ . 1 .]" 1
2316 1 116 MET HB2 1 120 VAL HA . . 4.450 3.265 2.842 3.595 . 0 0 "[ . 1 .]" 1
2317 1 116 MET HB2 1 121 GLY H . . 4.360 4.028 3.794 4.306 . 0 0 "[ . 1 .]" 1
2318 1 116 MET HB2 1 124 TYR HB2 . . 4.290 3.872 3.801 3.900 . 0 0 "[ . 1 .]" 1
2319 1 116 MET HB2 1 124 TYR HB3 . . 4.540 4.087 3.927 4.244 . 0 0 "[ . 1 .]" 1
2320 1 116 MET HB2 1 124 TYR QD . . 5.320 5.368 5.331 5.397 0.077 14 0 "[ . 1 .]" 1
2321 1 116 MET HB2 1 125 ALA HA . . 4.740 4.361 4.226 4.453 . 0 0 "[ . 1 .]" 1
2322 1 116 MET HB3 1 116 MET ME . . 4.090 3.665 3.544 3.909 . 0 0 "[ . 1 .]" 1
2323 1 116 MET HB3 1 117 LYS H . . 3.920 2.905 2.698 3.192 . 0 0 "[ . 1 .]" 1
2324 1 116 MET HB3 1 119 GLY H . . 4.180 3.950 3.644 4.138 . 0 0 "[ . 1 .]" 1
2325 1 116 MET HB3 1 120 VAL HA . . 4.340 3.218 2.589 3.543 . 0 0 "[ . 1 .]" 1
2326 1 116 MET HB3 1 121 GLY H . . 4.880 3.684 3.353 4.064 . 0 0 "[ . 1 .]" 1
2327 1 116 MET HB3 1 124 TYR H . . 5.500 4.460 4.332 4.549 . 0 0 "[ . 1 .]" 1
2328 1 116 MET HB3 1 124 TYR HA . . 4.510 4.404 4.256 4.524 0.014 11 0 "[ . 1 .]" 1
2329 1 116 MET HB3 1 124 TYR HB2 . . 3.780 2.314 2.200 2.405 . 0 0 "[ . 1 .]" 1
2330 1 116 MET HB3 1 124 TYR HB3 . . 3.700 2.488 2.368 2.640 . 0 0 "[ . 1 .]" 1
2331 1 116 MET HB3 1 124 TYR QD . . 4.430 4.176 4.053 4.235 . 0 0 "[ . 1 .]" 1
2332 1 116 MET HB3 1 125 ALA HA . . 4.480 3.533 3.311 3.704 . 0 0 "[ . 1 .]" 1
2333 1 116 MET ME 1 120 VAL HA . . 4.250 3.533 3.210 3.981 . 0 0 "[ . 1 .]" 1
2334 1 116 MET ME 1 120 VAL MG1 . . 4.730 2.573 2.166 4.238 . 0 0 "[ . 1 .]" 1
2335 1 116 MET ME 1 120 VAL QG . . 3.290 2.293 2.156 2.871 . 0 0 "[ . 1 .]" 1
2336 1 116 MET ME 1 120 VAL MG2 . . 4.730 3.655 2.216 3.959 . 0 0 "[ . 1 .]" 1
2337 1 116 MET ME 1 121 GLY H . . 4.350 3.521 3.330 3.815 . 0 0 "[ . 1 .]" 1
2338 1 116 MET HG2 1 117 LYS H . . 4.870 4.319 4.163 4.519 . 0 0 "[ . 1 .]" 1
2339 1 116 MET HG2 1 120 VAL HA . . 4.880 4.147 3.441 4.458 . 0 0 "[ . 1 .]" 1
2340 1 116 MET HG2 1 121 GLY H . . 4.070 3.354 2.922 3.777 . 0 0 "[ . 1 .]" 1
2341 1 116 MET HG2 1 124 TYR H . . 4.160 3.991 3.510 4.172 0.012 11 0 "[ . 1 .]" 1
2342 1 116 MET HG2 1 124 TYR HB3 . . 4.620 4.039 3.605 4.264 . 0 0 "[ . 1 .]" 1
2343 1 116 MET HG2 1 124 TYR QD . . 4.880 4.749 4.235 4.898 0.018 12 0 "[ . 1 .]" 1
2344 1 116 MET HG2 1 125 ALA H . . 3.830 3.151 2.967 3.289 . 0 0 "[ . 1 .]" 1
2345 1 116 MET HG2 1 125 ALA HA . . 3.900 2.333 2.204 2.872 . 0 0 "[ . 1 .]" 1
2346 1 116 MET HG2 1 125 ALA MB . . 3.680 2.616 2.290 3.082 . 0 0 "[ . 1 .]" 1
2347 1 116 MET HG2 1 126 GLU H . . 5.020 4.386 4.232 5.035 0.015 13 0 "[ . 1 .]" 1
2348 1 116 MET HG3 1 120 VAL HA . . 5.040 4.813 4.443 5.043 0.003 10 0 "[ . 1 .]" 1
2349 1 116 MET HG3 1 121 GLY H . . 4.490 4.298 4.054 4.514 0.024 4 0 "[ . 1 .]" 1
2350 1 116 MET HG3 1 125 ALA HA . . 3.810 2.779 2.357 2.937 . 0 0 "[ . 1 .]" 1
2351 1 116 MET HG3 1 126 GLU H . . 4.280 4.138 3.882 4.299 0.019 2 0 "[ . 1 .]" 1
2352 1 117 LYS H 1 117 LYS HB2 . . 3.710 2.970 2.771 3.104 . 0 0 "[ . 1 .]" 1
2353 1 117 LYS H 1 117 LYS HB3 . . 3.490 2.657 2.513 2.811 . 0 0 "[ . 1 .]" 1
2354 1 117 LYS H 1 117 LYS HG2 . . 4.660 4.514 4.407 4.598 . 0 0 "[ . 1 .]" 1
2355 1 117 LYS H 1 117 LYS HG3 . . 5.080 4.726 4.630 4.781 . 0 0 "[ . 1 .]" 1
2356 1 117 LYS H 1 118 GLY H . . 4.650 4.415 4.351 4.505 . 0 0 "[ . 1 .]" 1
2357 1 117 LYS H 1 119 GLY H . . 4.730 3.993 3.707 4.239 . 0 0 "[ . 1 .]" 1
2358 1 117 LYS H 1 124 TYR HB2 . . 4.380 3.942 3.520 4.301 . 0 0 "[ . 1 .]" 1
2359 1 117 LYS H 1 124 TYR HB3 . . 3.800 2.742 2.383 2.994 . 0 0 "[ . 1 .]" 1
2360 1 117 LYS H 1 124 TYR QD . . 4.510 4.365 4.137 4.515 0.005 11 0 "[ . 1 .]" 1
2361 1 117 LYS H 1 125 ALA H . . 5.380 4.862 4.720 4.972 . 0 0 "[ . 1 .]" 1
2362 1 117 LYS H 1 125 ALA HA . . 4.430 3.796 3.699 3.886 . 0 0 "[ . 1 .]" 1
2363 1 117 LYS H 1 126 GLU QB . . 5.020 4.612 4.295 4.979 . 0 0 "[ . 1 .]" 1
2364 1 117 LYS H 1 126 GLU QG . . 4.040 3.172 2.718 3.872 . 0 0 "[ . 1 .]" 1
2365 1 117 LYS HA 1 117 LYS QE . . 4.780 4.541 4.363 4.853 0.073 9 0 "[ . 1 .]" 1
2366 1 117 LYS HA 1 117 LYS HG2 . . 3.670 2.927 2.767 3.048 . 0 0 "[ . 1 .]" 1
2367 1 117 LYS HA 1 117 LYS HG3 . . 3.510 2.560 2.398 2.694 . 0 0 "[ . 1 .]" 1
2368 1 117 LYS HA 1 118 GLY H . . 2.980 2.138 2.098 2.166 . 0 0 "[ . 1 .]" 1
2369 1 117 LYS HA 1 118 GLY HA2 . . 4.540 4.361 4.307 4.395 . 0 0 "[ . 1 .]" 1
2370 1 117 LYS HA 1 119 GLY H . . 3.840 3.783 3.667 3.860 0.020 6 0 "[ . 1 .]" 1
2371 1 117 LYS HB2 1 117 LYS QE . . 4.510 3.839 3.093 4.285 . 0 0 "[ . 1 .]" 1
2372 1 117 LYS HB3 1 117 LYS QE . . 4.310 3.468 1.998 4.025 . 0 0 "[ . 1 .]" 1
2373 1 117 LYS HB3 1 118 GLY HA3 . . 5.500 4.687 4.546 4.911 . 0 0 "[ . 1 .]" 1
2374 1 117 LYS QE 1 117 LYS HG2 . . 3.130 2.294 2.200 2.351 . 0 0 "[ . 1 .]" 1
2375 1 117 LYS QE 1 117 LYS HG3 . . 3.260 2.668 2.300 3.295 0.035 11 0 "[ . 1 .]" 1
2376 1 117 LYS QE 1 118 GLY H . . 5.030 4.593 4.262 4.912 . 0 0 "[ . 1 .]" 1
2377 1 117 LYS QE 1 118 GLY HA3 . . 4.790 4.600 4.164 4.834 0.044 10 0 "[ . 1 .]" 1
2378 1 117 LYS HG2 1 118 GLY H . . 4.010 2.888 2.645 3.269 . 0 0 "[ . 1 .]" 1
2379 1 117 LYS HG2 1 118 GLY HA2 . . 4.310 3.863 3.688 4.160 . 0 0 "[ . 1 .]" 1
2380 1 117 LYS HG2 1 118 GLY HA3 . . 4.240 3.481 3.216 3.674 . 0 0 "[ . 1 .]" 1
2381 1 117 LYS HG3 1 118 GLY H . . 4.030 3.311 3.003 3.487 . 0 0 "[ . 1 .]" 1
2382 1 117 LYS HG3 1 118 GLY HA2 . . 4.970 4.907 4.726 4.985 0.015 15 0 "[ . 1 .]" 1
2383 1 117 LYS HG3 1 118 GLY HA3 . . 5.120 4.956 4.780 5.175 0.055 2 0 "[ . 1 .]" 1
2384 1 118 GLY H 1 119 GLY H . . 3.070 2.964 2.842 3.080 0.010 7 0 "[ . 1 .]" 1
2385 1 118 GLY HA2 1 124 TYR QD . . 4.880 4.869 4.684 4.953 0.073 10 0 "[ . 1 .]" 1
2386 1 118 GLY HA3 1 119 GLY H . . 3.460 3.213 3.053 3.339 . 0 0 "[ . 1 .]" 1
2387 1 118 GLY HA3 1 124 TYR QD . . 4.330 3.506 3.287 3.717 . 0 0 "[ . 1 .]" 1
2388 1 118 GLY HA3 1 124 TYR QE . . 4.660 4.232 3.876 4.661 0.001 10 0 "[ . 1 .]" 1
2389 1 119 GLY H 1 120 VAL H . . 4.440 4.319 4.246 4.351 . 0 0 "[ . 1 .]" 1
2390 1 119 GLY H 1 120 VAL HA . . 4.770 4.624 4.561 4.679 . 0 0 "[ . 1 .]" 1
2391 1 119 GLY H 1 120 VAL QG . . 5.010 4.371 4.188 4.811 . 0 0 "[ . 1 .]" 1
2392 1 119 GLY H 1 124 TYR HB2 . . 4.060 4.084 4.044 4.114 0.054 15 0 "[ . 1 .]" 1
2393 1 119 GLY H 1 124 TYR HB3 . . 3.600 2.872 2.736 2.964 . 0 0 "[ . 1 .]" 1
2394 1 119 GLY H 1 124 TYR QD . . 3.680 3.034 2.754 3.294 . 0 0 "[ . 1 .]" 1
2395 1 119 GLY HA2 1 120 VAL H . . 3.330 2.723 2.654 2.884 . 0 0 "[ . 1 .]" 1
2396 1 119 GLY HA2 1 120 VAL HA . . 4.870 4.492 4.398 4.604 . 0 0 "[ . 1 .]" 1
2397 1 119 GLY HA2 1 120 VAL QG . . 3.860 3.057 2.828 3.205 . 0 0 "[ . 1 .]" 1
2398 1 119 GLY HA2 1 124 TYR QD . . 4.480 4.467 4.394 4.507 0.027 7 0 "[ . 1 .]" 1
2399 1 119 GLY HA2 1 124 TYR QE . . 4.480 4.450 4.308 4.498 0.018 14 0 "[ . 1 .]" 1
2400 1 119 GLY HA3 1 120 VAL H . . 3.310 2.413 2.361 2.490 . 0 0 "[ . 1 .]" 1
2401 1 119 GLY HA3 1 120 VAL HA . . 5.300 4.461 4.412 4.519 . 0 0 "[ . 1 .]" 1
2402 1 119 GLY HA3 1 120 VAL HB . . 5.400 5.360 5.136 5.447 0.047 10 0 "[ . 1 .]" 1
2403 1 119 GLY HA3 1 120 VAL QG . . 4.220 3.856 3.703 4.013 . 0 0 "[ . 1 .]" 1
2404 1 119 GLY HA3 1 124 TYR HB3 . . 4.310 4.095 3.912 4.325 0.015 10 0 "[ . 1 .]" 1
2405 1 119 GLY HA3 1 124 TYR QD . . 4.000 3.264 3.115 3.359 . 0 0 "[ . 1 .]" 1
2406 1 119 GLY HA3 1 124 TYR QE . . 4.050 3.043 2.872 3.139 . 0 0 "[ . 1 .]" 1
2407 1 120 VAL H 1 120 VAL HB . . 3.540 3.100 2.829 3.510 . 0 0 "[ . 1 .]" 1
2408 1 120 VAL H 1 120 VAL MG1 . . 4.380 3.753 2.270 4.006 . 0 0 "[ . 1 .]" 1
2409 1 120 VAL H 1 120 VAL QG . . 2.960 2.479 2.253 2.825 . 0 0 "[ . 1 .]" 1
2410 1 120 VAL H 1 120 VAL MG2 . . 4.380 2.705 2.435 3.768 . 0 0 "[ . 1 .]" 1
2411 1 120 VAL H 1 124 TYR QD . . 4.070 3.564 3.195 3.913 . 0 0 "[ . 1 .]" 1
2412 1 120 VAL H 1 124 TYR QE . . 4.610 3.515 3.257 3.730 . 0 0 "[ . 1 .]" 1
2413 1 120 VAL HA 1 120 VAL MG1 . . 3.290 2.346 2.144 3.239 . 0 0 "[ . 1 .]" 1
2414 1 120 VAL HA 1 120 VAL MG2 . . 3.290 2.650 2.481 2.730 . 0 0 "[ . 1 .]" 1
2415 1 120 VAL HA 1 121 GLY H . . 2.700 2.092 2.020 2.143 . 0 0 "[ . 1 .]" 1
2416 1 120 VAL HA 1 121 GLY HA3 . . 4.760 4.417 4.364 4.450 . 0 0 "[ . 1 .]" 1
2417 1 120 VAL HA 1 124 TYR HB2 . . 4.780 3.256 2.941 3.513 . 0 0 "[ . 1 .]" 1
2418 1 120 VAL HA 1 124 TYR HB3 . . 4.610 4.223 3.894 4.443 . 0 0 "[ . 1 .]" 1
2419 1 120 VAL HA 1 124 TYR QD . . 4.210 3.651 3.499 3.939 . 0 0 "[ . 1 .]" 1
2420 1 120 VAL HA 1 124 TYR QE . . 5.170 5.082 4.855 5.202 0.032 13 0 "[ . 1 .]" 1
2421 1 120 VAL HB 1 121 GLY H . . 4.330 3.944 3.767 4.263 . 0 0 "[ . 1 .]" 1
2422 1 120 VAL QG 1 121 GLY H . . 3.350 2.538 2.381 2.996 . 0 0 "[ . 1 .]" 1
2423 1 120 VAL QG 1 121 GLY HA2 . . 4.370 3.604 3.417 3.798 . 0 0 "[ . 1 .]" 1
2424 1 120 VAL QG 1 124 TYR QD . . 4.800 4.348 4.210 4.527 . 0 0 "[ . 1 .]" 1
2425 1 120 VAL MG1 1 121 GLY H . . 4.260 2.784 2.393 4.286 0.026 11 0 "[ . 1 .]" 1
2426 1 120 VAL MG2 1 121 GLY H . . 4.260 4.031 2.561 4.307 0.047 5 0 "[ . 1 .]" 1
2427 1 121 GLY H 1 124 TYR HB2 . . 4.630 3.216 2.726 3.517 . 0 0 "[ . 1 .]" 1
2428 1 121 GLY H 1 124 TYR QD . . 4.300 3.342 2.961 3.694 . 0 0 "[ . 1 .]" 1
2429 1 121 GLY HA2 1 124 TYR QD . . 4.790 4.232 3.976 4.599 . 0 0 "[ . 1 .]" 1
2430 1 121 GLY HA3 1 124 TYR QD . . 4.090 2.946 2.594 3.333 . 0 0 "[ . 1 .]" 1
2431 1 122 ASN HA 1 124 TYR H . . 4.490 3.926 3.651 4.213 . 0 0 "[ . 1 .]" 1
2432 1 122 ASN HA 1 125 ALA H . . 4.140 3.411 3.002 3.900 . 0 0 "[ . 1 .]" 1
2433 1 122 ASN HA 1 125 ALA MB . . 3.490 2.584 2.321 3.009 . 0 0 "[ . 1 .]" 1
2434 1 123 ALA H 1 124 TYR H . . 4.020 2.769 2.677 2.939 . 0 0 "[ . 1 .]" 1
2435 1 123 ALA HA 1 125 ALA H . . 4.150 4.003 3.901 4.150 . 0 0 "[ . 1 .]" 1
2436 1 123 ALA MB 1 124 TYR H . . 3.420 2.966 2.696 3.155 . 0 0 "[ . 1 .]" 1
2437 1 123 ALA MB 1 124 TYR HB2 . . 4.850 4.696 4.558 4.866 0.016 15 0 "[ . 1 .]" 1
2438 1 123 ALA MB 1 124 TYR HB3 . . 5.450 5.349 5.199 5.441 . 0 0 "[ . 1 .]" 1
2439 1 123 ALA MB 1 124 TYR QD . . 3.970 3.462 3.161 3.721 . 0 0 "[ . 1 .]" 1
2440 1 123 ALA MB 1 124 TYR QE . . 4.030 3.766 3.255 4.042 0.012 5 0 "[ . 1 .]" 1
2441 1 123 ALA MB 1 125 ALA H . . 4.560 4.542 4.403 4.609 0.049 12 0 "[ . 1 .]" 1
2442 1 124 TYR H 1 124 TYR HB2 . . 3.330 2.493 2.448 2.538 . 0 0 "[ . 1 .]" 1
2443 1 124 TYR H 1 124 TYR HB3 . . 3.660 3.651 3.617 3.675 0.015 7 0 "[ . 1 .]" 1
2444 1 124 TYR H 1 124 TYR QD . . 3.500 2.600 2.248 2.990 . 0 0 "[ . 1 .]" 1
2445 1 124 TYR H 1 125 ALA H . . 2.820 2.421 2.191 2.658 . 0 0 "[ . 1 .]" 1
2446 1 124 TYR H 1 125 ALA MB . . 4.180 3.949 3.765 4.117 . 0 0 "[ . 1 .]" 1
2447 1 124 TYR HA 1 124 TYR QD . . 3.450 2.847 2.693 3.078 . 0 0 "[ . 1 .]" 1
2448 1 124 TYR HA 1 124 TYR QE . . 4.890 4.705 4.571 4.899 0.009 11 0 "[ . 1 .]" 1
2449 1 124 TYR HB2 1 125 ALA H . . 4.800 3.500 3.280 3.805 . 0 0 "[ . 1 .]" 1
2450 1 124 TYR HB3 1 125 ALA H . . 4.430 4.252 4.146 4.353 . 0 0 "[ . 1 .]" 1
2451 1 124 TYR QD 1 125 ALA H . . 5.020 4.586 4.291 4.865 . 0 0 "[ . 1 .]" 1
2452 1 125 ALA H 1 125 ALA MB . . 2.850 2.206 2.186 2.235 . 0 0 "[ . 1 .]" 1
2453 1 125 ALA H 1 126 GLU H . . 5.500 4.667 4.644 4.706 . 0 0 "[ . 1 .]" 1
2454 1 125 ALA HA 1 126 GLU H . . 3.200 2.216 2.167 2.278 . 0 0 "[ . 1 .]" 1
2455 1 125 ALA MB 1 126 GLU H . . 3.400 2.801 2.648 3.026 . 0 0 "[ . 1 .]" 1
2456 1 125 ALA MB 1 126 GLU HA . . 4.160 4.065 3.908 4.170 0.010 15 0 "[ . 1 .]" 1
2457 1 126 GLU H 1 126 GLU HB2 . . 4.110 2.959 2.714 3.895 . 0 0 "[ . 1 .]" 1
2458 1 126 GLU H 1 126 GLU QB . . 3.480 2.846 2.660 3.207 . 0 0 "[ . 1 .]" 1
2459 1 126 GLU H 1 126 GLU HB3 . . 4.110 3.885 3.413 3.998 . 0 0 "[ . 1 .]" 1
2460 1 126 GLU H 1 126 GLU QG . . 3.610 3.115 2.517 3.316 . 0 0 "[ . 1 .]" 1
2461 1 126 GLU H 1 127 ASP H . . 4.400 4.380 4.312 4.425 0.025 12 0 "[ . 1 .]" 1
2462 1 126 GLU HA 1 126 GLU HG2 . . 4.050 2.889 2.482 3.892 . 0 0 "[ . 1 .]" 1
2463 1 126 GLU HA 1 126 GLU QG . . 3.390 2.761 2.420 3.395 0.005 13 0 "[ . 1 .]" 1
2464 1 126 GLU HA 1 126 GLU HG3 . . 4.050 3.586 3.253 3.886 . 0 0 "[ . 1 .]" 1
2465 1 126 GLU HA 1 127 ASP H . . 2.880 2.274 2.118 2.421 . 0 0 "[ . 1 .]" 1
2466 1 126 GLU HA 1 127 ASP QB . . 5.150 4.043 3.785 4.577 . 0 0 "[ . 1 .]" 1
2467 1 126 GLU QB 1 127 ASP H . . 2.990 2.349 2.234 2.476 . 0 0 "[ . 1 .]" 1
2468 1 126 GLU HB2 1 127 ASP H . . 3.440 3.435 2.280 3.587 0.147 1 0 "[ . 1 .]" 1
2469 1 126 GLU HB3 1 127 ASP H . . 3.440 2.470 2.261 3.536 0.096 13 0 "[ . 1 .]" 1
2470 1 126 GLU QG 1 127 ASP H . . 4.260 4.067 3.744 4.335 0.075 6 0 "[ . 1 .]" 1
2471 1 126 GLU HG2 1 127 ASP H . . 4.900 4.464 4.043 4.908 0.008 6 0 "[ . 1 .]" 1
2472 1 126 GLU HG3 1 127 ASP H . . 4.900 4.808 3.900 4.977 0.077 5 0 "[ . 1 .]" 1
2473 1 127 ASP H 1 127 ASP HB2 . . 3.390 2.576 2.354 3.508 0.118 15 0 "[ . 1 .]" 1
2474 1 127 ASP H 1 127 ASP QB . . 2.800 2.234 2.122 2.802 0.002 15 0 "[ . 1 .]" 1
2475 1 127 ASP H 1 127 ASP HB3 . . 3.390 2.480 2.287 2.947 . 0 0 "[ . 1 .]" 1
2476 1 127 ASP H 1 128 PRO HD2 . . 4.920 4.950 4.872 4.993 0.073 6 0 "[ . 1 .]" 1
2477 1 127 ASP H 1 128 PRO HD3 . . 4.370 4.432 4.376 4.479 0.109 9 0 "[ . 1 .]" 1
2478 1 127 ASP HA 1 128 PRO HD2 . . 3.320 2.250 2.214 2.303 . 0 0 "[ . 1 .]" 1
2479 1 127 ASP HA 1 128 PRO HD3 . . 3.230 2.271 2.194 2.362 . 0 0 "[ . 1 .]" 1
2480 1 127 ASP HA 1 128 PRO HG2 . . 4.510 4.418 4.380 4.464 . 0 0 "[ . 1 .]" 1
2481 1 127 ASP HA 1 128 PRO HG3 . . 4.710 4.495 4.445 4.544 . 0 0 "[ . 1 .]" 1
2482 1 127 ASP HA 1 129 LYS H . . 4.660 3.713 3.644 3.767 . 0 0 "[ . 1 .]" 1
2483 1 127 ASP HA 1 129 LYS HB2 . . 5.110 5.047 4.902 5.126 0.016 13 0 "[ . 1 .]" 1
2484 1 127 ASP QB 1 130 PRO HD2 . . 4.400 3.394 2.492 3.832 . 0 0 "[ . 1 .]" 1
2485 1 128 PRO HA 1 130 PRO HD2 . . 4.870 3.854 3.734 3.987 . 0 0 "[ . 1 .]" 1
2486 1 128 PRO HA 1 131 PHE H . . 4.170 3.352 3.250 3.438 . 0 0 "[ . 1 .]" 1
2487 1 128 PRO HB2 1 131 PHE HB3 . . 4.790 4.126 4.025 4.281 . 0 0 "[ . 1 .]" 1
2488 1 128 PRO HB2 1 131 PHE QD . . 4.150 3.135 2.995 3.314 . 0 0 "[ . 1 .]" 1
2489 1 128 PRO HB2 1 132 ILE MD . . 3.180 2.867 2.546 3.063 . 0 0 "[ . 1 .]" 1
2490 1 128 PRO HB2 1 132 ILE HG13 . . 3.650 3.155 2.840 3.473 . 0 0 "[ . 1 .]" 1
2491 1 128 PRO HB3 1 131 PHE HB3 . . 4.790 4.213 4.111 4.333 . 0 0 "[ . 1 .]" 1
2492 1 128 PRO HB3 1 132 ILE MD . . 5.070 4.341 4.012 4.548 . 0 0 "[ . 1 .]" 1
2493 1 128 PRO HD2 1 129 LYS H . . 3.880 2.483 2.374 2.572 . 0 0 "[ . 1 .]" 1
2494 1 128 PRO HD2 1 130 PRO HD2 . . 4.250 4.309 4.260 4.344 0.094 13 0 "[ . 1 .]" 1
2495 1 128 PRO HD3 1 129 LYS H . . 4.400 3.846 3.775 3.914 . 0 0 "[ . 1 .]" 1
2496 1 128 PRO HG2 1 129 LYS H . . 3.200 2.829 2.565 2.958 . 0 0 "[ . 1 .]" 1
2497 1 128 PRO HG2 1 131 PHE HB3 . . 5.500 5.541 5.521 5.575 0.075 3 0 "[ . 1 .]" 1
2498 1 128 PRO HG3 1 129 LYS H . . 4.370 4.279 4.076 4.357 . 0 0 "[ . 1 .]" 1
2499 1 129 LYS H 1 129 LYS HB2 . . 3.120 2.120 2.045 2.189 . 0 0 "[ . 1 .]" 1
2500 1 129 LYS H 1 129 LYS HB3 . . 3.550 3.017 2.873 3.153 . 0 0 "[ . 1 .]" 1
2501 1 129 LYS H 1 129 LYS QD . . 4.950 4.597 4.325 4.825 . 0 0 "[ . 1 .]" 1
2502 1 129 LYS H 1 129 LYS HG2 . . 4.800 4.034 3.888 4.145 . 0 0 "[ . 1 .]" 1
2503 1 129 LYS H 1 129 LYS QG . . 4.140 3.719 3.578 3.800 . 0 0 "[ . 1 .]" 1
2504 1 129 LYS H 1 129 LYS HG3 . . 4.800 4.366 4.182 4.591 . 0 0 "[ . 1 .]" 1
2505 1 129 LYS H 1 130 PRO HD2 . . 3.580 2.349 2.295 2.465 . 0 0 "[ . 1 .]" 1
2506 1 129 LYS H 1 130 PRO HD3 . . 3.550 3.195 3.057 3.373 . 0 0 "[ . 1 .]" 1
2507 1 129 LYS H 1 130 PRO HG2 . . 4.660 4.589 4.503 4.682 0.022 15 0 "[ . 1 .]" 1
2508 1 129 LYS HA 1 129 LYS HB2 . . 2.940 2.725 2.667 2.795 . 0 0 "[ . 1 .]" 1
2509 1 129 LYS HA 1 129 LYS HD2 . . 4.090 3.580 2.753 4.169 0.079 5 0 "[ . 1 .]" 1
2510 1 129 LYS HA 1 129 LYS QD . . 3.250 2.814 2.192 3.163 . 0 0 "[ . 1 .]" 1
2511 1 129 LYS HA 1 129 LYS HD3 . . 4.090 3.185 2.246 4.122 0.032 11 0 "[ . 1 .]" 1
2512 1 129 LYS HA 1 129 LYS HG2 . . 3.870 2.313 2.134 2.896 . 0 0 "[ . 1 .]" 1
2513 1 129 LYS HA 1 129 LYS HG3 . . 3.870 3.552 3.467 3.726 . 0 0 "[ . 1 .]" 1
2514 1 129 LYS HA 1 131 PHE H . . 4.670 4.152 3.928 4.315 . 0 0 "[ . 1 .]" 1
2515 1 129 LYS HA 1 132 ILE H . . 3.780 3.479 3.262 3.606 . 0 0 "[ . 1 .]" 1
2516 1 129 LYS HA 1 132 ILE HB . . 3.610 2.949 2.625 3.389 . 0 0 "[ . 1 .]" 1
2517 1 129 LYS HA 1 132 ILE MD . . 3.610 3.135 2.305 3.388 . 0 0 "[ . 1 .]" 1
2518 1 129 LYS HA 1 132 ILE HG12 . . 5.430 5.346 5.085 5.450 0.020 3 0 "[ . 1 .]" 1
2519 1 129 LYS HA 1 132 ILE HG13 . . 4.370 4.044 3.856 4.204 . 0 0 "[ . 1 .]" 1
2520 1 129 LYS HA 1 133 ASP H . . 4.810 4.264 3.962 4.836 0.026 2 0 "[ . 1 .]" 1
2521 1 129 LYS HB2 1 130 PRO HD2 . . 3.740 3.490 3.312 3.682 . 0 0 "[ . 1 .]" 1
2522 1 129 LYS HB2 1 130 PRO HD3 . . 3.190 3.162 2.992 3.236 0.046 11 0 "[ . 1 .]" 1
2523 1 129 LYS HB3 1 130 PRO HD2 . . 3.270 3.124 2.983 3.258 . 0 0 "[ . 1 .]" 1
2524 1 129 LYS HB3 1 130 PRO HD3 . . 3.080 2.043 1.991 2.085 . 0 0 "[ . 1 .]" 1
2525 1 129 LYS QD 1 130 PRO HA . . 4.450 3.933 3.586 4.176 . 0 0 "[ . 1 .]" 1
2526 1 129 LYS QD 1 130 PRO HD2 . . 5.060 4.830 4.525 5.076 0.016 6 0 "[ . 1 .]" 1
2527 1 129 LYS QD 1 130 PRO HD3 . . 4.120 3.923 3.549 4.169 0.049 7 0 "[ . 1 .]" 1
2528 1 129 LYS QE 1 129 LYS HG2 . . 3.800 2.743 2.275 3.577 . 0 0 "[ . 1 .]" 1
2529 1 129 LYS QE 1 129 LYS HG3 . . 3.800 2.499 2.306 2.874 . 0 0 "[ . 1 .]" 1
2530 1 129 LYS QG 1 130 PRO HD3 . . 4.160 4.183 3.983 4.238 0.078 14 0 "[ . 1 .]" 1
2531 1 129 LYS HG2 1 130 PRO HD3 . . 4.850 4.900 4.858 4.932 0.082 8 0 "[ . 1 .]" 1
2532 1 129 LYS HG3 1 130 PRO HD3 . . 4.850 4.545 4.209 4.667 . 0 0 "[ . 1 .]" 1
2533 1 130 PRO HA 1 132 ILE H . . 4.410 4.192 4.004 4.370 . 0 0 "[ . 1 .]" 1
2534 1 130 PRO HA 1 133 ASP H . . 4.000 3.257 3.070 3.449 . 0 0 "[ . 1 .]" 1
2535 1 130 PRO HA 1 133 ASP QB . . 3.130 2.344 2.206 2.742 . 0 0 "[ . 1 .]" 1
2536 1 130 PRO HB2 1 131 PHE H . . 3.870 3.710 3.546 3.911 0.041 2 0 "[ . 1 .]" 1
2537 1 130 PRO HD2 1 131 PHE H . . 3.720 2.707 2.469 2.848 . 0 0 "[ . 1 .]" 1
2538 1 130 PRO HD3 1 131 PHE H . . 4.020 3.887 3.738 3.959 . 0 0 "[ . 1 .]" 1
2539 1 130 PRO HG2 1 131 PHE H . . 4.160 2.841 2.560 3.106 . 0 0 "[ . 1 .]" 1
2540 1 130 PRO HG2 1 131 PHE HA . . 5.420 4.673 4.386 5.108 . 0 0 "[ . 1 .]" 1
2541 1 131 PHE H 1 132 ILE H . . 3.140 2.530 2.406 2.597 . 0 0 "[ . 1 .]" 1
2542 1 131 PHE H 1 132 ILE HB . . 4.530 4.573 4.544 4.599 0.069 5 0 "[ . 1 .]" 1
2543 1 131 PHE H 1 132 ILE HG13 . . 4.790 4.446 4.318 4.541 . 0 0 "[ . 1 .]" 1
2544 1 131 PHE H 1 133 ASP H . . 4.310 3.996 3.887 4.144 . 0 0 "[ . 1 .]" 1
2545 1 131 PHE H 1 134 GLN HG2 . . 5.310 4.803 4.634 5.068 . 0 0 "[ . 1 .]" 1
2546 1 131 PHE HA 1 131 PHE QD . . 3.580 3.150 2.996 3.230 . 0 0 "[ . 1 .]" 1
2547 1 131 PHE HA 1 131 PHE QE . . 4.970 4.981 4.906 5.014 0.044 2 0 "[ . 1 .]" 1
2548 1 131 PHE HA 1 134 GLN QB . . 4.100 4.142 4.109 4.181 0.081 9 0 "[ . 1 .]" 1
2549 1 131 PHE HA 1 134 GLN HE21 . . 4.170 3.020 2.687 3.571 . 0 0 "[ . 1 .]" 1
2550 1 131 PHE HA 1 134 GLN HE22 . . 4.860 4.045 3.685 4.677 . 0 0 "[ . 1 .]" 1
2551 1 131 PHE HA 1 134 GLN HG2 . . 3.820 2.328 2.266 2.394 . 0 0 "[ . 1 .]" 1
2552 1 131 PHE HA 1 134 GLN HG3 . . 3.670 3.605 3.287 3.704 0.034 8 0 "[ . 1 .]" 1
2553 1 131 PHE HB2 1 132 ILE H . . 4.370 4.356 4.288 4.402 0.032 10 0 "[ . 1 .]" 1
2554 1 131 PHE HB3 1 132 ILE H . . 3.450 3.258 3.129 3.380 . 0 0 "[ . 1 .]" 1
2555 1 131 PHE QD 1 132 ILE H . . 4.070 3.204 3.037 3.310 . 0 0 "[ . 1 .]" 1
2556 1 131 PHE QD 1 132 ILE HA . . 3.960 3.855 3.710 3.963 0.003 1 0 "[ . 1 .]" 1
2557 1 131 PHE QD 1 132 ILE MD . . 4.020 3.708 3.581 3.849 . 0 0 "[ . 1 .]" 1
2558 1 131 PHE QD 1 132 ILE HG12 . . 3.890 3.483 3.364 3.813 . 0 0 "[ . 1 .]" 1
2559 1 131 PHE QD 1 132 ILE HG13 . . 3.570 2.377 2.269 2.493 . 0 0 "[ . 1 .]" 1
2560 1 131 PHE QE 1 132 ILE MD . . 4.920 4.216 3.988 4.807 . 0 0 "[ . 1 .]" 1
2561 1 131 PHE QE 1 135 LEU MD1 . . 3.690 3.194 2.829 3.421 . 0 0 "[ . 1 .]" 1
2562 1 131 PHE QE 1 135 LEU MD2 . . 3.750 3.602 3.193 3.763 0.013 5 0 "[ . 1 .]" 1
2563 1 131 PHE HZ 1 135 LEU MD1 . . 4.210 4.097 3.640 4.229 0.019 4 0 "[ . 1 .]" 1
2564 1 131 PHE HZ 1 135 LEU MD2 . . 4.020 3.581 2.908 3.842 . 0 0 "[ . 1 .]" 1
2565 1 132 ILE H 1 132 ILE HB . . 2.990 2.306 2.243 2.393 . 0 0 "[ . 1 .]" 1
2566 1 132 ILE H 1 132 ILE MD . . 4.460 3.676 3.187 3.817 . 0 0 "[ . 1 .]" 1
2567 1 132 ILE H 1 132 ILE HG12 . . 3.680 3.704 3.681 3.730 0.050 3 0 "[ . 1 .]" 1
2568 1 132 ILE H 1 132 ILE HG13 . . 3.260 2.476 2.328 2.564 . 0 0 "[ . 1 .]" 1
2569 1 132 ILE H 1 132 ILE MG . . 3.870 3.744 3.696 3.801 . 0 0 "[ . 1 .]" 1
2570 1 132 ILE H 1 133 ASP H . . 3.220 2.499 2.441 2.627 . 0 0 "[ . 1 .]" 1
2571 1 132 ILE H 1 133 ASP QB . . 4.370 4.288 4.000 4.401 0.031 2 0 "[ . 1 .]" 1
2572 1 132 ILE H 1 134 GLN H . . 4.380 4.169 4.088 4.345 . 0 0 "[ . 1 .]" 1
2573 1 132 ILE H 1 135 LEU MD1 . . 4.550 4.463 4.362 4.539 . 0 0 "[ . 1 .]" 1
2574 1 132 ILE H 1 135 LEU HG . . 4.870 4.683 4.587 4.812 . 0 0 "[ . 1 .]" 1
2575 1 132 ILE HA 1 132 ILE MD . . 3.810 3.781 3.739 3.836 0.026 8 0 "[ . 1 .]" 1
2576 1 132 ILE HA 1 132 ILE HG12 . . 3.470 2.379 2.283 2.635 . 0 0 "[ . 1 .]" 1
2577 1 132 ILE HA 1 132 ILE HG13 . . 3.610 2.821 2.663 2.906 . 0 0 "[ . 1 .]" 1
2578 1 132 ILE HA 1 132 ILE MG . . 3.120 2.521 2.488 2.560 . 0 0 "[ . 1 .]" 1
2579 1 132 ILE HA 1 134 GLN H . . 4.230 3.781 3.658 3.915 . 0 0 "[ . 1 .]" 1
2580 1 132 ILE HA 1 135 LEU H . . 3.720 3.463 3.322 3.656 . 0 0 "[ . 1 .]" 1
2581 1 132 ILE HA 1 135 LEU HB2 . . 4.560 3.351 3.195 3.472 . 0 0 "[ . 1 .]" 1
2582 1 132 ILE HA 1 135 LEU HB3 . . 4.740 4.490 4.412 4.587 . 0 0 "[ . 1 .]" 1
2583 1 132 ILE HA 1 135 LEU MD1 . . 2.980 2.166 2.113 2.231 . 0 0 "[ . 1 .]" 1
2584 1 132 ILE HA 1 135 LEU MD2 . . 4.010 3.711 3.603 3.866 . 0 0 "[ . 1 .]" 1
2585 1 132 ILE HA 1 135 LEU HG . . 3.160 2.230 2.154 2.329 . 0 0 "[ . 1 .]" 1
2586 1 132 ILE HA 1 139 GLU HA . . 4.990 4.829 4.610 4.930 . 0 0 "[ . 1 .]" 1
2587 1 132 ILE HB 1 132 ILE MD . . 3.090 2.453 2.306 2.499 . 0 0 "[ . 1 .]" 1
2588 1 132 ILE HB 1 133 ASP H . . 3.260 2.786 2.680 2.930 . 0 0 "[ . 1 .]" 1
2589 1 132 ILE HB 1 135 LEU MD1 . . 4.300 4.279 4.220 4.321 0.021 2 0 "[ . 1 .]" 1
2590 1 132 ILE MD 1 139 GLU HA . . 3.990 3.128 2.927 3.677 . 0 0 "[ . 1 .]" 1
2591 1 132 ILE MD 1 142 LEU MD1 . . 4.080 3.635 2.439 4.091 0.011 2 0 "[ . 1 .]" 1
2592 1 132 ILE MD 1 142 LEU QD . . 2.990 2.556 2.348 3.146 0.156 8 0 "[ . 1 .]" 1
2593 1 132 ILE MD 1 142 LEU MD2 . . 4.080 2.653 2.397 3.271 . 0 0 "[ . 1 .]" 1
2594 1 132 ILE HG12 1 132 ILE MG . . 3.100 2.436 2.301 2.489 . 0 0 "[ . 1 .]" 1
2595 1 132 ILE HG12 1 133 ASP H . . 5.230 5.077 5.007 5.196 . 0 0 "[ . 1 .]" 1
2596 1 132 ILE HG12 1 135 LEU MD1 . . 3.290 2.431 2.253 2.768 . 0 0 "[ . 1 .]" 1
2597 1 132 ILE HG12 1 142 LEU QD . . 4.180 2.396 2.031 2.577 . 0 0 "[ . 1 .]" 1
2598 1 132 ILE HG13 1 132 ILE MG . . 3.330 3.242 3.214 3.268 . 0 0 "[ . 1 .]" 1
2599 1 132 ILE HG13 1 133 ASP H . . 4.420 4.469 4.429 4.499 0.079 15 0 "[ . 1 .]" 1
2600 1 132 ILE HG13 1 135 LEU MD1 . . 3.850 3.536 3.360 3.648 . 0 0 "[ . 1 .]" 1
2601 1 132 ILE HG13 1 142 LEU QD . . 4.260 3.634 3.244 3.863 . 0 0 "[ . 1 .]" 1
2602 1 132 ILE MG 1 133 ASP H . . 3.780 3.337 3.246 3.515 . 0 0 "[ . 1 .]" 1
2603 1 132 ILE MG 1 133 ASP HA . . 3.710 3.444 3.253 3.722 0.012 2 0 "[ . 1 .]" 1
2604 1 132 ILE MG 1 134 GLN H . . 4.580 4.603 4.516 4.651 0.071 2 0 "[ . 1 .]" 1
2605 1 132 ILE MG 1 135 LEU MD1 . . 2.970 2.370 2.211 2.450 . 0 0 "[ . 1 .]" 1
2606 1 132 ILE MG 1 138 GLY H . . 4.730 4.674 4.485 4.791 0.061 3 0 "[ . 1 .]" 1
2607 1 132 ILE MG 1 138 GLY HA2 . . 4.290 3.055 2.848 3.309 . 0 0 "[ . 1 .]" 1
2608 1 132 ILE MG 1 138 GLY HA3 . . 4.470 3.664 3.478 3.932 . 0 0 "[ . 1 .]" 1
2609 1 132 ILE MG 1 139 GLU H . . 3.750 2.676 2.506 2.879 . 0 0 "[ . 1 .]" 1
2610 1 132 ILE MG 1 139 GLU HA . . 2.960 2.054 1.952 2.218 . 0 0 "[ . 1 .]" 1
2611 1 132 ILE MG 1 139 GLU HB2 . . 3.440 3.235 2.847 3.506 0.066 5 0 "[ . 1 .]" 1
2612 1 132 ILE MG 1 139 GLU HB3 . . 3.110 2.283 2.095 2.490 . 0 0 "[ . 1 .]" 1
2613 1 132 ILE MG 1 139 GLU HG2 . . 4.090 3.930 3.729 4.076 . 0 0 "[ . 1 .]" 1
2614 1 132 ILE MG 1 139 GLU HG3 . . 4.520 4.512 4.266 4.612 0.092 4 0 "[ . 1 .]" 1
2615 1 132 ILE MG 1 140 ARG H . . 4.200 4.280 4.256 4.297 0.097 11 0 "[ . 1 .]" 1
2616 1 132 ILE MG 1 141 SER H . . 4.620 4.295 4.136 4.408 . 0 0 "[ . 1 .]" 1
2617 1 132 ILE MG 1 142 LEU H . . 5.290 4.726 4.385 4.944 . 0 0 "[ . 1 .]" 1
2618 1 133 ASP H 1 133 ASP QB . . 2.920 2.268 2.103 2.388 . 0 0 "[ . 1 .]" 1
2619 1 133 ASP H 1 134 GLN H . . 3.150 2.932 2.804 3.018 . 0 0 "[ . 1 .]" 1
2620 1 133 ASP H 1 134 GLN HG2 . . 4.480 4.378 4.178 4.523 0.043 8 0 "[ . 1 .]" 1
2621 1 133 ASP H 1 135 LEU H . . 4.480 4.398 4.328 4.458 . 0 0 "[ . 1 .]" 1
2622 1 133 ASP HA 1 135 LEU H . . 4.220 3.900 3.664 4.190 . 0 0 "[ . 1 .]" 1
2623 1 133 ASP QB 1 134 GLN H . . 3.810 3.217 2.943 3.430 . 0 0 "[ . 1 .]" 1
2624 1 133 ASP QB 1 135 LEU H . . 4.890 4.876 4.683 4.932 0.042 14 0 "[ . 1 .]" 1
2625 1 134 GLN H 1 134 GLN QB . . 2.880 2.784 2.666 2.863 . 0 0 "[ . 1 .]" 1
2626 1 134 GLN H 1 134 GLN HG2 . . 3.510 2.287 2.089 2.628 . 0 0 "[ . 1 .]" 1
2627 1 134 GLN H 1 134 GLN HG3 . . 3.360 2.513 2.085 2.676 . 0 0 "[ . 1 .]" 1
2628 1 134 GLN H 1 135 LEU H . . 2.870 2.419 2.252 2.511 . 0 0 "[ . 1 .]" 1
2629 1 134 GLN H 1 135 LEU HA . . 4.900 4.851 4.712 4.930 0.030 4 0 "[ . 1 .]" 1
2630 1 134 GLN H 1 135 LEU MD1 . . 5.020 4.841 4.719 4.960 . 0 0 "[ . 1 .]" 1
2631 1 134 GLN H 1 135 LEU HG . . 4.460 3.662 3.477 3.802 . 0 0 "[ . 1 .]" 1
2632 1 134 GLN HA 1 134 GLN QB . . 2.700 2.173 2.133 2.189 . 0 0 "[ . 1 .]" 1
2633 1 134 GLN HA 1 134 GLN HG2 . . 4.060 3.897 3.802 4.079 0.019 3 0 "[ . 1 .]" 1
2634 1 134 GLN HA 1 134 GLN HG3 . . 3.650 3.646 3.580 3.673 0.023 9 0 "[ . 1 .]" 1
2635 1 134 GLN HA 1 135 LEU H . . 3.510 3.407 3.327 3.463 . 0 0 "[ . 1 .]" 1
2636 1 134 GLN QB 1 134 GLN HE21 . . 4.160 3.967 3.906 4.038 . 0 0 "[ . 1 .]" 1
2637 1 134 GLN QB 1 135 LEU H . . 3.810 3.857 3.833 3.878 0.068 8 0 "[ . 1 .]" 1
2638 1 134 GLN HE21 1 135 LEU MD2 . . 4.100 3.139 2.616 3.503 . 0 0 "[ . 1 .]" 1
2639 1 134 GLN HE21 1 135 LEU HG . . 4.730 3.667 3.043 4.202 . 0 0 "[ . 1 .]" 1
2640 1 134 GLN HE22 1 134 GLN HG3 . . 3.910 3.536 3.484 3.595 . 0 0 "[ . 1 .]" 1
2641 1 134 GLN HE22 1 135 LEU MD2 . . 4.470 3.992 2.965 4.481 0.011 11 0 "[ . 1 .]" 1
2642 1 134 GLN HG3 1 135 LEU H . . 4.140 2.841 2.684 3.062 . 0 0 "[ . 1 .]" 1
2643 1 135 LEU H 1 135 LEU HB2 . . 3.650 2.379 2.351 2.406 . 0 0 "[ . 1 .]" 1
2644 1 135 LEU H 1 135 LEU HB3 . . 3.700 3.581 3.560 3.607 . 0 0 "[ . 1 .]" 1
2645 1 135 LEU H 1 135 LEU MD1 . . 3.750 3.688 3.626 3.740 . 0 0 "[ . 1 .]" 1
2646 1 135 LEU H 1 135 LEU MD2 . . 3.750 3.565 3.465 3.717 . 0 0 "[ . 1 .]" 1
2647 1 135 LEU H 1 135 LEU HG . . 3.010 2.471 2.371 2.611 . 0 0 "[ . 1 .]" 1
2648 1 135 LEU H 1 136 PRO HD2 . . 4.810 4.856 4.841 4.867 0.057 9 0 "[ . 1 .]" 1
2649 1 135 LEU H 1 136 PRO HD3 . . 5.200 5.126 5.008 5.201 0.001 13 0 "[ . 1 .]" 1
2650 1 135 LEU H 1 138 GLY H . . 4.560 4.096 3.889 4.428 . 0 0 "[ . 1 .]" 1
2651 1 135 LEU H 1 138 GLY HA2 . . 4.010 3.383 3.072 3.703 . 0 0 "[ . 1 .]" 1
2652 1 135 LEU HA 1 135 LEU MD1 . . 3.910 3.838 3.820 3.853 . 0 0 "[ . 1 .]" 1
2653 1 135 LEU HA 1 135 LEU MD2 . . 2.800 2.110 2.082 2.143 . 0 0 "[ . 1 .]" 1
2654 1 135 LEU HA 1 135 LEU HG . . 3.740 3.043 2.980 3.079 . 0 0 "[ . 1 .]" 1
2655 1 135 LEU HA 1 136 PRO HD2 . . 3.130 2.501 2.468 2.523 . 0 0 "[ . 1 .]" 1
2656 1 135 LEU HA 1 136 PRO HD3 . . 2.910 2.349 2.238 2.425 . 0 0 "[ . 1 .]" 1
2657 1 135 LEU HA 1 136 PRO HG2 . . 4.620 4.621 4.599 4.634 0.014 4 0 "[ . 1 .]" 1
2658 1 135 LEU HA 1 136 PRO HG3 . . 4.660 4.587 4.506 4.645 . 0 0 "[ . 1 .]" 1
2659 1 135 LEU HA 1 138 GLY H . . 4.600 4.328 4.265 4.420 . 0 0 "[ . 1 .]" 1
2660 1 135 LEU HB2 1 135 LEU MD1 . . 3.280 2.300 2.273 2.333 . 0 0 "[ . 1 .]" 1
2661 1 135 LEU HB2 1 135 LEU MD2 . . 3.570 3.265 3.257 3.276 . 0 0 "[ . 1 .]" 1
2662 1 135 LEU HB2 1 136 PRO HD2 . . 3.950 3.674 3.645 3.723 . 0 0 "[ . 1 .]" 1
2663 1 135 LEU HB2 1 138 GLY H . . 3.710 2.737 2.574 2.874 . 0 0 "[ . 1 .]" 1
2664 1 135 LEU HB2 1 138 GLY HA2 . . 4.020 2.527 2.315 2.732 . 0 0 "[ . 1 .]" 1
2665 1 135 LEU HB2 1 138 GLY HA3 . . 4.260 4.086 3.879 4.267 0.007 15 0 "[ . 1 .]" 1
2666 1 135 LEU HB2 1 139 GLU HA . . 5.110 4.951 4.724 5.125 0.015 3 0 "[ . 1 .]" 1
2667 1 135 LEU HB2 1 141 SER QB . . 4.980 3.327 3.086 3.876 . 0 0 "[ . 1 .]" 1
2668 1 135 LEU HB3 1 135 LEU MD1 . . 3.330 2.359 2.336 2.383 . 0 0 "[ . 1 .]" 1
2669 1 135 LEU HB3 1 135 LEU MD2 . . 3.100 2.431 2.396 2.450 . 0 0 "[ . 1 .]" 1
2670 1 135 LEU HB3 1 136 PRO HD2 . . 3.280 2.095 2.063 2.151 . 0 0 "[ . 1 .]" 1
2671 1 135 LEU HB3 1 136 PRO HD3 . . 3.520 3.511 3.474 3.543 0.023 14 0 "[ . 1 .]" 1
2672 1 135 LEU HB3 1 137 ASP H . . 4.380 3.006 2.859 3.151 . 0 0 "[ . 1 .]" 1
2673 1 135 LEU HB3 1 138 GLY H . . 3.930 3.128 3.013 3.214 . 0 0 "[ . 1 .]" 1
2674 1 135 LEU HB3 1 138 GLY HA2 . . 4.660 3.968 3.797 4.136 . 0 0 "[ . 1 .]" 1
2675 1 135 LEU HB3 1 141 SER H . . 5.220 4.410 4.258 4.618 . 0 0 "[ . 1 .]" 1
2676 1 135 LEU HB3 1 141 SER QB . . 3.520 2.595 2.412 3.002 . 0 0 "[ . 1 .]" 1
2677 1 135 LEU MD1 1 136 PRO HD2 . . 4.070 3.703 3.642 3.777 . 0 0 "[ . 1 .]" 1
2678 1 135 LEU MD1 1 136 PRO HD3 . . 4.880 4.915 4.900 4.928 0.048 1 0 "[ . 1 .]" 1
2679 1 135 LEU MD1 1 137 ASP H . . 4.640 4.576 4.437 4.663 0.023 4 0 "[ . 1 .]" 1
2680 1 135 LEU MD1 1 138 GLY H . . 4.310 4.312 4.191 4.347 0.037 6 0 "[ . 1 .]" 1
2681 1 135 LEU MD1 1 138 GLY HA2 . . 4.450 3.882 3.682 4.161 . 0 0 "[ . 1 .]" 1
2682 1 135 LEU MD1 1 139 GLU HB3 . . 5.500 5.363 5.105 5.520 0.020 4 0 "[ . 1 .]" 1
2683 1 135 LEU MD1 1 141 SER H . . 4.180 3.825 3.735 3.922 . 0 0 "[ . 1 .]" 1
2684 1 135 LEU MD1 1 141 SER HA . . 5.330 4.683 4.470 4.859 . 0 0 "[ . 1 .]" 1
2685 1 135 LEU MD1 1 141 SER QB . . 3.120 2.116 2.006 2.201 . 0 0 "[ . 1 .]" 1
2686 1 135 LEU MD2 1 136 PRO HD2 . . 3.410 2.530 2.383 2.585 . 0 0 "[ . 1 .]" 1
2687 1 135 LEU MD2 1 136 PRO HD3 . . 3.230 3.125 3.022 3.178 . 0 0 "[ . 1 .]" 1
2688 1 135 LEU MD2 1 136 PRO HG2 . . 4.490 4.435 4.207 4.493 0.003 11 0 "[ . 1 .]" 1
2689 1 135 LEU MD2 1 136 PRO HG3 . . 4.440 4.435 4.280 4.463 0.023 11 0 "[ . 1 .]" 1
2690 1 135 LEU HG 1 141 SER QB . . 5.010 4.481 4.265 4.836 . 0 0 "[ . 1 .]" 1
2691 1 136 PRO HA 1 137 ASP HA . . 4.610 4.592 4.517 4.630 0.020 5 0 "[ . 1 .]" 1
2692 1 136 PRO HA 1 138 GLY H . . 4.400 4.089 3.860 4.242 . 0 0 "[ . 1 .]" 1
2693 1 136 PRO QB 1 137 ASP H . . 3.540 3.324 3.097 3.505 . 0 0 "[ . 1 .]" 1
2694 1 136 PRO HB2 1 137 ASP H . . 4.360 3.473 3.194 3.694 . 0 0 "[ . 1 .]" 1
2695 1 136 PRO HB3 1 137 ASP H . . 4.360 4.252 4.159 4.356 . 0 0 "[ . 1 .]" 1
2696 1 136 PRO HD2 1 137 ASP H . . 4.130 2.910 2.801 3.048 . 0 0 "[ . 1 .]" 1
2697 1 136 PRO HD3 1 137 ASP H . . 4.220 4.020 3.952 4.127 . 0 0 "[ . 1 .]" 1
2698 1 136 PRO HG2 1 138 GLY H . . 4.860 4.733 4.583 4.872 0.012 2 0 "[ . 1 .]" 1
2699 1 137 ASP H 1 137 ASP HB2 . . 3.490 2.528 2.427 2.662 . 0 0 "[ . 1 .]" 1
2700 1 137 ASP H 1 137 ASP HB3 . . 3.980 3.677 3.603 3.792 . 0 0 "[ . 1 .]" 1
2701 1 137 ASP H 1 141 SER QB . . 3.910 3.366 2.466 3.684 . 0 0 "[ . 1 .]" 1
2702 1 137 ASP HA 1 138 GLY H . . 3.260 3.186 3.141 3.272 0.012 9 0 "[ . 1 .]" 1
2703 1 137 ASP HA 1 138 GLY HA3 . . 4.490 4.508 4.456 4.550 0.060 9 0 "[ . 1 .]" 1
2704 1 137 ASP HB2 1 138 GLY H . . 4.130 4.012 3.768 4.104 . 0 0 "[ . 1 .]" 1
2705 1 137 ASP HB2 1 140 ARG H . . 4.770 4.638 4.373 4.802 0.032 3 0 "[ . 1 .]" 1
2706 1 137 ASP HB2 1 140 ARG HB2 . . 3.600 3.634 3.560 3.683 0.083 1 0 "[ . 1 .]" 1
2707 1 137 ASP HB2 1 141 SER H . . 3.940 3.226 2.894 3.507 . 0 0 "[ . 1 .]" 1
2708 1 137 ASP HB2 1 141 SER HA . . 3.830 2.723 2.376 3.229 . 0 0 "[ . 1 .]" 1
2709 1 137 ASP HB2 1 141 SER QB . . 3.950 3.334 2.208 3.745 . 0 0 "[ . 1 .]" 1
2710 1 137 ASP HB3 1 138 GLY H . . 4.550 4.351 4.279 4.426 . 0 0 "[ . 1 .]" 1
2711 1 137 ASP HB3 1 140 ARG H . . 4.130 3.809 3.557 4.049 . 0 0 "[ . 1 .]" 1
2712 1 137 ASP HB3 1 140 ARG HB2 . . 3.290 2.117 2.062 2.228 . 0 0 "[ . 1 .]" 1
2713 1 137 ASP HB3 1 140 ARG HB3 . . 3.880 3.365 3.099 3.776 . 0 0 "[ . 1 .]" 1
2714 1 137 ASP HB3 1 141 SER H . . 4.230 3.437 3.320 3.823 . 0 0 "[ . 1 .]" 1
2715 1 137 ASP HB3 1 141 SER QB . . 4.450 4.403 3.529 4.519 0.069 15 0 "[ . 1 .]" 1
2716 1 138 GLY H 1 138 GLY HA2 . . 2.920 2.326 2.293 2.359 . 0 0 "[ . 1 .]" 1
2717 1 138 GLY H 1 139 GLU H . . 4.630 4.655 4.609 4.676 0.046 10 0 "[ . 1 .]" 1
2718 1 138 GLY H 1 140 ARG H . . 4.820 4.657 4.569 4.817 . 0 0 "[ . 1 .]" 1
2719 1 138 GLY HA2 1 139 GLU H . . 3.400 3.058 2.923 3.147 . 0 0 "[ . 1 .]" 1
2720 1 138 GLY HA2 1 139 GLU HB3 . . 5.210 5.223 5.124 5.285 0.075 5 0 "[ . 1 .]" 1
2721 1 138 GLY HA2 1 140 ARG H . . 4.450 4.396 4.357 4.452 0.002 3 0 "[ . 1 .]" 1
2722 1 138 GLY HA3 1 139 GLU H . . 3.000 2.260 2.200 2.322 . 0 0 "[ . 1 .]" 1
2723 1 138 GLY HA3 1 139 GLU HB3 . . 5.150 4.803 4.734 4.897 . 0 0 "[ . 1 .]" 1
2724 1 138 GLY HA3 1 139 GLU HG2 . . 4.230 3.997 3.719 4.152 . 0 0 "[ . 1 .]" 1
2725 1 138 GLY HA3 1 139 GLU HG3 . . 5.500 4.998 3.792 5.385 . 0 0 "[ . 1 .]" 1
2726 1 138 GLY HA3 1 140 ARG H . . 3.570 3.336 3.246 3.422 . 0 0 "[ . 1 .]" 1
2727 1 139 GLU H 1 139 GLU HB2 . . 3.620 3.621 3.560 3.646 0.026 11 0 "[ . 1 .]" 1
2728 1 139 GLU H 1 139 GLU HB3 . . 3.410 2.568 2.464 2.727 . 0 0 "[ . 1 .]" 1
2729 1 139 GLU H 1 139 GLU HG2 . . 3.430 2.234 2.080 2.393 . 0 0 "[ . 1 .]" 1
2730 1 139 GLU H 1 139 GLU HG3 . . 3.900 3.268 2.410 3.712 . 0 0 "[ . 1 .]" 1
2731 1 139 GLU H 1 140 ARG H . . 3.500 2.751 2.534 2.890 . 0 0 "[ . 1 .]" 1
2732 1 139 GLU H 1 141 SER H . . 4.510 4.356 4.279 4.475 . 0 0 "[ . 1 .]" 1
2733 1 139 GLU HA 1 139 GLU HB3 . . 3.000 2.429 2.331 2.511 . 0 0 "[ . 1 .]" 1
2734 1 139 GLU HA 1 139 GLU HG2 . . 3.840 3.811 3.585 3.906 0.066 5 0 "[ . 1 .]" 1
2735 1 139 GLU HA 1 139 GLU HG3 . . 3.820 3.758 3.639 3.983 0.163 3 0 "[ . 1 .]" 1
2736 1 139 GLU HA 1 141 SER H . . 4.300 3.577 3.460 3.722 . 0 0 "[ . 1 .]" 1
2737 1 139 GLU HA 1 142 LEU H . . 4.290 3.653 3.403 3.831 . 0 0 "[ . 1 .]" 1
2738 1 139 GLU HA 1 142 LEU QB . . 3.910 3.740 3.418 3.938 0.028 9 0 "[ . 1 .]" 1
2739 1 139 GLU HA 1 142 LEU QD . . 3.510 2.520 2.307 2.758 . 0 0 "[ . 1 .]" 1
2740 1 139 GLU HA 1 142 LEU HG . . 5.060 4.418 3.988 5.089 0.029 11 0 "[ . 1 .]" 1
2741 1 139 GLU HB2 1 140 ARG H . . 4.440 4.077 3.897 4.175 . 0 0 "[ . 1 .]" 1
2742 1 139 GLU HB2 1 142 LEU QD . . 4.810 4.034 3.506 4.359 . 0 0 "[ . 1 .]" 1
2743 1 139 GLU HB2 1 143 TYR QE . . 4.390 2.796 2.462 3.170 . 0 0 "[ . 1 .]" 1
2744 1 139 GLU HB3 1 142 LEU QD . . 5.440 4.451 3.907 4.656 . 0 0 "[ . 1 .]" 1
2745 1 139 GLU HB3 1 143 TYR QE . . 4.420 4.366 4.115 4.499 0.079 5 0 "[ . 1 .]" 1
2746 1 139 GLU HG2 1 140 ARG H . . 3.790 3.141 2.227 3.802 0.012 5 0 "[ . 1 .]" 1
2747 1 139 GLU HG2 1 140 ARG QG . . 4.020 3.247 2.495 3.888 . 0 0 "[ . 1 .]" 1
2748 1 139 GLU HG2 1 143 TYR QE . . 4.630 4.482 4.131 4.711 0.081 5 0 "[ . 1 .]" 1
2749 1 139 GLU HG3 1 140 ARG H . . 3.470 2.873 2.271 3.516 0.046 3 0 "[ . 1 .]" 1
2750 1 139 GLU HG3 1 140 ARG HA . . 4.350 3.805 3.485 4.362 0.012 3 0 "[ . 1 .]" 1
2751 1 139 GLU HG3 1 140 ARG QG . . 3.910 2.643 2.303 3.255 . 0 0 "[ . 1 .]" 1
2752 1 139 GLU HG3 1 143 TYR QE . . 4.250 3.080 2.542 3.901 . 0 0 "[ . 1 .]" 1
2753 1 140 ARG H 1 140 ARG HB2 . . 3.110 2.690 2.530 2.876 . 0 0 "[ . 1 .]" 1
2754 1 140 ARG H 1 140 ARG HB3 . . 3.800 3.698 3.645 3.744 . 0 0 "[ . 1 .]" 1
2755 1 140 ARG H 1 140 ARG HG2 . . 3.650 3.337 2.696 3.594 . 0 0 "[ . 1 .]" 1
2756 1 140 ARG H 1 140 ARG QG . . 3.100 2.207 1.985 2.408 . 0 0 "[ . 1 .]" 1
2757 1 140 ARG H 1 140 ARG HG3 . . 3.650 2.241 2.012 2.447 . 0 0 "[ . 1 .]" 1
2758 1 140 ARG H 1 141 SER H . . 2.980 2.627 2.556 2.691 . 0 0 "[ . 1 .]" 1
2759 1 140 ARG H 1 142 LEU H . . 4.410 4.216 4.086 4.277 . 0 0 "[ . 1 .]" 1
2760 1 140 ARG H 1 143 TYR QE . . 5.500 4.768 4.545 5.069 . 0 0 "[ . 1 .]" 1
2761 1 140 ARG HA 1 140 ARG HG2 . . 3.650 2.643 2.411 2.890 . 0 0 "[ . 1 .]" 1
2762 1 140 ARG HA 1 140 ARG QG . . 3.140 2.532 2.333 2.704 . 0 0 "[ . 1 .]" 1
2763 1 140 ARG HA 1 140 ARG HG3 . . 3.650 3.265 3.037 3.588 . 0 0 "[ . 1 .]" 1
2764 1 140 ARG HA 1 142 LEU H . . 3.900 3.384 3.296 3.511 . 0 0 "[ . 1 .]" 1
2765 1 140 ARG HA 1 143 TYR H . . 3.600 2.810 2.612 3.058 . 0 0 "[ . 1 .]" 1
2766 1 140 ARG HA 1 143 TYR QD . . 4.320 3.471 2.843 3.738 . 0 0 "[ . 1 .]" 1
2767 1 140 ARG HB2 1 141 SER H . . 3.740 3.590 3.394 3.750 0.010 6 0 "[ . 1 .]" 1
2768 1 140 ARG HB3 1 140 ARG QD . . 3.690 2.500 2.262 2.982 . 0 0 "[ . 1 .]" 1
2769 1 140 ARG HB3 1 143 TYR H . . 5.360 4.594 4.271 4.790 . 0 0 "[ . 1 .]" 1
2770 1 140 ARG QG 1 141 SER H . . 4.270 4.284 4.107 4.364 0.094 1 0 "[ . 1 .]" 1
2771 1 141 SER H 1 141 SER QB . . 2.830 2.270 2.142 2.709 . 0 0 "[ . 1 .]" 1
2772 1 141 SER H 1 142 LEU H . . 3.060 2.508 2.425 2.593 . 0 0 "[ . 1 .]" 1
2773 1 141 SER H 1 142 LEU QB . . 4.440 4.446 4.370 4.477 0.037 11 0 "[ . 1 .]" 1
2774 1 141 SER H 1 142 LEU QD . . 4.340 3.474 3.359 3.726 . 0 0 "[ . 1 .]" 1
2775 1 141 SER H 1 143 TYR H . . 4.270 4.119 3.865 4.291 0.021 14 0 "[ . 1 .]" 1
2776 1 141 SER HA 1 142 LEU QD . . 5.440 4.313 4.233 4.495 . 0 0 "[ . 1 .]" 1
2777 1 141 SER HA 1 143 TYR H . . 4.490 4.232 4.045 4.486 . 0 0 "[ . 1 .]" 1
2778 1 141 SER QB 1 142 LEU H . . 3.720 3.120 2.995 3.274 . 0 0 "[ . 1 .]" 1
2779 1 141 SER QB 1 142 LEU MD1 . . 4.760 4.227 2.619 4.548 . 0 0 "[ . 1 .]" 1
2780 1 141 SER QB 1 142 LEU QD . . 3.690 2.674 2.544 2.803 . 0 0 "[ . 1 .]" 1
2781 1 141 SER QB 1 142 LEU MD2 . . 4.760 2.844 2.568 4.806 0.046 11 0 "[ . 1 .]" 1
2782 1 141 SER QB 1 142 LEU HG . . 5.450 5.323 3.897 5.507 0.057 4 0 "[ . 1 .]" 1
2783 1 142 LEU H 1 142 LEU QB . . 2.940 2.295 2.239 2.376 . 0 0 "[ . 1 .]" 1
2784 1 142 LEU H 1 142 LEU MD1 . . 4.640 3.861 2.475 4.047 . 0 0 "[ . 1 .]" 1
2785 1 142 LEU H 1 142 LEU QD . . 3.670 2.429 2.347 2.556 . 0 0 "[ . 1 .]" 1
2786 1 142 LEU H 1 142 LEU MD2 . . 4.640 2.574 2.366 4.328 . 0 0 "[ . 1 .]" 1
2787 1 142 LEU H 1 142 LEU HG . . 4.650 4.034 3.568 4.198 . 0 0 "[ . 1 .]" 1
2788 1 142 LEU H 1 143 TYR H . . 2.980 2.420 2.211 2.553 . 0 0 "[ . 1 .]" 1
2789 1 142 LEU HA 1 142 LEU MD1 . . 3.660 2.232 2.107 3.377 . 0 0 "[ . 1 .]" 1
2790 1 142 LEU HA 1 142 LEU QD . . 3.110 2.142 2.044 3.017 . 0 0 "[ . 1 .]" 1
2791 1 142 LEU HA 1 142 LEU MD2 . . 3.660 2.804 2.712 3.396 . 0 0 "[ . 1 .]" 1
2792 1 142 LEU HA 1 142 LEU HG . . 3.800 3.689 2.265 3.808 0.008 8 0 "[ . 1 .]" 1
2793 1 142 LEU QB 1 142 LEU QD . . 2.860 2.077 1.934 2.090 . 0 0 "[ . 1 .]" 1
2794 1 142 LEU QB 1 143 TYR H . . 3.650 3.011 2.779 3.135 . 0 0 "[ . 1 .]" 1
2795 1 142 LEU QB 1 143 TYR QD . . 3.690 2.477 2.305 2.931 . 0 0 "[ . 1 .]" 1
2796 1 142 LEU QB 1 143 TYR QE . . 4.560 3.645 2.915 4.287 . 0 0 "[ . 1 .]" 1
2797 1 142 LEU QD 1 143 TYR H . . 4.540 4.057 3.975 4.178 . 0 0 "[ . 1 .]" 1
2798 1 143 TYR H 1 144 ASP H . . 4.540 4.475 4.413 4.541 0.001 6 0 "[ . 1 .]" 1
2799 1 143 TYR HA 1 143 TYR QD . . 4.170 3.746 3.677 3.790 . 0 0 "[ . 1 .]" 1
2800 1 143 TYR HA 1 144 ASP H . . 3.030 2.191 2.096 2.376 . 0 0 "[ . 1 .]" 1
2801 1 143 TYR HA 1 144 ASP HB2 . . 4.260 4.200 4.015 4.311 0.051 5 0 "[ . 1 .]" 1
2802 1 143 TYR HB2 1 144 ASP H . . 3.370 2.805 2.513 3.084 . 0 0 "[ . 1 .]" 1
2803 1 143 TYR QD 1 144 ASP H . . 4.380 3.954 3.376 4.356 . 0 0 "[ . 1 .]" 1
2804 1 143 TYR QD 1 145 LEU H . . 3.970 2.478 2.119 2.719 . 0 0 "[ . 1 .]" 1
2805 1 143 TYR QD 1 145 LEU HB2 . . 4.140 2.599 2.226 2.787 . 0 0 "[ . 1 .]" 1
2806 1 143 TYR QD 1 145 LEU HB3 . . 4.860 2.509 2.134 4.439 . 0 0 "[ . 1 .]" 1
2807 1 143 TYR QD 1 145 LEU MD1 . . 5.220 3.959 2.104 4.272 . 0 0 "[ . 1 .]" 1
2808 1 143 TYR QD 1 145 LEU QD . . 3.860 3.704 2.100 3.947 0.087 5 0 "[ . 1 .]" 1
2809 1 143 TYR QD 1 145 LEU MD2 . . 5.220 4.573 4.012 4.702 . 0 0 "[ . 1 .]" 1
2810 1 143 TYR QD 1 145 LEU HG . . 4.190 4.028 2.507 4.200 0.010 13 0 "[ . 1 .]" 1
2811 1 143 TYR QE 1 145 LEU H . . 4.460 4.045 3.333 4.561 0.101 5 0 "[ . 1 .]" 1
2812 1 143 TYR QE 1 145 LEU HB2 . . 4.260 3.954 2.195 4.287 0.027 2 0 "[ . 1 .]" 1
2813 1 143 TYR QE 1 145 LEU HB3 . . 3.750 2.969 2.540 3.709 . 0 0 "[ . 1 .]" 1
2814 1 143 TYR QE 1 145 LEU MD1 . . 5.470 3.618 2.577 4.046 . 0 0 "[ . 1 .]" 1
2815 1 143 TYR QE 1 145 LEU QD . . 4.270 3.557 2.545 3.947 . 0 0 "[ . 1 .]" 1
2816 1 143 TYR QE 1 145 LEU MD2 . . 5.470 5.294 3.937 5.495 0.025 8 0 "[ . 1 .]" 1
2817 1 143 TYR QE 1 145 LEU HG . . 4.700 4.624 3.809 4.777 0.077 10 0 "[ . 1 .]" 1
2818 1 144 ASP H 1 144 ASP HB2 . . 3.350 2.550 2.121 2.876 . 0 0 "[ . 1 .]" 1
2819 1 144 ASP H 1 144 ASP HB3 . . 3.380 2.794 2.352 3.419 0.039 7 0 "[ . 1 .]" 1
2820 1 144 ASP HA 1 145 LEU H . . 2.620 2.328 2.047 2.568 . 0 0 "[ . 1 .]" 1
2821 1 144 ASP HA 1 145 LEU HA . . 4.510 4.466 4.321 4.547 0.037 4 0 "[ . 1 .]" 1
2822 1 144 ASP HA 1 145 LEU HB2 . . 4.670 4.571 4.395 4.710 0.040 5 0 "[ . 1 .]" 1
2823 1 144 ASP HA 1 145 LEU HB3 . . 5.500 5.150 4.699 5.620 0.120 9 0 "[ . 1 .]" 1
2824 1 144 ASP HA 1 145 LEU QD . . 4.990 5.104 4.313 5.280 0.290 11 0 "[ . 1 .]" 1
2825 1 144 ASP HB2 1 145 LEU H . . 4.680 4.616 4.372 4.712 0.032 1 0 "[ . 1 .]" 1
2826 1 144 ASP HB3 1 145 LEU H . . 4.300 4.352 4.131 4.428 0.128 15 0 "[ . 1 .]" 1
2827 1 145 LEU H 1 145 LEU HB2 . . 3.480 2.809 2.533 3.024 . 0 0 "[ . 1 .]" 1
2828 1 145 LEU H 1 145 LEU HB3 . . 3.660 2.935 2.678 3.646 . 0 0 "[ . 1 .]" 1
2829 1 145 LEU H 1 145 LEU QD . . 4.200 3.807 3.293 3.889 . 0 0 "[ . 1 .]" 1
2830 1 145 LEU H 1 145 LEU HG . . 4.830 4.734 3.584 4.922 0.092 3 0 "[ . 1 .]" 1
2831 1 145 LEU HA 1 145 LEU HB3 . . 2.870 2.919 2.442 2.986 0.116 6 0 "[ . 1 .]" 1
2832 1 145 LEU HA 1 145 LEU MD1 . . 3.270 3.031 2.526 3.472 0.202 9 0 "[ . 1 .]" 1
2833 1 145 LEU HA 1 145 LEU MD2 . . 3.270 2.182 2.054 3.278 0.008 10 0 "[ . 1 .]" 1
2834 1 145 LEU HA 1 145 LEU HG . . 3.840 3.553 2.150 3.720 . 0 0 "[ . 1 .]" 1
2835 1 145 LEU HB2 1 145 LEU QD . . 3.110 2.404 2.151 2.527 . 0 0 "[ . 1 .]" 1
2836 1 145 LEU HB3 1 145 LEU QD . . 3.070 2.246 2.023 2.321 . 0 0 "[ . 1 .]" 1
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