NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405289 |
1x5f   |
11119 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x5f
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 2587
_Distance_constraint_stats_list.Viol_count 1161
_Distance_constraint_stats_list.Viol_total 251.623
_Distance_constraint_stats_list.Viol_max 0.149
_Distance_constraint_stats_list.Viol_rms 0.0030
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0108
_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 8 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 THR 0.238 0.072 5 0 "[ . 1 . 2]"
1 14 THR 0.044 0.023 10 0 "[ . 1 . 2]"
1 15 GLY 0.044 0.023 10 0 "[ . 1 . 2]"
1 16 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 17 LEU 0.024 0.009 16 0 "[ . 1 . 2]"
1 18 PRO 0.072 0.009 14 0 "[ . 1 . 2]"
1 19 SER 0.041 0.010 14 0 "[ . 1 . 2]"
1 20 ALA 0.043 0.008 19 0 "[ . 1 . 2]"
1 21 PRO 0.091 0.012 20 0 "[ . 1 . 2]"
1 22 ARG 0.206 0.095 12 0 "[ . 1 . 2]"
1 23 ASP 0.166 0.095 12 0 "[ . 1 . 2]"
1 24 VAL 0.047 0.007 16 0 "[ . 1 . 2]"
1 25 VAL 0.161 0.026 13 0 "[ . 1 . 2]"
1 26 ALA 0.028 0.007 13 0 "[ . 1 . 2]"
1 27 SER 0.363 0.033 14 0 "[ . 1 . 2]"
1 28 LEU 0.391 0.049 16 0 "[ . 1 . 2]"
1 29 VAL 0.334 0.037 13 0 "[ . 1 . 2]"
1 30 SER 0.169 0.038 12 0 "[ . 1 . 2]"
1 31 THR 0.493 0.057 18 0 "[ . 1 . 2]"
1 32 ARG 0.175 0.072 5 0 "[ . 1 . 2]"
1 33 PHE 0.770 0.046 16 0 "[ . 1 . 2]"
1 34 ILE 0.740 0.037 13 0 "[ . 1 . 2]"
1 35 LYS 0.110 0.017 13 0 "[ . 1 . 2]"
1 36 LEU 0.531 0.033 14 0 "[ . 1 . 2]"
1 37 THR 0.522 0.050 20 0 "[ . 1 . 2]"
1 38 TRP 0.307 0.046 11 0 "[ . 1 . 2]"
1 39 ARG 0.297 0.068 11 0 "[ . 1 . 2]"
1 40 THR 0.175 0.066 11 0 "[ . 1 . 2]"
1 41 PRO 0.326 0.060 19 0 "[ . 1 . 2]"
1 42 ALA 0.056 0.010 3 0 "[ . 1 . 2]"
1 43 SER 0.021 0.006 16 0 "[ . 1 . 2]"
1 44 ASP 0.502 0.060 19 0 "[ . 1 . 2]"
1 45 PRO 0.135 0.028 5 0 "[ . 1 . 2]"
1 46 HIS 0.001 0.001 10 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ASP 0.079 0.026 20 0 "[ . 1 . 2]"
1 49 ASN 0.005 0.004 8 0 "[ . 1 . 2]"
1 50 LEU 0.303 0.026 20 0 "[ . 1 . 2]"
1 51 THR 0.114 0.016 14 0 "[ . 1 . 2]"
1 52 TYR 0.059 0.016 14 0 "[ . 1 . 2]"
1 53 SER 0.150 0.042 13 0 "[ . 1 . 2]"
1 54 VAL 0.131 0.019 13 0 "[ . 1 . 2]"
1 55 PHE 0.140 0.021 13 0 "[ . 1 . 2]"
1 56 TYR 0.134 0.016 7 0 "[ . 1 . 2]"
1 57 THR 0.102 0.028 2 0 "[ . 1 . 2]"
1 58 LYS 0.099 0.038 8 0 "[ . 1 . 2]"
1 59 GLU 0.233 0.063 12 0 "[ . 1 . 2]"
1 60 GLY 0.017 0.006 13 0 "[ . 1 . 2]"
1 61 ILE 0.266 0.067 15 0 "[ . 1 . 2]"
1 62 ALA 0.024 0.010 13 0 "[ . 1 . 2]"
1 63 ARG 0.681 0.099 13 0 "[ . 1 . 2]"
1 64 GLU 0.300 0.063 11 0 "[ . 1 . 2]"
1 65 ARG 0.169 0.069 4 0 "[ . 1 . 2]"
1 66 VAL 0.037 0.008 14 0 "[ . 1 . 2]"
1 67 GLU 0.009 0.005 16 0 "[ . 1 . 2]"
1 68 ASN 0.015 0.004 15 0 "[ . 1 . 2]"
1 69 THR 0.032 0.006 18 0 "[ . 1 . 2]"
1 70 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 HIS 0.016 0.007 13 0 "[ . 1 . 2]"
1 72 PRO 0.052 0.008 20 0 "[ . 1 . 2]"
1 73 GLY 0.152 0.015 20 0 "[ . 1 . 2]"
1 74 GLU 0.014 0.008 13 0 "[ . 1 . 2]"
1 75 MET 0.161 0.024 18 0 "[ . 1 . 2]"
1 76 GLN 0.578 0.050 20 0 "[ . 1 . 2]"
1 77 VAL 0.125 0.015 15 0 "[ . 1 . 2]"
1 78 THR 0.195 0.054 20 0 "[ . 1 . 2]"
1 79 ILE 0.384 0.054 20 0 "[ . 1 . 2]"
1 80 GLN 0.594 0.123 6 0 "[ . 1 . 2]"
1 81 ASN 0.366 0.123 6 0 "[ . 1 . 2]"
1 82 LEU 0.218 0.019 16 0 "[ . 1 . 2]"
1 83 MET 0.135 0.015 14 0 "[ . 1 . 2]"
1 84 PRO 0.129 0.015 20 0 "[ . 1 . 2]"
1 85 ALA 0.130 0.014 13 0 "[ . 1 . 2]"
1 86 THR 0.129 0.015 16 0 "[ . 1 . 2]"
1 87 VAL 0.718 0.149 19 0 "[ . 1 . 2]"
1 88 TYR 0.417 0.068 17 0 "[ . 1 . 2]"
1 89 ILE 0.462 0.068 17 0 "[ . 1 . 2]"
1 90 PHE 0.158 0.022 20 0 "[ . 1 . 2]"
1 91 ARG 0.042 0.016 13 0 "[ . 1 . 2]"
1 92 VAL 0.155 0.046 14 0 "[ . 1 . 2]"
1 93 MET 0.371 0.042 13 0 "[ . 1 . 2]"
1 94 ALA 0.067 0.013 19 0 "[ . 1 . 2]"
1 95 GLN 0.393 0.055 10 0 "[ . 1 . 2]"
1 96 ASN 0.138 0.018 10 0 "[ . 1 . 2]"
1 97 LYS 0.120 0.064 6 0 "[ . 1 . 2]"
1 98 HIS 0.015 0.007 5 0 "[ . 1 . 2]"
1 99 GLY 0.379 0.055 10 0 "[ . 1 . 2]"
1 100 SER 0.146 0.058 10 0 "[ . 1 . 2]"
1 101 GLY 0.212 0.058 10 0 "[ . 1 . 2]"
1 102 GLU 0.196 0.028 14 0 "[ . 1 . 2]"
1 103 SER 0.323 0.046 14 0 "[ . 1 . 2]"
1 104 SER 0.293 0.040 14 0 "[ . 1 . 2]"
1 105 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 PRO 0.003 0.003 16 0 "[ . 1 . 2]"
1 107 LEU 0.108 0.017 9 0 "[ . 1 . 2]"
1 108 ARG 0.023 0.011 16 0 "[ . 1 . 2]"
1 109 VAL 0.063 0.007 14 0 "[ . 1 . 2]"
1 110 GLU 0.004 0.004 19 0 "[ . 1 . 2]"
1 111 THR 2.135 0.082 8 0 "[ . 1 . 2]"
1 112 GLN 1.552 0.082 8 0 "[ . 1 . 2]"
1 113 PRO 0.042 0.008 17 0 "[ . 1 . 2]"
1 114 GLU 0.195 0.050 8 0 "[ . 1 . 2]"
1 115 SER 0.024 0.015 8 0 "[ . 1 . 2]"
1 116 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 GLU QG 1 9 HIS H . . 4.980 3.944 1.978 4.820 . 0 0 "[ . 1 . 2]" 1
2 1 10 ALA HA 1 11 PRO HD2 . . 3.330 2.135 1.920 2.572 . 0 0 "[ . 1 . 2]" 1
3 1 10 ALA HA 1 11 PRO HD3 . . 3.330 2.409 2.254 2.785 . 0 0 "[ . 1 . 2]" 1
4 1 10 ALA MB 1 11 PRO HD2 . . 4.360 2.791 1.942 3.657 . 0 0 "[ . 1 . 2]" 1
5 1 10 ALA MB 1 11 PRO QD . . 3.670 2.698 1.922 3.432 . 0 0 "[ . 1 . 2]" 1
6 1 10 ALA MB 1 11 PRO HD3 . . 4.360 3.717 3.076 4.158 . 0 0 "[ . 1 . 2]" 1
7 1 11 PRO HA 1 12 ALA H . . 3.470 2.506 2.151 3.391 . 0 0 "[ . 1 . 2]" 1
8 1 12 ALA HA 1 13 THR H . . 3.560 2.533 2.144 3.548 . 0 0 "[ . 1 . 2]" 1
9 1 12 ALA MB 1 13 THR H . . 4.760 3.020 2.244 3.719 . 0 0 "[ . 1 . 2]" 1
10 1 13 THR H 1 13 THR HB . . 3.540 3.153 2.586 3.612 0.072 5 0 "[ . 1 . 2]" 1
11 1 13 THR HA 1 13 THR MG . . 3.620 2.535 2.098 3.205 . 0 0 "[ . 1 . 2]" 1
12 1 13 THR HB 1 14 THR H . . 4.780 3.817 2.757 4.413 . 0 0 "[ . 1 . 2]" 1
13 1 13 THR MG 1 14 THR H . . 4.780 3.430 1.891 4.378 . 0 0 "[ . 1 . 2]" 1
14 1 14 THR H 1 15 GLY H . . 4.550 4.111 2.136 4.553 0.003 13 0 "[ . 1 . 2]" 1
15 1 14 THR HA 1 14 THR MG . . 3.350 2.511 2.148 3.207 . 0 0 "[ . 1 . 2]" 1
16 1 14 THR HA 1 15 GLY H . . 3.250 2.341 2.146 3.273 0.023 10 0 "[ . 1 . 2]" 1
17 1 14 THR HB 1 15 GLY H . . 4.260 3.602 2.111 4.277 0.017 10 0 "[ . 1 . 2]" 1
18 1 14 THR MG 1 15 GLY H . . 4.370 3.669 1.955 4.318 . 0 0 "[ . 1 . 2]" 1
19 1 15 GLY H 1 16 PRO HD2 . . 4.940 4.461 3.803 4.846 . 0 0 "[ . 1 . 2]" 1
20 1 15 GLY H 1 16 PRO HD3 . . 5.340 4.928 4.462 5.121 . 0 0 "[ . 1 . 2]" 1
21 1 15 GLY QA 1 16 PRO HB3 . . 5.110 4.590 4.579 4.595 . 0 0 "[ . 1 . 2]" 1
22 1 15 GLY QA 1 16 PRO HD3 . . 3.120 2.446 2.283 2.508 . 0 0 "[ . 1 . 2]" 1
23 1 15 GLY QA 1 16 PRO QG . . 4.070 3.671 3.643 3.700 . 0 0 "[ . 1 . 2]" 1
24 1 15 GLY HA2 1 16 PRO HD2 . . 3.480 2.986 2.444 3.454 . 0 0 "[ . 1 . 2]" 1
25 1 15 GLY HA2 1 16 PRO HD3 . . 3.620 2.730 2.316 3.225 . 0 0 "[ . 1 . 2]" 1
26 1 15 GLY HA3 1 16 PRO HD2 . . 3.480 2.134 1.917 2.583 . 0 0 "[ . 1 . 2]" 1
27 1 15 GLY HA3 1 16 PRO HD3 . . 3.620 2.933 2.459 3.461 . 0 0 "[ . 1 . 2]" 1
28 1 16 PRO HA 1 17 LEU H . . 2.660 2.313 2.213 2.576 . 0 0 "[ . 1 . 2]" 1
29 1 16 PRO HA 1 17 LEU HB2 . . 4.700 4.373 4.251 4.510 . 0 0 "[ . 1 . 2]" 1
30 1 16 PRO HA 1 17 LEU MD1 . . 5.100 4.852 4.644 5.039 . 0 0 "[ . 1 . 2]" 1
31 1 16 PRO HA 1 17 LEU MD2 . . 5.500 5.090 4.789 5.403 . 0 0 "[ . 1 . 2]" 1
32 1 16 PRO HA 1 17 LEU HG . . 4.360 4.031 3.873 4.291 . 0 0 "[ . 1 . 2]" 1
33 1 16 PRO HB2 1 17 LEU H . . 3.750 2.868 2.208 3.188 . 0 0 "[ . 1 . 2]" 1
34 1 16 PRO HB2 1 17 LEU HA . . 5.410 4.353 4.206 4.503 . 0 0 "[ . 1 . 2]" 1
35 1 16 PRO HB2 1 98 HIS HD2 . . 5.500 5.274 5.001 5.486 . 0 0 "[ . 1 . 2]" 1
36 1 16 PRO HB3 1 17 LEU H . . 3.780 3.595 3.265 3.778 . 0 0 "[ . 1 . 2]" 1
37 1 16 PRO HD2 1 98 HIS HD2 . . 5.460 5.099 4.675 5.399 . 0 0 "[ . 1 . 2]" 1
38 1 16 PRO HD2 1 98 HIS HE1 . . 5.200 4.511 3.566 5.156 . 0 0 "[ . 1 . 2]" 1
39 1 16 PRO QG 1 17 LEU H . . 5.000 4.323 3.866 4.507 . 0 0 "[ . 1 . 2]" 1
40 1 17 LEU H 1 17 LEU HB2 . . 3.540 2.449 2.315 2.562 . 0 0 "[ . 1 . 2]" 1
41 1 17 LEU H 1 17 LEU HB3 . . 3.710 3.653 3.573 3.707 . 0 0 "[ . 1 . 2]" 1
42 1 17 LEU H 1 17 LEU MD1 . . 4.130 3.908 3.589 4.105 . 0 0 "[ . 1 . 2]" 1
43 1 17 LEU H 1 17 LEU MD2 . . 4.260 4.150 3.869 4.264 0.004 20 0 "[ . 1 . 2]" 1
44 1 17 LEU H 1 17 LEU HG . . 3.740 3.255 2.856 3.489 . 0 0 "[ . 1 . 2]" 1
45 1 17 LEU H 1 18 PRO HD2 . . 4.970 4.811 4.784 4.828 . 0 0 "[ . 1 . 2]" 1
46 1 17 LEU H 1 18 PRO HD3 . . 5.100 5.004 4.959 5.067 . 0 0 "[ . 1 . 2]" 1
47 1 17 LEU HA 1 17 LEU MD1 . . 3.960 3.860 3.832 3.883 . 0 0 "[ . 1 . 2]" 1
48 1 17 LEU HA 1 17 LEU MD2 . . 3.120 2.153 1.986 2.385 . 0 0 "[ . 1 . 2]" 1
49 1 17 LEU HA 1 18 PRO HD2 . . 3.400 2.396 2.323 2.452 . 0 0 "[ . 1 . 2]" 1
50 1 17 LEU HA 1 18 PRO HD3 . . 3.310 2.299 2.275 2.322 . 0 0 "[ . 1 . 2]" 1
51 1 17 LEU HA 1 96 ASN HD22 . . 4.090 3.193 3.078 3.295 . 0 0 "[ . 1 . 2]" 1
52 1 17 LEU HA 1 101 GLY HA3 . . 5.110 4.721 4.459 4.892 . 0 0 "[ . 1 . 2]" 1
53 1 17 LEU HB2 1 17 LEU MD1 . . 3.220 2.219 2.073 2.364 . 0 0 "[ . 1 . 2]" 1
54 1 17 LEU HB2 1 17 LEU MD2 . . 3.290 3.173 3.152 3.187 . 0 0 "[ . 1 . 2]" 1
55 1 17 LEU HB2 1 18 PRO HD2 . . 3.890 3.694 3.632 3.873 . 0 0 "[ . 1 . 2]" 1
56 1 17 LEU HB2 1 18 PRO HD3 . . 4.860 4.741 4.704 4.851 . 0 0 "[ . 1 . 2]" 1
57 1 17 LEU HB2 1 101 GLY HA2 . . 4.230 3.242 3.116 3.413 . 0 0 "[ . 1 . 2]" 1
58 1 17 LEU HB2 1 101 GLY HA3 . . 4.370 4.156 3.983 4.373 0.003 10 0 "[ . 1 . 2]" 1
59 1 17 LEU HB3 1 17 LEU MD1 . . 3.170 2.486 2.299 2.627 . 0 0 "[ . 1 . 2]" 1
60 1 17 LEU HB3 1 18 PRO HD2 . . 4.330 2.106 2.020 2.387 . 0 0 "[ . 1 . 2]" 1
61 1 17 LEU HB3 1 18 PRO HD3 . . 4.710 3.535 3.463 3.764 . 0 0 "[ . 1 . 2]" 1
62 1 17 LEU HB3 1 96 ASN HD22 . . 4.940 4.610 4.343 4.878 . 0 0 "[ . 1 . 2]" 1
63 1 17 LEU HB3 1 101 GLY HA2 . . 4.200 2.027 1.997 2.079 . 0 0 "[ . 1 . 2]" 1
64 1 17 LEU HB3 1 101 GLY HA3 . . 4.790 2.664 2.456 2.871 . 0 0 "[ . 1 . 2]" 1
65 1 17 LEU MD1 1 18 PRO HD2 . . 4.390 3.873 3.711 3.933 . 0 0 "[ . 1 . 2]" 1
66 1 17 LEU MD1 1 18 PRO HD3 . . 5.110 5.071 4.955 5.109 . 0 0 "[ . 1 . 2]" 1
67 1 17 LEU MD1 1 98 HIS QB . . 4.930 4.275 4.042 4.467 . 0 0 "[ . 1 . 2]" 1
68 1 17 LEU MD1 1 99 GLY H . . 5.500 5.206 4.894 5.461 . 0 0 "[ . 1 . 2]" 1
69 1 17 LEU MD1 1 100 SER QB . . 5.340 4.761 4.260 5.065 . 0 0 "[ . 1 . 2]" 1
70 1 17 LEU MD1 1 101 GLY H . . 4.710 4.425 4.271 4.679 . 0 0 "[ . 1 . 2]" 1
71 1 17 LEU MD1 1 101 GLY HA2 . . 3.830 2.203 1.977 2.695 . 0 0 "[ . 1 . 2]" 1
72 1 17 LEU MD1 1 101 GLY HA3 . . 4.400 3.759 3.561 4.172 . 0 0 "[ . 1 . 2]" 1
73 1 17 LEU MD2 1 18 PRO HD2 . . 3.930 2.062 1.922 2.260 . 0 0 "[ . 1 . 2]" 1
74 1 17 LEU MD2 1 18 PRO HD3 . . 3.670 2.830 2.588 3.028 . 0 0 "[ . 1 . 2]" 1
75 1 17 LEU MD2 1 96 ASN H . . 4.720 4.292 4.150 4.543 . 0 0 "[ . 1 . 2]" 1
76 1 17 LEU MD2 1 96 ASN HD22 . . 4.580 2.676 2.294 2.990 . 0 0 "[ . 1 . 2]" 1
77 1 17 LEU MD2 1 98 HIS HB2 . . 3.530 2.414 2.153 2.787 . 0 0 "[ . 1 . 2]" 1
78 1 17 LEU MD2 1 98 HIS HB3 . . 3.530 2.393 2.071 2.821 . 0 0 "[ . 1 . 2]" 1
79 1 17 LEU MD2 1 98 HIS HD2 . . 4.910 3.439 3.031 3.984 . 0 0 "[ . 1 . 2]" 1
80 1 17 LEU MD2 1 99 GLY H . . 3.540 2.947 2.749 3.150 . 0 0 "[ . 1 . 2]" 1
81 1 17 LEU MD2 1 99 GLY HA2 . . 4.530 4.367 4.251 4.485 . 0 0 "[ . 1 . 2]" 1
82 1 17 LEU MD2 1 99 GLY HA3 . . 3.400 3.378 3.329 3.402 0.002 7 0 "[ . 1 . 2]" 1
83 1 17 LEU MD2 1 100 SER H . . 3.690 3.549 2.969 3.699 0.009 16 0 "[ . 1 . 2]" 1
84 1 17 LEU MD2 1 100 SER HA . . 4.660 4.101 3.752 4.480 . 0 0 "[ . 1 . 2]" 1
85 1 17 LEU MD2 1 101 GLY H . . 4.700 3.617 3.093 4.135 . 0 0 "[ . 1 . 2]" 1
86 1 17 LEU MD2 1 101 GLY HA2 . . 4.880 2.593 1.994 3.109 . 0 0 "[ . 1 . 2]" 1
87 1 18 PRO HA 1 19 SER H . . 2.970 2.624 2.395 2.718 . 0 0 "[ . 1 . 2]" 1
88 1 18 PRO HA 1 43 SER H . . 5.500 5.308 5.119 5.501 0.001 18 0 "[ . 1 . 2]" 1
89 1 18 PRO HA 1 43 SER HB2 . . 4.570 3.058 2.480 3.488 . 0 0 "[ . 1 . 2]" 1
90 1 18 PRO HA 1 43 SER HB3 . . 4.570 3.122 2.598 3.584 . 0 0 "[ . 1 . 2]" 1
91 1 18 PRO HA 1 50 LEU MD2 . . 5.230 4.943 4.591 5.173 . 0 0 "[ . 1 . 2]" 1
92 1 18 PRO HA 1 101 GLY HA3 . . 5.500 5.046 4.881 5.180 . 0 0 "[ . 1 . 2]" 1
93 1 18 PRO HB2 1 19 SER H . . 3.940 2.106 1.911 2.625 . 0 0 "[ . 1 . 2]" 1
94 1 18 PRO HB2 1 50 LEU MD2 . . 4.280 3.592 3.268 3.769 . 0 0 "[ . 1 . 2]" 1
95 1 18 PRO HB2 1 94 ALA MB . . 3.360 2.846 2.574 3.003 . 0 0 "[ . 1 . 2]" 1
96 1 18 PRO HB2 1 101 GLY H . . 5.500 5.286 5.055 5.432 . 0 0 "[ . 1 . 2]" 1
97 1 18 PRO HB2 1 101 GLY HA3 . . 4.590 4.280 4.021 4.418 . 0 0 "[ . 1 . 2]" 1
98 1 18 PRO HB3 1 19 SER H . . 3.750 3.226 3.149 3.460 . 0 0 "[ . 1 . 2]" 1
99 1 18 PRO HB3 1 94 ALA MB . . 3.960 3.857 3.482 3.969 0.009 14 0 "[ . 1 . 2]" 1
100 1 18 PRO HD2 1 94 ALA MB . . 5.200 5.009 4.764 5.189 . 0 0 "[ . 1 . 2]" 1
101 1 18 PRO HD2 1 96 ASN HD22 . . 4.630 2.868 2.634 3.029 . 0 0 "[ . 1 . 2]" 1
102 1 18 PRO HD2 1 100 SER HA . . 5.170 5.102 4.741 5.178 0.008 15 0 "[ . 1 . 2]" 1
103 1 18 PRO HD2 1 101 GLY H . . 3.870 3.708 3.473 3.866 . 0 0 "[ . 1 . 2]" 1
104 1 18 PRO HD2 1 101 GLY HA2 . . 4.140 3.066 2.919 3.113 . 0 0 "[ . 1 . 2]" 1
105 1 18 PRO HD2 1 101 GLY HA3 . . 4.120 2.772 2.566 2.903 . 0 0 "[ . 1 . 2]" 1
106 1 18 PRO HD2 1 102 GLU H . . 5.060 4.759 4.485 5.021 . 0 0 "[ . 1 . 2]" 1
107 1 18 PRO HD3 1 50 LEU MD2 . . 5.360 4.668 4.435 4.853 . 0 0 "[ . 1 . 2]" 1
108 1 18 PRO HD3 1 96 ASN H . . 4.590 4.313 4.124 4.482 . 0 0 "[ . 1 . 2]" 1
109 1 18 PRO HD3 1 96 ASN HD21 . . 4.390 2.472 2.300 2.690 . 0 0 "[ . 1 . 2]" 1
110 1 18 PRO HD3 1 96 ASN HD22 . . 4.270 1.916 1.897 1.999 . 0 0 "[ . 1 . 2]" 1
111 1 18 PRO HD3 1 101 GLY H . . 5.380 5.171 4.922 5.306 . 0 0 "[ . 1 . 2]" 1
112 1 18 PRO HD3 1 101 GLY HA2 . . 4.870 4.829 4.687 4.874 0.004 20 0 "[ . 1 . 2]" 1
113 1 18 PRO HD3 1 101 GLY HA3 . . 4.480 4.383 4.208 4.482 0.002 3 0 "[ . 1 . 2]" 1
114 1 18 PRO HG2 1 50 LEU MD2 . . 4.630 4.397 4.135 4.571 . 0 0 "[ . 1 . 2]" 1
115 1 18 PRO HG2 1 94 ALA MB . . 3.460 3.035 2.842 3.202 . 0 0 "[ . 1 . 2]" 1
116 1 18 PRO HG2 1 95 GLN HA . . 4.380 4.013 3.854 4.169 . 0 0 "[ . 1 . 2]" 1
117 1 18 PRO HG2 1 96 ASN H . . 4.780 4.397 4.155 4.509 . 0 0 "[ . 1 . 2]" 1
118 1 18 PRO HG2 1 96 ASN HB3 . . 4.920 4.823 4.630 4.926 0.006 14 0 "[ . 1 . 2]" 1
119 1 18 PRO HG2 1 96 ASN HD21 . . 4.000 3.323 3.190 3.477 . 0 0 "[ . 1 . 2]" 1
120 1 18 PRO HG2 1 96 ASN HD22 . . 4.940 4.135 3.927 4.363 . 0 0 "[ . 1 . 2]" 1
121 1 18 PRO HG2 1 101 GLY H . . 4.720 3.144 2.890 3.260 . 0 0 "[ . 1 . 2]" 1
122 1 18 PRO HG2 1 101 GLY HA2 . . 4.900 3.900 3.663 4.031 . 0 0 "[ . 1 . 2]" 1
123 1 18 PRO HG2 1 101 GLY HA3 . . 4.320 2.516 2.373 2.597 . 0 0 "[ . 1 . 2]" 1
124 1 18 PRO HG2 1 102 GLU H . . 4.320 3.893 3.686 4.031 . 0 0 "[ . 1 . 2]" 1
125 1 18 PRO HG3 1 50 LEU QB . . 4.690 3.957 3.764 4.113 . 0 0 "[ . 1 . 2]" 1
126 1 18 PRO HG3 1 50 LEU MD1 . . 5.260 4.853 4.667 5.031 . 0 0 "[ . 1 . 2]" 1
127 1 18 PRO HG3 1 50 LEU MD2 . . 4.030 3.211 2.959 3.403 . 0 0 "[ . 1 . 2]" 1
128 1 18 PRO HG3 1 94 ALA MB . . 3.660 3.238 2.857 3.396 . 0 0 "[ . 1 . 2]" 1
129 1 18 PRO HG3 1 95 GLN H . . 5.080 4.757 4.447 4.948 . 0 0 "[ . 1 . 2]" 1
130 1 18 PRO HG3 1 96 ASN H . . 3.430 3.341 3.101 3.437 0.007 18 0 "[ . 1 . 2]" 1
131 1 18 PRO HG3 1 96 ASN HD21 . . 3.950 1.954 1.899 2.075 . 0 0 "[ . 1 . 2]" 1
132 1 18 PRO HG3 1 96 ASN HD22 . . 4.990 3.050 2.836 3.252 . 0 0 "[ . 1 . 2]" 1
133 1 18 PRO HG3 1 99 GLY H . . 5.030 4.824 4.686 5.012 . 0 0 "[ . 1 . 2]" 1
134 1 18 PRO HG3 1 101 GLY H . . 4.490 4.323 4.074 4.471 . 0 0 "[ . 1 . 2]" 1
135 1 18 PRO HG3 1 101 GLY HA2 . . 5.420 5.220 5.058 5.319 . 0 0 "[ . 1 . 2]" 1
136 1 18 PRO HG3 1 101 GLY HA3 . . 4.210 4.144 4.025 4.214 0.004 5 0 "[ . 1 . 2]" 1
137 1 19 SER H 1 19 SER HB2 . . 3.950 2.960 2.575 3.833 . 0 0 "[ . 1 . 2]" 1
138 1 19 SER H 1 19 SER QB . . 3.420 2.573 2.385 2.771 . 0 0 "[ . 1 . 2]" 1
139 1 19 SER H 1 19 SER HB3 . . 3.950 3.030 2.473 3.850 . 0 0 "[ . 1 . 2]" 1
140 1 19 SER H 1 20 ALA H . . 4.480 4.407 4.320 4.477 . 0 0 "[ . 1 . 2]" 1
141 1 19 SER H 1 41 PRO HB2 . . 3.870 3.280 3.118 3.394 . 0 0 "[ . 1 . 2]" 1
142 1 19 SER H 1 41 PRO HB3 . . 4.260 4.189 4.026 4.266 0.006 20 0 "[ . 1 . 2]" 1
143 1 19 SER H 1 43 SER H . . 4.030 3.807 3.583 4.017 . 0 0 "[ . 1 . 2]" 1
144 1 19 SER H 1 43 SER HA . . 5.360 5.120 4.918 5.360 0.000 3 0 "[ . 1 . 2]" 1
145 1 19 SER H 1 43 SER HB2 . . 3.740 3.202 2.200 3.745 0.005 2 0 "[ . 1 . 2]" 1
146 1 19 SER H 1 43 SER QB . . 3.260 2.437 1.962 2.977 . 0 0 "[ . 1 . 2]" 1
147 1 19 SER H 1 43 SER HB3 . . 3.740 2.755 1.979 3.643 . 0 0 "[ . 1 . 2]" 1
148 1 19 SER H 1 43 SER HG . . 3.980 2.993 1.897 3.885 . 0 0 "[ . 1 . 2]" 1
149 1 19 SER H 1 44 ASP H . . 4.910 4.310 4.008 4.522 . 0 0 "[ . 1 . 2]" 1
150 1 19 SER H 1 94 ALA MB . . 4.900 3.965 3.689 4.306 . 0 0 "[ . 1 . 2]" 1
151 1 19 SER HA 1 20 ALA H . . 2.740 2.214 2.151 2.350 . 0 0 "[ . 1 . 2]" 1
152 1 19 SER HA 1 20 ALA MB . . 4.110 3.994 3.952 4.034 . 0 0 "[ . 1 . 2]" 1
153 1 19 SER HA 1 43 SER QB . . 5.340 4.482 3.888 4.829 . 0 0 "[ . 1 . 2]" 1
154 1 19 SER HA 1 102 GLU H . . 3.790 2.996 2.467 3.269 . 0 0 "[ . 1 . 2]" 1
155 1 19 SER HA 1 102 GLU HA . . 5.500 5.057 4.747 5.409 . 0 0 "[ . 1 . 2]" 1
156 1 19 SER HA 1 102 GLU HB2 . . 3.730 3.370 3.137 3.740 0.010 14 0 "[ . 1 . 2]" 1
157 1 19 SER HA 1 102 GLU HB3 . . 3.710 2.539 2.283 2.924 . 0 0 "[ . 1 . 2]" 1
158 1 19 SER HA 1 102 GLU QG . . 4.520 4.369 4.018 4.521 0.001 14 0 "[ . 1 . 2]" 1
159 1 19 SER QB 1 20 ALA H . . 3.850 3.382 2.877 3.748 . 0 0 "[ . 1 . 2]" 1
160 1 19 SER QB 1 42 ALA MB . . 4.030 3.466 3.164 3.834 . 0 0 "[ . 1 . 2]" 1
161 1 19 SER QB 1 43 SER H . . 3.760 2.801 2.254 3.417 . 0 0 "[ . 1 . 2]" 1
162 1 19 SER QB 1 43 SER HA . . 4.850 4.539 4.050 4.789 . 0 0 "[ . 1 . 2]" 1
163 1 19 SER HB2 1 20 ALA H . . 4.430 4.071 2.932 4.351 . 0 0 "[ . 1 . 2]" 1
164 1 19 SER HB3 1 20 ALA H . . 4.430 3.700 3.044 4.253 . 0 0 "[ . 1 . 2]" 1
165 1 20 ALA H 1 20 ALA MB . . 2.830 2.066 2.024 2.153 . 0 0 "[ . 1 . 2]" 1
166 1 20 ALA H 1 102 GLU H . . 4.730 3.292 2.971 3.897 . 0 0 "[ . 1 . 2]" 1
167 1 20 ALA H 1 102 GLU HB2 . . 3.830 3.658 3.578 3.835 0.005 14 0 "[ . 1 . 2]" 1
168 1 20 ALA H 1 102 GLU HB3 . . 3.800 1.980 1.897 2.204 . 0 0 "[ . 1 . 2]" 1
169 1 20 ALA H 1 102 GLU QG . . 4.520 3.405 3.080 3.659 . 0 0 "[ . 1 . 2]" 1
170 1 20 ALA HA 1 21 PRO HD2 . . 3.680 2.396 2.350 2.460 . 0 0 "[ . 1 . 2]" 1
171 1 20 ALA HA 1 21 PRO HD3 . . 3.980 2.298 2.282 2.324 . 0 0 "[ . 1 . 2]" 1
172 1 20 ALA HA 1 94 ALA MB . . 4.110 3.065 2.866 3.358 . 0 0 "[ . 1 . 2]" 1
173 1 20 ALA HA 1 102 GLU H . . 4.630 4.397 4.126 4.585 . 0 0 "[ . 1 . 2]" 1
174 1 20 ALA HA 1 102 GLU HB3 . . 5.500 4.301 4.114 4.412 . 0 0 "[ . 1 . 2]" 1
175 1 20 ALA MB 1 21 PRO HA . . 5.110 4.418 4.392 4.459 . 0 0 "[ . 1 . 2]" 1
176 1 20 ALA MB 1 21 PRO HD2 . . 3.660 2.134 1.984 2.289 . 0 0 "[ . 1 . 2]" 1
177 1 20 ALA MB 1 21 PRO HD3 . . 4.530 3.255 3.151 3.339 . 0 0 "[ . 1 . 2]" 1
178 1 20 ALA MB 1 21 PRO HG2 . . 4.610 3.816 3.747 3.880 . 0 0 "[ . 1 . 2]" 1
179 1 20 ALA MB 1 21 PRO HG3 . . 5.030 4.473 4.375 4.556 . 0 0 "[ . 1 . 2]" 1
180 1 20 ALA MB 1 102 GLU H . . 4.630 4.085 3.967 4.232 . 0 0 "[ . 1 . 2]" 1
181 1 20 ALA MB 1 102 GLU HA . . 5.440 4.390 4.316 4.500 . 0 0 "[ . 1 . 2]" 1
182 1 20 ALA MB 1 102 GLU HB2 . . 4.310 4.303 4.245 4.318 0.008 19 0 "[ . 1 . 2]" 1
183 1 20 ALA MB 1 102 GLU HB3 . . 3.710 2.820 2.700 2.932 . 0 0 "[ . 1 . 2]" 1
184 1 20 ALA MB 1 102 GLU QG . . 3.610 2.778 2.342 3.149 . 0 0 "[ . 1 . 2]" 1
185 1 20 ALA MB 1 103 SER H . . 4.100 3.917 3.741 4.037 . 0 0 "[ . 1 . 2]" 1
186 1 20 ALA MB 1 104 SER H . . 3.920 1.961 1.871 2.346 . 0 0 "[ . 1 . 2]" 1
187 1 20 ALA MB 1 104 SER HA . . 3.060 2.082 2.017 2.226 . 0 0 "[ . 1 . 2]" 1
188 1 20 ALA MB 1 104 SER QB . . 3.540 2.072 1.923 2.375 . 0 0 "[ . 1 . 2]" 1
189 1 20 ALA MB 1 104 SER HG . . 4.820 4.112 3.623 4.512 . 0 0 "[ . 1 . 2]" 1
190 1 20 ALA MB 1 105 ALA H . . 4.240 3.996 3.889 4.172 . 0 0 "[ . 1 . 2]" 1
191 1 21 PRO HA 1 22 ARG H . . 2.870 2.400 2.289 2.467 . 0 0 "[ . 1 . 2]" 1
192 1 21 PRO HA 1 22 ARG HA . . 4.460 4.418 4.391 4.444 . 0 0 "[ . 1 . 2]" 1
193 1 21 PRO HA 1 22 ARG QG . . 4.190 3.202 3.039 4.105 . 0 0 "[ . 1 . 2]" 1
194 1 21 PRO HA 1 24 VAL MG2 . . 5.250 4.807 4.636 4.925 . 0 0 "[ . 1 . 2]" 1
195 1 21 PRO HA 1 38 TRP HD1 . . 4.610 4.331 3.955 4.566 . 0 0 "[ . 1 . 2]" 1
196 1 21 PRO HA 1 39 ARG H . . 5.500 5.326 5.013 5.506 0.006 11 0 "[ . 1 . 2]" 1
197 1 21 PRO HA 1 41 PRO HA . . 3.790 2.453 2.242 2.600 . 0 0 "[ . 1 . 2]" 1
198 1 21 PRO HA 1 41 PRO HB3 . . 4.580 2.419 2.207 2.675 . 0 0 "[ . 1 . 2]" 1
199 1 21 PRO HA 1 42 ALA H . . 4.570 4.493 4.213 4.578 0.008 16 0 "[ . 1 . 2]" 1
200 1 21 PRO HB2 1 22 ARG H . . 3.800 2.619 2.452 2.922 . 0 0 "[ . 1 . 2]" 1
201 1 21 PRO HB2 1 24 VAL MG2 . . 3.850 3.187 2.902 3.309 . 0 0 "[ . 1 . 2]" 1
202 1 21 PRO HB2 1 38 TRP HB2 . . 4.890 2.403 2.184 2.503 . 0 0 "[ . 1 . 2]" 1
203 1 21 PRO HB2 1 38 TRP HD1 . . 4.030 2.386 2.188 2.545 . 0 0 "[ . 1 . 2]" 1
204 1 21 PRO HB2 1 39 ARG H . . 4.630 3.668 3.573 3.730 . 0 0 "[ . 1 . 2]" 1
205 1 21 PRO HB2 1 92 VAL MG1 . . 4.390 3.651 3.387 4.006 . 0 0 "[ . 1 . 2]" 1
206 1 21 PRO HB3 1 22 ARG H . . 3.730 3.458 3.374 3.621 . 0 0 "[ . 1 . 2]" 1
207 1 21 PRO HB3 1 24 VAL MG2 . . 4.670 4.542 4.214 4.668 . 0 0 "[ . 1 . 2]" 1
208 1 21 PRO HB3 1 38 TRP HB2 . . 4.570 3.951 3.741 4.077 . 0 0 "[ . 1 . 2]" 1
209 1 21 PRO HB3 1 38 TRP HD1 . . 3.780 2.539 2.190 2.764 . 0 0 "[ . 1 . 2]" 1
210 1 21 PRO HB3 1 39 ARG H . . 4.980 4.930 4.765 4.984 0.004 11 0 "[ . 1 . 2]" 1
211 1 21 PRO HB3 1 92 VAL HB . . 5.040 4.872 4.673 5.047 0.007 14 0 "[ . 1 . 2]" 1
212 1 21 PRO HB3 1 92 VAL MG1 . . 4.110 3.781 3.596 3.999 . 0 0 "[ . 1 . 2]" 1
213 1 21 PRO HD2 1 92 VAL HB . . 4.230 3.139 2.905 3.550 . 0 0 "[ . 1 . 2]" 1
214 1 21 PRO HD2 1 92 VAL MG1 . . 4.680 3.447 3.233 3.658 . 0 0 "[ . 1 . 2]" 1
215 1 21 PRO HD2 1 94 ALA H . . 4.640 3.848 3.680 4.016 . 0 0 "[ . 1 . 2]" 1
216 1 21 PRO HD2 1 94 ALA MB . . 4.860 4.236 4.027 4.627 . 0 0 "[ . 1 . 2]" 1
217 1 21 PRO HD2 1 104 SER H . . 3.860 3.201 2.870 3.434 . 0 0 "[ . 1 . 2]" 1
218 1 21 PRO HD2 1 104 SER HB2 . . 4.840 3.633 2.331 4.313 . 0 0 "[ . 1 . 2]" 1
219 1 21 PRO HD2 1 104 SER QB . . 4.070 2.234 2.017 2.562 . 0 0 "[ . 1 . 2]" 1
220 1 21 PRO HD2 1 104 SER HB3 . . 4.840 2.372 2.027 3.514 . 0 0 "[ . 1 . 2]" 1
221 1 21 PRO HD3 1 50 LEU MD1 . . 5.500 5.439 5.310 5.503 0.003 15 0 "[ . 1 . 2]" 1
222 1 21 PRO HD3 1 92 VAL MG1 . . 4.770 3.433 3.033 3.690 . 0 0 "[ . 1 . 2]" 1
223 1 21 PRO HD3 1 94 ALA H . . 4.290 3.016 2.778 3.200 . 0 0 "[ . 1 . 2]" 1
224 1 21 PRO HD3 1 94 ALA MB . . 4.390 2.855 2.585 3.259 . 0 0 "[ . 1 . 2]" 1
225 1 21 PRO HD3 1 104 SER H . . 5.160 4.677 4.447 4.924 . 0 0 "[ . 1 . 2]" 1
226 1 21 PRO HG2 1 24 VAL MG2 . . 4.230 2.648 2.315 2.789 . 0 0 "[ . 1 . 2]" 1
227 1 21 PRO HG2 1 38 TRP HD1 . . 5.280 4.126 3.907 4.305 . 0 0 "[ . 1 . 2]" 1
228 1 21 PRO HG2 1 38 TRP HE3 . . 5.500 5.334 5.241 5.495 . 0 0 "[ . 1 . 2]" 1
229 1 21 PRO HG2 1 92 VAL HB . . 3.650 2.137 1.997 2.298 . 0 0 "[ . 1 . 2]" 1
230 1 21 PRO HG2 1 92 VAL MG2 . . 4.730 3.464 3.341 3.757 . 0 0 "[ . 1 . 2]" 1
231 1 21 PRO HG2 1 104 SER H . . 5.050 4.821 4.307 5.018 . 0 0 "[ . 1 . 2]" 1
232 1 21 PRO HG2 1 104 SER QB . . 4.920 2.862 2.623 3.027 . 0 0 "[ . 1 . 2]" 1
233 1 21 PRO HG3 1 38 TRP HD1 . . 4.650 3.549 3.239 3.722 . 0 0 "[ . 1 . 2]" 1
234 1 21 PRO HG3 1 38 TRP HE1 . . 4.400 3.502 3.300 3.642 . 0 0 "[ . 1 . 2]" 1
235 1 21 PRO HG3 1 38 TRP HZ2 . . 4.800 4.776 4.637 4.812 0.012 20 0 "[ . 1 . 2]" 1
236 1 21 PRO HG3 1 52 TYR HD1 . . 4.860 3.125 2.800 3.378 . 0 0 "[ . 1 . 2]" 1
237 1 21 PRO HG3 1 92 VAL MG1 . . 3.290 1.975 1.831 2.201 . 0 0 "[ . 1 . 2]" 1
238 1 21 PRO HG3 1 92 VAL MG2 . . 4.540 3.960 3.643 4.236 . 0 0 "[ . 1 . 2]" 1
239 1 21 PRO HG3 1 93 MET H . . 4.500 4.161 3.954 4.501 0.001 11 0 "[ . 1 . 2]" 1
240 1 21 PRO HG3 1 94 ALA H . . 5.000 4.910 4.744 4.996 . 0 0 "[ . 1 . 2]" 1
241 1 22 ARG H 1 22 ARG HB2 . . 3.870 2.827 2.637 2.977 . 0 0 "[ . 1 . 2]" 1
242 1 22 ARG H 1 22 ARG HB3 . . 3.870 3.777 3.732 3.814 . 0 0 "[ . 1 . 2]" 1
243 1 22 ARG H 1 22 ARG HD2 . . 5.060 4.443 3.259 4.896 . 0 0 "[ . 1 . 2]" 1
244 1 22 ARG H 1 22 ARG QD . . 4.450 3.890 1.885 4.387 . 0 0 "[ . 1 . 2]" 1
245 1 22 ARG H 1 22 ARG HD3 . . 5.060 4.477 1.893 5.039 . 0 0 "[ . 1 . 2]" 1
246 1 22 ARG H 1 22 ARG HE . . 4.950 3.849 3.185 4.944 . 0 0 "[ . 1 . 2]" 1
247 1 22 ARG H 1 22 ARG QG . . 3.460 2.441 2.155 3.341 . 0 0 "[ . 1 . 2]" 1
248 1 22 ARG H 1 23 ASP H . . 4.640 4.435 4.385 4.490 . 0 0 "[ . 1 . 2]" 1
249 1 22 ARG H 1 24 VAL MG2 . . 4.500 4.082 3.967 4.222 . 0 0 "[ . 1 . 2]" 1
250 1 22 ARG H 1 38 TRP HA . . 5.500 5.443 5.322 5.501 0.001 15 0 "[ . 1 . 2]" 1
251 1 22 ARG H 1 38 TRP HB2 . . 4.390 3.708 3.596 3.803 . 0 0 "[ . 1 . 2]" 1
252 1 22 ARG H 1 38 TRP HB3 . . 5.500 5.387 5.270 5.492 . 0 0 "[ . 1 . 2]" 1
253 1 22 ARG H 1 38 TRP HD1 . . 4.660 4.105 3.882 4.343 . 0 0 "[ . 1 . 2]" 1
254 1 22 ARG H 1 39 ARG H . . 3.650 3.389 3.280 3.557 . 0 0 "[ . 1 . 2]" 1
255 1 22 ARG H 1 40 THR H . . 5.290 4.950 4.813 5.170 . 0 0 "[ . 1 . 2]" 1
256 1 22 ARG H 1 41 PRO HA . . 4.900 3.425 3.271 3.686 . 0 0 "[ . 1 . 2]" 1
257 1 22 ARG HA 1 22 ARG HE . . 5.040 3.361 1.931 5.064 0.024 12 0 "[ . 1 . 2]" 1
258 1 22 ARG HA 1 22 ARG HG2 . . 4.140 3.099 2.779 3.725 . 0 0 "[ . 1 . 2]" 1
259 1 22 ARG HA 1 22 ARG QG . . 3.290 2.859 2.431 3.205 . 0 0 "[ . 1 . 2]" 1
260 1 22 ARG HA 1 22 ARG HG3 . . 4.140 3.593 2.471 3.953 . 0 0 "[ . 1 . 2]" 1
261 1 22 ARG HA 1 23 ASP H . . 2.960 2.592 2.463 2.668 . 0 0 "[ . 1 . 2]" 1
262 1 22 ARG HA 1 23 ASP HA . . 4.720 4.610 4.529 4.652 . 0 0 "[ . 1 . 2]" 1
263 1 22 ARG QB 1 23 ASP H . . 3.300 2.182 1.958 2.369 . 0 0 "[ . 1 . 2]" 1
264 1 22 ARG QB 1 23 ASP HA . . 4.720 4.061 3.950 4.210 . 0 0 "[ . 1 . 2]" 1
265 1 22 ARG QB 1 23 ASP QB . . 4.560 3.356 3.136 3.681 . 0 0 "[ . 1 . 2]" 1
266 1 22 ARG QB 1 39 ARG H . . 4.710 4.058 3.909 4.239 . 0 0 "[ . 1 . 2]" 1
267 1 22 ARG HB2 1 22 ARG HE . . 4.180 3.504 2.385 4.167 . 0 0 "[ . 1 . 2]" 1
268 1 22 ARG HB2 1 23 ASP H . . 4.000 2.931 2.633 3.201 . 0 0 "[ . 1 . 2]" 1
269 1 22 ARG HB3 1 22 ARG HE . . 4.180 3.232 1.906 4.084 . 0 0 "[ . 1 . 2]" 1
270 1 22 ARG HB3 1 23 ASP H . . 4.000 2.258 1.983 2.441 . 0 0 "[ . 1 . 2]" 1
271 1 22 ARG QD 1 23 ASP H . . 4.730 4.349 4.062 4.825 0.095 12 0 "[ . 1 . 2]" 1
272 1 22 ARG QD 1 42 ALA H . . 4.110 3.121 2.155 3.433 . 0 0 "[ . 1 . 2]" 1
273 1 22 ARG QD 1 42 ALA HA . . 5.110 4.595 3.822 5.109 . 0 0 "[ . 1 . 2]" 1
274 1 22 ARG QD 1 42 ALA MB . . 3.410 3.102 2.625 3.413 0.003 2 0 "[ . 1 . 2]" 1
275 1 22 ARG HD2 1 42 ALA H . . 4.990 3.673 2.180 4.927 . 0 0 "[ . 1 . 2]" 1
276 1 22 ARG HD3 1 42 ALA H . . 4.990 4.197 2.746 4.994 0.004 3 0 "[ . 1 . 2]" 1
277 1 22 ARG HE 1 41 PRO HA . . 5.500 4.252 2.684 5.505 0.005 16 0 "[ . 1 . 2]" 1
278 1 22 ARG HE 1 42 ALA H . . 5.400 4.606 2.808 5.405 0.005 13 0 "[ . 1 . 2]" 1
279 1 22 ARG QG 1 23 ASP H . . 4.400 4.131 3.761 4.342 . 0 0 "[ . 1 . 2]" 1
280 1 22 ARG QG 1 42 ALA H . . 4.000 3.283 2.897 3.996 . 0 0 "[ . 1 . 2]" 1
281 1 22 ARG QG 1 42 ALA HA . . 5.340 4.711 4.189 5.340 . 0 0 "[ . 1 . 2]" 1
282 1 22 ARG QG 1 42 ALA MB . . 4.340 3.787 3.488 4.180 . 0 0 "[ . 1 . 2]" 1
283 1 22 ARG HG2 1 23 ASP H . . 5.050 4.598 4.181 4.924 . 0 0 "[ . 1 . 2]" 1
284 1 22 ARG HG2 1 42 ALA MB . . 4.970 4.425 4.192 4.852 . 0 0 "[ . 1 . 2]" 1
285 1 22 ARG HG3 1 23 ASP H . . 5.050 4.695 4.191 4.892 . 0 0 "[ . 1 . 2]" 1
286 1 22 ARG HG3 1 42 ALA MB . . 4.970 4.141 3.731 4.708 . 0 0 "[ . 1 . 2]" 1
287 1 23 ASP H 1 23 ASP HA . . 2.830 2.281 2.276 2.288 . 0 0 "[ . 1 . 2]" 1
288 1 23 ASP H 1 23 ASP HB2 . . 4.130 3.251 2.980 3.546 . 0 0 "[ . 1 . 2]" 1
289 1 23 ASP H 1 23 ASP HB3 . . 4.130 3.879 3.446 4.077 . 0 0 "[ . 1 . 2]" 1
290 1 23 ASP H 1 24 VAL H . . 3.290 2.830 2.761 2.929 . 0 0 "[ . 1 . 2]" 1
291 1 23 ASP H 1 24 VAL HB . . 5.190 5.129 5.021 5.188 . 0 0 "[ . 1 . 2]" 1
292 1 23 ASP H 1 24 VAL MG2 . . 4.590 4.054 3.951 4.170 . 0 0 "[ . 1 . 2]" 1
293 1 23 ASP HA 1 24 VAL H . . 2.950 2.793 2.654 2.891 . 0 0 "[ . 1 . 2]" 1
294 1 23 ASP HA 1 24 VAL HB . . 5.400 5.083 4.986 5.170 . 0 0 "[ . 1 . 2]" 1
295 1 23 ASP HA 1 24 VAL MG2 . . 4.750 4.630 4.510 4.723 . 0 0 "[ . 1 . 2]" 1
296 1 23 ASP HA 1 25 VAL MG1 . . 3.870 3.398 3.256 3.581 . 0 0 "[ . 1 . 2]" 1
297 1 23 ASP HA 1 39 ARG H . . 5.500 4.894 4.715 5.024 . 0 0 "[ . 1 . 2]" 1
298 1 23 ASP QB 1 24 VAL H . . 4.140 3.870 3.804 3.906 . 0 0 "[ . 1 . 2]" 1
299 1 23 ASP QB 1 39 ARG H . . 4.040 2.426 2.182 2.717 . 0 0 "[ . 1 . 2]" 1
300 1 23 ASP QB 1 39 ARG QB . . 3.860 2.461 2.033 2.697 . 0 0 "[ . 1 . 2]" 1
301 1 23 ASP QB 1 39 ARG QD . . 3.770 3.010 1.959 3.730 . 0 0 "[ . 1 . 2]" 1
302 1 23 ASP QB 1 39 ARG QG . . 3.570 2.252 1.812 2.990 . 0 0 "[ . 1 . 2]" 1
303 1 23 ASP HB2 1 24 VAL H . . 4.770 4.396 4.188 4.616 . 0 0 "[ . 1 . 2]" 1
304 1 23 ASP HB2 1 25 VAL MG1 . . 5.500 4.820 4.574 4.991 . 0 0 "[ . 1 . 2]" 1
305 1 23 ASP HB2 1 25 VAL MG2 . . 5.500 5.335 4.963 5.509 0.009 2 0 "[ . 1 . 2]" 1
306 1 23 ASP HB2 1 39 ARG H . . 4.720 2.977 2.357 3.899 . 0 0 "[ . 1 . 2]" 1
307 1 23 ASP HB2 1 39 ARG QD . . 4.390 3.238 1.995 4.219 . 0 0 "[ . 1 . 2]" 1
308 1 23 ASP HB3 1 24 VAL H . . 4.770 4.321 4.140 4.480 . 0 0 "[ . 1 . 2]" 1
309 1 23 ASP HB3 1 25 VAL MG1 . . 5.500 3.954 3.375 4.816 . 0 0 "[ . 1 . 2]" 1
310 1 23 ASP HB3 1 25 VAL MG2 . . 5.500 4.339 3.816 4.944 . 0 0 "[ . 1 . 2]" 1
311 1 23 ASP HB3 1 39 ARG H . . 4.720 3.305 2.193 4.237 . 0 0 "[ . 1 . 2]" 1
312 1 23 ASP HB3 1 39 ARG QD . . 4.390 3.690 2.581 4.389 . 0 0 "[ . 1 . 2]" 1
313 1 24 VAL H 1 24 VAL HB . . 2.880 2.471 2.405 2.531 . 0 0 "[ . 1 . 2]" 1
314 1 24 VAL H 1 24 VAL MG1 . . 3.950 3.759 3.742 3.766 . 0 0 "[ . 1 . 2]" 1
315 1 24 VAL H 1 24 VAL MG2 . . 2.760 2.393 2.211 2.581 . 0 0 "[ . 1 . 2]" 1
316 1 24 VAL H 1 25 VAL H . . 4.470 4.339 4.287 4.430 . 0 0 "[ . 1 . 2]" 1
317 1 24 VAL H 1 25 VAL MG1 . . 4.090 3.808 3.691 3.900 . 0 0 "[ . 1 . 2]" 1
318 1 24 VAL H 1 38 TRP HA . . 4.860 4.498 4.301 4.689 . 0 0 "[ . 1 . 2]" 1
319 1 24 VAL H 1 38 TRP HB2 . . 4.960 4.288 4.061 4.443 . 0 0 "[ . 1 . 2]" 1
320 1 24 VAL H 1 38 TRP HB3 . . 4.510 4.386 4.221 4.517 0.007 16 0 "[ . 1 . 2]" 1
321 1 24 VAL HA 1 24 VAL MG1 . . 3.290 2.396 2.330 2.486 . 0 0 "[ . 1 . 2]" 1
322 1 24 VAL HA 1 24 VAL MG2 . . 3.360 2.267 2.210 2.399 . 0 0 "[ . 1 . 2]" 1
323 1 24 VAL HA 1 25 VAL H . . 2.740 2.166 2.141 2.186 . 0 0 "[ . 1 . 2]" 1
324 1 24 VAL HA 1 25 VAL HA . . 4.660 4.380 4.373 4.390 . 0 0 "[ . 1 . 2]" 1
325 1 24 VAL HA 1 25 VAL MG1 . . 4.210 3.751 3.580 3.888 . 0 0 "[ . 1 . 2]" 1
326 1 24 VAL HA 1 25 VAL MG2 . . 4.570 4.040 3.905 4.188 . 0 0 "[ . 1 . 2]" 1
327 1 24 VAL HA 1 38 TRP HA . . 4.000 2.929 2.714 3.018 . 0 0 "[ . 1 . 2]" 1
328 1 24 VAL HA 1 38 TRP HB2 . . 4.600 3.139 3.047 3.219 . 0 0 "[ . 1 . 2]" 1
329 1 24 VAL HA 1 38 TRP HB3 . . 4.010 2.132 2.032 2.207 . 0 0 "[ . 1 . 2]" 1
330 1 24 VAL HA 1 38 TRP HE3 . . 4.240 3.784 3.685 3.925 . 0 0 "[ . 1 . 2]" 1
331 1 24 VAL HA 1 39 ARG H . . 4.720 4.444 4.253 4.539 . 0 0 "[ . 1 . 2]" 1
332 1 24 VAL HB 1 25 VAL H . . 4.570 4.414 4.334 4.466 . 0 0 "[ . 1 . 2]" 1
333 1 24 VAL HB 1 36 LEU MD1 . . 5.500 5.219 5.064 5.422 . 0 0 "[ . 1 . 2]" 1
334 1 24 VAL HB 1 92 VAL MG2 . . 4.240 4.041 3.854 4.180 . 0 0 "[ . 1 . 2]" 1
335 1 24 VAL HB 1 107 LEU MD1 . . 4.580 4.300 3.988 4.510 . 0 0 "[ . 1 . 2]" 1
336 1 24 VAL HB 1 107 LEU MD2 . . 4.030 3.983 3.870 4.035 0.005 20 0 "[ . 1 . 2]" 1
337 1 24 VAL MG1 1 25 VAL H . . 3.210 3.025 2.765 3.212 0.002 15 0 "[ . 1 . 2]" 1
338 1 24 VAL MG1 1 36 LEU MD1 . . 2.930 2.692 2.490 2.917 . 0 0 "[ . 1 . 2]" 1
339 1 24 VAL MG1 1 36 LEU HG . . 4.560 4.441 4.216 4.558 . 0 0 "[ . 1 . 2]" 1
340 1 24 VAL MG1 1 37 THR H . . 4.550 4.194 3.973 4.417 . 0 0 "[ . 1 . 2]" 1
341 1 24 VAL MG1 1 38 TRP HA . . 4.800 4.740 4.456 4.804 0.004 15 0 "[ . 1 . 2]" 1
342 1 24 VAL MG1 1 38 TRP HB2 . . 4.570 4.363 4.037 4.513 . 0 0 "[ . 1 . 2]" 1
343 1 24 VAL MG1 1 38 TRP HB3 . . 3.940 3.226 2.797 3.433 . 0 0 "[ . 1 . 2]" 1
344 1 24 VAL MG1 1 38 TRP HE3 . . 3.630 3.360 3.006 3.587 . 0 0 "[ . 1 . 2]" 1
345 1 24 VAL MG1 1 90 PHE HB3 . . 5.090 4.532 4.421 4.652 . 0 0 "[ . 1 . 2]" 1
346 1 24 VAL MG1 1 92 VAL MG1 . . 4.170 3.921 3.797 4.165 . 0 0 "[ . 1 . 2]" 1
347 1 24 VAL MG1 1 92 VAL MG2 . . 3.010 1.865 1.757 2.051 . 0 0 "[ . 1 . 2]" 1
348 1 24 VAL MG1 1 104 SER HG . . 4.680 3.348 2.621 4.327 . 0 0 "[ . 1 . 2]" 1
349 1 24 VAL MG1 1 107 LEU H . . 4.430 4.132 3.854 4.354 . 0 0 "[ . 1 . 2]" 1
350 1 24 VAL MG1 1 107 LEU HB2 . . 3.900 2.540 2.091 2.960 . 0 0 "[ . 1 . 2]" 1
351 1 24 VAL MG1 1 107 LEU HB3 . . 4.150 3.222 2.890 3.483 . 0 0 "[ . 1 . 2]" 1
352 1 24 VAL MG1 1 107 LEU MD2 . . 2.850 2.121 1.965 2.418 . 0 0 "[ . 1 . 2]" 1
353 1 24 VAL MG2 1 25 VAL H . . 4.180 4.121 4.039 4.178 . 0 0 "[ . 1 . 2]" 1
354 1 24 VAL MG2 1 36 LEU MD1 . . 4.960 4.615 4.380 4.852 . 0 0 "[ . 1 . 2]" 1
355 1 24 VAL MG2 1 38 TRP H . . 5.500 5.356 5.042 5.504 0.004 13 0 "[ . 1 . 2]" 1
356 1 24 VAL MG2 1 38 TRP HA . . 4.210 3.871 3.639 4.074 . 0 0 "[ . 1 . 2]" 1
357 1 24 VAL MG2 1 38 TRP HB2 . . 3.570 2.507 2.196 2.765 . 0 0 "[ . 1 . 2]" 1
358 1 24 VAL MG2 1 38 TRP HB3 . . 3.440 2.413 2.064 2.650 . 0 0 "[ . 1 . 2]" 1
359 1 24 VAL MG2 1 38 TRP HD1 . . 4.720 4.525 4.201 4.645 . 0 0 "[ . 1 . 2]" 1
360 1 24 VAL MG2 1 38 TRP HE3 . . 4.260 3.966 3.776 4.133 . 0 0 "[ . 1 . 2]" 1
361 1 24 VAL MG2 1 39 ARG H . . 4.220 4.123 3.936 4.224 0.004 7 0 "[ . 1 . 2]" 1
362 1 24 VAL MG2 1 92 VAL H . . 4.060 3.533 3.359 3.764 . 0 0 "[ . 1 . 2]" 1
363 1 24 VAL MG2 1 92 VAL HB . . 3.940 2.573 2.247 2.838 . 0 0 "[ . 1 . 2]" 1
364 1 24 VAL MG2 1 92 VAL MG1 . . 3.980 3.438 3.236 3.573 . 0 0 "[ . 1 . 2]" 1
365 1 24 VAL MG2 1 92 VAL MG2 . . 3.320 2.289 1.950 2.556 . 0 0 "[ . 1 . 2]" 1
366 1 24 VAL MG2 1 104 SER H . . 5.090 4.956 4.618 5.084 . 0 0 "[ . 1 . 2]" 1
367 1 24 VAL MG2 1 104 SER HB2 . . 3.690 2.597 2.160 3.075 . 0 0 "[ . 1 . 2]" 1
368 1 24 VAL MG2 1 104 SER HB3 . . 3.690 3.128 2.884 3.315 . 0 0 "[ . 1 . 2]" 1
369 1 24 VAL MG2 1 104 SER HG . . 3.810 2.931 2.063 3.804 . 0 0 "[ . 1 . 2]" 1
370 1 24 VAL MG2 1 105 ALA H . . 4.490 3.944 3.689 4.192 . 0 0 "[ . 1 . 2]" 1
371 1 25 VAL H 1 25 VAL HB . . 4.040 3.915 3.871 3.970 . 0 0 "[ . 1 . 2]" 1
372 1 25 VAL H 1 25 VAL MG2 . . 3.320 2.405 2.220 2.549 . 0 0 "[ . 1 . 2]" 1
373 1 25 VAL H 1 26 ALA H . . 4.640 4.418 4.394 4.438 . 0 0 "[ . 1 . 2]" 1
374 1 25 VAL H 1 27 SER H . . 5.500 5.425 5.366 5.490 . 0 0 "[ . 1 . 2]" 1
375 1 25 VAL H 1 36 LEU HA . . 5.000 4.962 4.841 5.010 0.010 3 0 "[ . 1 . 2]" 1
376 1 25 VAL H 1 36 LEU MD1 . . 4.420 3.681 3.495 3.807 . 0 0 "[ . 1 . 2]" 1
377 1 25 VAL H 1 37 THR H . . 3.470 3.118 3.001 3.179 . 0 0 "[ . 1 . 2]" 1
378 1 25 VAL H 1 37 THR MG . . 5.500 5.282 5.195 5.467 . 0 0 "[ . 1 . 2]" 1
379 1 25 VAL H 1 38 TRP HA . . 3.750 3.426 3.348 3.588 . 0 0 "[ . 1 . 2]" 1
380 1 25 VAL H 1 38 TRP HB2 . . 4.850 4.786 4.711 4.853 0.003 7 0 "[ . 1 . 2]" 1
381 1 25 VAL H 1 38 TRP HB3 . . 3.930 3.505 3.429 3.602 . 0 0 "[ . 1 . 2]" 1
382 1 25 VAL H 1 38 TRP HE3 . . 4.740 4.175 4.079 4.308 . 0 0 "[ . 1 . 2]" 1
383 1 25 VAL HA 1 25 VAL MG1 . . 3.310 2.420 2.336 2.501 . 0 0 "[ . 1 . 2]" 1
384 1 25 VAL HA 1 26 ALA H . . 2.540 2.491 2.370 2.540 . 16 0 "[ . 1 . 2]" 1
385 1 25 VAL HA 1 26 ALA HA . . 4.690 4.388 4.358 4.408 . 0 0 "[ . 1 . 2]" 1
386 1 25 VAL HA 1 26 ALA MB . . 4.100 3.907 3.882 3.961 . 0 0 "[ . 1 . 2]" 1
387 1 25 VAL HA 1 107 LEU MD1 . . 3.680 3.154 2.895 3.484 . 0 0 "[ . 1 . 2]" 1
388 1 25 VAL HA 1 107 LEU MD2 . . 3.480 2.325 2.149 2.519 . 0 0 "[ . 1 . 2]" 1
389 1 25 VAL HB 1 26 ALA H . . 3.000 2.263 2.175 2.477 . 0 0 "[ . 1 . 2]" 1
390 1 25 VAL HB 1 26 ALA MB . . 4.310 4.212 4.137 4.312 0.002 14 0 "[ . 1 . 2]" 1
391 1 25 VAL HB 1 27 SER HA . . 5.450 5.326 5.133 5.452 0.002 8 0 "[ . 1 . 2]" 1
392 1 25 VAL HB 1 37 THR H . . 5.500 5.459 5.379 5.510 0.010 18 0 "[ . 1 . 2]" 1
393 1 25 VAL MG2 1 26 ALA H . . 3.370 2.993 2.763 3.353 . 0 0 "[ . 1 . 2]" 1
394 1 25 VAL MG2 1 26 ALA HA . . 4.500 3.683 3.511 3.906 . 0 0 "[ . 1 . 2]" 1
395 1 25 VAL MG2 1 27 SER H . . 3.910 3.419 3.293 3.529 . 0 0 "[ . 1 . 2]" 1
396 1 25 VAL MG2 1 27 SER HA . . 3.810 3.577 3.491 3.697 . 0 0 "[ . 1 . 2]" 1
397 1 25 VAL MG2 1 27 SER HB2 . . 4.100 4.091 4.032 4.126 0.026 13 0 "[ . 1 . 2]" 1
398 1 25 VAL MG2 1 27 SER HB3 . . 5.030 4.925 4.861 5.002 . 0 0 "[ . 1 . 2]" 1
399 1 25 VAL MG2 1 36 LEU HA . . 4.820 4.583 4.428 4.725 . 0 0 "[ . 1 . 2]" 1
400 1 25 VAL MG2 1 37 THR H . . 3.760 3.478 3.364 3.567 . 0 0 "[ . 1 . 2]" 1
401 1 25 VAL MG2 1 37 THR HB . . 4.310 3.585 3.355 3.947 . 0 0 "[ . 1 . 2]" 1
402 1 25 VAL MG2 1 38 TRP HA . . 4.750 3.858 3.771 4.007 . 0 0 "[ . 1 . 2]" 1
403 1 26 ALA H 1 26 ALA MB . . 2.850 2.255 2.177 2.310 . 0 0 "[ . 1 . 2]" 1
404 1 26 ALA H 1 36 LEU HA . . 4.820 4.743 4.692 4.793 . 0 0 "[ . 1 . 2]" 1
405 1 26 ALA H 1 36 LEU MD1 . . 4.260 3.863 3.720 3.994 . 0 0 "[ . 1 . 2]" 1
406 1 26 ALA H 1 107 LEU MD1 . . 4.520 4.197 3.993 4.501 . 0 0 "[ . 1 . 2]" 1
407 1 26 ALA H 1 107 LEU MD2 . . 3.590 3.024 2.802 3.253 . 0 0 "[ . 1 . 2]" 1
408 1 26 ALA HA 1 27 SER H . . 2.830 2.173 2.165 2.185 . 0 0 "[ . 1 . 2]" 1
409 1 26 ALA HA 1 27 SER HA . . 4.670 4.447 4.436 4.461 . 0 0 "[ . 1 . 2]" 1
410 1 26 ALA HA 1 27 SER HB2 . . 5.120 4.903 4.826 4.954 . 0 0 "[ . 1 . 2]" 1
411 1 26 ALA HA 1 27 SER HB3 . . 4.540 4.375 4.341 4.437 . 0 0 "[ . 1 . 2]" 1
412 1 26 ALA HA 1 28 LEU H . . 3.570 3.502 3.394 3.577 0.007 1 0 "[ . 1 . 2]" 1
413 1 26 ALA HA 1 29 VAL MG2 . . 4.930 4.736 4.679 4.817 . 0 0 "[ . 1 . 2]" 1
414 1 26 ALA HA 1 34 ILE MG . . 4.190 3.775 3.689 3.867 . 0 0 "[ . 1 . 2]" 1
415 1 26 ALA HA 1 36 LEU HA . . 3.400 2.015 1.993 2.066 . 0 0 "[ . 1 . 2]" 1
416 1 26 ALA HA 1 36 LEU HB2 . . 5.290 4.920 4.878 4.959 . 0 0 "[ . 1 . 2]" 1
417 1 26 ALA HA 1 36 LEU HB3 . . 4.740 4.486 4.439 4.527 . 0 0 "[ . 1 . 2]" 1
418 1 26 ALA HA 1 36 LEU MD1 . . 3.300 2.400 2.204 2.629 . 0 0 "[ . 1 . 2]" 1
419 1 26 ALA HA 1 36 LEU MD2 . . 3.960 3.333 3.138 3.532 . 0 0 "[ . 1 . 2]" 1
420 1 26 ALA HA 1 36 LEU HG . . 5.410 5.093 4.995 5.172 . 0 0 "[ . 1 . 2]" 1
421 1 26 ALA HA 1 37 THR MG . . 4.550 4.302 4.035 4.557 0.007 13 0 "[ . 1 . 2]" 1
422 1 26 ALA HA 1 107 LEU MD2 . . 4.660 3.908 3.745 4.126 . 0 0 "[ . 1 . 2]" 1
423 1 26 ALA MB 1 27 SER H . . 3.640 3.458 3.437 3.484 . 0 0 "[ . 1 . 2]" 1
424 1 26 ALA MB 1 28 LEU H . . 3.700 3.044 2.806 3.165 . 0 0 "[ . 1 . 2]" 1
425 1 26 ALA MB 1 29 VAL H . . 5.030 4.678 4.597 4.726 . 0 0 "[ . 1 . 2]" 1
426 1 26 ALA MB 1 29 VAL HB . . 4.910 4.726 4.655 4.784 . 0 0 "[ . 1 . 2]" 1
427 1 26 ALA MB 1 29 VAL MG2 . . 2.760 2.365 2.306 2.426 . 0 0 "[ . 1 . 2]" 1
428 1 26 ALA MB 1 34 ILE MG . . 2.950 2.285 2.184 2.452 . 0 0 "[ . 1 . 2]" 1
429 1 26 ALA MB 1 35 LYS H . . 4.570 4.115 4.026 4.262 . 0 0 "[ . 1 . 2]" 1
430 1 26 ALA MB 1 36 LEU HA . . 4.080 3.261 3.193 3.341 . 0 0 "[ . 1 . 2]" 1
431 1 26 ALA MB 1 36 LEU MD1 . . 3.140 2.614 2.347 2.849 . 0 0 "[ . 1 . 2]" 1
432 1 26 ALA MB 1 36 LEU MD2 . . 3.830 2.759 2.444 3.033 . 0 0 "[ . 1 . 2]" 1
433 1 26 ALA MB 1 37 THR H . . 4.980 4.590 4.523 4.651 . 0 0 "[ . 1 . 2]" 1
434 1 26 ALA MB 1 90 PHE QE . . 5.420 5.131 4.983 5.313 . 0 0 "[ . 1 . 2]" 1
435 1 26 ALA MB 1 107 LEU MD2 . . 3.190 2.807 2.700 2.924 . 0 0 "[ . 1 . 2]" 1
436 1 27 SER H 1 27 SER HB2 . . 3.540 2.759 2.695 2.809 . 0 0 "[ . 1 . 2]" 1
437 1 27 SER H 1 27 SER HB3 . . 3.560 2.335 2.292 2.387 . 0 0 "[ . 1 . 2]" 1
438 1 27 SER H 1 28 LEU H . . 2.790 2.719 2.667 2.747 . 0 0 "[ . 1 . 2]" 1
439 1 27 SER H 1 28 LEU HA . . 5.500 5.274 5.245 5.298 . 0 0 "[ . 1 . 2]" 1
440 1 27 SER H 1 28 LEU QB . . 4.830 4.816 4.752 4.843 0.013 19 0 "[ . 1 . 2]" 1
441 1 27 SER H 1 34 ILE MG . . 5.120 4.856 4.752 4.984 . 0 0 "[ . 1 . 2]" 1
442 1 27 SER H 1 35 LYS H . . 5.500 5.261 5.203 5.348 . 0 0 "[ . 1 . 2]" 1
443 1 27 SER H 1 35 LYS HB2 . . 5.330 5.308 5.193 5.347 0.017 13 0 "[ . 1 . 2]" 1
444 1 27 SER H 1 35 LYS HB3 . . 4.280 3.675 3.591 3.756 . 0 0 "[ . 1 . 2]" 1
445 1 27 SER H 1 35 LYS HG2 . . 5.030 4.429 4.124 4.708 . 0 0 "[ . 1 . 2]" 1
446 1 27 SER H 1 35 LYS HG3 . . 4.720 3.820 3.499 4.194 . 0 0 "[ . 1 . 2]" 1
447 1 27 SER H 1 36 LEU HA . . 3.270 2.823 2.775 2.867 . 0 0 "[ . 1 . 2]" 1
448 1 27 SER H 1 36 LEU HB2 . . 5.500 5.507 5.479 5.533 0.033 14 0 "[ . 1 . 2]" 1
449 1 27 SER H 1 36 LEU MD1 . . 4.150 4.022 3.905 4.126 . 0 0 "[ . 1 . 2]" 1
450 1 27 SER H 1 36 LEU MD2 . . 4.880 4.504 4.372 4.702 . 0 0 "[ . 1 . 2]" 1
451 1 27 SER H 1 37 THR H . . 3.680 3.423 3.345 3.502 . 0 0 "[ . 1 . 2]" 1
452 1 27 SER H 1 37 THR HA . . 5.500 4.918 4.839 5.001 . 0 0 "[ . 1 . 2]" 1
453 1 27 SER H 1 37 THR MG . . 3.990 2.709 2.390 3.004 . 0 0 "[ . 1 . 2]" 1
454 1 27 SER HA 1 28 LEU QB . . 4.890 4.560 4.481 4.620 . 0 0 "[ . 1 . 2]" 1
455 1 27 SER HA 1 37 THR MG . . 4.220 3.701 3.508 3.923 . 0 0 "[ . 1 . 2]" 1
456 1 27 SER HB2 1 28 LEU H . . 4.250 4.195 4.113 4.259 0.009 14 0 "[ . 1 . 2]" 1
457 1 27 SER HB2 1 28 LEU QB . . 5.150 4.930 4.911 4.948 . 0 0 "[ . 1 . 2]" 1
458 1 27 SER HB2 1 35 LYS HB3 . . 4.700 4.490 4.395 4.668 . 0 0 "[ . 1 . 2]" 1
459 1 27 SER HB2 1 35 LYS HG3 . . 4.640 4.034 3.641 4.409 . 0 0 "[ . 1 . 2]" 1
460 1 27 SER HB2 1 37 THR H . . 5.270 4.998 4.841 5.105 . 0 0 "[ . 1 . 2]" 1
461 1 27 SER HB2 1 37 THR HB . . 4.780 3.796 3.681 3.895 . 0 0 "[ . 1 . 2]" 1
462 1 27 SER HB2 1 37 THR MG . . 3.310 1.882 1.783 2.039 . 0 0 "[ . 1 . 2]" 1
463 1 27 SER HB3 1 28 LEU H . . 3.800 3.000 2.878 3.136 . 0 0 "[ . 1 . 2]" 1
464 1 27 SER HB3 1 28 LEU HA . . 5.500 5.154 5.044 5.239 . 0 0 "[ . 1 . 2]" 1
465 1 27 SER HB3 1 28 LEU QB . . 4.420 3.782 3.685 3.835 . 0 0 "[ . 1 . 2]" 1
466 1 27 SER HB3 1 35 LYS HB2 . . 4.960 4.181 4.032 4.374 . 0 0 "[ . 1 . 2]" 1
467 1 27 SER HB3 1 35 LYS HB3 . . 4.720 2.798 2.704 2.986 . 0 0 "[ . 1 . 2]" 1
468 1 27 SER HB3 1 35 LYS HG2 . . 4.770 2.418 2.045 2.761 . 0 0 "[ . 1 . 2]" 1
469 1 27 SER HB3 1 35 LYS HG3 . . 4.640 2.492 2.094 2.857 . 0 0 "[ . 1 . 2]" 1
470 1 27 SER HB3 1 36 LEU HA . . 4.930 4.396 4.313 4.464 . 0 0 "[ . 1 . 2]" 1
471 1 27 SER HB3 1 37 THR H . . 5.320 4.987 4.902 5.105 . 0 0 "[ . 1 . 2]" 1
472 1 27 SER HB3 1 37 THR HA . . 5.500 5.268 5.110 5.420 . 0 0 "[ . 1 . 2]" 1
473 1 27 SER HB3 1 37 THR HB . . 5.080 4.908 4.767 5.079 . 0 0 "[ . 1 . 2]" 1
474 1 27 SER HB3 1 37 THR MG . . 3.400 2.152 1.959 2.494 . 0 0 "[ . 1 . 2]" 1
475 1 28 LEU H 1 28 LEU QB . . 2.980 2.769 2.707 2.851 . 0 0 "[ . 1 . 2]" 1
476 1 28 LEU H 1 28 LEU MD1 . . 5.070 4.863 4.808 4.925 . 0 0 "[ . 1 . 2]" 1
477 1 28 LEU H 1 28 LEU MD2 . . 3.810 3.655 3.485 3.815 0.005 8 0 "[ . 1 . 2]" 1
478 1 28 LEU H 1 28 LEU HG . . 4.760 4.647 4.598 4.686 . 0 0 "[ . 1 . 2]" 1
479 1 28 LEU H 1 29 VAL H . . 4.430 4.317 4.288 4.345 . 0 0 "[ . 1 . 2]" 1
480 1 28 LEU H 1 29 VAL MG2 . . 4.160 3.985 3.847 4.067 . 0 0 "[ . 1 . 2]" 1
481 1 28 LEU H 1 34 ILE MG . . 4.180 3.825 3.671 3.930 . 0 0 "[ . 1 . 2]" 1
482 1 28 LEU H 1 35 LYS H . . 3.430 3.290 3.203 3.395 . 0 0 "[ . 1 . 2]" 1
483 1 28 LEU H 1 35 LYS HA . . 4.860 4.480 4.402 4.588 . 0 0 "[ . 1 . 2]" 1
484 1 28 LEU H 1 35 LYS HB2 . . 4.210 3.690 3.561 3.843 . 0 0 "[ . 1 . 2]" 1
485 1 28 LEU H 1 35 LYS HB3 . . 3.400 2.041 1.918 2.166 . 0 0 "[ . 1 . 2]" 1
486 1 28 LEU H 1 35 LYS HG2 . . 4.180 3.904 3.682 4.100 . 0 0 "[ . 1 . 2]" 1
487 1 28 LEU H 1 36 LEU H . . 5.140 5.036 4.963 5.106 . 0 0 "[ . 1 . 2]" 1
488 1 28 LEU H 1 36 LEU HA . . 4.840 4.374 4.340 4.417 . 0 0 "[ . 1 . 2]" 1
489 1 28 LEU H 1 36 LEU MD2 . . 5.050 4.719 4.574 4.874 . 0 0 "[ . 1 . 2]" 1
490 1 28 LEU H 1 37 THR MG . . 5.000 4.502 4.244 4.847 . 0 0 "[ . 1 . 2]" 1
491 1 28 LEU HA 1 28 LEU MD1 . . 3.810 3.696 3.622 3.779 . 0 0 "[ . 1 . 2]" 1
492 1 28 LEU HA 1 28 LEU MD2 . . 3.530 3.527 3.474 3.579 0.049 16 0 "[ . 1 . 2]" 1
493 1 28 LEU HA 1 29 VAL H . . 2.590 2.294 2.279 2.314 . 0 0 "[ . 1 . 2]" 1
494 1 28 LEU HA 1 29 VAL HB . . 4.520 4.443 4.380 4.501 . 0 0 "[ . 1 . 2]" 1
495 1 28 LEU HA 1 29 VAL MG2 . . 4.000 3.650 3.541 3.818 . 0 0 "[ . 1 . 2]" 1
496 1 28 LEU QB 1 28 LEU MD1 . . 2.790 2.061 1.972 2.099 . 0 0 "[ . 1 . 2]" 1
497 1 28 LEU QB 1 29 VAL H . . 3.540 3.416 3.386 3.454 . 0 0 "[ . 1 . 2]" 1
498 1 28 LEU QB 1 30 SER HB2 . . 5.500 5.472 5.348 5.514 0.014 16 0 "[ . 1 . 2]" 1
499 1 28 LEU QB 1 33 PHE QE . . 4.200 3.810 3.696 3.968 . 0 0 "[ . 1 . 2]" 1
500 1 28 LEU QB 1 34 ILE MG . . 5.250 4.827 4.780 4.931 . 0 0 "[ . 1 . 2]" 1
501 1 28 LEU QB 1 35 LYS H . . 3.950 3.331 3.213 3.458 . 0 0 "[ . 1 . 2]" 1
502 1 28 LEU QB 1 35 LYS HA . . 4.920 4.528 4.436 4.625 . 0 0 "[ . 1 . 2]" 1
503 1 28 LEU QB 1 35 LYS HB3 . . 3.130 1.990 1.980 2.037 . 0 0 "[ . 1 . 2]" 1
504 1 28 LEU QB 1 35 LYS QE . . 5.340 5.067 4.744 5.339 . 0 0 "[ . 1 . 2]" 1
505 1 28 LEU QB 1 35 LYS HG2 . . 3.840 3.065 2.971 3.149 . 0 0 "[ . 1 . 2]" 1
506 1 28 LEU QB 1 35 LYS HG3 . . 4.370 4.120 3.980 4.219 . 0 0 "[ . 1 . 2]" 1
507 1 28 LEU MD1 1 29 VAL H . . 3.910 3.737 3.627 3.834 . 0 0 "[ . 1 . 2]" 1
508 1 28 LEU MD1 1 29 VAL HA . . 5.500 5.172 5.123 5.232 . 0 0 "[ . 1 . 2]" 1
509 1 28 LEU MD1 1 30 SER HB2 . . 3.810 3.678 3.521 3.807 . 0 0 "[ . 1 . 2]" 1
510 1 28 LEU MD1 1 30 SER HB3 . . 5.050 4.805 4.689 4.980 . 0 0 "[ . 1 . 2]" 1
511 1 28 LEU MD1 1 33 PHE QD . . 5.340 5.244 5.083 5.327 . 0 0 "[ . 1 . 2]" 1
512 1 28 LEU MD1 1 33 PHE QE . . 3.720 3.640 3.450 3.728 0.008 13 0 "[ . 1 . 2]" 1
513 1 28 LEU MD1 1 35 LYS H . . 4.900 4.668 4.522 4.752 . 0 0 "[ . 1 . 2]" 1
514 1 28 LEU MD1 1 35 LYS QD . . 5.070 4.373 3.899 4.665 . 0 0 "[ . 1 . 2]" 1
515 1 28 LEU MD1 1 35 LYS HG2 . . 4.850 4.530 4.359 4.731 . 0 0 "[ . 1 . 2]" 1
516 1 28 LEU MD2 1 29 VAL H . . 3.260 2.869 2.700 3.063 . 0 0 "[ . 1 . 2]" 1
517 1 28 LEU MD2 1 29 VAL HB . . 4.690 4.495 4.320 4.693 0.003 19 0 "[ . 1 . 2]" 1
518 1 28 LEU MD2 1 30 SER HB2 . . 4.190 2.409 2.225 2.563 . 0 0 "[ . 1 . 2]" 1
519 1 28 LEU MD2 1 30 SER HB3 . . 4.470 2.923 2.774 3.084 . 0 0 "[ . 1 . 2]" 1
520 1 28 LEU MD2 1 33 PHE QD . . 4.440 3.493 3.393 3.543 . 0 0 "[ . 1 . 2]" 1
521 1 28 LEU MD2 1 33 PHE QE . . 3.610 2.119 2.026 2.223 . 0 0 "[ . 1 . 2]" 1
522 1 28 LEU MD2 1 33 PHE HZ . . 4.010 2.166 1.987 2.339 . 0 0 "[ . 1 . 2]" 1
523 1 28 LEU MD2 1 35 LYS H . . 4.920 2.104 1.896 2.324 . 0 0 "[ . 1 . 2]" 1
524 1 28 LEU MD2 1 35 LYS HA . . 4.680 3.917 3.765 4.071 . 0 0 "[ . 1 . 2]" 1
525 1 28 LEU MD2 1 35 LYS HB2 . . 4.210 2.145 1.985 2.394 . 0 0 "[ . 1 . 2]" 1
526 1 28 LEU MD2 1 35 LYS HD2 . . 4.340 4.272 4.039 4.343 0.003 16 0 "[ . 1 . 2]" 1
527 1 28 LEU MD2 1 35 LYS QD . . 3.790 3.659 3.489 3.790 . 0 0 "[ . 1 . 2]" 1
528 1 28 LEU MD2 1 35 LYS HD3 . . 4.340 3.992 3.678 4.190 . 0 0 "[ . 1 . 2]" 1
529 1 28 LEU HG 1 29 VAL H . . 4.040 2.042 1.960 2.128 . 0 0 "[ . 1 . 2]" 1
530 1 28 LEU HG 1 30 SER H . . 4.530 4.098 3.947 4.227 . 0 0 "[ . 1 . 2]" 1
531 1 28 LEU HG 1 30 SER HB2 . . 5.000 4.457 4.338 4.590 . 0 0 "[ . 1 . 2]" 1
532 1 28 LEU HG 1 33 PHE QE . . 4.880 4.829 4.728 4.886 0.006 12 0 "[ . 1 . 2]" 1
533 1 28 LEU HG 1 33 PHE HZ . . 5.290 4.769 4.625 4.915 . 0 0 "[ . 1 . 2]" 1
534 1 29 VAL H 1 29 VAL HB . . 3.080 2.617 2.584 2.653 . 0 0 "[ . 1 . 2]" 1
535 1 29 VAL H 1 29 VAL MG1 . . 3.960 3.809 3.768 3.843 . 0 0 "[ . 1 . 2]" 1
536 1 29 VAL H 1 29 VAL MG2 . . 3.220 3.011 2.928 3.130 . 0 0 "[ . 1 . 2]" 1
537 1 29 VAL H 1 30 SER H . . 4.370 3.983 3.931 4.046 . 0 0 "[ . 1 . 2]" 1
538 1 29 VAL H 1 34 ILE MG . . 4.940 4.406 4.341 4.520 . 0 0 "[ . 1 . 2]" 1
539 1 29 VAL HA 1 29 VAL MG1 . . 3.320 2.406 2.353 2.463 . 0 0 "[ . 1 . 2]" 1
540 1 29 VAL HA 1 29 VAL MG2 . . 3.240 2.261 2.160 2.368 . 0 0 "[ . 1 . 2]" 1
541 1 29 VAL HA 1 30 SER H . . 2.740 2.185 2.165 2.200 . 0 0 "[ . 1 . 2]" 1
542 1 29 VAL HA 1 30 SER HB2 . . 5.360 5.030 4.874 5.141 . 0 0 "[ . 1 . 2]" 1
543 1 29 VAL HA 1 30 SER HB3 . . 4.620 4.426 4.379 4.516 . 0 0 "[ . 1 . 2]" 1
544 1 29 VAL HA 1 34 ILE HA . . 3.570 2.374 2.320 2.409 . 0 0 "[ . 1 . 2]" 1
545 1 29 VAL HA 1 34 ILE HB . . 4.500 4.515 4.507 4.537 0.037 13 0 "[ . 1 . 2]" 1
546 1 29 VAL HA 1 34 ILE MD . . 4.450 4.037 3.947 4.139 . 0 0 "[ . 1 . 2]" 1
547 1 29 VAL HA 1 34 ILE HG12 . . 4.160 2.660 2.529 2.797 . 0 0 "[ . 1 . 2]" 1
548 1 29 VAL HA 1 34 ILE HG13 . . 4.230 4.096 3.940 4.231 0.001 7 0 "[ . 1 . 2]" 1
549 1 29 VAL HA 1 34 ILE MG . . 3.670 2.200 2.059 2.476 . 0 0 "[ . 1 . 2]" 1
550 1 29 VAL HA 1 35 LYS H . . 3.950 3.111 3.030 3.190 . 0 0 "[ . 1 . 2]" 1
551 1 29 VAL HA 1 109 VAL MG1 . . 4.500 3.820 3.623 3.970 . 0 0 "[ . 1 . 2]" 1
552 1 29 VAL HB 1 30 SER H . . 4.640 4.478 4.458 4.513 . 0 0 "[ . 1 . 2]" 1
553 1 29 VAL HB 1 109 VAL MG1 . . 4.800 4.200 4.044 4.350 . 0 0 "[ . 1 . 2]" 1
554 1 29 VAL HB 1 111 THR HA . . 4.770 4.388 4.351 4.459 . 0 0 "[ . 1 . 2]" 1
555 1 29 VAL HB 1 112 GLN H . . 5.500 5.439 5.341 5.507 0.007 8 0 "[ . 1 . 2]" 1
556 1 29 VAL HB 1 112 GLN HE21 . . 4.640 2.380 1.937 2.744 . 0 0 "[ . 1 . 2]" 1
557 1 29 VAL HB 1 112 GLN QE . . 3.900 2.297 1.892 2.595 . 0 0 "[ . 1 . 2]" 1
558 1 29 VAL HB 1 112 GLN HE22 . . 4.640 3.163 2.631 4.051 . 0 0 "[ . 1 . 2]" 1
559 1 29 VAL MG1 1 30 SER H . . 3.310 3.105 3.012 3.174 . 0 0 "[ . 1 . 2]" 1
560 1 29 VAL MG1 1 30 SER HA . . 4.250 3.989 3.924 4.081 . 0 0 "[ . 1 . 2]" 1
561 1 29 VAL MG1 1 34 ILE HA . . 4.100 3.802 3.703 3.917 . 0 0 "[ . 1 . 2]" 1
562 1 29 VAL MG1 1 34 ILE MD . . 3.350 2.935 2.770 3.081 . 0 0 "[ . 1 . 2]" 1
563 1 29 VAL MG1 1 34 ILE HG12 . . 3.810 2.259 2.163 2.439 . 0 0 "[ . 1 . 2]" 1
564 1 29 VAL MG1 1 34 ILE HG13 . . 3.990 3.674 3.494 3.837 . 0 0 "[ . 1 . 2]" 1
565 1 29 VAL MG1 1 34 ILE MG . . 3.500 3.127 2.918 3.288 . 0 0 "[ . 1 . 2]" 1
566 1 29 VAL MG1 1 35 LYS H . . 5.260 5.019 4.936 5.118 . 0 0 "[ . 1 . 2]" 1
567 1 29 VAL MG1 1 110 GLU H . . 4.380 3.794 3.358 3.990 . 0 0 "[ . 1 . 2]" 1
568 1 29 VAL MG1 1 111 THR H . . 4.690 3.783 3.705 3.826 . 0 0 "[ . 1 . 2]" 1
569 1 29 VAL MG1 1 111 THR HA . . 2.890 1.892 1.877 1.898 . 0 0 "[ . 1 . 2]" 1
570 1 29 VAL MG1 1 112 GLN H . . 3.280 3.058 2.959 3.142 . 0 0 "[ . 1 . 2]" 1
571 1 29 VAL MG1 1 112 GLN HA . . 4.470 4.363 4.251 4.432 . 0 0 "[ . 1 . 2]" 1
572 1 29 VAL MG1 1 112 GLN HB3 . . 4.740 4.695 4.561 4.745 0.005 4 0 "[ . 1 . 2]" 1
573 1 29 VAL MG1 1 112 GLN HE21 . . 4.400 2.511 2.005 3.033 . 0 0 "[ . 1 . 2]" 1
574 1 29 VAL MG1 1 112 GLN QE . . 3.750 2.420 1.951 2.823 . 0 0 "[ . 1 . 2]" 1
575 1 29 VAL MG1 1 112 GLN HE22 . . 4.400 3.328 2.623 4.317 . 0 0 "[ . 1 . 2]" 1
576 1 29 VAL MG1 1 112 GLN QG . . 3.030 2.284 2.154 2.469 . 0 0 "[ . 1 . 2]" 1
577 1 29 VAL MG2 1 30 SER H . . 4.260 4.110 4.066 4.165 . 0 0 "[ . 1 . 2]" 1
578 1 29 VAL MG2 1 34 ILE MG . . 3.130 2.021 1.914 2.198 . 0 0 "[ . 1 . 2]" 1
579 1 29 VAL MG2 1 36 LEU MD2 . . 4.770 4.538 4.328 4.749 . 0 0 "[ . 1 . 2]" 1
580 1 29 VAL MG2 1 109 VAL HA . . 4.700 4.205 4.019 4.413 . 0 0 "[ . 1 . 2]" 1
581 1 29 VAL MG2 1 109 VAL MG1 . . 2.790 1.942 1.800 2.126 . 0 0 "[ . 1 . 2]" 1
582 1 29 VAL MG2 1 110 GLU H . . 4.360 3.788 3.471 4.028 . 0 0 "[ . 1 . 2]" 1
583 1 29 VAL MG2 1 111 THR HA . . 4.560 3.998 3.845 4.111 . 0 0 "[ . 1 . 2]" 1
584 1 29 VAL MG2 1 112 GLN QE . . 4.720 3.619 3.174 4.080 . 0 0 "[ . 1 . 2]" 1
585 1 29 VAL MG2 1 112 GLN QG . . 4.930 4.631 4.421 4.790 . 0 0 "[ . 1 . 2]" 1
586 1 30 SER H 1 30 SER HB2 . . 3.500 3.040 2.920 3.119 . 0 0 "[ . 1 . 2]" 1
587 1 30 SER H 1 30 SER HB3 . . 3.320 2.264 2.208 2.353 . 0 0 "[ . 1 . 2]" 1
588 1 30 SER H 1 31 THR H . . 4.640 4.582 4.567 4.595 . 0 0 "[ . 1 . 2]" 1
589 1 30 SER H 1 32 ARG H . . 5.180 5.006 4.849 5.178 . 0 0 "[ . 1 . 2]" 1
590 1 30 SER H 1 33 PHE H . . 4.100 3.855 3.775 3.949 . 0 0 "[ . 1 . 2]" 1
591 1 30 SER H 1 33 PHE QD . . 5.160 4.020 3.890 4.071 . 0 0 "[ . 1 . 2]" 1
592 1 30 SER H 1 34 ILE HA . . 3.500 2.106 2.047 2.166 . 0 0 "[ . 1 . 2]" 1
593 1 30 SER H 1 34 ILE MD . . 4.830 4.613 4.553 4.681 . 0 0 "[ . 1 . 2]" 1
594 1 30 SER H 1 34 ILE HG12 . . 4.690 3.094 3.022 3.219 . 0 0 "[ . 1 . 2]" 1
595 1 30 SER H 1 34 ILE HG13 . . 4.080 3.755 3.627 3.887 . 0 0 "[ . 1 . 2]" 1
596 1 30 SER H 1 34 ILE MG . . 3.900 3.592 3.516 3.716 . 0 0 "[ . 1 . 2]" 1
597 1 30 SER H 1 35 LYS H . . 4.300 3.458 3.376 3.573 . 0 0 "[ . 1 . 2]" 1
598 1 30 SER H 1 111 THR MG . . 4.170 4.081 3.971 4.150 . 0 0 "[ . 1 . 2]" 1
599 1 30 SER HA 1 31 THR H . . 3.210 2.398 2.317 2.424 . 0 0 "[ . 1 . 2]" 1
600 1 30 SER HA 1 112 GLN QE . . 4.900 4.477 3.820 4.902 0.002 5 0 "[ . 1 . 2]" 1
601 1 30 SER HA 1 112 GLN QG . . 4.090 3.635 3.412 3.915 . 0 0 "[ . 1 . 2]" 1
602 1 30 SER HB2 1 31 THR H . . 3.590 3.538 3.462 3.628 0.038 12 0 "[ . 1 . 2]" 1
603 1 30 SER HB2 1 31 THR MG . . 5.500 5.335 5.124 5.507 0.007 8 0 "[ . 1 . 2]" 1
604 1 30 SER HB2 1 32 ARG H . . 4.390 4.070 3.990 4.197 . 0 0 "[ . 1 . 2]" 1
605 1 30 SER HB2 1 33 PHE H . . 3.900 3.875 3.818 3.912 0.012 3 0 "[ . 1 . 2]" 1
606 1 30 SER HB2 1 33 PHE QD . . 4.660 3.269 3.118 3.452 . 0 0 "[ . 1 . 2]" 1
607 1 30 SER HB2 1 33 PHE QE . . 4.330 2.534 2.398 2.739 . 0 0 "[ . 1 . 2]" 1
608 1 30 SER HB2 1 33 PHE HZ . . 4.860 3.122 2.982 3.294 . 0 0 "[ . 1 . 2]" 1
609 1 30 SER HB3 1 31 THR H . . 4.040 3.835 3.693 4.005 . 0 0 "[ . 1 . 2]" 1
610 1 30 SER HB3 1 32 ARG H . . 4.090 3.533 3.275 3.706 . 0 0 "[ . 1 . 2]" 1
611 1 30 SER HB3 1 33 PHE H . . 3.240 2.533 2.341 2.651 . 0 0 "[ . 1 . 2]" 1
612 1 30 SER HB3 1 33 PHE QD . . 4.220 2.766 2.689 2.844 . 0 0 "[ . 1 . 2]" 1
613 1 30 SER HB3 1 33 PHE QE . . 4.470 3.196 3.135 3.293 . 0 0 "[ . 1 . 2]" 1
614 1 31 THR H 1 31 THR HB . . 3.680 3.618 3.588 3.632 . 0 0 "[ . 1 . 2]" 1
615 1 31 THR H 1 31 THR MG . . 2.990 2.491 2.226 2.713 . 0 0 "[ . 1 . 2]" 1
616 1 31 THR H 1 32 ARG H . . 2.950 2.467 2.436 2.554 . 0 0 "[ . 1 . 2]" 1
617 1 31 THR H 1 32 ARG HB2 . . 5.240 4.731 4.598 4.919 . 0 0 "[ . 1 . 2]" 1
618 1 31 THR H 1 32 ARG HG3 . . 5.500 4.433 4.044 4.767 . 0 0 "[ . 1 . 2]" 1
619 1 31 THR H 1 33 PHE H . . 3.750 3.664 3.612 3.752 0.002 16 0 "[ . 1 . 2]" 1
620 1 31 THR H 1 33 PHE QD . . 5.240 4.868 4.749 4.995 . 0 0 "[ . 1 . 2]" 1
621 1 31 THR H 1 112 GLN H . . 4.610 4.514 4.427 4.613 0.003 13 0 "[ . 1 . 2]" 1
622 1 31 THR H 1 112 GLN HB2 . . 4.810 4.626 4.519 4.729 . 0 0 "[ . 1 . 2]" 1
623 1 31 THR HA 1 31 THR MG . . 3.000 2.279 2.108 2.410 . 0 0 "[ . 1 . 2]" 1
624 1 31 THR HA 1 84 PRO HA . . 4.070 3.041 2.949 3.180 . 0 0 "[ . 1 . 2]" 1
625 1 31 THR HA 1 84 PRO HB3 . . 3.790 3.011 2.709 3.179 . 0 0 "[ . 1 . 2]" 1
626 1 31 THR HA 1 111 THR HA . . 4.600 4.260 4.155 4.370 . 0 0 "[ . 1 . 2]" 1
627 1 31 THR HA 1 112 GLN H . . 3.320 2.462 2.387 2.551 . 0 0 "[ . 1 . 2]" 1
628 1 31 THR HA 1 112 GLN HB2 . . 3.950 3.815 3.722 3.907 . 0 0 "[ . 1 . 2]" 1
629 1 31 THR HA 1 114 GLU QG . . 4.800 4.330 3.886 4.758 . 0 0 "[ . 1 . 2]" 1
630 1 31 THR HB 1 32 ARG H . . 4.010 3.945 3.807 4.007 . 0 0 "[ . 1 . 2]" 1
631 1 31 THR HB 1 32 ARG HG2 . . 4.700 4.506 4.285 4.692 . 0 0 "[ . 1 . 2]" 1
632 1 31 THR HB 1 32 ARG HG3 . . 4.060 3.768 3.350 4.058 . 0 0 "[ . 1 . 2]" 1
633 1 31 THR HB 1 33 PHE H . . 5.500 5.476 5.375 5.523 0.023 9 0 "[ . 1 . 2]" 1
634 1 31 THR HB 1 84 PRO HA . . 4.110 3.826 3.690 4.010 . 0 0 "[ . 1 . 2]" 1
635 1 31 THR HB 1 84 PRO HB2 . . 3.790 3.476 3.299 3.636 . 0 0 "[ . 1 . 2]" 1
636 1 31 THR HB 1 84 PRO HB3 . . 3.730 2.047 1.996 2.187 . 0 0 "[ . 1 . 2]" 1
637 1 31 THR HB 1 84 PRO HG2 . . 5.050 4.793 4.564 4.948 . 0 0 "[ . 1 . 2]" 1
638 1 31 THR HB 1 84 PRO HG3 . . 3.840 3.577 3.311 3.730 . 0 0 "[ . 1 . 2]" 1
639 1 31 THR HB 1 112 GLN H . . 4.930 4.453 4.314 4.614 . 0 0 "[ . 1 . 2]" 1
640 1 31 THR HB 1 112 GLN HB2 . . 4.550 4.480 4.302 4.607 0.057 18 0 "[ . 1 . 2]" 1
641 1 31 THR HB 1 114 GLU H . . 4.640 3.543 3.187 4.042 . 0 0 "[ . 1 . 2]" 1
642 1 31 THR HB 1 114 GLU HA . . 4.710 4.353 3.519 4.554 . 0 0 "[ . 1 . 2]" 1
643 1 31 THR HB 1 114 GLU QG . . 3.510 2.234 1.782 2.744 . 0 0 "[ . 1 . 2]" 1
644 1 31 THR MG 1 32 ARG H . . 4.560 4.086 3.973 4.190 . 0 0 "[ . 1 . 2]" 1
645 1 31 THR MG 1 32 ARG HG3 . . 4.970 4.640 4.451 4.813 . 0 0 "[ . 1 . 2]" 1
646 1 31 THR MG 1 84 PRO HB3 . . 3.750 3.162 2.823 3.248 . 0 0 "[ . 1 . 2]" 1
647 1 31 THR MG 1 84 PRO HD3 . . 5.500 5.475 5.125 5.511 0.011 5 0 "[ . 1 . 2]" 1
648 1 31 THR MG 1 84 PRO HG2 . . 5.500 5.417 5.080 5.505 0.005 5 0 "[ . 1 . 2]" 1
649 1 31 THR MG 1 84 PRO HG3 . . 5.070 4.682 4.337 4.736 . 0 0 "[ . 1 . 2]" 1
650 1 31 THR MG 1 85 ALA H . . 4.920 4.375 4.043 4.577 . 0 0 "[ . 1 . 2]" 1
651 1 31 THR MG 1 112 GLN H . . 3.510 2.867 2.516 3.112 . 0 0 "[ . 1 . 2]" 1
652 1 31 THR MG 1 112 GLN HA . . 4.620 4.015 3.834 4.182 . 0 0 "[ . 1 . 2]" 1
653 1 31 THR MG 1 112 GLN HB2 . . 3.210 1.975 1.901 2.142 . 0 0 "[ . 1 . 2]" 1
654 1 31 THR MG 1 112 GLN HB3 . . 3.820 3.449 3.357 3.579 . 0 0 "[ . 1 . 2]" 1
655 1 31 THR MG 1 112 GLN QG . . 3.670 2.759 2.561 2.993 . 0 0 "[ . 1 . 2]" 1
656 1 31 THR MG 1 113 PRO HD2 . . 4.790 4.445 4.309 4.570 . 0 0 "[ . 1 . 2]" 1
657 1 31 THR MG 1 113 PRO HD3 . . 5.500 5.123 4.999 5.252 . 0 0 "[ . 1 . 2]" 1
658 1 31 THR MG 1 113 PRO HG2 . . 5.500 5.181 4.984 5.340 . 0 0 "[ . 1 . 2]" 1
659 1 31 THR MG 1 114 GLU H . . 4.140 3.072 2.800 3.565 . 0 0 "[ . 1 . 2]" 1
660 1 31 THR MG 1 114 GLU HA . . 3.280 2.959 2.147 3.273 . 0 0 "[ . 1 . 2]" 1
661 1 31 THR MG 1 114 GLU HB2 . . 4.150 3.453 3.015 4.044 . 0 0 "[ . 1 . 2]" 1
662 1 31 THR MG 1 114 GLU QB . . 3.610 2.302 1.912 3.624 0.014 18 0 "[ . 1 . 2]" 1
663 1 31 THR MG 1 114 GLU HB3 . . 4.150 2.419 1.924 4.200 0.050 8 0 "[ . 1 . 2]" 1
664 1 31 THR MG 1 114 GLU QG . . 3.600 2.979 1.963 3.431 . 0 0 "[ . 1 . 2]" 1
665 1 32 ARG H 1 32 ARG HB2 . . 3.250 2.564 2.436 2.699 . 0 0 "[ . 1 . 2]" 1
666 1 32 ARG H 1 32 ARG HD2 . . 5.500 4.916 3.986 5.401 . 0 0 "[ . 1 . 2]" 1
667 1 32 ARG H 1 32 ARG QD . . 4.630 4.372 3.834 4.637 0.007 14 0 "[ . 1 . 2]" 1
668 1 32 ARG H 1 32 ARG HD3 . . 5.500 5.019 4.647 5.437 . 0 0 "[ . 1 . 2]" 1
669 1 32 ARG H 1 32 ARG HG2 . . 4.050 3.933 3.800 4.056 0.006 5 0 "[ . 1 . 2]" 1
670 1 32 ARG H 1 32 ARG HG3 . . 3.650 2.948 2.560 3.178 . 0 0 "[ . 1 . 2]" 1
671 1 32 ARG H 1 111 THR MG . . 5.010 4.241 4.131 4.379 . 0 0 "[ . 1 . 2]" 1
672 1 32 ARG HA 1 32 ARG HD2 . . 4.940 4.619 4.292 4.809 . 0 0 "[ . 1 . 2]" 1
673 1 32 ARG HA 1 32 ARG QD . . 4.100 4.057 3.885 4.172 0.072 5 0 "[ . 1 . 2]" 1
674 1 32 ARG HA 1 32 ARG HD3 . . 4.940 4.528 4.234 4.798 . 0 0 "[ . 1 . 2]" 1
675 1 32 ARG HA 1 32 ARG HG2 . . 3.720 2.505 2.339 2.812 . 0 0 "[ . 1 . 2]" 1
676 1 32 ARG HA 1 82 LEU H . . 3.610 3.393 3.127 3.558 . 0 0 "[ . 1 . 2]" 1
677 1 32 ARG HA 1 82 LEU HB2 . . 4.150 3.467 3.246 3.584 . 0 0 "[ . 1 . 2]" 1
678 1 32 ARG HB2 1 32 ARG HD2 . . 4.160 3.047 2.286 3.724 . 0 0 "[ . 1 . 2]" 1
679 1 32 ARG HB2 1 32 ARG QD . . 3.580 2.510 2.231 2.872 . 0 0 "[ . 1 . 2]" 1
680 1 32 ARG HB2 1 32 ARG HD3 . . 4.160 3.003 2.492 3.772 . 0 0 "[ . 1 . 2]" 1
681 1 32 ARG HB2 1 33 PHE H . . 3.830 3.494 3.438 3.534 . 0 0 "[ . 1 . 2]" 1
682 1 32 ARG HB3 1 32 ARG HD2 . . 3.710 3.127 2.312 3.672 . 0 0 "[ . 1 . 2]" 1
683 1 32 ARG HB3 1 32 ARG HD3 . . 3.710 2.844 2.440 3.654 . 0 0 "[ . 1 . 2]" 1
684 1 32 ARG HB3 1 33 PHE H . . 4.770 4.224 4.139 4.350 . 0 0 "[ . 1 . 2]" 1
685 1 32 ARG HB3 1 81 ASN HA . . 4.940 4.535 4.246 4.717 . 0 0 "[ . 1 . 2]" 1
686 1 32 ARG HB3 1 82 LEU H . . 3.720 3.617 3.389 3.730 0.010 12 0 "[ . 1 . 2]" 1
687 1 32 ARG HG2 1 33 PHE H . . 5.270 5.176 5.078 5.272 0.002 8 0 "[ . 1 . 2]" 1
688 1 32 ARG HG2 1 82 LEU H . . 5.250 5.037 4.798 5.253 0.003 6 0 "[ . 1 . 2]" 1
689 1 32 ARG HG2 1 84 PRO HD3 . . 4.350 3.702 3.359 4.008 . 0 0 "[ . 1 . 2]" 1
690 1 32 ARG HG3 1 84 PRO HD3 . . 4.970 4.719 4.440 4.974 0.004 12 0 "[ . 1 . 2]" 1
691 1 33 PHE H 1 33 PHE HB2 . . 4.180 4.030 4.026 4.033 . 0 0 "[ . 1 . 2]" 1
692 1 33 PHE H 1 33 PHE HB3 . . 4.020 3.232 3.202 3.265 . 0 0 "[ . 1 . 2]" 1
693 1 33 PHE H 1 34 ILE H . . 4.420 4.367 4.366 4.371 . 0 0 "[ . 1 . 2]" 1
694 1 33 PHE H 1 34 ILE HG13 . . 4.570 4.042 3.996 4.100 . 0 0 "[ . 1 . 2]" 1
695 1 33 PHE H 1 82 LEU H . . 5.050 4.897 4.716 5.020 . 0 0 "[ . 1 . 2]" 1
696 1 33 PHE H 1 82 LEU HB2 . . 4.290 3.840 3.699 3.998 . 0 0 "[ . 1 . 2]" 1
697 1 33 PHE H 1 82 LEU MD1 . . 4.130 4.019 3.866 4.130 . 0 0 "[ . 1 . 2]" 1
698 1 33 PHE H 1 111 THR MG . . 3.730 3.470 3.422 3.548 . 0 0 "[ . 1 . 2]" 1
699 1 33 PHE HA 1 33 PHE QD . . 4.040 3.655 3.634 3.669 . 0 0 "[ . 1 . 2]" 1
700 1 33 PHE HA 1 34 ILE H . . 2.930 2.590 2.571 2.597 . 0 0 "[ . 1 . 2]" 1
701 1 33 PHE HA 1 34 ILE HA . . 4.720 4.552 4.541 4.558 . 0 0 "[ . 1 . 2]" 1
702 1 33 PHE HA 1 34 ILE HB . . 4.920 4.553 4.500 4.593 . 0 0 "[ . 1 . 2]" 1
703 1 33 PHE HA 1 34 ILE MD . . 5.070 4.437 4.386 4.495 . 0 0 "[ . 1 . 2]" 1
704 1 33 PHE HA 1 78 THR MG . . 4.650 4.545 4.369 4.639 . 0 0 "[ . 1 . 2]" 1
705 1 33 PHE HA 1 79 ILE H . . 4.900 4.764 4.672 4.880 . 0 0 "[ . 1 . 2]" 1
706 1 33 PHE HA 1 79 ILE HB . . 4.880 4.206 4.090 4.323 . 0 0 "[ . 1 . 2]" 1
707 1 33 PHE HA 1 79 ILE MG . . 5.060 4.418 4.301 4.611 . 0 0 "[ . 1 . 2]" 1
708 1 33 PHE HA 1 80 GLN HG3 . . 5.430 5.295 4.765 5.434 0.004 2 0 "[ . 1 . 2]" 1
709 1 33 PHE HA 1 82 LEU H . . 4.160 3.752 3.634 3.860 . 0 0 "[ . 1 . 2]" 1
710 1 33 PHE HA 1 82 LEU HB2 . . 4.480 2.679 2.459 2.983 . 0 0 "[ . 1 . 2]" 1
711 1 33 PHE HA 1 82 LEU HB3 . . 4.920 4.125 3.913 4.410 . 0 0 "[ . 1 . 2]" 1
712 1 33 PHE HA 1 82 LEU MD1 . . 3.620 1.999 1.969 2.146 . 0 0 "[ . 1 . 2]" 1
713 1 33 PHE HA 1 82 LEU MD2 . . 4.740 4.217 4.082 4.340 . 0 0 "[ . 1 . 2]" 1
714 1 33 PHE HA 1 82 LEU HG . . 3.960 2.769 2.564 3.009 . 0 0 "[ . 1 . 2]" 1
715 1 33 PHE HB2 1 34 ILE H . . 3.350 2.294 2.249 2.359 . 0 0 "[ . 1 . 2]" 1
716 1 33 PHE HB2 1 78 THR MG . . 3.510 2.671 2.521 2.773 . 0 0 "[ . 1 . 2]" 1
717 1 33 PHE HB2 1 79 ILE H . . 4.810 3.462 3.359 3.610 . 0 0 "[ . 1 . 2]" 1
718 1 33 PHE HB2 1 80 GLN H . . 4.910 3.688 3.591 3.887 . 0 0 "[ . 1 . 2]" 1
719 1 33 PHE HB2 1 82 LEU MD1 . . 4.980 3.645 3.564 3.750 . 0 0 "[ . 1 . 2]" 1
720 1 33 PHE HB3 1 34 ILE H . . 3.940 3.731 3.710 3.768 . 0 0 "[ . 1 . 2]" 1
721 1 33 PHE HB3 1 78 THR MG . . 3.740 3.676 3.529 3.747 0.007 8 0 "[ . 1 . 2]" 1
722 1 33 PHE HB3 1 79 ILE H . . 5.500 5.212 5.106 5.368 . 0 0 "[ . 1 . 2]" 1
723 1 33 PHE HB3 1 80 GLN H . . 4.920 4.627 4.506 4.849 . 0 0 "[ . 1 . 2]" 1
724 1 33 PHE HB3 1 80 GLN HG3 . . 4.250 3.784 3.059 4.068 . 0 0 "[ . 1 . 2]" 1
725 1 33 PHE HB3 1 81 ASN H . . 4.350 3.811 3.626 4.130 . 0 0 "[ . 1 . 2]" 1
726 1 33 PHE HB3 1 82 LEU H . . 4.880 4.472 4.321 4.641 . 0 0 "[ . 1 . 2]" 1
727 1 33 PHE HB3 1 82 LEU MD1 . . 5.040 4.322 4.249 4.396 . 0 0 "[ . 1 . 2]" 1
728 1 33 PHE QD 1 34 ILE H . . 3.730 2.039 1.973 2.134 . 0 0 "[ . 1 . 2]" 1
729 1 33 PHE QD 1 34 ILE HA . . 4.160 3.144 3.059 3.194 . 0 0 "[ . 1 . 2]" 1
730 1 33 PHE QD 1 34 ILE HG13 . . 4.680 4.599 4.570 4.635 . 0 0 "[ . 1 . 2]" 1
731 1 33 PHE QD 1 35 LYS H . . 4.280 3.535 3.466 3.609 . 0 0 "[ . 1 . 2]" 1
732 1 33 PHE QD 1 35 LYS HB2 . . 4.280 4.058 4.000 4.128 . 0 0 "[ . 1 . 2]" 1
733 1 33 PHE QD 1 36 LEU H . . 5.500 5.508 5.497 5.527 0.027 20 0 "[ . 1 . 2]" 1
734 1 33 PHE QD 1 78 THR MG . . 3.230 2.008 1.873 2.161 . 0 0 "[ . 1 . 2]" 1
735 1 33 PHE QD 1 79 ILE H . . 4.660 2.966 2.763 3.190 . 0 0 "[ . 1 . 2]" 1
736 1 33 PHE QD 1 80 GLN HG3 . . 4.840 4.420 3.933 4.688 . 0 0 "[ . 1 . 2]" 1
737 1 33 PHE QD 1 111 THR MG . . 5.500 5.523 5.506 5.546 0.046 16 0 "[ . 1 . 2]" 1
738 1 33 PHE QE 1 35 LYS H . . 5.020 3.077 3.004 3.164 . 0 0 "[ . 1 . 2]" 1
739 1 33 PHE QE 1 35 LYS HB2 . . 4.010 2.229 2.154 2.336 . 0 0 "[ . 1 . 2]" 1
740 1 33 PHE QE 1 35 LYS QD . . 4.800 3.016 2.817 3.227 . 0 0 "[ . 1 . 2]" 1
741 1 33 PHE QE 1 35 LYS QE . . 5.340 5.038 4.876 5.244 . 0 0 "[ . 1 . 2]" 1
742 1 33 PHE QE 1 78 THR MG . . 4.250 2.620 2.226 2.917 . 0 0 "[ . 1 . 2]" 1
743 1 33 PHE QE 1 79 ILE H . . 5.500 4.791 4.568 5.044 . 0 0 "[ . 1 . 2]" 1
744 1 33 PHE HZ 1 35 LYS QD . . 5.340 4.349 4.058 4.658 . 0 0 "[ . 1 . 2]" 1
745 1 34 ILE H 1 34 ILE HB . . 3.430 2.924 2.885 2.943 . 0 0 "[ . 1 . 2]" 1
746 1 34 ILE H 1 34 ILE MD . . 4.310 4.248 4.147 4.306 . 0 0 "[ . 1 . 2]" 1
747 1 34 ILE H 1 34 ILE HG12 . . 4.940 4.222 4.164 4.320 . 0 0 "[ . 1 . 2]" 1
748 1 34 ILE H 1 34 ILE HG13 . . 4.040 3.106 3.050 3.177 . 0 0 "[ . 1 . 2]" 1
749 1 34 ILE H 1 34 ILE MG . . 4.120 3.951 3.932 3.964 . 0 0 "[ . 1 . 2]" 1
750 1 34 ILE H 1 35 LYS H . . 4.410 4.150 4.128 4.167 . 0 0 "[ . 1 . 2]" 1
751 1 34 ILE H 1 35 LYS HA . . 5.180 4.581 4.564 4.598 . 0 0 "[ . 1 . 2]" 1
752 1 34 ILE H 1 78 THR MG . . 3.840 3.207 2.902 3.366 . 0 0 "[ . 1 . 2]" 1
753 1 34 ILE H 1 79 ILE H . . 3.590 2.703 2.616 2.771 . 0 0 "[ . 1 . 2]" 1
754 1 34 ILE H 1 79 ILE HA . . 4.930 4.683 4.594 4.781 . 0 0 "[ . 1 . 2]" 1
755 1 34 ILE H 1 79 ILE HB . . 3.730 3.061 2.930 3.307 . 0 0 "[ . 1 . 2]" 1
756 1 34 ILE H 1 79 ILE MD . . 5.500 5.292 5.142 5.445 . 0 0 "[ . 1 . 2]" 1
757 1 34 ILE H 1 79 ILE MG . . 4.600 4.322 4.187 4.536 . 0 0 "[ . 1 . 2]" 1
758 1 34 ILE H 1 82 LEU MD1 . . 3.520 2.805 2.658 2.930 . 0 0 "[ . 1 . 2]" 1
759 1 34 ILE HA 1 34 ILE MD . . 4.070 3.868 3.856 3.882 . 0 0 "[ . 1 . 2]" 1
760 1 34 ILE HA 1 34 ILE HG12 . . 3.930 2.617 2.585 2.653 . 0 0 "[ . 1 . 2]" 1
761 1 34 ILE HA 1 34 ILE HG13 . . 4.030 2.967 2.861 3.013 . 0 0 "[ . 1 . 2]" 1
762 1 34 ILE HA 1 34 ILE MG . . 3.310 2.342 2.253 2.436 . 0 0 "[ . 1 . 2]" 1
763 1 34 ILE HA 1 35 LYS H . . 2.820 2.147 2.145 2.150 . 0 0 "[ . 1 . 2]" 1
764 1 34 ILE HA 1 35 LYS HB2 . . 4.830 4.394 4.322 4.467 . 0 0 "[ . 1 . 2]" 1
765 1 34 ILE HB 1 34 ILE MD . . 3.410 2.351 2.228 2.415 . 0 0 "[ . 1 . 2]" 1
766 1 34 ILE HB 1 35 LYS H . . 4.280 4.174 4.153 4.199 . 0 0 "[ . 1 . 2]" 1
767 1 34 ILE HB 1 79 ILE HB . . 4.150 3.220 3.033 3.377 . 0 0 "[ . 1 . 2]" 1
768 1 34 ILE HB 1 82 LEU MD1 . . 3.780 2.961 2.894 3.006 . 0 0 "[ . 1 . 2]" 1
769 1 34 ILE HB 1 90 PHE QE . . 4.790 3.406 3.238 3.583 . 0 0 "[ . 1 . 2]" 1
770 1 34 ILE HB 1 90 PHE HZ . . 4.150 2.830 2.631 3.074 . 0 0 "[ . 1 . 2]" 1
771 1 34 ILE MD 1 34 ILE MG . . 2.830 2.022 1.928 2.202 . 0 0 "[ . 1 . 2]" 1
772 1 34 ILE MD 1 35 LYS H . . 5.370 5.171 5.144 5.205 . 0 0 "[ . 1 . 2]" 1
773 1 34 ILE MD 1 79 ILE HB . . 4.420 4.311 4.131 4.421 0.001 6 0 "[ . 1 . 2]" 1
774 1 34 ILE MD 1 82 LEU MD1 . . 3.200 2.126 2.030 2.264 . 0 0 "[ . 1 . 2]" 1
775 1 34 ILE MD 1 82 LEU MD2 . . 4.290 3.949 3.837 4.050 . 0 0 "[ . 1 . 2]" 1
776 1 34 ILE MD 1 88 TYR HB2 . . 4.240 2.927 2.686 3.053 . 0 0 "[ . 1 . 2]" 1
777 1 34 ILE MD 1 88 TYR HB3 . . 4.400 3.914 3.707 4.080 . 0 0 "[ . 1 . 2]" 1
778 1 34 ILE MD 1 90 PHE QD . . 4.060 3.746 3.589 3.834 . 0 0 "[ . 1 . 2]" 1
779 1 34 ILE MD 1 90 PHE QE . . 3.230 1.988 1.905 2.105 . 0 0 "[ . 1 . 2]" 1
780 1 34 ILE MD 1 90 PHE HZ . . 3.230 1.967 1.839 2.161 . 0 0 "[ . 1 . 2]" 1
781 1 34 ILE MD 1 109 VAL HA . . 5.260 4.604 4.499 4.753 . 0 0 "[ . 1 . 2]" 1
782 1 34 ILE MD 1 109 VAL HB . . 3.370 2.609 2.461 2.801 . 0 0 "[ . 1 . 2]" 1
783 1 34 ILE MD 1 109 VAL MG1 . . 2.860 1.853 1.752 1.995 . 0 0 "[ . 1 . 2]" 1
784 1 34 ILE MD 1 110 GLU H . . 4.700 4.440 3.995 4.596 . 0 0 "[ . 1 . 2]" 1
785 1 34 ILE MD 1 111 THR H . . 3.980 3.602 3.433 3.782 . 0 0 "[ . 1 . 2]" 1
786 1 34 ILE MD 1 111 THR HA . . 3.940 3.485 3.328 3.625 . 0 0 "[ . 1 . 2]" 1
787 1 34 ILE MD 1 111 THR HG1 . . 4.820 4.660 4.384 4.831 0.011 8 0 "[ . 1 . 2]" 1
788 1 34 ILE MD 1 111 THR MG . . 2.920 2.106 1.930 2.302 . 0 0 "[ . 1 . 2]" 1
789 1 34 ILE HG12 1 34 ILE MG . . 3.500 2.330 2.233 2.386 . 0 0 "[ . 1 . 2]" 1
790 1 34 ILE HG12 1 35 LYS H . . 5.050 4.463 4.404 4.514 . 0 0 "[ . 1 . 2]" 1
791 1 34 ILE HG12 1 82 LEU MD1 . . 4.290 3.657 3.527 3.811 . 0 0 "[ . 1 . 2]" 1
792 1 34 ILE HG13 1 34 ILE MG . . 3.350 3.194 3.177 3.201 . 0 0 "[ . 1 . 2]" 1
793 1 34 ILE HG13 1 35 LYS H . . 5.500 5.006 4.920 5.042 . 0 0 "[ . 1 . 2]" 1
794 1 34 ILE HG13 1 79 ILE H . . 5.500 5.504 5.474 5.528 0.028 20 0 "[ . 1 . 2]" 1
795 1 34 ILE HG13 1 82 LEU MD1 . . 3.900 2.194 2.015 2.435 . 0 0 "[ . 1 . 2]" 1
796 1 34 ILE HG13 1 90 PHE QE . . 4.770 4.359 4.241 4.484 . 0 0 "[ . 1 . 2]" 1
797 1 34 ILE HG13 1 90 PHE HZ . . 4.910 3.497 3.296 3.891 . 0 0 "[ . 1 . 2]" 1
798 1 34 ILE HG13 1 109 VAL MG1 . . 4.840 4.070 3.932 4.312 . 0 0 "[ . 1 . 2]" 1
799 1 34 ILE HG13 1 111 THR HA . . 4.970 4.791 4.667 4.897 . 0 0 "[ . 1 . 2]" 1
800 1 34 ILE HG13 1 111 THR MG . . 3.840 2.685 2.598 2.769 . 0 0 "[ . 1 . 2]" 1
801 1 34 ILE MG 1 35 LYS H . . 3.320 2.593 2.368 2.697 . 0 0 "[ . 1 . 2]" 1
802 1 34 ILE MG 1 35 LYS HA . . 4.490 4.006 3.901 4.119 . 0 0 "[ . 1 . 2]" 1
803 1 34 ILE MG 1 35 LYS HB2 . . 5.500 4.675 4.595 4.761 . 0 0 "[ . 1 . 2]" 1
804 1 34 ILE MG 1 36 LEU H . . 4.440 4.383 4.263 4.457 0.017 13 0 "[ . 1 . 2]" 1
805 1 34 ILE MG 1 36 LEU HA . . 4.680 3.961 3.880 4.015 . 0 0 "[ . 1 . 2]" 1
806 1 34 ILE MG 1 36 LEU HB3 . . 5.500 5.480 5.413 5.506 0.006 16 0 "[ . 1 . 2]" 1
807 1 34 ILE MG 1 36 LEU MD1 . . 3.860 3.403 3.177 3.580 . 0 0 "[ . 1 . 2]" 1
808 1 34 ILE MG 1 36 LEU MD2 . . 3.080 2.076 1.885 2.286 . 0 0 "[ . 1 . 2]" 1
809 1 34 ILE MG 1 82 LEU MD1 . . 3.990 3.997 3.958 4.009 0.019 16 0 "[ . 1 . 2]" 1
810 1 34 ILE MG 1 90 PHE QD . . 4.450 4.184 4.027 4.293 . 0 0 "[ . 1 . 2]" 1
811 1 34 ILE MG 1 90 PHE QE . . 3.780 3.392 3.292 3.618 . 0 0 "[ . 1 . 2]" 1
812 1 34 ILE MG 1 90 PHE HZ . . 4.070 3.767 3.526 4.092 0.022 20 0 "[ . 1 . 2]" 1
813 1 34 ILE MG 1 109 VAL HB . . 4.370 3.306 3.087 3.531 . 0 0 "[ . 1 . 2]" 1
814 1 34 ILE MG 1 109 VAL MG1 . . 3.300 1.894 1.781 2.052 . 0 0 "[ . 1 . 2]" 1
815 1 34 ILE MG 1 111 THR MG . . 4.220 3.998 3.922 4.097 . 0 0 "[ . 1 . 2]" 1
816 1 35 LYS H 1 35 LYS HB2 . . 3.190 2.538 2.449 2.626 . 0 0 "[ . 1 . 2]" 1
817 1 35 LYS H 1 35 LYS HB3 . . 3.240 2.621 2.533 2.717 . 0 0 "[ . 1 . 2]" 1
818 1 35 LYS H 1 35 LYS QD . . 5.340 4.157 4.046 4.260 . 0 0 "[ . 1 . 2]" 1
819 1 35 LYS H 1 35 LYS HG2 . . 4.960 4.658 4.635 4.675 . 0 0 "[ . 1 . 2]" 1
820 1 35 LYS H 1 35 LYS HG3 . . 5.010 4.469 4.432 4.506 . 0 0 "[ . 1 . 2]" 1
821 1 35 LYS H 1 36 LEU H . . 4.570 4.489 4.462 4.511 . 0 0 "[ . 1 . 2]" 1
822 1 35 LYS H 1 36 LEU MD2 . . 4.750 3.965 3.897 4.053 . 0 0 "[ . 1 . 2]" 1
823 1 35 LYS HA 1 35 LYS QD . . 4.370 2.237 1.981 2.451 . 0 0 "[ . 1 . 2]" 1
824 1 35 LYS HA 1 35 LYS HG2 . . 4.090 3.735 3.693 3.781 . 0 0 "[ . 1 . 2]" 1
825 1 35 LYS HA 1 35 LYS HG3 . . 4.140 2.718 2.557 2.861 . 0 0 "[ . 1 . 2]" 1
826 1 35 LYS HA 1 36 LEU H . . 2.760 2.147 2.142 2.153 . 0 0 "[ . 1 . 2]" 1
827 1 35 LYS HA 1 77 VAL H . . 4.910 4.792 4.663 4.921 0.011 10 0 "[ . 1 . 2]" 1
828 1 35 LYS HA 1 77 VAL MG1 . . 5.360 4.727 4.475 5.064 . 0 0 "[ . 1 . 2]" 1
829 1 35 LYS HA 1 78 THR MG . . 3.910 3.369 3.052 3.539 . 0 0 "[ . 1 . 2]" 1
830 1 35 LYS HA 1 79 ILE H . . 3.880 3.707 3.600 3.813 . 0 0 "[ . 1 . 2]" 1
831 1 35 LYS HB2 1 35 LYS QD . . 3.670 2.290 2.222 2.377 . 0 0 "[ . 1 . 2]" 1
832 1 35 LYS HB2 1 35 LYS QE . . 4.430 4.007 3.932 4.109 . 0 0 "[ . 1 . 2]" 1
833 1 35 LYS HB2 1 36 LEU H . . 4.460 4.348 4.284 4.422 . 0 0 "[ . 1 . 2]" 1
834 1 35 LYS HB2 1 78 THR MG . . 4.460 3.918 3.552 4.217 . 0 0 "[ . 1 . 2]" 1
835 1 35 LYS HB3 1 35 LYS HD2 . . 3.790 3.661 3.574 3.768 . 0 0 "[ . 1 . 2]" 1
836 1 35 LYS HB3 1 35 LYS HD3 . . 3.790 3.661 3.518 3.787 . 0 0 "[ . 1 . 2]" 1
837 1 35 LYS HB3 1 36 LEU H . . 4.470 4.129 4.076 4.195 . 0 0 "[ . 1 . 2]" 1
838 1 35 LYS QE 1 35 LYS HG2 . . 3.370 2.627 2.309 2.974 . 0 0 "[ . 1 . 2]" 1
839 1 35 LYS QE 1 37 THR MG . . 3.890 3.353 3.022 3.852 . 0 0 "[ . 1 . 2]" 1
840 1 35 LYS QE 1 76 GLN QB . . 3.330 2.686 2.158 3.329 . 0 0 "[ . 1 . 2]" 1
841 1 35 LYS QE 1 76 GLN QG . . 3.970 3.310 2.814 3.977 0.007 16 0 "[ . 1 . 2]" 1
842 1 35 LYS QE 1 77 VAL H . . 5.030 3.606 2.938 4.373 . 0 0 "[ . 1 . 2]" 1
843 1 35 LYS QE 1 78 THR MG . . 5.330 4.406 4.011 4.946 . 0 0 "[ . 1 . 2]" 1
844 1 35 LYS HE2 1 35 LYS HG2 . . 4.230 2.864 2.352 3.728 . 0 0 "[ . 1 . 2]" 1
845 1 35 LYS HE2 1 35 LYS HG3 . . 3.820 2.689 2.138 3.598 . 0 0 "[ . 1 . 2]" 1
846 1 35 LYS HE2 1 37 THR MG . . 4.680 3.804 3.216 4.681 0.001 7 0 "[ . 1 . 2]" 1
847 1 35 LYS HE3 1 35 LYS HG2 . . 4.230 3.430 2.663 3.927 . 0 0 "[ . 1 . 2]" 1
848 1 35 LYS HE3 1 35 LYS HG3 . . 3.820 2.842 2.180 3.515 . 0 0 "[ . 1 . 2]" 1
849 1 35 LYS HE3 1 37 THR MG . . 4.680 4.139 3.135 4.686 0.006 9 0 "[ . 1 . 2]" 1
850 1 35 LYS HG2 1 36 LEU H . . 4.680 4.486 4.396 4.588 . 0 0 "[ . 1 . 2]" 1
851 1 35 LYS HG3 1 36 LEU H . . 3.850 2.830 2.721 2.949 . 0 0 "[ . 1 . 2]" 1
852 1 35 LYS HG3 1 77 VAL H . . 4.480 4.270 4.050 4.457 . 0 0 "[ . 1 . 2]" 1
853 1 36 LEU H 1 36 LEU HB2 . . 3.330 2.302 2.266 2.340 . 0 0 "[ . 1 . 2]" 1
854 1 36 LEU H 1 36 LEU HB3 . . 3.550 3.519 3.503 3.541 . 0 0 "[ . 1 . 2]" 1
855 1 36 LEU H 1 36 LEU MD1 . . 4.570 4.141 4.041 4.204 . 0 0 "[ . 1 . 2]" 1
856 1 36 LEU H 1 36 LEU MD2 . . 4.130 2.623 2.457 2.835 . 0 0 "[ . 1 . 2]" 1
857 1 36 LEU H 1 36 LEU HG . . 4.600 4.383 4.307 4.507 . 0 0 "[ . 1 . 2]" 1
858 1 36 LEU H 1 37 THR H . . 4.740 4.535 4.516 4.553 . 0 0 "[ . 1 . 2]" 1
859 1 36 LEU H 1 38 TRP HZ3 . . 5.200 4.819 4.685 4.986 . 0 0 "[ . 1 . 2]" 1
860 1 36 LEU H 1 76 GLN HA . . 5.060 4.771 4.660 4.896 . 0 0 "[ . 1 . 2]" 1
861 1 36 LEU H 1 76 GLN QB . . 4.760 4.381 4.200 4.664 . 0 0 "[ . 1 . 2]" 1
862 1 36 LEU H 1 77 VAL H . . 3.420 3.076 2.972 3.208 . 0 0 "[ . 1 . 2]" 1
863 1 36 LEU H 1 77 VAL MG1 . . 3.710 3.375 3.029 3.657 . 0 0 "[ . 1 . 2]" 1
864 1 36 LEU H 1 78 THR MG . . 4.940 4.779 4.571 4.916 . 0 0 "[ . 1 . 2]" 1
865 1 36 LEU H 1 79 ILE H . . 4.620 4.497 4.322 4.621 0.001 15 0 "[ . 1 . 2]" 1
866 1 36 LEU HA 1 36 LEU MD1 . . 3.350 2.001 1.957 2.131 . 0 0 "[ . 1 . 2]" 1
867 1 36 LEU HA 1 36 LEU MD2 . . 3.830 2.502 2.368 2.762 . 0 0 "[ . 1 . 2]" 1
868 1 36 LEU HA 1 36 LEU HG . . 4.140 3.675 3.646 3.685 . 0 0 "[ . 1 . 2]" 1
869 1 36 LEU HA 1 37 THR H . . 2.720 2.317 2.286 2.342 . 0 0 "[ . 1 . 2]" 1
870 1 36 LEU HA 1 37 THR HA . . 4.900 4.499 4.483 4.510 . 0 0 "[ . 1 . 2]" 1
871 1 36 LEU HA 1 37 THR MG . . 4.130 3.771 3.543 4.022 . 0 0 "[ . 1 . 2]" 1
872 1 36 LEU HA 1 38 TRP HE3 . . 5.090 4.730 4.653 4.862 . 0 0 "[ . 1 . 2]" 1
873 1 36 LEU HA 1 38 TRP HZ3 . . 5.060 4.727 4.647 4.888 . 0 0 "[ . 1 . 2]" 1
874 1 36 LEU HB2 1 36 LEU MD1 . . 3.600 3.188 3.178 3.193 . 0 0 "[ . 1 . 2]" 1
875 1 36 LEU HB2 1 36 LEU MD2 . . 3.260 2.374 2.163 2.446 . 0 0 "[ . 1 . 2]" 1
876 1 36 LEU HB2 1 37 THR H . . 4.100 4.025 3.984 4.080 . 0 0 "[ . 1 . 2]" 1
877 1 36 LEU HB2 1 38 TRP HE3 . . 4.620 4.340 4.263 4.421 . 0 0 "[ . 1 . 2]" 1
878 1 36 LEU HB2 1 38 TRP HH2 . . 4.660 4.572 4.469 4.659 . 0 0 "[ . 1 . 2]" 1
879 1 36 LEU HB2 1 38 TRP HZ3 . . 3.550 2.800 2.680 2.936 . 0 0 "[ . 1 . 2]" 1
880 1 36 LEU HB2 1 54 VAL MG2 . . 4.430 3.705 3.569 3.902 . 0 0 "[ . 1 . 2]" 1
881 1 36 LEU HB2 1 77 VAL H . . 3.880 3.111 2.998 3.260 . 0 0 "[ . 1 . 2]" 1
882 1 36 LEU HB2 1 77 VAL MG1 . . 3.590 2.277 1.961 2.644 . 0 0 "[ . 1 . 2]" 1
883 1 36 LEU HB2 1 79 ILE MD . . 4.600 4.243 4.020 4.376 . 0 0 "[ . 1 . 2]" 1
884 1 36 LEU HB3 1 36 LEU MD1 . . 3.380 2.332 2.256 2.379 . 0 0 "[ . 1 . 2]" 1
885 1 36 LEU HB3 1 36 LEU MD2 . . 3.400 3.185 3.171 3.196 . 0 0 "[ . 1 . 2]" 1
886 1 36 LEU HB3 1 37 THR H . . 3.400 2.717 2.651 2.805 . 0 0 "[ . 1 . 2]" 1
887 1 36 LEU HB3 1 37 THR HA . . 4.940 3.987 3.974 4.012 . 0 0 "[ . 1 . 2]" 1
888 1 36 LEU HB3 1 38 TRP HE3 . . 3.740 2.709 2.645 2.789 . 0 0 "[ . 1 . 2]" 1
889 1 36 LEU HB3 1 38 TRP HZ3 . . 3.640 2.086 1.999 2.235 . 0 0 "[ . 1 . 2]" 1
890 1 36 LEU HB3 1 77 VAL H . . 4.070 3.676 3.583 3.832 . 0 0 "[ . 1 . 2]" 1
891 1 36 LEU HB3 1 77 VAL MG1 . . 3.650 3.180 2.800 3.438 . 0 0 "[ . 1 . 2]" 1
892 1 36 LEU HB3 1 79 ILE MD . . 5.500 5.418 5.168 5.511 0.011 20 0 "[ . 1 . 2]" 1
893 1 36 LEU MD1 1 37 THR H . . 3.660 2.577 2.363 2.716 . 0 0 "[ . 1 . 2]" 1
894 1 36 LEU MD1 1 38 TRP HE3 . . 4.100 3.364 3.214 3.601 . 0 0 "[ . 1 . 2]" 1
895 1 36 LEU MD1 1 38 TRP HZ3 . . 4.110 3.696 3.482 3.909 . 0 0 "[ . 1 . 2]" 1
896 1 36 LEU MD1 1 54 VAL MG2 . . 4.680 4.366 4.093 4.632 . 0 0 "[ . 1 . 2]" 1
897 1 36 LEU MD1 1 90 PHE H . . 5.340 5.068 4.944 5.199 . 0 0 "[ . 1 . 2]" 1
898 1 36 LEU MD1 1 90 PHE HB2 . . 4.210 3.035 2.881 3.193 . 0 0 "[ . 1 . 2]" 1
899 1 36 LEU MD1 1 90 PHE HB3 . . 4.090 3.265 3.008 3.453 . 0 0 "[ . 1 . 2]" 1
900 1 36 LEU MD1 1 90 PHE QD . . 3.910 3.788 3.670 3.907 . 0 0 "[ . 1 . 2]" 1
901 1 36 LEU MD1 1 92 VAL MG1 . . 5.230 4.886 4.562 5.113 . 0 0 "[ . 1 . 2]" 1
902 1 36 LEU MD1 1 92 VAL MG2 . . 3.470 3.222 2.852 3.471 0.001 10 0 "[ . 1 . 2]" 1
903 1 36 LEU MD1 1 107 LEU HB3 . . 4.570 3.712 3.564 3.855 . 0 0 "[ . 1 . 2]" 1
904 1 36 LEU MD1 1 107 LEU MD1 . . 4.600 4.366 4.160 4.508 . 0 0 "[ . 1 . 2]" 1
905 1 36 LEU MD1 1 107 LEU MD2 . . 3.110 2.136 1.937 2.275 . 0 0 "[ . 1 . 2]" 1
906 1 36 LEU MD1 1 109 VAL HB . . 5.500 5.053 4.855 5.321 . 0 0 "[ . 1 . 2]" 1
907 1 36 LEU MD1 1 109 VAL MG1 . . 4.720 4.375 4.091 4.580 . 0 0 "[ . 1 . 2]" 1
908 1 36 LEU MD1 1 109 VAL MG2 . . 3.510 3.120 2.847 3.318 . 0 0 "[ . 1 . 2]" 1
909 1 36 LEU MD2 1 37 THR H . . 4.460 4.289 4.202 4.458 . 0 0 "[ . 1 . 2]" 1
910 1 36 LEU MD2 1 38 TRP HZ3 . . 4.550 4.387 4.281 4.439 . 0 0 "[ . 1 . 2]" 1
911 1 36 LEU MD2 1 54 VAL MG1 . . 3.380 3.346 3.160 3.395 0.015 14 0 "[ . 1 . 2]" 1
912 1 36 LEU MD2 1 54 VAL MG2 . . 4.920 4.255 4.023 4.388 . 0 0 "[ . 1 . 2]" 1
913 1 36 LEU MD2 1 77 VAL MG1 . . 3.870 3.531 3.219 3.835 . 0 0 "[ . 1 . 2]" 1
914 1 36 LEU MD2 1 90 PHE HB2 . . 3.970 3.872 3.766 3.971 0.001 2 0 "[ . 1 . 2]" 1
915 1 36 LEU MD2 1 90 PHE HB3 . . 3.770 3.661 3.434 3.767 . 0 0 "[ . 1 . 2]" 1
916 1 36 LEU MD2 1 90 PHE QD . . 3.510 3.088 2.870 3.309 . 0 0 "[ . 1 . 2]" 1
917 1 36 LEU MD2 1 90 PHE QE . . 3.960 3.262 3.076 3.463 . 0 0 "[ . 1 . 2]" 1
918 1 36 LEU MD2 1 90 PHE HZ . . 4.820 4.032 3.917 4.270 . 0 0 "[ . 1 . 2]" 1
919 1 36 LEU MD2 1 107 LEU HB3 . . 5.500 5.353 5.193 5.463 . 0 0 "[ . 1 . 2]" 1
920 1 36 LEU MD2 1 107 LEU MD2 . . 3.840 3.625 3.479 3.786 . 0 0 "[ . 1 . 2]" 1
921 1 36 LEU MD2 1 109 VAL HB . . 4.940 4.612 4.360 4.822 . 0 0 "[ . 1 . 2]" 1
922 1 36 LEU MD2 1 109 VAL MG1 . . 4.970 3.899 3.730 4.057 . 0 0 "[ . 1 . 2]" 1
923 1 36 LEU HG 1 37 THR H . . 4.760 4.613 4.544 4.664 . 0 0 "[ . 1 . 2]" 1
924 1 36 LEU HG 1 38 TRP HE3 . . 4.460 4.439 4.353 4.467 0.007 14 0 "[ . 1 . 2]" 1
925 1 36 LEU HG 1 38 TRP HZ3 . . 4.720 3.327 3.180 3.484 . 0 0 "[ . 1 . 2]" 1
926 1 36 LEU HG 1 77 VAL MG1 . . 3.850 3.625 3.331 3.856 0.006 9 0 "[ . 1 . 2]" 1
927 1 36 LEU HG 1 90 PHE QD . . 5.130 3.599 3.311 3.860 . 0 0 "[ . 1 . 2]" 1
928 1 37 THR H 1 37 THR HB . . 4.000 3.919 3.882 3.963 . 0 0 "[ . 1 . 2]" 1
929 1 37 THR H 1 37 THR MG . . 3.480 3.347 3.156 3.489 0.009 14 0 "[ . 1 . 2]" 1
930 1 37 THR H 1 38 TRP H . . 4.210 4.133 4.067 4.203 . 0 0 "[ . 1 . 2]" 1
931 1 37 THR H 1 38 TRP HE3 . . 4.070 3.232 3.156 3.313 . 0 0 "[ . 1 . 2]" 1
932 1 37 THR H 1 38 TRP HZ3 . . 4.820 4.346 4.246 4.431 . 0 0 "[ . 1 . 2]" 1
933 1 37 THR H 1 92 VAL MG2 . . 4.880 4.815 4.531 4.883 0.003 9 0 "[ . 1 . 2]" 1
934 1 37 THR HA 1 37 THR MG . . 3.200 2.210 2.087 2.306 . 0 0 "[ . 1 . 2]" 1
935 1 37 THR HA 1 38 TRP H . . 2.680 2.157 2.144 2.179 . 0 0 "[ . 1 . 2]" 1
936 1 37 THR HA 1 38 TRP HE3 . . 4.510 3.605 3.474 3.723 . 0 0 "[ . 1 . 2]" 1
937 1 37 THR HA 1 76 GLN QB . . 4.480 2.879 2.516 3.519 . 0 0 "[ . 1 . 2]" 1
938 1 37 THR HA 1 77 VAL H . . 5.040 3.929 3.805 4.004 . 0 0 "[ . 1 . 2]" 1
939 1 37 THR HB 1 38 TRP H . . 3.400 3.249 3.088 3.373 . 0 0 "[ . 1 . 2]" 1
940 1 37 THR HB 1 76 GLN QB . . 4.490 3.776 3.245 4.463 . 0 0 "[ . 1 . 2]" 1
941 1 37 THR MG 1 38 TRP H . . 3.990 3.807 3.705 3.973 . 0 0 "[ . 1 . 2]" 1
942 1 37 THR MG 1 76 GLN H . . 4.920 4.835 4.648 4.944 0.024 5 0 "[ . 1 . 2]" 1
943 1 37 THR MG 1 76 GLN HA . . 4.190 2.984 2.643 3.241 . 0 0 "[ . 1 . 2]" 1
944 1 37 THR MG 1 76 GLN QB . . 3.040 1.827 1.738 2.070 . 0 0 "[ . 1 . 2]" 1
945 1 37 THR MG 1 76 GLN HG2 . . 4.010 3.362 1.960 4.060 0.050 20 0 "[ . 1 . 2]" 1
946 1 37 THR MG 1 76 GLN HG3 . . 4.010 3.434 2.220 4.053 0.043 14 0 "[ . 1 . 2]" 1
947 1 38 TRP H 1 38 TRP HB3 . . 4.120 3.341 3.293 3.399 . 0 0 "[ . 1 . 2]" 1
948 1 38 TRP H 1 38 TRP HD1 . . 4.500 4.222 4.170 4.283 . 0 0 "[ . 1 . 2]" 1
949 1 38 TRP H 1 38 TRP HE3 . . 3.900 3.455 3.286 3.690 . 0 0 "[ . 1 . 2]" 1
950 1 38 TRP H 1 39 ARG H . . 4.480 4.415 4.398 4.426 . 0 0 "[ . 1 . 2]" 1
951 1 38 TRP H 1 75 MET HB2 . . 4.690 4.683 4.612 4.704 0.014 20 0 "[ . 1 . 2]" 1
952 1 38 TRP H 1 75 MET HB3 . . 3.650 3.331 3.193 3.421 . 0 0 "[ . 1 . 2]" 1
953 1 38 TRP H 1 75 MET ME . . 4.550 4.411 3.947 4.555 0.005 6 0 "[ . 1 . 2]" 1
954 1 38 TRP H 1 76 GLN HA . . 4.900 3.538 3.416 3.729 . 0 0 "[ . 1 . 2]" 1
955 1 38 TRP H 1 76 GLN QB . . 4.990 4.133 3.619 4.993 0.003 19 0 "[ . 1 . 2]" 1
956 1 38 TRP H 1 77 VAL H . . 5.500 5.485 5.393 5.512 0.012 16 0 "[ . 1 . 2]" 1
957 1 38 TRP HA 1 38 TRP HD1 . . 4.710 4.394 4.343 4.422 . 0 0 "[ . 1 . 2]" 1
958 1 38 TRP HA 1 38 TRP HE3 . . 4.560 4.308 4.267 4.380 . 0 0 "[ . 1 . 2]" 1
959 1 38 TRP HA 1 39 ARG H . . 3.000 2.456 2.361 2.520 . 0 0 "[ . 1 . 2]" 1
960 1 38 TRP HA 1 39 ARG QG . . 4.930 3.964 3.369 4.976 0.046 11 0 "[ . 1 . 2]" 1
961 1 38 TRP HB2 1 38 TRP HE3 . . 4.110 4.075 4.043 4.094 . 0 0 "[ . 1 . 2]" 1
962 1 38 TRP HB2 1 39 ARG H . . 3.130 2.329 2.195 2.542 . 0 0 "[ . 1 . 2]" 1
963 1 38 TRP HB3 1 38 TRP HE3 . . 3.780 2.519 2.485 2.543 . 0 0 "[ . 1 . 2]" 1
964 1 38 TRP HB3 1 39 ARG H . . 3.790 3.696 3.615 3.804 0.014 7 0 "[ . 1 . 2]" 1
965 1 38 TRP HD1 1 39 ARG H . . 4.010 3.493 3.361 3.770 . 0 0 "[ . 1 . 2]" 1
966 1 38 TRP HD1 1 40 THR HA . . 4.480 3.991 3.922 4.077 . 0 0 "[ . 1 . 2]" 1
967 1 38 TRP HD1 1 75 MET HA . . 5.000 3.938 3.719 4.188 . 0 0 "[ . 1 . 2]" 1
968 1 38 TRP HD1 1 75 MET HB3 . . 4.740 4.614 4.446 4.748 0.008 16 0 "[ . 1 . 2]" 1
969 1 38 TRP HD1 1 75 MET ME . . 3.620 2.196 1.987 2.478 . 0 0 "[ . 1 . 2]" 1
970 1 38 TRP HD1 1 75 MET HG2 . . 5.500 5.332 5.106 5.477 . 0 0 "[ . 1 . 2]" 1
971 1 38 TRP HD1 1 92 VAL MG1 . . 4.960 3.841 3.512 4.197 . 0 0 "[ . 1 . 2]" 1
972 1 38 TRP HE1 1 52 TYR HD2 . . 4.140 3.323 2.991 3.587 . 0 0 "[ . 1 . 2]" 1
973 1 38 TRP HE1 1 69 THR MG . . 5.150 4.702 4.491 4.901 . 0 0 "[ . 1 . 2]" 1
974 1 38 TRP HE1 1 75 MET HA . . 3.710 3.205 2.968 3.421 . 0 0 "[ . 1 . 2]" 1
975 1 38 TRP HE1 1 75 MET ME . . 3.760 2.168 1.970 2.347 . 0 0 "[ . 1 . 2]" 1
976 1 38 TRP HE1 1 75 MET HG2 . . 5.210 4.971 4.737 5.177 . 0 0 "[ . 1 . 2]" 1
977 1 38 TRP HE1 1 92 VAL MG1 . . 4.480 3.306 3.102 3.499 . 0 0 "[ . 1 . 2]" 1
978 1 38 TRP HE3 1 54 VAL MG2 . . 4.580 4.297 4.175 4.449 . 0 0 "[ . 1 . 2]" 1
979 1 38 TRP HE3 1 92 VAL MG1 . . 4.250 3.244 3.014 3.368 . 0 0 "[ . 1 . 2]" 1
980 1 38 TRP HE3 1 92 VAL MG2 . . 4.090 2.522 2.228 2.693 . 0 0 "[ . 1 . 2]" 1
981 1 38 TRP HH2 1 52 TYR HB2 . . 4.770 3.935 3.781 4.117 . 0 0 "[ . 1 . 2]" 1
982 1 38 TRP HH2 1 52 TYR HB3 . . 5.060 3.721 3.577 3.921 . 0 0 "[ . 1 . 2]" 1
983 1 38 TRP HH2 1 54 VAL MG2 . . 3.620 2.268 2.069 2.435 . 0 0 "[ . 1 . 2]" 1
984 1 38 TRP HH2 1 69 THR MG . . 3.350 2.755 2.503 2.868 . 0 0 "[ . 1 . 2]" 1
985 1 38 TRP HH2 1 77 VAL H . . 4.830 4.189 3.976 4.406 . 0 0 "[ . 1 . 2]" 1
986 1 38 TRP HH2 1 77 VAL HB . . 3.670 2.821 2.483 3.149 . 0 0 "[ . 1 . 2]" 1
987 1 38 TRP HH2 1 77 VAL MG1 . . 3.250 2.065 1.939 2.338 . 0 0 "[ . 1 . 2]" 1
988 1 38 TRP HH2 1 77 VAL MG2 . . 4.170 3.939 3.616 4.182 0.012 20 0 "[ . 1 . 2]" 1
989 1 38 TRP HH2 1 92 VAL MG1 . . 4.830 3.073 2.844 3.247 . 0 0 "[ . 1 . 2]" 1
990 1 38 TRP HZ2 1 52 TYR H . . 5.320 4.693 4.517 4.916 . 0 0 "[ . 1 . 2]" 1
991 1 38 TRP HZ2 1 52 TYR HB2 . . 3.660 2.106 2.020 2.234 . 0 0 "[ . 1 . 2]" 1
992 1 38 TRP HZ2 1 52 TYR HB3 . . 3.960 2.099 2.005 2.222 . 0 0 "[ . 1 . 2]" 1
993 1 38 TRP HZ2 1 53 SER H . . 5.500 5.274 5.133 5.428 . 0 0 "[ . 1 . 2]" 1
994 1 38 TRP HZ2 1 54 VAL MG2 . . 4.550 3.789 3.581 3.933 . 0 0 "[ . 1 . 2]" 1
995 1 38 TRP HZ2 1 69 THR HB . . 5.500 5.123 4.806 5.309 . 0 0 "[ . 1 . 2]" 1
996 1 38 TRP HZ2 1 69 THR MG . . 3.360 2.618 2.375 2.763 . 0 0 "[ . 1 . 2]" 1
997 1 38 TRP HZ2 1 75 MET HA . . 4.580 4.243 4.103 4.473 . 0 0 "[ . 1 . 2]" 1
998 1 38 TRP HZ2 1 76 GLN H . . 5.290 4.667 4.375 5.018 . 0 0 "[ . 1 . 2]" 1
999 1 38 TRP HZ2 1 77 VAL MG1 . . 4.340 4.179 3.991 4.313 . 0 0 "[ . 1 . 2]" 1
1000 1 38 TRP HZ2 1 92 VAL MG1 . . 4.550 3.017 2.850 3.122 . 0 0 "[ . 1 . 2]" 1
1001 1 38 TRP HZ3 1 54 VAL MG1 . . 4.070 3.921 3.706 4.064 . 0 0 "[ . 1 . 2]" 1
1002 1 38 TRP HZ3 1 54 VAL MG2 . . 3.710 2.550 2.398 2.728 . 0 0 "[ . 1 . 2]" 1
1003 1 38 TRP HZ3 1 69 THR MG . . 4.760 4.665 4.438 4.762 0.002 1 0 "[ . 1 . 2]" 1
1004 1 38 TRP HZ3 1 76 GLN HA . . 4.580 4.019 3.612 4.452 . 0 0 "[ . 1 . 2]" 1
1005 1 38 TRP HZ3 1 77 VAL H . . 3.820 3.684 3.436 3.816 . 0 0 "[ . 1 . 2]" 1
1006 1 38 TRP HZ3 1 77 VAL HB . . 4.670 4.233 3.859 4.551 . 0 0 "[ . 1 . 2]" 1
1007 1 38 TRP HZ3 1 77 VAL MG1 . . 3.340 2.369 2.013 2.663 . 0 0 "[ . 1 . 2]" 1
1008 1 38 TRP HZ3 1 92 VAL MG1 . . 5.160 3.269 2.934 3.509 . 0 0 "[ . 1 . 2]" 1
1009 1 38 TRP HZ3 1 92 VAL MG2 . . 4.660 2.988 2.540 3.183 . 0 0 "[ . 1 . 2]" 1
1010 1 39 ARG H 1 39 ARG HB2 . . 3.770 2.607 2.266 3.722 . 0 0 "[ . 1 . 2]" 1
1011 1 39 ARG H 1 39 ARG HB3 . . 3.770 3.492 2.683 3.708 . 0 0 "[ . 1 . 2]" 1
1012 1 39 ARG H 1 39 ARG QD . . 4.520 3.937 2.316 4.542 0.022 7 0 "[ . 1 . 2]" 1
1013 1 39 ARG H 1 39 ARG HG2 . . 4.290 3.334 2.209 4.268 . 0 0 "[ . 1 . 2]" 1
1014 1 39 ARG H 1 39 ARG QG . . 3.680 2.853 2.166 3.691 0.011 16 0 "[ . 1 . 2]" 1
1015 1 39 ARG H 1 39 ARG HG3 . . 4.290 3.466 2.748 4.358 0.068 11 0 "[ . 1 . 2]" 1
1016 1 39 ARG H 1 40 THR H . . 4.570 4.478 4.456 4.494 . 0 0 "[ . 1 . 2]" 1
1017 1 39 ARG H 1 75 MET ME . . 4.960 4.600 4.315 4.790 . 0 0 "[ . 1 . 2]" 1
1018 1 39 ARG HA 1 75 MET ME . . 5.080 3.636 3.359 3.759 . 0 0 "[ . 1 . 2]" 1
1019 1 39 ARG QB 1 40 THR H . . 3.150 2.069 2.004 2.221 . 0 0 "[ . 1 . 2]" 1
1020 1 39 ARG HB2 1 39 ARG QD . . 3.570 2.805 2.177 3.493 . 0 0 "[ . 1 . 2]" 1
1021 1 39 ARG HB2 1 40 THR H . . 3.680 3.207 2.174 3.563 . 0 0 "[ . 1 . 2]" 1
1022 1 39 ARG HB3 1 39 ARG QD . . 3.570 2.536 2.086 3.411 . 0 0 "[ . 1 . 2]" 1
1023 1 39 ARG HB3 1 40 THR H . . 3.680 2.308 2.020 3.700 0.020 19 0 "[ . 1 . 2]" 1
1024 1 39 ARG QD 1 40 THR H . . 4.460 3.926 3.266 4.526 0.066 11 0 "[ . 1 . 2]" 1
1025 1 39 ARG QG 1 40 THR H . . 4.130 3.581 2.657 4.136 0.006 20 0 "[ . 1 . 2]" 1
1026 1 39 ARG HG2 1 40 THR H . . 4.780 4.150 3.285 4.658 . 0 0 "[ . 1 . 2]" 1
1027 1 39 ARG HG3 1 40 THR H . . 4.780 4.190 2.693 4.717 . 0 0 "[ . 1 . 2]" 1
1028 1 40 THR H 1 40 THR HB . . 3.590 3.536 3.512 3.614 0.024 10 0 "[ . 1 . 2]" 1
1029 1 40 THR H 1 40 THR MG . . 2.980 2.818 2.497 2.922 . 0 0 "[ . 1 . 2]" 1
1030 1 40 THR H 1 41 PRO HD2 . . 4.810 4.807 4.793 4.811 0.001 13 0 "[ . 1 . 2]" 1
1031 1 40 THR H 1 41 PRO HD3 . . 5.000 4.972 4.942 5.008 0.008 18 0 "[ . 1 . 2]" 1
1032 1 40 THR H 1 75 MET ME . . 3.810 3.767 3.555 3.813 0.003 20 0 "[ . 1 . 2]" 1
1033 1 40 THR HA 1 40 THR MG . . 3.400 2.203 2.090 2.300 . 0 0 "[ . 1 . 2]" 1
1034 1 40 THR HA 1 41 PRO HD2 . . 3.570 2.255 2.215 2.316 . 0 0 "[ . 1 . 2]" 1
1035 1 40 THR HA 1 41 PRO HD3 . . 3.530 2.261 2.255 2.273 . 0 0 "[ . 1 . 2]" 1
1036 1 40 THR HA 1 41 PRO HG3 . . 4.450 4.394 4.375 4.425 . 0 0 "[ . 1 . 2]" 1
1037 1 40 THR HA 1 50 LEU MD1 . . 5.150 4.866 4.762 4.950 . 0 0 "[ . 1 . 2]" 1
1038 1 40 THR HA 1 75 MET ME . . 3.800 2.299 2.146 2.482 . 0 0 "[ . 1 . 2]" 1
1039 1 40 THR HB 1 41 PRO HD2 . . 3.900 2.515 2.342 2.650 . 0 0 "[ . 1 . 2]" 1
1040 1 40 THR HB 1 41 PRO HD3 . . 4.440 3.871 3.744 3.976 . 0 0 "[ . 1 . 2]" 1
1041 1 40 THR HB 1 45 PRO HA . . 3.800 2.457 2.226 2.785 . 0 0 "[ . 1 . 2]" 1
1042 1 40 THR HB 1 50 LEU MD1 . . 5.500 5.403 5.100 5.498 . 0 0 "[ . 1 . 2]" 1
1043 1 40 THR HB 1 75 MET ME . . 4.600 4.363 4.166 4.605 0.005 18 0 "[ . 1 . 2]" 1
1044 1 40 THR MG 1 41 PRO HD2 . . 4.040 2.599 2.453 3.115 . 0 0 "[ . 1 . 2]" 1
1045 1 40 THR MG 1 41 PRO HD3 . . 4.000 3.588 3.470 3.942 . 0 0 "[ . 1 . 2]" 1
1046 1 40 THR MG 1 44 ASP HB3 . . 5.500 4.363 3.872 5.173 . 0 0 "[ . 1 . 2]" 1
1047 1 40 THR MG 1 45 PRO HA . . 3.880 3.577 3.439 3.757 . 0 0 "[ . 1 . 2]" 1
1048 1 40 THR MG 1 45 PRO HB3 . . 5.500 5.307 5.172 5.507 0.007 19 0 "[ . 1 . 2]" 1
1049 1 40 THR MG 1 47 GLY H . . 4.110 3.103 2.854 3.434 . 0 0 "[ . 1 . 2]" 1
1050 1 40 THR MG 1 47 GLY HA2 . . 4.220 3.923 3.703 4.177 . 0 0 "[ . 1 . 2]" 1
1051 1 40 THR MG 1 47 GLY HA3 . . 3.550 2.622 2.331 2.822 . 0 0 "[ . 1 . 2]" 1
1052 1 40 THR MG 1 48 ASP QB . . 5.500 4.990 4.707 5.488 . 0 0 "[ . 1 . 2]" 1
1053 1 40 THR MG 1 52 TYR HH . . 4.230 3.013 2.407 3.916 . 0 0 "[ . 1 . 2]" 1
1054 1 40 THR MG 1 75 MET ME . . 2.940 2.438 2.040 2.650 . 0 0 "[ . 1 . 2]" 1
1055 1 40 THR MG 1 75 MET HG2 . . 4.960 3.857 3.724 4.060 . 0 0 "[ . 1 . 2]" 1
1056 1 41 PRO HA 1 42 ALA H . . 3.100 2.263 2.219 2.322 . 0 0 "[ . 1 . 2]" 1
1057 1 41 PRO HA 1 42 ALA HA . . 4.610 4.322 4.315 4.329 . 0 0 "[ . 1 . 2]" 1
1058 1 41 PRO HA 1 42 ALA MB . . 4.550 4.039 3.982 4.080 . 0 0 "[ . 1 . 2]" 1
1059 1 41 PRO HA 1 44 ASP H . . 4.520 4.513 4.405 4.531 0.011 12 0 "[ . 1 . 2]" 1
1060 1 41 PRO HB2 1 42 ALA H . . 3.930 3.006 2.826 3.156 . 0 0 "[ . 1 . 2]" 1
1061 1 41 PRO HB2 1 42 ALA MB . . 5.360 4.248 4.166 4.359 . 0 0 "[ . 1 . 2]" 1
1062 1 41 PRO HB2 1 43 SER H . . 3.650 2.550 2.365 2.670 . 0 0 "[ . 1 . 2]" 1
1063 1 41 PRO HB2 1 44 ASP H . . 3.540 2.674 2.472 2.775 . 0 0 "[ . 1 . 2]" 1
1064 1 41 PRO HB2 1 44 ASP HB2 . . 4.630 3.975 3.859 4.228 . 0 0 "[ . 1 . 2]" 1
1065 1 41 PRO HB2 1 44 ASP HB3 . . 5.500 5.462 5.349 5.560 0.060 19 0 "[ . 1 . 2]" 1
1066 1 41 PRO HB3 1 42 ALA H . . 4.040 3.670 3.567 3.759 . 0 0 "[ . 1 . 2]" 1
1067 1 41 PRO HB3 1 43 SER H . . 4.310 4.203 4.023 4.316 0.006 16 0 "[ . 1 . 2]" 1
1068 1 41 PRO HB3 1 44 ASP H . . 4.360 4.213 4.036 4.294 . 0 0 "[ . 1 . 2]" 1
1069 1 41 PRO HB3 1 44 ASP HB2 . . 4.980 4.823 4.749 4.863 . 0 0 "[ . 1 . 2]" 1
1070 1 41 PRO HB3 1 94 ALA MB . . 4.850 3.609 3.436 3.814 . 0 0 "[ . 1 . 2]" 1
1071 1 41 PRO HD2 1 44 ASP HB2 . . 4.550 3.351 2.733 3.561 . 0 0 "[ . 1 . 2]" 1
1072 1 41 PRO HD2 1 44 ASP HB3 . . 4.680 3.897 3.551 4.627 . 0 0 "[ . 1 . 2]" 1
1073 1 41 PRO HD2 1 50 LEU MD1 . . 3.630 3.552 3.450 3.643 0.013 18 0 "[ . 1 . 2]" 1
1074 1 41 PRO HD2 1 50 LEU MD2 . . 5.500 4.422 4.231 4.722 . 0 0 "[ . 1 . 2]" 1
1075 1 41 PRO HD2 1 94 ALA MB . . 4.870 4.647 4.458 4.821 . 0 0 "[ . 1 . 2]" 1
1076 1 41 PRO HD3 1 44 ASP H . . 5.500 4.978 4.868 5.033 . 0 0 "[ . 1 . 2]" 1
1077 1 41 PRO HD3 1 44 ASP HB2 . . 4.540 4.425 3.957 4.545 0.005 11 0 "[ . 1 . 2]" 1
1078 1 41 PRO HD3 1 50 LEU MD1 . . 4.010 3.758 3.657 3.833 . 0 0 "[ . 1 . 2]" 1
1079 1 41 PRO HD3 1 94 ALA MB . . 4.190 3.878 3.766 3.973 . 0 0 "[ . 1 . 2]" 1
1080 1 41 PRO HG2 1 44 ASP H . . 4.900 2.148 2.041 2.223 . 0 0 "[ . 1 . 2]" 1
1081 1 41 PRO HG2 1 44 ASP HA . . 4.740 4.093 3.894 4.205 . 0 0 "[ . 1 . 2]" 1
1082 1 41 PRO HG2 1 44 ASP HB2 . . 4.460 1.992 1.969 1.999 . 0 0 "[ . 1 . 2]" 1
1083 1 41 PRO HG2 1 50 LEU MD1 . . 4.130 3.577 3.438 3.750 . 0 0 "[ . 1 . 2]" 1
1084 1 41 PRO HG3 1 44 ASP H . . 5.100 3.741 3.552 3.846 . 0 0 "[ . 1 . 2]" 1
1085 1 41 PRO HG3 1 44 ASP HB2 . . 4.670 3.041 2.886 3.127 . 0 0 "[ . 1 . 2]" 1
1086 1 41 PRO HG3 1 44 ASP HB3 . . 4.660 4.393 4.204 4.579 . 0 0 "[ . 1 . 2]" 1
1087 1 41 PRO HG3 1 50 LEU MD1 . . 3.740 3.013 2.858 3.121 . 0 0 "[ . 1 . 2]" 1
1088 1 41 PRO HG3 1 50 LEU MD2 . . 4.770 3.538 3.160 3.750 . 0 0 "[ . 1 . 2]" 1
1089 1 41 PRO HG3 1 94 ALA MB . . 3.600 2.750 2.605 2.901 . 0 0 "[ . 1 . 2]" 1
1090 1 42 ALA H 1 42 ALA MB . . 3.060 2.117 2.026 2.232 . 0 0 "[ . 1 . 2]" 1
1091 1 42 ALA H 1 43 SER H . . 3.520 2.743 2.647 2.820 . 0 0 "[ . 1 . 2]" 1
1092 1 42 ALA H 1 44 ASP H . . 4.770 4.266 4.096 4.381 . 0 0 "[ . 1 . 2]" 1
1093 1 42 ALA HA 1 44 ASP H . . 4.660 4.464 4.247 4.670 0.010 3 0 "[ . 1 . 2]" 1
1094 1 42 ALA HA 1 45 PRO HB3 . . 5.490 5.029 4.692 5.432 . 0 0 "[ . 1 . 2]" 1
1095 1 42 ALA HA 1 45 PRO HD3 . . 5.380 5.030 4.750 5.331 . 0 0 "[ . 1 . 2]" 1
1096 1 42 ALA MB 1 43 SER H . . 3.450 2.708 2.552 2.927 . 0 0 "[ . 1 . 2]" 1
1097 1 42 ALA MB 1 43 SER HA . . 4.310 3.785 3.689 3.860 . 0 0 "[ . 1 . 2]" 1
1098 1 42 ALA MB 1 44 ASP H . . 4.810 4.602 4.487 4.771 . 0 0 "[ . 1 . 2]" 1
1099 1 43 SER H 1 43 SER QB . . 3.110 2.333 2.194 2.495 . 0 0 "[ . 1 . 2]" 1
1100 1 43 SER H 1 43 SER HG . . 4.370 3.356 2.118 4.341 . 0 0 "[ . 1 . 2]" 1
1101 1 43 SER H 1 44 ASP H . . 3.370 2.576 2.390 2.663 . 0 0 "[ . 1 . 2]" 1
1102 1 43 SER H 1 44 ASP HB2 . . 5.500 4.982 4.767 5.435 . 0 0 "[ . 1 . 2]" 1
1103 1 43 SER HA 1 45 PRO HD3 . . 4.930 4.469 4.207 4.828 . 0 0 "[ . 1 . 2]" 1
1104 1 43 SER QB 1 44 ASP H . . 3.950 2.975 2.559 3.487 . 0 0 "[ . 1 . 2]" 1
1105 1 43 SER HG 1 44 ASP H . . 4.360 3.301 1.896 4.275 . 0 0 "[ . 1 . 2]" 1
1106 1 44 ASP H 1 44 ASP HB2 . . 3.470 2.604 2.461 2.986 . 0 0 "[ . 1 . 2]" 1
1107 1 44 ASP H 1 44 ASP HB3 . . 3.730 3.676 3.607 3.785 0.055 18 0 "[ . 1 . 2]" 1
1108 1 44 ASP H 1 45 PRO HA . . 5.500 4.773 4.689 4.878 . 0 0 "[ . 1 . 2]" 1
1109 1 44 ASP H 1 45 PRO HD2 . . 4.770 4.494 4.436 4.588 . 0 0 "[ . 1 . 2]" 1
1110 1 44 ASP H 1 45 PRO HD3 . . 4.180 3.984 3.882 4.151 . 0 0 "[ . 1 . 2]" 1
1111 1 44 ASP H 1 50 LEU MD1 . . 5.470 5.097 4.902 5.285 . 0 0 "[ . 1 . 2]" 1
1112 1 44 ASP HA 1 45 PRO HD2 . . 3.250 1.916 1.913 1.921 . 0 0 "[ . 1 . 2]" 1
1113 1 44 ASP HA 1 45 PRO HD3 . . 3.420 2.530 2.430 2.579 . 0 0 "[ . 1 . 2]" 1
1114 1 44 ASP HA 1 45 PRO HG2 . . 4.390 4.116 4.114 4.126 . 0 0 "[ . 1 . 2]" 1
1115 1 44 ASP HA 1 45 PRO HG3 . . 4.820 4.398 4.348 4.426 . 0 0 "[ . 1 . 2]" 1
1116 1 44 ASP HB2 1 50 LEU MD1 . . 3.460 3.031 2.821 3.258 . 0 0 "[ . 1 . 2]" 1
1117 1 44 ASP HB2 1 50 LEU MD2 . . 3.840 2.225 1.972 2.751 . 0 0 "[ . 1 . 2]" 1
1118 1 44 ASP HB2 1 50 LEU HG . . 4.800 4.497 4.323 4.681 . 0 0 "[ . 1 . 2]" 1
1119 1 44 ASP HB3 1 45 PRO HD2 . . 4.940 3.833 3.653 3.960 . 0 0 "[ . 1 . 2]" 1
1120 1 44 ASP HB3 1 45 PRO HG2 . . 5.500 5.450 5.247 5.528 0.028 5 0 "[ . 1 . 2]" 1
1121 1 44 ASP HB3 1 47 GLY HA2 . . 4.710 2.497 2.288 2.988 . 0 0 "[ . 1 . 2]" 1
1122 1 44 ASP HB3 1 47 GLY HA3 . . 5.110 3.446 3.083 4.173 . 0 0 "[ . 1 . 2]" 1
1123 1 44 ASP HB3 1 49 ASN HD21 . . 5.380 4.862 4.471 5.381 0.001 2 0 "[ . 1 . 2]" 1
1124 1 44 ASP HB3 1 49 ASN QD . . 4.700 3.808 3.298 4.293 . 0 0 "[ . 1 . 2]" 1
1125 1 44 ASP HB3 1 49 ASN HD22 . . 5.380 4.020 3.395 5.384 0.004 8 0 "[ . 1 . 2]" 1
1126 1 44 ASP HB3 1 50 LEU MD1 . . 3.730 3.326 3.043 3.700 . 0 0 "[ . 1 . 2]" 1
1127 1 44 ASP HB3 1 50 LEU MD2 . . 3.750 2.493 2.182 2.767 . 0 0 "[ . 1 . 2]" 1
1128 1 44 ASP HB3 1 50 LEU HG . . 4.980 3.998 3.737 4.205 . 0 0 "[ . 1 . 2]" 1
1129 1 45 PRO HD2 1 46 HIS HD2 . . 5.250 4.280 3.427 5.231 . 0 0 "[ . 1 . 2]" 1
1130 1 45 PRO HG2 1 46 HIS H . . 4.430 2.914 2.078 3.177 . 0 0 "[ . 1 . 2]" 1
1131 1 45 PRO HG2 1 46 HIS HD2 . . 4.330 2.706 2.054 3.373 . 0 0 "[ . 1 . 2]" 1
1132 1 46 HIS H 1 47 GLY H . . 4.340 1.950 1.856 2.317 . 0 0 "[ . 1 . 2]" 1
1133 1 46 HIS QB 1 47 GLY H . . 3.980 2.982 2.890 3.471 . 0 0 "[ . 1 . 2]" 1
1134 1 46 HIS HB2 1 47 GLY H . . 4.680 3.123 2.974 3.673 . 0 0 "[ . 1 . 2]" 1
1135 1 46 HIS HB2 1 48 ASP H . . 4.290 3.281 2.634 3.529 . 0 0 "[ . 1 . 2]" 1
1136 1 46 HIS HB3 1 47 GLY H . . 4.680 3.794 3.620 4.289 . 0 0 "[ . 1 . 2]" 1
1137 1 46 HIS HB3 1 48 ASP H . . 4.290 3.009 2.577 4.291 0.001 10 0 "[ . 1 . 2]" 1
1138 1 47 GLY H 1 48 ASP H . . 3.860 3.052 2.990 3.090 . 0 0 "[ . 1 . 2]" 1
1139 1 47 GLY H 1 50 LEU MD1 . . 4.830 3.793 3.663 4.142 . 0 0 "[ . 1 . 2]" 1
1140 1 47 GLY HA2 1 50 LEU H . . 4.170 3.808 3.620 4.052 . 0 0 "[ . 1 . 2]" 1
1141 1 47 GLY HA2 1 50 LEU MD1 . . 3.710 2.030 1.875 2.366 . 0 0 "[ . 1 . 2]" 1
1142 1 47 GLY HA2 1 50 LEU MD2 . . 5.050 2.545 2.387 2.841 . 0 0 "[ . 1 . 2]" 1
1143 1 47 GLY HA2 1 50 LEU HG . . 4.320 2.296 2.098 2.509 . 0 0 "[ . 1 . 2]" 1
1144 1 47 GLY HA3 1 50 LEU MD1 . . 3.880 2.234 2.055 2.549 . 0 0 "[ . 1 . 2]" 1
1145 1 47 GLY HA3 1 50 LEU HG . . 4.600 3.689 3.460 3.987 . 0 0 "[ . 1 . 2]" 1
1146 1 47 GLY HA3 1 75 MET ME . . 4.840 3.758 3.423 4.094 . 0 0 "[ . 1 . 2]" 1
1147 1 48 ASP H 1 48 ASP QB . . 3.040 2.322 2.218 2.371 . 0 0 "[ . 1 . 2]" 1
1148 1 48 ASP H 1 49 ASN H . . 3.720 2.205 2.126 2.308 . 0 0 "[ . 1 . 2]" 1
1149 1 48 ASP H 1 50 LEU H . . 4.920 3.996 3.845 4.099 . 0 0 "[ . 1 . 2]" 1
1150 1 48 ASP H 1 50 LEU HG . . 4.670 3.805 3.633 4.011 . 0 0 "[ . 1 . 2]" 1
1151 1 48 ASP HA 1 50 LEU H . . 3.850 3.660 3.551 3.766 . 0 0 "[ . 1 . 2]" 1
1152 1 48 ASP QB 1 49 ASN H . . 3.780 3.105 2.933 3.251 . 0 0 "[ . 1 . 2]" 1
1153 1 48 ASP QB 1 49 ASN HD21 . . 5.500 4.378 2.975 5.485 . 0 0 "[ . 1 . 2]" 1
1154 1 48 ASP QB 1 49 ASN HD22 . . 5.500 4.893 3.553 5.430 . 0 0 "[ . 1 . 2]" 1
1155 1 48 ASP QB 1 50 LEU H . . 4.720 4.694 4.548 4.746 0.026 20 0 "[ . 1 . 2]" 1
1156 1 49 ASN H 1 49 ASN QB . . 3.420 2.924 2.613 3.071 . 0 0 "[ . 1 . 2]" 1
1157 1 49 ASN H 1 49 ASN QD . . 4.570 2.226 1.824 2.508 . 0 0 "[ . 1 . 2]" 1
1158 1 49 ASN H 1 50 LEU H . . 3.140 2.497 2.365 2.698 . 0 0 "[ . 1 . 2]" 1
1159 1 49 ASN H 1 50 LEU MD1 . . 4.940 3.886 3.713 4.105 . 0 0 "[ . 1 . 2]" 1
1160 1 49 ASN H 1 50 LEU HG . . 4.470 2.770 2.684 2.883 . 0 0 "[ . 1 . 2]" 1
1161 1 49 ASN HA 1 49 ASN QD . . 4.610 3.715 3.582 4.004 . 0 0 "[ . 1 . 2]" 1
1162 1 49 ASN HA 1 50 LEU H . . 3.330 3.051 2.941 3.137 . 0 0 "[ . 1 . 2]" 1
1163 1 49 ASN HA 1 50 LEU HG . . 5.060 4.589 4.423 4.674 . 0 0 "[ . 1 . 2]" 1
1164 1 49 ASN QB 1 49 ASN QD . . 2.970 2.368 2.146 2.524 . 0 0 "[ . 1 . 2]" 1
1165 1 49 ASN QB 1 50 LEU H . . 4.170 3.952 3.704 4.018 . 0 0 "[ . 1 . 2]" 1
1166 1 49 ASN HB2 1 50 LEU H . . 4.910 4.332 3.913 4.537 . 0 0 "[ . 1 . 2]" 1
1167 1 49 ASN HB3 1 50 LEU H . . 4.910 4.575 4.457 4.657 . 0 0 "[ . 1 . 2]" 1
1168 1 49 ASN QD 1 50 LEU MD2 . . 4.470 2.645 2.006 3.604 . 0 0 "[ . 1 . 2]" 1
1169 1 49 ASN HD21 1 50 LEU MD2 . . 5.120 3.243 2.129 4.676 . 0 0 "[ . 1 . 2]" 1
1170 1 49 ASN HD22 1 50 LEU MD2 . . 5.120 2.940 2.311 5.112 . 0 0 "[ . 1 . 2]" 1
1171 1 50 LEU H 1 50 LEU HB2 . . 4.110 3.753 3.698 3.795 . 0 0 "[ . 1 . 2]" 1
1172 1 50 LEU H 1 50 LEU QB . . 3.510 3.262 3.210 3.301 . 0 0 "[ . 1 . 2]" 1
1173 1 50 LEU H 1 50 LEU HB3 . . 4.110 3.583 3.520 3.660 . 0 0 "[ . 1 . 2]" 1
1174 1 50 LEU H 1 50 LEU MD1 . . 3.200 2.895 2.698 3.011 . 0 0 "[ . 1 . 2]" 1
1175 1 50 LEU H 1 50 LEU MD2 . . 3.890 3.862 3.804 3.895 0.005 19 0 "[ . 1 . 2]" 1
1176 1 50 LEU H 1 50 LEU HG . . 2.920 2.227 2.134 2.280 . 0 0 "[ . 1 . 2]" 1
1177 1 50 LEU H 1 51 THR H . . 4.420 4.260 4.213 4.369 . 0 0 "[ . 1 . 2]" 1
1178 1 50 LEU H 1 72 PRO HB2 . . 4.610 4.072 3.637 4.437 . 0 0 "[ . 1 . 2]" 1
1179 1 50 LEU H 1 72 PRO HB3 . . 5.500 5.236 4.838 5.499 . 0 0 "[ . 1 . 2]" 1
1180 1 50 LEU H 1 73 GLY H . . 4.670 4.665 4.515 4.685 0.015 20 0 "[ . 1 . 2]" 1
1181 1 50 LEU HA 1 50 LEU MD2 . . 4.790 3.965 3.924 3.988 . 0 0 "[ . 1 . 2]" 1
1182 1 50 LEU QB 1 50 LEU MD2 . . 2.950 2.036 1.945 2.073 . 0 0 "[ . 1 . 2]" 1
1183 1 50 LEU QB 1 51 THR H . . 3.690 3.029 2.852 3.129 . 0 0 "[ . 1 . 2]" 1
1184 1 50 LEU QB 1 94 ALA MB . . 3.590 3.106 2.895 3.283 . 0 0 "[ . 1 . 2]" 1
1185 1 50 LEU QB 1 95 GLN H . . 4.060 2.421 2.274 2.538 . 0 0 "[ . 1 . 2]" 1
1186 1 50 LEU QB 1 96 ASN HD21 . . 4.650 3.891 3.801 4.067 . 0 0 "[ . 1 . 2]" 1
1187 1 50 LEU HB2 1 51 THR H . . 4.200 3.166 2.956 3.284 . 0 0 "[ . 1 . 2]" 1
1188 1 50 LEU HB3 1 51 THR H . . 4.200 3.864 3.750 3.940 . 0 0 "[ . 1 . 2]" 1
1189 1 50 LEU MD1 1 51 THR H . . 4.480 4.124 3.966 4.244 . 0 0 "[ . 1 . 2]" 1
1190 1 50 LEU MD1 1 94 ALA MB . . 3.240 2.309 2.092 2.564 . 0 0 "[ . 1 . 2]" 1
1191 1 50 LEU MD1 1 95 GLN H . . 4.050 3.066 2.896 3.198 . 0 0 "[ . 1 . 2]" 1
1192 1 50 LEU MD2 1 94 ALA MB . . 3.420 3.050 2.911 3.241 . 0 0 "[ . 1 . 2]" 1
1193 1 50 LEU MD2 1 95 GLN H . . 4.420 4.198 4.080 4.334 . 0 0 "[ . 1 . 2]" 1
1194 1 50 LEU MD2 1 96 ASN H . . 4.550 4.452 4.267 4.558 0.008 15 0 "[ . 1 . 2]" 1
1195 1 50 LEU MD2 1 96 ASN HA . . 4.120 3.990 3.803 4.123 0.003 12 0 "[ . 1 . 2]" 1
1196 1 50 LEU MD2 1 96 ASN HB2 . . 3.630 3.446 3.215 3.623 . 0 0 "[ . 1 . 2]" 1
1197 1 50 LEU MD2 1 96 ASN HB3 . . 3.810 2.379 2.188 2.509 . 0 0 "[ . 1 . 2]" 1
1198 1 50 LEU MD2 1 96 ASN HD21 . . 3.970 3.851 3.712 3.970 0.000 16 0 "[ . 1 . 2]" 1
1199 1 50 LEU MD2 1 96 ASN HD22 . . 5.080 4.929 4.755 5.062 . 0 0 "[ . 1 . 2]" 1
1200 1 50 LEU HG 1 96 ASN HB3 . . 5.360 4.343 4.216 4.549 . 0 0 "[ . 1 . 2]" 1
1201 1 51 THR H 1 51 THR MG . . 3.840 3.740 3.718 3.774 . 0 0 "[ . 1 . 2]" 1
1202 1 51 THR H 1 52 TYR H . . 4.690 4.579 4.521 4.613 . 0 0 "[ . 1 . 2]" 1
1203 1 51 THR H 1 95 GLN H . . 3.540 3.428 3.201 3.541 0.001 11 0 "[ . 1 . 2]" 1
1204 1 51 THR H 1 95 GLN QB . . 4.390 3.201 3.053 3.292 . 0 0 "[ . 1 . 2]" 1
1205 1 51 THR HA 1 73 GLY H . . 3.650 2.440 2.123 2.819 . 0 0 "[ . 1 . 2]" 1
1206 1 51 THR HB 1 52 TYR H . . 3.310 3.093 2.779 3.326 0.016 14 0 "[ . 1 . 2]" 1
1207 1 51 THR HB 1 69 THR H . . 5.280 5.216 5.094 5.278 . 0 0 "[ . 1 . 2]" 1
1208 1 51 THR HB 1 69 THR MG . . 5.500 5.455 5.282 5.502 0.002 18 0 "[ . 1 . 2]" 1
1209 1 51 THR HB 1 95 GLN HG2 . . 5.500 5.461 5.330 5.505 0.005 15 0 "[ . 1 . 2]" 1
1210 1 51 THR HB 1 95 GLN HG3 . . 5.500 5.455 5.321 5.506 0.006 20 0 "[ . 1 . 2]" 1
1211 1 51 THR MG 1 52 TYR H . . 3.670 1.889 1.804 2.017 . 0 0 "[ . 1 . 2]" 1
1212 1 51 THR MG 1 53 SER H . . 5.370 4.883 4.695 5.090 . 0 0 "[ . 1 . 2]" 1
1213 1 51 THR MG 1 69 THR H . . 4.140 2.957 2.840 3.048 . 0 0 "[ . 1 . 2]" 1
1214 1 51 THR MG 1 71 HIS H . . 5.020 4.713 4.587 4.901 . 0 0 "[ . 1 . 2]" 1
1215 1 51 THR MG 1 71 HIS HA . . 4.630 4.575 4.449 4.637 0.007 13 0 "[ . 1 . 2]" 1
1216 1 51 THR MG 1 72 PRO HA . . 4.260 2.060 1.971 2.249 . 0 0 "[ . 1 . 2]" 1
1217 1 51 THR MG 1 72 PRO HB2 . . 4.110 4.061 3.993 4.113 0.003 2 0 "[ . 1 . 2]" 1
1218 1 51 THR MG 1 72 PRO HD2 . . 5.200 4.982 4.926 5.019 . 0 0 "[ . 1 . 2]" 1
1219 1 51 THR MG 1 72 PRO HD3 . . 4.280 3.930 3.848 4.019 . 0 0 "[ . 1 . 2]" 1
1220 1 51 THR MG 1 72 PRO HG2 . . 5.130 5.124 5.061 5.138 0.008 4 0 "[ . 1 . 2]" 1
1221 1 51 THR MG 1 72 PRO QG . . 4.370 4.328 4.255 4.378 0.008 20 0 "[ . 1 . 2]" 1
1222 1 51 THR MG 1 72 PRO HG3 . . 5.130 4.666 4.564 4.745 . 0 0 "[ . 1 . 2]" 1
1223 1 51 THR MG 1 73 GLY H . . 4.060 3.352 3.036 3.722 . 0 0 "[ . 1 . 2]" 1
1224 1 52 TYR H 1 52 TYR HB2 . . 4.090 2.605 2.509 2.712 . 0 0 "[ . 1 . 2]" 1
1225 1 52 TYR H 1 52 TYR HB3 . . 4.160 3.756 3.698 3.819 . 0 0 "[ . 1 . 2]" 1
1226 1 52 TYR H 1 52 TYR HD2 . . 4.470 3.495 3.233 3.860 . 0 0 "[ . 1 . 2]" 1
1227 1 52 TYR H 1 53 SER H . . 4.770 4.311 4.187 4.446 . 0 0 "[ . 1 . 2]" 1
1228 1 52 TYR H 1 69 THR H . . 3.740 3.554 3.465 3.670 . 0 0 "[ . 1 . 2]" 1
1229 1 52 TYR H 1 69 THR MG . . 3.870 2.954 2.791 3.130 . 0 0 "[ . 1 . 2]" 1
1230 1 52 TYR HA 1 53 SER H . . 2.860 2.151 2.138 2.181 . 0 0 "[ . 1 . 2]" 1
1231 1 52 TYR HA 1 53 SER QB . . 4.810 4.177 4.083 4.301 . 0 0 "[ . 1 . 2]" 1
1232 1 52 TYR HA 1 69 THR MG . . 5.380 4.230 4.085 4.335 . 0 0 "[ . 1 . 2]" 1
1233 1 52 TYR HA 1 92 VAL MG1 . . 4.990 4.071 3.883 4.255 . 0 0 "[ . 1 . 2]" 1
1234 1 52 TYR HA 1 93 MET H . . 4.650 4.101 3.913 4.369 . 0 0 "[ . 1 . 2]" 1
1235 1 52 TYR HA 1 94 ALA HA . . 3.490 2.472 2.379 2.547 . 0 0 "[ . 1 . 2]" 1
1236 1 52 TYR HA 1 94 ALA MB . . 4.130 4.013 3.913 4.125 . 0 0 "[ . 1 . 2]" 1
1237 1 52 TYR HA 1 95 GLN H . . 3.790 3.591 3.446 3.757 . 0 0 "[ . 1 . 2]" 1
1238 1 52 TYR HB2 1 54 VAL MG2 . . 5.110 4.460 4.262 4.629 . 0 0 "[ . 1 . 2]" 1
1239 1 52 TYR HB2 1 69 THR MG . . 3.530 2.073 1.950 2.299 . 0 0 "[ . 1 . 2]" 1
1240 1 52 TYR HB2 1 92 VAL MG1 . . 4.150 3.990 3.841 4.152 0.002 2 0 "[ . 1 . 2]" 1
1241 1 52 TYR HB3 1 53 SER H . . 3.450 3.304 3.099 3.453 0.003 19 0 "[ . 1 . 2]" 1
1242 1 52 TYR HB3 1 54 VAL MG2 . . 4.670 3.831 3.718 3.940 . 0 0 "[ . 1 . 2]" 1
1243 1 52 TYR HB3 1 69 THR MG . . 3.880 3.162 2.927 3.311 . 0 0 "[ . 1 . 2]" 1
1244 1 52 TYR HB3 1 92 VAL MG1 . . 3.700 2.664 2.522 2.819 . 0 0 "[ . 1 . 2]" 1
1245 1 52 TYR HB3 1 93 MET H . . 3.950 3.859 3.688 3.965 0.015 17 0 "[ . 1 . 2]" 1
1246 1 52 TYR HB3 1 94 ALA HA . . 4.810 4.270 4.058 4.431 . 0 0 "[ . 1 . 2]" 1
1247 1 52 TYR HB3 1 94 ALA MB . . 5.500 5.072 4.943 5.211 . 0 0 "[ . 1 . 2]" 1
1248 1 52 TYR HD1 1 53 SER H . . 4.890 3.823 3.629 3.958 . 0 0 "[ . 1 . 2]" 1
1249 1 52 TYR HD1 1 92 VAL MG1 . . 4.970 3.081 2.836 3.385 . 0 0 "[ . 1 . 2]" 1
1250 1 52 TYR HD1 1 94 ALA MB . . 3.910 2.905 2.757 3.098 . 0 0 "[ . 1 . 2]" 1
1251 1 52 TYR HD2 1 75 MET HA . . 5.180 4.287 4.002 4.522 . 0 0 "[ . 1 . 2]" 1
1252 1 52 TYR HD2 1 75 MET ME . . 4.980 3.515 3.241 3.778 . 0 0 "[ . 1 . 2]" 1
1253 1 52 TYR HD2 1 75 MET HG2 . . 5.500 5.222 4.902 5.490 . 0 0 "[ . 1 . 2]" 1
1254 1 52 TYR HD2 1 76 GLN H . . 5.500 5.305 5.013 5.504 0.004 16 0 "[ . 1 . 2]" 1
1255 1 52 TYR HH 1 75 MET ME . . 4.410 2.472 1.939 3.338 . 0 0 "[ . 1 . 2]" 1
1256 1 53 SER H 1 53 SER QB . . 3.310 2.324 2.255 2.450 . 0 0 "[ . 1 . 2]" 1
1257 1 53 SER H 1 54 VAL MG2 . . 4.650 4.429 4.295 4.532 . 0 0 "[ . 1 . 2]" 1
1258 1 53 SER H 1 55 PHE QE . . 5.030 4.483 4.089 5.030 . 0 0 "[ . 1 . 2]" 1
1259 1 53 SER H 1 68 ASN HA . . 5.500 5.187 5.039 5.334 . 0 0 "[ . 1 . 2]" 1
1260 1 53 SER H 1 69 THR H . . 5.500 5.419 5.304 5.504 0.004 20 0 "[ . 1 . 2]" 1
1261 1 53 SER H 1 69 THR MG . . 5.050 4.717 4.541 4.839 . 0 0 "[ . 1 . 2]" 1
1262 1 53 SER H 1 92 VAL MG1 . . 3.990 3.843 3.581 3.978 . 0 0 "[ . 1 . 2]" 1
1263 1 53 SER H 1 93 MET HB3 . . 4.390 3.435 3.218 3.876 . 0 0 "[ . 1 . 2]" 1
1264 1 53 SER H 1 93 MET ME . . 4.610 4.417 3.763 4.615 0.005 3 0 "[ . 1 . 2]" 1
1265 1 53 SER H 1 93 MET HG2 . . 5.500 4.524 4.293 4.810 . 0 0 "[ . 1 . 2]" 1
1266 1 53 SER H 1 93 MET HG3 . . 5.500 5.482 5.230 5.526 0.026 20 0 "[ . 1 . 2]" 1
1267 1 53 SER H 1 94 ALA HA . . 3.980 3.704 3.572 3.805 . 0 0 "[ . 1 . 2]" 1
1268 1 53 SER H 1 94 ALA MB . . 5.330 5.056 4.953 5.137 . 0 0 "[ . 1 . 2]" 1
1269 1 53 SER H 1 95 GLN H . . 5.100 4.933 4.807 5.051 . 0 0 "[ . 1 . 2]" 1
1270 1 53 SER H 1 95 GLN HE21 . . 5.230 4.567 3.677 5.236 0.006 19 0 "[ . 1 . 2]" 1
1271 1 53 SER H 1 95 GLN HE22 . . 4.720 4.307 3.774 4.721 0.001 13 0 "[ . 1 . 2]" 1
1272 1 53 SER H 1 95 GLN HG3 . . 5.390 5.030 4.903 5.206 . 0 0 "[ . 1 . 2]" 1
1273 1 53 SER HA 1 54 VAL H . . 2.860 2.223 2.169 2.379 . 0 0 "[ . 1 . 2]" 1
1274 1 53 SER HA 1 54 VAL HB . . 4.710 4.519 4.431 4.587 . 0 0 "[ . 1 . 2]" 1
1275 1 53 SER HA 1 54 VAL MG2 . . 4.510 3.625 3.439 3.746 . 0 0 "[ . 1 . 2]" 1
1276 1 53 SER HA 1 66 VAL MG1 . . 5.280 4.964 4.799 5.160 . 0 0 "[ . 1 . 2]" 1
1277 1 53 SER HA 1 66 VAL MG2 . . 4.500 3.108 2.964 3.294 . 0 0 "[ . 1 . 2]" 1
1278 1 53 SER HA 1 67 GLU H . . 4.540 4.010 3.796 4.298 . 0 0 "[ . 1 . 2]" 1
1279 1 53 SER HA 1 68 ASN H . . 4.920 4.763 4.658 4.892 . 0 0 "[ . 1 . 2]" 1
1280 1 53 SER HA 1 68 ASN HA . . 3.470 2.769 2.537 2.904 . 0 0 "[ . 1 . 2]" 1
1281 1 53 SER HA 1 68 ASN QB . . 4.790 4.525 3.795 4.753 . 0 0 "[ . 1 . 2]" 1
1282 1 53 SER HA 1 69 THR H . . 4.070 3.733 3.594 3.858 . 0 0 "[ . 1 . 2]" 1
1283 1 53 SER QB 1 54 VAL H . . 3.550 2.957 2.628 3.158 . 0 0 "[ . 1 . 2]" 1
1284 1 53 SER QB 1 55 PHE QD . . 4.770 3.732 3.400 4.412 . 0 0 "[ . 1 . 2]" 1
1285 1 53 SER QB 1 55 PHE QE . . 3.710 2.468 2.029 3.310 . 0 0 "[ . 1 . 2]" 1
1286 1 53 SER QB 1 55 PHE HZ . . 4.190 2.968 2.696 3.472 . 0 0 "[ . 1 . 2]" 1
1287 1 53 SER QB 1 66 VAL HA . . 4.400 4.288 4.134 4.401 0.001 15 0 "[ . 1 . 2]" 1
1288 1 53 SER QB 1 66 VAL MG1 . . 4.020 3.973 3.855 4.018 . 0 0 "[ . 1 . 2]" 1
1289 1 53 SER QB 1 66 VAL MG2 . . 3.390 1.887 1.845 1.979 . 0 0 "[ . 1 . 2]" 1
1290 1 53 SER QB 1 67 GLU H . . 4.940 4.053 3.767 4.244 . 0 0 "[ . 1 . 2]" 1
1291 1 53 SER QB 1 68 ASN HA . . 4.650 4.468 4.002 4.625 . 0 0 "[ . 1 . 2]" 1
1292 1 53 SER QB 1 93 MET H . . 4.250 3.725 3.549 3.973 . 0 0 "[ . 1 . 2]" 1
1293 1 53 SER QB 1 93 MET HB2 . . 5.120 4.337 3.898 4.868 . 0 0 "[ . 1 . 2]" 1
1294 1 53 SER QB 1 93 MET HB3 . . 4.110 2.821 2.498 3.319 . 0 0 "[ . 1 . 2]" 1
1295 1 53 SER QB 1 93 MET ME . . 3.590 2.816 1.916 3.265 . 0 0 "[ . 1 . 2]" 1
1296 1 53 SER QB 1 93 MET HG2 . . 5.310 4.147 3.979 4.755 . 0 0 "[ . 1 . 2]" 1
1297 1 53 SER QB 1 93 MET QG . . 4.540 3.958 3.865 4.191 . 0 0 "[ . 1 . 2]" 1
1298 1 53 SER QB 1 93 MET HG3 . . 5.310 5.177 4.610 5.352 0.042 13 0 "[ . 1 . 2]" 1
1299 1 53 SER QB 1 95 GLN HE21 . . 4.290 3.100 2.543 3.588 . 0 0 "[ . 1 . 2]" 1
1300 1 53 SER QB 1 95 GLN HE22 . . 4.350 2.367 1.914 2.727 . 0 0 "[ . 1 . 2]" 1
1301 1 53 SER QB 1 95 GLN HG3 . . 4.830 4.442 4.250 4.716 . 0 0 "[ . 1 . 2]" 1
1302 1 54 VAL H 1 54 VAL HB . . 3.190 2.639 2.572 2.816 . 0 0 "[ . 1 . 2]" 1
1303 1 54 VAL H 1 54 VAL MG1 . . 3.990 3.834 3.806 3.882 . 0 0 "[ . 1 . 2]" 1
1304 1 54 VAL H 1 54 VAL MG2 . . 3.410 2.892 2.675 3.125 . 0 0 "[ . 1 . 2]" 1
1305 1 54 VAL H 1 55 PHE H . . 4.460 4.178 3.889 4.316 . 0 0 "[ . 1 . 2]" 1
1306 1 54 VAL H 1 55 PHE QD . . 5.200 4.651 4.366 4.908 . 0 0 "[ . 1 . 2]" 1
1307 1 54 VAL H 1 55 PHE QE . . 5.500 4.811 4.533 5.055 . 0 0 "[ . 1 . 2]" 1
1308 1 54 VAL H 1 66 VAL HA . . 4.330 3.796 3.466 3.962 . 0 0 "[ . 1 . 2]" 1
1309 1 54 VAL H 1 66 VAL MG1 . . 4.790 4.709 4.531 4.792 0.002 15 0 "[ . 1 . 2]" 1
1310 1 54 VAL H 1 66 VAL MG2 . . 4.060 2.614 2.289 2.869 . 0 0 "[ . 1 . 2]" 1
1311 1 54 VAL H 1 67 GLU HB2 . . 4.610 4.499 4.379 4.589 . 0 0 "[ . 1 . 2]" 1
1312 1 54 VAL H 1 67 GLU HB3 . . 4.510 3.724 3.596 3.973 . 0 0 "[ . 1 . 2]" 1
1313 1 54 VAL H 1 68 ASN HA . . 4.250 3.989 3.753 4.154 . 0 0 "[ . 1 . 2]" 1
1314 1 54 VAL H 1 69 THR H . . 5.210 4.977 4.813 5.207 . 0 0 "[ . 1 . 2]" 1
1315 1 54 VAL H 1 69 THR MG . . 5.500 4.797 4.608 5.126 . 0 0 "[ . 1 . 2]" 1
1316 1 54 VAL HB 1 55 PHE H . . 4.610 4.359 4.269 4.433 . 0 0 "[ . 1 . 2]" 1
1317 1 54 VAL HB 1 55 PHE HA . . 5.090 4.957 4.898 5.007 . 0 0 "[ . 1 . 2]" 1
1318 1 54 VAL HB 1 66 VAL MG2 . . 4.720 4.506 4.287 4.709 . 0 0 "[ . 1 . 2]" 1
1319 1 54 VAL HB 1 67 GLU H . . 4.080 3.242 3.053 3.403 . 0 0 "[ . 1 . 2]" 1
1320 1 54 VAL HB 1 67 GLU HB2 . . 3.820 3.678 3.420 3.795 . 0 0 "[ . 1 . 2]" 1
1321 1 54 VAL HB 1 79 ILE MD . . 3.350 2.455 2.266 2.719 . 0 0 "[ . 1 . 2]" 1
1322 1 54 VAL HB 1 79 ILE MG . . 4.880 4.646 4.491 4.886 0.006 13 0 "[ . 1 . 2]" 1
1323 1 54 VAL MG1 1 55 PHE H . . 3.380 2.955 2.724 3.154 . 0 0 "[ . 1 . 2]" 1
1324 1 54 VAL MG1 1 55 PHE HA . . 4.650 3.738 3.637 3.821 . 0 0 "[ . 1 . 2]" 1
1325 1 54 VAL MG1 1 55 PHE QD . . 5.060 4.559 4.244 4.915 . 0 0 "[ . 1 . 2]" 1
1326 1 54 VAL MG1 1 56 TYR H . . 4.500 3.879 3.774 4.008 . 0 0 "[ . 1 . 2]" 1
1327 1 54 VAL MG1 1 56 TYR HB2 . . 4.820 4.774 4.687 4.824 0.004 12 0 "[ . 1 . 2]" 1
1328 1 54 VAL MG1 1 56 TYR HB3 . . 3.760 3.285 3.191 3.353 . 0 0 "[ . 1 . 2]" 1
1329 1 54 VAL MG1 1 56 TYR QD . . 3.780 2.599 2.421 2.865 . 0 0 "[ . 1 . 2]" 1
1330 1 54 VAL MG1 1 56 TYR QE . . 4.610 4.161 3.874 4.353 . 0 0 "[ . 1 . 2]" 1
1331 1 54 VAL MG1 1 66 VAL HA . . 5.050 4.664 4.500 4.806 . 0 0 "[ . 1 . 2]" 1
1332 1 54 VAL MG1 1 67 GLU H . . 4.550 4.138 3.784 4.339 . 0 0 "[ . 1 . 2]" 1
1333 1 54 VAL MG1 1 67 GLU HB2 . . 4.510 4.273 3.954 4.479 . 0 0 "[ . 1 . 2]" 1
1334 1 54 VAL MG1 1 79 ILE MD . . 2.770 2.088 1.855 2.299 . 0 0 "[ . 1 . 2]" 1
1335 1 54 VAL MG1 1 90 PHE HA . . 4.490 3.530 3.413 3.746 . 0 0 "[ . 1 . 2]" 1
1336 1 54 VAL MG1 1 90 PHE HB2 . . 4.250 4.155 3.970 4.269 0.019 13 0 "[ . 1 . 2]" 1
1337 1 54 VAL MG1 1 90 PHE HB3 . . 3.850 2.678 2.494 2.785 . 0 0 "[ . 1 . 2]" 1
1338 1 54 VAL MG1 1 90 PHE QD . . 2.970 2.215 1.981 2.340 . 0 0 "[ . 1 . 2]" 1
1339 1 54 VAL MG1 1 90 PHE QE . . 3.710 3.600 3.366 3.719 0.009 15 0 "[ . 1 . 2]" 1
1340 1 54 VAL MG1 1 91 ARG H . . 3.990 3.010 2.843 3.244 . 0 0 "[ . 1 . 2]" 1
1341 1 54 VAL MG1 1 92 VAL HA . . 4.150 3.829 3.585 4.059 . 0 0 "[ . 1 . 2]" 1
1342 1 54 VAL MG1 1 92 VAL MG1 . . 4.150 4.084 3.855 4.158 0.008 14 0 "[ . 1 . 2]" 1
1343 1 54 VAL MG2 1 55 PHE H . . 4.230 4.077 3.991 4.157 . 0 0 "[ . 1 . 2]" 1
1344 1 54 VAL MG2 1 67 GLU H . . 4.830 4.366 4.224 4.473 . 0 0 "[ . 1 . 2]" 1
1345 1 54 VAL MG2 1 67 GLU HB2 . . 5.060 4.988 4.756 5.054 . 0 0 "[ . 1 . 2]" 1
1346 1 54 VAL MG2 1 67 GLU HB3 . . 4.260 3.830 3.597 3.934 . 0 0 "[ . 1 . 2]" 1
1347 1 54 VAL MG2 1 69 THR MG . . 3.930 3.175 2.936 3.345 . 0 0 "[ . 1 . 2]" 1
1348 1 54 VAL MG2 1 77 VAL H . . 5.000 4.723 4.563 4.923 . 0 0 "[ . 1 . 2]" 1
1349 1 54 VAL MG2 1 77 VAL MG1 . . 3.020 1.829 1.730 1.942 . 0 0 "[ . 1 . 2]" 1
1350 1 54 VAL MG2 1 90 PHE QD . . 4.650 4.394 4.279 4.552 . 0 0 "[ . 1 . 2]" 1
1351 1 54 VAL MG2 1 91 ARG H . . 4.830 4.798 4.676 4.846 0.016 13 0 "[ . 1 . 2]" 1
1352 1 54 VAL MG2 1 92 VAL HA . . 3.890 2.822 2.590 3.159 . 0 0 "[ . 1 . 2]" 1
1353 1 54 VAL MG2 1 92 VAL HB . . 4.870 4.585 4.315 4.781 . 0 0 "[ . 1 . 2]" 1
1354 1 54 VAL MG2 1 92 VAL MG1 . . 3.160 2.383 2.120 2.627 . 0 0 "[ . 1 . 2]" 1
1355 1 54 VAL MG2 1 92 VAL MG2 . . 3.080 2.661 2.337 2.914 . 0 0 "[ . 1 . 2]" 1
1356 1 54 VAL MG2 1 93 MET H . . 4.380 3.875 3.644 4.096 . 0 0 "[ . 1 . 2]" 1
1357 1 55 PHE H 1 55 PHE HB2 . . 3.310 2.595 2.528 2.659 . 0 0 "[ . 1 . 2]" 1
1358 1 55 PHE H 1 55 PHE HB3 . . 3.940 3.695 3.669 3.724 . 0 0 "[ . 1 . 2]" 1
1359 1 55 PHE H 1 55 PHE QD . . 3.560 2.101 1.918 2.373 . 0 0 "[ . 1 . 2]" 1
1360 1 55 PHE H 1 55 PHE QE . . 4.610 4.206 4.072 4.353 . 0 0 "[ . 1 . 2]" 1
1361 1 55 PHE H 1 56 TYR H . . 4.390 4.363 4.320 4.406 0.016 7 0 "[ . 1 . 2]" 1
1362 1 55 PHE H 1 66 VAL MG2 . . 4.810 3.992 3.814 4.167 . 0 0 "[ . 1 . 2]" 1
1363 1 55 PHE H 1 91 ARG QB . . 4.380 2.955 2.739 3.080 . 0 0 "[ . 1 . 2]" 1
1364 1 55 PHE H 1 91 ARG QG . . 5.260 4.646 4.130 4.928 . 0 0 "[ . 1 . 2]" 1
1365 1 55 PHE H 1 92 VAL HA . . 4.110 3.849 3.751 4.000 . 0 0 "[ . 1 . 2]" 1
1366 1 55 PHE H 1 92 VAL MG1 . . 5.480 5.320 5.155 5.491 0.011 14 0 "[ . 1 . 2]" 1
1367 1 55 PHE H 1 92 VAL MG2 . . 4.750 4.716 4.605 4.771 0.021 13 0 "[ . 1 . 2]" 1
1368 1 55 PHE H 1 93 MET H . . 5.460 5.122 4.754 5.416 . 0 0 "[ . 1 . 2]" 1
1369 1 55 PHE H 1 93 MET ME . . 5.500 5.432 5.235 5.518 0.018 13 0 "[ . 1 . 2]" 1
1370 1 55 PHE HA 1 55 PHE QD . . 4.210 3.127 2.947 3.218 . 0 0 "[ . 1 . 2]" 1
1371 1 55 PHE HA 1 56 TYR H . . 3.020 2.140 2.138 2.144 . 0 0 "[ . 1 . 2]" 1
1372 1 55 PHE HA 1 56 TYR QD . . 4.190 3.568 3.163 3.945 . 0 0 "[ . 1 . 2]" 1
1373 1 55 PHE HA 1 56 TYR QE . . 5.060 4.585 4.203 4.851 . 0 0 "[ . 1 . 2]" 1
1374 1 55 PHE HA 1 64 GLU HB2 . . 4.110 3.957 3.711 4.119 0.009 2 0 "[ . 1 . 2]" 1
1375 1 55 PHE HA 1 64 GLU QG . . 4.500 3.744 3.411 4.240 . 0 0 "[ . 1 . 2]" 1
1376 1 55 PHE HA 1 65 ARG H . . 4.290 4.089 3.709 4.298 0.008 15 0 "[ . 1 . 2]" 1
1377 1 55 PHE HA 1 65 ARG HB2 . . 5.500 5.122 4.987 5.321 . 0 0 "[ . 1 . 2]" 1
1378 1 55 PHE HA 1 66 VAL HA . . 3.530 2.463 2.241 2.691 . 0 0 "[ . 1 . 2]" 1
1379 1 55 PHE HA 1 66 VAL HB . . 4.480 4.189 3.849 4.420 . 0 0 "[ . 1 . 2]" 1
1380 1 55 PHE HA 1 66 VAL MG1 . . 5.420 5.081 4.878 5.258 . 0 0 "[ . 1 . 2]" 1
1381 1 55 PHE HA 1 66 VAL MG2 . . 4.040 3.542 3.371 3.693 . 0 0 "[ . 1 . 2]" 1
1382 1 55 PHE HA 1 67 GLU H . . 4.290 3.926 3.719 4.070 . 0 0 "[ . 1 . 2]" 1
1383 1 55 PHE HB2 1 56 TYR H . . 4.430 4.248 4.159 4.309 . 0 0 "[ . 1 . 2]" 1
1384 1 55 PHE HB2 1 57 THR MG . . 5.500 4.628 4.345 4.809 . 0 0 "[ . 1 . 2]" 1
1385 1 55 PHE HB2 1 64 GLU HB2 . . 4.520 4.215 3.928 4.499 . 0 0 "[ . 1 . 2]" 1
1386 1 55 PHE HB2 1 91 ARG QB . . 4.220 2.153 1.981 2.357 . 0 0 "[ . 1 . 2]" 1
1387 1 55 PHE HB2 1 91 ARG QG . . 4.700 3.710 2.829 4.144 . 0 0 "[ . 1 . 2]" 1
1388 1 55 PHE HB2 1 93 MET ME . . 5.500 5.321 5.036 5.507 0.007 16 0 "[ . 1 . 2]" 1
1389 1 55 PHE HB3 1 56 TYR H . . 3.830 3.508 3.383 3.566 . 0 0 "[ . 1 . 2]" 1
1390 1 55 PHE HB3 1 57 THR MG . . 5.180 4.170 3.904 4.460 . 0 0 "[ . 1 . 2]" 1
1391 1 55 PHE HB3 1 64 GLU HB2 . . 4.250 2.904 2.694 3.110 . 0 0 "[ . 1 . 2]" 1
1392 1 55 PHE HB3 1 64 GLU HB3 . . 4.470 4.048 3.806 4.357 . 0 0 "[ . 1 . 2]" 1
1393 1 55 PHE HB3 1 64 GLU HG2 . . 4.730 2.930 2.009 4.098 . 0 0 "[ . 1 . 2]" 1
1394 1 55 PHE HB3 1 64 GLU QG . . 3.980 2.175 1.855 2.766 . 0 0 "[ . 1 . 2]" 1
1395 1 55 PHE HB3 1 64 GLU HG3 . . 4.730 2.295 1.995 2.819 . 0 0 "[ . 1 . 2]" 1
1396 1 55 PHE HB3 1 65 ARG H . . 4.610 4.505 4.231 4.619 0.009 16 0 "[ . 1 . 2]" 1
1397 1 55 PHE HB3 1 91 ARG QB . . 4.310 3.799 3.605 4.015 . 0 0 "[ . 1 . 2]" 1
1398 1 55 PHE QD 1 56 TYR H . . 4.730 4.609 4.448 4.722 . 0 0 "[ . 1 . 2]" 1
1399 1 55 PHE QD 1 64 GLU HB2 . . 4.560 4.274 4.037 4.457 . 0 0 "[ . 1 . 2]" 1
1400 1 55 PHE QD 1 64 GLU QG . . 3.780 2.397 2.088 2.867 . 0 0 "[ . 1 . 2]" 1
1401 1 55 PHE QD 1 66 VAL HA . . 5.250 3.527 3.211 3.766 . 0 0 "[ . 1 . 2]" 1
1402 1 55 PHE QD 1 66 VAL HB . . 4.000 2.821 2.445 3.152 . 0 0 "[ . 1 . 2]" 1
1403 1 55 PHE QD 1 66 VAL MG1 . . 4.660 4.303 3.975 4.531 . 0 0 "[ . 1 . 2]" 1
1404 1 55 PHE QD 1 66 VAL MG2 . . 3.880 3.122 2.862 3.286 . 0 0 "[ . 1 . 2]" 1
1405 1 55 PHE QD 1 91 ARG QB . . 4.780 2.821 2.357 3.238 . 0 0 "[ . 1 . 2]" 1
1406 1 55 PHE QD 1 92 VAL HA . . 5.280 4.116 3.916 4.345 . 0 0 "[ . 1 . 2]" 1
1407 1 55 PHE QD 1 93 MET H . . 5.010 4.559 4.229 4.938 . 0 0 "[ . 1 . 2]" 1
1408 1 55 PHE QD 1 93 MET HB3 . . 5.000 4.129 3.709 4.385 . 0 0 "[ . 1 . 2]" 1
1409 1 55 PHE QE 1 66 VAL HB . . 4.320 2.448 2.050 2.735 . 0 0 "[ . 1 . 2]" 1
1410 1 55 PHE QE 1 66 VAL MG1 . . 3.810 3.527 3.254 3.800 . 0 0 "[ . 1 . 2]" 1
1411 1 55 PHE QE 1 66 VAL MG2 . . 3.840 2.548 2.298 2.680 . 0 0 "[ . 1 . 2]" 1
1412 1 55 PHE QE 1 93 MET H . . 4.890 4.152 3.813 4.470 . 0 0 "[ . 1 . 2]" 1
1413 1 55 PHE QE 1 93 MET HB2 . . 4.070 3.249 2.731 4.071 0.001 16 0 "[ . 1 . 2]" 1
1414 1 55 PHE QE 1 93 MET HB3 . . 4.060 2.471 2.286 2.600 . 0 0 "[ . 1 . 2]" 1
1415 1 55 PHE QE 1 93 MET ME . . 3.460 1.971 1.787 2.229 . 0 0 "[ . 1 . 2]" 1
1416 1 55 PHE QE 1 93 MET QG . . 4.240 4.091 3.982 4.240 . 0 0 "[ . 1 . 2]" 1
1417 1 55 PHE HZ 1 66 VAL HB . . 4.920 3.965 3.637 4.284 . 0 0 "[ . 1 . 2]" 1
1418 1 55 PHE HZ 1 66 VAL MG1 . . 4.550 4.325 3.904 4.535 . 0 0 "[ . 1 . 2]" 1
1419 1 55 PHE HZ 1 66 VAL MG2 . . 4.060 2.496 2.293 2.694 . 0 0 "[ . 1 . 2]" 1
1420 1 55 PHE HZ 1 93 MET ME . . 3.870 2.408 1.931 2.812 . 0 0 "[ . 1 . 2]" 1
1421 1 55 PHE HZ 1 95 GLN HE21 . . 4.540 3.941 3.650 4.256 . 0 0 "[ . 1 . 2]" 1
1422 1 56 TYR H 1 56 TYR HB2 . . 3.840 3.700 3.660 3.731 . 0 0 "[ . 1 . 2]" 1
1423 1 56 TYR H 1 56 TYR HB3 . . 3.990 3.191 3.127 3.282 . 0 0 "[ . 1 . 2]" 1
1424 1 56 TYR H 1 56 TYR QD . . 3.470 2.579 2.231 2.921 . 0 0 "[ . 1 . 2]" 1
1425 1 56 TYR H 1 56 TYR QE . . 4.290 3.897 3.724 4.084 . 0 0 "[ . 1 . 2]" 1
1426 1 56 TYR H 1 57 THR H . . 4.630 4.472 4.408 4.512 . 0 0 "[ . 1 . 2]" 1
1427 1 56 TYR H 1 57 THR MG . . 5.050 4.487 4.174 4.713 . 0 0 "[ . 1 . 2]" 1
1428 1 56 TYR H 1 64 GLU HA . . 4.670 4.450 4.279 4.671 0.001 7 0 "[ . 1 . 2]" 1
1429 1 56 TYR H 1 64 GLU HB2 . . 4.170 3.291 3.037 3.483 . 0 0 "[ . 1 . 2]" 1
1430 1 56 TYR H 1 64 GLU QG . . 4.890 4.155 3.827 4.533 . 0 0 "[ . 1 . 2]" 1
1431 1 56 TYR H 1 65 ARG H . . 3.460 2.912 2.567 3.099 . 0 0 "[ . 1 . 2]" 1
1432 1 56 TYR H 1 65 ARG HB2 . . 4.410 4.047 3.824 4.322 . 0 0 "[ . 1 . 2]" 1
1433 1 56 TYR H 1 65 ARG HB3 . . 5.500 5.177 4.942 5.428 . 0 0 "[ . 1 . 2]" 1
1434 1 56 TYR H 1 65 ARG QG . . 5.500 5.238 4.852 5.513 0.013 2 0 "[ . 1 . 2]" 1
1435 1 56 TYR H 1 66 VAL HA . . 4.200 3.950 3.707 4.177 . 0 0 "[ . 1 . 2]" 1
1436 1 56 TYR H 1 66 VAL MG2 . . 5.450 5.255 5.133 5.398 . 0 0 "[ . 1 . 2]" 1
1437 1 56 TYR H 1 90 PHE QD . . 5.310 4.880 4.645 5.143 . 0 0 "[ . 1 . 2]" 1
1438 1 56 TYR H 1 91 ARG H . . 4.940 4.791 4.657 4.887 . 0 0 "[ . 1 . 2]" 1
1439 1 56 TYR HA 1 56 TYR QD . . 4.170 3.706 3.632 3.735 . 0 0 "[ . 1 . 2]" 1
1440 1 56 TYR HA 1 57 THR H . . 2.800 2.236 2.180 2.302 . 0 0 "[ . 1 . 2]" 1
1441 1 56 TYR HA 1 57 THR MG . . 4.210 3.362 3.208 3.510 . 0 0 "[ . 1 . 2]" 1
1442 1 56 TYR HA 1 89 ILE H . . 4.550 4.394 4.143 4.566 0.016 15 0 "[ . 1 . 2]" 1
1443 1 56 TYR HA 1 90 PHE HA . . 3.660 2.426 2.331 2.556 . 0 0 "[ . 1 . 2]" 1
1444 1 56 TYR HA 1 90 PHE QD . . 4.450 3.901 3.603 4.077 . 0 0 "[ . 1 . 2]" 1
1445 1 56 TYR HA 1 91 ARG H . . 4.110 3.796 3.653 3.890 . 0 0 "[ . 1 . 2]" 1
1446 1 56 TYR HB2 1 57 THR H . . 3.400 2.897 2.683 3.114 . 0 0 "[ . 1 . 2]" 1
1447 1 56 TYR HB2 1 79 ILE MG . . 4.840 3.614 3.401 3.810 . 0 0 "[ . 1 . 2]" 1
1448 1 56 TYR HB2 1 89 ILE H . . 5.270 4.871 4.602 5.079 . 0 0 "[ . 1 . 2]" 1
1449 1 56 TYR HB2 1 90 PHE HA . . 4.350 4.188 4.045 4.344 . 0 0 "[ . 1 . 2]" 1
1450 1 56 TYR HB2 1 90 PHE QD . . 4.240 3.925 3.681 4.151 . 0 0 "[ . 1 . 2]" 1
1451 1 56 TYR HB2 1 90 PHE QE . . 4.270 3.462 3.138 3.712 . 0 0 "[ . 1 . 2]" 1
1452 1 56 TYR HB3 1 57 THR H . . 4.240 3.893 3.783 4.028 . 0 0 "[ . 1 . 2]" 1
1453 1 56 TYR HB3 1 79 ILE MD . . 4.830 4.143 3.820 4.361 . 0 0 "[ . 1 . 2]" 1
1454 1 56 TYR HB3 1 90 PHE HA . . 4.140 3.231 3.090 3.429 . 0 0 "[ . 1 . 2]" 1
1455 1 56 TYR HB3 1 90 PHE QD . . 3.920 2.459 2.208 2.676 . 0 0 "[ . 1 . 2]" 1
1456 1 56 TYR HB3 1 90 PHE QE . . 4.070 2.713 2.409 2.948 . 0 0 "[ . 1 . 2]" 1
1457 1 56 TYR QD 1 57 THR H . . 4.350 4.118 3.831 4.325 . 0 0 "[ . 1 . 2]" 1
1458 1 56 TYR QD 1 65 ARG H . . 4.830 3.842 3.518 4.160 . 0 0 "[ . 1 . 2]" 1
1459 1 56 TYR QD 1 65 ARG HB3 . . 5.500 5.117 4.800 5.458 . 0 0 "[ . 1 . 2]" 1
1460 1 56 TYR QD 1 65 ARG QG . . 5.500 4.609 3.912 5.221 . 0 0 "[ . 1 . 2]" 1
1461 1 56 TYR QD 1 66 VAL HA . . 4.920 4.434 4.141 4.778 . 0 0 "[ . 1 . 2]" 1
1462 1 56 TYR QD 1 67 GLU H . . 4.600 4.434 4.313 4.558 . 0 0 "[ . 1 . 2]" 1
1463 1 56 TYR QD 1 67 GLU HB3 . . 4.880 4.519 4.285 4.798 . 0 0 "[ . 1 . 2]" 1
1464 1 56 TYR QD 1 79 ILE MD . . 4.040 2.767 2.449 2.998 . 0 0 "[ . 1 . 2]" 1
1465 1 56 TYR QD 1 79 ILE MG . . 4.280 2.517 2.187 2.794 . 0 0 "[ . 1 . 2]" 1
1466 1 56 TYR QD 1 82 LEU MD1 . . 4.860 4.339 4.087 4.516 . 0 0 "[ . 1 . 2]" 1
1467 1 56 TYR QD 1 82 LEU MD2 . . 3.950 2.875 2.473 3.206 . 0 0 "[ . 1 . 2]" 1
1468 1 56 TYR QD 1 88 TYR HB3 . . 4.790 4.615 4.339 4.792 0.002 15 0 "[ . 1 . 2]" 1
1469 1 56 TYR QD 1 88 TYR QE . . 4.550 4.425 4.189 4.553 0.003 11 0 "[ . 1 . 2]" 1
1470 1 56 TYR QD 1 90 PHE QD . . 4.180 3.414 3.138 3.663 . 0 0 "[ . 1 . 2]" 1
1471 1 56 TYR QE 1 65 ARG H . . 4.970 4.106 3.727 4.378 . 0 0 "[ . 1 . 2]" 1
1472 1 56 TYR QE 1 65 ARG HB2 . . 3.860 2.782 2.439 3.330 . 0 0 "[ . 1 . 2]" 1
1473 1 56 TYR QE 1 65 ARG HB3 . . 4.360 3.779 3.463 4.126 . 0 0 "[ . 1 . 2]" 1
1474 1 56 TYR QE 1 65 ARG QD . . 4.590 4.085 2.580 4.596 0.006 15 0 "[ . 1 . 2]" 1
1475 1 56 TYR QE 1 65 ARG QG . . 4.550 3.444 2.529 4.405 . 0 0 "[ . 1 . 2]" 1
1476 1 56 TYR QE 1 66 VAL H . . 5.490 5.076 4.722 5.313 . 0 0 "[ . 1 . 2]" 1
1477 1 56 TYR QE 1 66 VAL HA . . 4.660 4.199 3.705 4.562 . 0 0 "[ . 1 . 2]" 1
1478 1 56 TYR QE 1 67 GLU H . . 4.150 3.854 3.483 4.031 . 0 0 "[ . 1 . 2]" 1
1479 1 56 TYR QE 1 67 GLU HB2 . . 3.640 2.033 1.996 2.155 . 0 0 "[ . 1 . 2]" 1
1480 1 56 TYR QE 1 67 GLU HB3 . . 4.230 3.557 3.436 3.678 . 0 0 "[ . 1 . 2]" 1
1481 1 56 TYR QE 1 67 GLU QG . . 3.790 3.555 3.186 3.793 0.003 16 0 "[ . 1 . 2]" 1
1482 1 56 TYR QE 1 79 ILE MD . . 3.650 2.966 2.711 3.173 . 0 0 "[ . 1 . 2]" 1
1483 1 56 TYR QE 1 79 ILE QG . . 4.790 4.466 4.283 4.769 . 0 0 "[ . 1 . 2]" 1
1484 1 56 TYR QE 1 79 ILE MG . . 3.600 2.607 2.259 2.893 . 0 0 "[ . 1 . 2]" 1
1485 1 56 TYR QE 1 82 LEU MD2 . . 3.370 3.121 2.734 3.372 0.002 3 0 "[ . 1 . 2]" 1
1486 1 56 TYR QE 1 90 PHE QD . . 5.500 5.426 5.281 5.503 0.003 15 0 "[ . 1 . 2]" 1
1487 1 57 THR H 1 57 THR HB . . 4.010 3.650 3.569 3.769 . 0 0 "[ . 1 . 2]" 1
1488 1 57 THR H 1 57 THR MG . . 3.240 2.365 2.163 2.567 . 0 0 "[ . 1 . 2]" 1
1489 1 57 THR H 1 88 TYR HA . . 4.260 3.924 3.642 4.101 . 0 0 "[ . 1 . 2]" 1
1490 1 57 THR H 1 89 ILE H . . 3.420 2.769 2.556 2.954 . 0 0 "[ . 1 . 2]" 1
1491 1 57 THR H 1 89 ILE HB . . 3.920 3.598 3.355 3.858 . 0 0 "[ . 1 . 2]" 1
1492 1 57 THR H 1 89 ILE MD . . 5.500 5.078 4.915 5.367 . 0 0 "[ . 1 . 2]" 1
1493 1 57 THR H 1 89 ILE MG . . 5.060 4.850 4.674 5.067 0.007 13 0 "[ . 1 . 2]" 1
1494 1 57 THR H 1 90 PHE HA . . 4.250 4.111 3.927 4.239 . 0 0 "[ . 1 . 2]" 1
1495 1 57 THR HB 1 58 LYS H . . 4.080 3.840 3.566 4.079 . 0 0 "[ . 1 . 2]" 1
1496 1 57 THR HB 1 63 ARG H . . 5.050 4.768 4.094 5.061 0.011 15 0 "[ . 1 . 2]" 1
1497 1 57 THR HB 1 63 ARG QB . . 5.340 4.976 4.668 5.347 0.007 15 0 "[ . 1 . 2]" 1
1498 1 57 THR HB 1 64 GLU HA . . 3.280 2.043 1.996 2.235 . 0 0 "[ . 1 . 2]" 1
1499 1 57 THR HB 1 64 GLU HB2 . . 3.900 2.580 2.303 2.754 . 0 0 "[ . 1 . 2]" 1
1500 1 57 THR HB 1 64 GLU HB3 . . 3.440 2.084 1.995 2.278 . 0 0 "[ . 1 . 2]" 1
1501 1 57 THR HB 1 64 GLU HG2 . . 4.740 4.545 4.293 4.740 . 0 0 "[ . 1 . 2]" 1
1502 1 57 THR HB 1 64 GLU QG . . 4.110 3.999 3.893 4.124 0.014 15 0 "[ . 1 . 2]" 1
1503 1 57 THR HB 1 64 GLU HG3 . . 4.740 4.453 4.280 4.675 . 0 0 "[ . 1 . 2]" 1
1504 1 57 THR HB 1 65 ARG H . . 4.110 3.882 3.742 4.043 . 0 0 "[ . 1 . 2]" 1
1505 1 57 THR HB 1 89 ILE HB . . 5.500 5.390 5.185 5.503 0.003 15 0 "[ . 1 . 2]" 1
1506 1 57 THR MG 1 58 LYS H . . 4.250 4.012 3.693 4.225 . 0 0 "[ . 1 . 2]" 1
1507 1 57 THR MG 1 62 ALA HA . . 4.710 4.383 3.625 4.709 . 0 0 "[ . 1 . 2]" 1
1508 1 57 THR MG 1 63 ARG H . . 5.500 5.020 4.388 5.476 . 0 0 "[ . 1 . 2]" 1
1509 1 57 THR MG 1 64 GLU HA . . 3.610 3.484 3.236 3.578 . 0 0 "[ . 1 . 2]" 1
1510 1 57 THR MG 1 64 GLU HB3 . . 3.270 2.059 1.924 2.269 . 0 0 "[ . 1 . 2]" 1
1511 1 57 THR MG 1 64 GLU QG . . 3.580 3.404 3.012 3.608 0.028 2 0 "[ . 1 . 2]" 1
1512 1 57 THR MG 1 65 ARG H . . 4.720 4.562 4.176 4.714 . 0 0 "[ . 1 . 2]" 1
1513 1 57 THR MG 1 88 TYR HA . . 4.930 4.777 4.517 4.929 . 0 0 "[ . 1 . 2]" 1
1514 1 57 THR MG 1 89 ILE H . . 4.100 3.247 3.016 3.432 . 0 0 "[ . 1 . 2]" 1
1515 1 57 THR MG 1 89 ILE HB . . 3.300 2.420 2.190 2.547 . 0 0 "[ . 1 . 2]" 1
1516 1 57 THR MG 1 89 ILE MG . . 3.890 3.670 3.450 3.782 . 0 0 "[ . 1 . 2]" 1
1517 1 58 LYS H 1 58 LYS QB . . 2.920 2.213 2.131 2.265 . 0 0 "[ . 1 . 2]" 1
1518 1 58 LYS H 1 61 ILE HB . . 4.050 2.750 2.205 3.203 . 0 0 "[ . 1 . 2]" 1
1519 1 58 LYS H 1 61 ILE MD . . 5.260 4.720 2.745 5.262 0.002 12 0 "[ . 1 . 2]" 1
1520 1 58 LYS H 1 61 ILE HG12 . . 4.910 4.349 3.907 4.927 0.017 3 0 "[ . 1 . 2]" 1
1521 1 58 LYS H 1 61 ILE QG . . 4.180 3.590 3.085 3.998 . 0 0 "[ . 1 . 2]" 1
1522 1 58 LYS H 1 61 ILE HG13 . . 4.910 3.852 3.212 4.518 . 0 0 "[ . 1 . 2]" 1
1523 1 58 LYS H 1 61 ILE MG . . 4.600 3.644 2.874 4.029 . 0 0 "[ . 1 . 2]" 1
1524 1 58 LYS H 1 88 TYR QE . . 4.580 3.180 2.656 3.691 . 0 0 "[ . 1 . 2]" 1
1525 1 58 LYS HA 1 58 LYS QD . . 4.560 3.816 2.848 4.108 . 0 0 "[ . 1 . 2]" 1
1526 1 58 LYS HA 1 58 LYS QE . . 4.880 4.527 4.138 4.769 . 0 0 "[ . 1 . 2]" 1
1527 1 58 LYS HA 1 58 LYS QG . . 3.470 2.305 2.164 2.412 . 0 0 "[ . 1 . 2]" 1
1528 1 58 LYS HA 1 59 GLU H . . 2.880 2.190 2.151 2.240 . 0 0 "[ . 1 . 2]" 1
1529 1 58 LYS HA 1 59 GLU HA . . 4.780 4.325 4.303 4.351 . 0 0 "[ . 1 . 2]" 1
1530 1 58 LYS HA 1 59 GLU QB . . 4.870 4.175 4.070 4.690 . 0 0 "[ . 1 . 2]" 1
1531 1 58 LYS HA 1 86 THR MG . . 3.960 3.732 3.578 3.866 . 0 0 "[ . 1 . 2]" 1
1532 1 58 LYS HA 1 87 VAL QG . . 4.860 4.300 3.950 4.617 . 0 0 "[ . 1 . 2]" 1
1533 1 58 LYS HA 1 88 TYR HA . . 3.480 2.572 2.321 2.879 . 0 0 "[ . 1 . 2]" 1
1534 1 58 LYS HA 1 88 TYR QE . . 4.230 3.517 3.471 3.557 . 0 0 "[ . 1 . 2]" 1
1535 1 58 LYS HA 1 89 ILE H . . 4.020 3.672 3.475 3.900 . 0 0 "[ . 1 . 2]" 1
1536 1 58 LYS HA 1 89 ILE MD . . 4.880 4.588 4.281 4.885 0.005 20 0 "[ . 1 . 2]" 1
1537 1 58 LYS HA 1 89 ILE HG12 . . 5.300 4.136 3.949 4.345 . 0 0 "[ . 1 . 2]" 1
1538 1 58 LYS QB 1 58 LYS QE . . 3.310 2.234 1.959 2.489 . 0 0 "[ . 1 . 2]" 1
1539 1 58 LYS QB 1 61 ILE H . . 4.110 2.618 1.892 3.702 . 0 0 "[ . 1 . 2]" 1
1540 1 58 LYS QB 1 61 ILE HB . . 3.640 2.534 1.981 3.013 . 0 0 "[ . 1 . 2]" 1
1541 1 58 LYS QB 1 61 ILE MD . . 3.830 3.266 1.886 3.727 . 0 0 "[ . 1 . 2]" 1
1542 1 58 LYS QB 1 61 ILE HG12 . . 3.810 2.353 1.942 3.545 . 0 0 "[ . 1 . 2]" 1
1543 1 58 LYS QB 1 61 ILE QG . . 3.310 1.973 1.800 2.190 . 0 0 "[ . 1 . 2]" 1
1544 1 58 LYS QB 1 61 ILE HG13 . . 3.810 2.324 1.978 3.027 . 0 0 "[ . 1 . 2]" 1
1545 1 58 LYS QB 1 61 ILE MG . . 3.980 3.631 3.370 3.848 . 0 0 "[ . 1 . 2]" 1
1546 1 58 LYS QB 1 86 THR MG . . 4.130 3.491 3.175 3.895 . 0 0 "[ . 1 . 2]" 1
1547 1 58 LYS QB 1 88 TYR QE . . 4.290 2.587 2.234 3.757 . 0 0 "[ . 1 . 2]" 1
1548 1 58 LYS QD 1 86 THR MG . . 3.180 2.268 1.791 3.180 . 0 0 "[ . 1 . 2]" 1
1549 1 58 LYS QE 1 58 LYS QG . . 3.080 2.396 2.179 2.655 . 0 0 "[ . 1 . 2]" 1
1550 1 58 LYS QE 1 61 ILE HA . . 5.500 5.002 3.986 5.406 . 0 0 "[ . 1 . 2]" 1
1551 1 58 LYS QE 1 61 ILE MD . . 3.880 2.818 2.001 3.411 . 0 0 "[ . 1 . 2]" 1
1552 1 58 LYS QE 1 61 ILE HG12 . . 4.740 2.587 1.969 3.921 . 0 0 "[ . 1 . 2]" 1
1553 1 58 LYS QE 1 61 ILE QG . . 3.970 2.195 1.880 2.631 . 0 0 "[ . 1 . 2]" 1
1554 1 58 LYS QE 1 61 ILE HG13 . . 4.740 2.589 1.962 3.320 . 0 0 "[ . 1 . 2]" 1
1555 1 58 LYS QE 1 61 ILE MG . . 4.610 4.365 3.980 4.614 0.004 11 0 "[ . 1 . 2]" 1
1556 1 58 LYS QE 1 86 THR MG . . 3.800 3.570 2.194 3.799 . 0 0 "[ . 1 . 2]" 1
1557 1 58 LYS QG 1 59 GLU H . . 3.430 2.619 2.279 3.457 0.027 8 0 "[ . 1 . 2]" 1
1558 1 58 LYS QG 1 61 ILE H . . 4.040 3.635 2.862 4.078 0.038 8 0 "[ . 1 . 2]" 1
1559 1 58 LYS QG 1 86 THR MG . . 3.100 2.305 1.915 2.694 . 0 0 "[ . 1 . 2]" 1
1560 1 58 LYS QG 1 88 TYR QE . . 4.050 3.661 1.988 4.055 0.005 20 0 "[ . 1 . 2]" 1
1561 1 59 GLU H 1 59 GLU HB2 . . 3.500 2.322 2.168 3.563 0.063 12 0 "[ . 1 . 2]" 1
1562 1 59 GLU H 1 59 GLU QB . . 2.940 2.205 2.122 2.796 . 0 0 "[ . 1 . 2]" 1
1563 1 59 GLU H 1 59 GLU HB3 . . 3.500 3.042 2.884 3.533 0.033 4 0 "[ . 1 . 2]" 1
1564 1 59 GLU H 1 59 GLU QG . . 3.780 3.476 1.874 3.782 0.002 11 0 "[ . 1 . 2]" 1
1565 1 59 GLU H 1 60 GLY H . . 4.560 3.606 2.711 4.563 0.003 15 0 "[ . 1 . 2]" 1
1566 1 59 GLU H 1 61 ILE H . . 4.760 4.463 4.077 4.740 . 0 0 "[ . 1 . 2]" 1
1567 1 59 GLU H 1 87 VAL QG . . 3.610 3.233 2.805 3.573 . 0 0 "[ . 1 . 2]" 1
1568 1 59 GLU H 1 88 TYR HA . . 3.570 3.299 2.999 3.542 . 0 0 "[ . 1 . 2]" 1
1569 1 59 GLU H 1 88 TYR QE . . 5.500 5.486 5.398 5.507 0.007 13 0 "[ . 1 . 2]" 1
1570 1 59 GLU H 1 89 ILE H . . 4.490 4.035 3.598 4.491 0.001 8 0 "[ . 1 . 2]" 1
1571 1 59 GLU H 1 89 ILE MD . . 4.140 3.503 3.084 3.955 . 0 0 "[ . 1 . 2]" 1
1572 1 59 GLU H 1 89 ILE HG12 . . 4.440 3.544 3.146 3.788 . 0 0 "[ . 1 . 2]" 1
1573 1 59 GLU HA 1 59 GLU HG2 . . 3.800 2.514 2.162 3.709 . 0 0 "[ . 1 . 2]" 1
1574 1 59 GLU HA 1 59 GLU QG . . 3.240 2.347 2.124 3.254 0.014 8 0 "[ . 1 . 2]" 1
1575 1 59 GLU HA 1 59 GLU HG3 . . 3.800 3.151 2.460 3.618 . 0 0 "[ . 1 . 2]" 1
1576 1 59 GLU HA 1 60 GLY QA . . 5.080 4.167 3.896 4.434 . 0 0 "[ . 1 . 2]" 1
1577 1 59 GLU HA 1 61 ILE H . . 4.910 4.384 3.868 4.898 . 0 0 "[ . 1 . 2]" 1
1578 1 59 GLU HA 1 87 VAL QG . . 4.610 4.256 3.972 4.538 . 0 0 "[ . 1 . 2]" 1
1579 1 59 GLU HA 1 89 ILE MD . . 3.490 3.096 2.682 3.430 . 0 0 "[ . 1 . 2]" 1
1580 1 59 GLU HA 1 89 ILE HG12 . . 4.330 2.876 2.391 3.195 . 0 0 "[ . 1 . 2]" 1
1581 1 59 GLU HA 1 89 ILE HG13 . . 4.280 3.074 2.627 3.344 . 0 0 "[ . 1 . 2]" 1
1582 1 59 GLU HA 1 89 ILE MG . . 5.370 4.878 4.480 5.115 . 0 0 "[ . 1 . 2]" 1
1583 1 59 GLU QB 1 60 GLY H . . 4.140 3.243 2.228 3.870 . 0 0 "[ . 1 . 2]" 1
1584 1 59 GLU QB 1 87 VAL QG . . 3.140 2.522 2.000 3.127 . 0 0 "[ . 1 . 2]" 1
1585 1 59 GLU QB 1 89 ILE H . . 5.340 4.979 4.459 5.360 0.020 15 0 "[ . 1 . 2]" 1
1586 1 59 GLU QB 1 89 ILE MD . . 3.590 2.939 2.226 3.589 . 0 0 "[ . 1 . 2]" 1
1587 1 59 GLU QB 1 89 ILE HG12 . . 4.700 3.944 3.264 4.303 . 0 0 "[ . 1 . 2]" 1
1588 1 59 GLU QB 1 89 ILE HG13 . . 5.180 4.441 3.506 4.835 . 0 0 "[ . 1 . 2]" 1
1589 1 59 GLU HB2 1 60 GLY H . . 4.880 3.996 2.822 4.566 . 0 0 "[ . 1 . 2]" 1
1590 1 59 GLU HB3 1 60 GLY H . . 4.880 3.512 2.259 4.411 . 0 0 "[ . 1 . 2]" 1
1591 1 59 GLU QG 1 60 GLY H . . 4.530 3.696 2.268 4.492 . 0 0 "[ . 1 . 2]" 1
1592 1 59 GLU QG 1 60 GLY QA . . 5.180 4.376 3.717 5.185 0.005 4 0 "[ . 1 . 2]" 1
1593 1 59 GLU QG 1 87 VAL QG . . 4.260 2.940 1.916 3.502 . 0 0 "[ . 1 . 2]" 1
1594 1 59 GLU QG 1 89 ILE MD . . 3.350 2.525 1.702 3.329 . 0 0 "[ . 1 . 2]" 1
1595 1 59 GLU QG 1 89 ILE HG12 . . 4.780 3.808 2.574 4.385 . 0 0 "[ . 1 . 2]" 1
1596 1 59 GLU QG 1 108 ARG QG . . 5.180 4.162 3.086 4.841 . 0 0 "[ . 1 . 2]" 1
1597 1 59 GLU HG2 1 60 GLY H . . 5.300 4.049 2.997 5.077 . 0 0 "[ . 1 . 2]" 1
1598 1 59 GLU HG3 1 60 GLY H . . 5.300 4.658 2.286 5.296 . 0 0 "[ . 1 . 2]" 1
1599 1 60 GLY H 1 61 ILE H . . 3.510 2.689 2.068 3.349 . 0 0 "[ . 1 . 2]" 1
1600 1 60 GLY H 1 61 ILE HB . . 5.500 4.772 4.393 5.123 . 0 0 "[ . 1 . 2]" 1
1601 1 60 GLY H 1 89 ILE MD . . 5.500 5.127 4.152 5.506 0.006 13 0 "[ . 1 . 2]" 1
1602 1 60 GLY QA 1 61 ILE HB . . 5.340 4.936 4.829 5.046 . 0 0 "[ . 1 . 2]" 1
1603 1 61 ILE H 1 61 ILE HB . . 2.970 2.545 2.354 2.650 . 0 0 "[ . 1 . 2]" 1
1604 1 61 ILE H 1 61 ILE MD . . 3.860 3.315 2.929 3.822 . 0 0 "[ . 1 . 2]" 1
1605 1 61 ILE H 1 61 ILE HG12 . . 3.980 2.370 1.918 3.721 . 0 0 "[ . 1 . 2]" 1
1606 1 61 ILE H 1 61 ILE QG . . 3.300 2.159 1.909 2.470 . 0 0 "[ . 1 . 2]" 1
1607 1 61 ILE H 1 61 ILE HG13 . . 3.980 3.387 2.132 3.856 . 0 0 "[ . 1 . 2]" 1
1608 1 61 ILE H 1 61 ILE MG . . 3.920 3.767 3.718 3.803 . 0 0 "[ . 1 . 2]" 1
1609 1 61 ILE H 1 62 ALA H . . 4.650 4.560 4.279 4.639 . 0 0 "[ . 1 . 2]" 1
1610 1 61 ILE HA 1 61 ILE MD . . 3.840 2.387 1.925 3.846 0.006 3 0 "[ . 1 . 2]" 1
1611 1 61 ILE HA 1 61 ILE HG12 . . 3.870 2.955 2.428 3.244 . 0 0 "[ . 1 . 2]" 1
1612 1 61 ILE HA 1 61 ILE QG . . 3.360 2.821 2.299 3.049 . 0 0 "[ . 1 . 2]" 1
1613 1 61 ILE HA 1 61 ILE HG13 . . 3.870 3.606 2.844 3.814 . 0 0 "[ . 1 . 2]" 1
1614 1 61 ILE HA 1 61 ILE MG . . 3.200 2.334 2.213 2.481 . 0 0 "[ . 1 . 2]" 1
1615 1 61 ILE HB 1 61 ILE MD . . 3.530 3.091 2.359 3.230 . 0 0 "[ . 1 . 2]" 1
1616 1 61 ILE HB 1 63 ARG H . . 4.220 3.749 3.117 4.287 0.067 15 0 "[ . 1 . 2]" 1
1617 1 61 ILE MD 1 61 ILE MG . . 2.710 1.992 1.870 2.189 . 0 0 "[ . 1 . 2]" 1
1618 1 61 ILE MD 1 63 ARG H . . 4.600 4.282 3.832 4.619 0.019 3 0 "[ . 1 . 2]" 1
1619 1 61 ILE MD 1 63 ARG QB . . 4.820 4.423 3.883 4.887 0.067 15 0 "[ . 1 . 2]" 1
1620 1 61 ILE HG12 1 61 ILE MG . . 3.260 3.058 2.336 3.194 . 0 0 "[ . 1 . 2]" 1
1621 1 61 ILE HG13 1 61 ILE MG . . 3.260 2.484 2.172 3.191 . 0 0 "[ . 1 . 2]" 1
1622 1 61 ILE MG 1 62 ALA H . . 4.800 2.231 1.857 3.145 . 0 0 "[ . 1 . 2]" 1
1623 1 61 ILE MG 1 62 ALA HA . . 4.480 3.916 3.613 4.215 . 0 0 "[ . 1 . 2]" 1
1624 1 61 ILE MG 1 63 ARG H . . 2.990 1.811 1.681 1.930 . 0 0 "[ . 1 . 2]" 1
1625 1 61 ILE MG 1 63 ARG HA . . 4.790 3.849 3.732 4.053 . 0 0 "[ . 1 . 2]" 1
1626 1 61 ILE MG 1 63 ARG HB2 . . 3.810 2.805 1.916 3.835 0.025 13 0 "[ . 1 . 2]" 1
1627 1 61 ILE MG 1 63 ARG QB . . 3.230 2.325 1.903 3.239 0.009 15 0 "[ . 1 . 2]" 1
1628 1 61 ILE MG 1 63 ARG HB3 . . 3.810 3.069 2.017 3.795 . 0 0 "[ . 1 . 2]" 1
1629 1 61 ILE MG 1 63 ARG QD . . 4.240 3.647 2.713 4.220 . 0 0 "[ . 1 . 2]" 1
1630 1 62 ALA H 1 63 ARG H . . 4.510 2.453 2.073 2.885 . 0 0 "[ . 1 . 2]" 1
1631 1 62 ALA HA 1 63 ARG H . . 3.480 3.283 2.921 3.489 0.009 12 0 "[ . 1 . 2]" 1
1632 1 62 ALA MB 1 63 ARG H . . 3.620 3.188 2.831 3.630 0.010 13 0 "[ . 1 . 2]" 1
1633 1 62 ALA MB 1 63 ARG HA . . 4.900 4.000 3.793 4.251 . 0 0 "[ . 1 . 2]" 1
1634 1 62 ALA MB 1 63 ARG QB . . 4.830 4.256 3.860 4.634 . 0 0 "[ . 1 . 2]" 1
1635 1 63 ARG H 1 63 ARG HB2 . . 3.780 2.726 2.210 3.879 0.099 13 0 "[ . 1 . 2]" 1
1636 1 63 ARG H 1 63 ARG QB . . 2.960 2.377 2.139 2.788 . 0 0 "[ . 1 . 2]" 1
1637 1 63 ARG H 1 63 ARG HB3 . . 3.780 3.121 2.198 3.746 . 0 0 "[ . 1 . 2]" 1
1638 1 63 ARG H 1 63 ARG QD . . 4.730 4.113 2.392 4.660 . 0 0 "[ . 1 . 2]" 1
1639 1 63 ARG H 1 63 ARG HG2 . . 4.620 3.816 2.141 4.592 . 0 0 "[ . 1 . 2]" 1
1640 1 63 ARG H 1 63 ARG QG . . 3.820 3.240 2.126 3.905 0.085 3 0 "[ . 1 . 2]" 1
1641 1 63 ARG H 1 63 ARG HG3 . . 4.620 3.833 2.566 4.616 . 0 0 "[ . 1 . 2]" 1
1642 1 63 ARG H 1 64 GLU H . . 4.540 4.420 4.087 4.603 0.063 11 0 "[ . 1 . 2]" 1
1643 1 63 ARG HA 1 63 ARG QD . . 4.530 3.764 1.988 4.543 0.013 15 0 "[ . 1 . 2]" 1
1644 1 63 ARG HA 1 63 ARG QG . . 3.520 2.616 2.198 3.339 . 0 0 "[ . 1 . 2]" 1
1645 1 63 ARG HA 1 64 GLU H . . 2.930 2.176 2.140 2.296 . 0 0 "[ . 1 . 2]" 1
1646 1 63 ARG QB 1 63 ARG QD . . 2.980 2.242 2.067 2.556 . 0 0 "[ . 1 . 2]" 1
1647 1 63 ARG QB 1 63 ARG QG . . 2.310 2.064 1.980 2.087 . 0 0 "[ . 1 . 2]" 1
1648 1 63 ARG QB 1 64 GLU H . . 3.930 3.360 2.669 3.886 . 0 0 "[ . 1 . 2]" 1
1649 1 63 ARG HG2 1 64 GLU H . . 5.080 4.147 2.714 5.084 0.004 20 0 "[ . 1 . 2]" 1
1650 1 63 ARG HG3 1 64 GLU H . . 5.080 4.125 2.299 5.087 0.007 11 0 "[ . 1 . 2]" 1
1651 1 64 GLU H 1 64 GLU HB3 . . 3.370 3.011 2.805 3.228 . 0 0 "[ . 1 . 2]" 1
1652 1 64 GLU H 1 64 GLU HG2 . . 4.430 3.103 2.290 3.598 . 0 0 "[ . 1 . 2]" 1
1653 1 64 GLU H 1 64 GLU QG . . 3.570 2.970 2.267 3.384 . 0 0 "[ . 1 . 2]" 1
1654 1 64 GLU H 1 64 GLU HG3 . . 4.430 3.893 3.458 4.121 . 0 0 "[ . 1 . 2]" 1
1655 1 64 GLU H 1 65 ARG H . . 4.500 4.436 4.320 4.513 0.013 19 0 "[ . 1 . 2]" 1
1656 1 64 GLU H 1 65 ARG QG . . 5.500 4.718 4.340 5.246 . 0 0 "[ . 1 . 2]" 1
1657 1 64 GLU HA 1 64 GLU QG . . 3.590 3.417 3.288 3.497 . 0 0 "[ . 1 . 2]" 1
1658 1 64 GLU HA 1 65 ARG H . . 2.680 2.283 2.215 2.390 . 0 0 "[ . 1 . 2]" 1
1659 1 64 GLU HA 1 65 ARG HB2 . . 4.910 4.547 4.294 4.812 . 0 0 "[ . 1 . 2]" 1
1660 1 64 GLU HB2 1 65 ARG H . . 3.450 2.805 2.519 3.001 . 0 0 "[ . 1 . 2]" 1
1661 1 64 GLU QG 1 65 ARG H . . 3.760 3.503 3.177 3.711 . 0 0 "[ . 1 . 2]" 1
1662 1 64 GLU QG 1 65 ARG HA . . 4.220 3.805 3.606 4.040 . 0 0 "[ . 1 . 2]" 1
1663 1 65 ARG H 1 65 ARG HB2 . . 3.320 2.556 2.397 2.758 . 0 0 "[ . 1 . 2]" 1
1664 1 65 ARG H 1 65 ARG HB3 . . 4.010 3.711 3.610 3.797 . 0 0 "[ . 1 . 2]" 1
1665 1 65 ARG H 1 65 ARG QD . . 4.710 4.221 2.028 4.691 . 0 0 "[ . 1 . 2]" 1
1666 1 65 ARG H 1 65 ARG QG . . 3.710 2.889 2.480 3.532 . 0 0 "[ . 1 . 2]" 1
1667 1 65 ARG H 1 66 VAL H . . 4.500 4.469 4.399 4.508 0.008 14 0 "[ . 1 . 2]" 1
1668 1 65 ARG HA 1 65 ARG QD . . 3.900 3.235 2.410 3.969 0.069 4 0 "[ . 1 . 2]" 1
1669 1 65 ARG HA 1 65 ARG QG . . 3.070 2.519 2.184 2.868 . 0 0 "[ . 1 . 2]" 1
1670 1 65 ARG HA 1 66 VAL H . . 2.870 2.207 2.183 2.264 . 0 0 "[ . 1 . 2]" 1
1671 1 65 ARG HA 1 66 VAL HB . . 4.700 4.308 4.255 4.397 . 0 0 "[ . 1 . 2]" 1
1672 1 65 ARG HA 1 66 VAL MG1 . . 4.450 4.127 3.975 4.229 . 0 0 "[ . 1 . 2]" 1
1673 1 65 ARG HA 1 66 VAL MG2 . . 5.500 5.356 5.315 5.415 . 0 0 "[ . 1 . 2]" 1
1674 1 65 ARG HB2 1 65 ARG QD . . 3.590 2.932 2.223 3.494 . 0 0 "[ . 1 . 2]" 1
1675 1 65 ARG HB2 1 66 VAL H . . 4.140 4.045 3.902 4.144 0.004 2 0 "[ . 1 . 2]" 1
1676 1 65 ARG HB3 1 66 VAL H . . 3.100 3.011 2.809 3.102 0.002 20 0 "[ . 1 . 2]" 1
1677 1 65 ARG QD 1 66 VAL H . . 5.240 4.303 2.970 5.158 . 0 0 "[ . 1 . 2]" 1
1678 1 66 VAL H 1 66 VAL HB . . 3.550 2.629 2.545 2.713 . 0 0 "[ . 1 . 2]" 1
1679 1 66 VAL H 1 66 VAL MG1 . . 3.030 2.263 2.158 2.360 . 0 0 "[ . 1 . 2]" 1
1680 1 66 VAL H 1 66 VAL MG2 . . 3.890 3.823 3.803 3.840 . 0 0 "[ . 1 . 2]" 1
1681 1 66 VAL H 1 67 GLU H . . 4.720 4.532 4.490 4.571 . 0 0 "[ . 1 . 2]" 1
1682 1 66 VAL HA 1 66 VAL MG1 . . 3.430 3.181 3.165 3.194 . 0 0 "[ . 1 . 2]" 1
1683 1 66 VAL HA 1 66 VAL MG2 . . 3.360 2.155 2.042 2.282 . 0 0 "[ . 1 . 2]" 1
1684 1 66 VAL HA 1 67 GLU H . . 3.030 2.203 2.166 2.266 . 0 0 "[ . 1 . 2]" 1
1685 1 66 VAL HA 1 79 ILE MD . . 5.500 5.290 4.989 5.505 0.005 13 0 "[ . 1 . 2]" 1
1686 1 66 VAL HB 1 67 GLU H . . 4.510 4.207 4.058 4.318 . 0 0 "[ . 1 . 2]" 1
1687 1 66 VAL MG1 1 67 GLU H . . 3.700 3.529 3.390 3.699 . 0 0 "[ . 1 . 2]" 1
1688 1 66 VAL MG1 1 67 GLU HB2 . . 5.140 4.988 4.902 5.136 . 0 0 "[ . 1 . 2]" 1
1689 1 66 VAL MG1 1 68 ASN H . . 4.390 3.655 3.490 3.856 . 0 0 "[ . 1 . 2]" 1
1690 1 66 VAL MG1 1 68 ASN HD21 . . 4.180 3.632 2.714 4.052 . 0 0 "[ . 1 . 2]" 1
1691 1 66 VAL MG1 1 68 ASN QD . . 3.650 2.784 2.472 3.062 . 0 0 "[ . 1 . 2]" 1
1692 1 66 VAL MG1 1 68 ASN HD22 . . 4.180 2.975 2.527 3.621 . 0 0 "[ . 1 . 2]" 1
1693 1 66 VAL MG2 1 67 GLU H . . 3.460 2.354 2.088 2.612 . 0 0 "[ . 1 . 2]" 1
1694 1 66 VAL MG2 1 68 ASN H . . 4.890 4.022 3.825 4.204 . 0 0 "[ . 1 . 2]" 1
1695 1 66 VAL MG2 1 68 ASN HD21 . . 4.960 3.779 3.008 4.936 . 0 0 "[ . 1 . 2]" 1
1696 1 66 VAL MG2 1 68 ASN QD . . 4.160 3.203 2.601 3.993 . 0 0 "[ . 1 . 2]" 1
1697 1 66 VAL MG2 1 68 ASN HD22 . . 4.960 3.563 2.846 4.941 . 0 0 "[ . 1 . 2]" 1
1698 1 66 VAL MG2 1 93 MET ME . . 4.490 3.809 3.026 4.066 . 0 0 "[ . 1 . 2]" 1
1699 1 67 GLU H 1 67 GLU HB2 . . 3.760 2.807 2.711 2.894 . 0 0 "[ . 1 . 2]" 1
1700 1 67 GLU H 1 67 GLU HB3 . . 3.820 2.953 2.899 3.031 . 0 0 "[ . 1 . 2]" 1
1701 1 67 GLU H 1 67 GLU HG2 . . 5.210 4.759 4.537 4.948 . 0 0 "[ . 1 . 2]" 1
1702 1 67 GLU H 1 67 GLU QG . . 4.410 4.218 4.110 4.298 . 0 0 "[ . 1 . 2]" 1
1703 1 67 GLU H 1 67 GLU HG3 . . 5.210 4.743 4.493 4.962 . 0 0 "[ . 1 . 2]" 1
1704 1 67 GLU H 1 68 ASN H . . 4.290 4.052 3.980 4.138 . 0 0 "[ . 1 . 2]" 1
1705 1 67 GLU HB2 1 68 ASN H . . 4.640 4.572 4.547 4.587 . 0 0 "[ . 1 . 2]" 1
1706 1 67 GLU HB2 1 79 ILE MD . . 3.420 2.756 2.494 2.950 . 0 0 "[ . 1 . 2]" 1
1707 1 67 GLU HB2 1 79 ILE MG . . 5.020 3.622 3.235 4.016 . 0 0 "[ . 1 . 2]" 1
1708 1 67 GLU HB3 1 68 ASN H . . 4.420 4.206 4.151 4.231 . 0 0 "[ . 1 . 2]" 1
1709 1 67 GLU HB3 1 79 ILE MD . . 3.470 2.498 2.316 2.668 . 0 0 "[ . 1 . 2]" 1
1710 1 67 GLU QG 1 68 ASN H . . 3.750 3.532 3.353 3.722 . 0 0 "[ . 1 . 2]" 1
1711 1 67 GLU QG 1 77 VAL MG2 . . 4.300 3.477 3.034 3.952 . 0 0 "[ . 1 . 2]" 1
1712 1 67 GLU QG 1 79 ILE HA . . 4.100 3.510 3.117 4.081 . 0 0 "[ . 1 . 2]" 1
1713 1 67 GLU QG 1 79 ILE MD . . 3.410 2.630 2.321 3.056 . 0 0 "[ . 1 . 2]" 1
1714 1 67 GLU QG 1 79 ILE MG . . 4.120 3.778 3.398 4.125 0.005 16 0 "[ . 1 . 2]" 1
1715 1 67 GLU HG2 1 77 VAL MG2 . . 5.090 4.068 3.081 4.933 . 0 0 "[ . 1 . 2]" 1
1716 1 67 GLU HG3 1 77 VAL MG2 . . 5.090 3.963 3.342 4.802 . 0 0 "[ . 1 . 2]" 1
1717 1 68 ASN H 1 68 ASN HB2 . . 3.750 2.717 2.263 3.502 . 0 0 "[ . 1 . 2]" 1
1718 1 68 ASN H 1 68 ASN QB . . 2.930 2.594 2.238 2.864 . 0 0 "[ . 1 . 2]" 1
1719 1 68 ASN H 1 68 ASN HB3 . . 3.750 3.533 3.032 3.610 . 0 0 "[ . 1 . 2]" 1
1720 1 68 ASN H 1 68 ASN HD21 . . 4.450 2.904 1.975 3.808 . 0 0 "[ . 1 . 2]" 1
1721 1 68 ASN H 1 68 ASN QD . . 3.770 2.725 1.924 3.454 . 0 0 "[ . 1 . 2]" 1
1722 1 68 ASN H 1 68 ASN HD22 . . 4.450 3.506 2.600 3.956 . 0 0 "[ . 1 . 2]" 1
1723 1 68 ASN H 1 69 THR H . . 4.810 4.526 4.510 4.557 . 0 0 "[ . 1 . 2]" 1
1724 1 68 ASN H 1 77 VAL MG2 . . 5.500 5.426 5.173 5.503 0.003 18 0 "[ . 1 . 2]" 1
1725 1 68 ASN HA 1 69 THR H . . 2.840 2.149 2.145 2.163 . 0 0 "[ . 1 . 2]" 1
1726 1 68 ASN HA 1 69 THR MG . . 4.630 3.831 3.768 3.954 . 0 0 "[ . 1 . 2]" 1
1727 1 68 ASN QB 1 68 ASN QD . . 3.010 2.294 2.067 2.497 . 0 0 "[ . 1 . 2]" 1
1728 1 68 ASN QB 1 69 THR H . . 3.230 3.205 3.138 3.234 0.004 15 0 "[ . 1 . 2]" 1
1729 1 69 THR H 1 69 THR MG . . 3.150 2.260 2.168 2.413 . 0 0 "[ . 1 . 2]" 1
1730 1 69 THR H 1 70 SER H . . 5.480 4.538 4.507 4.572 . 0 0 "[ . 1 . 2]" 1
1731 1 69 THR H 1 77 VAL MG2 . . 4.150 3.903 3.599 4.076 . 0 0 "[ . 1 . 2]" 1
1732 1 69 THR HA 1 69 THR MG . . 3.380 2.262 2.209 2.296 . 0 0 "[ . 1 . 2]" 1
1733 1 69 THR HA 1 70 SER H . . 3.210 2.151 2.142 2.165 . 0 0 "[ . 1 . 2]" 1
1734 1 69 THR HA 1 70 SER HA . . 4.550 4.351 4.335 4.367 . 0 0 "[ . 1 . 2]" 1
1735 1 69 THR HA 1 71 HIS H . . 4.320 3.822 3.720 3.939 . 0 0 "[ . 1 . 2]" 1
1736 1 69 THR HA 1 77 VAL MG2 . . 3.960 2.205 1.987 2.486 . 0 0 "[ . 1 . 2]" 1
1737 1 69 THR HB 1 70 SER H . . 3.690 3.285 3.167 3.389 . 0 0 "[ . 1 . 2]" 1
1738 1 69 THR HB 1 71 HIS H . . 4.170 2.739 2.598 2.903 . 0 0 "[ . 1 . 2]" 1
1739 1 69 THR HB 1 74 GLU HB2 . . 4.250 2.856 2.500 3.440 . 0 0 "[ . 1 . 2]" 1
1740 1 69 THR HB 1 74 GLU HB3 . . 4.220 2.341 2.121 2.565 . 0 0 "[ . 1 . 2]" 1
1741 1 69 THR HB 1 74 GLU QG . . 4.550 3.680 2.871 4.021 . 0 0 "[ . 1 . 2]" 1
1742 1 69 THR MG 1 70 SER H . . 4.190 3.983 3.898 4.032 . 0 0 "[ . 1 . 2]" 1
1743 1 69 THR MG 1 74 GLU H . . 4.930 4.296 3.419 4.679 . 0 0 "[ . 1 . 2]" 1
1744 1 69 THR MG 1 74 GLU HB3 . . 4.260 2.429 2.104 2.938 . 0 0 "[ . 1 . 2]" 1
1745 1 69 THR MG 1 74 GLU QG . . 3.990 3.809 3.354 3.991 0.001 16 0 "[ . 1 . 2]" 1
1746 1 69 THR MG 1 75 MET HA . . 5.190 4.947 4.740 5.094 . 0 0 "[ . 1 . 2]" 1
1747 1 69 THR MG 1 76 GLN H . . 4.260 3.881 3.637 4.212 . 0 0 "[ . 1 . 2]" 1
1748 1 69 THR MG 1 77 VAL H . . 4.940 4.667 4.479 4.841 . 0 0 "[ . 1 . 2]" 1
1749 1 69 THR MG 1 77 VAL HA . . 4.770 4.022 3.821 4.246 . 0 0 "[ . 1 . 2]" 1
1750 1 69 THR MG 1 77 VAL HB . . 3.500 2.178 2.015 2.319 . 0 0 "[ . 1 . 2]" 1
1751 1 69 THR MG 1 77 VAL MG1 . . 3.110 2.948 2.536 3.116 0.006 18 0 "[ . 1 . 2]" 1
1752 1 69 THR MG 1 77 VAL MG2 . . 3.230 2.340 2.012 2.637 . 0 0 "[ . 1 . 2]" 1
1753 1 70 SER H 1 70 SER HB2 . . 4.020 2.619 2.224 3.626 . 0 0 "[ . 1 . 2]" 1
1754 1 70 SER H 1 70 SER QB . . 3.510 2.373 2.165 2.612 . 0 0 "[ . 1 . 2]" 1
1755 1 70 SER H 1 70 SER HB3 . . 4.020 3.073 2.509 3.629 . 0 0 "[ . 1 . 2]" 1
1756 1 70 SER H 1 71 HIS H . . 3.380 2.942 2.854 3.012 . 0 0 "[ . 1 . 2]" 1
1757 1 70 SER QB 1 71 HIS H . . 3.770 2.866 2.605 3.550 . 0 0 "[ . 1 . 2]" 1
1758 1 70 SER QB 1 71 HIS HD2 . . 4.070 2.624 2.040 3.725 . 0 0 "[ . 1 . 2]" 1
1759 1 70 SER HB2 1 71 HIS H . . 4.480 3.500 2.663 4.122 . 0 0 "[ . 1 . 2]" 1
1760 1 70 SER HB2 1 71 HIS HD2 . . 4.860 3.531 2.097 4.766 . 0 0 "[ . 1 . 2]" 1
1761 1 70 SER HB3 1 71 HIS H . . 4.480 3.332 2.648 4.103 . 0 0 "[ . 1 . 2]" 1
1762 1 70 SER HB3 1 71 HIS HD2 . . 4.860 3.059 2.115 4.741 . 0 0 "[ . 1 . 2]" 1
1763 1 71 HIS H 1 71 HIS HB2 . . 3.710 2.831 2.744 2.935 . 0 0 "[ . 1 . 2]" 1
1764 1 71 HIS H 1 71 HIS HB3 . . 4.000 3.873 3.820 3.917 . 0 0 "[ . 1 . 2]" 1
1765 1 71 HIS H 1 71 HIS HD2 . . 5.200 3.365 2.831 3.738 . 0 0 "[ . 1 . 2]" 1
1766 1 71 HIS H 1 72 PRO HD3 . . 5.130 4.827 4.751 4.888 . 0 0 "[ . 1 . 2]" 1
1767 1 71 HIS H 1 74 GLU HB2 . . 4.370 3.282 3.088 3.465 . 0 0 "[ . 1 . 2]" 1
1768 1 71 HIS H 1 74 GLU HB3 . . 4.350 4.124 3.735 4.330 . 0 0 "[ . 1 . 2]" 1
1769 1 71 HIS H 1 74 GLU QG . . 4.950 4.305 3.696 4.702 . 0 0 "[ . 1 . 2]" 1
1770 1 71 HIS HA 1 71 HIS HD2 . . 4.750 4.443 4.127 4.654 . 0 0 "[ . 1 . 2]" 1
1771 1 71 HIS HA 1 72 PRO HB3 . . 4.960 4.831 4.829 4.834 . 0 0 "[ . 1 . 2]" 1
1772 1 71 HIS HA 1 72 PRO HD2 . . 3.010 2.277 2.245 2.319 . 0 0 "[ . 1 . 2]" 1
1773 1 71 HIS HA 1 72 PRO HD3 . . 2.940 2.263 2.257 2.272 . 0 0 "[ . 1 . 2]" 1
1774 1 71 HIS HA 1 72 PRO HG2 . . 4.600 4.413 4.387 4.447 . 0 0 "[ . 1 . 2]" 1
1775 1 71 HIS HA 1 72 PRO QG . . 4.040 3.927 3.909 3.952 . 0 0 "[ . 1 . 2]" 1
1776 1 71 HIS HA 1 72 PRO HG3 . . 4.600 4.403 4.387 4.424 . 0 0 "[ . 1 . 2]" 1
1777 1 71 HIS HB2 1 72 PRO HD2 . . 3.750 3.690 3.534 3.750 0.000 14 0 "[ . 1 . 2]" 1
1778 1 71 HIS HB2 1 72 PRO HD3 . . 4.850 4.728 4.623 4.769 . 0 0 "[ . 1 . 2]" 1
1779 1 71 HIS HB2 1 74 GLU H . . 4.890 3.908 3.583 4.724 . 0 0 "[ . 1 . 2]" 1
1780 1 71 HIS HB2 1 74 GLU HB2 . . 4.250 2.917 2.429 3.111 . 0 0 "[ . 1 . 2]" 1
1781 1 71 HIS HB2 1 74 GLU HB3 . . 4.870 4.589 4.017 4.815 . 0 0 "[ . 1 . 2]" 1
1782 1 71 HIS HB2 1 74 GLU QG . . 4.000 3.866 3.591 4.001 0.001 1 0 "[ . 1 . 2]" 1
1783 1 71 HIS HB3 1 72 PRO HD2 . . 3.610 2.240 2.140 2.309 . 0 0 "[ . 1 . 2]" 1
1784 1 71 HIS HB3 1 72 PRO HD3 . . 3.950 3.649 3.550 3.708 . 0 0 "[ . 1 . 2]" 1
1785 1 71 HIS HB3 1 74 GLU HB2 . . 4.490 4.387 4.000 4.491 0.001 4 0 "[ . 1 . 2]" 1
1786 1 71 HIS HD2 1 74 GLU HB2 . . 5.230 4.526 3.967 4.851 . 0 0 "[ . 1 . 2]" 1
1787 1 71 HIS HD2 1 74 GLU QG . . 4.870 4.214 3.740 4.848 . 0 0 "[ . 1 . 2]" 1
1788 1 72 PRO HA 1 73 GLY H . . 2.910 2.163 2.154 2.182 . 0 0 "[ . 1 . 2]" 1
1789 1 72 PRO HA 1 73 GLY QA . . 4.560 3.931 3.912 3.951 . 0 0 "[ . 1 . 2]" 1
1790 1 72 PRO HA 1 74 GLU H . . 3.910 3.604 3.411 3.845 . 0 0 "[ . 1 . 2]" 1
1791 1 72 PRO HB2 1 73 GLY H . . 3.740 3.519 3.353 3.710 . 0 0 "[ . 1 . 2]" 1
1792 1 72 PRO HB2 1 73 GLY QA . . 4.860 3.944 3.878 4.013 . 0 0 "[ . 1 . 2]" 1
1793 1 72 PRO HB3 1 73 GLY H . . 4.120 3.993 3.884 4.125 0.005 14 0 "[ . 1 . 2]" 1
1794 1 73 GLY H 1 74 GLU H . . 3.350 2.718 2.233 2.874 . 0 0 "[ . 1 . 2]" 1
1795 1 73 GLY QA 1 74 GLU HB2 . . 5.340 4.733 4.673 4.785 . 0 0 "[ . 1 . 2]" 1
1796 1 73 GLY QA 1 75 MET ME . . 5.340 3.663 3.490 3.805 . 0 0 "[ . 1 . 2]" 1
1797 1 74 GLU H 1 74 GLU HB2 . . 3.050 2.202 2.168 2.381 . 0 0 "[ . 1 . 2]" 1
1798 1 74 GLU H 1 74 GLU HB3 . . 3.180 2.986 2.837 3.079 . 0 0 "[ . 1 . 2]" 1
1799 1 74 GLU H 1 74 GLU QG . . 4.510 3.891 3.745 4.048 . 0 0 "[ . 1 . 2]" 1
1800 1 74 GLU H 1 75 MET H . . 4.790 4.486 4.430 4.551 . 0 0 "[ . 1 . 2]" 1
1801 1 74 GLU HA 1 74 GLU QG . . 3.310 2.434 2.142 2.949 . 0 0 "[ . 1 . 2]" 1
1802 1 74 GLU HA 1 75 MET H . . 2.680 2.145 2.140 2.162 . 0 0 "[ . 1 . 2]" 1
1803 1 74 GLU HA 1 75 MET HA . . 4.720 4.384 4.371 4.403 . 0 0 "[ . 1 . 2]" 1
1804 1 74 GLU HA 1 75 MET HB2 . . 4.600 4.507 4.473 4.600 0.000 14 0 "[ . 1 . 2]" 1
1805 1 74 GLU HA 1 75 MET ME . . 5.010 4.739 4.292 4.888 . 0 0 "[ . 1 . 2]" 1
1806 1 74 GLU HA 1 75 MET HG2 . . 4.630 4.042 3.749 4.151 . 0 0 "[ . 1 . 2]" 1
1807 1 74 GLU HA 1 76 GLN H . . 3.890 3.545 3.364 3.772 . 0 0 "[ . 1 . 2]" 1
1808 1 74 GLU HB3 1 75 MET H . . 4.400 4.029 3.874 4.149 . 0 0 "[ . 1 . 2]" 1
1809 1 74 GLU HB3 1 76 GLN H . . 4.370 3.057 2.872 3.240 . 0 0 "[ . 1 . 2]" 1
1810 1 74 GLU QG 1 75 MET H . . 3.870 3.055 2.777 3.223 . 0 0 "[ . 1 . 2]" 1
1811 1 74 GLU QG 1 76 GLN H . . 3.300 2.138 1.894 2.394 . 0 0 "[ . 1 . 2]" 1
1812 1 74 GLU QG 1 76 GLN QB . . 4.840 3.819 3.066 4.186 . 0 0 "[ . 1 . 2]" 1
1813 1 74 GLU QG 1 76 GLN QE . . 4.330 3.605 2.189 4.338 0.008 13 0 "[ . 1 . 2]" 1
1814 1 75 MET H 1 75 MET HB2 . . 3.410 2.395 2.363 2.490 . 0 0 "[ . 1 . 2]" 1
1815 1 75 MET H 1 75 MET HB3 . . 3.740 3.609 3.590 3.651 . 0 0 "[ . 1 . 2]" 1
1816 1 75 MET H 1 75 MET ME . . 4.020 3.879 3.663 4.026 0.006 16 0 "[ . 1 . 2]" 1
1817 1 75 MET H 1 75 MET HG2 . . 3.430 2.683 2.544 2.815 . 0 0 "[ . 1 . 2]" 1
1818 1 75 MET H 1 75 MET HG3 . . 3.710 3.561 3.448 3.699 . 0 0 "[ . 1 . 2]" 1
1819 1 75 MET H 1 76 GLN H . . 3.140 2.705 2.491 2.861 . 0 0 "[ . 1 . 2]" 1
1820 1 75 MET H 1 76 GLN QE . . 4.870 3.939 2.939 4.821 . 0 0 "[ . 1 . 2]" 1
1821 1 75 MET HA 1 75 MET ME . . 3.520 2.125 1.934 2.358 . 0 0 "[ . 1 . 2]" 1
1822 1 75 MET HA 1 75 MET HG2 . . 3.790 2.659 2.622 2.772 . 0 0 "[ . 1 . 2]" 1
1823 1 75 MET HA 1 75 MET HG3 . . 3.930 3.746 3.728 3.798 . 0 0 "[ . 1 . 2]" 1
1824 1 75 MET HA 1 76 GLN H . . 3.180 3.083 2.956 3.204 0.024 18 0 "[ . 1 . 2]" 1
1825 1 75 MET HB2 1 75 MET ME . . 3.980 3.919 3.835 3.980 . 3 0 "[ . 1 . 2]" 1
1826 1 75 MET HB2 1 76 GLN H . . 4.420 3.879 3.673 4.059 . 0 0 "[ . 1 . 2]" 1
1827 1 75 MET HB3 1 75 MET ME . . 4.290 3.260 3.023 3.430 . 0 0 "[ . 1 . 2]" 1
1828 1 75 MET HB3 1 76 GLN H . . 4.640 4.359 4.281 4.454 . 0 0 "[ . 1 . 2]" 1
1829 1 75 MET ME 1 75 MET HG2 . . 3.370 2.160 2.051 2.278 . 0 0 "[ . 1 . 2]" 1
1830 1 76 GLN H 1 76 GLN QE . . 4.660 4.101 3.461 4.663 0.003 8 0 "[ . 1 . 2]" 1
1831 1 76 GLN H 1 76 GLN QG . . 3.230 2.956 2.661 3.243 0.013 12 0 "[ . 1 . 2]" 1
1832 1 76 GLN H 1 77 VAL H . . 4.400 4.267 4.149 4.361 . 0 0 "[ . 1 . 2]" 1
1833 1 76 GLN HA 1 77 VAL H . . 2.770 2.245 2.183 2.314 . 0 0 "[ . 1 . 2]" 1
1834 1 76 GLN QB 1 77 VAL H . . 3.090 2.836 2.651 3.036 . 0 0 "[ . 1 . 2]" 1
1835 1 76 GLN QG 1 77 VAL H . . 4.550 3.991 3.545 4.460 . 0 0 "[ . 1 . 2]" 1
1836 1 77 VAL H 1 77 VAL HB . . 3.980 3.220 3.100 3.394 . 0 0 "[ . 1 . 2]" 1
1837 1 77 VAL H 1 77 VAL MG1 . . 3.250 2.478 2.398 2.616 . 0 0 "[ . 1 . 2]" 1
1838 1 77 VAL H 1 77 VAL MG2 . . 4.250 4.009 3.982 4.032 . 0 0 "[ . 1 . 2]" 1
1839 1 77 VAL H 1 78 THR H . . 4.500 4.386 4.321 4.426 . 0 0 "[ . 1 . 2]" 1
1840 1 77 VAL H 1 79 ILE MD . . 5.500 5.384 5.088 5.495 . 0 0 "[ . 1 . 2]" 1
1841 1 77 VAL HA 1 77 VAL MG2 . . 3.200 2.178 2.080 2.295 . 0 0 "[ . 1 . 2]" 1
1842 1 77 VAL HA 1 78 THR H . . 2.590 2.356 2.296 2.444 . 0 0 "[ . 1 . 2]" 1
1843 1 77 VAL HA 1 78 THR HB . . 4.750 4.716 4.659 4.749 . 0 0 "[ . 1 . 2]" 1
1844 1 77 VAL HB 1 78 THR H . . 4.020 3.931 3.821 4.035 0.015 15 0 "[ . 1 . 2]" 1
1845 1 77 VAL MG2 1 78 THR H . . 3.070 1.919 1.804 2.082 . 0 0 "[ . 1 . 2]" 1
1846 1 77 VAL MG2 1 78 THR HB . . 4.340 3.975 3.864 4.203 . 0 0 "[ . 1 . 2]" 1
1847 1 77 VAL MG2 1 79 ILE HA . . 4.580 4.388 4.226 4.531 . 0 0 "[ . 1 . 2]" 1
1848 1 78 THR H 1 78 THR HB . . 2.890 2.655 2.569 2.715 . 0 0 "[ . 1 . 2]" 1
1849 1 78 THR H 1 78 THR MG . . 3.880 3.862 3.826 3.885 0.005 1 0 "[ . 1 . 2]" 1
1850 1 78 THR H 1 79 ILE H . . 4.440 4.437 4.390 4.494 0.054 20 0 "[ . 1 . 2]" 1
1851 1 78 THR HB 1 79 ILE H . . 4.490 4.050 3.950 4.143 . 0 0 "[ . 1 . 2]" 1
1852 1 78 THR HB 1 80 GLN HE21 . . 5.130 3.315 2.263 4.020 . 0 0 "[ . 1 . 2]" 1
1853 1 78 THR HB 1 80 GLN QE . . 4.320 3.235 2.170 3.879 . 0 0 "[ . 1 . 2]" 1
1854 1 78 THR HB 1 80 GLN HE22 . . 5.130 4.630 2.790 5.106 . 0 0 "[ . 1 . 2]" 1
1855 1 78 THR HB 1 80 GLN HG2 . . 4.950 4.811 4.666 4.968 0.018 20 0 "[ . 1 . 2]" 1
1856 1 78 THR HB 1 80 GLN HG3 . . 4.860 3.717 3.582 4.004 . 0 0 "[ . 1 . 2]" 1
1857 1 78 THR MG 1 79 ILE H . . 3.350 2.330 2.133 2.530 . 0 0 "[ . 1 . 2]" 1
1858 1 78 THR MG 1 79 ILE HA . . 4.790 3.805 3.664 3.989 . 0 0 "[ . 1 . 2]" 1
1859 1 78 THR MG 1 80 GLN H . . 4.570 3.437 3.203 3.633 . 0 0 "[ . 1 . 2]" 1
1860 1 78 THR MG 1 80 GLN HA . . 5.130 3.825 3.719 3.954 . 0 0 "[ . 1 . 2]" 1
1861 1 78 THR MG 1 80 GLN HE21 . . 4.310 2.547 2.117 2.821 . 0 0 "[ . 1 . 2]" 1
1862 1 78 THR MG 1 80 GLN QE . . 3.660 2.516 2.099 2.773 . 0 0 "[ . 1 . 2]" 1
1863 1 78 THR MG 1 80 GLN HE22 . . 4.310 3.954 3.463 4.184 . 0 0 "[ . 1 . 2]" 1
1864 1 78 THR MG 1 80 GLN HG2 . . 3.680 2.851 2.569 3.687 0.007 15 0 "[ . 1 . 2]" 1
1865 1 78 THR MG 1 80 GLN HG3 . . 3.680 2.307 2.047 2.622 . 0 0 "[ . 1 . 2]" 1
1866 1 79 ILE H 1 79 ILE HB . . 3.250 2.712 2.649 2.770 . 0 0 "[ . 1 . 2]" 1
1867 1 79 ILE H 1 79 ILE MD . . 3.730 3.511 3.381 3.649 . 0 0 "[ . 1 . 2]" 1
1868 1 79 ILE H 1 79 ILE QG . . 3.350 2.442 2.353 2.577 . 0 0 "[ . 1 . 2]" 1
1869 1 79 ILE H 1 79 ILE MG . . 4.000 3.872 3.845 3.892 . 0 0 "[ . 1 . 2]" 1
1870 1 79 ILE H 1 80 GLN H . . 4.450 3.977 3.923 4.038 . 0 0 "[ . 1 . 2]" 1
1871 1 79 ILE H 1 82 LEU MD1 . . 4.720 4.198 4.061 4.358 . 0 0 "[ . 1 . 2]" 1
1872 1 79 ILE HA 1 79 ILE MD . . 3.200 2.049 1.976 2.127 . 0 0 "[ . 1 . 2]" 1
1873 1 79 ILE HA 1 79 ILE QG . . 3.670 3.012 2.945 3.071 . 0 0 "[ . 1 . 2]" 1
1874 1 79 ILE HA 1 79 ILE MG . . 3.270 2.267 2.169 2.346 . 0 0 "[ . 1 . 2]" 1
1875 1 79 ILE HA 1 80 GLN H . . 2.660 2.226 2.208 2.234 . 0 0 "[ . 1 . 2]" 1
1876 1 79 ILE HA 1 80 GLN HB2 . . 4.900 4.754 4.679 4.844 . 0 0 "[ . 1 . 2]" 1
1877 1 79 ILE HA 1 80 GLN HG3 . . 4.450 4.133 3.943 4.482 0.032 15 0 "[ . 1 . 2]" 1
1878 1 79 ILE HA 1 82 LEU MD1 . . 4.840 4.393 4.176 4.567 . 0 0 "[ . 1 . 2]" 1
1879 1 79 ILE HB 1 79 ILE MD . . 3.520 3.217 3.214 3.220 . 0 0 "[ . 1 . 2]" 1
1880 1 79 ILE HB 1 80 GLN H . . 4.620 4.387 4.344 4.409 . 0 0 "[ . 1 . 2]" 1
1881 1 79 ILE HB 1 82 LEU MD1 . . 3.740 2.281 2.073 2.595 . 0 0 "[ . 1 . 2]" 1
1882 1 79 ILE HB 1 82 LEU MD2 . . 4.330 3.779 3.538 3.970 . 0 0 "[ . 1 . 2]" 1
1883 1 79 ILE HB 1 90 PHE QD . . 4.830 4.435 4.230 4.674 . 0 0 "[ . 1 . 2]" 1
1884 1 79 ILE HB 1 90 PHE QE . . 4.380 2.418 2.176 2.654 . 0 0 "[ . 1 . 2]" 1
1885 1 79 ILE HB 1 90 PHE HZ . . 4.960 3.481 3.302 3.574 . 0 0 "[ . 1 . 2]" 1
1886 1 79 ILE MD 1 79 ILE MG . . 2.870 2.034 1.905 2.140 . 0 0 "[ . 1 . 2]" 1
1887 1 79 ILE MD 1 80 GLN H . . 4.050 3.986 3.903 4.046 . 0 0 "[ . 1 . 2]" 1
1888 1 79 ILE MD 1 82 LEU MD2 . . 4.870 4.774 4.697 4.867 . 0 0 "[ . 1 . 2]" 1
1889 1 79 ILE MD 1 90 PHE QD . . 4.010 3.495 3.321 3.624 . 0 0 "[ . 1 . 2]" 1
1890 1 79 ILE MD 1 90 PHE QE . . 3.560 3.453 3.242 3.565 0.005 14 0 "[ . 1 . 2]" 1
1891 1 79 ILE QG 1 79 ILE MG . . 3.070 2.325 2.238 2.398 . 0 0 "[ . 1 . 2]" 1
1892 1 79 ILE QG 1 80 GLN H . . 5.290 4.844 4.804 4.880 . 0 0 "[ . 1 . 2]" 1
1893 1 79 ILE QG 1 90 PHE QD . . 5.160 2.548 2.375 2.787 . 0 0 "[ . 1 . 2]" 1
1894 1 79 ILE QG 1 90 PHE QE . . 3.620 1.989 1.979 2.000 . 0 0 "[ . 1 . 2]" 1
1895 1 79 ILE QG 1 90 PHE HZ . . 4.390 4.065 3.892 4.182 . 0 0 "[ . 1 . 2]" 1
1896 1 79 ILE MG 1 80 GLN H . . 3.370 3.253 3.194 3.365 . 0 0 "[ . 1 . 2]" 1
1897 1 79 ILE MG 1 82 LEU H . . 5.500 5.353 5.220 5.436 . 0 0 "[ . 1 . 2]" 1
1898 1 79 ILE MG 1 82 LEU HA . . 5.250 5.117 4.919 5.233 . 0 0 "[ . 1 . 2]" 1
1899 1 79 ILE MG 1 82 LEU MD1 . . 3.150 2.169 1.945 2.455 . 0 0 "[ . 1 . 2]" 1
1900 1 79 ILE MG 1 82 LEU MD2 . . 2.940 2.163 2.021 2.358 . 0 0 "[ . 1 . 2]" 1
1901 1 79 ILE MG 1 82 LEU HG . . 4.210 3.021 2.629 3.194 . 0 0 "[ . 1 . 2]" 1
1902 1 79 ILE MG 1 90 PHE QD . . 4.910 3.674 3.414 3.843 . 0 0 "[ . 1 . 2]" 1
1903 1 79 ILE MG 1 90 PHE QE . . 3.640 2.147 1.966 2.441 . 0 0 "[ . 1 . 2]" 1
1904 1 79 ILE MG 1 90 PHE HZ . . 4.370 3.460 3.132 3.771 . 0 0 "[ . 1 . 2]" 1
1905 1 80 GLN H 1 80 GLN HB2 . . 3.290 2.551 2.480 2.659 . 0 0 "[ . 1 . 2]" 1
1906 1 80 GLN H 1 80 GLN HB3 . . 4.040 3.636 3.621 3.651 . 0 0 "[ . 1 . 2]" 1
1907 1 80 GLN H 1 80 GLN QE . . 5.020 4.223 3.317 4.697 . 0 0 "[ . 1 . 2]" 1
1908 1 80 GLN H 1 80 GLN HG2 . . 3.740 3.584 3.467 3.778 0.038 6 0 "[ . 1 . 2]" 1
1909 1 80 GLN H 1 80 GLN HG3 . . 3.380 2.386 2.187 2.743 . 0 0 "[ . 1 . 2]" 1
1910 1 80 GLN H 1 81 ASN H . . 4.550 4.505 4.470 4.538 . 0 0 "[ . 1 . 2]" 1
1911 1 80 GLN H 1 82 LEU HG . . 5.500 4.660 4.555 4.775 . 0 0 "[ . 1 . 2]" 1
1912 1 80 GLN HB2 1 80 GLN QE . . 4.280 3.840 3.514 4.014 . 0 0 "[ . 1 . 2]" 1
1913 1 80 GLN HB2 1 80 GLN HE22 . . 5.070 4.490 4.283 4.616 . 0 0 "[ . 1 . 2]" 1
1914 1 80 GLN HB2 1 81 ASN H . . 3.310 3.137 2.854 3.283 . 0 0 "[ . 1 . 2]" 1
1915 1 80 GLN HB2 1 81 ASN HD21 . . 4.660 3.482 2.440 4.638 . 0 0 "[ . 1 . 2]" 1
1916 1 80 GLN HB2 1 81 ASN HD22 . . 4.660 3.136 2.554 3.895 . 0 0 "[ . 1 . 2]" 1
1917 1 80 GLN HB3 1 81 ASN H . . 3.070 2.100 1.998 2.199 . 0 0 "[ . 1 . 2]" 1
1918 1 80 GLN HB3 1 81 ASN HA . . 4.540 4.171 4.093 4.246 . 0 0 "[ . 1 . 2]" 1
1919 1 80 GLN HB3 1 81 ASN HD21 . . 4.700 4.195 3.501 4.680 . 0 0 "[ . 1 . 2]" 1
1920 1 80 GLN HB3 1 81 ASN HD22 . . 4.700 4.008 3.658 4.463 . 0 0 "[ . 1 . 2]" 1
1921 1 80 GLN HB3 1 82 LEU H . . 4.900 4.585 4.488 4.680 . 0 0 "[ . 1 . 2]" 1
1922 1 80 GLN HG2 1 81 ASN H . . 4.190 4.127 3.996 4.313 0.123 6 0 "[ . 1 . 2]" 1
1923 1 80 GLN HG3 1 81 ASN H . . 4.950 4.679 4.365 4.781 . 0 0 "[ . 1 . 2]" 1
1924 1 81 ASN H 1 81 ASN HA . . 2.730 2.277 2.273 2.283 . 0 0 "[ . 1 . 2]" 1
1925 1 81 ASN H 1 81 ASN HB2 . . 4.090 3.721 3.530 3.804 . 0 0 "[ . 1 . 2]" 1
1926 1 81 ASN H 1 81 ASN HB3 . . 4.090 4.023 3.952 4.059 . 0 0 "[ . 1 . 2]" 1
1927 1 81 ASN H 1 82 LEU H . . 3.260 2.666 2.540 2.810 . 0 0 "[ . 1 . 2]" 1
1928 1 81 ASN HA 1 82 LEU H . . 3.190 2.724 2.648 2.791 . 0 0 "[ . 1 . 2]" 1
1929 1 81 ASN QB 1 81 ASN QD . . 2.820 2.190 2.066 2.441 . 0 0 "[ . 1 . 2]" 1
1930 1 81 ASN QB 1 82 LEU H . . 4.250 3.896 3.881 3.915 . 0 0 "[ . 1 . 2]" 1
1931 1 81 ASN HB2 1 82 LEU H . . 4.860 4.271 4.212 4.319 . 0 0 "[ . 1 . 2]" 1
1932 1 81 ASN HB3 1 82 LEU H . . 4.860 4.496 4.439 4.543 . 0 0 "[ . 1 . 2]" 1
1933 1 82 LEU H 1 82 LEU HB2 . . 3.310 2.615 2.534 2.676 . 0 0 "[ . 1 . 2]" 1
1934 1 82 LEU H 1 82 LEU HB3 . . 3.810 3.754 3.716 3.792 . 0 0 "[ . 1 . 2]" 1
1935 1 82 LEU H 1 82 LEU MD1 . . 4.150 4.060 3.992 4.150 0.000 15 0 "[ . 1 . 2]" 1
1936 1 82 LEU H 1 82 LEU MD2 . . 3.790 3.665 3.547 3.773 . 0 0 "[ . 1 . 2]" 1
1937 1 82 LEU H 1 82 LEU HG . . 3.060 2.914 2.784 3.064 0.004 20 0 "[ . 1 . 2]" 1
1938 1 82 LEU H 1 83 MET H . . 4.520 4.489 4.469 4.506 . 0 0 "[ . 1 . 2]" 1
1939 1 82 LEU HA 1 82 LEU MD1 . . 4.010 3.860 3.814 3.887 . 0 0 "[ . 1 . 2]" 1
1940 1 82 LEU HA 1 82 LEU MD2 . . 2.900 2.119 1.954 2.237 . 0 0 "[ . 1 . 2]" 1
1941 1 82 LEU HA 1 82 LEU HG . . 4.260 3.200 3.112 3.256 . 0 0 "[ . 1 . 2]" 1
1942 1 82 LEU HA 1 83 MET H . . 3.130 2.433 2.405 2.489 . 0 0 "[ . 1 . 2]" 1
1943 1 82 LEU HA 1 83 MET HB2 . . 4.890 4.504 4.376 4.816 . 0 0 "[ . 1 . 2]" 1
1944 1 82 LEU HA 1 83 MET HB3 . . 4.890 4.618 4.322 4.748 . 0 0 "[ . 1 . 2]" 1
1945 1 82 LEU HA 1 88 TYR QE . . 4.970 4.115 3.757 4.349 . 0 0 "[ . 1 . 2]" 1
1946 1 82 LEU HB2 1 82 LEU MD1 . . 3.160 2.351 2.283 2.459 . 0 0 "[ . 1 . 2]" 1
1947 1 82 LEU HB2 1 82 LEU MD2 . . 3.480 3.188 3.178 3.194 . 0 0 "[ . 1 . 2]" 1
1948 1 82 LEU HB2 1 83 MET H . . 3.680 3.514 3.364 3.657 . 0 0 "[ . 1 . 2]" 1
1949 1 82 LEU HB2 1 88 TYR QE . . 4.760 4.426 3.687 4.727 . 0 0 "[ . 1 . 2]" 1
1950 1 82 LEU HB3 1 82 LEU MD1 . . 3.260 2.346 2.210 2.407 . 0 0 "[ . 1 . 2]" 1
1951 1 82 LEU HB3 1 82 LEU MD2 . . 3.320 2.340 2.276 2.435 . 0 0 "[ . 1 . 2]" 1
1952 1 82 LEU HB3 1 83 MET H . . 3.380 2.361 2.238 2.418 . 0 0 "[ . 1 . 2]" 1
1953 1 82 LEU HB3 1 88 TYR QE . . 4.390 2.921 2.316 3.200 . 0 0 "[ . 1 . 2]" 1
1954 1 82 LEU HB3 1 111 THR MG . . 4.230 3.249 3.145 3.316 . 0 0 "[ . 1 . 2]" 1
1955 1 82 LEU MD1 1 83 MET H . . 4.380 4.317 4.181 4.384 0.004 9 0 "[ . 1 . 2]" 1
1956 1 82 LEU MD1 1 88 TYR QE . . 4.350 3.998 3.554 4.298 . 0 0 "[ . 1 . 2]" 1
1957 1 82 LEU MD1 1 90 PHE QE . . 4.100 2.760 2.630 2.884 . 0 0 "[ . 1 . 2]" 1
1958 1 82 LEU MD1 1 90 PHE HZ . . 3.700 2.054 1.877 2.160 . 0 0 "[ . 1 . 2]" 1
1959 1 82 LEU MD1 1 111 THR MG . . 3.210 3.084 2.940 3.163 . 0 0 "[ . 1 . 2]" 1
1960 1 82 LEU MD2 1 83 MET H . . 3.610 3.389 3.259 3.610 0.000 9 0 "[ . 1 . 2]" 1
1961 1 82 LEU MD2 1 88 TYR QE . . 3.680 3.462 3.161 3.679 . 0 0 "[ . 1 . 2]" 1
1962 1 82 LEU MD2 1 90 PHE QE . . 4.820 3.566 3.413 3.785 . 0 0 "[ . 1 . 2]" 1
1963 1 82 LEU MD2 1 90 PHE HZ . . 3.870 3.450 3.137 3.656 . 0 0 "[ . 1 . 2]" 1
1964 1 82 LEU MD2 1 111 THR MG . . 4.550 4.508 4.406 4.550 0.000 9 0 "[ . 1 . 2]" 1
1965 1 83 MET H 1 83 MET HB2 . . 3.980 2.981 2.845 3.268 . 0 0 "[ . 1 . 2]" 1
1966 1 83 MET H 1 83 MET QB . . 3.460 2.339 2.254 2.390 . 0 0 "[ . 1 . 2]" 1
1967 1 83 MET H 1 83 MET HB3 . . 3.980 2.456 2.297 2.548 . 0 0 "[ . 1 . 2]" 1
1968 1 83 MET H 1 83 MET ME . . 4.840 4.684 4.298 4.831 . 0 0 "[ . 1 . 2]" 1
1969 1 83 MET H 1 83 MET HG2 . . 4.720 4.443 3.938 4.690 . 0 0 "[ . 1 . 2]" 1
1970 1 83 MET H 1 83 MET QG . . 4.030 3.960 3.702 4.041 0.011 15 0 "[ . 1 . 2]" 1
1971 1 83 MET H 1 83 MET HG3 . . 4.720 4.505 4.383 4.686 . 0 0 "[ . 1 . 2]" 1
1972 1 83 MET H 1 84 PRO HD2 . . 4.910 4.843 4.837 4.845 . 0 0 "[ . 1 . 2]" 1
1973 1 83 MET H 1 84 PRO HD3 . . 5.010 4.864 4.809 4.883 . 0 0 "[ . 1 . 2]" 1
1974 1 83 MET H 1 86 THR HB . . 4.450 3.885 3.739 3.986 . 0 0 "[ . 1 . 2]" 1
1975 1 83 MET H 1 86 THR MG . . 4.470 4.293 4.010 4.441 . 0 0 "[ . 1 . 2]" 1
1976 1 83 MET H 1 88 TYR QE . . 3.690 2.387 2.071 2.545 . 0 0 "[ . 1 . 2]" 1
1977 1 83 MET H 1 111 THR HG1 . . 4.970 4.503 4.397 4.580 . 0 0 "[ . 1 . 2]" 1
1978 1 83 MET H 1 111 THR MG . . 4.170 4.167 4.142 4.185 0.015 14 0 "[ . 1 . 2]" 1
1979 1 83 MET HA 1 83 MET ME . . 4.150 3.837 3.338 4.114 . 0 0 "[ . 1 . 2]" 1
1980 1 83 MET HA 1 83 MET HG2 . . 4.010 3.560 3.098 3.817 . 0 0 "[ . 1 . 2]" 1
1981 1 83 MET HA 1 83 MET HG3 . . 4.010 2.790 2.678 2.886 . 0 0 "[ . 1 . 2]" 1
1982 1 83 MET HA 1 84 PRO HD2 . . 3.720 2.163 2.114 2.178 . 0 0 "[ . 1 . 2]" 1
1983 1 83 MET HA 1 84 PRO HD3 . . 3.150 2.254 2.253 2.260 . 0 0 "[ . 1 . 2]" 1
1984 1 83 MET HA 1 84 PRO HG3 . . 4.920 4.354 4.338 4.360 . 0 0 "[ . 1 . 2]" 1
1985 1 83 MET QB 1 83 MET ME . . 3.330 2.118 1.894 2.338 . 0 0 "[ . 1 . 2]" 1
1986 1 83 MET QB 1 84 PRO HD3 . . 4.770 4.159 4.020 4.211 . 0 0 "[ . 1 . 2]" 1
1987 1 83 MET HB2 1 83 MET ME . . 3.900 2.158 1.913 2.417 . 0 0 "[ . 1 . 2]" 1
1988 1 83 MET HB2 1 84 PRO HD2 . . 4.760 3.536 3.190 3.683 . 0 0 "[ . 1 . 2]" 1
1989 1 83 MET HB2 1 86 THR MG . . 5.010 4.438 4.283 4.689 . 0 0 "[ . 1 . 2]" 1
1990 1 83 MET HB3 1 83 MET ME . . 3.900 3.116 2.894 3.379 . 0 0 "[ . 1 . 2]" 1
1991 1 83 MET HB3 1 84 PRO HD2 . . 4.760 4.034 3.980 4.165 . 0 0 "[ . 1 . 2]" 1
1992 1 83 MET HB3 1 86 THR MG . . 5.010 3.078 2.924 3.280 . 0 0 "[ . 1 . 2]" 1
1993 1 83 MET ME 1 84 PRO HD2 . . 4.080 3.886 3.195 4.005 . 0 0 "[ . 1 . 2]" 1
1994 1 83 MET ME 1 84 PRO HD3 . . 5.280 5.102 4.583 5.287 0.007 13 0 "[ . 1 . 2]" 1
1995 1 83 MET ME 1 86 THR MG . . 4.810 4.341 3.888 4.703 . 0 0 "[ . 1 . 2]" 1
1996 1 83 MET QG 1 84 PRO HD2 . . 3.230 1.970 1.922 1.987 . 0 0 "[ . 1 . 2]" 1
1997 1 83 MET QG 1 84 PRO HD3 . . 4.930 3.429 3.351 3.470 . 0 0 "[ . 1 . 2]" 1
1998 1 83 MET QG 1 86 THR HB . . 4.080 3.167 2.221 3.514 . 0 0 "[ . 1 . 2]" 1
1999 1 83 MET HG2 1 84 PRO HD2 . . 3.730 3.230 2.515 3.532 . 0 0 "[ . 1 . 2]" 1
2000 1 83 MET HG2 1 86 THR HB . . 4.940 3.405 2.233 3.907 . 0 0 "[ . 1 . 2]" 1
2001 1 83 MET HG2 1 86 THR MG . . 4.860 3.710 3.293 3.911 . 0 0 "[ . 1 . 2]" 1
2002 1 83 MET HG3 1 84 PRO HD2 . . 3.730 1.994 1.987 1.998 . 0 0 "[ . 1 . 2]" 1
2003 1 83 MET HG3 1 86 THR HB . . 4.940 4.154 3.708 4.946 0.006 1 0 "[ . 1 . 2]" 1
2004 1 83 MET HG3 1 86 THR MG . . 4.860 4.656 4.386 4.871 0.011 8 0 "[ . 1 . 2]" 1
2005 1 84 PRO HA 1 85 ALA H . . 2.940 2.284 2.223 2.335 . 0 0 "[ . 1 . 2]" 1
2006 1 84 PRO HA 1 85 ALA MB . . 4.320 4.205 4.117 4.254 . 0 0 "[ . 1 . 2]" 1
2007 1 84 PRO HA 1 86 THR H . . 3.880 3.563 3.424 3.657 . 0 0 "[ . 1 . 2]" 1
2008 1 84 PRO HA 1 111 THR H . . 4.890 4.802 4.599 4.894 0.004 18 0 "[ . 1 . 2]" 1
2009 1 84 PRO HA 1 111 THR HG1 . . 3.510 2.035 1.997 2.118 . 0 0 "[ . 1 . 2]" 1
2010 1 84 PRO HA 1 111 THR MG . . 4.000 3.101 2.949 3.269 . 0 0 "[ . 1 . 2]" 1
2011 1 84 PRO HA 1 112 GLN H . . 4.730 3.619 3.469 3.835 . 0 0 "[ . 1 . 2]" 1
2012 1 84 PRO HA 1 114 GLU H . . 5.090 4.660 4.485 4.910 . 0 0 "[ . 1 . 2]" 1
2013 1 84 PRO HA 1 114 GLU QG . . 4.740 4.354 4.133 4.668 . 0 0 "[ . 1 . 2]" 1
2014 1 84 PRO HB2 1 85 ALA H . . 3.550 2.939 2.786 3.141 . 0 0 "[ . 1 . 2]" 1
2015 1 84 PRO HB2 1 85 ALA HA . . 5.240 4.657 4.590 4.746 . 0 0 "[ . 1 . 2]" 1
2016 1 84 PRO HB2 1 85 ALA MB . . 3.690 3.194 3.067 3.280 . 0 0 "[ . 1 . 2]" 1
2017 1 84 PRO HB2 1 86 THR H . . 5.330 5.126 4.974 5.268 . 0 0 "[ . 1 . 2]" 1
2018 1 84 PRO HB2 1 111 THR HG1 . . 5.260 4.488 4.399 4.625 . 0 0 "[ . 1 . 2]" 1
2019 1 84 PRO HB2 1 112 GLN H . . 5.500 4.827 4.532 5.097 . 0 0 "[ . 1 . 2]" 1
2020 1 84 PRO HB2 1 113 PRO HA . . 3.900 2.594 2.479 2.751 . 0 0 "[ . 1 . 2]" 1
2021 1 84 PRO HB2 1 114 GLU H . . 3.130 2.221 2.078 2.359 . 0 0 "[ . 1 . 2]" 1
2022 1 84 PRO HB2 1 114 GLU QG . . 3.850 2.659 2.335 3.038 . 0 0 "[ . 1 . 2]" 1
2023 1 84 PRO HB3 1 85 ALA H . . 3.750 3.631 3.544 3.749 . 0 0 "[ . 1 . 2]" 1
2024 1 84 PRO HB3 1 85 ALA MB . . 4.710 4.612 4.546 4.654 . 0 0 "[ . 1 . 2]" 1
2025 1 84 PRO HB3 1 111 THR HG1 . . 4.530 4.324 4.283 4.403 . 0 0 "[ . 1 . 2]" 1
2026 1 84 PRO HB3 1 114 GLU H . . 3.600 3.019 2.867 3.240 . 0 0 "[ . 1 . 2]" 1
2027 1 84 PRO HD3 1 114 GLU H . . 5.500 5.446 5.340 5.515 0.015 20 0 "[ . 1 . 2]" 1
2028 1 84 PRO HG2 1 85 ALA H . . 4.940 4.650 4.548 4.773 . 0 0 "[ . 1 . 2]" 1
2029 1 84 PRO HG2 1 114 GLU H . . 4.790 3.743 3.551 3.912 . 0 0 "[ . 1 . 2]" 1
2030 1 84 PRO HG3 1 85 ALA H . . 5.500 5.314 5.210 5.442 . 0 0 "[ . 1 . 2]" 1
2031 1 84 PRO HG3 1 114 GLU QG . . 3.910 2.059 1.868 2.570 . 0 0 "[ . 1 . 2]" 1
2032 1 85 ALA H 1 85 ALA HA . . 2.850 2.281 2.276 2.290 . 0 0 "[ . 1 . 2]" 1
2033 1 85 ALA H 1 85 ALA MB . . 3.190 2.810 2.732 2.899 . 0 0 "[ . 1 . 2]" 1
2034 1 85 ALA H 1 86 THR H . . 3.390 2.802 2.632 2.891 . 0 0 "[ . 1 . 2]" 1
2035 1 85 ALA H 1 111 THR H . . 4.590 4.179 4.015 4.321 . 0 0 "[ . 1 . 2]" 1
2036 1 85 ALA H 1 111 THR HA . . 4.630 4.405 4.316 4.471 . 0 0 "[ . 1 . 2]" 1
2037 1 85 ALA H 1 111 THR HG1 . . 3.480 2.797 2.689 2.939 . 0 0 "[ . 1 . 2]" 1
2038 1 85 ALA H 1 111 THR MG . . 4.150 4.036 3.976 4.124 . 0 0 "[ . 1 . 2]" 1
2039 1 85 ALA H 1 112 GLN H . . 4.420 3.296 3.153 3.528 . 0 0 "[ . 1 . 2]" 1
2040 1 85 ALA H 1 112 GLN HA . . 4.330 3.649 3.466 3.850 . 0 0 "[ . 1 . 2]" 1
2041 1 85 ALA H 1 113 PRO HA . . 3.610 3.504 3.367 3.618 0.008 17 0 "[ . 1 . 2]" 1
2042 1 85 ALA H 1 113 PRO QB . . 5.340 4.630 4.505 4.769 . 0 0 "[ . 1 . 2]" 1
2043 1 85 ALA H 1 113 PRO HD2 . . 5.500 5.084 4.885 5.263 . 0 0 "[ . 1 . 2]" 1
2044 1 85 ALA H 1 113 PRO HD3 . . 4.730 4.162 3.992 4.334 . 0 0 "[ . 1 . 2]" 1
2045 1 85 ALA H 1 114 GLU H . . 4.660 4.510 4.314 4.662 0.002 5 0 "[ . 1 . 2]" 1
2046 1 85 ALA H 1 114 GLU QG . . 5.500 5.153 4.825 5.502 0.002 10 0 "[ . 1 . 2]" 1
2047 1 85 ALA HA 1 86 THR H . . 3.150 2.826 2.762 2.921 . 0 0 "[ . 1 . 2]" 1
2048 1 85 ALA HA 1 110 GLU HG2 . . 4.400 3.320 3.187 3.476 . 0 0 "[ . 1 . 2]" 1
2049 1 85 ALA HA 1 110 GLU QG . . 3.660 3.166 3.056 3.318 . 0 0 "[ . 1 . 2]" 1
2050 1 85 ALA HA 1 110 GLU HG3 . . 4.400 4.007 3.838 4.199 . 0 0 "[ . 1 . 2]" 1
2051 1 85 ALA HA 1 111 THR H . . 4.410 4.296 4.240 4.347 . 0 0 "[ . 1 . 2]" 1
2052 1 85 ALA HA 1 111 THR HG1 . . 4.380 4.216 4.110 4.382 0.002 9 0 "[ . 1 . 2]" 1
2053 1 85 ALA HA 1 112 GLN HA . . 4.620 3.897 3.715 4.154 . 0 0 "[ . 1 . 2]" 1
2054 1 85 ALA HA 1 113 PRO HA . . 4.210 4.137 3.846 4.218 0.008 7 0 "[ . 1 . 2]" 1
2055 1 85 ALA HA 1 113 PRO QB . . 5.340 4.193 3.903 4.366 . 0 0 "[ . 1 . 2]" 1
2056 1 85 ALA MB 1 86 THR H . . 3.690 3.672 3.628 3.695 0.005 11 0 "[ . 1 . 2]" 1
2057 1 85 ALA MB 1 86 THR HA . . 4.470 4.238 4.198 4.268 . 0 0 "[ . 1 . 2]" 1
2058 1 85 ALA MB 1 110 GLU QG . . 5.300 4.308 4.200 4.440 . 0 0 "[ . 1 . 2]" 1
2059 1 85 ALA MB 1 111 THR H . . 5.500 5.499 5.470 5.514 0.014 13 0 "[ . 1 . 2]" 1
2060 1 85 ALA MB 1 111 THR HG1 . . 4.770 4.605 4.522 4.714 . 0 0 "[ . 1 . 2]" 1
2061 1 85 ALA MB 1 112 GLN HA . . 4.780 4.287 4.086 4.566 . 0 0 "[ . 1 . 2]" 1
2062 1 85 ALA MB 1 113 PRO HA . . 3.070 2.257 2.057 2.549 . 0 0 "[ . 1 . 2]" 1
2063 1 85 ALA MB 1 113 PRO HB2 . . 3.770 3.666 3.462 3.773 0.003 3 0 "[ . 1 . 2]" 1
2064 1 85 ALA MB 1 113 PRO QB . . 3.190 2.250 1.996 2.449 . 0 0 "[ . 1 . 2]" 1
2065 1 85 ALA MB 1 113 PRO HB3 . . 3.770 2.272 2.009 2.481 . 0 0 "[ . 1 . 2]" 1
2066 1 85 ALA MB 1 113 PRO HD2 . . 5.040 4.467 4.259 4.723 . 0 0 "[ . 1 . 2]" 1
2067 1 85 ALA MB 1 113 PRO HD3 . . 4.450 3.202 2.862 3.524 . 0 0 "[ . 1 . 2]" 1
2068 1 85 ALA MB 1 113 PRO HG2 . . 4.740 4.567 4.435 4.747 0.007 14 0 "[ . 1 . 2]" 1
2069 1 85 ALA MB 1 113 PRO HG3 . . 4.210 3.817 3.575 4.056 . 0 0 "[ . 1 . 2]" 1
2070 1 85 ALA MB 1 114 GLU H . . 4.150 3.991 3.758 4.150 0.000 4 0 "[ . 1 . 2]" 1
2071 1 86 THR H 1 86 THR HB . . 3.350 2.791 2.698 2.847 . 0 0 "[ . 1 . 2]" 1
2072 1 86 THR H 1 86 THR HG1 . . 4.000 3.213 2.921 3.862 . 0 0 "[ . 1 . 2]" 1
2073 1 86 THR H 1 86 THR MG . . 4.020 3.898 3.773 3.942 . 0 0 "[ . 1 . 2]" 1
2074 1 86 THR H 1 87 VAL QG . . 4.970 4.711 4.637 4.838 . 0 0 "[ . 1 . 2]" 1
2075 1 86 THR H 1 110 GLU HA . . 4.450 4.273 4.126 4.394 . 0 0 "[ . 1 . 2]" 1
2076 1 86 THR H 1 110 GLU HG2 . . 4.100 3.986 3.821 4.099 . 0 0 "[ . 1 . 2]" 1
2077 1 86 THR H 1 110 GLU HG3 . . 4.100 3.919 3.597 4.104 0.004 19 0 "[ . 1 . 2]" 1
2078 1 86 THR H 1 111 THR H . . 3.140 2.843 2.725 2.953 . 0 0 "[ . 1 . 2]" 1
2079 1 86 THR H 1 111 THR HA . . 5.340 4.788 4.685 4.922 . 0 0 "[ . 1 . 2]" 1
2080 1 86 THR H 1 111 THR HG1 . . 3.050 2.180 2.049 2.252 . 0 0 "[ . 1 . 2]" 1
2081 1 86 THR H 1 111 THR MG . . 3.710 3.710 3.678 3.725 0.015 16 0 "[ . 1 . 2]" 1
2082 1 86 THR HA 1 86 THR MG . . 3.160 2.390 2.277 2.532 . 0 0 "[ . 1 . 2]" 1
2083 1 86 THR HA 1 87 VAL H . . 3.000 2.145 2.141 2.156 . 0 0 "[ . 1 . 2]" 1
2084 1 86 THR HA 1 87 VAL QG . . 4.000 3.603 3.308 3.953 . 0 0 "[ . 1 . 2]" 1
2085 1 86 THR HB 1 88 TYR QE . . 3.710 2.370 2.017 2.952 . 0 0 "[ . 1 . 2]" 1
2086 1 86 THR HB 1 111 THR HG1 . . 3.910 3.197 3.062 3.411 . 0 0 "[ . 1 . 2]" 1
2087 1 86 THR HB 1 111 THR MG . . 4.470 4.217 4.121 4.366 . 0 0 "[ . 1 . 2]" 1
2088 1 86 THR MG 1 87 VAL H . . 3.190 2.719 2.414 2.925 . 0 0 "[ . 1 . 2]" 1
2089 1 86 THR MG 1 88 TYR HA . . 4.660 4.361 4.141 4.521 . 0 0 "[ . 1 . 2]" 1
2090 1 86 THR MG 1 88 TYR QE . . 3.990 2.856 2.381 3.241 . 0 0 "[ . 1 . 2]" 1
2091 1 86 THR MG 1 111 THR HG1 . . 4.900 4.640 4.391 4.818 . 0 0 "[ . 1 . 2]" 1
2092 1 87 VAL H 1 87 VAL HB . . 3.410 2.713 2.370 3.559 0.149 19 0 "[ . 1 . 2]" 1
2093 1 87 VAL H 1 87 VAL MG1 . . 3.930 3.554 2.695 3.768 . 0 0 "[ . 1 . 2]" 1
2094 1 87 VAL H 1 87 VAL QG . . 2.940 2.125 1.793 2.483 . 0 0 "[ . 1 . 2]" 1
2095 1 87 VAL H 1 87 VAL MG2 . . 3.930 2.144 1.816 2.521 . 0 0 "[ . 1 . 2]" 1
2096 1 87 VAL H 1 88 TYR H . . 5.030 4.622 4.601 4.637 . 0 0 "[ . 1 . 2]" 1
2097 1 87 VAL HA 1 87 VAL MG1 . . 3.290 2.350 2.185 2.539 . 0 0 "[ . 1 . 2]" 1
2098 1 87 VAL HA 1 87 VAL MG2 . . 3.290 2.524 2.206 3.165 . 0 0 "[ . 1 . 2]" 1
2099 1 87 VAL HA 1 88 TYR H . . 2.810 2.254 2.198 2.351 . 0 0 "[ . 1 . 2]" 1
2100 1 87 VAL HA 1 88 TYR HB2 . . 4.930 4.258 4.195 4.315 . 0 0 "[ . 1 . 2]" 1
2101 1 87 VAL HA 1 88 TYR QE . . 5.500 5.489 5.407 5.506 0.006 13 0 "[ . 1 . 2]" 1
2102 1 87 VAL HA 1 109 VAL H . . 4.880 4.553 4.270 4.715 . 0 0 "[ . 1 . 2]" 1
2103 1 87 VAL HA 1 110 GLU HA . . 3.250 2.083 1.998 2.269 . 0 0 "[ . 1 . 2]" 1
2104 1 87 VAL HA 1 110 GLU QB . . 4.020 3.183 2.957 3.437 . 0 0 "[ . 1 . 2]" 1
2105 1 87 VAL HA 1 110 GLU HG2 . . 4.610 4.423 4.261 4.552 . 0 0 "[ . 1 . 2]" 1
2106 1 87 VAL HA 1 110 GLU QG . . 4.010 3.103 2.953 3.365 . 0 0 "[ . 1 . 2]" 1
2107 1 87 VAL HA 1 110 GLU HG3 . . 4.610 3.171 2.999 3.470 . 0 0 "[ . 1 . 2]" 1
2108 1 87 VAL HA 1 111 THR H . . 3.780 3.571 3.394 3.746 . 0 0 "[ . 1 . 2]" 1
2109 1 87 VAL HB 1 88 TYR H . . 4.050 3.684 2.557 4.051 0.001 6 0 "[ . 1 . 2]" 1
2110 1 87 VAL QG 1 88 TYR H . . 3.160 2.298 1.914 3.151 . 0 0 "[ . 1 . 2]" 1
2111 1 87 VAL QG 1 88 TYR HA . . 4.500 3.465 3.038 4.059 . 0 0 "[ . 1 . 2]" 1
2112 1 87 VAL QG 1 89 ILE H . . 4.800 4.236 3.799 4.837 0.037 17 0 "[ . 1 . 2]" 1
2113 1 87 VAL QG 1 108 ARG HA . . 4.200 3.505 3.258 4.132 . 0 0 "[ . 1 . 2]" 1
2114 1 87 VAL QG 1 108 ARG QB . . 4.420 3.684 3.454 3.998 . 0 0 "[ . 1 . 2]" 1
2115 1 87 VAL QG 1 108 ARG QD . . 3.850 2.547 1.960 3.255 . 0 0 "[ . 1 . 2]" 1
2116 1 87 VAL QG 1 108 ARG QG . . 2.940 1.991 1.794 2.283 . 0 0 "[ . 1 . 2]" 1
2117 1 87 VAL QG 1 109 VAL H . . 4.090 3.327 2.864 4.015 . 0 0 "[ . 1 . 2]" 1
2118 1 87 VAL QG 1 109 VAL HA . . 5.440 4.254 4.069 4.443 . 0 0 "[ . 1 . 2]" 1
2119 1 87 VAL QG 1 110 GLU HA . . 3.570 2.938 2.573 3.174 . 0 0 "[ . 1 . 2]" 1
2120 1 87 VAL QG 1 110 GLU QB . . 3.040 2.223 1.916 2.515 . 0 0 "[ . 1 . 2]" 1
2121 1 87 VAL QG 1 110 GLU QG . . 3.260 2.196 1.982 2.496 . 0 0 "[ . 1 . 2]" 1
2122 1 87 VAL QG 1 111 THR H . . 4.740 4.278 4.107 4.479 . 0 0 "[ . 1 . 2]" 1
2123 1 87 VAL MG1 1 88 TYR H . . 4.130 2.339 1.918 3.320 . 0 0 "[ . 1 . 2]" 1
2124 1 87 VAL MG1 1 110 GLU HA . . 4.630 3.502 2.589 3.897 . 0 0 "[ . 1 . 2]" 1
2125 1 87 VAL MG2 1 88 TYR H . . 4.130 3.861 3.625 4.046 . 0 0 "[ . 1 . 2]" 1
2126 1 87 VAL MG2 1 110 GLU HA . . 4.630 3.454 2.973 4.508 . 0 0 "[ . 1 . 2]" 1
2127 1 88 TYR H 1 88 TYR HB2 . . 3.560 2.741 2.685 2.812 . 0 0 "[ . 1 . 2]" 1
2128 1 88 TYR H 1 88 TYR HB3 . . 3.830 3.803 3.774 3.835 0.005 14 0 "[ . 1 . 2]" 1
2129 1 88 TYR H 1 89 ILE H . . 4.390 4.211 4.007 4.368 . 0 0 "[ . 1 . 2]" 1
2130 1 88 TYR H 1 90 PHE QD . . 5.500 4.727 4.461 4.887 . 0 0 "[ . 1 . 2]" 1
2131 1 88 TYR H 1 90 PHE QE . . 4.170 3.952 3.671 4.177 0.007 20 0 "[ . 1 . 2]" 1
2132 1 88 TYR H 1 108 ARG QG . . 4.740 3.864 3.535 4.107 . 0 0 "[ . 1 . 2]" 1
2133 1 88 TYR H 1 109 VAL H . . 3.720 2.874 2.631 3.029 . 0 0 "[ . 1 . 2]" 1
2134 1 88 TYR H 1 109 VAL HB . . 4.680 3.817 3.651 4.033 . 0 0 "[ . 1 . 2]" 1
2135 1 88 TYR H 1 110 GLU H . . 5.500 4.833 4.648 4.958 . 0 0 "[ . 1 . 2]" 1
2136 1 88 TYR H 1 110 GLU HA . . 3.880 3.493 3.287 3.807 . 0 0 "[ . 1 . 2]" 1
2137 1 88 TYR H 1 110 GLU QB . . 5.270 4.576 4.345 4.951 . 0 0 "[ . 1 . 2]" 1
2138 1 88 TYR H 1 111 THR MG . . 5.500 5.499 5.460 5.514 0.014 13 0 "[ . 1 . 2]" 1
2139 1 88 TYR HA 1 88 TYR QE . . 4.500 4.421 4.371 4.448 . 0 0 "[ . 1 . 2]" 1
2140 1 88 TYR HA 1 89 ILE H . . 2.830 2.168 2.138 2.239 . 0 0 "[ . 1 . 2]" 1
2141 1 88 TYR HA 1 89 ILE HB . . 5.230 4.923 4.845 5.015 . 0 0 "[ . 1 . 2]" 1
2142 1 88 TYR HA 1 89 ILE MD . . 4.360 3.502 3.140 3.815 . 0 0 "[ . 1 . 2]" 1
2143 1 88 TYR HA 1 89 ILE HG12 . . 4.690 3.497 3.309 3.702 . 0 0 "[ . 1 . 2]" 1
2144 1 88 TYR HA 1 89 ILE HG13 . . 5.430 5.209 5.044 5.374 . 0 0 "[ . 1 . 2]" 1
2145 1 88 TYR HB2 1 89 ILE H . . 4.380 4.287 4.096 4.448 0.068 17 0 "[ . 1 . 2]" 1
2146 1 88 TYR HB2 1 90 PHE QE . . 3.600 2.229 2.000 2.433 . 0 0 "[ . 1 . 2]" 1
2147 1 88 TYR HB2 1 90 PHE HZ . . 4.280 3.346 3.019 3.560 . 0 0 "[ . 1 . 2]" 1
2148 1 88 TYR HB2 1 109 VAL H . . 4.640 4.205 3.956 4.437 . 0 0 "[ . 1 . 2]" 1
2149 1 88 TYR HB2 1 109 VAL MG1 . . 5.140 4.261 4.211 4.310 . 0 0 "[ . 1 . 2]" 1
2150 1 88 TYR HB3 1 89 ILE H . . 3.600 3.256 2.903 3.567 . 0 0 "[ . 1 . 2]" 1
2151 1 88 TYR HB3 1 90 PHE QD . . 4.800 3.875 3.736 4.011 . 0 0 "[ . 1 . 2]" 1
2152 1 88 TYR HB3 1 90 PHE QE . . 3.870 3.010 2.803 3.180 . 0 0 "[ . 1 . 2]" 1
2153 1 88 TYR HB3 1 90 PHE HZ . . 4.370 3.553 3.235 3.865 . 0 0 "[ . 1 . 2]" 1
2154 1 88 TYR HB3 1 109 VAL MG1 . . 5.500 5.499 5.477 5.507 0.007 14 0 "[ . 1 . 2]" 1
2155 1 88 TYR HB3 1 109 VAL MG2 . . 5.500 5.426 5.066 5.504 0.004 14 0 "[ . 1 . 2]" 1
2156 1 88 TYR QE 1 111 THR H . . 5.260 4.824 4.657 5.084 . 0 0 "[ . 1 . 2]" 1
2157 1 88 TYR QE 1 111 THR HG1 . . 4.770 3.446 3.130 3.802 . 0 0 "[ . 1 . 2]" 1
2158 1 88 TYR QE 1 111 THR MG . . 3.590 3.227 2.766 3.513 . 0 0 "[ . 1 . 2]" 1
2159 1 89 ILE H 1 89 ILE HB . . 3.220 2.786 2.703 2.875 . 0 0 "[ . 1 . 2]" 1
2160 1 89 ILE H 1 89 ILE MD . . 3.560 2.857 2.587 3.190 . 0 0 "[ . 1 . 2]" 1
2161 1 89 ILE H 1 89 ILE HG12 . . 3.790 2.028 1.913 2.198 . 0 0 "[ . 1 . 2]" 1
2162 1 89 ILE H 1 89 ILE HG13 . . 3.730 3.599 3.500 3.729 . 0 0 "[ . 1 . 2]" 1
2163 1 89 ILE H 1 89 ILE MG . . 3.980 3.803 3.760 3.852 . 0 0 "[ . 1 . 2]" 1
2164 1 89 ILE H 1 90 PHE H . . 4.460 4.255 4.111 4.346 . 0 0 "[ . 1 . 2]" 1
2165 1 89 ILE HA 1 89 ILE MD . . 3.660 2.076 1.977 2.180 . 0 0 "[ . 1 . 2]" 1
2166 1 89 ILE HA 1 89 ILE HG12 . . 4.100 3.377 3.251 3.484 . 0 0 "[ . 1 . 2]" 1
2167 1 89 ILE HA 1 89 ILE HG13 . . 4.060 3.831 3.727 3.905 . 0 0 "[ . 1 . 2]" 1
2168 1 89 ILE HA 1 89 ILE MG . . 3.180 2.126 2.031 2.287 . 0 0 "[ . 1 . 2]" 1
2169 1 89 ILE HA 1 90 PHE H . . 2.870 2.169 2.150 2.194 . 0 0 "[ . 1 . 2]" 1
2170 1 89 ILE HA 1 90 PHE QD . . 4.200 3.725 3.547 3.837 . 0 0 "[ . 1 . 2]" 1
2171 1 89 ILE HA 1 107 LEU H . . 4.420 4.242 3.997 4.420 . 0 0 "[ . 1 . 2]" 1
2172 1 89 ILE HA 1 108 ARG HA . . 3.680 2.806 2.642 2.944 . 0 0 "[ . 1 . 2]" 1
2173 1 89 ILE HA 1 109 VAL H . . 4.020 3.534 3.371 3.791 . 0 0 "[ . 1 . 2]" 1
2174 1 89 ILE HB 1 89 ILE MD . . 3.380 3.214 3.203 3.223 . 0 0 "[ . 1 . 2]" 1
2175 1 89 ILE HB 1 90 PHE H . . 4.270 4.243 4.176 4.284 0.014 9 0 "[ . 1 . 2]" 1
2176 1 89 ILE MD 1 90 PHE H . . 4.500 3.993 3.887 4.122 . 0 0 "[ . 1 . 2]" 1
2177 1 89 ILE MD 1 108 ARG H . . 5.240 4.405 3.992 4.773 . 0 0 "[ . 1 . 2]" 1
2178 1 89 ILE MD 1 108 ARG HA . . 3.630 2.410 2.074 2.629 . 0 0 "[ . 1 . 2]" 1
2179 1 89 ILE MD 1 108 ARG QB . . 4.430 3.003 2.656 3.292 . 0 0 "[ . 1 . 2]" 1
2180 1 89 ILE MD 1 108 ARG QD . . 3.900 3.495 2.692 3.905 0.005 12 0 "[ . 1 . 2]" 1
2181 1 89 ILE MD 1 109 VAL H . . 4.340 3.662 3.403 3.905 . 0 0 "[ . 1 . 2]" 1
2182 1 89 ILE HG12 1 89 ILE MG . . 3.210 3.183 3.172 3.194 . 0 0 "[ . 1 . 2]" 1
2183 1 89 ILE HG12 1 90 PHE H . . 5.400 5.292 5.214 5.403 0.003 4 0 "[ . 1 . 2]" 1
2184 1 89 ILE HG13 1 89 ILE MG . . 3.150 2.269 2.168 2.416 . 0 0 "[ . 1 . 2]" 1
2185 1 89 ILE HG13 1 108 ARG HA . . 5.500 5.291 4.967 5.470 . 0 0 "[ . 1 . 2]" 1
2186 1 89 ILE MG 1 90 PHE H . . 3.300 3.099 2.934 3.254 . 0 0 "[ . 1 . 2]" 1
2187 1 89 ILE MG 1 90 PHE HA . . 4.800 4.408 4.232 4.578 . 0 0 "[ . 1 . 2]" 1
2188 1 89 ILE MG 1 90 PHE HB2 . . 5.170 4.958 4.826 5.058 . 0 0 "[ . 1 . 2]" 1
2189 1 89 ILE MG 1 90 PHE QD . . 4.990 4.906 4.735 4.974 . 0 0 "[ . 1 . 2]" 1
2190 1 89 ILE MG 1 91 ARG QD . . 4.740 3.701 3.059 4.325 . 0 0 "[ . 1 . 2]" 1
2191 1 89 ILE MG 1 91 ARG QG . . 4.030 2.902 2.635 3.188 . 0 0 "[ . 1 . 2]" 1
2192 1 89 ILE MG 1 106 PRO HA . . 3.730 2.805 2.524 3.016 . 0 0 "[ . 1 . 2]" 1
2193 1 89 ILE MG 1 106 PRO HB2 . . 3.100 1.973 1.890 2.146 . 0 0 "[ . 1 . 2]" 1
2194 1 89 ILE MG 1 106 PRO HB3 . . 3.100 2.333 2.216 2.466 . 0 0 "[ . 1 . 2]" 1
2195 1 89 ILE MG 1 106 PRO QD . . 5.350 4.402 4.304 4.511 . 0 0 "[ . 1 . 2]" 1
2196 1 89 ILE MG 1 106 PRO HG2 . . 4.000 3.803 3.698 4.000 . 1 0 "[ . 1 . 2]" 1
2197 1 89 ILE MG 1 106 PRO HG3 . . 4.000 3.813 3.698 3.975 . 0 0 "[ . 1 . 2]" 1
2198 1 89 ILE MG 1 107 LEU H . . 3.610 3.151 2.815 3.300 . 0 0 "[ . 1 . 2]" 1
2199 1 89 ILE MG 1 108 ARG H . . 4.870 4.403 4.160 4.686 . 0 0 "[ . 1 . 2]" 1
2200 1 89 ILE MG 1 108 ARG HA . . 4.070 3.581 3.400 3.841 . 0 0 "[ . 1 . 2]" 1
2201 1 90 PHE H 1 90 PHE HB2 . . 3.480 2.430 2.407 2.448 . 0 0 "[ . 1 . 2]" 1
2202 1 90 PHE H 1 90 PHE HB3 . . 3.760 3.634 3.622 3.649 . 0 0 "[ . 1 . 2]" 1
2203 1 90 PHE H 1 90 PHE QD . . 3.440 2.358 2.206 2.489 . 0 0 "[ . 1 . 2]" 1
2204 1 90 PHE H 1 90 PHE QE . . 4.900 4.476 4.351 4.596 . 0 0 "[ . 1 . 2]" 1
2205 1 90 PHE H 1 106 PRO HA . . 4.880 4.609 4.431 4.879 . 0 0 "[ . 1 . 2]" 1
2206 1 90 PHE H 1 107 LEU H . . 3.720 3.299 3.063 3.547 . 0 0 "[ . 1 . 2]" 1
2207 1 90 PHE H 1 107 LEU HB2 . . 5.300 4.829 4.705 4.945 . 0 0 "[ . 1 . 2]" 1
2208 1 90 PHE H 1 107 LEU HB3 . . 4.050 3.227 3.099 3.343 . 0 0 "[ . 1 . 2]" 1
2209 1 90 PHE H 1 107 LEU MD1 . . 5.430 5.280 5.156 5.383 . 0 0 "[ . 1 . 2]" 1
2210 1 90 PHE H 1 108 ARG HA . . 4.010 3.929 3.777 4.015 0.005 17 0 "[ . 1 . 2]" 1
2211 1 90 PHE H 1 109 VAL H . . 4.590 3.931 3.765 4.182 . 0 0 "[ . 1 . 2]" 1
2212 1 90 PHE H 1 109 VAL MG2 . . 4.300 3.661 3.456 3.949 . 0 0 "[ . 1 . 2]" 1
2213 1 90 PHE HA 1 90 PHE QD . . 3.840 3.004 2.941 3.069 . 0 0 "[ . 1 . 2]" 1
2214 1 90 PHE HA 1 91 ARG H . . 2.810 2.207 2.158 2.271 . 0 0 "[ . 1 . 2]" 1
2215 1 90 PHE HA 1 91 ARG QB . . 4.590 4.285 4.121 4.425 . 0 0 "[ . 1 . 2]" 1
2216 1 90 PHE HA 1 91 ARG QG . . 4.560 3.770 3.445 4.117 . 0 0 "[ . 1 . 2]" 1
2217 1 90 PHE HB2 1 91 ARG H . . 4.610 4.075 3.944 4.223 . 0 0 "[ . 1 . 2]" 1
2218 1 90 PHE HB2 1 107 LEU H . . 4.880 3.832 3.614 4.017 . 0 0 "[ . 1 . 2]" 1
2219 1 90 PHE HB2 1 107 LEU HB2 . . 4.470 4.242 4.138 4.309 . 0 0 "[ . 1 . 2]" 1
2220 1 90 PHE HB2 1 107 LEU HB3 . . 4.110 2.564 2.482 2.624 . 0 0 "[ . 1 . 2]" 1
2221 1 90 PHE HB2 1 107 LEU MD2 . . 4.230 3.083 2.858 3.279 . 0 0 "[ . 1 . 2]" 1
2222 1 90 PHE HB2 1 109 VAL MG2 . . 4.570 3.272 3.074 3.454 . 0 0 "[ . 1 . 2]" 1
2223 1 90 PHE HB3 1 91 ARG H . . 3.650 3.009 2.781 3.247 . 0 0 "[ . 1 . 2]" 1
2224 1 90 PHE HB3 1 91 ARG QG . . 5.340 5.082 4.841 5.276 . 0 0 "[ . 1 . 2]" 1
2225 1 90 PHE HB3 1 92 VAL MG2 . . 5.040 3.797 3.604 3.888 . 0 0 "[ . 1 . 2]" 1
2226 1 90 PHE HB3 1 107 LEU HB2 . . 5.500 5.484 5.410 5.505 0.005 16 0 "[ . 1 . 2]" 1
2227 1 90 PHE HB3 1 107 LEU HB3 . . 4.190 4.010 3.927 4.067 . 0 0 "[ . 1 . 2]" 1
2228 1 90 PHE HB3 1 107 LEU MD2 . . 4.590 4.188 3.945 4.388 . 0 0 "[ . 1 . 2]" 1
2229 1 90 PHE HB3 1 109 VAL MG2 . . 5.450 4.605 4.432 4.753 . 0 0 "[ . 1 . 2]" 1
2230 1 90 PHE QD 1 91 ARG H . . 4.140 3.975 3.755 4.103 . 0 0 "[ . 1 . 2]" 1
2231 1 90 PHE QD 1 107 LEU H . . 5.180 5.055 4.785 5.189 0.009 15 0 "[ . 1 . 2]" 1
2232 1 90 PHE QD 1 107 LEU HB3 . . 4.740 3.915 3.737 4.085 . 0 0 "[ . 1 . 2]" 1
2233 1 90 PHE QD 1 107 LEU MD2 . . 3.860 3.790 3.625 3.861 0.001 8 0 "[ . 1 . 2]" 1
2234 1 90 PHE QD 1 107 LEU HG . . 4.350 4.027 3.833 4.211 . 0 0 "[ . 1 . 2]" 1
2235 1 90 PHE QD 1 109 VAL H . . 4.370 3.259 3.046 3.503 . 0 0 "[ . 1 . 2]" 1
2236 1 90 PHE QD 1 109 VAL HB . . 3.810 2.648 2.356 2.802 . 0 0 "[ . 1 . 2]" 1
2237 1 90 PHE QD 1 109 VAL MG1 . . 4.350 4.031 3.775 4.193 . 0 0 "[ . 1 . 2]" 1
2238 1 90 PHE QD 1 109 VAL MG2 . . 3.410 2.273 1.981 2.425 . 0 0 "[ . 1 . 2]" 1
2239 1 90 PHE QE 1 109 VAL H . . 4.210 3.843 3.575 4.065 . 0 0 "[ . 1 . 2]" 1
2240 1 90 PHE QE 1 109 VAL HB . . 3.240 2.062 1.994 2.292 . 0 0 "[ . 1 . 2]" 1
2241 1 90 PHE QE 1 109 VAL MG1 . . 3.760 3.084 2.906 3.374 . 0 0 "[ . 1 . 2]" 1
2242 1 90 PHE QE 1 109 VAL MG2 . . 3.460 3.304 3.196 3.404 . 0 0 "[ . 1 . 2]" 1
2243 1 90 PHE HZ 1 109 VAL HB . . 4.640 4.357 4.184 4.641 0.001 20 0 "[ . 1 . 2]" 1
2244 1 90 PHE HZ 1 109 VAL MG1 . . 4.990 4.374 4.196 4.845 . 0 0 "[ . 1 . 2]" 1
2245 1 90 PHE HZ 1 109 VAL MG2 . . 5.500 4.990 4.764 5.159 . 0 0 "[ . 1 . 2]" 1
2246 1 91 ARG H 1 91 ARG QB . . 3.550 2.646 2.535 2.757 . 0 0 "[ . 1 . 2]" 1
2247 1 91 ARG H 1 91 ARG HD2 . . 5.500 4.974 4.224 5.491 . 0 0 "[ . 1 . 2]" 1
2248 1 91 ARG H 1 91 ARG HD3 . . 5.500 5.356 4.897 5.504 0.004 17 0 "[ . 1 . 2]" 1
2249 1 91 ARG H 1 91 ARG QG . . 3.570 3.117 2.897 3.421 . 0 0 "[ . 1 . 2]" 1
2250 1 91 ARG H 1 92 VAL H . . 4.620 4.172 4.094 4.226 . 0 0 "[ . 1 . 2]" 1
2251 1 91 ARG H 1 92 VAL MG2 . . 4.870 4.169 3.974 4.307 . 0 0 "[ . 1 . 2]" 1
2252 1 91 ARG HA 1 91 ARG QG . . 3.640 2.406 2.272 2.545 . 0 0 "[ . 1 . 2]" 1
2253 1 91 ARG HA 1 92 VAL H . . 2.940 2.141 2.140 2.143 . 0 0 "[ . 1 . 2]" 1
2254 1 91 ARG HA 1 92 VAL MG2 . . 4.140 3.389 3.262 3.539 . 0 0 "[ . 1 . 2]" 1
2255 1 91 ARG HA 1 104 SER HG . . 3.990 3.175 2.610 3.993 0.003 9 0 "[ . 1 . 2]" 1
2256 1 91 ARG QB 1 92 VAL H . . 3.590 3.350 3.300 3.406 . 0 0 "[ . 1 . 2]" 1
2257 1 91 ARG QB 1 103 SER QB . . 3.820 2.953 2.603 3.318 . 0 0 "[ . 1 . 2]" 1
2258 1 91 ARG QB 1 104 SER H . . 4.580 4.243 4.012 4.539 . 0 0 "[ . 1 . 2]" 1
2259 1 91 ARG QB 1 104 SER HG . . 5.020 4.128 3.069 4.975 . 0 0 "[ . 1 . 2]" 1
2260 1 91 ARG QD 1 103 SER QB . . 4.080 3.262 2.749 3.676 . 0 0 "[ . 1 . 2]" 1
2261 1 91 ARG QD 1 106 PRO QD . . 4.760 3.953 2.466 4.763 0.003 16 0 "[ . 1 . 2]" 1
2262 1 91 ARG HD2 1 103 SER QB . . 4.900 4.087 2.991 4.887 . 0 0 "[ . 1 . 2]" 1
2263 1 91 ARG HD3 1 103 SER QB . . 4.900 3.859 2.787 4.866 . 0 0 "[ . 1 . 2]" 1
2264 1 91 ARG HE 1 91 ARG QG . . 3.400 2.546 2.167 3.178 . 0 0 "[ . 1 . 2]" 1
2265 1 91 ARG QG 1 92 VAL H . . 4.770 4.172 3.896 4.409 . 0 0 "[ . 1 . 2]" 1
2266 1 91 ARG QG 1 103 SER QB . . 5.200 4.378 3.846 5.021 . 0 0 "[ . 1 . 2]" 1
2267 1 91 ARG QG 1 106 PRO HA . . 3.560 2.052 1.944 2.341 . 0 0 "[ . 1 . 2]" 1
2268 1 91 ARG QG 1 107 LEU H . . 4.510 3.410 3.254 3.616 . 0 0 "[ . 1 . 2]" 1
2269 1 92 VAL H 1 92 VAL HB . . 3.490 2.763 2.681 2.824 . 0 0 "[ . 1 . 2]" 1
2270 1 92 VAL H 1 92 VAL MG1 . . 4.090 3.826 3.814 3.834 . 0 0 "[ . 1 . 2]" 1
2271 1 92 VAL H 1 92 VAL MG2 . . 3.410 2.102 1.902 2.302 . 0 0 "[ . 1 . 2]" 1
2272 1 92 VAL H 1 93 MET H . . 4.600 4.533 4.396 4.574 . 0 0 "[ . 1 . 2]" 1
2273 1 92 VAL H 1 103 SER QB . . 5.240 5.168 4.858 5.286 0.046 14 0 "[ . 1 . 2]" 1
2274 1 92 VAL H 1 104 SER H . . 4.100 3.935 3.669 4.089 . 0 0 "[ . 1 . 2]" 1
2275 1 92 VAL H 1 104 SER HB2 . . 4.680 3.960 3.730 4.248 . 0 0 "[ . 1 . 2]" 1
2276 1 92 VAL H 1 104 SER QB . . 3.810 3.213 2.193 3.505 . 0 0 "[ . 1 . 2]" 1
2277 1 92 VAL H 1 104 SER HB3 . . 4.680 3.461 2.206 3.886 . 0 0 "[ . 1 . 2]" 1
2278 1 92 VAL H 1 104 SER HG . . 3.230 2.228 1.901 3.235 0.005 15 0 "[ . 1 . 2]" 1
2279 1 92 VAL HA 1 92 VAL MG1 . . 3.380 2.262 2.113 2.321 . 0 0 "[ . 1 . 2]" 1
2280 1 92 VAL HA 1 92 VAL MG2 . . 3.480 2.562 2.481 2.632 . 0 0 "[ . 1 . 2]" 1
2281 1 92 VAL HA 1 93 MET H . . 2.810 2.211 2.141 2.291 . 0 0 "[ . 1 . 2]" 1
2282 1 92 VAL HA 1 93 MET HB2 . . 5.000 4.497 4.303 4.860 . 0 0 "[ . 1 . 2]" 1
2283 1 92 VAL HA 1 93 MET HB3 . . 4.700 4.469 4.172 4.686 . 0 0 "[ . 1 . 2]" 1
2284 1 92 VAL HB 1 93 MET H . . 4.200 3.782 3.518 4.159 . 0 0 "[ . 1 . 2]" 1
2285 1 92 VAL HB 1 104 SER H . . 4.570 4.275 4.070 4.403 . 0 0 "[ . 1 . 2]" 1
2286 1 92 VAL HB 1 104 SER HB2 . . 4.840 3.753 3.173 4.158 . 0 0 "[ . 1 . 2]" 1
2287 1 92 VAL HB 1 104 SER QB . . 4.080 2.831 2.495 3.181 . 0 0 "[ . 1 . 2]" 1
2288 1 92 VAL HB 1 104 SER HB3 . . 4.840 2.931 2.580 3.301 . 0 0 "[ . 1 . 2]" 1
2289 1 92 VAL HB 1 104 SER HG . . 4.990 3.439 2.377 4.179 . 0 0 "[ . 1 . 2]" 1
2290 1 92 VAL MG1 1 93 MET H . . 3.230 2.273 1.983 2.635 . 0 0 "[ . 1 . 2]" 1
2291 1 92 VAL MG1 1 94 ALA H . . 5.090 4.816 4.541 5.074 . 0 0 "[ . 1 . 2]" 1
2292 1 92 VAL MG1 1 94 ALA MB . . 4.930 4.738 4.565 4.853 . 0 0 "[ . 1 . 2]" 1
2293 1 92 VAL MG1 1 104 SER H . . 5.300 4.910 4.653 5.043 . 0 0 "[ . 1 . 2]" 1
2294 1 92 VAL MG2 1 93 MET H . . 4.370 4.151 4.059 4.236 . 0 0 "[ . 1 . 2]" 1
2295 1 92 VAL MG2 1 104 SER H . . 5.100 5.074 4.958 5.113 0.013 13 0 "[ . 1 . 2]" 1
2296 1 92 VAL MG2 1 104 SER HG . . 4.500 3.245 2.461 3.933 . 0 0 "[ . 1 . 2]" 1
2297 1 93 MET H 1 93 MET HB2 . . 3.830 3.333 3.048 3.622 . 0 0 "[ . 1 . 2]" 1
2298 1 93 MET H 1 93 MET HB3 . . 3.630 2.839 2.716 3.026 . 0 0 "[ . 1 . 2]" 1
2299 1 93 MET H 1 93 MET QG . . 4.460 4.129 4.068 4.190 . 0 0 "[ . 1 . 2]" 1
2300 1 93 MET H 1 94 ALA H . . 4.730 4.351 4.268 4.469 . 0 0 "[ . 1 . 2]" 1
2301 1 93 MET HB2 1 94 ALA H . . 4.130 3.964 3.742 4.123 . 0 0 "[ . 1 . 2]" 1
2302 1 93 MET HB2 1 103 SER QB . . 3.890 3.072 2.806 3.291 . 0 0 "[ . 1 . 2]" 1
2303 1 93 MET HB2 1 104 SER H . . 4.510 3.252 3.061 3.516 . 0 0 "[ . 1 . 2]" 1
2304 1 93 MET HB3 1 93 MET ME . . 3.080 2.073 1.972 2.201 . 0 0 "[ . 1 . 2]" 1
2305 1 93 MET HB3 1 94 ALA H . . 4.480 3.915 3.631 4.252 . 0 0 "[ . 1 . 2]" 1
2306 1 93 MET HB3 1 95 GLN HE21 . . 5.500 3.779 3.131 4.930 . 0 0 "[ . 1 . 2]" 1
2307 1 93 MET HB3 1 95 GLN HE22 . . 5.500 4.284 3.838 5.146 . 0 0 "[ . 1 . 2]" 1
2308 1 93 MET HB3 1 100 SER QB . . 5.170 4.670 4.331 4.971 . 0 0 "[ . 1 . 2]" 1
2309 1 93 MET HB3 1 103 SER QB . . 4.660 4.365 4.029 4.647 . 0 0 "[ . 1 . 2]" 1
2310 1 93 MET HB3 1 104 SER H . . 5.100 4.785 4.554 5.068 . 0 0 "[ . 1 . 2]" 1
2311 1 93 MET ME 1 93 MET HG2 . . 3.910 2.658 2.469 3.374 . 0 0 "[ . 1 . 2]" 1
2312 1 93 MET ME 1 93 MET QG . . 3.380 2.447 2.337 2.538 . 0 0 "[ . 1 . 2]" 1
2313 1 93 MET ME 1 93 MET HG3 . . 3.910 3.228 2.384 3.397 . 0 0 "[ . 1 . 2]" 1
2314 1 93 MET ME 1 95 GLN HE21 . . 3.950 2.410 1.846 2.833 . 0 0 "[ . 1 . 2]" 1
2315 1 93 MET ME 1 95 GLN HE22 . . 4.770 2.956 2.003 3.507 . 0 0 "[ . 1 . 2]" 1
2316 1 93 MET ME 1 100 SER HA . . 4.300 3.871 3.294 4.276 . 0 0 "[ . 1 . 2]" 1
2317 1 93 MET ME 1 100 SER HB2 . . 3.770 2.697 2.083 3.637 . 0 0 "[ . 1 . 2]" 1
2318 1 93 MET ME 1 100 SER QB . . 3.290 2.256 2.041 2.870 . 0 0 "[ . 1 . 2]" 1
2319 1 93 MET ME 1 100 SER HB3 . . 3.770 2.862 2.142 3.728 . 0 0 "[ . 1 . 2]" 1
2320 1 93 MET ME 1 101 GLY H . . 4.840 4.492 4.241 4.647 . 0 0 "[ . 1 . 2]" 1
2321 1 93 MET ME 1 103 SER QB . . 4.440 3.192 2.494 4.428 . 0 0 "[ . 1 . 2]" 1
2322 1 93 MET QG 1 94 ALA H . . 4.110 2.206 1.930 2.373 . 0 0 "[ . 1 . 2]" 1
2323 1 93 MET QG 1 100 SER HA . . 4.490 3.450 3.153 3.688 . 0 0 "[ . 1 . 2]" 1
2324 1 93 MET QG 1 100 SER QB . . 3.870 3.285 2.974 3.615 . 0 0 "[ . 1 . 2]" 1
2325 1 93 MET QG 1 101 GLY H . . 3.900 3.039 2.787 3.290 . 0 0 "[ . 1 . 2]" 1
2326 1 93 MET QG 1 101 GLY HA3 . . 4.650 4.124 3.827 4.326 . 0 0 "[ . 1 . 2]" 1
2327 1 93 MET QG 1 102 GLU HA . . 5.340 4.298 3.944 4.473 . 0 0 "[ . 1 . 2]" 1
2328 1 93 MET QG 1 103 SER QB . . 4.450 4.059 3.614 4.275 . 0 0 "[ . 1 . 2]" 1
2329 1 93 MET HG2 1 94 ALA H . . 4.700 2.722 2.212 3.041 . 0 0 "[ . 1 . 2]" 1
2330 1 93 MET HG2 1 94 ALA MB . . 5.380 4.205 3.772 4.427 . 0 0 "[ . 1 . 2]" 1
2331 1 93 MET HG2 1 95 GLN HE21 . . 5.400 3.270 2.628 4.735 . 0 0 "[ . 1 . 2]" 1
2332 1 93 MET HG2 1 101 GLY H . . 4.560 3.233 2.993 3.475 . 0 0 "[ . 1 . 2]" 1
2333 1 93 MET HG2 1 101 GLY HA3 . . 5.360 4.780 4.115 5.067 . 0 0 "[ . 1 . 2]" 1
2334 1 93 MET HG2 1 103 SER QB . . 5.250 5.058 4.548 5.279 0.029 11 0 "[ . 1 . 2]" 1
2335 1 93 MET HG2 1 104 SER H . . 5.500 5.471 5.261 5.540 0.040 14 0 "[ . 1 . 2]" 1
2336 1 93 MET HG3 1 94 ALA H . . 4.700 2.549 1.969 4.018 . 0 0 "[ . 1 . 2]" 1
2337 1 93 MET HG3 1 94 ALA MB . . 5.380 4.266 3.866 5.304 . 0 0 "[ . 1 . 2]" 1
2338 1 93 MET HG3 1 95 GLN HE21 . . 5.400 4.666 4.205 5.111 . 0 0 "[ . 1 . 2]" 1
2339 1 93 MET HG3 1 101 GLY H . . 4.560 3.706 3.323 4.065 . 0 0 "[ . 1 . 2]" 1
2340 1 93 MET HG3 1 101 GLY HA3 . . 5.360 4.541 4.244 4.834 . 0 0 "[ . 1 . 2]" 1
2341 1 93 MET HG3 1 103 SER QB . . 5.250 4.280 3.793 4.536 . 0 0 "[ . 1 . 2]" 1
2342 1 93 MET HG3 1 104 SER H . . 5.500 4.313 4.033 5.504 0.004 19 0 "[ . 1 . 2]" 1
2343 1 94 ALA H 1 94 ALA MB . . 3.350 2.201 2.101 2.308 . 0 0 "[ . 1 . 2]" 1
2344 1 94 ALA H 1 95 GLN H . . 4.770 4.571 4.543 4.598 . 0 0 "[ . 1 . 2]" 1
2345 1 94 ALA H 1 101 GLY H . . 4.430 4.294 4.105 4.443 0.013 19 0 "[ . 1 . 2]" 1
2346 1 94 ALA HA 1 95 GLN H . . 2.790 2.307 2.260 2.350 . 0 0 "[ . 1 . 2]" 1
2347 1 94 ALA MB 1 95 GLN H . . 3.240 2.716 2.615 2.832 . 0 0 "[ . 1 . 2]" 1
2348 1 94 ALA MB 1 96 ASN HD21 . . 4.580 4.534 4.401 4.592 0.012 20 0 "[ . 1 . 2]" 1
2349 1 94 ALA MB 1 101 GLY H . . 4.420 4.292 4.076 4.394 . 0 0 "[ . 1 . 2]" 1
2350 1 94 ALA MB 1 102 GLU H . . 5.030 4.641 4.341 4.906 . 0 0 "[ . 1 . 2]" 1
2351 1 95 GLN H 1 95 GLN QB . . 3.210 2.626 2.578 2.644 . 0 0 "[ . 1 . 2]" 1
2352 1 95 GLN H 1 95 GLN HG2 . . 4.940 4.827 4.800 4.871 . 0 0 "[ . 1 . 2]" 1
2353 1 95 GLN H 1 95 GLN HG3 . . 4.000 3.863 3.834 3.927 . 0 0 "[ . 1 . 2]" 1
2354 1 95 GLN HA 1 95 GLN HG2 . . 3.990 2.814 2.803 2.859 . 0 0 "[ . 1 . 2]" 1
2355 1 95 GLN HA 1 95 GLN HG3 . . 4.030 2.339 2.284 2.357 . 0 0 "[ . 1 . 2]" 1
2356 1 95 GLN HA 1 96 ASN H . . 2.750 2.147 2.140 2.160 . 0 0 "[ . 1 . 2]" 1
2357 1 95 GLN HA 1 96 ASN HA . . 4.620 4.393 4.391 4.399 . 0 0 "[ . 1 . 2]" 1
2358 1 95 GLN HA 1 99 GLY H . . 4.370 4.094 4.035 4.244 . 0 0 "[ . 1 . 2]" 1
2359 1 95 GLN QB 1 100 SER HA . . 4.590 4.001 3.865 4.116 . 0 0 "[ . 1 . 2]" 1
2360 1 95 GLN HB2 1 100 SER HA . . 5.340 4.595 4.477 4.719 . 0 0 "[ . 1 . 2]" 1
2361 1 95 GLN HB3 1 100 SER HA . . 5.340 4.401 4.225 4.544 . 0 0 "[ . 1 . 2]" 1
2362 1 95 GLN HG2 1 96 ASN H . . 4.460 4.096 3.974 4.290 . 0 0 "[ . 1 . 2]" 1
2363 1 95 GLN HG2 1 99 GLY H . . 5.040 4.745 4.690 4.836 . 0 0 "[ . 1 . 2]" 1
2364 1 95 GLN HG2 1 99 GLY HA2 . . 4.500 3.353 3.108 3.581 . 0 0 "[ . 1 . 2]" 1
2365 1 95 GLN HG2 1 100 SER QB . . 4.420 3.290 2.842 4.049 . 0 0 "[ . 1 . 2]" 1
2366 1 95 GLN HG2 1 101 GLY H . . 5.500 4.424 4.182 4.659 . 0 0 "[ . 1 . 2]" 1
2367 1 95 GLN HG3 1 96 ASN H . . 4.410 4.318 4.211 4.392 . 0 0 "[ . 1 . 2]" 1
2368 1 95 GLN HG3 1 99 GLY H . . 5.500 5.517 5.508 5.555 0.055 10 0 "[ . 1 . 2]" 1
2369 1 95 GLN HG3 1 100 SER HB2 . . 4.970 3.981 2.640 4.744 . 0 0 "[ . 1 . 2]" 1
2370 1 95 GLN HG3 1 100 SER QB . . 4.370 3.199 2.611 3.697 . 0 0 "[ . 1 . 2]" 1
2371 1 95 GLN HG3 1 100 SER HB3 . . 4.970 3.443 3.135 4.122 . 0 0 "[ . 1 . 2]" 1
2372 1 95 GLN HG3 1 101 GLY H . . 4.630 3.370 3.173 3.551 . 0 0 "[ . 1 . 2]" 1
2373 1 96 ASN H 1 96 ASN HB3 . . 4.180 2.934 2.797 3.006 . 0 0 "[ . 1 . 2]" 1
2374 1 96 ASN H 1 98 HIS H . . 4.170 3.730 3.635 3.956 . 0 0 "[ . 1 . 2]" 1
2375 1 96 ASN H 1 99 GLY H . . 3.310 2.751 2.597 2.849 . 0 0 "[ . 1 . 2]" 1
2376 1 96 ASN H 1 99 GLY HA2 . . 4.580 4.065 3.809 4.315 . 0 0 "[ . 1 . 2]" 1
2377 1 96 ASN H 1 100 SER HA . . 4.740 4.554 3.988 4.732 . 0 0 "[ . 1 . 2]" 1
2378 1 96 ASN H 1 101 GLY H . . 4.840 4.803 4.648 4.858 0.018 10 0 "[ . 1 . 2]" 1
2379 1 96 ASN HA 1 96 ASN HD21 . . 4.020 3.888 3.814 3.958 . 0 0 "[ . 1 . 2]" 1
2380 1 96 ASN HA 1 97 LYS HA . . 5.070 4.326 4.310 4.338 . 0 0 "[ . 1 . 2]" 1
2381 1 96 ASN HA 1 98 HIS H . . 4.550 4.147 4.072 4.379 . 0 0 "[ . 1 . 2]" 1
2382 1 96 ASN HA 1 99 GLY H . . 5.330 4.970 4.785 5.087 . 0 0 "[ . 1 . 2]" 1
2383 1 96 ASN HB2 1 97 LYS H . . 4.490 2.120 2.049 2.201 . 0 0 "[ . 1 . 2]" 1
2384 1 96 ASN HB2 1 98 HIS H . . 4.470 3.501 3.280 3.760 . 0 0 "[ . 1 . 2]" 1
2385 1 96 ASN HB3 1 96 ASN HD22 . . 4.050 3.556 3.537 3.574 . 0 0 "[ . 1 . 2]" 1
2386 1 96 ASN HB3 1 97 LYS H . . 4.610 3.628 3.582 3.684 . 0 0 "[ . 1 . 2]" 1
2387 1 96 ASN HB3 1 98 HIS H . . 4.640 4.220 4.162 4.409 . 0 0 "[ . 1 . 2]" 1
2388 1 96 ASN HD21 1 98 HIS HD2 . . 4.360 3.934 3.563 4.358 . 0 0 "[ . 1 . 2]" 1
2389 1 96 ASN HD22 1 98 HIS HD2 . . 3.940 2.363 1.982 2.933 . 0 0 "[ . 1 . 2]" 1
2390 1 97 LYS H 1 97 LYS QG . . 4.780 2.470 2.095 3.911 . 0 0 "[ . 1 . 2]" 1
2391 1 97 LYS H 1 98 HIS H . . 4.170 2.875 2.807 3.002 . 0 0 "[ . 1 . 2]" 1
2392 1 97 LYS HA 1 97 LYS QD . . 4.320 4.170 3.591 4.384 0.064 6 0 "[ . 1 . 2]" 1
2393 1 97 LYS HA 1 97 LYS QE . . 5.460 5.058 4.387 5.477 0.017 13 0 "[ . 1 . 2]" 1
2394 1 97 LYS HA 1 97 LYS HG2 . . 4.250 3.731 3.564 4.231 . 0 0 "[ . 1 . 2]" 1
2395 1 97 LYS HA 1 97 LYS HG3 . . 4.250 3.781 2.881 4.184 . 0 0 "[ . 1 . 2]" 1
2396 1 97 LYS HA 1 99 GLY H . . 5.390 5.329 5.071 5.399 0.009 5 0 "[ . 1 . 2]" 1
2397 1 97 LYS QB 1 98 HIS H . . 3.950 3.559 2.842 3.662 . 0 0 "[ . 1 . 2]" 1
2398 1 97 LYS HB2 1 98 HIS H . . 4.820 4.013 3.821 4.134 . 0 0 "[ . 1 . 2]" 1
2399 1 97 LYS HB3 1 98 HIS H . . 4.820 4.018 2.896 4.194 . 0 0 "[ . 1 . 2]" 1
2400 1 97 LYS QD 1 98 HIS HE1 . . 4.430 3.572 2.123 4.433 0.003 5 0 "[ . 1 . 2]" 1
2401 1 97 LYS QE 1 97 LYS HG2 . . 3.690 2.782 2.097 3.471 . 0 0 "[ . 1 . 2]" 1
2402 1 97 LYS QE 1 97 LYS HG3 . . 3.690 2.499 2.108 3.282 . 0 0 "[ . 1 . 2]" 1
2403 1 97 LYS QE 1 98 HIS HE1 . . 4.080 3.124 1.947 4.082 0.002 5 0 "[ . 1 . 2]" 1
2404 1 97 LYS QG 1 98 HIS H . . 3.530 2.406 2.069 2.974 . 0 0 "[ . 1 . 2]" 1
2405 1 97 LYS QG 1 98 HIS HD2 . . 5.040 4.205 3.707 5.047 0.007 5 0 "[ . 1 . 2]" 1
2406 1 97 LYS QG 1 98 HIS HE1 . . 4.380 3.300 2.783 4.357 . 0 0 "[ . 1 . 2]" 1
2407 1 97 LYS HG2 1 98 HIS H . . 4.150 2.776 2.256 4.143 . 0 0 "[ . 1 . 2]" 1
2408 1 97 LYS HG3 1 98 HIS H . . 4.150 3.000 2.109 4.122 . 0 0 "[ . 1 . 2]" 1
2409 1 98 HIS H 1 98 HIS HB2 . . 3.630 2.507 2.347 2.624 . 0 0 "[ . 1 . 2]" 1
2410 1 98 HIS H 1 98 HIS QB . . 3.020 2.462 2.318 2.565 . 0 0 "[ . 1 . 2]" 1
2411 1 98 HIS H 1 98 HIS HB3 . . 3.630 3.608 3.580 3.625 . 0 0 "[ . 1 . 2]" 1
2412 1 98 HIS H 1 98 HIS HD2 . . 4.060 3.847 3.370 4.041 . 0 0 "[ . 1 . 2]" 1
2413 1 98 HIS H 1 99 GLY HA2 . . 5.070 4.838 4.745 4.935 . 0 0 "[ . 1 . 2]" 1
2414 1 98 HIS QB 1 99 GLY H . . 3.240 1.986 1.897 2.152 . 0 0 "[ . 1 . 2]" 1
2415 1 98 HIS HB2 1 99 GLY H . . 3.730 2.012 1.911 2.185 . 0 0 "[ . 1 . 2]" 1
2416 1 98 HIS HB3 1 99 GLY H . . 3.730 3.096 2.818 3.270 . 0 0 "[ . 1 . 2]" 1
2417 1 98 HIS HD2 1 99 GLY H . . 4.780 4.589 4.328 4.782 0.002 10 0 "[ . 1 . 2]" 1
2418 1 99 GLY H 1 100 SER H . . 4.410 4.203 3.946 4.319 . 0 0 "[ . 1 . 2]" 1
2419 1 99 GLY H 1 100 SER HA . . 5.500 4.825 4.611 4.942 . 0 0 "[ . 1 . 2]" 1
2420 1 99 GLY HA2 1 100 SER H . . 3.300 3.051 2.957 3.260 . 0 0 "[ . 1 . 2]" 1
2421 1 99 GLY HA3 1 100 SER H . . 2.770 2.195 2.136 2.240 . 0 0 "[ . 1 . 2]" 1
2422 1 100 SER H 1 100 SER HB2 . . 3.760 3.308 2.474 3.694 . 0 0 "[ . 1 . 2]" 1
2423 1 100 SER H 1 100 SER QB . . 3.100 2.642 2.350 2.910 . 0 0 "[ . 1 . 2]" 1
2424 1 100 SER H 1 100 SER HB3 . . 3.760 3.038 2.396 3.723 . 0 0 "[ . 1 . 2]" 1
2425 1 100 SER H 1 101 GLY H . . 4.500 4.406 4.315 4.455 . 0 0 "[ . 1 . 2]" 1
2426 1 100 SER HA 1 101 GLY H . . 2.880 2.145 2.142 2.191 . 0 0 "[ . 1 . 2]" 1
2427 1 100 SER QB 1 101 GLY H . . 3.500 3.391 3.289 3.558 0.058 10 0 "[ . 1 . 2]" 1
2428 1 100 SER HB2 1 101 GLY H . . 4.350 3.764 3.431 4.343 . 0 0 "[ . 1 . 2]" 1
2429 1 100 SER HB3 1 101 GLY H . . 4.350 4.084 3.501 4.368 0.018 5 0 "[ . 1 . 2]" 1
2430 1 101 GLY H 1 102 GLU H . . 3.930 3.654 3.313 3.893 . 0 0 "[ . 1 . 2]" 1
2431 1 101 GLY HA3 1 102 GLU H . . 3.000 2.156 2.136 2.220 . 0 0 "[ . 1 . 2]" 1
2432 1 102 GLU H 1 102 GLU HB2 . . 3.350 2.862 2.656 3.133 . 0 0 "[ . 1 . 2]" 1
2433 1 102 GLU H 1 102 GLU HB3 . . 3.110 2.579 2.443 2.719 . 0 0 "[ . 1 . 2]" 1
2434 1 102 GLU H 1 102 GLU QG . . 4.110 4.046 3.972 4.117 0.007 14 0 "[ . 1 . 2]" 1
2435 1 102 GLU H 1 103 SER H . . 4.670 4.498 4.411 4.573 . 0 0 "[ . 1 . 2]" 1
2436 1 102 GLU HA 1 102 GLU QG . . 3.490 2.565 2.283 2.961 . 0 0 "[ . 1 . 2]" 1
2437 1 102 GLU HA 1 103 SER H . . 2.670 2.206 2.160 2.286 . 0 0 "[ . 1 . 2]" 1
2438 1 102 GLU HA 1 103 SER QB . . 4.590 4.419 4.015 4.616 0.026 20 0 "[ . 1 . 2]" 1
2439 1 102 GLU HB2 1 103 SER H . . 4.210 4.113 4.011 4.238 0.028 14 0 "[ . 1 . 2]" 1
2440 1 102 GLU QG 1 103 SER H . . 3.650 2.418 2.009 2.705 . 0 0 "[ . 1 . 2]" 1
2441 1 102 GLU QG 1 103 SER QB . . 4.690 4.245 3.985 4.464 . 0 0 "[ . 1 . 2]" 1
2442 1 103 SER H 1 103 SER QB . . 2.910 2.636 2.180 2.905 . 0 0 "[ . 1 . 2]" 1
2443 1 103 SER H 1 104 SER H . . 4.510 4.461 4.379 4.549 0.039 14 0 "[ . 1 . 2]" 1
2444 1 103 SER QB 1 104 SER H . . 3.550 3.301 3.127 3.573 0.023 14 0 "[ . 1 . 2]" 1
2445 1 104 SER H 1 104 SER QB . . 3.320 2.318 2.195 2.503 . 0 0 "[ . 1 . 2]" 1
2446 1 104 SER H 1 104 SER HG . . 4.110 3.497 2.399 4.143 0.033 15 0 "[ . 1 . 2]" 1
2447 1 104 SER H 1 105 ALA H . . 4.860 4.613 4.596 4.630 . 0 0 "[ . 1 . 2]" 1
2448 1 104 SER HA 1 105 ALA H . . 2.800 2.520 2.467 2.561 . 0 0 "[ . 1 . 2]" 1
2449 1 104 SER HA 1 105 ALA MB . . 4.320 4.144 4.087 4.185 . 0 0 "[ . 1 . 2]" 1
2450 1 104 SER QB 1 105 ALA MB . . 4.760 3.956 3.764 4.516 . 0 0 "[ . 1 . 2]" 1
2451 1 104 SER HB2 1 105 ALA H . . 3.930 2.454 2.180 3.493 . 0 0 "[ . 1 . 2]" 1
2452 1 104 SER HB3 1 105 ALA H . . 3.930 3.720 3.598 3.816 . 0 0 "[ . 1 . 2]" 1
2453 1 104 SER HG 1 105 ALA H . . 3.930 3.201 2.144 3.924 . 0 0 "[ . 1 . 2]" 1
2454 1 105 ALA H 1 105 ALA MB . . 2.800 2.198 2.111 2.254 . 0 0 "[ . 1 . 2]" 1
2455 1 105 ALA H 1 106 PRO HD2 . . 5.110 4.794 4.786 4.805 . 0 0 "[ . 1 . 2]" 1
2456 1 105 ALA H 1 106 PRO QD . . 4.400 4.356 4.350 4.363 . 0 0 "[ . 1 . 2]" 1
2457 1 105 ALA H 1 106 PRO HD3 . . 5.110 4.999 4.984 5.008 . 0 0 "[ . 1 . 2]" 1
2458 1 105 ALA HA 1 106 PRO HD2 . . 3.070 2.307 2.283 2.314 . 0 0 "[ . 1 . 2]" 1
2459 1 105 ALA HA 1 106 PRO HD3 . . 3.070 2.270 2.264 2.272 . 0 0 "[ . 1 . 2]" 1
2460 1 105 ALA MB 1 106 PRO HD2 . . 3.510 2.137 2.102 2.258 . 0 0 "[ . 1 . 2]" 1
2461 1 105 ALA MB 1 106 PRO QD . . 2.880 2.114 2.081 2.227 . 0 0 "[ . 1 . 2]" 1
2462 1 105 ALA MB 1 106 PRO HD3 . . 3.510 3.350 3.337 3.385 . 0 0 "[ . 1 . 2]" 1
2463 1 106 PRO HA 1 107 LEU H . . 2.750 2.173 2.152 2.201 . 0 0 "[ . 1 . 2]" 1
2464 1 106 PRO HA 1 107 LEU HB2 . . 5.060 4.721 4.606 4.812 . 0 0 "[ . 1 . 2]" 1
2465 1 106 PRO HA 1 107 LEU HB3 . . 4.690 4.555 4.506 4.601 . 0 0 "[ . 1 . 2]" 1
2466 1 106 PRO QB 1 107 LEU H . . 3.750 3.558 3.370 3.658 . 0 0 "[ . 1 . 2]" 1
2467 1 106 PRO HB2 1 107 LEU H . . 4.460 3.835 3.604 3.957 . 0 0 "[ . 1 . 2]" 1
2468 1 106 PRO HB3 1 107 LEU H . . 4.460 4.214 4.049 4.305 . 0 0 "[ . 1 . 2]" 1
2469 1 107 LEU H 1 107 LEU HB2 . . 3.370 2.813 2.691 2.903 . 0 0 "[ . 1 . 2]" 1
2470 1 107 LEU H 1 107 LEU HB3 . . 3.760 2.406 2.356 2.458 . 0 0 "[ . 1 . 2]" 1
2471 1 107 LEU H 1 107 LEU MD1 . . 4.280 4.260 4.210 4.291 0.011 9 0 "[ . 1 . 2]" 1
2472 1 107 LEU H 1 107 LEU MD2 . . 4.310 4.281 4.233 4.327 0.017 9 0 "[ . 1 . 2]" 1
2473 1 107 LEU H 1 107 LEU HG . . 4.810 4.384 4.345 4.421 . 0 0 "[ . 1 . 2]" 1
2474 1 107 LEU H 1 108 ARG H . . 4.580 4.471 4.363 4.525 . 0 0 "[ . 1 . 2]" 1
2475 1 107 LEU HB2 1 107 LEU MD1 . . 3.510 2.279 2.184 2.398 . 0 0 "[ . 1 . 2]" 1
2476 1 107 LEU HB2 1 107 LEU MD2 . . 3.540 2.372 2.327 2.412 . 0 0 "[ . 1 . 2]" 1
2477 1 107 LEU HB2 1 108 ARG H . . 4.620 4.196 4.103 4.306 . 0 0 "[ . 1 . 2]" 1
2478 1 107 LEU HB3 1 107 LEU MD1 . . 3.310 3.188 3.174 3.194 . 0 0 "[ . 1 . 2]" 1
2479 1 107 LEU HB3 1 107 LEU MD2 . . 3.240 2.337 2.310 2.371 . 0 0 "[ . 1 . 2]" 1
2480 1 107 LEU HB3 1 108 ARG H . . 4.550 4.247 4.117 4.367 . 0 0 "[ . 1 . 2]" 1
2481 1 107 LEU HB3 1 109 VAL MG2 . . 4.590 3.376 3.253 3.616 . 0 0 "[ . 1 . 2]" 1
2482 1 107 LEU MD1 1 108 ARG H . . 3.180 2.427 2.240 2.636 . 0 0 "[ . 1 . 2]" 1
2483 1 107 LEU MD1 1 108 ARG HA . . 4.660 4.604 4.499 4.661 0.001 20 0 "[ . 1 . 2]" 1
2484 1 107 LEU MD1 1 108 ARG QB . . 4.300 3.925 3.806 4.011 . 0 0 "[ . 1 . 2]" 1
2485 1 107 LEU MD1 1 109 VAL H . . 5.370 4.980 4.804 5.175 . 0 0 "[ . 1 . 2]" 1
2486 1 107 LEU MD2 1 108 ARG H . . 4.790 4.563 4.338 4.801 0.011 16 0 "[ . 1 . 2]" 1
2487 1 107 LEU MD2 1 109 VAL HA . . 5.500 4.855 4.671 5.033 . 0 0 "[ . 1 . 2]" 1
2488 1 107 LEU MD2 1 109 VAL MG2 . . 3.210 2.241 2.070 2.351 . 0 0 "[ . 1 . 2]" 1
2489 1 107 LEU HG 1 108 ARG H . . 3.600 3.177 2.852 3.500 . 0 0 "[ . 1 . 2]" 1
2490 1 107 LEU HG 1 109 VAL HA . . 5.260 4.275 4.143 4.502 . 0 0 "[ . 1 . 2]" 1
2491 1 107 LEU HG 1 109 VAL MG1 . . 5.310 4.571 4.415 4.713 . 0 0 "[ . 1 . 2]" 1
2492 1 107 LEU HG 1 109 VAL MG2 . . 2.970 2.027 1.878 2.181 . 0 0 "[ . 1 . 2]" 1
2493 1 108 ARG H 1 108 ARG HB2 . . 3.500 2.737 2.611 2.878 . 0 0 "[ . 1 . 2]" 1
2494 1 108 ARG H 1 108 ARG QB . . 2.920 2.316 2.268 2.349 . 0 0 "[ . 1 . 2]" 1
2495 1 108 ARG H 1 108 ARG HB3 . . 3.500 2.507 2.418 2.637 . 0 0 "[ . 1 . 2]" 1
2496 1 108 ARG H 1 108 ARG QD . . 4.780 4.611 4.031 4.776 . 0 0 "[ . 1 . 2]" 1
2497 1 108 ARG H 1 108 ARG QG . . 4.530 4.006 3.965 4.099 . 0 0 "[ . 1 . 2]" 1
2498 1 108 ARG H 1 109 VAL H . . 4.470 4.289 4.194 4.430 . 0 0 "[ . 1 . 2]" 1
2499 1 108 ARG HA 1 108 ARG QD . . 4.680 3.893 3.059 4.211 . 0 0 "[ . 1 . 2]" 1
2500 1 108 ARG HA 1 108 ARG HG2 . . 4.050 3.130 2.315 3.462 . 0 0 "[ . 1 . 2]" 1
2501 1 108 ARG HA 1 108 ARG QG . . 3.500 2.421 2.280 2.530 . 0 0 "[ . 1 . 2]" 1
2502 1 108 ARG HA 1 108 ARG HG3 . . 4.050 2.631 2.330 3.720 . 0 0 "[ . 1 . 2]" 1
2503 1 108 ARG HA 1 109 VAL H . . 2.740 2.161 2.140 2.182 . 0 0 "[ . 1 . 2]" 1
2504 1 108 ARG HA 1 109 VAL HA . . 4.740 4.400 4.393 4.413 . 0 0 "[ . 1 . 2]" 1
2505 1 108 ARG HA 1 109 VAL HB . . 4.950 4.721 4.638 4.821 . 0 0 "[ . 1 . 2]" 1
2506 1 108 ARG HA 1 109 VAL MG2 . . 4.210 3.885 3.688 3.994 . 0 0 "[ . 1 . 2]" 1
2507 1 108 ARG QB 1 108 ARG QD . . 3.120 2.218 2.085 2.464 . 0 0 "[ . 1 . 2]" 1
2508 1 108 ARG QB 1 109 VAL MG2 . . 4.940 4.567 4.442 4.669 . 0 0 "[ . 1 . 2]" 1
2509 1 108 ARG HB2 1 108 ARG QD . . 3.560 2.459 2.138 3.463 . 0 0 "[ . 1 . 2]" 1
2510 1 108 ARG HB2 1 109 VAL H . . 4.520 4.438 4.297 4.509 . 0 0 "[ . 1 . 2]" 1
2511 1 108 ARG HB3 1 108 ARG QD . . 3.560 2.673 2.241 2.893 . 0 0 "[ . 1 . 2]" 1
2512 1 108 ARG HB3 1 109 VAL H . . 4.520 4.375 4.257 4.455 . 0 0 "[ . 1 . 2]" 1
2513 1 108 ARG QG 1 109 VAL H . . 3.570 3.253 2.869 3.401 . 0 0 "[ . 1 . 2]" 1
2514 1 108 ARG QG 1 109 VAL HA . . 5.340 4.036 3.789 4.720 . 0 0 "[ . 1 . 2]" 1
2515 1 108 ARG QG 1 110 GLU H . . 5.210 4.722 4.295 5.205 . 0 0 "[ . 1 . 2]" 1
2516 1 109 VAL H 1 109 VAL HB . . 3.520 2.651 2.580 2.757 . 0 0 "[ . 1 . 2]" 1
2517 1 109 VAL H 1 109 VAL MG1 . . 4.280 3.858 3.826 3.899 . 0 0 "[ . 1 . 2]" 1
2518 1 109 VAL H 1 109 VAL MG2 . . 3.310 2.781 2.593 2.961 . 0 0 "[ . 1 . 2]" 1
2519 1 109 VAL H 1 110 GLU H . . 4.680 4.403 4.255 4.522 . 0 0 "[ . 1 . 2]" 1
2520 1 109 VAL HA 1 109 VAL MG1 . . 3.110 2.300 2.214 2.412 . 0 0 "[ . 1 . 2]" 1
2521 1 109 VAL HA 1 109 VAL MG2 . . 3.190 2.317 2.265 2.384 . 0 0 "[ . 1 . 2]" 1
2522 1 109 VAL HA 1 110 GLU H . . 2.630 2.185 2.142 2.340 . 0 0 "[ . 1 . 2]" 1
2523 1 109 VAL HA 1 110 GLU HA . . 4.770 4.398 4.385 4.456 . 0 0 "[ . 1 . 2]" 1
2524 1 109 VAL HA 1 110 GLU HB2 . . 4.690 4.436 4.286 4.610 . 0 0 "[ . 1 . 2]" 1
2525 1 109 VAL HA 1 110 GLU QB . . 4.100 4.023 3.930 4.081 . 0 0 "[ . 1 . 2]" 1
2526 1 109 VAL HA 1 110 GLU HB3 . . 4.690 4.610 4.550 4.675 . 0 0 "[ . 1 . 2]" 1
2527 1 109 VAL HB 1 110 GLU H . . 4.380 4.065 3.676 4.240 . 0 0 "[ . 1 . 2]" 1
2528 1 109 VAL MG1 1 110 GLU H . . 3.070 2.305 1.838 2.549 . 0 0 "[ . 1 . 2]" 1
2529 1 109 VAL MG1 1 110 GLU HA . . 4.900 3.764 3.360 3.920 . 0 0 "[ . 1 . 2]" 1
2530 1 109 VAL MG1 1 110 GLU QB . . 5.070 4.087 3.836 4.222 . 0 0 "[ . 1 . 2]" 1
2531 1 109 VAL MG1 1 111 THR H . . 5.020 4.108 3.895 4.296 . 0 0 "[ . 1 . 2]" 1
2532 1 109 VAL MG1 1 111 THR HA . . 4.290 3.895 3.795 3.973 . 0 0 "[ . 1 . 2]" 1
2533 1 110 GLU H 1 110 GLU HB2 . . 3.310 2.968 2.824 3.176 . 0 0 "[ . 1 . 2]" 1
2534 1 110 GLU H 1 110 GLU QB . . 2.880 2.462 2.363 2.623 . 0 0 "[ . 1 . 2]" 1
2535 1 110 GLU H 1 110 GLU HB3 . . 3.310 2.631 2.490 2.799 . 0 0 "[ . 1 . 2]" 1
2536 1 110 GLU H 1 110 GLU QG . . 4.430 4.063 4.011 4.132 . 0 0 "[ . 1 . 2]" 1
2537 1 110 GLU H 1 111 THR H . . 4.470 4.324 4.208 4.418 . 0 0 "[ . 1 . 2]" 1
2538 1 110 GLU H 1 111 THR HA . . 5.500 4.957 4.720 5.105 . 0 0 "[ . 1 . 2]" 1
2539 1 110 GLU HA 1 110 GLU HG2 . . 3.850 3.011 2.945 3.165 . 0 0 "[ . 1 . 2]" 1
2540 1 110 GLU HA 1 110 GLU QG . . 3.310 2.452 2.398 2.538 . 0 0 "[ . 1 . 2]" 1
2541 1 110 GLU HA 1 110 GLU HG3 . . 3.850 2.600 2.523 2.746 . 0 0 "[ . 1 . 2]" 1
2542 1 110 GLU HA 1 111 THR H . . 2.800 2.141 2.137 2.150 . 0 0 "[ . 1 . 2]" 1
2543 1 110 GLU HA 1 111 THR MG . . 4.460 4.242 4.115 4.353 . 0 0 "[ . 1 . 2]" 1
2544 1 110 GLU HB2 1 111 THR H . . 4.530 4.309 4.233 4.379 . 0 0 "[ . 1 . 2]" 1
2545 1 110 GLU HB3 1 111 THR H . . 4.530 4.225 4.164 4.292 . 0 0 "[ . 1 . 2]" 1
2546 1 110 GLU HG2 1 111 THR H . . 3.660 3.129 2.988 3.276 . 0 0 "[ . 1 . 2]" 1
2547 1 110 GLU HG3 1 111 THR H . . 3.660 3.419 3.079 3.604 . 0 0 "[ . 1 . 2]" 1
2548 1 111 THR H 1 111 THR HG1 . . 3.750 3.200 3.104 3.254 . 0 0 "[ . 1 . 2]" 1
2549 1 111 THR H 1 111 THR MG . . 3.230 2.764 2.691 2.827 . 0 0 "[ . 1 . 2]" 1
2550 1 111 THR H 1 112 GLN H . . 4.830 4.558 4.536 4.576 . 0 0 "[ . 1 . 2]" 1
2551 1 111 THR HA 1 111 THR MG . . 3.180 2.093 2.043 2.161 . 0 0 "[ . 1 . 2]" 1
2552 1 111 THR HA 1 112 GLN H . . 2.950 2.589 2.544 2.625 . 0 0 "[ . 1 . 2]" 1
2553 1 111 THR HA 1 112 GLN HB2 . . 5.450 5.255 5.225 5.300 . 0 0 "[ . 1 . 2]" 1
2554 1 111 THR HA 1 112 GLN HB3 . . 5.500 5.568 5.560 5.582 0.082 8 0 "[ . 1 . 2]" 1
2555 1 111 THR HA 1 112 GLN QG . . 4.040 3.244 3.176 3.350 . 0 0 "[ . 1 . 2]" 1
2556 1 111 THR HG1 1 111 THR MG . . 3.180 2.264 2.092 2.390 . 0 0 "[ . 1 . 2]" 1
2557 1 111 THR HG1 1 112 GLN H . . 4.380 4.206 4.119 4.291 . 0 0 "[ . 1 . 2]" 1
2558 1 111 THR MG 1 112 GLN H . . 3.920 3.252 3.179 3.354 . 0 0 "[ . 1 . 2]" 1
2559 1 112 GLN H 1 112 GLN HB2 . . 3.270 2.912 2.901 2.924 . 0 0 "[ . 1 . 2]" 1
2560 1 112 GLN H 1 112 GLN HB3 . . 3.820 3.711 3.683 3.736 . 0 0 "[ . 1 . 2]" 1
2561 1 112 GLN H 1 112 GLN QG . . 3.210 2.066 1.933 2.276 . 0 0 "[ . 1 . 2]" 1
2562 1 112 GLN H 1 113 PRO HD2 . . 4.850 4.840 4.833 4.843 . 0 0 "[ . 1 . 2]" 1
2563 1 112 GLN H 1 113 PRO HD3 . . 5.030 4.931 4.891 4.975 . 0 0 "[ . 1 . 2]" 1
2564 1 112 GLN HA 1 112 GLN QE . . 5.130 4.568 4.324 5.019 . 0 0 "[ . 1 . 2]" 1
2565 1 112 GLN HA 1 112 GLN QG . . 3.310 3.043 2.722 3.244 . 0 0 "[ . 1 . 2]" 1
2566 1 112 GLN HA 1 113 PRO HA . . 4.520 4.401 4.395 4.408 . 0 0 "[ . 1 . 2]" 1
2567 1 112 GLN HA 1 113 PRO HD2 . . 3.140 2.246 2.185 2.304 . 0 0 "[ . 1 . 2]" 1
2568 1 112 GLN HA 1 113 PRO HD3 . . 3.060 2.258 2.252 2.268 . 0 0 "[ . 1 . 2]" 1
2569 1 112 GLN HA 1 113 PRO HG3 . . 4.480 4.388 4.361 4.417 . 0 0 "[ . 1 . 2]" 1
2570 1 112 GLN HB2 1 113 PRO HD2 . . 4.020 3.459 3.341 3.573 . 0 0 "[ . 1 . 2]" 1
2571 1 112 GLN HB2 1 113 PRO HD3 . . 4.710 4.555 4.477 4.627 . 0 0 "[ . 1 . 2]" 1
2572 1 112 GLN HB3 1 113 PRO HD2 . . 3.820 2.346 2.223 2.478 . 0 0 "[ . 1 . 2]" 1
2573 1 112 GLN QE 1 112 GLN QG . . 3.040 2.206 2.155 2.226 . 0 0 "[ . 1 . 2]" 1
2574 1 113 PRO HA 1 114 GLU H . . 2.820 2.213 2.165 2.303 . 0 0 "[ . 1 . 2]" 1
2575 1 113 PRO HA 1 114 GLU QG . . 4.980 3.974 3.611 4.510 . 0 0 "[ . 1 . 2]" 1
2576 1 113 PRO QB 1 114 GLU H . . 3.960 3.671 3.541 3.815 . 0 0 "[ . 1 . 2]" 1
2577 1 113 PRO HD2 1 114 GLU H . . 5.500 5.333 5.125 5.467 . 0 0 "[ . 1 . 2]" 1
2578 1 113 PRO HD3 1 114 GLU H . . 5.500 5.405 5.274 5.490 . 0 0 "[ . 1 . 2]" 1
2579 1 114 GLU H 1 114 GLU HB2 . . 3.730 3.387 2.280 3.705 . 0 0 "[ . 1 . 2]" 1
2580 1 114 GLU H 1 114 GLU QB . . 3.070 2.643 2.254 2.883 . 0 0 "[ . 1 . 2]" 1
2581 1 114 GLU H 1 114 GLU HB3 . . 3.730 2.967 2.608 3.591 . 0 0 "[ . 1 . 2]" 1
2582 1 114 GLU H 1 114 GLU QG . . 3.260 2.103 1.872 2.615 . 0 0 "[ . 1 . 2]" 1
2583 1 114 GLU HA 1 114 GLU QG . . 3.440 3.170 2.160 3.456 0.016 10 0 "[ . 1 . 2]" 1
2584 1 114 GLU QG 1 115 SER QB . . 5.090 4.148 2.740 5.105 0.015 8 0 "[ . 1 . 2]" 1
2585 1 116 GLY QA 1 117 PRO QG . . 4.490 3.675 3.654 3.700 . 0 0 "[ . 1 . 2]" 1
2586 1 116 GLY HA2 1 117 PRO QD . . 3.060 2.310 1.938 2.676 . 0 0 "[ . 1 . 2]" 1
2587 1 116 GLY HA3 1 117 PRO QD . . 3.060 2.324 1.940 2.866 . 0 0 "[ . 1 . 2]" 1
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