NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
405148 |
1x4z   |
11127 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x4z
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 2695
_Distance_constraint_stats_list.Viol_count 1050
_Distance_constraint_stats_list.Viol_total 217.442
_Distance_constraint_stats_list.Viol_max 0.171
_Distance_constraint_stats_list.Viol_rms 0.0026
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0104
_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 9 GLN 0.022 0.022 8 0 "[ . 1 . 2]"
1 10 PRO 0.296 0.076 8 0 "[ . 1 . 2]"
1 11 ASP 0.274 0.076 8 0 "[ . 1 . 2]"
1 12 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLY 0.007 0.005 14 0 "[ . 1 . 2]"
1 14 ARG 0.563 0.171 18 0 "[ . 1 . 2]"
1 15 LEU 0.053 0.022 9 0 "[ . 1 . 2]"
1 16 SER 0.445 0.058 10 0 "[ . 1 . 2]"
1 17 PRO 0.300 0.018 14 0 "[ . 1 . 2]"
1 18 PRO 0.123 0.012 16 0 "[ . 1 . 2]"
1 19 GLU 0.095 0.015 14 0 "[ . 1 . 2]"
1 20 ALA 0.006 0.006 20 0 "[ . 1 . 2]"
1 21 PRO 0.076 0.009 16 0 "[ . 1 . 2]"
1 22 ASP 0.014 0.004 8 0 "[ . 1 . 2]"
1 23 ARG 0.143 0.018 19 0 "[ . 1 . 2]"
1 24 PRO 0.084 0.029 14 0 "[ . 1 . 2]"
1 25 THR 0.086 0.029 14 0 "[ . 1 . 2]"
1 26 ILE 0.051 0.025 14 0 "[ . 1 . 2]"
1 27 SER 0.007 0.004 7 0 "[ . 1 . 2]"
1 28 THR 0.026 0.005 6 0 "[ . 1 . 2]"
1 29 ALA 0.026 0.005 10 0 "[ . 1 . 2]"
1 30 SER 0.104 0.028 11 0 "[ . 1 . 2]"
1 31 GLU 0.106 0.028 11 0 "[ . 1 . 2]"
1 32 THR 0.158 0.018 13 0 "[ . 1 . 2]"
1 33 SER 0.200 0.018 13 0 "[ . 1 . 2]"
1 34 VAL 0.026 0.012 13 0 "[ . 1 . 2]"
1 35 TYR 0.117 0.022 2 0 "[ . 1 . 2]"
1 36 VAL 0.095 0.022 2 0 "[ . 1 . 2]"
1 37 THR 0.185 0.025 14 0 "[ . 1 . 2]"
1 38 TRP 0.138 0.016 19 0 "[ . 1 . 2]"
1 39 ILE 0.156 0.016 14 0 "[ . 1 . 2]"
1 40 PRO 0.145 0.016 14 0 "[ . 1 . 2]"
1 41 ARG 0.393 0.039 17 0 "[ . 1 . 2]"
1 42 GLY 0.283 0.025 17 0 "[ . 1 . 2]"
1 43 ASN 0.034 0.006 16 0 "[ . 1 . 2]"
1 44 GLY 0.111 0.012 14 0 "[ . 1 . 2]"
1 45 GLY 0.557 0.058 10 0 "[ . 1 . 2]"
1 46 PHE 0.202 0.024 13 0 "[ . 1 . 2]"
1 47 PRO 0.014 0.012 8 0 "[ . 1 . 2]"
1 48 ILE 0.046 0.012 8 0 "[ . 1 . 2]"
1 49 GLN 0.038 0.010 7 0 "[ . 1 . 2]"
1 50 SER 0.061 0.010 7 0 "[ . 1 . 2]"
1 51 PHE 0.055 0.025 11 0 "[ . 1 . 2]"
1 52 ARG 0.637 0.128 12 0 "[ . 1 . 2]"
1 53 VAL 0.165 0.036 11 0 "[ . 1 . 2]"
1 54 GLU 0.097 0.018 19 0 "[ . 1 . 2]"
1 55 TYR 0.061 0.010 5 0 "[ . 1 . 2]"
1 56 LYS 0.047 0.010 14 0 "[ . 1 . 2]"
1 57 LYS 0.081 0.017 13 0 "[ . 1 . 2]"
1 58 LEU 0.056 0.016 15 0 "[ . 1 . 2]"
1 59 LYS 0.181 0.094 9 0 "[ . 1 . 2]"
1 60 LYS 0.310 0.109 19 0 "[ . 1 . 2]"
1 61 VAL 0.031 0.019 5 0 "[ . 1 . 2]"
1 62 GLY 0.029 0.029 17 0 "[ . 1 . 2]"
1 63 ASP 0.127 0.032 17 0 "[ . 1 . 2]"
1 64 TRP 0.131 0.019 13 0 "[ . 1 . 2]"
1 65 ILE 0.081 0.019 14 0 "[ . 1 . 2]"
1 66 LEU 0.121 0.027 5 0 "[ . 1 . 2]"
1 67 ALA 0.054 0.009 5 0 "[ . 1 . 2]"
1 68 THR 0.008 0.005 11 0 "[ . 1 . 2]"
1 69 SER 0.017 0.008 11 0 "[ . 1 . 2]"
1 70 ALA 0.001 0.001 18 0 "[ . 1 . 2]"
1 71 ILE 0.094 0.025 11 0 "[ . 1 . 2]"
1 72 PRO 0.041 0.012 14 0 "[ . 1 . 2]"
1 73 PRO 0.028 0.008 11 0 "[ . 1 . 2]"
1 74 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ARG 0.051 0.012 14 0 "[ . 1 . 2]"
1 76 LEU 0.045 0.008 17 0 "[ . 1 . 2]"
1 77 SER 0.109 0.016 19 0 "[ . 1 . 2]"
1 78 VAL 0.111 0.016 19 0 "[ . 1 . 2]"
1 79 GLU 0.044 0.009 13 0 "[ . 1 . 2]"
1 80 ILE 0.020 0.007 17 0 "[ . 1 . 2]"
1 81 THR 0.059 0.012 13 0 "[ . 1 . 2]"
1 82 GLY 0.022 0.008 7 0 "[ . 1 . 2]"
1 83 LEU 0.062 0.019 10 0 "[ . 1 . 2]"
1 84 GLU 0.038 0.015 20 0 "[ . 1 . 2]"
1 85 LYS 0.540 0.051 8 0 "[ . 1 . 2]"
1 86 GLY 0.063 0.016 15 0 "[ . 1 . 2]"
1 87 ILE 0.936 0.051 8 0 "[ . 1 . 2]"
1 88 SER 0.933 0.046 3 0 "[ . 1 . 2]"
1 89 TYR 0.906 0.046 3 0 "[ . 1 . 2]"
1 90 LYS 0.133 0.058 14 0 "[ . 1 . 2]"
1 91 PHE 0.032 0.018 14 0 "[ . 1 . 2]"
1 92 ARG 0.235 0.048 13 0 "[ . 1 . 2]"
1 93 VAL 0.196 0.013 11 0 "[ . 1 . 2]"
1 94 ARG 0.835 0.067 14 0 "[ . 1 . 2]"
1 95 ALA 0.052 0.015 14 0 "[ . 1 . 2]"
1 96 LEU 0.058 0.008 7 0 "[ . 1 . 2]"
1 97 ASN 0.235 0.012 16 0 "[ . 1 . 2]"
1 98 MET 0.015 0.005 8 0 "[ . 1 . 2]"
1 99 LEU 0.132 0.017 15 0 "[ . 1 . 2]"
1 100 GLY 0.203 0.016 14 0 "[ . 1 . 2]"
1 101 GLU 0.232 0.031 19 0 "[ . 1 . 2]"
1 102 SER 0.297 0.022 14 0 "[ . 1 . 2]"
1 103 GLU 0.201 0.045 19 0 "[ . 1 . 2]"
1 104 PRO 0.125 0.045 19 0 "[ . 1 . 2]"
1 105 SER 1.248 0.073 15 0 "[ . 1 . 2]"
1 106 ALA 1.171 0.073 15 0 "[ . 1 . 2]"
1 107 PRO 0.085 0.058 14 0 "[ . 1 . 2]"
1 108 SER 0.065 0.047 19 0 "[ . 1 . 2]"
1 109 ARG 0.001 0.001 9 0 "[ . 1 . 2]"
1 110 PRO 0.034 0.009 14 0 "[ . 1 . 2]"
1 111 TYR 0.091 0.019 14 0 "[ . 1 . 2]"
1 112 VAL 0.411 0.030 17 0 "[ . 1 . 2]"
1 113 VAL 0.513 0.024 14 0 "[ . 1 . 2]"
1 114 SER 0.079 0.015 10 0 "[ . 1 . 2]"
1 115 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 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 9 GLN HA 1 10 PRO HD2 . . 3.000 2.271 2.138 2.416 . 0 0 "[ . 1 . 2]" 1
2 1 9 GLN HA 1 10 PRO HD3 . . 3.000 2.267 2.251 2.304 . 0 0 "[ . 1 . 2]" 1
3 1 9 GLN QB 1 10 PRO QD . . 3.260 2.362 1.983 3.246 . 0 0 "[ . 1 . 2]" 1
4 1 9 GLN QG 1 10 PRO HD2 . . 4.760 3.302 1.825 3.880 . 0 0 "[ . 1 . 2]" 1
5 1 9 GLN QG 1 10 PRO HD3 . . 4.760 4.238 3.136 4.782 0.022 8 0 "[ . 1 . 2]" 1
6 1 10 PRO HA 1 11 ASP H . . 3.210 2.519 2.153 3.286 0.076 8 0 "[ . 1 . 2]" 1
7 1 11 ASP H 1 11 ASP QB . . 3.510 2.544 2.184 3.252 . 0 0 "[ . 1 . 2]" 1
8 1 12 HIS HA 1 12 HIS HD2 . . 4.710 3.906 2.581 4.697 . 0 0 "[ . 1 . 2]" 1
9 1 13 GLY QA 1 14 ARG H . . 3.110 2.313 2.111 2.628 . 0 0 "[ . 1 . 2]" 1
10 1 13 GLY QA 1 14 ARG HA . . 4.240 4.002 3.934 4.121 . 0 0 "[ . 1 . 2]" 1
11 1 13 GLY QA 1 14 ARG HG2 . . 5.200 4.298 3.457 5.181 . 0 0 "[ . 1 . 2]" 1
12 1 13 GLY QA 1 14 ARG QG . . 4.480 3.827 3.401 4.285 . 0 0 "[ . 1 . 2]" 1
13 1 13 GLY QA 1 14 ARG HG3 . . 5.200 4.681 3.777 5.201 0.001 9 0 "[ . 1 . 2]" 1
14 1 13 GLY QA 1 15 LEU H . . 4.710 4.391 3.774 4.708 . 0 0 "[ . 1 . 2]" 1
15 1 13 GLY QA 1 15 LEU HB2 . . 5.500 5.286 4.851 5.505 0.005 14 0 "[ . 1 . 2]" 1
16 1 14 ARG H 1 14 ARG HB2 . . 3.690 2.554 2.248 3.607 . 0 0 "[ . 1 . 2]" 1
17 1 14 ARG H 1 14 ARG QB . . 3.210 2.436 2.224 2.791 . 0 0 "[ . 1 . 2]" 1
18 1 14 ARG H 1 14 ARG HB3 . . 3.690 3.512 2.836 3.619 . 0 0 "[ . 1 . 2]" 1
19 1 14 ARG H 1 14 ARG QD . . 4.580 3.888 1.844 4.565 . 0 0 "[ . 1 . 2]" 1
20 1 14 ARG H 1 14 ARG HG2 . . 3.780 2.768 2.104 3.751 . 0 0 "[ . 1 . 2]" 1
21 1 14 ARG H 1 14 ARG QG . . 3.190 2.355 2.022 2.775 . 0 0 "[ . 1 . 2]" 1
22 1 14 ARG H 1 14 ARG HG3 . . 3.780 2.975 2.305 3.583 . 0 0 "[ . 1 . 2]" 1
23 1 14 ARG HA 1 14 ARG QD . . 4.060 3.124 2.058 4.231 0.171 18 0 "[ . 1 . 2]" 1
24 1 14 ARG HA 1 14 ARG HG2 . . 3.830 2.766 2.209 3.871 0.041 16 0 "[ . 1 . 2]" 1
25 1 14 ARG HA 1 14 ARG QG . . 3.270 2.605 2.173 3.331 0.061 16 0 "[ . 1 . 2]" 1
26 1 14 ARG HA 1 14 ARG HG3 . . 3.830 3.493 2.575 3.826 . 0 0 "[ . 1 . 2]" 1
27 1 14 ARG HA 1 15 LEU H . . 2.550 2.259 2.166 2.527 . 0 0 "[ . 1 . 2]" 1
28 1 14 ARG HA 1 15 LEU HB2 . . 4.850 4.491 4.369 4.702 . 0 0 "[ . 1 . 2]" 1
29 1 14 ARG HA 1 15 LEU MD1 . . 5.380 5.202 5.012 5.384 0.004 9 0 "[ . 1 . 2]" 1
30 1 14 ARG QB 1 14 ARG QG . . 2.270 2.040 2.003 2.083 . 0 0 "[ . 1 . 2]" 1
31 1 14 ARG HB2 1 14 ARG QD . . 3.370 2.879 2.037 3.389 0.019 10 0 "[ . 1 . 2]" 1
32 1 14 ARG HB3 1 14 ARG QD . . 3.370 2.331 2.064 3.185 . 0 0 "[ . 1 . 2]" 1
33 1 14 ARG QD 1 15 LEU H . . 5.400 4.840 4.010 5.404 0.004 14 0 "[ . 1 . 2]" 1
34 1 15 LEU H 1 15 LEU HB2 . . 2.910 2.258 2.171 2.340 . 0 0 "[ . 1 . 2]" 1
35 1 15 LEU H 1 15 LEU HB3 . . 3.760 3.533 3.476 3.585 . 0 0 "[ . 1 . 2]" 1
36 1 15 LEU H 1 15 LEU MD1 . . 3.940 3.564 3.298 3.718 . 0 0 "[ . 1 . 2]" 1
37 1 15 LEU H 1 15 LEU MD2 . . 4.350 4.237 4.134 4.342 . 0 0 "[ . 1 . 2]" 1
38 1 15 LEU H 1 15 LEU HG . . 3.380 3.226 2.971 3.350 . 0 0 "[ . 1 . 2]" 1
39 1 15 LEU H 1 16 SER H . . 4.570 4.463 4.427 4.524 . 0 0 "[ . 1 . 2]" 1
40 1 15 LEU HB2 1 15 LEU MD1 . . 2.900 2.162 1.987 2.237 . 0 0 "[ . 1 . 2]" 1
41 1 15 LEU HB2 1 15 LEU MD2 . . 3.220 3.143 3.117 3.162 . 0 0 "[ . 1 . 2]" 1
42 1 15 LEU HB2 1 16 SER H . . 3.640 3.428 3.368 3.595 . 0 0 "[ . 1 . 2]" 1
43 1 15 LEU HB2 1 46 PHE QE . . 4.450 3.350 3.027 3.668 . 0 0 "[ . 1 . 2]" 1
44 1 15 LEU HB2 1 99 LEU MD1 . . 3.410 2.557 2.180 2.877 . 0 0 "[ . 1 . 2]" 1
45 1 15 LEU HB3 1 15 LEU MD1 . . 2.950 2.597 2.512 2.679 . 0 0 "[ . 1 . 2]" 1
46 1 15 LEU HB3 1 15 LEU MD2 . . 3.020 2.153 2.018 2.255 . 0 0 "[ . 1 . 2]" 1
47 1 15 LEU HB3 1 16 SER H . . 3.420 1.936 1.899 2.097 . 0 0 "[ . 1 . 2]" 1
48 1 15 LEU HB3 1 16 SER QB . . 5.340 4.561 4.335 4.839 . 0 0 "[ . 1 . 2]" 1
49 1 15 LEU HB3 1 46 PHE H . . 5.110 4.876 4.645 5.115 0.005 14 0 "[ . 1 . 2]" 1
50 1 15 LEU HB3 1 46 PHE QD . . 4.420 3.827 3.627 4.012 . 0 0 "[ . 1 . 2]" 1
51 1 15 LEU HB3 1 46 PHE QE . . 4.340 4.184 3.964 4.327 . 0 0 "[ . 1 . 2]" 1
52 1 15 LEU HB3 1 97 ASN HD22 . . 5.260 5.143 5.032 5.241 . 0 0 "[ . 1 . 2]" 1
53 1 15 LEU MD1 1 16 SER H . . 4.270 4.155 4.014 4.247 . 0 0 "[ . 1 . 2]" 1
54 1 15 LEU MD1 1 45 GLY HA2 . . 5.130 4.916 4.644 5.131 0.001 2 0 "[ . 1 . 2]" 1
55 1 15 LEU MD1 1 45 GLY HA3 . . 4.480 3.717 3.448 3.923 . 0 0 "[ . 1 . 2]" 1
56 1 15 LEU MD1 1 46 PHE QD . . 4.200 2.787 2.631 2.964 . 0 0 "[ . 1 . 2]" 1
57 1 15 LEU MD1 1 46 PHE QE . . 3.330 2.221 1.970 2.387 . 0 0 "[ . 1 . 2]" 1
58 1 15 LEU MD1 1 46 PHE HZ . . 3.810 2.689 2.531 2.819 . 0 0 "[ . 1 . 2]" 1
59 1 15 LEU MD2 1 16 SER H . . 3.270 2.603 2.375 2.925 . 0 0 "[ . 1 . 2]" 1
60 1 15 LEU MD2 1 45 GLY H . . 4.420 4.293 4.093 4.421 0.001 9 0 "[ . 1 . 2]" 1
61 1 15 LEU MD2 1 45 GLY HA2 . . 3.330 3.221 3.104 3.352 0.022 9 0 "[ . 1 . 2]" 1
62 1 15 LEU MD2 1 45 GLY HA3 . . 3.030 1.903 1.827 1.965 . 0 0 "[ . 1 . 2]" 1
63 1 15 LEU MD2 1 46 PHE H . . 4.040 3.758 3.352 3.992 . 0 0 "[ . 1 . 2]" 1
64 1 15 LEU MD2 1 46 PHE QD . . 4.540 4.012 3.664 4.192 . 0 0 "[ . 1 . 2]" 1
65 1 15 LEU MD2 1 46 PHE QE . . 4.650 4.281 4.110 4.484 . 0 0 "[ . 1 . 2]" 1
66 1 15 LEU HG 1 16 SER H . . 4.500 4.276 4.135 4.360 . 0 0 "[ . 1 . 2]" 1
67 1 16 SER H 1 16 SER HB2 . . 3.830 3.093 2.637 3.726 . 0 0 "[ . 1 . 2]" 1
68 1 16 SER H 1 16 SER QB . . 3.300 2.874 2.581 3.284 . 0 0 "[ . 1 . 2]" 1
69 1 16 SER H 1 16 SER HB3 . . 3.830 3.657 3.540 3.721 . 0 0 "[ . 1 . 2]" 1
70 1 16 SER H 1 44 GLY HA2 . . 4.400 4.250 4.138 4.323 . 0 0 "[ . 1 . 2]" 1
71 1 16 SER H 1 44 GLY HA3 . . 4.420 4.215 4.184 4.250 . 0 0 "[ . 1 . 2]" 1
72 1 16 SER H 1 45 GLY H . . 5.500 5.521 5.506 5.558 0.058 10 0 "[ . 1 . 2]" 1
73 1 16 SER H 1 45 GLY HA3 . . 4.420 3.992 3.952 4.061 . 0 0 "[ . 1 . 2]" 1
74 1 16 SER H 1 46 PHE H . . 5.500 5.191 5.108 5.339 . 0 0 "[ . 1 . 2]" 1
75 1 16 SER H 1 46 PHE QD . . 5.500 5.191 5.026 5.315 . 0 0 "[ . 1 . 2]" 1
76 1 16 SER H 1 97 ASN HD22 . . 5.220 5.191 5.094 5.231 0.011 9 0 "[ . 1 . 2]" 1
77 1 16 SER H 1 99 LEU MD1 . . 3.730 2.618 2.530 2.698 . 0 0 "[ . 1 . 2]" 1
78 1 16 SER HA 1 17 PRO HD2 . . 3.370 2.516 2.494 2.531 . 0 0 "[ . 1 . 2]" 1
79 1 16 SER HA 1 17 PRO HG3 . . 4.770 4.545 4.530 4.554 . 0 0 "[ . 1 . 2]" 1
80 1 16 SER HA 1 99 LEU HB3 . . 4.980 3.917 3.836 3.978 . 0 0 "[ . 1 . 2]" 1
81 1 16 SER HA 1 99 LEU MD1 . . 3.600 2.993 2.896 3.105 . 0 0 "[ . 1 . 2]" 1
82 1 16 SER HA 1 99 LEU MD2 . . 5.300 4.660 4.403 4.780 . 0 0 "[ . 1 . 2]" 1
83 1 16 SER QB 1 17 PRO HB3 . . 5.250 5.104 5.056 5.134 . 0 0 "[ . 1 . 2]" 1
84 1 16 SER QB 1 17 PRO HD2 . . 3.190 1.977 1.946 2.005 . 0 0 "[ . 1 . 2]" 1
85 1 16 SER QB 1 17 PRO HD3 . . 3.670 3.299 3.187 3.375 . 0 0 "[ . 1 . 2]" 1
86 1 16 SER QB 1 17 PRO HG3 . . 4.560 4.436 4.347 4.496 . 0 0 "[ . 1 . 2]" 1
87 1 16 SER QB 1 99 LEU MD1 . . 4.640 3.963 3.849 4.130 . 0 0 "[ . 1 . 2]" 1
88 1 17 PRO HA 1 18 PRO HD2 . . 3.710 2.568 2.549 2.576 . 0 0 "[ . 1 . 2]" 1
89 1 17 PRO HA 1 18 PRO HD3 . . 3.350 2.386 2.374 2.391 . 0 0 "[ . 1 . 2]" 1
90 1 17 PRO HA 1 97 ASN H . . 5.210 5.027 4.957 5.086 . 0 0 "[ . 1 . 2]" 1
91 1 17 PRO HA 1 97 ASN HD21 . . 4.210 3.850 3.766 3.933 . 0 0 "[ . 1 . 2]" 1
92 1 17 PRO HA 1 97 ASN HD22 . . 3.970 2.319 2.233 2.414 . 0 0 "[ . 1 . 2]" 1
93 1 17 PRO HA 1 99 LEU H . . 4.580 4.316 4.286 4.347 . 0 0 "[ . 1 . 2]" 1
94 1 17 PRO HA 1 99 LEU HB2 . . 4.350 2.071 2.035 2.151 . 0 0 "[ . 1 . 2]" 1
95 1 17 PRO HA 1 99 LEU HB3 . . 5.120 3.117 3.019 3.251 . 0 0 "[ . 1 . 2]" 1
96 1 17 PRO HA 1 99 LEU MD1 . . 3.800 2.893 2.839 2.977 . 0 0 "[ . 1 . 2]" 1
97 1 17 PRO HA 1 99 LEU MD2 . . 5.500 4.660 4.609 4.750 . 0 0 "[ . 1 . 2]" 1
98 1 17 PRO HA 1 99 LEU HG . . 4.500 4.068 3.956 4.148 . 0 0 "[ . 1 . 2]" 1
99 1 17 PRO HA 1 100 GLY H . . 4.250 4.063 4.003 4.138 . 0 0 "[ . 1 . 2]" 1
100 1 17 PRO HB2 1 18 PRO HD2 . . 4.060 2.004 1.986 2.046 . 0 0 "[ . 1 . 2]" 1
101 1 17 PRO HB2 1 18 PRO HD3 . . 3.720 3.453 3.438 3.489 . 0 0 "[ . 1 . 2]" 1
102 1 17 PRO HB2 1 100 GLY H . . 4.970 4.909 4.883 4.939 . 0 0 "[ . 1 . 2]" 1
103 1 17 PRO HB2 1 100 GLY HA2 . . 5.500 5.437 5.408 5.481 . 0 0 "[ . 1 . 2]" 1
104 1 17 PRO HB2 1 102 SER HA . . 4.350 3.645 3.585 3.754 . 0 0 "[ . 1 . 2]" 1
105 1 17 PRO HB3 1 18 PRO HD2 . . 4.320 2.690 2.683 2.710 . 0 0 "[ . 1 . 2]" 1
106 1 17 PRO HB3 1 100 GLY H . . 3.880 3.872 3.820 3.896 0.016 14 0 "[ . 1 . 2]" 1
107 1 17 PRO HB3 1 101 GLU H . . 4.350 4.237 4.112 4.350 0.000 14 0 "[ . 1 . 2]" 1
108 1 17 PRO HD2 1 99 LEU MD1 . . 4.580 4.447 4.383 4.508 . 0 0 "[ . 1 . 2]" 1
109 1 17 PRO HD3 1 99 LEU HB2 . . 5.270 4.276 4.150 4.356 . 0 0 "[ . 1 . 2]" 1
110 1 17 PRO HD3 1 99 LEU HB3 . . 4.440 3.505 3.417 3.576 . 0 0 "[ . 1 . 2]" 1
111 1 17 PRO HD3 1 99 LEU MD1 . . 3.970 3.804 3.702 3.896 . 0 0 "[ . 1 . 2]" 1
112 1 17 PRO HD3 1 99 LEU MD2 . . 5.500 5.090 4.901 5.210 . 0 0 "[ . 1 . 2]" 1
113 1 17 PRO HG2 1 100 GLY HA3 . . 5.500 5.505 5.487 5.515 0.015 15 0 "[ . 1 . 2]" 1
114 1 17 PRO HG3 1 99 LEU HB3 . . 5.020 4.904 4.816 4.979 . 0 0 "[ . 1 . 2]" 1
115 1 17 PRO HG3 1 100 GLY HA3 . . 4.470 4.316 4.281 4.342 . 0 0 "[ . 1 . 2]" 1
116 1 17 PRO HG3 1 102 SER HA . . 5.500 5.479 5.342 5.518 0.018 14 0 "[ . 1 . 2]" 1
117 1 18 PRO HA 1 19 GLU H . . 2.960 2.282 2.248 2.316 . 0 0 "[ . 1 . 2]" 1
118 1 18 PRO HA 1 19 GLU HA . . 4.880 4.372 4.364 4.381 . 0 0 "[ . 1 . 2]" 1
119 1 18 PRO HA 1 19 GLU QB . . 4.540 4.094 4.055 4.159 . 0 0 "[ . 1 . 2]" 1
120 1 18 PRO HA 1 43 ASN HA . . 3.890 2.792 2.622 2.907 . 0 0 "[ . 1 . 2]" 1
121 1 18 PRO HA 1 44 GLY H . . 3.830 2.688 2.404 2.856 . 0 0 "[ . 1 . 2]" 1
122 1 18 PRO HA 1 44 GLY HA2 . . 4.470 3.285 3.175 3.356 . 0 0 "[ . 1 . 2]" 1
123 1 18 PRO HA 1 44 GLY HA3 . . 4.080 2.861 2.790 2.919 . 0 0 "[ . 1 . 2]" 1
124 1 18 PRO HA 1 95 ALA MB . . 4.170 4.120 4.029 4.174 0.004 11 0 "[ . 1 . 2]" 1
125 1 18 PRO HA 1 102 SER HB3 . . 5.160 4.297 4.058 4.452 . 0 0 "[ . 1 . 2]" 1
126 1 18 PRO HB2 1 19 GLU H . . 3.430 2.947 2.844 3.057 . 0 0 "[ . 1 . 2]" 1
127 1 18 PRO HB2 1 44 GLY H . . 5.340 5.057 4.804 5.224 . 0 0 "[ . 1 . 2]" 1
128 1 18 PRO HB2 1 48 ILE HG12 . . 5.080 4.028 3.951 4.143 . 0 0 "[ . 1 . 2]" 1
129 1 18 PRO HB2 1 48 ILE MG . . 5.430 4.991 4.826 5.149 . 0 0 "[ . 1 . 2]" 1
130 1 18 PRO HB2 1 95 ALA MB . . 3.420 1.901 1.830 1.939 . 0 0 "[ . 1 . 2]" 1
131 1 18 PRO HB2 1 102 SER H . . 4.850 4.389 4.333 4.514 . 0 0 "[ . 1 . 2]" 1
132 1 18 PRO HB2 1 102 SER HA . . 4.950 4.417 4.198 4.892 . 0 0 "[ . 1 . 2]" 1
133 1 18 PRO HB2 1 102 SER HB2 . . 4.730 3.273 3.036 3.756 . 0 0 "[ . 1 . 2]" 1
134 1 18 PRO HB2 1 102 SER HB3 . . 4.430 2.255 2.182 2.474 . 0 0 "[ . 1 . 2]" 1
135 1 18 PRO HB3 1 19 GLU H . . 3.730 3.635 3.578 3.699 . 0 0 "[ . 1 . 2]" 1
136 1 18 PRO HB3 1 43 ASN HA . . 4.600 2.141 2.000 2.267 . 0 0 "[ . 1 . 2]" 1
137 1 18 PRO HB3 1 43 ASN HB3 . . 5.030 4.318 4.065 4.530 . 0 0 "[ . 1 . 2]" 1
138 1 18 PRO HB3 1 48 ILE HG12 . . 4.160 3.127 2.978 3.248 . 0 0 "[ . 1 . 2]" 1
139 1 18 PRO HB3 1 95 ALA MB . . 3.170 2.573 2.518 2.633 . 0 0 "[ . 1 . 2]" 1
140 1 18 PRO HB3 1 102 SER HB3 . . 4.120 3.827 3.768 3.966 . 0 0 "[ . 1 . 2]" 1
141 1 18 PRO HD2 1 95 ALA MB . . 4.580 4.487 4.353 4.567 . 0 0 "[ . 1 . 2]" 1
142 1 18 PRO HD2 1 97 ASN H . . 3.890 3.608 3.550 3.660 . 0 0 "[ . 1 . 2]" 1
143 1 18 PRO HD2 1 97 ASN HD22 . . 4.700 3.881 3.805 4.001 . 0 0 "[ . 1 . 2]" 1
144 1 18 PRO HD2 1 100 GLY H . . 4.860 3.848 3.791 3.902 . 0 0 "[ . 1 . 2]" 1
145 1 18 PRO HD2 1 102 SER H . . 4.440 4.331 4.267 4.367 . 0 0 "[ . 1 . 2]" 1
146 1 18 PRO HD2 1 102 SER HA . . 4.650 4.024 3.881 4.277 . 0 0 "[ . 1 . 2]" 1
147 1 18 PRO HD3 1 46 PHE H . . 5.500 5.385 5.237 5.479 . 0 0 "[ . 1 . 2]" 1
148 1 18 PRO HD3 1 97 ASN H . . 3.730 3.328 3.196 3.391 . 0 0 "[ . 1 . 2]" 1
149 1 18 PRO HD3 1 97 ASN HD21 . . 4.570 3.073 2.974 3.174 . 0 0 "[ . 1 . 2]" 1
150 1 18 PRO HD3 1 97 ASN HD22 . . 4.530 2.553 2.474 2.659 . 0 0 "[ . 1 . 2]" 1
151 1 18 PRO HD3 1 99 LEU HB2 . . 5.430 3.279 3.204 3.383 . 0 0 "[ . 1 . 2]" 1
152 1 18 PRO HD3 1 102 SER H . . 5.500 5.499 5.468 5.510 0.010 16 0 "[ . 1 . 2]" 1
153 1 18 PRO HG2 1 97 ASN H . . 4.110 4.022 3.940 4.072 . 0 0 "[ . 1 . 2]" 1
154 1 18 PRO HG2 1 97 ASN HB3 . . 4.740 4.729 4.646 4.752 0.012 16 0 "[ . 1 . 2]" 1
155 1 18 PRO HG2 1 102 SER H . . 3.840 2.769 2.730 2.823 . 0 0 "[ . 1 . 2]" 1
156 1 18 PRO HG3 1 97 ASN HB2 . . 4.740 4.671 4.630 4.699 . 0 0 "[ . 1 . 2]" 1
157 1 18 PRO HG3 1 97 ASN HB3 . . 4.620 3.015 2.946 3.039 . 0 0 "[ . 1 . 2]" 1
158 1 18 PRO HG3 1 97 ASN HD21 . . 4.800 4.561 4.476 4.665 . 0 0 "[ . 1 . 2]" 1
159 1 18 PRO HG3 1 97 ASN HD22 . . 5.170 4.671 4.590 4.778 . 0 0 "[ . 1 . 2]" 1
160 1 19 GLU H 1 19 GLU QB . . 3.050 2.508 2.418 2.593 . 0 0 "[ . 1 . 2]" 1
161 1 19 GLU H 1 19 GLU QG . . 3.200 2.471 2.329 2.552 . 0 0 "[ . 1 . 2]" 1
162 1 19 GLU H 1 20 ALA H . . 4.650 4.537 4.512 4.567 . 0 0 "[ . 1 . 2]" 1
163 1 19 GLU H 1 42 GLY H . . 4.370 3.898 3.804 3.957 . 0 0 "[ . 1 . 2]" 1
164 1 19 GLU H 1 43 ASN HA . . 3.960 3.625 3.416 3.764 . 0 0 "[ . 1 . 2]" 1
165 1 19 GLU H 1 44 GLY H . . 3.750 3.635 3.330 3.755 0.005 11 0 "[ . 1 . 2]" 1
166 1 19 GLU H 1 44 GLY HA2 . . 4.830 4.684 4.561 4.778 . 0 0 "[ . 1 . 2]" 1
167 1 19 GLU H 1 44 GLY HA3 . . 5.140 4.915 4.841 4.977 . 0 0 "[ . 1 . 2]" 1
168 1 19 GLU H 1 48 ILE MD . . 5.480 5.320 5.112 5.468 . 0 0 "[ . 1 . 2]" 1
169 1 19 GLU H 1 95 ALA MB . . 4.110 4.056 3.862 4.125 0.015 14 0 "[ . 1 . 2]" 1
170 1 19 GLU HA 1 19 GLU QG . . 3.440 3.288 3.269 3.316 . 0 0 "[ . 1 . 2]" 1
171 1 19 GLU HA 1 20 ALA H . . 2.640 2.459 2.369 2.534 . 0 0 "[ . 1 . 2]" 1
172 1 19 GLU HA 1 20 ALA HA . . 4.590 4.302 4.297 4.309 . 0 0 "[ . 1 . 2]" 1
173 1 19 GLU HA 1 20 ALA MB . . 4.310 4.155 4.107 4.203 . 0 0 "[ . 1 . 2]" 1
174 1 19 GLU HA 1 103 GLU H . . 3.890 3.154 2.924 3.565 . 0 0 "[ . 1 . 2]" 1
175 1 19 GLU QB 1 20 ALA H . . 3.190 2.485 2.356 2.632 . 0 0 "[ . 1 . 2]" 1
176 1 19 GLU QB 1 20 ALA MB . . 4.050 3.968 3.864 4.056 0.006 20 0 "[ . 1 . 2]" 1
177 1 19 GLU QB 1 42 GLY H . . 4.110 4.074 3.935 4.122 0.012 15 0 "[ . 1 . 2]" 1
178 1 19 GLU QB 1 42 GLY HA2 . . 5.320 5.045 4.910 5.194 . 0 0 "[ . 1 . 2]" 1
179 1 19 GLU QB 1 42 GLY HA3 . . 4.390 3.424 3.285 3.579 . 0 0 "[ . 1 . 2]" 1
180 1 19 GLU QB 1 43 ASN H . . 5.500 5.455 5.284 5.505 0.005 2 0 "[ . 1 . 2]" 1
181 1 19 GLU QG 1 20 ALA H . . 3.530 2.827 2.555 3.079 . 0 0 "[ . 1 . 2]" 1
182 1 19 GLU QG 1 20 ALA MB . . 4.320 3.712 3.528 4.019 . 0 0 "[ . 1 . 2]" 1
183 1 19 GLU QG 1 41 ARG H . . 3.970 3.761 3.696 3.859 . 0 0 "[ . 1 . 2]" 1
184 1 19 GLU QG 1 41 ARG HB2 . . 4.680 2.919 2.774 3.025 . 0 0 "[ . 1 . 2]" 1
185 1 19 GLU QG 1 41 ARG HG2 . . 4.620 3.910 3.675 4.047 . 0 0 "[ . 1 . 2]" 1
186 1 19 GLU QG 1 42 GLY H . . 3.950 2.029 1.921 2.113 . 0 0 "[ . 1 . 2]" 1
187 1 19 GLU QG 1 42 GLY HA2 . . 4.750 3.900 3.639 4.110 . 0 0 "[ . 1 . 2]" 1
188 1 19 GLU QG 1 42 GLY HA3 . . 4.420 2.508 2.150 2.765 . 0 0 "[ . 1 . 2]" 1
189 1 19 GLU QG 1 44 GLY H . . 5.030 4.785 4.456 4.979 . 0 0 "[ . 1 . 2]" 1
190 1 20 ALA H 1 20 ALA MB . . 2.710 2.157 2.038 2.242 . 0 0 "[ . 1 . 2]" 1
191 1 20 ALA H 1 21 PRO HD2 . . 4.870 4.758 4.736 4.777 . 0 0 "[ . 1 . 2]" 1
192 1 20 ALA H 1 21 PRO HD3 . . 5.120 4.677 4.648 4.708 . 0 0 "[ . 1 . 2]" 1
193 1 20 ALA H 1 102 SER HG . . 4.560 3.866 3.679 4.140 . 0 0 "[ . 1 . 2]" 1
194 1 20 ALA HA 1 21 PRO HD2 . . 3.450 2.001 1.991 2.017 . 0 0 "[ . 1 . 2]" 1
195 1 20 ALA HA 1 21 PRO HD3 . . 3.570 2.305 2.295 2.316 . 0 0 "[ . 1 . 2]" 1
196 1 20 ALA HA 1 95 ALA MB . . 4.480 4.353 4.227 4.450 . 0 0 "[ . 1 . 2]" 1
197 1 20 ALA HA 1 102 SER HB2 . . 4.330 3.281 3.136 3.414 . 0 0 "[ . 1 . 2]" 1
198 1 20 ALA HA 1 102 SER HB3 . . 5.000 4.406 4.282 4.493 . 0 0 "[ . 1 . 2]" 1
199 1 20 ALA HA 1 102 SER HG . . 4.230 2.069 1.994 2.430 . 0 0 "[ . 1 . 2]" 1
200 1 20 ALA HA 1 105 SER HB3 . . 4.610 4.056 3.792 4.228 . 0 0 "[ . 1 . 2]" 1
201 1 20 ALA MB 1 21 PRO HD2 . . 3.720 2.904 2.837 2.973 . 0 0 "[ . 1 . 2]" 1
202 1 20 ALA MB 1 21 PRO HD3 . . 4.120 3.839 3.819 3.859 . 0 0 "[ . 1 . 2]" 1
203 1 20 ALA MB 1 102 SER HB2 . . 4.540 4.146 3.890 4.281 . 0 0 "[ . 1 . 2]" 1
204 1 20 ALA MB 1 102 SER HG . . 4.080 3.441 3.226 3.672 . 0 0 "[ . 1 . 2]" 1
205 1 20 ALA MB 1 103 GLU H . . 4.070 3.247 3.049 3.346 . 0 0 "[ . 1 . 2]" 1
206 1 20 ALA MB 1 103 GLU HA . . 4.480 4.035 3.778 4.209 . 0 0 "[ . 1 . 2]" 1
207 1 20 ALA MB 1 103 GLU HB2 . . 3.390 2.148 2.002 2.369 . 0 0 "[ . 1 . 2]" 1
208 1 20 ALA MB 1 103 GLU HB3 . . 3.760 2.571 2.301 2.966 . 0 0 "[ . 1 . 2]" 1
209 1 20 ALA MB 1 103 GLU HG3 . . 4.760 4.375 4.181 4.733 . 0 0 "[ . 1 . 2]" 1
210 1 20 ALA MB 1 105 SER H . . 3.560 3.341 3.070 3.547 . 0 0 "[ . 1 . 2]" 1
211 1 20 ALA MB 1 105 SER HA . . 2.820 2.174 2.020 2.436 . 0 0 "[ . 1 . 2]" 1
212 1 20 ALA MB 1 105 SER HB2 . . 4.000 3.788 3.641 4.000 0.000 2 0 "[ . 1 . 2]" 1
213 1 20 ALA MB 1 105 SER HB3 . . 3.840 3.518 3.193 3.736 . 0 0 "[ . 1 . 2]" 1
214 1 20 ALA MB 1 106 ALA H . . 4.130 3.822 3.688 4.011 . 0 0 "[ . 1 . 2]" 1
215 1 21 PRO HA 1 22 ASP H . . 2.990 2.350 2.327 2.382 . 0 0 "[ . 1 . 2]" 1
216 1 21 PRO HA 1 41 ARG H . . 3.080 2.594 2.376 2.743 . 0 0 "[ . 1 . 2]" 1
217 1 21 PRO HA 1 41 ARG HB2 . . 4.650 4.150 3.967 4.222 . 0 0 "[ . 1 . 2]" 1
218 1 21 PRO HA 1 41 ARG HB3 . . 5.290 5.255 5.113 5.298 0.008 17 0 "[ . 1 . 2]" 1
219 1 21 PRO HA 1 41 ARG HD3 . . 4.310 3.938 3.680 4.307 . 0 0 "[ . 1 . 2]" 1
220 1 21 PRO HA 1 41 ARG HG2 . . 3.930 2.408 2.285 2.546 . 0 0 "[ . 1 . 2]" 1
221 1 21 PRO HA 1 41 ARG HG3 . . 4.010 3.916 3.771 4.014 0.004 15 0 "[ . 1 . 2]" 1
222 1 21 PRO HA 1 42 GLY H . . 4.870 4.283 4.181 4.364 . 0 0 "[ . 1 . 2]" 1
223 1 21 PRO HB2 1 22 ASP H . . 3.560 2.743 2.659 2.806 . 0 0 "[ . 1 . 2]" 1
224 1 21 PRO HB2 1 38 TRP HB2 . . 4.520 3.222 3.132 3.298 . 0 0 "[ . 1 . 2]" 1
225 1 21 PRO HB2 1 38 TRP HD1 . . 3.800 2.616 2.466 2.794 . 0 0 "[ . 1 . 2]" 1
226 1 21 PRO HB2 1 39 ILE H . . 4.410 3.678 3.595 3.776 . 0 0 "[ . 1 . 2]" 1
227 1 21 PRO HB2 1 40 PRO HA . . 3.970 2.995 2.822 3.162 . 0 0 "[ . 1 . 2]" 1
228 1 21 PRO HB2 1 93 VAL HB . . 4.400 3.378 3.271 3.558 . 0 0 "[ . 1 . 2]" 1
229 1 21 PRO HB2 1 93 VAL MG1 . . 4.050 3.267 3.110 3.404 . 0 0 "[ . 1 . 2]" 1
230 1 21 PRO HB2 1 93 VAL MG2 . . 4.450 4.297 4.208 4.375 . 0 0 "[ . 1 . 2]" 1
231 1 21 PRO HB3 1 22 ASP H . . 4.190 3.521 3.476 3.556 . 0 0 "[ . 1 . 2]" 1
232 1 21 PRO HB3 1 38 TRP HD1 . . 4.380 3.230 3.082 3.326 . 0 0 "[ . 1 . 2]" 1
233 1 21 PRO HB3 1 41 ARG H . . 3.770 3.510 3.361 3.654 . 0 0 "[ . 1 . 2]" 1
234 1 21 PRO HB3 1 93 VAL HB . . 4.680 4.400 4.301 4.555 . 0 0 "[ . 1 . 2]" 1
235 1 21 PRO HB3 1 93 VAL MG1 . . 3.780 3.533 3.322 3.644 . 0 0 "[ . 1 . 2]" 1
236 1 21 PRO HB3 1 93 VAL MG2 . . 5.330 5.278 5.188 5.333 0.003 17 0 "[ . 1 . 2]" 1
237 1 21 PRO HB3 1 105 SER HB3 . . 4.930 4.917 4.752 4.939 0.009 16 0 "[ . 1 . 2]" 1
238 1 21 PRO HD2 1 93 VAL HB . . 4.720 4.140 3.990 4.261 . 0 0 "[ . 1 . 2]" 1
239 1 21 PRO HD2 1 93 VAL MG1 . . 4.450 4.085 3.895 4.209 . 0 0 "[ . 1 . 2]" 1
240 1 21 PRO HD2 1 94 ARG HA . . 4.430 3.133 3.006 3.255 . 0 0 "[ . 1 . 2]" 1
241 1 21 PRO HD2 1 95 ALA H . . 4.400 4.032 3.792 4.172 . 0 0 "[ . 1 . 2]" 1
242 1 21 PRO HD2 1 95 ALA MB . . 4.600 4.402 4.305 4.516 . 0 0 "[ . 1 . 2]" 1
243 1 21 PRO HD2 1 105 SER H . . 4.060 3.066 2.921 3.188 . 0 0 "[ . 1 . 2]" 1
244 1 21 PRO HD3 1 93 VAL MG1 . . 4.180 3.982 3.831 4.103 . 0 0 "[ . 1 . 2]" 1
245 1 21 PRO HD3 1 95 ALA H . . 3.930 3.135 2.883 3.280 . 0 0 "[ . 1 . 2]" 1
246 1 21 PRO HD3 1 95 ALA MB . . 3.900 2.956 2.851 3.076 . 0 0 "[ . 1 . 2]" 1
247 1 21 PRO HD3 1 102 SER HG . . 4.690 2.528 2.021 2.943 . 0 0 "[ . 1 . 2]" 1
248 1 21 PRO HD3 1 105 SER H . . 5.500 4.722 4.582 4.831 . 0 0 "[ . 1 . 2]" 1
249 1 21 PRO HG2 1 24 PRO HD3 . . 5.010 4.451 4.410 4.498 . 0 0 "[ . 1 . 2]" 1
250 1 21 PRO HG2 1 93 VAL HB . . 4.060 2.135 2.001 2.240 . 0 0 "[ . 1 . 2]" 1
251 1 21 PRO HG2 1 93 VAL MG1 . . 3.410 2.842 2.729 2.934 . 0 0 "[ . 1 . 2]" 1
252 1 21 PRO HG2 1 93 VAL MG2 . . 3.980 3.818 3.700 3.898 . 0 0 "[ . 1 . 2]" 1
253 1 21 PRO HG2 1 105 SER H . . 4.410 3.999 3.810 4.214 . 0 0 "[ . 1 . 2]" 1
254 1 21 PRO HG3 1 51 PHE HD1 . . 4.740 3.847 3.710 4.067 . 0 0 "[ . 1 . 2]" 1
255 1 21 PRO HG3 1 93 VAL HB . . 4.310 2.880 2.797 2.950 . 0 0 "[ . 1 . 2]" 1
256 1 21 PRO HG3 1 93 VAL MG1 . . 3.660 2.114 1.973 2.247 . 0 0 "[ . 1 . 2]" 1
257 1 22 ASP H 1 22 ASP HB2 . . 3.080 2.203 2.179 2.278 . 0 0 "[ . 1 . 2]" 1
258 1 22 ASP H 1 22 ASP HB3 . . 3.240 2.933 2.822 2.968 . 0 0 "[ . 1 . 2]" 1
259 1 22 ASP H 1 23 ARG H . . 4.650 4.614 4.599 4.627 . 0 0 "[ . 1 . 2]" 1
260 1 22 ASP H 1 38 TRP HD1 . . 4.890 4.542 4.423 4.683 . 0 0 "[ . 1 . 2]" 1
261 1 22 ASP H 1 39 ILE H . . 4.130 3.506 3.401 3.619 . 0 0 "[ . 1 . 2]" 1
262 1 22 ASP H 1 39 ILE HB . . 4.370 3.852 3.778 3.906 . 0 0 "[ . 1 . 2]" 1
263 1 22 ASP H 1 39 ILE MG . . 4.440 4.401 4.319 4.443 0.003 19 0 "[ . 1 . 2]" 1
264 1 22 ASP H 1 40 PRO HB3 . . 5.490 5.354 5.267 5.433 . 0 0 "[ . 1 . 2]" 1
265 1 22 ASP H 1 41 ARG H . . 4.280 3.731 3.474 3.939 . 0 0 "[ . 1 . 2]" 1
266 1 22 ASP H 1 41 ARG HA . . 5.460 5.362 5.151 5.461 0.001 8 0 "[ . 1 . 2]" 1
267 1 22 ASP H 1 41 ARG HD2 . . 4.830 4.088 3.769 4.777 . 0 0 "[ . 1 . 2]" 1
268 1 22 ASP H 1 41 ARG HD3 . . 4.600 2.649 2.382 3.282 . 0 0 "[ . 1 . 2]" 1
269 1 22 ASP H 1 41 ARG HG2 . . 3.420 2.724 2.544 2.868 . 0 0 "[ . 1 . 2]" 1
270 1 22 ASP H 1 41 ARG HG3 . . 4.040 3.888 3.771 4.028 . 0 0 "[ . 1 . 2]" 1
271 1 22 ASP HA 1 23 ARG H . . 2.580 2.533 2.502 2.567 . 0 0 "[ . 1 . 2]" 1
272 1 22 ASP HA 1 39 ILE H . . 5.130 4.845 4.767 4.909 . 0 0 "[ . 1 . 2]" 1
273 1 22 ASP HA 1 39 ILE HB . . 5.020 4.897 4.843 4.961 . 0 0 "[ . 1 . 2]" 1
274 1 22 ASP HA 1 41 ARG HD3 . . 4.780 3.936 3.521 4.732 . 0 0 "[ . 1 . 2]" 1
275 1 22 ASP HB2 1 23 ARG H . . 3.980 3.817 3.757 3.864 . 0 0 "[ . 1 . 2]" 1
276 1 22 ASP HB2 1 39 ILE H . . 3.760 3.411 3.293 3.639 . 0 0 "[ . 1 . 2]" 1
277 1 22 ASP HB2 1 39 ILE HB . . 3.400 2.385 2.321 2.464 . 0 0 "[ . 1 . 2]" 1
278 1 22 ASP HB2 1 39 ILE MD . . 5.360 5.153 5.104 5.235 . 0 0 "[ . 1 . 2]" 1
279 1 22 ASP HB2 1 39 ILE HG12 . . 4.860 4.507 4.361 4.674 . 0 0 "[ . 1 . 2]" 1
280 1 22 ASP HB2 1 39 ILE HG13 . . 4.570 4.548 4.501 4.574 0.004 8 0 "[ . 1 . 2]" 1
281 1 22 ASP HB2 1 39 ILE MG . . 3.980 3.471 3.390 3.566 . 0 0 "[ . 1 . 2]" 1
282 1 22 ASP HB2 1 41 ARG HD2 . . 4.480 3.835 3.585 4.291 . 0 0 "[ . 1 . 2]" 1
283 1 22 ASP HB2 1 41 ARG HD3 . . 4.340 2.247 1.995 2.936 . 0 0 "[ . 1 . 2]" 1
284 1 22 ASP HB2 1 41 ARG HG2 . . 4.520 3.784 3.561 3.912 . 0 0 "[ . 1 . 2]" 1
285 1 22 ASP HB2 1 41 ARG HG3 . . 4.460 4.227 4.077 4.391 . 0 0 "[ . 1 . 2]" 1
286 1 22 ASP HB3 1 23 ARG H . . 3.370 2.987 2.878 3.149 . 0 0 "[ . 1 . 2]" 1
287 1 22 ASP HB3 1 39 ILE H . . 3.400 2.340 2.152 2.453 . 0 0 "[ . 1 . 2]" 1
288 1 22 ASP HB3 1 39 ILE HA . . 5.220 4.549 4.422 4.637 . 0 0 "[ . 1 . 2]" 1
289 1 22 ASP HB3 1 39 ILE HB . . 3.360 2.482 2.324 2.610 . 0 0 "[ . 1 . 2]" 1
290 1 22 ASP HB3 1 39 ILE MD . . 4.900 4.798 4.716 4.889 . 0 0 "[ . 1 . 2]" 1
291 1 22 ASP HB3 1 39 ILE HG12 . . 5.050 3.567 3.451 3.710 . 0 0 "[ . 1 . 2]" 1
292 1 22 ASP HB3 1 39 ILE HG13 . . 4.360 4.112 3.966 4.215 . 0 0 "[ . 1 . 2]" 1
293 1 22 ASP HB3 1 39 ILE MG . . 4.360 4.078 3.930 4.190 . 0 0 "[ . 1 . 2]" 1
294 1 22 ASP HB3 1 41 ARG HG2 . . 5.500 5.254 5.025 5.380 . 0 0 "[ . 1 . 2]" 1
295 1 23 ARG H 1 23 ARG HB2 . . 3.500 2.587 2.386 2.932 . 0 0 "[ . 1 . 2]" 1
296 1 23 ARG H 1 23 ARG QB . . 2.870 2.265 2.185 2.286 . 0 0 "[ . 1 . 2]" 1
297 1 23 ARG H 1 23 ARG HB3 . . 3.500 2.553 2.254 2.756 . 0 0 "[ . 1 . 2]" 1
298 1 23 ARG H 1 23 ARG QD . . 4.580 4.511 4.257 4.587 0.007 19 0 "[ . 1 . 2]" 1
299 1 23 ARG H 1 23 ARG HG2 . . 4.770 4.454 4.170 4.605 . 0 0 "[ . 1 . 2]" 1
300 1 23 ARG H 1 23 ARG QG . . 4.050 3.972 3.876 3.993 . 0 0 "[ . 1 . 2]" 1
301 1 23 ARG H 1 23 ARG HG3 . . 4.770 4.475 4.337 4.608 . 0 0 "[ . 1 . 2]" 1
302 1 23 ARG H 1 24 PRO HD2 . . 5.180 4.798 4.793 4.807 . 0 0 "[ . 1 . 2]" 1
303 1 23 ARG H 1 105 SER HB2 . . 5.500 4.980 4.562 5.143 . 0 0 "[ . 1 . 2]" 1
304 1 23 ARG H 1 106 ALA H . . 5.330 5.310 5.215 5.338 0.008 19 0 "[ . 1 . 2]" 1
305 1 23 ARG H 1 106 ALA MB . . 4.400 4.363 4.244 4.407 0.007 3 0 "[ . 1 . 2]" 1
306 1 23 ARG HA 1 23 ARG HG2 . . 4.050 3.044 2.772 3.339 . 0 0 "[ . 1 . 2]" 1
307 1 23 ARG HA 1 23 ARG QG . . 3.510 2.426 2.226 2.690 . 0 0 "[ . 1 . 2]" 1
308 1 23 ARG HA 1 23 ARG HG3 . . 4.050 2.565 2.283 2.869 . 0 0 "[ . 1 . 2]" 1
309 1 23 ARG HA 1 24 PRO HD2 . . 3.460 2.013 2.003 2.024 . 0 0 "[ . 1 . 2]" 1
310 1 23 ARG HA 1 24 PRO HD3 . . 3.550 2.295 2.289 2.302 . 0 0 "[ . 1 . 2]" 1
311 1 23 ARG HA 1 24 PRO HG2 . . 4.710 4.204 4.197 4.213 . 0 0 "[ . 1 . 2]" 1
312 1 23 ARG HA 1 93 VAL HB . . 5.500 5.491 5.327 5.510 0.010 15 0 "[ . 1 . 2]" 1
313 1 23 ARG HA 1 93 VAL MG2 . . 4.970 4.909 4.662 4.974 0.004 20 0 "[ . 1 . 2]" 1
314 1 23 ARG HA 1 105 SER HB2 . . 3.680 3.347 3.038 3.497 . 0 0 "[ . 1 . 2]" 1
315 1 23 ARG HA 1 106 ALA MB . . 4.790 3.469 3.323 3.577 . 0 0 "[ . 1 . 2]" 1
316 1 23 ARG QB 1 23 ARG QD . . 2.870 2.158 2.068 2.271 . 0 0 "[ . 1 . 2]" 1
317 1 23 ARG QB 1 24 PRO HD2 . . 4.320 3.612 3.457 3.666 . 0 0 "[ . 1 . 2]" 1
318 1 23 ARG QB 1 106 ALA MB . . 3.910 2.610 2.398 2.871 . 0 0 "[ . 1 . 2]" 1
319 1 23 ARG QB 1 108 SER HA . . 4.490 4.258 4.051 4.409 . 0 0 "[ . 1 . 2]" 1
320 1 23 ARG QB 1 108 SER QB . . 4.650 4.450 4.174 4.668 0.018 19 0 "[ . 1 . 2]" 1
321 1 23 ARG HB2 1 23 ARG HD2 . . 4.210 3.185 2.400 3.638 . 0 0 "[ . 1 . 2]" 1
322 1 23 ARG HB2 1 23 ARG HD3 . . 4.210 2.997 2.156 3.857 . 0 0 "[ . 1 . 2]" 1
323 1 23 ARG HB3 1 23 ARG HD2 . . 4.210 3.097 2.175 3.896 . 0 0 "[ . 1 . 2]" 1
324 1 23 ARG HB3 1 23 ARG HD3 . . 4.210 3.095 2.223 3.561 . 0 0 "[ . 1 . 2]" 1
325 1 23 ARG QD 1 106 ALA MB . . 3.690 2.968 2.026 3.699 0.009 14 0 "[ . 1 . 2]" 1
326 1 23 ARG QD 1 108 SER HA . . 3.920 2.128 1.985 2.619 . 0 0 "[ . 1 . 2]" 1
327 1 23 ARG QD 1 108 SER QB . . 4.240 3.514 3.015 4.069 . 0 0 "[ . 1 . 2]" 1
328 1 23 ARG QD 1 109 ARG H . . 4.110 3.339 2.657 3.805 . 0 0 "[ . 1 . 2]" 1
329 1 23 ARG HD2 1 106 ALA MB . . 4.300 3.454 2.536 4.155 . 0 0 "[ . 1 . 2]" 1
330 1 23 ARG HD2 1 108 SER HA . . 4.560 2.837 1.996 3.867 . 0 0 "[ . 1 . 2]" 1
331 1 23 ARG HD3 1 106 ALA MB . . 4.300 3.348 2.068 4.304 0.004 16 0 "[ . 1 . 2]" 1
332 1 23 ARG HD3 1 108 SER HA . . 4.560 3.023 1.994 4.067 . 0 0 "[ . 1 . 2]" 1
333 1 23 ARG QG 1 24 PRO HD2 . . 3.740 2.328 2.137 2.549 . 0 0 "[ . 1 . 2]" 1
334 1 23 ARG QG 1 24 PRO HD3 . . 5.180 3.684 3.600 3.872 . 0 0 "[ . 1 . 2]" 1
335 1 23 ARG QG 1 24 PRO HG2 . . 4.050 3.611 3.532 3.726 . 0 0 "[ . 1 . 2]" 1
336 1 23 ARG QG 1 106 ALA MB . . 3.630 2.557 2.073 3.343 . 0 0 "[ . 1 . 2]" 1
337 1 23 ARG QG 1 108 SER H . . 4.590 3.208 3.049 3.380 . 0 0 "[ . 1 . 2]" 1
338 1 23 ARG HG2 1 24 PRO HD2 . . 4.250 2.887 2.497 3.367 . 0 0 "[ . 1 . 2]" 1
339 1 23 ARG HG2 1 24 PRO HG2 . . 4.900 4.003 3.713 4.414 . 0 0 "[ . 1 . 2]" 1
340 1 23 ARG HG2 1 108 SER HA . . 3.950 2.685 2.338 3.305 . 0 0 "[ . 1 . 2]" 1
341 1 23 ARG HG3 1 24 PRO HD2 . . 4.250 2.521 2.167 2.819 . 0 0 "[ . 1 . 2]" 1
342 1 23 ARG HG3 1 24 PRO HG2 . . 4.900 4.220 3.808 4.645 . 0 0 "[ . 1 . 2]" 1
343 1 23 ARG HG3 1 108 SER HA . . 3.950 2.720 2.190 3.109 . 0 0 "[ . 1 . 2]" 1
344 1 24 PRO HA 1 25 THR H . . 2.820 2.202 2.188 2.223 . 0 0 "[ . 1 . 2]" 1
345 1 24 PRO HA 1 25 THR HB . . 4.610 4.369 4.316 4.451 . 0 0 "[ . 1 . 2]" 1
346 1 24 PRO HA 1 25 THR MG . . 4.230 4.054 3.878 4.181 . 0 0 "[ . 1 . 2]" 1
347 1 24 PRO HA 1 36 VAL MG1 . . 3.860 3.454 3.345 3.617 . 0 0 "[ . 1 . 2]" 1
348 1 24 PRO HA 1 37 THR H . . 4.130 4.019 3.931 4.143 0.013 14 0 "[ . 1 . 2]" 1
349 1 24 PRO HA 1 37 THR HB . . 5.250 5.001 4.898 5.084 . 0 0 "[ . 1 . 2]" 1
350 1 24 PRO HA 1 38 TRP HB2 . . 4.320 3.528 3.450 3.564 . 0 0 "[ . 1 . 2]" 1
351 1 24 PRO HA 1 38 TRP HB3 . . 4.190 2.766 2.666 2.899 . 0 0 "[ . 1 . 2]" 1
352 1 24 PRO HA 1 38 TRP HE3 . . 4.700 4.425 4.346 4.554 . 0 0 "[ . 1 . 2]" 1
353 1 24 PRO HA 1 39 ILE H . . 4.690 4.389 4.245 4.479 . 0 0 "[ . 1 . 2]" 1
354 1 24 PRO HA 1 93 VAL MG2 . . 4.320 3.855 3.709 3.918 . 0 0 "[ . 1 . 2]" 1
355 1 24 PRO HB2 1 25 THR H . . 3.680 3.226 3.138 3.289 . 0 0 "[ . 1 . 2]" 1
356 1 24 PRO HB2 1 26 ILE MD . . 3.440 3.240 3.142 3.319 . 0 0 "[ . 1 . 2]" 1
357 1 24 PRO HB2 1 36 VAL MG1 . . 3.640 1.940 1.836 2.073 . 0 0 "[ . 1 . 2]" 1
358 1 24 PRO HB2 1 37 THR H . . 4.260 4.002 3.911 4.102 . 0 0 "[ . 1 . 2]" 1
359 1 24 PRO HB2 1 38 TRP HB3 . . 4.530 3.651 3.598 3.720 . 0 0 "[ . 1 . 2]" 1
360 1 24 PRO HB2 1 93 VAL MG2 . . 3.540 3.349 3.279 3.433 . 0 0 "[ . 1 . 2]" 1
361 1 24 PRO HB2 1 108 SER QB . . 4.540 3.646 3.513 3.843 . 0 0 "[ . 1 . 2]" 1
362 1 24 PRO HB3 1 25 THR H . . 4.050 3.801 3.746 3.840 . 0 0 "[ . 1 . 2]" 1
363 1 24 PRO HB3 1 26 ILE MD . . 4.980 4.738 4.638 4.813 . 0 0 "[ . 1 . 2]" 1
364 1 24 PRO HB3 1 36 VAL MG1 . . 3.470 2.636 2.566 2.770 . 0 0 "[ . 1 . 2]" 1
365 1 24 PRO HB3 1 36 VAL MG2 . . 5.040 4.875 4.720 5.041 0.001 14 0 "[ . 1 . 2]" 1
366 1 24 PRO HB3 1 37 THR H . . 4.790 4.638 4.545 4.745 . 0 0 "[ . 1 . 2]" 1
367 1 24 PRO HB3 1 38 TRP HA . . 4.840 3.647 3.436 3.779 . 0 0 "[ . 1 . 2]" 1
368 1 24 PRO HB3 1 38 TRP HB2 . . 4.550 3.402 3.324 3.481 . 0 0 "[ . 1 . 2]" 1
369 1 24 PRO HB3 1 38 TRP HB3 . . 4.350 2.039 1.990 2.117 . 0 0 "[ . 1 . 2]" 1
370 1 24 PRO HB3 1 39 ILE H . . 5.350 5.273 5.104 5.350 0.000 16 0 "[ . 1 . 2]" 1
371 1 24 PRO HB3 1 93 VAL MG1 . . 4.670 4.575 4.474 4.666 . 0 0 "[ . 1 . 2]" 1
372 1 24 PRO HB3 1 93 VAL MG2 . . 3.640 2.098 1.985 2.183 . 0 0 "[ . 1 . 2]" 1
373 1 24 PRO HD2 1 92 ARG HA . . 4.300 3.339 2.982 3.467 . 0 0 "[ . 1 . 2]" 1
374 1 24 PRO HD2 1 93 VAL MG2 . . 4.650 4.142 3.949 4.245 . 0 0 "[ . 1 . 2]" 1
375 1 24 PRO HD2 1 105 SER HG . . 4.010 2.989 2.658 3.796 . 0 0 "[ . 1 . 2]" 1
376 1 24 PRO HD2 1 108 SER H . . 3.430 3.300 3.211 3.393 . 0 0 "[ . 1 . 2]" 1
377 1 24 PRO HD3 1 36 VAL MG1 . . 5.500 4.922 4.829 5.062 . 0 0 "[ . 1 . 2]" 1
378 1 24 PRO HD3 1 92 ARG HA . . 4.360 3.349 3.124 3.477 . 0 0 "[ . 1 . 2]" 1
379 1 24 PRO HD3 1 93 VAL HB . . 4.710 3.610 3.486 3.648 . 0 0 "[ . 1 . 2]" 1
380 1 24 PRO HD3 1 93 VAL MG1 . . 5.360 4.935 4.820 5.001 . 0 0 "[ . 1 . 2]" 1
381 1 24 PRO HD3 1 93 VAL MG2 . . 3.840 2.880 2.620 2.975 . 0 0 "[ . 1 . 2]" 1
382 1 24 PRO HD3 1 105 SER HG . . 4.060 2.756 2.271 3.491 . 0 0 "[ . 1 . 2]" 1
383 1 24 PRO HG2 1 26 ILE MD . . 4.420 3.645 3.467 3.815 . 0 0 "[ . 1 . 2]" 1
384 1 24 PRO HG2 1 36 VAL MG1 . . 4.520 3.645 3.490 3.773 . 0 0 "[ . 1 . 2]" 1
385 1 24 PRO HG2 1 92 ARG H . . 4.550 4.468 4.316 4.555 0.005 14 0 "[ . 1 . 2]" 1
386 1 24 PRO HG2 1 92 ARG HA . . 5.020 2.996 2.732 3.154 . 0 0 "[ . 1 . 2]" 1
387 1 24 PRO HG2 1 93 VAL H . . 5.200 5.020 4.878 5.152 . 0 0 "[ . 1 . 2]" 1
388 1 24 PRO HG2 1 93 VAL MG2 . . 4.210 3.715 3.594 3.831 . 0 0 "[ . 1 . 2]" 1
389 1 24 PRO HG2 1 108 SER H . . 3.880 3.313 3.146 3.487 . 0 0 "[ . 1 . 2]" 1
390 1 24 PRO HG2 1 108 SER QB . . 4.120 2.068 1.974 2.383 . 0 0 "[ . 1 . 2]" 1
391 1 24 PRO HG2 1 108 SER HG . . 5.180 4.271 3.948 4.724 . 0 0 "[ . 1 . 2]" 1
392 1 24 PRO HG3 1 25 THR H . . 5.500 5.493 5.440 5.529 0.029 14 0 "[ . 1 . 2]" 1
393 1 24 PRO HG3 1 26 ILE MD . . 5.030 4.783 4.647 4.870 . 0 0 "[ . 1 . 2]" 1
394 1 24 PRO HG3 1 36 VAL MG1 . . 3.860 3.599 3.497 3.723 . 0 0 "[ . 1 . 2]" 1
395 1 24 PRO HG3 1 91 PHE HB2 . . 5.340 4.117 3.882 4.325 . 0 0 "[ . 1 . 2]" 1
396 1 24 PRO HG3 1 92 ARG HA . . 3.850 2.107 1.999 2.240 . 0 0 "[ . 1 . 2]" 1
397 1 24 PRO HG3 1 93 VAL H . . 4.130 3.498 3.378 3.627 . 0 0 "[ . 1 . 2]" 1
398 1 24 PRO HG3 1 93 VAL MG1 . . 5.180 4.946 4.830 5.046 . 0 0 "[ . 1 . 2]" 1
399 1 24 PRO HG3 1 93 VAL MG2 . . 3.360 2.236 2.052 2.385 . 0 0 "[ . 1 . 2]" 1
400 1 24 PRO HG3 1 108 SER H . . 4.560 4.372 4.217 4.517 . 0 0 "[ . 1 . 2]" 1
401 1 24 PRO HG3 1 108 SER QB . . 5.340 3.679 3.507 3.855 . 0 0 "[ . 1 . 2]" 1
402 1 25 THR H 1 25 THR HB . . 3.480 2.655 2.579 2.767 . 0 0 "[ . 1 . 2]" 1
403 1 25 THR H 1 25 THR MG . . 3.660 2.173 2.031 2.311 . 0 0 "[ . 1 . 2]" 1
404 1 25 THR H 1 26 ILE H . . 4.620 4.560 4.549 4.577 . 0 0 "[ . 1 . 2]" 1
405 1 25 THR H 1 26 ILE MD . . 4.460 3.950 3.815 4.106 . 0 0 "[ . 1 . 2]" 1
406 1 25 THR H 1 36 VAL HA . . 4.420 4.068 3.963 4.222 . 0 0 "[ . 1 . 2]" 1
407 1 25 THR H 1 36 VAL MG1 . . 4.330 3.107 2.960 3.355 . 0 0 "[ . 1 . 2]" 1
408 1 25 THR H 1 37 THR H . . 3.510 2.486 2.428 2.662 . 0 0 "[ . 1 . 2]" 1
409 1 25 THR H 1 37 THR HB . . 4.290 3.553 3.433 3.678 . 0 0 "[ . 1 . 2]" 1
410 1 25 THR H 1 37 THR MG . . 4.580 4.384 4.203 4.549 . 0 0 "[ . 1 . 2]" 1
411 1 25 THR H 1 38 TRP HA . . 4.410 3.670 3.537 3.769 . 0 0 "[ . 1 . 2]" 1
412 1 25 THR H 1 38 TRP HB2 . . 5.500 5.481 5.388 5.516 0.016 19 0 "[ . 1 . 2]" 1
413 1 25 THR H 1 38 TRP HB3 . . 4.730 4.444 4.360 4.538 . 0 0 "[ . 1 . 2]" 1
414 1 25 THR H 1 93 VAL MG2 . . 5.350 5.270 5.157 5.328 . 0 0 "[ . 1 . 2]" 1
415 1 25 THR HA 1 25 THR MG . . 3.220 3.193 3.179 3.205 . 0 0 "[ . 1 . 2]" 1
416 1 25 THR HA 1 26 ILE H . . 2.810 2.422 2.325 2.462 . 0 0 "[ . 1 . 2]" 1
417 1 25 THR HA 1 26 ILE HB . . 5.020 4.878 4.708 4.971 . 0 0 "[ . 1 . 2]" 1
418 1 25 THR HA 1 26 ILE HG12 . . 4.390 3.321 3.233 3.539 . 0 0 "[ . 1 . 2]" 1
419 1 25 THR HB 1 26 ILE H . . 4.120 3.854 3.770 4.020 . 0 0 "[ . 1 . 2]" 1
420 1 25 THR HB 1 36 VAL MG1 . . 5.500 5.248 5.153 5.442 . 0 0 "[ . 1 . 2]" 1
421 1 25 THR HB 1 37 THR H . . 4.290 4.173 4.059 4.254 . 0 0 "[ . 1 . 2]" 1
422 1 25 THR HB 1 37 THR HB . . 4.260 3.837 3.619 4.069 . 0 0 "[ . 1 . 2]" 1
423 1 25 THR HB 1 37 THR MG . . 4.950 4.784 4.607 4.940 . 0 0 "[ . 1 . 2]" 1
424 1 25 THR MG 1 26 ILE H . . 3.370 3.067 2.930 3.225 . 0 0 "[ . 1 . 2]" 1
425 1 25 THR MG 1 37 THR H . . 4.760 1.894 1.859 2.098 . 0 0 "[ . 1 . 2]" 1
426 1 25 THR MG 1 37 THR HB . . 4.410 1.944 1.895 2.028 . 0 0 "[ . 1 . 2]" 1
427 1 25 THR MG 1 38 TRP H . . 4.930 4.844 4.681 4.927 . 0 0 "[ . 1 . 2]" 1
428 1 26 ILE H 1 26 ILE HB . . 3.360 2.875 2.690 2.968 . 0 0 "[ . 1 . 2]" 1
429 1 26 ILE H 1 26 ILE MD . . 3.870 3.168 3.007 3.362 . 0 0 "[ . 1 . 2]" 1
430 1 26 ILE H 1 26 ILE HG12 . . 3.500 2.603 2.442 2.738 . 0 0 "[ . 1 . 2]" 1
431 1 26 ILE H 1 26 ILE HG13 . . 4.360 4.092 3.972 4.159 . 0 0 "[ . 1 . 2]" 1
432 1 26 ILE H 1 26 ILE MG . . 3.960 3.930 3.876 3.948 . 0 0 "[ . 1 . 2]" 1
433 1 26 ILE H 1 27 SER H . . 4.590 4.280 4.197 4.375 . 0 0 "[ . 1 . 2]" 1
434 1 26 ILE H 1 37 THR H . . 5.190 5.124 5.032 5.215 0.025 14 0 "[ . 1 . 2]" 1
435 1 26 ILE HA 1 26 ILE MD . . 3.380 2.045 1.972 2.175 . 0 0 "[ . 1 . 2]" 1
436 1 26 ILE HA 1 26 ILE MG . . 3.250 2.135 2.071 2.241 . 0 0 "[ . 1 . 2]" 1
437 1 26 ILE HA 1 27 SER H . . 2.700 2.146 2.139 2.164 . 0 0 "[ . 1 . 2]" 1
438 1 26 ILE HA 1 34 VAL HB . . 4.920 3.995 3.865 4.213 . 0 0 "[ . 1 . 2]" 1
439 1 26 ILE HA 1 35 TYR H . . 5.500 4.968 4.881 5.088 . 0 0 "[ . 1 . 2]" 1
440 1 26 ILE HA 1 36 VAL HA . . 4.130 3.127 3.040 3.193 . 0 0 "[ . 1 . 2]" 1
441 1 26 ILE HA 1 36 VAL MG1 . . 4.490 4.155 4.057 4.260 . 0 0 "[ . 1 . 2]" 1
442 1 26 ILE HA 1 36 VAL MG2 . . 4.430 3.033 2.812 3.205 . 0 0 "[ . 1 . 2]" 1
443 1 26 ILE HA 1 37 THR H . . 4.650 4.476 4.358 4.584 . 0 0 "[ . 1 . 2]" 1
444 1 26 ILE HB 1 26 ILE MD . . 3.570 3.211 3.203 3.219 . 0 0 "[ . 1 . 2]" 1
445 1 26 ILE HB 1 27 SER H . . 4.200 4.052 3.868 4.151 . 0 0 "[ . 1 . 2]" 1
446 1 26 ILE HB 1 91 PHE QE . . 5.500 5.302 4.779 5.489 . 0 0 "[ . 1 . 2]" 1
447 1 26 ILE HB 1 111 TYR QB . . 4.440 3.133 2.924 3.356 . 0 0 "[ . 1 . 2]" 1
448 1 26 ILE HB 1 111 TYR QD . . 3.920 2.799 2.207 3.363 . 0 0 "[ . 1 . 2]" 1
449 1 26 ILE MD 1 26 ILE MG . . 2.950 2.211 2.033 2.323 . 0 0 "[ . 1 . 2]" 1
450 1 26 ILE MD 1 27 SER H . . 3.970 3.842 3.634 3.947 . 0 0 "[ . 1 . 2]" 1
451 1 26 ILE MD 1 34 VAL MG1 . . 5.030 4.843 4.647 5.019 . 0 0 "[ . 1 . 2]" 1
452 1 26 ILE MD 1 34 VAL MG2 . . 3.870 3.352 3.000 3.618 . 0 0 "[ . 1 . 2]" 1
453 1 26 ILE MD 1 36 VAL H . . 5.360 5.291 5.115 5.363 0.003 7 0 "[ . 1 . 2]" 1
454 1 26 ILE MD 1 36 VAL HA . . 3.510 3.321 3.175 3.448 . 0 0 "[ . 1 . 2]" 1
455 1 26 ILE MD 1 36 VAL MG1 . . 3.100 2.897 2.755 3.048 . 0 0 "[ . 1 . 2]" 1
456 1 26 ILE MD 1 36 VAL MG2 . . 3.070 2.310 2.109 2.537 . 0 0 "[ . 1 . 2]" 1
457 1 26 ILE MD 1 37 THR H . . 4.370 4.216 4.123 4.312 . 0 0 "[ . 1 . 2]" 1
458 1 26 ILE MD 1 53 VAL MG1 . . 5.020 4.936 4.764 5.020 0.000 12 0 "[ . 1 . 2]" 1
459 1 26 ILE MD 1 91 PHE H . . 4.720 3.684 3.443 3.848 . 0 0 "[ . 1 . 2]" 1
460 1 26 ILE MD 1 91 PHE HB2 . . 3.600 2.219 2.067 2.397 . 0 0 "[ . 1 . 2]" 1
461 1 26 ILE MD 1 91 PHE HB3 . . 3.920 3.496 3.305 3.657 . 0 0 "[ . 1 . 2]" 1
462 1 26 ILE MD 1 91 PHE QD . . 3.480 2.051 1.973 2.197 . 0 0 "[ . 1 . 2]" 1
463 1 26 ILE MD 1 91 PHE QE . . 4.170 3.476 3.288 3.699 . 0 0 "[ . 1 . 2]" 1
464 1 26 ILE MD 1 92 ARG H . . 5.500 5.419 5.246 5.505 0.005 20 0 "[ . 1 . 2]" 1
465 1 26 ILE MD 1 108 SER H . . 5.240 4.947 4.774 5.098 . 0 0 "[ . 1 . 2]" 1
466 1 26 ILE MD 1 108 SER HB2 . . 3.800 3.079 2.553 3.587 . 0 0 "[ . 1 . 2]" 1
467 1 26 ILE MD 1 108 SER HB3 . . 3.800 3.315 2.983 3.684 . 0 0 "[ . 1 . 2]" 1
468 1 26 ILE MD 1 108 SER HG . . 4.120 2.815 2.125 3.285 . 0 0 "[ . 1 . 2]" 1
469 1 26 ILE MD 1 109 ARG H . . 5.420 4.778 4.453 5.295 . 0 0 "[ . 1 . 2]" 1
470 1 26 ILE HG12 1 26 ILE MG . . 3.610 3.177 3.164 3.195 . 0 0 "[ . 1 . 2]" 1
471 1 26 ILE HG12 1 91 PHE QD . . 4.490 4.235 3.803 4.450 . 0 0 "[ . 1 . 2]" 1
472 1 26 ILE HG12 1 108 SER QB . . 4.480 3.287 2.937 3.951 . 0 0 "[ . 1 . 2]" 1
473 1 26 ILE HG12 1 109 ARG H . . 4.700 4.289 4.083 4.701 0.001 9 0 "[ . 1 . 2]" 1
474 1 26 ILE HG13 1 91 PHE QD . . 4.250 2.958 2.591 3.130 . 0 0 "[ . 1 . 2]" 1
475 1 26 ILE HG13 1 108 SER QB . . 4.640 3.967 3.763 4.230 . 0 0 "[ . 1 . 2]" 1
476 1 26 ILE MG 1 27 SER H . . 3.140 2.673 2.442 2.896 . 0 0 "[ . 1 . 2]" 1
477 1 26 ILE MG 1 27 SER HB2 . . 5.500 4.878 4.716 5.032 . 0 0 "[ . 1 . 2]" 1
478 1 26 ILE MG 1 28 THR HA . . 5.500 4.891 4.785 5.032 . 0 0 "[ . 1 . 2]" 1
479 1 26 ILE MG 1 34 VAL HA . . 4.820 4.575 4.447 4.644 . 0 0 "[ . 1 . 2]" 1
480 1 26 ILE MG 1 34 VAL HB . . 3.210 2.477 2.290 2.578 . 0 0 "[ . 1 . 2]" 1
481 1 26 ILE MG 1 34 VAL MG1 . . 3.020 2.845 2.747 2.993 . 0 0 "[ . 1 . 2]" 1
482 1 26 ILE MG 1 36 VAL HA . . 4.580 4.414 4.233 4.545 . 0 0 "[ . 1 . 2]" 1
483 1 26 ILE MG 1 36 VAL MG1 . . 4.850 4.709 4.486 4.852 0.002 14 0 "[ . 1 . 2]" 1
484 1 26 ILE MG 1 91 PHE QD . . 4.170 3.367 3.143 3.669 . 0 0 "[ . 1 . 2]" 1
485 1 26 ILE MG 1 91 PHE QE . . 4.550 2.768 2.403 2.946 . 0 0 "[ . 1 . 2]" 1
486 1 26 ILE MG 1 111 TYR H . . 4.950 4.479 4.207 4.663 . 0 0 "[ . 1 . 2]" 1
487 1 26 ILE MG 1 111 TYR QB . . 3.600 2.136 1.921 2.357 . 0 0 "[ . 1 . 2]" 1
488 1 26 ILE MG 1 111 TYR QD . . 3.450 2.491 2.304 2.728 . 0 0 "[ . 1 . 2]" 1
489 1 26 ILE MG 1 111 TYR QE . . 4.020 3.192 2.937 3.470 . 0 0 "[ . 1 . 2]" 1
490 1 26 ILE MG 1 113 VAL MG2 . . 4.470 4.323 4.129 4.444 . 0 0 "[ . 1 . 2]" 1
491 1 27 SER H 1 27 SER HB2 . . 3.520 2.628 2.424 2.970 . 0 0 "[ . 1 . 2]" 1
492 1 27 SER H 1 28 THR H . . 4.570 4.439 4.400 4.485 . 0 0 "[ . 1 . 2]" 1
493 1 27 SER H 1 34 VAL HA . . 4.870 4.692 4.556 4.854 . 0 0 "[ . 1 . 2]" 1
494 1 27 SER H 1 34 VAL HB . . 3.810 3.113 2.952 3.344 . 0 0 "[ . 1 . 2]" 1
495 1 27 SER H 1 34 VAL MG1 . . 4.720 4.474 4.341 4.674 . 0 0 "[ . 1 . 2]" 1
496 1 27 SER H 1 34 VAL MG2 . . 4.220 3.953 3.768 4.184 . 0 0 "[ . 1 . 2]" 1
497 1 27 SER H 1 35 TYR H . . 3.370 3.214 3.046 3.340 . 0 0 "[ . 1 . 2]" 1
498 1 27 SER H 1 35 TYR HB2 . . 4.090 3.497 3.352 3.604 . 0 0 "[ . 1 . 2]" 1
499 1 27 SER H 1 35 TYR HB3 . . 4.510 4.391 4.137 4.508 . 0 0 "[ . 1 . 2]" 1
500 1 27 SER H 1 35 TYR QD . . 5.290 5.198 5.099 5.277 . 0 0 "[ . 1 . 2]" 1
501 1 27 SER H 1 36 VAL HA . . 4.030 3.852 3.593 3.991 . 0 0 "[ . 1 . 2]" 1
502 1 27 SER H 1 36 VAL MG1 . . 5.480 5.381 5.284 5.446 . 0 0 "[ . 1 . 2]" 1
503 1 27 SER H 1 36 VAL MG2 . . 4.490 3.810 3.700 3.919 . 0 0 "[ . 1 . 2]" 1
504 1 27 SER HA 1 28 THR H . . 3.140 2.506 2.370 2.652 . 0 0 "[ . 1 . 2]" 1
505 1 27 SER HA 1 28 THR HB . . 5.090 4.977 4.856 5.066 . 0 0 "[ . 1 . 2]" 1
506 1 27 SER HA 1 34 VAL HB . . 5.500 5.013 4.806 5.187 . 0 0 "[ . 1 . 2]" 1
507 1 27 SER HA 1 35 TYR H . . 5.500 4.856 4.661 4.982 . 0 0 "[ . 1 . 2]" 1
508 1 27 SER HB2 1 28 THR H . . 4.030 3.758 3.431 3.955 . 0 0 "[ . 1 . 2]" 1
509 1 27 SER HB2 1 35 TYR H . . 4.690 3.864 3.323 4.694 0.004 7 0 "[ . 1 . 2]" 1
510 1 27 SER HB2 1 35 TYR HB2 . . 4.750 2.498 2.001 3.421 . 0 0 "[ . 1 . 2]" 1
511 1 27 SER HB2 1 35 TYR HB3 . . 4.750 3.280 2.644 4.107 . 0 0 "[ . 1 . 2]" 1
512 1 27 SER HB3 1 28 THR H . . 3.560 2.526 1.935 3.184 . 0 0 "[ . 1 . 2]" 1
513 1 27 SER HB3 1 35 TYR H . . 4.520 3.693 3.148 4.047 . 0 0 "[ . 1 . 2]" 1
514 1 27 SER HB3 1 35 TYR HB2 . . 4.980 2.407 1.999 2.877 . 0 0 "[ . 1 . 2]" 1
515 1 27 SER HB3 1 35 TYR QD . . 4.240 3.179 2.976 3.273 . 0 0 "[ . 1 . 2]" 1
516 1 27 SER HB3 1 35 TYR QE . . 5.500 5.420 5.221 5.502 0.002 17 0 "[ . 1 . 2]" 1
517 1 28 THR H 1 28 THR HB . . 3.300 2.593 2.515 2.676 . 0 0 "[ . 1 . 2]" 1
518 1 28 THR H 1 28 THR MG . . 3.960 3.804 3.781 3.831 . 0 0 "[ . 1 . 2]" 1
519 1 28 THR H 1 29 ALA H . . 4.810 4.235 4.118 4.353 . 0 0 "[ . 1 . 2]" 1
520 1 28 THR H 1 111 TYR QE . . 5.170 4.905 4.517 5.157 . 0 0 "[ . 1 . 2]" 1
521 1 28 THR HA 1 28 THR MG . . 2.990 2.320 2.247 2.413 . 0 0 "[ . 1 . 2]" 1
522 1 28 THR HA 1 29 ALA H . . 3.040 2.181 2.152 2.206 . 0 0 "[ . 1 . 2]" 1
523 1 28 THR HA 1 29 ALA MB . . 4.110 4.076 4.003 4.115 0.005 16 0 "[ . 1 . 2]" 1
524 1 28 THR HA 1 30 SER H . . 3.780 3.729 3.596 3.785 0.005 6 0 "[ . 1 . 2]" 1
525 1 28 THR HA 1 34 VAL HA . . 3.840 3.676 3.536 3.812 . 0 0 "[ . 1 . 2]" 1
526 1 28 THR HA 1 34 VAL HB . . 4.760 4.171 3.976 4.373 . 0 0 "[ . 1 . 2]" 1
527 1 28 THR HA 1 34 VAL MG1 . . 3.590 3.240 2.999 3.399 . 0 0 "[ . 1 . 2]" 1
528 1 28 THR HA 1 35 TYR H . . 5.050 4.000 3.812 4.113 . 0 0 "[ . 1 . 2]" 1
529 1 28 THR HA 1 111 TYR QE . . 4.580 4.205 4.049 4.343 . 0 0 "[ . 1 . 2]" 1
530 1 28 THR HB 1 29 ALA H . . 4.450 4.375 4.278 4.438 . 0 0 "[ . 1 . 2]" 1
531 1 28 THR MG 1 29 ALA H . . 3.350 3.035 2.817 3.145 . 0 0 "[ . 1 . 2]" 1
532 1 28 THR MG 1 29 ALA HA . . 4.150 4.016 3.829 4.119 . 0 0 "[ . 1 . 2]" 1
533 1 28 THR MG 1 29 ALA MB . . 4.430 4.385 4.254 4.435 0.005 10 0 "[ . 1 . 2]" 1
534 1 28 THR MG 1 30 SER H . . 3.420 3.322 3.153 3.423 0.003 6 0 "[ . 1 . 2]" 1
535 1 28 THR MG 1 34 VAL HA . . 4.970 4.778 4.644 4.890 . 0 0 "[ . 1 . 2]" 1
536 1 28 THR MG 1 34 VAL MG1 . . 4.260 4.174 4.000 4.261 0.001 16 0 "[ . 1 . 2]" 1
537 1 28 THR MG 1 35 TYR H . . 5.460 5.351 5.181 5.419 . 0 0 "[ . 1 . 2]" 1
538 1 28 THR MG 1 117 GLY QA . . 4.620 3.125 1.808 4.172 . 0 0 "[ . 1 . 2]" 1
539 1 28 THR MG 1 118 PRO QD . . 4.540 3.488 2.055 4.461 . 0 0 "[ . 1 . 2]" 1
540 1 29 ALA H 1 29 ALA MB . . 3.230 2.368 2.222 2.446 . 0 0 "[ . 1 . 2]" 1
541 1 29 ALA H 1 33 SER H . . 5.500 5.359 5.227 5.494 . 0 0 "[ . 1 . 2]" 1
542 1 29 ALA H 1 34 VAL HA . . 3.170 2.161 1.961 2.300 . 0 0 "[ . 1 . 2]" 1
543 1 29 ALA H 1 34 VAL HB . . 4.150 3.876 3.671 4.025 . 0 0 "[ . 1 . 2]" 1
544 1 29 ALA H 1 34 VAL MG1 . . 3.870 3.064 2.878 3.276 . 0 0 "[ . 1 . 2]" 1
545 1 29 ALA H 1 35 TYR H . . 3.730 2.884 2.749 3.053 . 0 0 "[ . 1 . 2]" 1
546 1 29 ALA H 1 35 TYR QD . . 4.770 4.076 3.872 4.273 . 0 0 "[ . 1 . 2]" 1
547 1 29 ALA HA 1 35 TYR H . . 4.620 4.133 4.015 4.214 . 0 0 "[ . 1 . 2]" 1
548 1 29 ALA HA 1 35 TYR QD . . 3.700 2.662 2.423 2.807 . 0 0 "[ . 1 . 2]" 1
549 1 29 ALA HA 1 35 TYR QE . . 3.280 2.440 2.227 2.603 . 0 0 "[ . 1 . 2]" 1
550 1 29 ALA MB 1 30 SER H . . 2.940 2.622 2.521 2.698 . 0 0 "[ . 1 . 2]" 1
551 1 29 ALA MB 1 30 SER QB . . 4.440 3.372 2.990 3.750 . 0 0 "[ . 1 . 2]" 1
552 1 29 ALA MB 1 33 SER H . . 4.650 4.552 4.459 4.615 . 0 0 "[ . 1 . 2]" 1
553 1 29 ALA MB 1 33 SER HA . . 5.010 4.779 4.653 4.914 . 0 0 "[ . 1 . 2]" 1
554 1 29 ALA MB 1 33 SER HB3 . . 5.020 4.586 4.488 4.700 . 0 0 "[ . 1 . 2]" 1
555 1 29 ALA MB 1 34 VAL H . . 3.860 3.484 3.404 3.668 . 0 0 "[ . 1 . 2]" 1
556 1 29 ALA MB 1 34 VAL HA . . 3.490 2.257 2.077 2.376 . 0 0 "[ . 1 . 2]" 1
557 1 29 ALA MB 1 35 TYR H . . 3.520 1.978 1.892 2.088 . 0 0 "[ . 1 . 2]" 1
558 1 29 ALA MB 1 35 TYR HA . . 4.220 3.037 2.948 3.125 . 0 0 "[ . 1 . 2]" 1
559 1 29 ALA MB 1 35 TYR HB2 . . 5.040 2.898 2.687 3.193 . 0 0 "[ . 1 . 2]" 1
560 1 29 ALA MB 1 35 TYR QD . . 3.460 2.530 2.341 2.647 . 0 0 "[ . 1 . 2]" 1
561 1 29 ALA MB 1 35 TYR QE . . 3.450 2.746 2.664 2.831 . 0 0 "[ . 1 . 2]" 1
562 1 29 ALA MB 1 36 VAL H . . 5.160 4.813 4.743 4.883 . 0 0 "[ . 1 . 2]" 1
563 1 29 ALA MB 1 79 GLU H . . 5.500 5.479 5.411 5.505 0.005 19 0 "[ . 1 . 2]" 1
564 1 29 ALA MB 1 79 GLU HA . . 4.550 3.704 3.598 3.785 . 0 0 "[ . 1 . 2]" 1
565 1 29 ALA MB 1 79 GLU HB3 . . 4.580 4.247 4.165 4.359 . 0 0 "[ . 1 . 2]" 1
566 1 29 ALA MB 1 79 GLU HG2 . . 3.570 3.207 2.960 3.439 . 0 0 "[ . 1 . 2]" 1
567 1 29 ALA MB 1 79 GLU HG3 . . 3.550 2.024 1.928 2.159 . 0 0 "[ . 1 . 2]" 1
568 1 29 ALA MB 1 80 ILE H . . 5.450 4.543 4.451 4.676 . 0 0 "[ . 1 . 2]" 1
569 1 29 ALA MB 1 81 THR MG . . 4.670 4.415 4.221 4.590 . 0 0 "[ . 1 . 2]" 1
570 1 30 SER H 1 30 SER QB . . 3.450 2.935 2.811 3.127 . 0 0 "[ . 1 . 2]" 1
571 1 30 SER H 1 31 GLU H . . 4.640 4.364 4.353 4.374 . 0 0 "[ . 1 . 2]" 1
572 1 30 SER H 1 32 THR H . . 4.770 4.668 4.491 4.767 . 0 0 "[ . 1 . 2]" 1
573 1 30 SER H 1 33 SER H . . 3.770 3.619 3.437 3.719 . 0 0 "[ . 1 . 2]" 1
574 1 30 SER H 1 33 SER HA . . 5.490 5.189 5.007 5.322 . 0 0 "[ . 1 . 2]" 1
575 1 30 SER H 1 33 SER HG . . 4.610 3.775 2.542 4.547 . 0 0 "[ . 1 . 2]" 1
576 1 30 SER H 1 34 VAL HB . . 5.340 5.183 5.048 5.337 . 0 0 "[ . 1 . 2]" 1
577 1 30 SER H 1 34 VAL MG1 . . 4.330 3.485 3.327 3.711 . 0 0 "[ . 1 . 2]" 1
578 1 30 SER H 1 35 TYR H . . 4.600 4.564 4.470 4.604 0.004 4 0 "[ . 1 . 2]" 1
579 1 30 SER H 1 35 TYR QD . . 5.500 5.433 5.248 5.499 . 0 0 "[ . 1 . 2]" 1
580 1 30 SER HA 1 32 THR H . . 4.290 4.192 3.963 4.301 0.011 6 0 "[ . 1 . 2]" 1
581 1 30 SER HA 1 33 SER H . . 4.470 4.407 4.218 4.478 0.008 11 0 "[ . 1 . 2]" 1
582 1 30 SER QB 1 31 GLU H . . 3.240 2.251 1.982 2.723 . 0 0 "[ . 1 . 2]" 1
583 1 30 SER QB 1 31 GLU QB . . 4.510 4.280 3.728 4.538 0.028 11 0 "[ . 1 . 2]" 1
584 1 30 SER QB 1 32 THR H . . 3.410 2.328 2.168 2.450 . 0 0 "[ . 1 . 2]" 1
585 1 30 SER QB 1 33 SER H . . 3.910 2.234 1.994 2.508 . 0 0 "[ . 1 . 2]" 1
586 1 30 SER HB2 1 31 GLU H . . 3.820 3.389 2.928 3.730 . 0 0 "[ . 1 . 2]" 1
587 1 30 SER HB2 1 32 THR H . . 4.080 3.093 2.419 4.076 . 0 0 "[ . 1 . 2]" 1
588 1 30 SER HB3 1 31 GLU H . . 3.820 2.293 1.994 2.798 . 0 0 "[ . 1 . 2]" 1
589 1 30 SER HB3 1 32 THR H . . 4.080 2.564 2.199 3.042 . 0 0 "[ . 1 . 2]" 1
590 1 31 GLU H 1 31 GLU QB . . 3.560 2.455 2.142 2.724 . 0 0 "[ . 1 . 2]" 1
591 1 31 GLU H 1 31 GLU QG . . 3.930 2.749 1.911 3.772 . 0 0 "[ . 1 . 2]" 1
592 1 31 GLU H 1 32 THR H . . 3.750 2.389 2.331 2.575 . 0 0 "[ . 1 . 2]" 1
593 1 31 GLU H 1 32 THR MG . . 4.650 4.406 4.136 4.621 . 0 0 "[ . 1 . 2]" 1
594 1 31 GLU H 1 33 SER H . . 4.270 3.683 3.579 3.853 . 0 0 "[ . 1 . 2]" 1
595 1 31 GLU HA 1 31 GLU QG . . 3.450 3.245 2.759 3.448 . 0 0 "[ . 1 . 2]" 1
596 1 31 GLU HA 1 32 THR MG . . 4.720 4.584 4.435 4.697 . 0 0 "[ . 1 . 2]" 1
597 1 31 GLU HA 1 33 SER H . . 4.590 4.129 4.067 4.191 . 0 0 "[ . 1 . 2]" 1
598 1 31 GLU HA 1 113 VAL MG1 . . 4.090 3.331 2.864 3.622 . 0 0 "[ . 1 . 2]" 1
599 1 31 GLU HA 1 113 VAL MG2 . . 5.030 4.835 4.408 5.034 0.004 13 0 "[ . 1 . 2]" 1
600 1 31 GLU QB 1 32 THR H . . 3.720 3.582 3.138 3.728 0.008 4 0 "[ . 1 . 2]" 1
601 1 31 GLU QB 1 32 THR MG . . 3.850 3.653 3.459 3.851 0.001 10 0 "[ . 1 . 2]" 1
602 1 31 GLU QB 1 33 SER H . . 5.030 4.953 4.713 5.043 0.013 8 0 "[ . 1 . 2]" 1
603 1 31 GLU QB 1 85 LYS QE . . 4.320 3.648 2.206 4.275 . 0 0 "[ . 1 . 2]" 1
604 1 31 GLU QG 1 32 THR H . . 3.850 2.765 2.379 3.409 . 0 0 "[ . 1 . 2]" 1
605 1 31 GLU QG 1 32 THR MG . . 3.520 2.167 1.969 2.535 . 0 0 "[ . 1 . 2]" 1
606 1 31 GLU QG 1 33 SER H . . 4.850 4.477 4.207 4.856 0.006 6 0 "[ . 1 . 2]" 1
607 1 31 GLU QG 1 85 LYS QE . . 4.380 2.899 2.030 4.048 . 0 0 "[ . 1 . 2]" 1
608 1 32 THR H 1 32 THR HB . . 4.210 3.724 3.682 3.773 . 0 0 "[ . 1 . 2]" 1
609 1 32 THR H 1 32 THR MG . . 3.360 3.086 2.928 3.190 . 0 0 "[ . 1 . 2]" 1
610 1 32 THR H 1 33 SER H . . 2.680 1.980 1.938 2.072 . 0 0 "[ . 1 . 2]" 1
611 1 32 THR H 1 33 SER HA . . 4.970 4.686 4.655 4.732 . 0 0 "[ . 1 . 2]" 1
612 1 32 THR H 1 33 SER HB3 . . 4.780 4.224 4.036 4.468 . 0 0 "[ . 1 . 2]" 1
613 1 32 THR H 1 33 SER HG . . 5.050 4.613 3.790 5.031 . 0 0 "[ . 1 . 2]" 1
614 1 32 THR H 1 81 THR MG . . 5.500 5.419 5.206 5.509 0.009 14 0 "[ . 1 . 2]" 1
615 1 32 THR H 1 113 VAL MG2 . . 5.500 5.384 5.137 5.502 0.002 18 0 "[ . 1 . 2]" 1
616 1 32 THR HA 1 32 THR MG . . 2.880 2.249 2.143 2.362 . 0 0 "[ . 1 . 2]" 1
617 1 32 THR HA 1 33 SER H . . 3.500 3.275 3.216 3.327 . 0 0 "[ . 1 . 2]" 1
618 1 32 THR HA 1 83 LEU H . . 4.060 3.890 3.662 4.037 . 0 0 "[ . 1 . 2]" 1
619 1 32 THR HA 1 83 LEU QB . . 4.640 3.292 2.960 3.530 . 0 0 "[ . 1 . 2]" 1
620 1 32 THR HA 1 83 LEU MD1 . . 4.700 4.328 4.150 4.519 . 0 0 "[ . 1 . 2]" 1
621 1 32 THR HA 1 113 VAL MG1 . . 3.420 2.953 2.733 3.141 . 0 0 "[ . 1 . 2]" 1
622 1 32 THR HA 1 113 VAL MG2 . . 4.560 4.207 3.992 4.488 . 0 0 "[ . 1 . 2]" 1
623 1 32 THR HB 1 33 SER H . . 4.630 4.172 4.073 4.265 . 0 0 "[ . 1 . 2]" 1
624 1 32 THR HB 1 82 GLY H . . 4.310 3.160 3.027 3.347 . 0 0 "[ . 1 . 2]" 1
625 1 32 THR HB 1 83 LEU H . . 3.310 3.052 2.637 3.309 . 0 0 "[ . 1 . 2]" 1
626 1 32 THR HB 1 113 VAL MG1 . . 5.440 5.102 4.831 5.297 . 0 0 "[ . 1 . 2]" 1
627 1 32 THR MG 1 33 SER H . . 4.300 4.282 4.203 4.318 0.018 13 0 "[ . 1 . 2]" 1
628 1 32 THR MG 1 83 LEU H . . 4.310 4.214 4.008 4.314 0.004 2 0 "[ . 1 . 2]" 1
629 1 32 THR MG 1 84 GLU HA . . 4.960 4.601 4.007 4.960 0.000 3 0 "[ . 1 . 2]" 1
630 1 32 THR MG 1 85 LYS QE . . 3.260 2.118 1.829 2.508 . 0 0 "[ . 1 . 2]" 1
631 1 33 SER H 1 33 SER HB2 . . 4.090 3.927 3.861 3.954 . 0 0 "[ . 1 . 2]" 1
632 1 33 SER H 1 33 SER HB3 . . 3.920 3.090 2.956 3.212 . 0 0 "[ . 1 . 2]" 1
633 1 33 SER H 1 33 SER HG . . 4.370 3.388 2.525 3.776 . 0 0 "[ . 1 . 2]" 1
634 1 33 SER H 1 34 VAL H . . 4.510 4.413 4.393 4.430 . 0 0 "[ . 1 . 2]" 1
635 1 33 SER H 1 34 VAL MG1 . . 4.480 3.955 3.870 4.036 . 0 0 "[ . 1 . 2]" 1
636 1 33 SER H 1 79 GLU HG2 . . 5.500 5.490 5.446 5.509 0.009 13 0 "[ . 1 . 2]" 1
637 1 33 SER H 1 82 GLY H . . 5.460 5.344 5.202 5.461 0.001 8 0 "[ . 1 . 2]" 1
638 1 33 SER H 1 83 LEU MD1 . . 4.210 4.054 3.833 4.213 0.003 20 0 "[ . 1 . 2]" 1
639 1 33 SER H 1 113 VAL MG1 . . 4.390 4.266 4.041 4.390 0.000 18 0 "[ . 1 . 2]" 1
640 1 33 SER H 1 113 VAL MG2 . . 4.630 4.443 4.182 4.612 . 0 0 "[ . 1 . 2]" 1
641 1 33 SER HA 1 34 VAL H . . 2.960 2.487 2.405 2.559 . 0 0 "[ . 1 . 2]" 1
642 1 33 SER HA 1 34 VAL MG1 . . 4.700 3.411 3.329 3.481 . 0 0 "[ . 1 . 2]" 1
643 1 33 SER HA 1 34 VAL MG2 . . 4.090 3.533 3.453 3.612 . 0 0 "[ . 1 . 2]" 1
644 1 33 SER HA 1 79 GLU HG2 . . 4.590 4.378 4.199 4.562 . 0 0 "[ . 1 . 2]" 1
645 1 33 SER HA 1 80 ILE H . . 5.330 4.991 4.826 5.148 . 0 0 "[ . 1 . 2]" 1
646 1 33 SER HA 1 81 THR HA . . 3.800 2.566 2.444 2.755 . 0 0 "[ . 1 . 2]" 1
647 1 33 SER HA 1 81 THR MG . . 3.940 3.857 3.621 3.952 0.012 13 0 "[ . 1 . 2]" 1
648 1 33 SER HA 1 82 GLY H . . 4.480 4.180 4.002 4.347 . 0 0 "[ . 1 . 2]" 1
649 1 33 SER HA 1 83 LEU H . . 4.270 4.021 3.842 4.199 . 0 0 "[ . 1 . 2]" 1
650 1 33 SER HA 1 83 LEU MD1 . . 3.780 2.139 1.963 2.412 . 0 0 "[ . 1 . 2]" 1
651 1 33 SER HA 1 83 LEU HG . . 4.110 2.819 2.588 3.087 . 0 0 "[ . 1 . 2]" 1
652 1 33 SER HB2 1 34 VAL H . . 3.460 2.415 2.214 2.641 . 0 0 "[ . 1 . 2]" 1
653 1 33 SER HB2 1 34 VAL MG2 . . 4.510 4.337 4.202 4.470 . 0 0 "[ . 1 . 2]" 1
654 1 33 SER HB2 1 79 GLU HG2 . . 4.530 2.175 1.995 2.442 . 0 0 "[ . 1 . 2]" 1
655 1 33 SER HB2 1 79 GLU HG3 . . 4.500 3.381 3.119 3.660 . 0 0 "[ . 1 . 2]" 1
656 1 33 SER HB2 1 80 ILE H . . 4.620 3.915 3.724 4.046 . 0 0 "[ . 1 . 2]" 1
657 1 33 SER HB2 1 81 THR HA . . 4.040 2.246 2.017 2.663 . 0 0 "[ . 1 . 2]" 1
658 1 33 SER HB2 1 81 THR MG . . 3.520 2.113 1.964 2.379 . 0 0 "[ . 1 . 2]" 1
659 1 33 SER HB3 1 34 VAL H . . 4.060 3.829 3.692 3.978 . 0 0 "[ . 1 . 2]" 1
660 1 33 SER HB3 1 79 GLU HG2 . . 4.640 3.447 3.353 3.554 . 0 0 "[ . 1 . 2]" 1
661 1 33 SER HB3 1 81 THR H . . 4.660 4.413 4.284 4.552 . 0 0 "[ . 1 . 2]" 1
662 1 33 SER HB3 1 81 THR HA . . 3.830 2.088 1.997 2.185 . 0 0 "[ . 1 . 2]" 1
663 1 33 SER HB3 1 81 THR HB . . 4.580 2.930 2.685 3.167 . 0 0 "[ . 1 . 2]" 1
664 1 33 SER HB3 1 81 THR MG . . 3.380 2.023 1.873 2.172 . 0 0 "[ . 1 . 2]" 1
665 1 33 SER HB3 1 82 GLY H . . 3.620 3.591 3.523 3.624 0.004 17 0 "[ . 1 . 2]" 1
666 1 33 SER HB3 1 83 LEU H . . 4.810 4.766 4.598 4.813 0.003 5 0 "[ . 1 . 2]" 1
667 1 34 VAL H 1 34 VAL MG1 . . 4.590 3.139 3.073 3.190 . 0 0 "[ . 1 . 2]" 1
668 1 34 VAL H 1 34 VAL MG2 . . 3.140 2.343 2.171 2.496 . 0 0 "[ . 1 . 2]" 1
669 1 34 VAL H 1 35 TYR H . . 4.530 4.334 4.283 4.377 . 0 0 "[ . 1 . 2]" 1
670 1 34 VAL H 1 79 GLU HA . . 4.710 4.024 3.923 4.193 . 0 0 "[ . 1 . 2]" 1
671 1 34 VAL H 1 79 GLU HG2 . . 3.780 3.241 2.987 3.619 . 0 0 "[ . 1 . 2]" 1
672 1 34 VAL H 1 79 GLU HG3 . . 4.330 3.405 3.194 3.796 . 0 0 "[ . 1 . 2]" 1
673 1 34 VAL H 1 80 ILE H . . 3.570 2.990 2.873 3.112 . 0 0 "[ . 1 . 2]" 1
674 1 34 VAL H 1 80 ILE HB . . 4.540 3.233 3.065 3.397 . 0 0 "[ . 1 . 2]" 1
675 1 34 VAL H 1 80 ILE HG13 . . 5.500 5.437 5.315 5.503 0.003 17 0 "[ . 1 . 2]" 1
676 1 34 VAL H 1 80 ILE MG . . 4.720 4.293 4.023 4.446 . 0 0 "[ . 1 . 2]" 1
677 1 34 VAL H 1 81 THR HA . . 4.210 3.982 3.870 4.110 . 0 0 "[ . 1 . 2]" 1
678 1 34 VAL H 1 81 THR MG . . 4.260 4.090 3.854 4.261 0.001 5 0 "[ . 1 . 2]" 1
679 1 34 VAL H 1 83 LEU MD1 . . 3.780 3.057 2.799 3.352 . 0 0 "[ . 1 . 2]" 1
680 1 34 VAL H 1 113 VAL MG2 . . 5.430 5.128 5.000 5.315 . 0 0 "[ . 1 . 2]" 1
681 1 34 VAL HA 1 34 VAL MG1 . . 3.460 2.299 2.252 2.332 . 0 0 "[ . 1 . 2]" 1
682 1 34 VAL HA 1 35 TYR H . . 3.040 2.246 2.217 2.281 . 0 0 "[ . 1 . 2]" 1
683 1 34 VAL HB 1 35 TYR H . . 3.210 2.810 2.695 2.910 . 0 0 "[ . 1 . 2]" 1
684 1 34 VAL MG1 1 35 TYR H . . 3.820 3.779 3.697 3.832 0.012 13 0 "[ . 1 . 2]" 1
685 1 34 VAL MG1 1 83 LEU MD1 . . 3.230 2.435 2.164 2.829 . 0 0 "[ . 1 . 2]" 1
686 1 34 VAL MG1 1 111 TYR QD . . 3.840 2.806 2.454 3.261 . 0 0 "[ . 1 . 2]" 1
687 1 34 VAL MG1 1 111 TYR QE . . 3.400 2.425 2.020 2.789 . 0 0 "[ . 1 . 2]" 1
688 1 34 VAL MG1 1 113 VAL MG1 . . 4.430 3.792 3.572 3.909 . 0 0 "[ . 1 . 2]" 1
689 1 34 VAL MG1 1 113 VAL MG2 . . 3.680 2.340 2.123 2.499 . 0 0 "[ . 1 . 2]" 1
690 1 34 VAL MG2 1 35 TYR H . . 3.940 3.727 3.635 3.804 . 0 0 "[ . 1 . 2]" 1
691 1 34 VAL MG2 1 35 TYR HA . . 4.820 4.267 4.164 4.347 . 0 0 "[ . 1 . 2]" 1
692 1 34 VAL MG2 1 36 VAL H . . 4.460 4.285 4.081 4.428 . 0 0 "[ . 1 . 2]" 1
693 1 34 VAL MG2 1 36 VAL HA . . 4.600 4.458 4.252 4.600 . 0 0 "[ . 1 . 2]" 1
694 1 34 VAL MG2 1 36 VAL HB . . 4.670 4.541 4.417 4.608 . 0 0 "[ . 1 . 2]" 1
695 1 34 VAL MG2 1 36 VAL MG1 . . 4.820 4.500 4.372 4.590 . 0 0 "[ . 1 . 2]" 1
696 1 34 VAL MG2 1 36 VAL MG2 . . 2.870 2.268 2.158 2.393 . 0 0 "[ . 1 . 2]" 1
697 1 34 VAL MG2 1 53 VAL MG1 . . 5.400 5.106 4.997 5.205 . 0 0 "[ . 1 . 2]" 1
698 1 34 VAL MG2 1 79 GLU HA . . 5.280 4.453 4.334 4.677 . 0 0 "[ . 1 . 2]" 1
699 1 34 VAL MG2 1 80 ILE H . . 3.710 3.277 3.054 3.474 . 0 0 "[ . 1 . 2]" 1
700 1 34 VAL MG2 1 80 ILE HA . . 5.170 4.890 4.743 5.045 . 0 0 "[ . 1 . 2]" 1
701 1 34 VAL MG2 1 80 ILE HB . . 3.170 2.548 2.340 2.729 . 0 0 "[ . 1 . 2]" 1
702 1 34 VAL MG2 1 80 ILE MD . . 4.990 4.603 4.474 4.763 . 0 0 "[ . 1 . 2]" 1
703 1 34 VAL MG2 1 80 ILE HG12 . . 3.930 3.734 3.517 3.923 . 0 0 "[ . 1 . 2]" 1
704 1 34 VAL MG2 1 80 ILE HG13 . . 4.180 3.778 3.627 3.973 . 0 0 "[ . 1 . 2]" 1
705 1 34 VAL MG2 1 80 ILE MG . . 3.790 3.551 3.264 3.759 . 0 0 "[ . 1 . 2]" 1
706 1 34 VAL MG2 1 83 LEU MD1 . . 3.050 2.211 1.959 2.445 . 0 0 "[ . 1 . 2]" 1
707 1 34 VAL MG2 1 91 PHE QD . . 4.690 3.829 3.707 4.035 . 0 0 "[ . 1 . 2]" 1
708 1 34 VAL MG2 1 91 PHE QE . . 3.750 2.815 2.499 3.033 . 0 0 "[ . 1 . 2]" 1
709 1 34 VAL MG2 1 91 PHE HZ . . 3.800 2.514 2.178 2.852 . 0 0 "[ . 1 . 2]" 1
710 1 34 VAL MG2 1 113 VAL MG2 . . 4.020 3.633 3.430 3.762 . 0 0 "[ . 1 . 2]" 1
711 1 35 TYR H 1 35 TYR HB2 . . 3.520 2.276 2.254 2.301 . 0 0 "[ . 1 . 2]" 1
712 1 35 TYR H 1 35 TYR HB3 . . 3.690 3.552 3.539 3.562 . 0 0 "[ . 1 . 2]" 1
713 1 35 TYR H 1 35 TYR QD . . 3.820 3.370 3.265 3.452 . 0 0 "[ . 1 . 2]" 1
714 1 35 TYR H 1 35 TYR QE . . 5.350 5.022 4.917 5.109 . 0 0 "[ . 1 . 2]" 1
715 1 35 TYR H 1 36 VAL H . . 4.530 4.443 4.392 4.503 . 0 0 "[ . 1 . 2]" 1
716 1 35 TYR HA 1 35 TYR QD . . 3.430 2.105 2.026 2.204 . 0 0 "[ . 1 . 2]" 1
717 1 35 TYR HA 1 35 TYR QE . . 4.560 4.241 4.199 4.285 . 0 0 "[ . 1 . 2]" 1
718 1 35 TYR HA 1 36 VAL H . . 2.770 2.139 2.137 2.145 . 0 0 "[ . 1 . 2]" 1
719 1 35 TYR HA 1 36 VAL HA . . 4.900 4.396 4.394 4.400 . 0 0 "[ . 1 . 2]" 1
720 1 35 TYR HA 1 36 VAL HB . . 5.080 4.604 4.543 4.673 . 0 0 "[ . 1 . 2]" 1
721 1 35 TYR HA 1 36 VAL MG2 . . 4.030 3.832 3.698 3.938 . 0 0 "[ . 1 . 2]" 1
722 1 35 TYR HA 1 79 GLU HB2 . . 4.710 3.593 3.436 3.814 . 0 0 "[ . 1 . 2]" 1
723 1 35 TYR HA 1 79 GLU HG3 . . 4.720 3.356 3.124 3.534 . 0 0 "[ . 1 . 2]" 1
724 1 35 TYR HB2 1 36 VAL H . . 4.440 4.427 4.370 4.462 0.022 2 0 "[ . 1 . 2]" 1
725 1 35 TYR HB3 1 36 VAL H . . 3.790 3.529 3.395 3.624 . 0 0 "[ . 1 . 2]" 1
726 1 35 TYR HB3 1 78 VAL H . . 5.500 5.433 5.301 5.505 0.005 9 0 "[ . 1 . 2]" 1
727 1 35 TYR QD 1 36 VAL H . . 3.630 3.492 3.379 3.610 . 0 0 "[ . 1 . 2]" 1
728 1 35 TYR QD 1 36 VAL MG2 . . 5.500 5.293 5.162 5.408 . 0 0 "[ . 1 . 2]" 1
729 1 35 TYR QD 1 78 VAL H . . 5.070 4.769 4.586 4.876 . 0 0 "[ . 1 . 2]" 1
730 1 35 TYR QD 1 79 GLU H . . 4.310 3.929 3.790 4.035 . 0 0 "[ . 1 . 2]" 1
731 1 35 TYR QD 1 79 GLU HA . . 3.930 2.890 2.725 3.019 . 0 0 "[ . 1 . 2]" 1
732 1 35 TYR QD 1 79 GLU HB2 . . 3.790 2.517 2.362 2.629 . 0 0 "[ . 1 . 2]" 1
733 1 35 TYR QD 1 79 GLU HB3 . . 4.260 4.159 4.007 4.263 0.003 18 0 "[ . 1 . 2]" 1
734 1 35 TYR QD 1 79 GLU HG2 . . 5.360 4.757 4.625 4.912 . 0 0 "[ . 1 . 2]" 1
735 1 35 TYR QD 1 79 GLU HG3 . . 4.510 3.482 3.293 3.666 . 0 0 "[ . 1 . 2]" 1
736 1 35 TYR QD 1 80 ILE H . . 5.010 4.875 4.705 5.003 . 0 0 "[ . 1 . 2]" 1
737 1 35 TYR QE 1 79 GLU H . . 4.460 4.241 3.999 4.415 . 0 0 "[ . 1 . 2]" 1
738 1 35 TYR QE 1 79 GLU HA . . 4.870 4.238 4.058 4.403 . 0 0 "[ . 1 . 2]" 1
739 1 35 TYR QE 1 79 GLU HB2 . . 3.510 2.172 1.998 2.338 . 0 0 "[ . 1 . 2]" 1
740 1 35 TYR QE 1 79 GLU HB3 . . 3.890 3.630 3.399 3.811 . 0 0 "[ . 1 . 2]" 1
741 1 35 TYR QE 1 79 GLU HG2 . . 5.500 4.805 4.662 5.018 . 0 0 "[ . 1 . 2]" 1
742 1 35 TYR QE 1 79 GLU HG3 . . 5.260 3.773 3.518 4.040 . 0 0 "[ . 1 . 2]" 1
743 1 36 VAL H 1 36 VAL HB . . 3.290 2.579 2.530 2.638 . 0 0 "[ . 1 . 2]" 1
744 1 36 VAL H 1 36 VAL MG1 . . 3.980 3.824 3.802 3.852 . 0 0 "[ . 1 . 2]" 1
745 1 36 VAL H 1 36 VAL MG2 . . 3.390 2.794 2.659 2.955 . 0 0 "[ . 1 . 2]" 1
746 1 36 VAL H 1 37 THR H . . 4.470 4.404 4.325 4.435 . 0 0 "[ . 1 . 2]" 1
747 1 36 VAL H 1 78 VAL H . . 3.250 3.180 3.043 3.248 . 0 0 "[ . 1 . 2]" 1
748 1 36 VAL H 1 78 VAL MG2 . . 4.000 3.774 3.641 3.849 . 0 0 "[ . 1 . 2]" 1
749 1 36 VAL H 1 79 GLU HB2 . . 5.080 4.921 4.750 5.070 . 0 0 "[ . 1 . 2]" 1
750 1 36 VAL H 1 79 GLU HG3 . . 5.310 5.073 4.875 5.221 . 0 0 "[ . 1 . 2]" 1
751 1 36 VAL HA 1 36 VAL MG1 . . 3.270 2.334 2.274 2.383 . 0 0 "[ . 1 . 2]" 1
752 1 36 VAL HA 1 36 VAL MG2 . . 3.460 2.305 2.217 2.397 . 0 0 "[ . 1 . 2]" 1
753 1 36 VAL HA 1 37 THR H . . 2.790 2.156 2.144 2.164 . 0 0 "[ . 1 . 2]" 1
754 1 36 VAL HA 1 37 THR HB . . 4.750 4.625 4.542 4.749 . 0 0 "[ . 1 . 2]" 1
755 1 36 VAL HB 1 37 THR H . . 4.250 4.174 4.130 4.245 . 0 0 "[ . 1 . 2]" 1
756 1 36 VAL HB 1 38 TRP HE3 . . 4.420 4.022 3.831 4.103 . 0 0 "[ . 1 . 2]" 1
757 1 36 VAL HB 1 38 TRP HZ3 . . 3.800 3.689 3.450 3.803 0.003 19 0 "[ . 1 . 2]" 1
758 1 36 VAL HB 1 53 VAL MG1 . . 3.840 3.718 3.576 3.844 0.004 19 0 "[ . 1 . 2]" 1
759 1 36 VAL HB 1 53 VAL MG2 . . 4.100 3.953 3.772 4.093 . 0 0 "[ . 1 . 2]" 1
760 1 36 VAL HB 1 77 SER HA . . 5.490 4.678 4.488 4.767 . 0 0 "[ . 1 . 2]" 1
761 1 36 VAL HB 1 78 VAL H . . 3.870 3.407 3.227 3.488 . 0 0 "[ . 1 . 2]" 1
762 1 36 VAL HB 1 78 VAL MG2 . . 3.460 3.086 2.972 3.222 . 0 0 "[ . 1 . 2]" 1
763 1 36 VAL HB 1 80 ILE H . . 4.710 4.240 4.093 4.442 . 0 0 "[ . 1 . 2]" 1
764 1 36 VAL HB 1 80 ILE MD . . 4.370 3.618 3.438 3.766 . 0 0 "[ . 1 . 2]" 1
765 1 36 VAL HB 1 80 ILE HG12 . . 3.900 2.952 2.701 3.137 . 0 0 "[ . 1 . 2]" 1
766 1 36 VAL HB 1 80 ILE HG13 . . 4.880 3.667 3.413 3.925 . 0 0 "[ . 1 . 2]" 1
767 1 36 VAL MG1 1 37 THR H . . 3.340 2.456 2.303 2.568 . 0 0 "[ . 1 . 2]" 1
768 1 36 VAL MG1 1 37 THR HA . . 4.410 3.602 3.507 3.685 . 0 0 "[ . 1 . 2]" 1
769 1 36 VAL MG1 1 37 THR HB . . 4.860 4.720 4.636 4.820 . 0 0 "[ . 1 . 2]" 1
770 1 36 VAL MG1 1 38 TRP H . . 4.470 3.962 3.783 4.076 . 0 0 "[ . 1 . 2]" 1
771 1 36 VAL MG1 1 38 TRP HA . . 5.050 4.563 4.457 4.659 . 0 0 "[ . 1 . 2]" 1
772 1 36 VAL MG1 1 38 TRP HB3 . . 4.220 3.438 3.367 3.531 . 0 0 "[ . 1 . 2]" 1
773 1 36 VAL MG1 1 38 TRP HE3 . . 3.060 2.360 2.207 2.492 . 0 0 "[ . 1 . 2]" 1
774 1 36 VAL MG1 1 38 TRP HZ3 . . 3.630 3.387 3.223 3.551 . 0 0 "[ . 1 . 2]" 1
775 1 36 VAL MG1 1 53 VAL MG1 . . 3.210 2.983 2.801 3.169 . 0 0 "[ . 1 . 2]" 1
776 1 36 VAL MG1 1 78 VAL H . . 4.110 4.035 3.866 4.100 . 0 0 "[ . 1 . 2]" 1
777 1 36 VAL MG1 1 80 ILE HG13 . . 4.490 3.886 3.633 4.090 . 0 0 "[ . 1 . 2]" 1
778 1 36 VAL MG1 1 91 PHE HB2 . . 4.120 3.343 3.135 3.562 . 0 0 "[ . 1 . 2]" 1
779 1 36 VAL MG1 1 91 PHE HB3 . . 3.970 3.008 2.777 3.211 . 0 0 "[ . 1 . 2]" 1
780 1 36 VAL MG1 1 91 PHE QD . . 4.220 3.951 3.651 4.128 . 0 0 "[ . 1 . 2]" 1
781 1 36 VAL MG1 1 93 VAL MG1 . . 5.020 4.849 4.683 4.999 . 0 0 "[ . 1 . 2]" 1
782 1 36 VAL MG1 1 93 VAL MG2 . . 3.230 3.040 2.960 3.142 . 0 0 "[ . 1 . 2]" 1
783 1 36 VAL MG2 1 37 THR H . . 4.070 3.982 3.910 4.056 . 0 0 "[ . 1 . 2]" 1
784 1 36 VAL MG2 1 38 TRP HZ3 . . 5.500 5.113 4.908 5.220 . 0 0 "[ . 1 . 2]" 1
785 1 36 VAL MG2 1 53 VAL MG1 . . 3.430 3.253 3.117 3.377 . 0 0 "[ . 1 . 2]" 1
786 1 36 VAL MG2 1 78 VAL H . . 4.800 4.720 4.548 4.798 . 0 0 "[ . 1 . 2]" 1
787 1 36 VAL MG2 1 78 VAL MG2 . . 4.020 3.899 3.784 3.999 . 0 0 "[ . 1 . 2]" 1
788 1 36 VAL MG2 1 79 GLU HA . . 5.090 4.115 3.861 4.283 . 0 0 "[ . 1 . 2]" 1
789 1 36 VAL MG2 1 80 ILE H . . 4.010 3.124 2.946 3.425 . 0 0 "[ . 1 . 2]" 1
790 1 36 VAL MG2 1 80 ILE HB . . 3.770 3.078 2.785 3.256 . 0 0 "[ . 1 . 2]" 1
791 1 36 VAL MG2 1 80 ILE MD . . 3.560 3.372 3.237 3.487 . 0 0 "[ . 1 . 2]" 1
792 1 36 VAL MG2 1 80 ILE HG12 . . 2.970 2.192 2.011 2.564 . 0 0 "[ . 1 . 2]" 1
793 1 36 VAL MG2 1 80 ILE HG13 . . 3.490 2.320 2.049 2.492 . 0 0 "[ . 1 . 2]" 1
794 1 36 VAL MG2 1 91 PHE HB2 . . 4.460 3.278 3.054 3.486 . 0 0 "[ . 1 . 2]" 1
795 1 36 VAL MG2 1 91 PHE HB3 . . 4.390 3.070 2.846 3.373 . 0 0 "[ . 1 . 2]" 1
796 1 36 VAL MG2 1 91 PHE QD . . 3.880 3.049 2.580 3.335 . 0 0 "[ . 1 . 2]" 1
797 1 36 VAL MG2 1 91 PHE QE . . 3.970 3.670 3.300 3.939 . 0 0 "[ . 1 . 2]" 1
798 1 36 VAL MG2 1 92 ARG H . . 5.500 5.226 4.972 5.373 . 0 0 "[ . 1 . 2]" 1
799 1 37 THR H 1 37 THR HB . . 3.240 2.737 2.690 2.837 . 0 0 "[ . 1 . 2]" 1
800 1 37 THR H 1 37 THR MG . . 3.970 3.894 3.857 3.935 . 0 0 "[ . 1 . 2]" 1
801 1 37 THR H 1 38 TRP H . . 4.260 4.248 4.201 4.274 0.014 15 0 "[ . 1 . 2]" 1
802 1 37 THR H 1 38 TRP HE3 . . 4.360 4.150 4.128 4.185 . 0 0 "[ . 1 . 2]" 1
803 1 37 THR H 1 38 TRP HZ3 . . 5.500 5.485 5.432 5.509 0.009 9 0 "[ . 1 . 2]" 1
804 1 37 THR HA 1 37 THR MG . . 3.160 2.357 2.242 2.474 . 0 0 "[ . 1 . 2]" 1
805 1 37 THR HA 1 38 TRP H . . 2.760 2.143 2.140 2.147 . 0 0 "[ . 1 . 2]" 1
806 1 37 THR HA 1 38 TRP HE3 . . 4.210 2.849 2.749 2.993 . 0 0 "[ . 1 . 2]" 1
807 1 37 THR HA 1 77 SER HB2 . . 4.740 2.430 2.216 2.606 . 0 0 "[ . 1 . 2]" 1
808 1 37 THR HA 1 77 SER HB3 . . 4.780 4.002 3.853 4.145 . 0 0 "[ . 1 . 2]" 1
809 1 37 THR HA 1 78 VAL H . . 4.720 3.696 3.621 3.754 . 0 0 "[ . 1 . 2]" 1
810 1 37 THR HB 1 38 TRP H . . 4.280 4.228 4.146 4.270 . 0 0 "[ . 1 . 2]" 1
811 1 37 THR HB 1 77 SER HA . . 5.230 4.962 4.812 5.130 . 0 0 "[ . 1 . 2]" 1
812 1 37 THR HB 1 77 SER HB2 . . 4.810 3.813 3.730 3.910 . 0 0 "[ . 1 . 2]" 1
813 1 37 THR HB 1 77 SER HB3 . . 5.500 5.486 5.396 5.506 0.006 9 0 "[ . 1 . 2]" 1
814 1 37 THR MG 1 38 TRP H . . 3.070 2.708 2.441 2.879 . 0 0 "[ . 1 . 2]" 1
815 1 37 THR MG 1 38 TRP HA . . 3.960 3.700 3.471 3.933 . 0 0 "[ . 1 . 2]" 1
816 1 37 THR MG 1 38 TRP HE3 . . 4.810 4.390 4.215 4.481 . 0 0 "[ . 1 . 2]" 1
817 1 37 THR MG 1 38 TRP HZ3 . . 5.500 5.311 5.160 5.477 . 0 0 "[ . 1 . 2]" 1
818 1 37 THR MG 1 76 LEU HB3 . . 3.900 3.650 3.487 3.777 . 0 0 "[ . 1 . 2]" 1
819 1 37 THR MG 1 77 SER HA . . 4.290 3.438 3.253 3.611 . 0 0 "[ . 1 . 2]" 1
820 1 37 THR MG 1 77 SER HB2 . . 3.340 2.005 1.926 2.158 . 0 0 "[ . 1 . 2]" 1
821 1 37 THR MG 1 77 SER HB3 . . 3.430 3.205 2.974 3.445 0.015 5 0 "[ . 1 . 2]" 1
822 1 37 THR MG 1 78 VAL H . . 5.190 5.086 4.986 5.204 0.014 19 0 "[ . 1 . 2]" 1
823 1 38 TRP H 1 38 TRP HE3 . . 3.660 2.295 2.206 2.443 . 0 0 "[ . 1 . 2]" 1
824 1 38 TRP H 1 39 ILE H . . 4.550 4.474 4.463 4.489 . 0 0 "[ . 1 . 2]" 1
825 1 38 TRP H 1 39 ILE MD . . 4.960 4.348 4.150 4.529 . 0 0 "[ . 1 . 2]" 1
826 1 38 TRP H 1 76 LEU HA . . 4.630 4.116 3.977 4.203 . 0 0 "[ . 1 . 2]" 1
827 1 38 TRP H 1 76 LEU HB2 . . 4.910 4.511 4.339 4.657 . 0 0 "[ . 1 . 2]" 1
828 1 38 TRP H 1 76 LEU HB3 . . 3.920 3.617 3.526 3.703 . 0 0 "[ . 1 . 2]" 1
829 1 38 TRP H 1 76 LEU MD1 . . 5.500 5.243 5.147 5.330 . 0 0 "[ . 1 . 2]" 1
830 1 38 TRP H 1 76 LEU MD2 . . 4.980 4.953 4.883 4.985 0.005 13 0 "[ . 1 . 2]" 1
831 1 38 TRP H 1 77 SER HA . . 4.350 3.309 3.209 3.387 . 0 0 "[ . 1 . 2]" 1
832 1 38 TRP H 1 77 SER HB2 . . 4.730 3.935 3.654 4.101 . 0 0 "[ . 1 . 2]" 1
833 1 38 TRP H 1 77 SER HB3 . . 5.500 5.235 5.091 5.412 . 0 0 "[ . 1 . 2]" 1
834 1 38 TRP H 1 78 VAL H . . 5.110 5.057 5.005 5.096 . 0 0 "[ . 1 . 2]" 1
835 1 38 TRP H 1 78 VAL MG1 . . 5.500 5.487 5.407 5.503 0.003 17 0 "[ . 1 . 2]" 1
836 1 38 TRP HA 1 38 TRP HE3 . . 4.840 4.161 4.127 4.212 . 0 0 "[ . 1 . 2]" 1
837 1 38 TRP HA 1 39 ILE H . . 2.880 2.480 2.457 2.491 . 0 0 "[ . 1 . 2]" 1
838 1 38 TRP HA 1 39 ILE HB . . 4.790 4.691 4.656 4.723 . 0 0 "[ . 1 . 2]" 1
839 1 38 TRP HA 1 39 ILE MD . . 4.830 4.163 3.981 4.350 . 0 0 "[ . 1 . 2]" 1
840 1 38 TRP HA 1 39 ILE HG12 . . 4.940 3.199 3.167 3.246 . 0 0 "[ . 1 . 2]" 1
841 1 38 TRP HA 1 39 ILE HG13 . . 4.950 4.883 4.836 4.946 . 0 0 "[ . 1 . 2]" 1
842 1 38 TRP HA 1 39 ILE MG . . 5.500 5.418 5.407 5.429 . 0 0 "[ . 1 . 2]" 1
843 1 38 TRP HA 1 93 VAL MG2 . . 4.730 4.171 4.047 4.258 . 0 0 "[ . 1 . 2]" 1
844 1 38 TRP HB2 1 39 ILE H . . 3.570 2.313 2.289 2.356 . 0 0 "[ . 1 . 2]" 1
845 1 38 TRP HB2 1 93 VAL MG1 . . 4.430 3.448 3.290 3.644 . 0 0 "[ . 1 . 2]" 1
846 1 38 TRP HB2 1 93 VAL MG2 . . 3.860 2.830 2.717 2.943 . 0 0 "[ . 1 . 2]" 1
847 1 38 TRP HB3 1 38 TRP HE3 . . 4.150 2.691 2.652 2.713 . 0 0 "[ . 1 . 2]" 1
848 1 38 TRP HB3 1 39 ILE H . . 3.910 3.743 3.720 3.767 . 0 0 "[ . 1 . 2]" 1
849 1 38 TRP HB3 1 93 VAL MG1 . . 4.310 3.660 3.538 3.807 . 0 0 "[ . 1 . 2]" 1
850 1 38 TRP HB3 1 93 VAL MG2 . . 3.850 2.094 1.983 2.208 . 0 0 "[ . 1 . 2]" 1
851 1 38 TRP HD1 1 39 ILE H . . 4.170 3.347 3.279 3.424 . 0 0 "[ . 1 . 2]" 1
852 1 38 TRP HD1 1 39 ILE HA . . 4.650 3.874 3.747 3.941 . 0 0 "[ . 1 . 2]" 1
853 1 38 TRP HD1 1 40 PRO HA . . 4.010 3.634 3.597 3.670 . 0 0 "[ . 1 . 2]" 1
854 1 38 TRP HD1 1 40 PRO HB2 . . 5.270 5.147 5.060 5.257 . 0 0 "[ . 1 . 2]" 1
855 1 38 TRP HD1 1 40 PRO HB3 . . 4.400 3.597 3.524 3.726 . 0 0 "[ . 1 . 2]" 1
856 1 38 TRP HD1 1 40 PRO HD2 . . 4.600 4.242 4.057 4.369 . 0 0 "[ . 1 . 2]" 1
857 1 38 TRP HD1 1 40 PRO HD3 . . 4.490 2.661 2.459 2.837 . 0 0 "[ . 1 . 2]" 1
858 1 38 TRP HD1 1 40 PRO HG2 . . 5.500 5.255 5.095 5.405 . 0 0 "[ . 1 . 2]" 1
859 1 38 TRP HD1 1 40 PRO HG3 . . 4.620 4.357 4.187 4.562 . 0 0 "[ . 1 . 2]" 1
860 1 38 TRP HD1 1 76 LEU MD1 . . 5.500 5.254 5.063 5.432 . 0 0 "[ . 1 . 2]" 1
861 1 38 TRP HD1 1 76 LEU MD2 . . 4.200 3.995 3.823 4.142 . 0 0 "[ . 1 . 2]" 1
862 1 38 TRP HD1 1 93 VAL MG1 . . 4.260 2.579 2.430 2.805 . 0 0 "[ . 1 . 2]" 1
863 1 38 TRP HE1 1 40 PRO HG3 . . 5.010 3.813 3.626 3.989 . 0 0 "[ . 1 . 2]" 1
864 1 38 TRP HE1 1 48 ILE MD . . 5.190 4.728 4.540 4.969 . 0 0 "[ . 1 . 2]" 1
865 1 38 TRP HE1 1 51 PHE HD1 . . 4.930 3.794 3.657 3.915 . 0 0 "[ . 1 . 2]" 1
866 1 38 TRP HE1 1 51 PHE HD2 . . 5.130 3.656 3.394 3.797 . 0 0 "[ . 1 . 2]" 1
867 1 38 TRP HE1 1 51 PHE QE . . 4.260 3.224 3.047 3.388 . 0 0 "[ . 1 . 2]" 1
868 1 38 TRP HE1 1 71 ILE MG . . 5.000 4.915 4.774 5.003 0.003 5 0 "[ . 1 . 2]" 1
869 1 38 TRP HE1 1 76 LEU HA . . 4.250 3.604 3.388 3.765 . 0 0 "[ . 1 . 2]" 1
870 1 38 TRP HE1 1 76 LEU HB3 . . 5.500 4.665 4.500 4.914 . 0 0 "[ . 1 . 2]" 1
871 1 38 TRP HE1 1 76 LEU MD1 . . 5.500 5.268 5.086 5.407 . 0 0 "[ . 1 . 2]" 1
872 1 38 TRP HE1 1 76 LEU MD2 . . 3.350 3.173 2.896 3.351 0.001 5 0 "[ . 1 . 2]" 1
873 1 38 TRP HE1 1 93 VAL MG1 . . 4.110 2.776 2.652 2.904 . 0 0 "[ . 1 . 2]" 1
874 1 38 TRP HE3 1 53 VAL MG2 . . 4.180 4.111 3.934 4.181 0.001 12 0 "[ . 1 . 2]" 1
875 1 38 TRP HE3 1 78 VAL MG2 . . 4.400 4.344 4.224 4.402 0.002 9 0 "[ . 1 . 2]" 1
876 1 38 TRP HE3 1 93 VAL MG2 . . 3.710 2.920 2.805 3.052 . 0 0 "[ . 1 . 2]" 1
877 1 38 TRP HH2 1 53 VAL MG2 . . 4.370 3.879 3.643 4.087 . 0 0 "[ . 1 . 2]" 1
878 1 38 TRP HH2 1 68 THR MG . . 5.500 4.691 4.508 4.860 . 0 0 "[ . 1 . 2]" 1
879 1 38 TRP HH2 1 71 ILE MD . . 3.240 2.086 1.977 2.260 . 0 0 "[ . 1 . 2]" 1
880 1 38 TRP HH2 1 71 ILE MG . . 3.330 2.216 2.007 2.325 . 0 0 "[ . 1 . 2]" 1
881 1 38 TRP HH2 1 76 LEU HA . . 4.620 4.017 3.884 4.226 . 0 0 "[ . 1 . 2]" 1
882 1 38 TRP HH2 1 77 SER H . . 4.170 3.868 3.774 3.994 . 0 0 "[ . 1 . 2]" 1
883 1 38 TRP HH2 1 78 VAL HB . . 4.730 4.656 4.584 4.716 . 0 0 "[ . 1 . 2]" 1
884 1 38 TRP HH2 1 78 VAL MG1 . . 3.140 1.932 1.884 2.045 . 0 0 "[ . 1 . 2]" 1
885 1 38 TRP HZ2 1 51 PHE HB2 . . 4.290 2.936 2.736 3.171 . 0 0 "[ . 1 . 2]" 1
886 1 38 TRP HZ2 1 51 PHE HB3 . . 4.100 3.502 3.247 3.772 . 0 0 "[ . 1 . 2]" 1
887 1 38 TRP HZ2 1 51 PHE HD2 . . 3.810 2.402 2.210 2.603 . 0 0 "[ . 1 . 2]" 1
888 1 38 TRP HZ2 1 53 VAL MG2 . . 4.860 4.663 4.425 4.797 . 0 0 "[ . 1 . 2]" 1
889 1 38 TRP HZ2 1 71 ILE HB . . 4.650 3.741 3.535 3.869 . 0 0 "[ . 1 . 2]" 1
890 1 38 TRP HZ2 1 71 ILE MD . . 3.870 3.234 3.011 3.371 . 0 0 "[ . 1 . 2]" 1
891 1 38 TRP HZ2 1 71 ILE MG . . 3.390 2.464 2.287 2.557 . 0 0 "[ . 1 . 2]" 1
892 1 38 TRP HZ2 1 76 LEU HA . . 3.950 3.146 2.985 3.329 . 0 0 "[ . 1 . 2]" 1
893 1 38 TRP HZ2 1 76 LEU MD2 . . 4.020 3.810 3.660 3.987 . 0 0 "[ . 1 . 2]" 1
894 1 38 TRP HZ2 1 77 SER H . . 5.070 4.796 4.658 4.915 . 0 0 "[ . 1 . 2]" 1
895 1 38 TRP HZ2 1 78 VAL MG1 . . 4.210 3.911 3.838 3.999 . 0 0 "[ . 1 . 2]" 1
896 1 38 TRP HZ2 1 78 VAL MG2 . . 5.370 5.192 5.086 5.296 . 0 0 "[ . 1 . 2]" 1
897 1 38 TRP HZ3 1 53 VAL MG1 . . 5.230 4.908 4.603 5.200 . 0 0 "[ . 1 . 2]" 1
898 1 38 TRP HZ3 1 53 VAL MG2 . . 3.930 3.541 3.338 3.671 . 0 0 "[ . 1 . 2]" 1
899 1 38 TRP HZ3 1 68 THR MG . . 5.360 5.001 4.812 5.147 . 0 0 "[ . 1 . 2]" 1
900 1 38 TRP HZ3 1 71 ILE MD . . 4.920 3.593 3.430 3.705 . 0 0 "[ . 1 . 2]" 1
901 1 38 TRP HZ3 1 77 SER HA . . 4.230 2.585 2.411 2.662 . 0 0 "[ . 1 . 2]" 1
902 1 38 TRP HZ3 1 77 SER HB2 . . 5.200 4.904 4.789 5.007 . 0 0 "[ . 1 . 2]" 1
903 1 38 TRP HZ3 1 77 SER HB3 . . 5.500 5.423 5.238 5.502 0.002 4 0 "[ . 1 . 2]" 1
904 1 38 TRP HZ3 1 78 VAL H . . 3.380 2.425 2.351 2.527 . 0 0 "[ . 1 . 2]" 1
905 1 38 TRP HZ3 1 78 VAL MG1 . . 4.180 2.410 2.300 2.506 . 0 0 "[ . 1 . 2]" 1
906 1 38 TRP HZ3 1 78 VAL MG2 . . 3.200 2.413 2.233 2.473 . 0 0 "[ . 1 . 2]" 1
907 1 38 TRP HZ3 1 80 ILE MD . . 4.910 4.676 4.472 4.844 . 0 0 "[ . 1 . 2]" 1
908 1 39 ILE H 1 39 ILE HB . . 3.200 2.831 2.800 2.862 . 0 0 "[ . 1 . 2]" 1
909 1 39 ILE H 1 39 ILE MD . . 3.960 3.868 3.738 3.942 . 0 0 "[ . 1 . 2]" 1
910 1 39 ILE H 1 39 ILE HG12 . . 3.440 2.821 2.781 2.858 . 0 0 "[ . 1 . 2]" 1
911 1 39 ILE H 1 39 ILE HG13 . . 4.300 4.144 4.086 4.190 . 0 0 "[ . 1 . 2]" 1
912 1 39 ILE H 1 39 ILE MG . . 3.950 3.931 3.916 3.942 . 0 0 "[ . 1 . 2]" 1
913 1 39 ILE H 1 40 PRO HA . . 4.830 4.728 4.689 4.760 . 0 0 "[ . 1 . 2]" 1
914 1 39 ILE H 1 40 PRO HD2 . . 4.660 4.563 4.531 4.602 . 0 0 "[ . 1 . 2]" 1
915 1 39 ILE H 1 40 PRO HD3 . . 4.570 4.106 4.047 4.180 . 0 0 "[ . 1 . 2]" 1
916 1 39 ILE H 1 93 VAL MG2 . . 4.970 4.796 4.657 4.900 . 0 0 "[ . 1 . 2]" 1
917 1 39 ILE HA 1 39 ILE MD . . 3.620 2.158 2.017 2.279 . 0 0 "[ . 1 . 2]" 1
918 1 39 ILE HA 1 39 ILE HG12 . . 3.720 3.021 2.952 3.107 . 0 0 "[ . 1 . 2]" 1
919 1 39 ILE HA 1 39 ILE HG13 . . 4.020 3.803 3.790 3.816 . 0 0 "[ . 1 . 2]" 1
920 1 39 ILE HA 1 39 ILE MG . . 3.140 2.255 2.216 2.306 . 0 0 "[ . 1 . 2]" 1
921 1 39 ILE HA 1 40 PRO HD2 . . 3.140 1.919 1.914 1.928 . 0 0 "[ . 1 . 2]" 1
922 1 39 ILE HA 1 40 PRO HD3 . . 3.300 2.430 2.397 2.447 . 0 0 "[ . 1 . 2]" 1
923 1 39 ILE HA 1 40 PRO HG2 . . 4.180 4.125 4.121 4.135 . 0 0 "[ . 1 . 2]" 1
924 1 39 ILE HA 1 40 PRO HG3 . . 4.470 4.348 4.335 4.356 . 0 0 "[ . 1 . 2]" 1
925 1 39 ILE HA 1 76 LEU MD1 . . 3.710 2.976 2.768 3.200 . 0 0 "[ . 1 . 2]" 1
926 1 39 ILE HA 1 76 LEU MD2 . . 3.840 3.566 3.354 3.741 . 0 0 "[ . 1 . 2]" 1
927 1 39 ILE HB 1 39 ILE MD . . 3.230 3.212 3.203 3.221 . 0 0 "[ . 1 . 2]" 1
928 1 39 ILE HB 1 40 PRO HD2 . . 4.500 4.480 4.418 4.506 0.006 4 0 "[ . 1 . 2]" 1
929 1 39 ILE HB 1 40 PRO HD3 . . 5.160 5.083 5.066 5.089 . 0 0 "[ . 1 . 2]" 1
930 1 39 ILE MD 1 39 ILE MG . . 2.520 1.967 1.904 2.035 . 0 0 "[ . 1 . 2]" 1
931 1 39 ILE MD 1 40 PRO HD2 . . 4.280 3.156 3.068 3.268 . 0 0 "[ . 1 . 2]" 1
932 1 39 ILE MD 1 40 PRO HD3 . . 4.380 4.050 3.956 4.141 . 0 0 "[ . 1 . 2]" 1
933 1 39 ILE MD 1 40 PRO HG2 . . 5.320 5.076 4.992 5.144 . 0 0 "[ . 1 . 2]" 1
934 1 39 ILE MD 1 40 PRO HG3 . . 5.500 5.459 5.378 5.501 0.001 20 0 "[ . 1 . 2]" 1
935 1 39 ILE HG12 1 40 PRO HD2 . . 5.210 4.892 4.815 4.989 . 0 0 "[ . 1 . 2]" 1
936 1 39 ILE HG12 1 40 PRO HD3 . . 5.480 5.248 5.182 5.323 . 0 0 "[ . 1 . 2]" 1
937 1 39 ILE HG13 1 39 ILE MG . . 3.200 2.436 2.393 2.471 . 0 0 "[ . 1 . 2]" 1
938 1 39 ILE MG 1 40 PRO HA . . 4.530 4.418 4.348 4.460 . 0 0 "[ . 1 . 2]" 1
939 1 39 ILE MG 1 40 PRO HD2 . . 3.290 2.498 2.347 2.585 . 0 0 "[ . 1 . 2]" 1
940 1 39 ILE MG 1 40 PRO HD3 . . 3.880 3.810 3.702 3.859 . 0 0 "[ . 1 . 2]" 1
941 1 39 ILE MG 1 40 PRO HG2 . . 4.090 3.787 3.658 3.855 . 0 0 "[ . 1 . 2]" 1
942 1 39 ILE MG 1 40 PRO HG3 . . 4.780 4.762 4.636 4.796 0.016 14 0 "[ . 1 . 2]" 1
943 1 39 ILE MG 1 41 ARG HD2 . . 4.640 3.303 3.018 4.007 . 0 0 "[ . 1 . 2]" 1
944 1 39 ILE MG 1 41 ARG HD3 . . 4.590 3.182 2.869 3.524 . 0 0 "[ . 1 . 2]" 1
945 1 39 ILE MG 1 76 LEU MD2 . . 4.600 4.362 4.166 4.475 . 0 0 "[ . 1 . 2]" 1
946 1 40 PRO HA 1 41 ARG H . . 3.230 2.181 2.156 2.211 . 0 0 "[ . 1 . 2]" 1
947 1 40 PRO HB2 1 41 ARG H . . 3.930 3.350 3.190 3.525 . 0 0 "[ . 1 . 2]" 1
948 1 40 PRO HB2 1 48 ILE MD . . 3.770 2.773 2.571 3.059 . 0 0 "[ . 1 . 2]" 1
949 1 40 PRO HB2 1 51 PHE QE . . 4.090 3.874 3.735 3.986 . 0 0 "[ . 1 . 2]" 1
950 1 40 PRO HB2 1 76 LEU MD2 . . 4.690 4.330 4.207 4.456 . 0 0 "[ . 1 . 2]" 1
951 1 40 PRO HB3 1 41 ARG H . . 4.210 3.881 3.780 3.995 . 0 0 "[ . 1 . 2]" 1
952 1 40 PRO HB3 1 48 ILE MD . . 3.180 2.973 2.815 3.159 . 0 0 "[ . 1 . 2]" 1
953 1 40 PRO HB3 1 48 ILE MG . . 5.500 4.849 4.695 5.047 . 0 0 "[ . 1 . 2]" 1
954 1 40 PRO HB3 1 51 PHE QE . . 3.810 2.740 2.564 2.939 . 0 0 "[ . 1 . 2]" 1
955 1 40 PRO HB3 1 51 PHE HZ . . 4.530 2.661 2.489 2.772 . 0 0 "[ . 1 . 2]" 1
956 1 40 PRO HB3 1 76 LEU MD2 . . 4.360 3.819 3.687 4.007 . 0 0 "[ . 1 . 2]" 1
957 1 40 PRO HD2 1 76 LEU HB3 . . 4.620 3.577 3.504 3.642 . 0 0 "[ . 1 . 2]" 1
958 1 40 PRO HD2 1 76 LEU MD1 . . 3.550 2.100 1.980 2.274 . 0 0 "[ . 1 . 2]" 1
959 1 40 PRO HD2 1 76 LEU MD2 . . 3.640 2.530 2.326 2.698 . 0 0 "[ . 1 . 2]" 1
960 1 40 PRO HD3 1 51 PHE QE . . 5.000 4.459 4.296 4.541 . 0 0 "[ . 1 . 2]" 1
961 1 40 PRO HD3 1 76 LEU MD1 . . 3.460 3.080 2.897 3.278 . 0 0 "[ . 1 . 2]" 1
962 1 40 PRO HD3 1 76 LEU MD2 . . 3.380 2.077 1.972 2.338 . 0 0 "[ . 1 . 2]" 1
963 1 40 PRO HG2 1 51 PHE QE . . 4.920 4.829 4.604 4.923 0.003 8 0 "[ . 1 . 2]" 1
964 1 40 PRO HG2 1 76 LEU MD1 . . 3.950 3.295 3.105 3.613 . 0 0 "[ . 1 . 2]" 1
965 1 40 PRO HG2 1 76 LEU MD2 . . 3.540 2.980 2.742 3.092 . 0 0 "[ . 1 . 2]" 1
966 1 40 PRO HG3 1 48 ILE MD . . 4.100 3.524 3.309 3.839 . 0 0 "[ . 1 . 2]" 1
967 1 40 PRO HG3 1 51 PHE QE . . 3.960 3.499 3.226 3.602 . 0 0 "[ . 1 . 2]" 1
968 1 40 PRO HG3 1 76 LEU MD1 . . 3.990 3.423 3.270 3.826 . 0 0 "[ . 1 . 2]" 1
969 1 40 PRO HG3 1 76 LEU MD2 . . 3.480 2.116 1.942 2.296 . 0 0 "[ . 1 . 2]" 1
970 1 41 ARG H 1 41 ARG HB2 . . 3.420 2.820 2.706 2.868 . 0 0 "[ . 1 . 2]" 1
971 1 41 ARG H 1 41 ARG HB3 . . 3.830 3.715 3.660 3.762 . 0 0 "[ . 1 . 2]" 1
972 1 41 ARG H 1 41 ARG HD2 . . 4.920 3.476 3.052 4.303 . 0 0 "[ . 1 . 2]" 1
973 1 41 ARG H 1 41 ARG HD3 . . 4.590 3.608 3.255 3.766 . 0 0 "[ . 1 . 2]" 1
974 1 41 ARG H 1 41 ARG HG2 . . 3.790 2.187 2.070 2.317 . 0 0 "[ . 1 . 2]" 1
975 1 41 ARG H 1 41 ARG HG3 . . 4.330 3.732 3.612 3.850 . 0 0 "[ . 1 . 2]" 1
976 1 41 ARG H 1 42 GLY H . . 3.730 2.594 2.488 2.697 . 0 0 "[ . 1 . 2]" 1
977 1 41 ARG H 1 42 GLY HA3 . . 5.160 4.918 4.823 5.045 . 0 0 "[ . 1 . 2]" 1
978 1 41 ARG H 1 48 ILE MD . . 5.250 4.774 4.596 5.012 . 0 0 "[ . 1 . 2]" 1
979 1 41 ARG H 1 95 ALA MB . . 5.500 5.257 5.124 5.384 . 0 0 "[ . 1 . 2]" 1
980 1 41 ARG HA 1 41 ARG HD2 . . 3.640 2.213 2.060 2.767 . 0 0 "[ . 1 . 2]" 1
981 1 41 ARG HA 1 41 ARG HD3 . . 3.710 3.534 2.734 3.749 0.039 17 0 "[ . 1 . 2]" 1
982 1 41 ARG HA 1 41 ARG HG2 . . 3.770 3.400 3.261 3.463 . 0 0 "[ . 1 . 2]" 1
983 1 41 ARG HA 1 41 ARG HG3 . . 3.980 3.891 3.862 3.930 . 0 0 "[ . 1 . 2]" 1
984 1 41 ARG HB2 1 42 GLY H . . 3.070 1.918 1.897 1.987 . 0 0 "[ . 1 . 2]" 1
985 1 41 ARG HB2 1 42 GLY HA2 . . 4.870 4.216 4.178 4.294 . 0 0 "[ . 1 . 2]" 1
986 1 41 ARG HB2 1 42 GLY HA3 . . 4.600 3.767 3.745 3.821 . 0 0 "[ . 1 . 2]" 1
987 1 41 ARG HB3 1 41 ARG HD2 . . 4.030 2.646 2.238 2.807 . 0 0 "[ . 1 . 2]" 1
988 1 41 ARG HB3 1 41 ARG HD3 . . 4.080 3.691 3.303 3.806 . 0 0 "[ . 1 . 2]" 1
989 1 41 ARG HB3 1 42 GLY H . . 3.520 3.370 3.277 3.449 . 0 0 "[ . 1 . 2]" 1
990 1 41 ARG HB3 1 42 GLY HA2 . . 4.880 4.837 4.747 4.880 . 0 0 "[ . 1 . 2]" 1
991 1 41 ARG HB3 1 42 GLY HA3 . . 4.920 4.862 4.737 4.912 . 0 0 "[ . 1 . 2]" 1
992 1 41 ARG HD2 1 42 GLY H . . 5.310 4.806 4.676 5.116 . 0 0 "[ . 1 . 2]" 1
993 1 41 ARG HD3 1 42 GLY H . . 5.430 5.378 5.105 5.455 0.025 17 0 "[ . 1 . 2]" 1
994 1 41 ARG HG2 1 42 GLY H . . 3.810 3.522 3.467 3.699 . 0 0 "[ . 1 . 2]" 1
995 1 41 ARG HG3 1 42 GLY H . . 4.380 4.179 4.088 4.259 . 0 0 "[ . 1 . 2]" 1
996 1 42 GLY H 1 43 ASN H . . 4.620 4.538 4.521 4.561 . 0 0 "[ . 1 . 2]" 1
997 1 42 GLY H 1 44 GLY H . . 5.440 5.355 5.289 5.410 . 0 0 "[ . 1 . 2]" 1
998 1 42 GLY HA2 1 43 ASN H . . 3.070 2.256 2.203 2.362 . 0 0 "[ . 1 . 2]" 1
999 1 42 GLY HA2 1 44 GLY H . . 3.910 3.752 3.665 3.884 . 0 0 "[ . 1 . 2]" 1
1000 1 42 GLY HA3 1 43 ASN H . . 3.300 2.941 2.788 3.027 . 0 0 "[ . 1 . 2]" 1
1001 1 42 GLY HA3 1 44 GLY H . . 4.470 3.377 3.340 3.415 . 0 0 "[ . 1 . 2]" 1
1002 1 42 GLY HA3 1 45 GLY H . . 5.500 5.498 5.455 5.511 0.011 12 0 "[ . 1 . 2]" 1
1003 1 43 ASN H 1 43 ASN HB3 . . 3.990 3.077 3.006 3.201 . 0 0 "[ . 1 . 2]" 1
1004 1 43 ASN H 1 43 ASN HD21 . . 4.850 4.554 4.348 4.675 . 0 0 "[ . 1 . 2]" 1
1005 1 43 ASN H 1 43 ASN HD22 . . 5.030 4.387 4.230 4.494 . 0 0 "[ . 1 . 2]" 1
1006 1 43 ASN H 1 44 GLY HA2 . . 4.810 4.401 4.258 4.520 . 0 0 "[ . 1 . 2]" 1
1007 1 43 ASN H 1 44 GLY HA3 . . 4.870 4.778 4.662 4.867 . 0 0 "[ . 1 . 2]" 1
1008 1 43 ASN H 1 45 GLY H . . 3.610 3.068 3.018 3.107 . 0 0 "[ . 1 . 2]" 1
1009 1 43 ASN H 1 48 ILE MD . . 4.990 4.792 4.662 4.892 . 0 0 "[ . 1 . 2]" 1
1010 1 43 ASN H 1 48 ILE HG13 . . 5.500 5.231 5.109 5.326 . 0 0 "[ . 1 . 2]" 1
1011 1 43 ASN HA 1 45 GLY H . . 4.560 4.293 4.168 4.390 . 0 0 "[ . 1 . 2]" 1
1012 1 43 ASN HA 1 46 PHE H . . 5.460 5.174 5.042 5.278 . 0 0 "[ . 1 . 2]" 1
1013 1 43 ASN HA 1 48 ILE H . . 5.400 4.984 4.877 5.122 . 0 0 "[ . 1 . 2]" 1
1014 1 43 ASN HA 1 48 ILE MD . . 3.510 3.123 2.844 3.276 . 0 0 "[ . 1 . 2]" 1
1015 1 43 ASN HA 1 48 ILE HG12 . . 4.850 3.208 3.095 3.338 . 0 0 "[ . 1 . 2]" 1
1016 1 43 ASN HA 1 48 ILE HG13 . . 4.760 3.286 3.127 3.506 . 0 0 "[ . 1 . 2]" 1
1017 1 43 ASN HB2 1 45 GLY H . . 4.390 3.885 3.793 4.038 . 0 0 "[ . 1 . 2]" 1
1018 1 43 ASN HB2 1 46 PHE H . . 4.050 3.917 3.792 4.000 . 0 0 "[ . 1 . 2]" 1
1019 1 43 ASN HB2 1 48 ILE H . . 3.990 2.944 2.841 3.023 . 0 0 "[ . 1 . 2]" 1
1020 1 43 ASN HB2 1 48 ILE HB . . 5.040 4.581 4.471 4.698 . 0 0 "[ . 1 . 2]" 1
1021 1 43 ASN HB2 1 48 ILE MD . . 3.690 3.497 3.387 3.628 . 0 0 "[ . 1 . 2]" 1
1022 1 43 ASN HB2 1 48 ILE HG12 . . 4.670 3.162 2.968 3.247 . 0 0 "[ . 1 . 2]" 1
1023 1 43 ASN HB2 1 48 ILE HG13 . . 4.220 2.234 2.145 2.353 . 0 0 "[ . 1 . 2]" 1
1024 1 43 ASN HB3 1 43 ASN HD22 . . 3.960 3.626 3.546 3.668 . 0 0 "[ . 1 . 2]" 1
1025 1 43 ASN HB3 1 44 GLY H . . 4.660 4.460 4.409 4.539 . 0 0 "[ . 1 . 2]" 1
1026 1 43 ASN HB3 1 45 GLY H . . 4.890 4.476 4.420 4.513 . 0 0 "[ . 1 . 2]" 1
1027 1 43 ASN HB3 1 46 PHE H . . 5.390 5.291 5.111 5.390 0.000 1 0 "[ . 1 . 2]" 1
1028 1 43 ASN HB3 1 47 PRO HA . . 4.760 4.554 4.470 4.615 . 0 0 "[ . 1 . 2]" 1
1029 1 43 ASN HB3 1 48 ILE H . . 4.190 3.571 3.420 3.652 . 0 0 "[ . 1 . 2]" 1
1030 1 43 ASN HB3 1 48 ILE HB . . 5.210 4.638 4.477 4.822 . 0 0 "[ . 1 . 2]" 1
1031 1 43 ASN HB3 1 48 ILE MD . . 3.640 2.694 2.514 2.808 . 0 0 "[ . 1 . 2]" 1
1032 1 43 ASN HB3 1 48 ILE HG12 . . 4.520 3.542 3.222 3.678 . 0 0 "[ . 1 . 2]" 1
1033 1 43 ASN HB3 1 48 ILE HG13 . . 4.280 2.345 2.202 2.485 . 0 0 "[ . 1 . 2]" 1
1034 1 43 ASN HB3 1 48 ILE MG . . 5.090 5.010 4.817 5.096 0.006 16 0 "[ . 1 . 2]" 1
1035 1 43 ASN HD21 1 47 PRO HA . . 3.890 2.555 2.379 2.804 . 0 0 "[ . 1 . 2]" 1
1036 1 43 ASN HD21 1 47 PRO HB2 . . 5.500 5.264 5.094 5.483 . 0 0 "[ . 1 . 2]" 1
1037 1 43 ASN HD21 1 48 ILE H . . 4.110 2.963 2.815 3.097 . 0 0 "[ . 1 . 2]" 1
1038 1 43 ASN HD22 1 47 PRO HA . . 4.040 3.700 3.549 3.889 . 0 0 "[ . 1 . 2]" 1
1039 1 43 ASN HD22 1 48 ILE H . . 4.970 4.620 4.477 4.758 . 0 0 "[ . 1 . 2]" 1
1040 1 44 GLY H 1 44 GLY HA2 . . 2.890 2.320 2.308 2.332 . 0 0 "[ . 1 . 2]" 1
1041 1 44 GLY H 1 45 GLY H . . 3.170 2.585 2.494 2.712 . 0 0 "[ . 1 . 2]" 1
1042 1 44 GLY H 1 45 GLY HA2 . . 4.970 4.736 4.661 4.802 . 0 0 "[ . 1 . 2]" 1
1043 1 44 GLY H 1 45 GLY HA3 . . 5.160 5.101 5.031 5.170 0.010 14 0 "[ . 1 . 2]" 1
1044 1 44 GLY H 1 46 PHE H . . 4.610 4.565 4.379 4.622 0.012 14 0 "[ . 1 . 2]" 1
1045 1 44 GLY HA2 1 46 PHE H . . 5.030 4.578 4.500 4.650 . 0 0 "[ . 1 . 2]" 1
1046 1 44 GLY HA2 1 97 ASN HD21 . . 5.500 5.497 5.422 5.508 0.008 2 0 "[ . 1 . 2]" 1
1047 1 44 GLY HA2 1 97 ASN HD22 . . 5.410 5.062 4.967 5.133 . 0 0 "[ . 1 . 2]" 1
1048 1 44 GLY HA3 1 46 PHE H . . 4.080 3.601 3.563 3.643 . 0 0 "[ . 1 . 2]" 1
1049 1 44 GLY HA3 1 97 ASN HD21 . . 5.080 3.812 3.734 3.829 . 0 0 "[ . 1 . 2]" 1
1050 1 44 GLY HA3 1 97 ASN HD22 . . 4.740 3.346 3.253 3.421 . 0 0 "[ . 1 . 2]" 1
1051 1 45 GLY H 1 45 GLY HA2 . . 2.890 2.436 2.410 2.468 . 0 0 "[ . 1 . 2]" 1
1052 1 45 GLY H 1 46 PHE H . . 2.850 2.541 2.397 2.637 . 0 0 "[ . 1 . 2]" 1
1053 1 45 GLY H 1 46 PHE HA . . 4.960 4.855 4.770 4.902 . 0 0 "[ . 1 . 2]" 1
1054 1 45 GLY H 1 46 PHE HB2 . . 5.110 4.861 4.724 4.932 . 0 0 "[ . 1 . 2]" 1
1055 1 45 GLY H 1 97 ASN HD21 . . 4.950 4.844 4.620 4.959 0.009 10 0 "[ . 1 . 2]" 1
1056 1 45 GLY H 1 97 ASN HD22 . . 5.500 5.415 5.210 5.504 0.004 8 0 "[ . 1 . 2]" 1
1057 1 45 GLY HA3 1 46 PHE H . . 3.430 3.039 2.990 3.123 . 0 0 "[ . 1 . 2]" 1
1058 1 46 PHE H 1 46 PHE HB2 . . 3.270 2.350 2.319 2.421 . 0 0 "[ . 1 . 2]" 1
1059 1 46 PHE H 1 46 PHE HB3 . . 3.540 3.533 3.522 3.564 0.024 13 0 "[ . 1 . 2]" 1
1060 1 46 PHE H 1 47 PRO HD2 . . 4.850 4.758 4.754 4.766 . 0 0 "[ . 1 . 2]" 1
1061 1 46 PHE H 1 47 PRO HD3 . . 5.500 5.079 5.060 5.085 . 0 0 "[ . 1 . 2]" 1
1062 1 46 PHE H 1 97 ASN HB3 . . 5.480 5.293 5.137 5.375 . 0 0 "[ . 1 . 2]" 1
1063 1 46 PHE H 1 97 ASN HD21 . . 3.340 3.015 2.901 3.088 . 0 0 "[ . 1 . 2]" 1
1064 1 46 PHE H 1 97 ASN HD22 . . 4.230 3.865 3.776 3.942 . 0 0 "[ . 1 . 2]" 1
1065 1 46 PHE HA 1 46 PHE QD . . 3.830 2.008 1.989 2.026 . 0 0 "[ . 1 . 2]" 1
1066 1 46 PHE HA 1 47 PRO HB3 . . 5.030 4.874 4.872 4.878 . 0 0 "[ . 1 . 2]" 1
1067 1 46 PHE HA 1 47 PRO HD2 . . 3.240 2.534 2.528 2.547 . 0 0 "[ . 1 . 2]" 1
1068 1 46 PHE HA 1 47 PRO HD3 . . 3.580 2.360 2.356 2.366 . 0 0 "[ . 1 . 2]" 1
1069 1 46 PHE HA 1 47 PRO QG . . 4.660 4.089 4.084 4.097 . 0 0 "[ . 1 . 2]" 1
1070 1 46 PHE HB2 1 47 PRO HD2 . . 4.340 3.566 3.552 3.577 . 0 0 "[ . 1 . 2]" 1
1071 1 46 PHE HB2 1 47 PRO HD3 . . 4.720 4.661 4.650 4.669 . 0 0 "[ . 1 . 2]" 1
1072 1 46 PHE HB2 1 97 ASN HB2 . . 4.120 3.539 3.411 3.616 . 0 0 "[ . 1 . 2]" 1
1073 1 46 PHE HB2 1 97 ASN HD21 . . 4.210 2.230 2.138 2.300 . 0 0 "[ . 1 . 2]" 1
1074 1 46 PHE HB2 1 97 ASN HD22 . . 4.240 3.132 3.056 3.203 . 0 0 "[ . 1 . 2]" 1
1075 1 46 PHE HB2 1 98 MET H . . 4.690 4.338 4.229 4.407 . 0 0 "[ . 1 . 2]" 1
1076 1 46 PHE HB2 1 98 MET ME . . 5.190 4.375 3.220 4.949 . 0 0 "[ . 1 . 2]" 1
1077 1 46 PHE HB2 1 98 MET QG . . 4.310 3.326 3.195 3.563 . 0 0 "[ . 1 . 2]" 1
1078 1 46 PHE HB2 1 99 LEU H . . 4.730 4.639 4.587 4.699 . 0 0 "[ . 1 . 2]" 1
1079 1 46 PHE HB2 1 99 LEU MD1 . . 4.720 2.669 2.545 2.744 . 0 0 "[ . 1 . 2]" 1
1080 1 46 PHE HB3 1 47 PRO HD2 . . 4.020 1.996 1.987 2.013 . 0 0 "[ . 1 . 2]" 1
1081 1 46 PHE HB3 1 47 PRO HD3 . . 3.860 3.441 3.433 3.456 . 0 0 "[ . 1 . 2]" 1
1082 1 46 PHE HB3 1 47 PRO QG . . 4.820 3.519 3.509 3.531 . 0 0 "[ . 1 . 2]" 1
1083 1 46 PHE HB3 1 97 ASN HA . . 5.500 5.464 5.313 5.507 0.007 1 0 "[ . 1 . 2]" 1
1084 1 46 PHE HB3 1 97 ASN HB2 . . 4.350 3.311 3.172 3.347 . 0 0 "[ . 1 . 2]" 1
1085 1 46 PHE HB3 1 97 ASN HD21 . . 4.520 3.222 3.135 3.284 . 0 0 "[ . 1 . 2]" 1
1086 1 46 PHE HB3 1 97 ASN HD22 . . 4.740 4.494 4.394 4.570 . 0 0 "[ . 1 . 2]" 1
1087 1 46 PHE HB3 1 98 MET H . . 4.180 3.839 3.742 3.906 . 0 0 "[ . 1 . 2]" 1
1088 1 46 PHE HB3 1 98 MET ME . . 4.770 3.891 2.210 4.708 . 0 0 "[ . 1 . 2]" 1
1089 1 46 PHE HB3 1 98 MET QG . . 4.160 2.914 2.613 3.463 . 0 0 "[ . 1 . 2]" 1
1090 1 46 PHE HB3 1 99 LEU H . . 5.130 5.133 5.107 5.147 0.017 15 0 "[ . 1 . 2]" 1
1091 1 46 PHE HB3 1 99 LEU MD1 . . 4.180 4.125 4.017 4.185 0.005 14 0 "[ . 1 . 2]" 1
1092 1 46 PHE HB3 1 99 LEU MD2 . . 4.760 4.549 4.312 4.724 . 0 0 "[ . 1 . 2]" 1
1093 1 46 PHE QD 1 47 PRO HD2 . . 4.220 2.009 1.996 2.038 . 0 0 "[ . 1 . 2]" 1
1094 1 46 PHE QD 1 47 PRO HD3 . . 4.040 2.250 2.196 2.281 . 0 0 "[ . 1 . 2]" 1
1095 1 46 PHE QD 1 97 ASN HD22 . . 4.730 3.753 3.648 3.825 . 0 0 "[ . 1 . 2]" 1
1096 1 46 PHE QD 1 98 MET ME . . 3.770 3.126 2.528 3.434 . 0 0 "[ . 1 . 2]" 1
1097 1 46 PHE QD 1 98 MET HG2 . . 4.740 3.206 2.710 3.487 . 0 0 "[ . 1 . 2]" 1
1098 1 46 PHE QD 1 98 MET QG . . 4.090 2.703 2.578 2.788 . 0 0 "[ . 1 . 2]" 1
1099 1 46 PHE QD 1 98 MET HG3 . . 4.740 3.093 2.705 3.765 . 0 0 "[ . 1 . 2]" 1
1100 1 46 PHE QD 1 99 LEU H . . 4.640 4.496 4.421 4.585 . 0 0 "[ . 1 . 2]" 1
1101 1 46 PHE QD 1 99 LEU MD1 . . 3.450 2.033 1.942 2.150 . 0 0 "[ . 1 . 2]" 1
1102 1 46 PHE QD 1 99 LEU MD2 . . 4.060 1.966 1.943 1.998 . 0 0 "[ . 1 . 2]" 1
1103 1 46 PHE QD 1 99 LEU HG . . 4.060 2.054 1.994 2.223 . 0 0 "[ . 1 . 2]" 1
1104 1 46 PHE QE 1 98 MET ME . . 3.460 2.650 2.327 2.977 . 0 0 "[ . 1 . 2]" 1
1105 1 46 PHE QE 1 99 LEU MD1 . . 3.480 3.163 3.061 3.250 . 0 0 "[ . 1 . 2]" 1
1106 1 46 PHE QE 1 99 LEU MD2 . . 3.670 2.080 1.974 2.283 . 0 0 "[ . 1 . 2]" 1
1107 1 46 PHE QE 1 99 LEU HG . . 4.460 4.054 3.938 4.259 . 0 0 "[ . 1 . 2]" 1
1108 1 46 PHE HZ 1 98 MET ME . . 4.620 3.017 2.601 3.666 . 0 0 "[ . 1 . 2]" 1
1109 1 46 PHE HZ 1 99 LEU MD1 . . 5.210 5.049 5.002 5.107 . 0 0 "[ . 1 . 2]" 1
1110 1 46 PHE HZ 1 99 LEU MD2 . . 4.440 4.241 4.197 4.310 . 0 0 "[ . 1 . 2]" 1
1111 1 47 PRO HA 1 48 ILE H . . 2.840 2.162 2.153 2.170 . 0 0 "[ . 1 . 2]" 1
1112 1 47 PRO HA 1 48 ILE HB . . 4.760 4.515 4.488 4.568 . 0 0 "[ . 1 . 2]" 1
1113 1 47 PRO HA 1 48 ILE MD . . 5.210 5.143 5.067 5.210 0.000 8 0 "[ . 1 . 2]" 1
1114 1 47 PRO HA 1 48 ILE HG12 . . 5.500 5.451 5.328 5.501 0.001 4 0 "[ . 1 . 2]" 1
1115 1 47 PRO HA 1 48 ILE HG13 . . 4.670 4.029 3.920 4.104 . 0 0 "[ . 1 . 2]" 1
1116 1 47 PRO HA 1 48 ILE MG . . 5.500 5.459 5.452 5.473 . 0 0 "[ . 1 . 2]" 1
1117 1 47 PRO HB2 1 48 ILE H . . 3.830 3.795 3.733 3.842 0.012 8 0 "[ . 1 . 2]" 1
1118 1 47 PRO HB2 1 48 ILE HA . . 5.500 5.130 5.096 5.171 . 0 0 "[ . 1 . 2]" 1
1119 1 47 PRO HB2 1 48 ILE HB . . 5.470 5.307 5.247 5.379 . 0 0 "[ . 1 . 2]" 1
1120 1 47 PRO HD2 1 97 ASN HD21 . . 5.500 5.117 5.037 5.171 . 0 0 "[ . 1 . 2]" 1
1121 1 47 PRO HD2 1 98 MET H . . 5.500 5.179 5.093 5.271 . 0 0 "[ . 1 . 2]" 1
1122 1 47 PRO QG 1 48 ILE H . . 4.920 4.734 4.720 4.742 . 0 0 "[ . 1 . 2]" 1
1123 1 48 ILE H 1 48 ILE HB . . 3.010 2.540 2.498 2.592 . 0 0 "[ . 1 . 2]" 1
1124 1 48 ILE H 1 48 ILE MD . . 3.660 3.535 3.468 3.580 . 0 0 "[ . 1 . 2]" 1
1125 1 48 ILE H 1 48 ILE HG12 . . 3.760 3.429 3.354 3.482 . 0 0 "[ . 1 . 2]" 1
1126 1 48 ILE H 1 48 ILE HG13 . . 3.490 2.112 2.016 2.181 . 0 0 "[ . 1 . 2]" 1
1127 1 48 ILE H 1 48 ILE MG . . 3.880 3.768 3.761 3.774 . 0 0 "[ . 1 . 2]" 1
1128 1 48 ILE H 1 49 GLN H . . 4.890 4.567 4.519 4.613 . 0 0 "[ . 1 . 2]" 1
1129 1 48 ILE H 1 73 PRO HB3 . . 4.600 4.483 4.248 4.608 0.008 11 0 "[ . 1 . 2]" 1
1130 1 48 ILE HA 1 48 ILE MD . . 3.840 3.817 3.803 3.839 . 0 0 "[ . 1 . 2]" 1
1131 1 48 ILE HA 1 48 ILE HG12 . . 3.960 2.513 2.481 2.556 . 0 0 "[ . 1 . 2]" 1
1132 1 48 ILE HA 1 48 ILE HG13 . . 4.020 2.867 2.839 2.924 . 0 0 "[ . 1 . 2]" 1
1133 1 48 ILE HA 1 48 ILE MG . . 3.320 2.415 2.353 2.442 . 0 0 "[ . 1 . 2]" 1
1134 1 48 ILE HA 1 49 GLN H . . 3.170 2.168 2.144 2.210 . 0 0 "[ . 1 . 2]" 1
1135 1 48 ILE HA 1 49 GLN HB2 . . 5.040 4.463 4.431 4.524 . 0 0 "[ . 1 . 2]" 1
1136 1 48 ILE HA 1 49 GLN HG2 . . 5.150 5.059 4.987 5.145 . 0 0 "[ . 1 . 2]" 1
1137 1 48 ILE HA 1 49 GLN HG3 . . 4.590 4.178 3.920 4.365 . 0 0 "[ . 1 . 2]" 1
1138 1 48 ILE HA 1 50 SER H . . 4.370 4.181 4.050 4.337 . 0 0 "[ . 1 . 2]" 1
1139 1 48 ILE HA 1 95 ALA MB . . 4.710 4.454 4.364 4.597 . 0 0 "[ . 1 . 2]" 1
1140 1 48 ILE HA 1 96 LEU H . . 4.990 4.895 4.763 4.979 . 0 0 "[ . 1 . 2]" 1
1141 1 48 ILE HA 1 97 ASN HA . . 4.100 3.398 3.173 3.573 . 0 0 "[ . 1 . 2]" 1
1142 1 48 ILE HA 1 97 ASN HB2 . . 4.470 3.297 3.135 3.441 . 0 0 "[ . 1 . 2]" 1
1143 1 48 ILE HA 1 97 ASN HB3 . . 4.230 2.608 2.504 2.691 . 0 0 "[ . 1 . 2]" 1
1144 1 48 ILE HA 1 98 MET H . . 5.500 4.960 4.748 5.107 . 0 0 "[ . 1 . 2]" 1
1145 1 48 ILE HB 1 48 ILE MD . . 3.060 2.314 2.271 2.357 . 0 0 "[ . 1 . 2]" 1
1146 1 48 ILE HB 1 49 GLN H . . 5.170 4.185 4.062 4.275 . 0 0 "[ . 1 . 2]" 1
1147 1 48 ILE HB 1 50 SER H . . 5.490 5.088 4.956 5.280 . 0 0 "[ . 1 . 2]" 1
1148 1 48 ILE HB 1 51 PHE QE . . 5.040 4.237 4.084 4.334 . 0 0 "[ . 1 . 2]" 1
1149 1 48 ILE HB 1 73 PRO HB3 . . 4.340 2.649 2.510 2.795 . 0 0 "[ . 1 . 2]" 1
1150 1 48 ILE MD 1 48 ILE MG . . 2.880 2.059 1.983 2.164 . 0 0 "[ . 1 . 2]" 1
1151 1 48 ILE MD 1 49 GLN H . . 5.250 5.005 4.873 5.161 . 0 0 "[ . 1 . 2]" 1
1152 1 48 ILE MD 1 51 PHE HD1 . . 3.970 3.894 3.762 3.972 0.002 11 0 "[ . 1 . 2]" 1
1153 1 48 ILE MD 1 51 PHE QE . . 3.420 1.980 1.951 2.053 . 0 0 "[ . 1 . 2]" 1
1154 1 48 ILE MD 1 95 ALA HA . . 4.630 3.870 3.599 4.119 . 0 0 "[ . 1 . 2]" 1
1155 1 48 ILE MD 1 95 ALA MB . . 3.090 2.331 1.948 2.681 . 0 0 "[ . 1 . 2]" 1
1156 1 48 ILE MD 1 96 LEU H . . 4.930 4.637 4.277 4.816 . 0 0 "[ . 1 . 2]" 1
1157 1 48 ILE MD 1 97 ASN HB3 . . 5.400 5.103 4.844 5.245 . 0 0 "[ . 1 . 2]" 1
1158 1 48 ILE HG12 1 48 ILE MG . . 3.500 2.321 2.249 2.415 . 0 0 "[ . 1 . 2]" 1
1159 1 48 ILE HG12 1 49 GLN H . . 4.840 4.185 4.076 4.368 . 0 0 "[ . 1 . 2]" 1
1160 1 48 ILE HG12 1 95 ALA MB . . 3.720 2.790 2.699 2.920 . 0 0 "[ . 1 . 2]" 1
1161 1 48 ILE HG13 1 48 ILE MG . . 3.580 3.187 3.182 3.200 . 0 0 "[ . 1 . 2]" 1
1162 1 48 ILE MG 1 49 GLN H . . 3.540 2.249 1.974 2.455 . 0 0 "[ . 1 . 2]" 1
1163 1 48 ILE MG 1 49 GLN HA . . 4.600 3.835 3.735 4.016 . 0 0 "[ . 1 . 2]" 1
1164 1 48 ILE MG 1 50 SER H . . 3.060 2.374 2.272 2.564 . 0 0 "[ . 1 . 2]" 1
1165 1 48 ILE MG 1 51 PHE H . . 4.970 4.209 4.124 4.356 . 0 0 "[ . 1 . 2]" 1
1166 1 48 ILE MG 1 51 PHE HA . . 4.870 3.856 3.730 4.013 . 0 0 "[ . 1 . 2]" 1
1167 1 48 ILE MG 1 51 PHE QE . . 3.770 2.800 2.731 2.884 . 0 0 "[ . 1 . 2]" 1
1168 1 48 ILE MG 1 73 PRO HA . . 4.000 3.181 2.973 3.343 . 0 0 "[ . 1 . 2]" 1
1169 1 48 ILE MG 1 73 PRO HB2 . . 4.420 4.289 4.201 4.406 . 0 0 "[ . 1 . 2]" 1
1170 1 48 ILE MG 1 73 PRO HB3 . . 3.650 2.892 2.781 2.957 . 0 0 "[ . 1 . 2]" 1
1171 1 48 ILE MG 1 73 PRO HG2 . . 5.450 5.419 5.276 5.454 0.004 14 0 "[ . 1 . 2]" 1
1172 1 48 ILE MG 1 73 PRO HG3 . . 4.680 4.555 4.320 4.638 . 0 0 "[ . 1 . 2]" 1
1173 1 48 ILE MG 1 95 ALA HA . . 4.450 3.210 3.027 3.499 . 0 0 "[ . 1 . 2]" 1
1174 1 48 ILE MG 1 95 ALA MB . . 3.330 2.800 2.516 3.144 . 0 0 "[ . 1 . 2]" 1
1175 1 48 ILE MG 1 96 LEU H . . 3.540 2.957 2.766 3.091 . 0 0 "[ . 1 . 2]" 1
1176 1 48 ILE MG 1 97 ASN HB3 . . 4.880 3.989 3.873 4.145 . 0 0 "[ . 1 . 2]" 1
1177 1 49 GLN H 1 49 GLN HB2 . . 3.780 2.346 2.314 2.394 . 0 0 "[ . 1 . 2]" 1
1178 1 49 GLN H 1 49 GLN HB3 . . 3.780 3.590 3.571 3.620 . 0 0 "[ . 1 . 2]" 1
1179 1 49 GLN H 1 49 GLN HG2 . . 4.190 3.620 3.473 3.810 . 0 0 "[ . 1 . 2]" 1
1180 1 49 GLN H 1 49 GLN HG3 . . 3.960 2.794 2.635 2.934 . 0 0 "[ . 1 . 2]" 1
1181 1 49 GLN H 1 50 SER H . . 2.930 2.442 2.337 2.538 . 0 0 "[ . 1 . 2]" 1
1182 1 49 GLN H 1 96 LEU H . . 4.710 4.280 4.128 4.427 . 0 0 "[ . 1 . 2]" 1
1183 1 49 GLN H 1 96 LEU HB2 . . 5.360 5.050 4.895 5.146 . 0 0 "[ . 1 . 2]" 1
1184 1 49 GLN H 1 97 ASN HA . . 3.410 2.284 2.123 2.515 . 0 0 "[ . 1 . 2]" 1
1185 1 49 GLN H 1 97 ASN HB2 . . 4.650 3.650 3.506 3.806 . 0 0 "[ . 1 . 2]" 1
1186 1 49 GLN H 1 97 ASN HB3 . . 4.430 3.303 3.150 3.432 . 0 0 "[ . 1 . 2]" 1
1187 1 49 GLN H 1 98 MET H . . 4.910 4.512 4.362 4.740 . 0 0 "[ . 1 . 2]" 1
1188 1 49 GLN HA 1 49 GLN HE21 . . 5.100 4.759 4.459 5.027 . 0 0 "[ . 1 . 2]" 1
1189 1 49 GLN HA 1 49 GLN HG2 . . 3.430 2.329 2.267 2.453 . 0 0 "[ . 1 . 2]" 1
1190 1 49 GLN HA 1 49 GLN HG3 . . 3.670 3.186 3.044 3.268 . 0 0 "[ . 1 . 2]" 1
1191 1 49 GLN HA 1 73 PRO HG3 . . 4.810 4.552 4.342 4.788 . 0 0 "[ . 1 . 2]" 1
1192 1 49 GLN HB2 1 49 GLN HE21 . . 4.750 4.465 4.208 4.545 . 0 0 "[ . 1 . 2]" 1
1193 1 49 GLN HB2 1 49 GLN HE22 . . 4.930 4.829 4.721 4.889 . 0 0 "[ . 1 . 2]" 1
1194 1 49 GLN HB2 1 50 SER H . . 3.700 2.499 2.411 2.578 . 0 0 "[ . 1 . 2]" 1
1195 1 49 GLN HB2 1 50 SER QB . . 4.670 4.098 3.721 4.493 . 0 0 "[ . 1 . 2]" 1
1196 1 49 GLN HB2 1 96 LEU H . . 5.140 4.906 4.751 5.082 . 0 0 "[ . 1 . 2]" 1
1197 1 49 GLN HB3 1 49 GLN HE21 . . 4.730 4.253 3.985 4.356 . 0 0 "[ . 1 . 2]" 1
1198 1 49 GLN HB3 1 50 SER H . . 3.390 3.359 3.283 3.397 0.007 9 0 "[ . 1 . 2]" 1
1199 1 49 GLN HB3 1 50 SER QB . . 4.770 3.790 3.565 4.010 . 0 0 "[ . 1 . 2]" 1
1200 1 49 GLN HB3 1 97 ASN HA . . 4.220 4.027 3.848 4.183 . 0 0 "[ . 1 . 2]" 1
1201 1 49 GLN HE21 1 49 GLN HG2 . . 3.410 2.447 2.202 2.824 . 0 0 "[ . 1 . 2]" 1
1202 1 49 GLN HE21 1 98 MET H . . 4.790 3.485 2.959 4.399 . 0 0 "[ . 1 . 2]" 1
1203 1 49 GLN HE21 1 98 MET HA . . 4.580 3.738 3.129 4.425 . 0 0 "[ . 1 . 2]" 1
1204 1 49 GLN HE21 1 98 MET HB2 . . 4.270 3.834 3.462 4.258 . 0 0 "[ . 1 . 2]" 1
1205 1 49 GLN HE21 1 98 MET HB3 . . 4.270 2.344 1.899 3.420 . 0 0 "[ . 1 . 2]" 1
1206 1 49 GLN HE22 1 49 GLN HG2 . . 3.800 3.569 3.470 3.735 . 0 0 "[ . 1 . 2]" 1
1207 1 49 GLN HE22 1 98 MET H . . 5.020 4.333 3.962 4.992 . 0 0 "[ . 1 . 2]" 1
1208 1 49 GLN HE22 1 98 MET HA . . 4.230 3.333 2.559 3.962 . 0 0 "[ . 1 . 2]" 1
1209 1 49 GLN HE22 1 98 MET HB2 . . 4.360 3.779 3.164 4.167 . 0 0 "[ . 1 . 2]" 1
1210 1 49 GLN HE22 1 98 MET HB3 . . 4.220 2.871 2.489 3.936 . 0 0 "[ . 1 . 2]" 1
1211 1 49 GLN HE22 1 98 MET ME . . 5.500 5.250 4.564 5.501 0.001 7 0 "[ . 1 . 2]" 1
1212 1 49 GLN HG2 1 50 SER H . . 4.890 4.869 4.843 4.900 0.010 7 0 "[ . 1 . 2]" 1
1213 1 49 GLN HG2 1 97 ASN HA . . 3.950 3.783 3.694 3.899 . 0 0 "[ . 1 . 2]" 1
1214 1 49 GLN HG2 1 98 MET H . . 4.840 4.189 3.982 4.359 . 0 0 "[ . 1 . 2]" 1
1215 1 49 GLN HG3 1 50 SER H . . 4.510 4.426 4.315 4.500 . 0 0 "[ . 1 . 2]" 1
1216 1 49 GLN HG3 1 97 ASN HA . . 3.860 2.119 2.026 2.255 . 0 0 "[ . 1 . 2]" 1
1217 1 49 GLN HG3 1 97 ASN HB2 . . 5.160 3.301 3.091 3.503 . 0 0 "[ . 1 . 2]" 1
1218 1 49 GLN HG3 1 98 MET H . . 3.840 2.716 2.535 2.847 . 0 0 "[ . 1 . 2]" 1
1219 1 50 SER H 1 51 PHE H . . 4.470 4.358 4.339 4.376 . 0 0 "[ . 1 . 2]" 1
1220 1 50 SER H 1 95 ALA HA . . 5.310 5.018 4.910 5.231 . 0 0 "[ . 1 . 2]" 1
1221 1 50 SER H 1 96 LEU H . . 3.460 3.295 3.195 3.443 . 0 0 "[ . 1 . 2]" 1
1222 1 50 SER H 1 96 LEU HB2 . . 4.640 3.501 3.441 3.578 . 0 0 "[ . 1 . 2]" 1
1223 1 50 SER H 1 96 LEU HB3 . . 4.540 4.175 3.986 4.370 . 0 0 "[ . 1 . 2]" 1
1224 1 50 SER H 1 96 LEU MD1 . . 5.170 4.899 4.817 4.968 . 0 0 "[ . 1 . 2]" 1
1225 1 50 SER H 1 96 LEU MD2 . . 5.300 5.257 5.146 5.308 0.008 9 0 "[ . 1 . 2]" 1
1226 1 50 SER H 1 97 ASN HA . . 4.040 3.894 3.792 4.038 . 0 0 "[ . 1 . 2]" 1
1227 1 50 SER HA 1 71 ILE H . . 4.520 4.267 3.998 4.479 . 0 0 "[ . 1 . 2]" 1
1228 1 50 SER QB 1 51 PHE H . . 3.270 2.471 2.381 2.556 . 0 0 "[ . 1 . 2]" 1
1229 1 50 SER QB 1 70 ALA HA . . 4.010 2.482 2.095 2.708 . 0 0 "[ . 1 . 2]" 1
1230 1 50 SER QB 1 70 ALA MB . . 4.140 3.912 3.662 4.114 . 0 0 "[ . 1 . 2]" 1
1231 1 50 SER QB 1 71 ILE H . . 3.820 2.861 2.710 3.057 . 0 0 "[ . 1 . 2]" 1
1232 1 50 SER QB 1 71 ILE HB . . 4.530 4.281 4.175 4.434 . 0 0 "[ . 1 . 2]" 1
1233 1 50 SER QB 1 96 LEU MD1 . . 5.110 4.698 4.303 5.112 0.002 12 0 "[ . 1 . 2]" 1
1234 1 50 SER HB2 1 51 PHE H . . 3.960 3.137 2.408 3.940 . 0 0 "[ . 1 . 2]" 1
1235 1 50 SER HB3 1 51 PHE H . . 3.960 3.150 2.467 3.910 . 0 0 "[ . 1 . 2]" 1
1236 1 51 PHE H 1 51 PHE HB2 . . 4.140 2.456 2.435 2.486 . 0 0 "[ . 1 . 2]" 1
1237 1 51 PHE H 1 51 PHE HB3 . . 3.820 3.669 3.654 3.686 . 0 0 "[ . 1 . 2]" 1
1238 1 51 PHE H 1 51 PHE HD2 . . 3.920 3.376 3.291 3.552 . 0 0 "[ . 1 . 2]" 1
1239 1 51 PHE H 1 71 ILE H . . 3.760 2.787 2.554 2.991 . 0 0 "[ . 1 . 2]" 1
1240 1 51 PHE H 1 71 ILE HA . . 4.640 4.520 4.370 4.616 . 0 0 "[ . 1 . 2]" 1
1241 1 51 PHE H 1 71 ILE HB . . 3.460 2.584 2.480 2.653 . 0 0 "[ . 1 . 2]" 1
1242 1 51 PHE H 1 71 ILE MD . . 4.540 4.338 4.225 4.449 . 0 0 "[ . 1 . 2]" 1
1243 1 51 PHE H 1 71 ILE HG12 . . 5.450 5.349 5.244 5.440 . 0 0 "[ . 1 . 2]" 1
1244 1 51 PHE H 1 71 ILE HG13 . . 4.550 4.292 4.111 4.396 . 0 0 "[ . 1 . 2]" 1
1245 1 51 PHE H 1 71 ILE MG . . 3.920 3.860 3.714 3.923 0.003 2 0 "[ . 1 . 2]" 1
1246 1 51 PHE HA 1 51 PHE HD1 . . 3.940 2.421 2.328 2.545 . 0 0 "[ . 1 . 2]" 1
1247 1 51 PHE HA 1 52 ARG H . . 3.010 2.512 2.441 2.573 . 0 0 "[ . 1 . 2]" 1
1248 1 51 PHE HA 1 71 ILE HB . . 4.960 4.629 4.427 4.717 . 0 0 "[ . 1 . 2]" 1
1249 1 51 PHE HA 1 71 ILE MD . . 5.410 5.218 4.993 5.406 . 0 0 "[ . 1 . 2]" 1
1250 1 51 PHE HA 1 93 VAL MG1 . . 4.970 4.060 3.990 4.120 . 0 0 "[ . 1 . 2]" 1
1251 1 51 PHE HA 1 94 ARG H . . 4.540 4.345 4.245 4.439 . 0 0 "[ . 1 . 2]" 1
1252 1 51 PHE HA 1 95 ALA HA . . 3.610 2.718 2.559 2.857 . 0 0 "[ . 1 . 2]" 1
1253 1 51 PHE HA 1 95 ALA MB . . 4.480 4.215 4.073 4.353 . 0 0 "[ . 1 . 2]" 1
1254 1 51 PHE HA 1 96 LEU H . . 3.680 3.128 3.010 3.320 . 0 0 "[ . 1 . 2]" 1
1255 1 51 PHE HA 1 96 LEU MD1 . . 3.900 3.366 3.209 3.574 . 0 0 "[ . 1 . 2]" 1
1256 1 51 PHE HB2 1 52 ARG H . . 3.640 3.521 3.410 3.633 . 0 0 "[ . 1 . 2]" 1
1257 1 51 PHE HB2 1 53 VAL MG2 . . 4.600 4.367 4.184 4.605 0.005 11 0 "[ . 1 . 2]" 1
1258 1 51 PHE HB2 1 71 ILE H . . 4.620 3.962 3.731 4.112 . 0 0 "[ . 1 . 2]" 1
1259 1 51 PHE HB2 1 71 ILE HB . . 4.030 2.105 1.993 2.222 . 0 0 "[ . 1 . 2]" 1
1260 1 51 PHE HB2 1 71 ILE MD . . 4.220 3.064 2.938 3.215 . 0 0 "[ . 1 . 2]" 1
1261 1 51 PHE HB2 1 71 ILE HG13 . . 5.000 4.124 3.966 4.266 . 0 0 "[ . 1 . 2]" 1
1262 1 51 PHE HB2 1 71 ILE MG . . 4.220 3.024 2.859 3.088 . 0 0 "[ . 1 . 2]" 1
1263 1 51 PHE HB2 1 93 VAL MG1 . . 4.000 3.883 3.747 3.977 . 0 0 "[ . 1 . 2]" 1
1264 1 51 PHE HB3 1 52 ARG H . . 3.530 2.194 2.071 2.346 . 0 0 "[ . 1 . 2]" 1
1265 1 51 PHE HB3 1 53 VAL MG2 . . 4.970 3.829 3.661 4.019 . 0 0 "[ . 1 . 2]" 1
1266 1 51 PHE HB3 1 71 ILE H . . 5.500 5.269 5.054 5.395 . 0 0 "[ . 1 . 2]" 1
1267 1 51 PHE HB3 1 71 ILE HB . . 4.120 3.727 3.567 3.851 . 0 0 "[ . 1 . 2]" 1
1268 1 51 PHE HB3 1 71 ILE MD . . 3.950 3.681 3.496 3.889 . 0 0 "[ . 1 . 2]" 1
1269 1 51 PHE HB3 1 71 ILE MG . . 4.350 4.284 4.114 4.346 . 0 0 "[ . 1 . 2]" 1
1270 1 51 PHE HB3 1 93 VAL MG1 . . 4.920 2.553 2.485 2.625 . 0 0 "[ . 1 . 2]" 1
1271 1 51 PHE HB3 1 95 ALA MB . . 5.500 5.201 5.046 5.333 . 0 0 "[ . 1 . 2]" 1
1272 1 51 PHE HD1 1 52 ARG H . . 4.090 3.378 3.296 3.453 . 0 0 "[ . 1 . 2]" 1
1273 1 51 PHE HD1 1 93 VAL MG1 . . 3.810 2.860 2.694 3.105 . 0 0 "[ . 1 . 2]" 1
1274 1 51 PHE HD1 1 95 ALA H . . 4.950 4.089 3.930 4.238 . 0 0 "[ . 1 . 2]" 1
1275 1 51 PHE HD1 1 95 ALA HA . . 4.280 2.219 2.107 2.347 . 0 0 "[ . 1 . 2]" 1
1276 1 51 PHE HD1 1 95 ALA MB . . 3.340 2.908 2.751 3.074 . 0 0 "[ . 1 . 2]" 1
1277 1 51 PHE HD1 1 96 LEU MD1 . . 4.600 4.547 4.393 4.608 0.008 7 0 "[ . 1 . 2]" 1
1278 1 51 PHE HD2 1 71 ILE HB . . 4.580 3.117 2.963 3.279 . 0 0 "[ . 1 . 2]" 1
1279 1 51 PHE HD2 1 71 ILE MD . . 4.240 4.144 3.946 4.265 0.025 11 0 "[ . 1 . 2]" 1
1280 1 51 PHE HD2 1 71 ILE MG . . 3.560 2.741 2.563 2.834 . 0 0 "[ . 1 . 2]" 1
1281 1 51 PHE HD2 1 73 PRO HA . . 4.090 3.512 3.386 3.699 . 0 0 "[ . 1 . 2]" 1
1282 1 51 PHE QE 1 71 ILE MG . . 4.680 4.276 4.038 4.390 . 0 0 "[ . 1 . 2]" 1
1283 1 51 PHE QE 1 73 PRO HA . . 4.490 2.062 1.999 2.282 . 0 0 "[ . 1 . 2]" 1
1284 1 51 PHE QE 1 76 LEU MD1 . . 5.500 5.171 5.027 5.379 . 0 0 "[ . 1 . 2]" 1
1285 1 51 PHE QE 1 76 LEU MD2 . . 3.450 2.789 2.590 3.030 . 0 0 "[ . 1 . 2]" 1
1286 1 51 PHE QE 1 95 ALA MB . . 4.850 2.088 1.979 2.287 . 0 0 "[ . 1 . 2]" 1
1287 1 51 PHE HZ 1 73 PRO HA . . 3.890 3.712 3.561 3.856 . 0 0 "[ . 1 . 2]" 1
1288 1 51 PHE HZ 1 95 ALA MB . . 4.770 4.094 3.899 4.359 . 0 0 "[ . 1 . 2]" 1
1289 1 52 ARG H 1 52 ARG HB2 . . 3.430 2.752 2.685 2.804 . 0 0 "[ . 1 . 2]" 1
1290 1 52 ARG H 1 52 ARG HB3 . . 3.820 3.782 3.682 3.871 0.051 11 0 "[ . 1 . 2]" 1
1291 1 52 ARG H 1 52 ARG QD . . 5.310 4.822 4.634 5.235 . 0 0 "[ . 1 . 2]" 1
1292 1 52 ARG H 1 53 VAL HA . . 4.720 4.624 4.569 4.730 0.010 11 0 "[ . 1 . 2]" 1
1293 1 52 ARG H 1 53 VAL MG2 . . 4.560 3.880 3.684 4.050 . 0 0 "[ . 1 . 2]" 1
1294 1 52 ARG H 1 71 ILE HB . . 5.330 5.071 4.910 5.225 . 0 0 "[ . 1 . 2]" 1
1295 1 52 ARG H 1 71 ILE MD . . 4.790 4.477 4.259 4.696 . 0 0 "[ . 1 . 2]" 1
1296 1 52 ARG H 1 93 VAL HA . . 4.250 3.917 3.779 4.059 . 0 0 "[ . 1 . 2]" 1
1297 1 52 ARG H 1 93 VAL MG1 . . 3.940 2.979 2.717 3.100 . 0 0 "[ . 1 . 2]" 1
1298 1 52 ARG H 1 93 VAL MG2 . . 4.910 4.819 4.681 4.906 . 0 0 "[ . 1 . 2]" 1
1299 1 52 ARG H 1 94 ARG H . . 3.470 2.325 2.242 2.460 . 0 0 "[ . 1 . 2]" 1
1300 1 52 ARG H 1 94 ARG HB2 . . 4.250 3.511 3.377 3.644 . 0 0 "[ . 1 . 2]" 1
1301 1 52 ARG H 1 95 ALA HA . . 4.610 4.190 4.077 4.363 . 0 0 "[ . 1 . 2]" 1
1302 1 52 ARG H 1 96 LEU H . . 5.360 5.154 5.024 5.220 . 0 0 "[ . 1 . 2]" 1
1303 1 52 ARG H 1 96 LEU MD1 . . 3.950 3.792 3.638 3.908 . 0 0 "[ . 1 . 2]" 1
1304 1 52 ARG HA 1 53 VAL MG2 . . 4.240 3.616 3.421 3.731 . 0 0 "[ . 1 . 2]" 1
1305 1 52 ARG HB2 1 52 ARG HD2 . . 3.500 2.797 2.513 3.526 0.026 11 0 "[ . 1 . 2]" 1
1306 1 52 ARG HB2 1 52 ARG QD . . 3.020 2.558 2.341 3.148 0.128 12 0 "[ . 1 . 2]" 1
1307 1 52 ARG HB2 1 52 ARG HD3 . . 3.500 3.173 2.377 3.609 0.109 15 0 "[ . 1 . 2]" 1
1308 1 52 ARG HB2 1 53 VAL H . . 4.510 4.340 3.982 4.464 . 0 0 "[ . 1 . 2]" 1
1309 1 52 ARG HB2 1 66 LEU MD1 . . 4.670 4.385 3.755 4.654 . 0 0 "[ . 1 . 2]" 1
1310 1 52 ARG HB2 1 94 ARG H . . 4.010 3.374 3.202 3.494 . 0 0 "[ . 1 . 2]" 1
1311 1 52 ARG HB2 1 94 ARG HB2 . . 4.140 2.166 1.998 2.296 . 0 0 "[ . 1 . 2]" 1
1312 1 52 ARG HB2 1 94 ARG HD2 . . 4.530 4.188 4.020 4.345 . 0 0 "[ . 1 . 2]" 1
1313 1 52 ARG HB2 1 96 LEU MD1 . . 4.100 2.603 2.385 2.972 . 0 0 "[ . 1 . 2]" 1
1314 1 52 ARG HB3 1 52 ARG HD2 . . 4.220 2.942 2.630 3.721 . 0 0 "[ . 1 . 2]" 1
1315 1 52 ARG HB3 1 52 ARG QD . . 3.540 2.341 2.153 2.664 . 0 0 "[ . 1 . 2]" 1
1316 1 52 ARG HB3 1 52 ARG HD3 . . 4.220 2.554 2.204 3.735 . 0 0 "[ . 1 . 2]" 1
1317 1 52 ARG HB3 1 53 VAL H . . 4.020 3.346 2.925 3.537 . 0 0 "[ . 1 . 2]" 1
1318 1 52 ARG HB3 1 66 LEU MD1 . . 3.770 2.974 2.325 3.282 . 0 0 "[ . 1 . 2]" 1
1319 1 52 ARG HB3 1 69 SER HB2 . . 5.500 5.004 3.738 5.504 0.004 8 0 "[ . 1 . 2]" 1
1320 1 52 ARG HB3 1 69 SER QB . . 4.730 4.342 3.677 4.707 . 0 0 "[ . 1 . 2]" 1
1321 1 52 ARG HB3 1 69 SER HB3 . . 5.500 5.009 4.288 5.502 0.002 19 0 "[ . 1 . 2]" 1
1322 1 52 ARG HB3 1 96 LEU MD1 . . 4.300 3.747 3.547 4.001 . 0 0 "[ . 1 . 2]" 1
1323 1 52 ARG QD 1 66 LEU MD1 . . 3.260 3.014 2.765 3.287 0.027 5 0 "[ . 1 . 2]" 1
1324 1 52 ARG QD 1 66 LEU MD2 . . 3.940 3.397 3.014 3.734 . 0 0 "[ . 1 . 2]" 1
1325 1 52 ARG QD 1 69 SER QB . . 4.370 3.726 2.997 4.050 . 0 0 "[ . 1 . 2]" 1
1326 1 52 ARG QD 1 94 ARG HB2 . . 4.860 3.835 3.541 4.585 . 0 0 "[ . 1 . 2]" 1
1327 1 52 ARG QD 1 96 LEU MD1 . . 3.410 2.165 1.924 2.552 . 0 0 "[ . 1 . 2]" 1
1328 1 52 ARG QD 1 96 LEU MD2 . . 3.880 2.604 1.939 2.883 . 0 0 "[ . 1 . 2]" 1
1329 1 52 ARG QD 1 101 GLU HB3 . . 5.340 4.879 4.627 5.268 . 0 0 "[ . 1 . 2]" 1
1330 1 52 ARG HG2 1 53 VAL H . . 4.210 3.986 3.717 4.227 0.017 11 0 "[ . 1 . 2]" 1
1331 1 52 ARG HG2 1 69 SER HB2 . . 4.140 2.877 2.013 4.099 . 0 0 "[ . 1 . 2]" 1
1332 1 52 ARG HG2 1 69 SER QB . . 3.590 2.497 2.003 2.823 . 0 0 "[ . 1 . 2]" 1
1333 1 52 ARG HG2 1 69 SER HB3 . . 4.140 3.131 2.154 4.014 . 0 0 "[ . 1 . 2]" 1
1334 1 52 ARG HG2 1 96 LEU MD1 . . 3.870 3.579 3.426 3.742 . 0 0 "[ . 1 . 2]" 1
1335 1 52 ARG HG3 1 53 VAL H . . 5.080 5.008 4.794 5.116 0.036 11 0 "[ . 1 . 2]" 1
1336 1 52 ARG HG3 1 96 LEU MD1 . . 2.950 2.110 1.970 2.319 . 0 0 "[ . 1 . 2]" 1
1337 1 53 VAL H 1 53 VAL HB . . 3.480 2.633 2.558 2.674 . 0 0 "[ . 1 . 2]" 1
1338 1 53 VAL H 1 53 VAL MG1 . . 3.980 3.848 3.817 3.870 . 0 0 "[ . 1 . 2]" 1
1339 1 53 VAL H 1 53 VAL MG2 . . 3.610 2.620 2.476 2.829 . 0 0 "[ . 1 . 2]" 1
1340 1 53 VAL H 1 54 GLU H . . 4.910 4.438 4.338 4.504 . 0 0 "[ . 1 . 2]" 1
1341 1 53 VAL H 1 66 LEU MD1 . . 4.050 3.111 2.776 3.279 . 0 0 "[ . 1 . 2]" 1
1342 1 53 VAL H 1 67 ALA MB . . 4.760 4.459 4.022 4.706 . 0 0 "[ . 1 . 2]" 1
1343 1 53 VAL H 1 68 THR H . . 4.010 3.371 2.907 3.647 . 0 0 "[ . 1 . 2]" 1
1344 1 53 VAL H 1 68 THR HB . . 5.500 5.367 5.150 5.498 . 0 0 "[ . 1 . 2]" 1
1345 1 53 VAL H 1 68 THR MG . . 3.770 2.873 2.633 3.083 . 0 0 "[ . 1 . 2]" 1
1346 1 53 VAL H 1 71 ILE MD . . 3.890 3.688 3.467 3.898 0.008 11 0 "[ . 1 . 2]" 1
1347 1 53 VAL H 1 80 ILE MD . . 4.810 4.437 4.299 4.593 . 0 0 "[ . 1 . 2]" 1
1348 1 53 VAL H 1 94 ARG H . . 5.220 4.894 4.783 5.013 . 0 0 "[ . 1 . 2]" 1
1349 1 53 VAL H 1 94 ARG HB2 . . 5.500 5.500 5.477 5.506 0.006 11 0 "[ . 1 . 2]" 1
1350 1 53 VAL HA 1 53 VAL MG2 . . 3.290 2.378 2.308 2.496 . 0 0 "[ . 1 . 2]" 1
1351 1 53 VAL HB 1 54 GLU H . . 5.040 4.078 3.967 4.243 . 0 0 "[ . 1 . 2]" 1
1352 1 53 VAL HB 1 67 ALA H . . 4.680 4.060 3.931 4.193 . 0 0 "[ . 1 . 2]" 1
1353 1 53 VAL HB 1 67 ALA MB . . 3.550 2.862 2.306 3.061 . 0 0 "[ . 1 . 2]" 1
1354 1 53 VAL HB 1 68 THR H . . 4.030 2.647 2.464 2.790 . 0 0 "[ . 1 . 2]" 1
1355 1 53 VAL HB 1 68 THR HB . . 4.570 4.194 3.903 4.339 . 0 0 "[ . 1 . 2]" 1
1356 1 53 VAL HB 1 68 THR MG . . 3.460 2.083 1.961 2.300 . 0 0 "[ . 1 . 2]" 1
1357 1 53 VAL HB 1 71 ILE MD . . 4.010 3.915 3.720 4.013 0.003 5 0 "[ . 1 . 2]" 1
1358 1 53 VAL HB 1 78 VAL MG2 . . 4.420 4.161 3.998 4.312 . 0 0 "[ . 1 . 2]" 1
1359 1 53 VAL HB 1 80 ILE MD . . 3.440 2.286 2.107 2.525 . 0 0 "[ . 1 . 2]" 1
1360 1 53 VAL HB 1 80 ILE MG . . 4.870 4.114 3.916 4.241 . 0 0 "[ . 1 . 2]" 1
1361 1 53 VAL MG1 1 54 GLU H . . 3.300 2.409 2.143 2.772 . 0 0 "[ . 1 . 2]" 1
1362 1 53 VAL MG1 1 54 GLU HA . . 4.790 3.698 3.526 3.933 . 0 0 "[ . 1 . 2]" 1
1363 1 53 VAL MG1 1 55 TYR H . . 5.140 4.797 4.521 4.985 . 0 0 "[ . 1 . 2]" 1
1364 1 53 VAL MG1 1 55 TYR QD . . 4.140 3.912 3.755 4.100 . 0 0 "[ . 1 . 2]" 1
1365 1 53 VAL MG1 1 67 ALA MB . . 3.160 2.683 2.147 2.953 . 0 0 "[ . 1 . 2]" 1
1366 1 53 VAL MG1 1 68 THR H . . 4.610 3.807 3.527 3.949 . 0 0 "[ . 1 . 2]" 1
1367 1 53 VAL MG1 1 68 THR HB . . 5.160 5.005 4.651 5.162 0.002 19 0 "[ . 1 . 2]" 1
1368 1 53 VAL MG1 1 80 ILE MD . . 2.830 1.981 1.854 2.260 . 0 0 "[ . 1 . 2]" 1
1369 1 53 VAL MG1 1 80 ILE HG13 . . 3.690 2.524 2.358 2.676 . 0 0 "[ . 1 . 2]" 1
1370 1 53 VAL MG1 1 80 ILE MG . . 3.600 3.111 2.908 3.258 . 0 0 "[ . 1 . 2]" 1
1371 1 53 VAL MG1 1 91 PHE HA . . 4.500 3.788 3.482 3.922 . 0 0 "[ . 1 . 2]" 1
1372 1 53 VAL MG1 1 91 PHE HB2 . . 4.400 4.247 3.884 4.379 . 0 0 "[ . 1 . 2]" 1
1373 1 53 VAL MG1 1 91 PHE HB3 . . 3.950 2.847 2.525 2.970 . 0 0 "[ . 1 . 2]" 1
1374 1 53 VAL MG1 1 91 PHE QD . . 3.420 2.667 2.477 2.958 . 0 0 "[ . 1 . 2]" 1
1375 1 53 VAL MG1 1 91 PHE QE . . 4.870 4.226 3.963 4.602 . 0 0 "[ . 1 . 2]" 1
1376 1 53 VAL MG1 1 92 ARG H . . 4.030 2.618 2.320 2.821 . 0 0 "[ . 1 . 2]" 1
1377 1 53 VAL MG1 1 92 ARG HA . . 5.040 4.497 4.251 4.613 . 0 0 "[ . 1 . 2]" 1
1378 1 53 VAL MG1 1 93 VAL HA . . 4.290 3.831 3.751 3.939 . 0 0 "[ . 1 . 2]" 1
1379 1 53 VAL MG1 1 93 VAL MG1 . . 4.850 4.609 4.493 4.704 . 0 0 "[ . 1 . 2]" 1
1380 1 53 VAL MG1 1 93 VAL MG2 . . 3.730 3.076 2.928 3.169 . 0 0 "[ . 1 . 2]" 1
1381 1 53 VAL MG1 1 94 ARG H . . 5.500 5.404 5.319 5.480 . 0 0 "[ . 1 . 2]" 1
1382 1 53 VAL MG2 1 54 GLU H . . 4.220 4.058 3.971 4.167 . 0 0 "[ . 1 . 2]" 1
1383 1 53 VAL MG2 1 67 ALA MB . . 4.200 4.075 3.697 4.203 0.003 13 0 "[ . 1 . 2]" 1
1384 1 53 VAL MG2 1 68 THR H . . 5.010 3.971 3.819 4.094 . 0 0 "[ . 1 . 2]" 1
1385 1 53 VAL MG2 1 68 THR HB . . 4.550 4.442 4.271 4.546 . 0 0 "[ . 1 . 2]" 1
1386 1 53 VAL MG2 1 68 THR MG . . 3.540 2.157 2.039 2.241 . 0 0 "[ . 1 . 2]" 1
1387 1 53 VAL MG2 1 71 ILE MD . . 2.840 2.226 2.075 2.313 . 0 0 "[ . 1 . 2]" 1
1388 1 53 VAL MG2 1 71 ILE HG13 . . 4.350 4.243 4.061 4.350 0.000 17 0 "[ . 1 . 2]" 1
1389 1 53 VAL MG2 1 71 ILE MG . . 4.480 4.399 4.193 4.485 0.005 19 0 "[ . 1 . 2]" 1
1390 1 53 VAL MG2 1 78 VAL H . . 5.160 4.994 4.823 5.132 . 0 0 "[ . 1 . 2]" 1
1391 1 53 VAL MG2 1 78 VAL MG1 . . 3.960 3.796 3.617 3.902 . 0 0 "[ . 1 . 2]" 1
1392 1 53 VAL MG2 1 78 VAL MG2 . . 3.270 2.725 2.547 2.848 . 0 0 "[ . 1 . 2]" 1
1393 1 53 VAL MG2 1 80 ILE MD . . 3.170 2.461 2.251 2.639 . 0 0 "[ . 1 . 2]" 1
1394 1 53 VAL MG2 1 93 VAL HA . . 4.100 3.184 2.941 3.394 . 0 0 "[ . 1 . 2]" 1
1395 1 53 VAL MG2 1 93 VAL HB . . 5.180 4.926 4.745 5.123 . 0 0 "[ . 1 . 2]" 1
1396 1 53 VAL MG2 1 93 VAL MG1 . . 3.360 3.101 2.939 3.278 . 0 0 "[ . 1 . 2]" 1
1397 1 53 VAL MG2 1 93 VAL MG2 . . 3.100 2.555 2.361 2.746 . 0 0 "[ . 1 . 2]" 1
1398 1 53 VAL MG2 1 94 ARG H . . 4.370 4.091 3.983 4.242 . 0 0 "[ . 1 . 2]" 1
1399 1 54 GLU H 1 54 GLU HB2 . . 3.590 2.640 2.522 2.803 . 0 0 "[ . 1 . 2]" 1
1400 1 54 GLU H 1 54 GLU HB3 . . 4.110 3.763 3.651 3.867 . 0 0 "[ . 1 . 2]" 1
1401 1 54 GLU H 1 54 GLU HG2 . . 5.070 4.397 3.608 4.695 . 0 0 "[ . 1 . 2]" 1
1402 1 54 GLU H 1 54 GLU QG . . 4.440 3.344 2.929 3.705 . 0 0 "[ . 1 . 2]" 1
1403 1 54 GLU H 1 54 GLU HG3 . . 5.070 3.475 3.080 3.904 . 0 0 "[ . 1 . 2]" 1
1404 1 54 GLU H 1 55 TYR H . . 4.840 4.446 4.392 4.506 . 0 0 "[ . 1 . 2]" 1
1405 1 54 GLU H 1 66 LEU HA . . 5.310 5.167 4.945 5.308 . 0 0 "[ . 1 . 2]" 1
1406 1 54 GLU H 1 67 ALA MB . . 4.780 4.494 3.867 4.785 0.005 14 0 "[ . 1 . 2]" 1
1407 1 54 GLU H 1 92 ARG H . . 3.820 2.666 2.420 2.885 . 0 0 "[ . 1 . 2]" 1
1408 1 54 GLU H 1 92 ARG QD . . 5.180 3.805 3.521 5.101 . 0 0 "[ . 1 . 2]" 1
1409 1 54 GLU H 1 92 ARG HE . . 5.500 5.279 3.952 5.501 0.001 15 0 "[ . 1 . 2]" 1
1410 1 54 GLU H 1 92 ARG QG . . 3.630 2.198 1.931 3.648 0.018 19 0 "[ . 1 . 2]" 1
1411 1 54 GLU H 1 93 VAL HA . . 3.910 3.883 3.682 3.923 0.013 11 0 "[ . 1 . 2]" 1
1412 1 54 GLU HA 1 54 GLU HG2 . . 3.910 2.939 2.366 3.582 . 0 0 "[ . 1 . 2]" 1
1413 1 54 GLU HA 1 54 GLU HG3 . . 3.910 2.657 2.321 3.446 . 0 0 "[ . 1 . 2]" 1
1414 1 54 GLU HA 1 55 TYR H . . 3.320 2.322 2.245 2.396 . 0 0 "[ . 1 . 2]" 1
1415 1 54 GLU HA 1 55 TYR QD . . 4.390 3.601 3.249 3.866 . 0 0 "[ . 1 . 2]" 1
1416 1 54 GLU HA 1 64 TRP HE3 . . 5.020 4.291 4.142 4.443 . 0 0 "[ . 1 . 2]" 1
1417 1 54 GLU HA 1 65 ILE H . . 4.790 4.489 4.095 4.782 . 0 0 "[ . 1 . 2]" 1
1418 1 54 GLU HA 1 66 LEU HA . . 3.710 2.645 2.544 2.732 . 0 0 "[ . 1 . 2]" 1
1419 1 54 GLU HA 1 66 LEU HB2 . . 5.210 4.958 4.808 5.058 . 0 0 "[ . 1 . 2]" 1
1420 1 54 GLU HA 1 66 LEU MD1 . . 3.980 3.358 3.223 3.557 . 0 0 "[ . 1 . 2]" 1
1421 1 54 GLU HA 1 67 ALA H . . 3.660 2.559 2.017 2.950 . 0 0 "[ . 1 . 2]" 1
1422 1 54 GLU HA 1 67 ALA MB . . 3.930 3.172 2.774 3.574 . 0 0 "[ . 1 . 2]" 1
1423 1 54 GLU HA 1 68 THR H . . 5.030 4.649 4.332 4.953 . 0 0 "[ . 1 . 2]" 1
1424 1 54 GLU HA 1 92 ARG QG . . 5.330 4.021 3.884 5.067 . 0 0 "[ . 1 . 2]" 1
1425 1 54 GLU HB2 1 55 TYR H . . 4.150 3.854 3.705 4.036 . 0 0 "[ . 1 . 2]" 1
1426 1 54 GLU HB2 1 64 TRP QB . . 5.220 3.799 3.251 4.146 . 0 0 "[ . 1 . 2]" 1
1427 1 54 GLU HB2 1 64 TRP HE3 . . 4.090 3.226 2.958 3.617 . 0 0 "[ . 1 . 2]" 1
1428 1 54 GLU HB2 1 66 LEU HA . . 4.890 4.694 4.497 4.868 . 0 0 "[ . 1 . 2]" 1
1429 1 54 GLU HB2 1 92 ARG H . . 4.730 4.261 4.120 4.517 . 0 0 "[ . 1 . 2]" 1
1430 1 54 GLU HB2 1 92 ARG QD . . 4.190 2.229 1.986 4.120 . 0 0 "[ . 1 . 2]" 1
1431 1 54 GLU HB2 1 92 ARG HE . . 4.800 3.838 2.244 4.488 . 0 0 "[ . 1 . 2]" 1
1432 1 54 GLU HB2 1 92 ARG QG . . 4.120 2.138 1.911 3.535 . 0 0 "[ . 1 . 2]" 1
1433 1 54 GLU HB3 1 55 TYR H . . 3.860 2.644 2.450 2.854 . 0 0 "[ . 1 . 2]" 1
1434 1 54 GLU HB3 1 64 TRP QB . . 4.470 2.678 2.482 3.187 . 0 0 "[ . 1 . 2]" 1
1435 1 54 GLU HB3 1 64 TRP HE3 . . 3.990 2.549 2.225 3.057 . 0 0 "[ . 1 . 2]" 1
1436 1 54 GLU HB3 1 65 ILE H . . 4.400 3.465 2.875 3.853 . 0 0 "[ . 1 . 2]" 1
1437 1 54 GLU HB3 1 66 LEU HA . . 4.850 3.829 3.469 4.197 . 0 0 "[ . 1 . 2]" 1
1438 1 54 GLU HB3 1 92 ARG H . . 5.320 5.230 5.013 5.324 0.004 14 0 "[ . 1 . 2]" 1
1439 1 54 GLU HB3 1 92 ARG HE . . 5.170 4.698 2.900 5.139 . 0 0 "[ . 1 . 2]" 1
1440 1 54 GLU HB3 1 92 ARG QG . . 5.000 3.290 3.002 4.376 . 0 0 "[ . 1 . 2]" 1
1441 1 54 GLU QG 1 55 TYR H . . 4.330 3.758 3.362 4.105 . 0 0 "[ . 1 . 2]" 1
1442 1 54 GLU QG 1 64 TRP HE3 . . 5.340 4.435 4.105 4.911 . 0 0 "[ . 1 . 2]" 1
1443 1 54 GLU QG 1 66 LEU HA . . 3.540 2.190 1.986 2.438 . 0 0 "[ . 1 . 2]" 1
1444 1 54 GLU QG 1 66 LEU HB2 . . 4.910 3.265 3.025 3.604 . 0 0 "[ . 1 . 2]" 1
1445 1 54 GLU QG 1 66 LEU MD2 . . 4.500 4.178 4.004 4.344 . 0 0 "[ . 1 . 2]" 1
1446 1 54 GLU QG 1 67 ALA H . . 4.420 3.374 3.034 3.619 . 0 0 "[ . 1 . 2]" 1
1447 1 54 GLU HG2 1 66 LEU HA . . 4.150 2.672 2.022 3.611 . 0 0 "[ . 1 . 2]" 1
1448 1 54 GLU HG2 1 66 LEU MD1 . . 3.740 2.974 2.254 3.576 . 0 0 "[ . 1 . 2]" 1
1449 1 54 GLU HG2 1 67 ALA H . . 5.190 4.218 3.376 5.195 0.005 19 0 "[ . 1 . 2]" 1
1450 1 54 GLU HG3 1 66 LEU HA . . 4.150 2.814 1.999 4.006 . 0 0 "[ . 1 . 2]" 1
1451 1 54 GLU HG3 1 66 LEU MD1 . . 3.740 2.533 2.078 3.476 . 0 0 "[ . 1 . 2]" 1
1452 1 54 GLU HG3 1 67 ALA H . . 5.190 3.806 3.172 4.914 . 0 0 "[ . 1 . 2]" 1
1453 1 55 TYR H 1 55 TYR QD . . 3.720 3.032 2.762 3.308 . 0 0 "[ . 1 . 2]" 1
1454 1 55 TYR H 1 55 TYR QE . . 4.980 4.247 4.039 4.466 . 0 0 "[ . 1 . 2]" 1
1455 1 55 TYR H 1 56 LYS H . . 5.020 4.411 4.336 4.469 . 0 0 "[ . 1 . 2]" 1
1456 1 55 TYR H 1 64 TRP HE3 . . 4.420 3.048 2.733 3.530 . 0 0 "[ . 1 . 2]" 1
1457 1 55 TYR H 1 65 ILE H . . 3.860 2.694 2.414 3.080 . 0 0 "[ . 1 . 2]" 1
1458 1 55 TYR H 1 65 ILE HB . . 4.570 3.618 3.284 3.975 . 0 0 "[ . 1 . 2]" 1
1459 1 55 TYR H 1 65 ILE MG . . 5.180 4.799 4.501 5.038 . 0 0 "[ . 1 . 2]" 1
1460 1 55 TYR H 1 66 LEU HA . . 4.060 3.977 3.812 4.065 0.005 13 0 "[ . 1 . 2]" 1
1461 1 55 TYR H 1 66 LEU MD1 . . 5.440 5.100 4.918 5.291 . 0 0 "[ . 1 . 2]" 1
1462 1 55 TYR H 1 67 ALA H . . 4.530 4.161 3.644 4.536 0.006 14 0 "[ . 1 . 2]" 1
1463 1 55 TYR H 1 67 ALA MB . . 4.430 3.946 3.551 4.314 . 0 0 "[ . 1 . 2]" 1
1464 1 55 TYR HA 1 55 TYR QD . . 4.560 3.732 3.701 3.741 . 0 0 "[ . 1 . 2]" 1
1465 1 55 TYR HA 1 56 LYS H . . 3.510 2.402 2.219 2.579 . 0 0 "[ . 1 . 2]" 1
1466 1 55 TYR HA 1 64 TRP HE3 . . 4.100 2.916 2.379 3.493 . 0 0 "[ . 1 . 2]" 1
1467 1 55 TYR HA 1 64 TRP HZ3 . . 3.730 2.326 2.014 2.981 . 0 0 "[ . 1 . 2]" 1
1468 1 55 TYR HA 1 90 LYS H . . 4.910 4.164 3.955 4.315 . 0 0 "[ . 1 . 2]" 1
1469 1 55 TYR HA 1 92 ARG H . . 4.710 3.993 3.684 4.179 . 0 0 "[ . 1 . 2]" 1
1470 1 55 TYR QB 1 56 LYS H . . 3.470 2.433 2.061 2.872 . 0 0 "[ . 1 . 2]" 1
1471 1 55 TYR QB 1 83 LEU MD2 . . 4.890 3.684 3.388 4.021 . 0 0 "[ . 1 . 2]" 1
1472 1 55 TYR QB 1 90 LYS H . . 4.660 3.690 3.300 4.071 . 0 0 "[ . 1 . 2]" 1
1473 1 55 TYR QB 1 91 PHE HA . . 4.430 3.068 2.868 3.375 . 0 0 "[ . 1 . 2]" 1
1474 1 55 TYR QB 1 91 PHE QD . . 3.880 3.012 2.736 3.366 . 0 0 "[ . 1 . 2]" 1
1475 1 55 TYR QB 1 91 PHE QE . . 4.280 3.329 3.002 3.940 . 0 0 "[ . 1 . 2]" 1
1476 1 55 TYR HB2 1 56 LYS H . . 4.020 2.469 2.075 2.941 . 0 0 "[ . 1 . 2]" 1
1477 1 55 TYR HB2 1 91 PHE QD . . 4.710 4.343 4.181 4.580 . 0 0 "[ . 1 . 2]" 1
1478 1 55 TYR HB3 1 56 LYS H . . 4.020 3.755 3.529 4.024 0.004 15 0 "[ . 1 . 2]" 1
1479 1 55 TYR HB3 1 91 PHE QD . . 4.710 3.074 2.774 3.463 . 0 0 "[ . 1 . 2]" 1
1480 1 55 TYR QD 1 56 LYS H . . 4.260 3.360 2.864 3.830 . 0 0 "[ . 1 . 2]" 1
1481 1 55 TYR QD 1 56 LYS HA . . 4.190 3.305 2.961 3.732 . 0 0 "[ . 1 . 2]" 1
1482 1 55 TYR QD 1 57 LYS H . . 4.560 3.932 3.573 4.051 . 0 0 "[ . 1 . 2]" 1
1483 1 55 TYR QD 1 57 LYS QG . . 4.940 3.343 3.020 4.617 . 0 0 "[ . 1 . 2]" 1
1484 1 55 TYR QD 1 65 ILE H . . 4.830 3.877 3.550 4.140 . 0 0 "[ . 1 . 2]" 1
1485 1 55 TYR QD 1 65 ILE HB . . 4.970 3.500 3.227 3.645 . 0 0 "[ . 1 . 2]" 1
1486 1 55 TYR QD 1 65 ILE MD . . 5.030 4.737 4.487 4.842 . 0 0 "[ . 1 . 2]" 1
1487 1 55 TYR QD 1 65 ILE HG12 . . 4.590 3.477 3.164 3.675 . 0 0 "[ . 1 . 2]" 1
1488 1 55 TYR QD 1 65 ILE HG13 . . 5.050 3.775 3.263 4.196 . 0 0 "[ . 1 . 2]" 1
1489 1 55 TYR QD 1 65 ILE MG . . 4.710 4.519 4.197 4.717 0.007 14 0 "[ . 1 . 2]" 1
1490 1 55 TYR QD 1 66 LEU MD1 . . 5.500 5.433 5.244 5.510 0.010 5 0 "[ . 1 . 2]" 1
1491 1 55 TYR QD 1 67 ALA H . . 4.950 3.733 3.400 4.155 . 0 0 "[ . 1 . 2]" 1
1492 1 55 TYR QD 1 67 ALA HA . . 4.470 3.714 2.738 4.188 . 0 0 "[ . 1 . 2]" 1
1493 1 55 TYR QD 1 67 ALA MB . . 3.280 1.992 1.872 2.130 . 0 0 "[ . 1 . 2]" 1
1494 1 55 TYR QD 1 80 ILE MD . . 4.620 4.410 4.194 4.622 0.002 7 0 "[ . 1 . 2]" 1
1495 1 55 TYR QD 1 83 LEU MD2 . . 3.940 3.506 3.277 3.925 . 0 0 "[ . 1 . 2]" 1
1496 1 55 TYR QD 1 89 TYR HB3 . . 4.560 3.821 3.386 4.045 . 0 0 "[ . 1 . 2]" 1
1497 1 55 TYR QD 1 91 PHE QD . . 4.410 3.895 3.402 4.320 . 0 0 "[ . 1 . 2]" 1
1498 1 55 TYR QE 1 57 LYS H . . 5.120 4.979 4.555 5.114 . 0 0 "[ . 1 . 2]" 1
1499 1 55 TYR QE 1 57 LYS QE . . 4.100 2.966 2.072 4.051 . 0 0 "[ . 1 . 2]" 1
1500 1 55 TYR QE 1 65 ILE HB . . 4.810 2.700 2.418 2.881 . 0 0 "[ . 1 . 2]" 1
1501 1 55 TYR QE 1 65 ILE MD . . 4.020 3.934 3.778 4.027 0.007 5 0 "[ . 1 . 2]" 1
1502 1 55 TYR QE 1 65 ILE HG12 . . 4.330 3.222 2.719 3.559 . 0 0 "[ . 1 . 2]" 1
1503 1 55 TYR QE 1 65 ILE HG13 . . 4.120 2.338 2.147 2.611 . 0 0 "[ . 1 . 2]" 1
1504 1 55 TYR QE 1 65 ILE MG . . 3.360 3.244 2.950 3.367 0.007 17 0 "[ . 1 . 2]" 1
1505 1 55 TYR QE 1 66 LEU MD1 . . 5.500 5.410 5.292 5.498 . 0 0 "[ . 1 . 2]" 1
1506 1 55 TYR QE 1 67 ALA HA . . 3.910 2.220 1.996 2.674 . 0 0 "[ . 1 . 2]" 1
1507 1 55 TYR QE 1 67 ALA MB . . 3.400 2.344 1.958 3.056 . 0 0 "[ . 1 . 2]" 1
1508 1 55 TYR QE 1 80 ILE MG . . 4.010 3.717 3.347 4.010 . 17 0 "[ . 1 . 2]" 1
1509 1 55 TYR QE 1 83 LEU MD2 . . 4.060 3.546 3.155 3.964 . 0 0 "[ . 1 . 2]" 1
1510 1 56 LYS H 1 56 LYS HG2 . . 4.840 4.324 3.979 4.478 . 0 0 "[ . 1 . 2]" 1
1511 1 56 LYS H 1 56 LYS HG3 . . 5.350 4.688 4.552 4.774 . 0 0 "[ . 1 . 2]" 1
1512 1 56 LYS H 1 64 TRP HE3 . . 4.560 3.919 3.170 4.523 . 0 0 "[ . 1 . 2]" 1
1513 1 56 LYS H 1 64 TRP HZ3 . . 4.190 3.564 2.598 4.197 0.007 17 0 "[ . 1 . 2]" 1
1514 1 56 LYS H 1 65 ILE HG12 . . 5.500 5.431 5.195 5.503 0.003 2 0 "[ . 1 . 2]" 1
1515 1 56 LYS H 1 89 TYR HA . . 4.790 4.186 3.912 4.511 . 0 0 "[ . 1 . 2]" 1
1516 1 56 LYS H 1 89 TYR HB3 . . 4.890 3.878 3.543 4.313 . 0 0 "[ . 1 . 2]" 1
1517 1 56 LYS H 1 89 TYR QD . . 5.430 4.968 4.687 5.429 . 0 0 "[ . 1 . 2]" 1
1518 1 56 LYS H 1 91 PHE HA . . 4.450 4.299 4.074 4.431 . 0 0 "[ . 1 . 2]" 1
1519 1 56 LYS HA 1 56 LYS HD2 . . 4.990 4.736 4.343 4.995 0.005 8 0 "[ . 1 . 2]" 1
1520 1 56 LYS HA 1 56 LYS HD3 . . 4.700 4.236 4.027 4.506 . 0 0 "[ . 1 . 2]" 1
1521 1 56 LYS HA 1 56 LYS HG2 . . 4.130 3.373 3.228 3.629 . 0 0 "[ . 1 . 2]" 1
1522 1 56 LYS HA 1 56 LYS HG3 . . 3.810 2.642 2.441 2.909 . 0 0 "[ . 1 . 2]" 1
1523 1 56 LYS HA 1 57 LYS H . . 3.140 2.171 2.146 2.209 . 0 0 "[ . 1 . 2]" 1
1524 1 56 LYS HA 1 57 LYS HB2 . . 4.890 4.413 4.312 4.540 . 0 0 "[ . 1 . 2]" 1
1525 1 56 LYS HA 1 65 ILE H . . 4.740 3.466 3.194 3.711 . 0 0 "[ . 1 . 2]" 1
1526 1 56 LYS HA 1 65 ILE MD . . 4.780 4.327 4.009 4.557 . 0 0 "[ . 1 . 2]" 1
1527 1 56 LYS HA 1 65 ILE HG12 . . 4.390 3.343 2.990 3.505 . 0 0 "[ . 1 . 2]" 1
1528 1 56 LYS QB 1 56 LYS HD3 . . 3.620 2.189 2.100 2.243 . 0 0 "[ . 1 . 2]" 1
1529 1 56 LYS QB 1 56 LYS QE . . 4.200 2.393 2.127 3.359 . 0 0 "[ . 1 . 2]" 1
1530 1 56 LYS QB 1 57 LYS H . . 3.970 3.681 3.530 3.768 . 0 0 "[ . 1 . 2]" 1
1531 1 56 LYS QB 1 64 TRP HE3 . . 5.150 3.257 2.868 3.547 . 0 0 "[ . 1 . 2]" 1
1532 1 56 LYS QB 1 90 LYS H . . 4.450 3.331 3.062 3.792 . 0 0 "[ . 1 . 2]" 1
1533 1 56 LYS HB2 1 56 LYS HD3 . . 4.180 2.282 2.144 2.482 . 0 0 "[ . 1 . 2]" 1
1534 1 56 LYS HB2 1 57 LYS H . . 4.510 4.059 3.776 4.221 . 0 0 "[ . 1 . 2]" 1
1535 1 56 LYS HB2 1 64 TRP HA . . 4.520 2.647 2.219 2.925 . 0 0 "[ . 1 . 2]" 1
1536 1 56 LYS HB3 1 56 LYS HD3 . . 4.180 2.873 2.528 3.082 . 0 0 "[ . 1 . 2]" 1
1537 1 56 LYS HB3 1 57 LYS H . . 4.510 4.222 4.102 4.328 . 0 0 "[ . 1 . 2]" 1
1538 1 56 LYS HB3 1 64 TRP HA . . 4.520 4.265 3.793 4.521 0.001 11 0 "[ . 1 . 2]" 1
1539 1 56 LYS HD2 1 64 TRP HA . . 5.470 5.048 4.477 5.343 . 0 0 "[ . 1 . 2]" 1
1540 1 56 LYS HD2 1 64 TRP HD1 . . 5.000 4.372 3.405 4.759 . 0 0 "[ . 1 . 2]" 1
1541 1 56 LYS HD2 1 64 TRP HE1 . . 4.440 3.851 2.970 4.280 . 0 0 "[ . 1 . 2]" 1
1542 1 56 LYS HD2 1 64 TRP HZ2 . . 5.230 5.075 4.479 5.235 0.005 13 0 "[ . 1 . 2]" 1
1543 1 56 LYS HD3 1 57 LYS H . . 5.500 5.221 5.080 5.383 . 0 0 "[ . 1 . 2]" 1
1544 1 56 LYS HD3 1 64 TRP HA . . 5.500 4.138 3.885 4.803 . 0 0 "[ . 1 . 2]" 1
1545 1 56 LYS HD3 1 64 TRP HD1 . . 4.330 3.360 3.034 3.897 . 0 0 "[ . 1 . 2]" 1
1546 1 56 LYS HD3 1 64 TRP HE1 . . 4.120 2.558 2.329 3.023 . 0 0 "[ . 1 . 2]" 1
1547 1 56 LYS HD3 1 64 TRP HE3 . . 5.500 5.140 4.650 5.456 . 0 0 "[ . 1 . 2]" 1
1548 1 56 LYS HD3 1 64 TRP HZ2 . . 4.430 3.640 2.813 3.826 . 0 0 "[ . 1 . 2]" 1
1549 1 56 LYS QE 1 56 LYS HG2 . . 3.410 2.254 2.090 2.464 . 0 0 "[ . 1 . 2]" 1
1550 1 56 LYS QE 1 57 LYS H . . 5.340 5.120 4.845 5.297 . 0 0 "[ . 1 . 2]" 1
1551 1 56 LYS QE 1 64 TRP HD1 . . 5.340 5.078 4.692 5.310 . 0 0 "[ . 1 . 2]" 1
1552 1 56 LYS QE 1 64 TRP HE1 . . 4.690 3.526 2.985 3.926 . 0 0 "[ . 1 . 2]" 1
1553 1 56 LYS QE 1 64 TRP HZ2 . . 4.100 3.083 2.488 4.068 . 0 0 "[ . 1 . 2]" 1
1554 1 56 LYS QE 1 90 LYS H . . 5.340 4.647 4.210 5.160 . 0 0 "[ . 1 . 2]" 1
1555 1 56 LYS QE 1 90 LYS HB2 . . 4.950 4.100 3.555 4.952 0.002 16 0 "[ . 1 . 2]" 1
1556 1 56 LYS QE 1 90 LYS HD2 . . 4.410 3.419 2.705 3.980 . 0 0 "[ . 1 . 2]" 1
1557 1 56 LYS HE2 1 56 LYS HG2 . . 3.930 2.893 2.129 3.627 . 0 0 "[ . 1 . 2]" 1
1558 1 56 LYS HE2 1 58 LEU MD2 . . 4.370 3.260 1.973 3.813 . 0 0 "[ . 1 . 2]" 1
1559 1 56 LYS HE3 1 56 LYS HG2 . . 3.930 2.502 2.128 3.459 . 0 0 "[ . 1 . 2]" 1
1560 1 56 LYS HE3 1 58 LEU MD2 . . 4.370 2.696 2.199 3.899 . 0 0 "[ . 1 . 2]" 1
1561 1 56 LYS HG2 1 57 LYS H . . 4.300 3.284 3.014 3.664 . 0 0 "[ . 1 . 2]" 1
1562 1 56 LYS HG2 1 58 LEU MD2 . . 3.950 2.627 2.338 2.985 . 0 0 "[ . 1 . 2]" 1
1563 1 56 LYS HG2 1 64 TRP HA . . 5.350 4.997 4.637 5.299 . 0 0 "[ . 1 . 2]" 1
1564 1 56 LYS HG2 1 90 LYS H . . 4.790 4.504 3.781 4.787 . 0 0 "[ . 1 . 2]" 1
1565 1 56 LYS HG3 1 57 LYS H . . 4.510 2.759 2.583 2.978 . 0 0 "[ . 1 . 2]" 1
1566 1 56 LYS HG3 1 64 TRP H . . 4.950 4.565 3.976 4.960 0.010 14 0 "[ . 1 . 2]" 1
1567 1 57 LYS H 1 57 LYS HB2 . . 3.630 2.285 2.181 2.393 . 0 0 "[ . 1 . 2]" 1
1568 1 57 LYS H 1 57 LYS HB3 . . 3.850 3.551 3.488 3.602 . 0 0 "[ . 1 . 2]" 1
1569 1 57 LYS H 1 57 LYS QD . . 4.430 3.883 2.245 4.447 0.017 13 0 "[ . 1 . 2]" 1
1570 1 57 LYS H 1 57 LYS HG2 . . 4.180 4.063 3.901 4.188 0.008 15 0 "[ . 1 . 2]" 1
1571 1 57 LYS H 1 57 LYS QG . . 3.550 2.806 2.497 3.559 0.009 15 0 "[ . 1 . 2]" 1
1572 1 57 LYS H 1 57 LYS HG3 . . 4.180 2.868 2.527 3.851 . 0 0 "[ . 1 . 2]" 1
1573 1 57 LYS H 1 58 LEU H . . 4.590 4.508 4.422 4.601 0.011 15 0 "[ . 1 . 2]" 1
1574 1 57 LYS H 1 65 ILE MD . . 5.250 4.527 4.180 4.793 . 0 0 "[ . 1 . 2]" 1
1575 1 57 LYS HA 1 57 LYS QD . . 4.940 3.997 2.829 4.132 . 0 0 "[ . 1 . 2]" 1
1576 1 57 LYS HA 1 57 LYS HG2 . . 4.060 2.708 2.393 3.550 . 0 0 "[ . 1 . 2]" 1
1577 1 57 LYS HA 1 57 LYS QG . . 3.510 2.361 2.224 2.447 . 0 0 "[ . 1 . 2]" 1
1578 1 57 LYS HA 1 57 LYS HG3 . . 4.060 2.650 2.248 2.819 . 0 0 "[ . 1 . 2]" 1
1579 1 57 LYS HA 1 58 LEU H . . 2.980 2.156 2.141 2.210 . 0 0 "[ . 1 . 2]" 1
1580 1 57 LYS HA 1 58 LEU MD2 . . 4.380 4.237 3.919 4.363 . 0 0 "[ . 1 . 2]" 1
1581 1 57 LYS HA 1 58 LEU HG . . 3.920 3.765 3.579 3.920 . 16 0 "[ . 1 . 2]" 1
1582 1 57 LYS HA 1 87 ILE MD . . 5.490 5.451 5.351 5.496 0.006 17 0 "[ . 1 . 2]" 1
1583 1 57 LYS HA 1 87 ILE MG . . 3.940 3.314 3.235 3.416 . 0 0 "[ . 1 . 2]" 1
1584 1 57 LYS HA 1 89 TYR HA . . 3.770 3.045 2.823 3.187 . 0 0 "[ . 1 . 2]" 1
1585 1 57 LYS HA 1 89 TYR QD . . 4.830 3.208 3.097 3.393 . 0 0 "[ . 1 . 2]" 1
1586 1 57 LYS HA 1 90 LYS H . . 4.780 4.491 4.262 4.635 . 0 0 "[ . 1 . 2]" 1
1587 1 57 LYS HB2 1 57 LYS QD . . 3.660 2.389 2.052 2.668 . 0 0 "[ . 1 . 2]" 1
1588 1 57 LYS HB2 1 57 LYS QE . . 5.040 2.914 2.078 4.049 . 0 0 "[ . 1 . 2]" 1
1589 1 57 LYS HB2 1 58 LEU H . . 4.990 4.332 4.145 4.459 . 0 0 "[ . 1 . 2]" 1
1590 1 57 LYS HB2 1 87 ILE MG . . 4.360 4.267 4.141 4.362 0.002 13 0 "[ . 1 . 2]" 1
1591 1 57 LYS HB3 1 57 LYS QD . . 3.730 2.587 2.273 3.445 . 0 0 "[ . 1 . 2]" 1
1592 1 57 LYS HB3 1 58 LEU H . . 3.820 3.344 3.062 3.572 . 0 0 "[ . 1 . 2]" 1
1593 1 57 LYS HB3 1 60 LYS QE . . 5.500 4.338 3.390 5.252 . 0 0 "[ . 1 . 2]" 1
1594 1 57 LYS HB3 1 87 ILE MG . . 4.360 3.169 2.913 3.431 . 0 0 "[ . 1 . 2]" 1
1595 1 57 LYS QD 1 87 ILE MD . . 4.630 4.059 3.506 4.642 0.012 15 0 "[ . 1 . 2]" 1
1596 1 57 LYS QD 1 87 ILE MG . . 3.580 2.934 2.193 3.421 . 0 0 "[ . 1 . 2]" 1
1597 1 57 LYS QE 1 57 LYS QG . . 3.080 2.230 2.087 2.616 . 0 0 "[ . 1 . 2]" 1
1598 1 57 LYS QE 1 65 ILE MD . . 4.160 3.397 2.646 4.160 . 0 0 "[ . 1 . 2]" 1
1599 1 57 LYS QG 1 58 LEU H . . 4.380 3.903 3.506 4.096 . 0 0 "[ . 1 . 2]" 1
1600 1 57 LYS QG 1 87 ILE MG . . 3.580 2.054 1.895 2.198 . 0 0 "[ . 1 . 2]" 1
1601 1 57 LYS QG 1 89 TYR QD . . 4.680 2.436 2.189 2.634 . 0 0 "[ . 1 . 2]" 1
1602 1 57 LYS QG 1 89 TYR QE . . 4.240 4.024 3.854 4.181 . 0 0 "[ . 1 . 2]" 1
1603 1 57 LYS HG2 1 58 LEU H . . 5.040 4.225 3.729 4.687 . 0 0 "[ . 1 . 2]" 1
1604 1 57 LYS HG2 1 87 ILE MG . . 4.080 2.099 1.909 2.448 . 0 0 "[ . 1 . 2]" 1
1605 1 57 LYS HG2 1 89 TYR QE . . 5.110 4.301 4.035 5.113 0.003 15 0 "[ . 1 . 2]" 1
1606 1 57 LYS HG3 1 58 LEU H . . 5.040 4.670 3.621 4.848 . 0 0 "[ . 1 . 2]" 1
1607 1 57 LYS HG3 1 87 ILE MG . . 4.080 3.322 1.979 3.587 . 0 0 "[ . 1 . 2]" 1
1608 1 57 LYS HG3 1 89 TYR QE . . 5.110 4.940 4.067 5.112 0.002 16 0 "[ . 1 . 2]" 1
1609 1 58 LEU H 1 58 LEU QB . . 3.750 2.507 2.412 2.597 . 0 0 "[ . 1 . 2]" 1
1610 1 58 LEU H 1 58 LEU MD1 . . 4.000 3.745 3.595 3.904 . 0 0 "[ . 1 . 2]" 1
1611 1 58 LEU H 1 58 LEU MD2 . . 3.910 3.332 3.145 3.572 . 0 0 "[ . 1 . 2]" 1
1612 1 58 LEU H 1 58 LEU HG . . 3.010 2.403 2.220 2.656 . 0 0 "[ . 1 . 2]" 1
1613 1 58 LEU H 1 87 ILE MD . . 5.500 5.372 5.099 5.500 0.000 2 0 "[ . 1 . 2]" 1
1614 1 58 LEU H 1 87 ILE MG . . 4.040 3.650 3.354 3.761 . 0 0 "[ . 1 . 2]" 1
1615 1 58 LEU H 1 88 SER H . . 4.810 4.554 4.239 4.800 . 0 0 "[ . 1 . 2]" 1
1616 1 58 LEU H 1 88 SER HB2 . . 4.400 3.718 3.554 3.890 . 0 0 "[ . 1 . 2]" 1
1617 1 58 LEU H 1 88 SER HB3 . . 5.480 5.134 4.970 5.266 . 0 0 "[ . 1 . 2]" 1
1618 1 58 LEU H 1 89 TYR HA . . 3.790 2.877 2.649 3.078 . 0 0 "[ . 1 . 2]" 1
1619 1 58 LEU H 1 89 TYR QD . . 5.020 4.504 4.340 4.669 . 0 0 "[ . 1 . 2]" 1
1620 1 58 LEU H 1 90 LYS H . . 5.150 4.951 4.647 5.166 0.016 15 0 "[ . 1 . 2]" 1
1621 1 58 LEU HA 1 58 LEU MD1 . . 4.020 3.882 3.830 3.953 . 0 0 "[ . 1 . 2]" 1
1622 1 58 LEU HA 1 58 LEU MD2 . . 3.220 2.248 2.140 2.411 . 0 0 "[ . 1 . 2]" 1
1623 1 58 LEU QB 1 59 LYS H . . 4.150 2.229 1.888 2.757 . 0 0 "[ . 1 . 2]" 1
1624 1 58 LEU QB 1 88 SER H . . 4.450 4.322 4.046 4.464 0.014 15 0 "[ . 1 . 2]" 1
1625 1 58 LEU QB 1 88 SER HB2 . . 3.380 2.314 2.122 2.431 . 0 0 "[ . 1 . 2]" 1
1626 1 58 LEU QB 1 88 SER HB3 . . 4.180 3.817 3.641 3.954 . 0 0 "[ . 1 . 2]" 1
1627 1 58 LEU MD1 1 88 SER HA . . 5.050 4.296 4.064 4.570 . 0 0 "[ . 1 . 2]" 1
1628 1 58 LEU MD1 1 88 SER HB2 . . 3.210 2.659 2.396 2.979 . 0 0 "[ . 1 . 2]" 1
1629 1 58 LEU MD1 1 88 SER HB3 . . 3.430 2.966 2.753 3.227 . 0 0 "[ . 1 . 2]" 1
1630 1 58 LEU MD1 1 89 TYR H . . 4.430 3.634 3.351 3.892 . 0 0 "[ . 1 . 2]" 1
1631 1 58 LEU MD1 1 89 TYR HA . . 4.530 3.184 2.901 3.414 . 0 0 "[ . 1 . 2]" 1
1632 1 58 LEU MD1 1 90 LYS H . . 4.420 4.246 3.784 4.413 . 0 0 "[ . 1 . 2]" 1
1633 1 58 LEU MD1 1 90 LYS HB2 . . 5.200 4.946 4.465 5.194 . 0 0 "[ . 1 . 2]" 1
1634 1 58 LEU MD1 1 90 LYS HB3 . . 5.500 5.133 4.498 5.428 . 0 0 "[ . 1 . 2]" 1
1635 1 58 LEU MD1 1 90 LYS HD2 . . 4.300 4.027 3.394 4.300 . 0 0 "[ . 1 . 2]" 1
1636 1 58 LEU MD1 1 90 LYS HD3 . . 4.960 4.567 4.050 4.818 . 0 0 "[ . 1 . 2]" 1
1637 1 58 LEU MD1 1 90 LYS HE2 . . 3.840 3.478 3.017 3.841 0.001 10 0 "[ . 1 . 2]" 1
1638 1 58 LEU MD1 1 90 LYS QE . . 3.180 2.169 1.957 2.636 . 0 0 "[ . 1 . 2]" 1
1639 1 58 LEU MD1 1 90 LYS HE3 . . 3.840 2.195 1.983 2.748 . 0 0 "[ . 1 . 2]" 1
1640 1 58 LEU MD1 1 90 LYS QG . . 4.150 2.644 2.049 2.829 . 0 0 "[ . 1 . 2]" 1
1641 1 58 LEU MD1 1 110 PRO HA . . 4.020 3.191 2.871 3.356 . 0 0 "[ . 1 . 2]" 1
1642 1 58 LEU MD1 1 110 PRO HB2 . . 3.540 2.679 2.537 2.827 . 0 0 "[ . 1 . 2]" 1
1643 1 58 LEU MD1 1 110 PRO HB3 . . 3.190 1.930 1.816 2.031 . 0 0 "[ . 1 . 2]" 1
1644 1 58 LEU MD1 1 110 PRO HG2 . . 4.300 4.178 4.046 4.303 0.003 9 0 "[ . 1 . 2]" 1
1645 1 58 LEU MD1 1 110 PRO HG3 . . 4.040 3.368 3.168 3.511 . 0 0 "[ . 1 . 2]" 1
1646 1 58 LEU MD1 1 111 TYR H . . 4.660 4.193 3.954 4.490 . 0 0 "[ . 1 . 2]" 1
1647 1 58 LEU MD2 1 59 LYS H . . 4.840 4.381 3.500 4.645 . 0 0 "[ . 1 . 2]" 1
1648 1 58 LEU MD2 1 88 SER HB2 . . 5.320 4.702 4.467 4.916 . 0 0 "[ . 1 . 2]" 1
1649 1 58 LEU MD2 1 89 TYR H . . 5.500 5.349 5.065 5.496 . 0 0 "[ . 1 . 2]" 1
1650 1 58 LEU MD2 1 89 TYR HA . . 4.920 3.412 3.114 3.583 . 0 0 "[ . 1 . 2]" 1
1651 1 58 LEU MD2 1 90 LYS H . . 4.420 3.832 3.527 4.050 . 0 0 "[ . 1 . 2]" 1
1652 1 58 LEU MD2 1 90 LYS HB2 . . 4.840 4.262 3.959 4.415 . 0 0 "[ . 1 . 2]" 1
1653 1 58 LEU MD2 1 90 LYS HB3 . . 5.230 5.027 4.897 5.199 . 0 0 "[ . 1 . 2]" 1
1654 1 58 LEU MD2 1 90 LYS HD2 . . 4.050 3.161 2.249 3.427 . 0 0 "[ . 1 . 2]" 1
1655 1 58 LEU MD2 1 90 LYS HD3 . . 4.590 4.346 3.740 4.558 . 0 0 "[ . 1 . 2]" 1
1656 1 58 LEU MD2 1 90 LYS HE2 . . 4.310 4.028 3.791 4.205 . 0 0 "[ . 1 . 2]" 1
1657 1 58 LEU MD2 1 90 LYS QE . . 3.770 2.506 2.188 3.187 . 0 0 "[ . 1 . 2]" 1
1658 1 58 LEU MD2 1 90 LYS HE3 . . 4.310 2.535 2.202 3.324 . 0 0 "[ . 1 . 2]" 1
1659 1 58 LEU HG 1 88 SER HB2 . . 4.600 3.601 3.254 3.875 . 0 0 "[ . 1 . 2]" 1
1660 1 58 LEU HG 1 88 SER HB3 . . 5.040 4.551 4.215 4.724 . 0 0 "[ . 1 . 2]" 1
1661 1 58 LEU HG 1 89 TYR H . . 5.090 4.126 3.858 4.285 . 0 0 "[ . 1 . 2]" 1
1662 1 58 LEU HG 1 89 TYR HA . . 4.190 2.107 2.004 2.195 . 0 0 "[ . 1 . 2]" 1
1663 1 58 LEU HG 1 90 LYS H . . 4.500 3.754 3.522 3.949 . 0 0 "[ . 1 . 2]" 1
1664 1 59 LYS H 1 59 LYS QG . . 4.090 3.430 2.100 4.105 0.015 11 0 "[ . 1 . 2]" 1
1665 1 59 LYS HA 1 59 LYS QD . . 3.990 2.860 2.016 3.998 0.008 8 0 "[ . 1 . 2]" 1
1666 1 59 LYS HA 1 59 LYS QE . . 3.800 3.434 1.970 3.894 0.094 9 0 "[ . 1 . 2]" 1
1667 1 59 LYS HA 1 59 LYS QG . . 3.320 2.513 2.127 3.019 . 0 0 "[ . 1 . 2]" 1
1668 1 59 LYS QB 1 59 LYS QD . . 3.030 2.309 1.972 2.712 . 0 0 "[ . 1 . 2]" 1
1669 1 59 LYS QB 1 59 LYS QE . . 3.780 2.819 1.996 3.762 . 0 0 "[ . 1 . 2]" 1
1670 1 59 LYS HB2 1 59 LYS QD . . 3.590 2.815 2.018 3.459 . 0 0 "[ . 1 . 2]" 1
1671 1 59 LYS HB2 1 59 LYS QE . . 4.560 3.381 2.044 4.363 . 0 0 "[ . 1 . 2]" 1
1672 1 59 LYS HB3 1 59 LYS QD . . 3.590 2.723 2.093 3.530 . 0 0 "[ . 1 . 2]" 1
1673 1 59 LYS HB3 1 59 LYS QE . . 4.560 3.416 2.010 4.273 . 0 0 "[ . 1 . 2]" 1
1674 1 59 LYS QE 1 59 LYS QG . . 3.060 2.202 2.018 2.553 . 0 0 "[ . 1 . 2]" 1
1675 1 60 LYS HA 1 60 LYS QD . . 4.030 3.553 2.158 4.139 0.109 19 0 "[ . 1 . 2]" 1
1676 1 60 LYS HA 1 60 LYS QE . . 4.910 4.443 3.646 4.805 . 0 0 "[ . 1 . 2]" 1
1677 1 60 LYS HA 1 60 LYS QG . . 3.720 2.516 2.140 3.395 . 0 0 "[ . 1 . 2]" 1
1678 1 60 LYS HA 1 61 VAL H . . 3.540 2.355 2.143 2.658 . 0 0 "[ . 1 . 2]" 1
1679 1 60 LYS HA 1 61 VAL HA . . 4.650 4.347 4.297 4.405 . 0 0 "[ . 1 . 2]" 1
1680 1 60 LYS HA 1 61 VAL MG1 . . 4.370 3.947 3.657 4.337 . 0 0 "[ . 1 . 2]" 1
1681 1 60 LYS QB 1 61 VAL MG1 . . 4.750 3.900 2.936 4.490 . 0 0 "[ . 1 . 2]" 1
1682 1 60 LYS QB 1 87 ILE MD . . 4.670 3.449 2.574 4.641 . 0 0 "[ . 1 . 2]" 1
1683 1 60 LYS HB2 1 60 LYS QE . . 4.770 2.836 2.014 3.952 . 0 0 "[ . 1 . 2]" 1
1684 1 60 LYS HB2 1 61 VAL H . . 4.290 3.723 2.077 4.294 0.004 1 0 "[ . 1 . 2]" 1
1685 1 60 LYS HB3 1 60 LYS QE . . 4.770 2.975 2.237 4.348 . 0 0 "[ . 1 . 2]" 1
1686 1 60 LYS HB3 1 61 VAL H . . 4.290 3.380 1.963 4.276 . 0 0 "[ . 1 . 2]" 1
1687 1 60 LYS QD 1 61 VAL MG1 . . 4.700 4.079 2.957 4.706 0.006 15 0 "[ . 1 . 2]" 1
1688 1 60 LYS QD 1 87 ILE MD . . 4.500 3.615 2.395 4.409 . 0 0 "[ . 1 . 2]" 1
1689 1 60 LYS QE 1 60 LYS QG . . 3.270 2.285 2.031 2.593 . 0 0 "[ . 1 . 2]" 1
1690 1 60 LYS QE 1 87 ILE MD . . 3.340 2.528 2.048 3.171 . 0 0 "[ . 1 . 2]" 1
1691 1 60 LYS QE 1 87 ILE QG . . 4.570 3.812 3.428 4.349 . 0 0 "[ . 1 . 2]" 1
1692 1 60 LYS QE 1 87 ILE MG . . 3.710 3.452 2.978 3.716 0.006 16 0 "[ . 1 . 2]" 1
1693 1 60 LYS QG 1 61 VAL H . . 4.710 2.815 1.845 3.849 . 0 0 "[ . 1 . 2]" 1
1694 1 60 LYS QG 1 61 VAL MG1 . . 4.590 3.351 2.265 4.609 0.019 5 0 "[ . 1 . 2]" 1
1695 1 60 LYS QG 1 87 ILE MD . . 4.300 3.793 2.529 4.305 0.005 14 0 "[ . 1 . 2]" 1
1696 1 60 LYS QG 1 87 ILE MG . . 4.930 4.400 2.906 4.932 0.002 2 0 "[ . 1 . 2]" 1
1697 1 61 VAL H 1 61 VAL HB . . 3.880 2.692 2.473 3.114 . 0 0 "[ . 1 . 2]" 1
1698 1 61 VAL H 1 61 VAL MG1 . . 3.720 2.062 1.842 2.365 . 0 0 "[ . 1 . 2]" 1
1699 1 61 VAL HA 1 61 VAL MG1 . . 3.520 3.191 3.169 3.201 . 0 0 "[ . 1 . 2]" 1
1700 1 61 VAL HA 1 61 VAL MG2 . . 3.060 2.363 2.179 2.523 . 0 0 "[ . 1 . 2]" 1
1701 1 61 VAL MG2 1 62 GLY HA2 . . 4.510 3.251 2.908 4.021 . 0 0 "[ . 1 . 2]" 1
1702 1 61 VAL MG2 1 62 GLY QA . . 3.870 3.126 2.800 3.689 . 0 0 "[ . 1 . 2]" 1
1703 1 61 VAL MG2 1 62 GLY HA3 . . 4.510 4.090 3.585 4.487 . 0 0 "[ . 1 . 2]" 1
1704 1 62 GLY QA 1 63 ASP H . . 2.960 2.146 2.109 2.282 . 0 0 "[ . 1 . 2]" 1
1705 1 62 GLY QA 1 63 ASP QB . . 4.300 3.997 3.529 4.329 0.029 17 0 "[ . 1 . 2]" 1
1706 1 62 GLY QA 1 65 ILE MD . . 5.340 3.896 3.215 5.281 . 0 0 "[ . 1 . 2]" 1
1707 1 62 GLY HA2 1 63 ASP H . . 3.450 2.252 2.137 3.158 . 0 0 "[ . 1 . 2]" 1
1708 1 62 GLY HA3 1 63 ASP H . . 3.450 3.057 2.150 3.427 . 0 0 "[ . 1 . 2]" 1
1709 1 63 ASP H 1 63 ASP HB2 . . 3.730 2.913 2.180 3.762 0.032 17 0 "[ . 1 . 2]" 1
1710 1 63 ASP H 1 63 ASP QB . . 3.210 2.392 2.145 3.240 0.030 17 0 "[ . 1 . 2]" 1
1711 1 63 ASP H 1 63 ASP HB3 . . 3.730 3.041 2.216 3.566 . 0 0 "[ . 1 . 2]" 1
1712 1 63 ASP H 1 64 TRP H . . 4.700 4.438 2.883 4.608 . 0 0 "[ . 1 . 2]" 1
1713 1 63 ASP H 1 65 ILE MD . . 5.490 3.820 3.028 4.695 . 0 0 "[ . 1 . 2]" 1
1714 1 63 ASP QB 1 64 TRP H . . 3.080 2.223 1.949 2.990 . 0 0 "[ . 1 . 2]" 1
1715 1 63 ASP QB 1 64 TRP HD1 . . 5.340 4.004 2.169 5.356 0.016 17 0 "[ . 1 . 2]" 1
1716 1 63 ASP QB 1 65 ILE MD . . 4.280 3.834 2.521 4.267 . 0 0 "[ . 1 . 2]" 1
1717 1 63 ASP HB2 1 65 ILE MD . . 4.920 4.324 2.559 4.739 . 0 0 "[ . 1 . 2]" 1
1718 1 63 ASP HB3 1 65 ILE MD . . 4.920 4.410 3.403 4.939 0.019 14 0 "[ . 1 . 2]" 1
1719 1 64 TRP H 1 64 TRP QB . . 3.370 2.340 2.277 2.797 . 0 0 "[ . 1 . 2]" 1
1720 1 64 TRP H 1 64 TRP HD1 . . 3.360 2.556 2.077 3.367 0.007 14 0 "[ . 1 . 2]" 1
1721 1 64 TRP H 1 65 ILE H . . 4.890 4.592 4.338 4.642 . 0 0 "[ . 1 . 2]" 1
1722 1 64 TRP HA 1 64 TRP HD1 . . 4.790 3.949 3.597 4.280 . 0 0 "[ . 1 . 2]" 1
1723 1 64 TRP HA 1 64 TRP HE3 . . 4.170 3.350 2.787 3.899 . 0 0 "[ . 1 . 2]" 1
1724 1 64 TRP HA 1 65 ILE H . . 3.150 2.257 2.141 2.552 . 0 0 "[ . 1 . 2]" 1
1725 1 64 TRP HA 1 65 ILE MD . . 4.770 3.618 3.036 3.881 . 0 0 "[ . 1 . 2]" 1
1726 1 64 TRP QB 1 64 TRP HD1 . . 3.560 2.652 2.544 2.806 . 0 0 "[ . 1 . 2]" 1
1727 1 64 TRP QB 1 64 TRP HE3 . . 3.700 2.517 2.389 2.694 . 0 0 "[ . 1 . 2]" 1
1728 1 64 TRP QB 1 65 ILE H . . 3.850 2.823 2.097 3.355 . 0 0 "[ . 1 . 2]" 1
1729 1 64 TRP QB 1 65 ILE MD . . 5.450 4.356 3.906 4.557 . 0 0 "[ . 1 . 2]" 1
1730 1 64 TRP QB 1 65 ILE MG . . 5.410 5.325 5.128 5.418 0.008 17 0 "[ . 1 . 2]" 1
1731 1 64 TRP QB 1 92 ARG QH1 . . 4.910 3.698 3.379 4.450 . 0 0 "[ . 1 . 2]" 1
1732 1 64 TRP HD1 1 92 ARG QH1 . . 5.300 4.637 3.795 5.319 0.019 13 0 "[ . 1 . 2]" 1
1733 1 64 TRP HE3 1 65 ILE H . . 4.450 3.366 2.917 3.637 . 0 0 "[ . 1 . 2]" 1
1734 1 64 TRP HE3 1 91 PHE HA . . 5.100 4.661 4.387 4.935 . 0 0 "[ . 1 . 2]" 1
1735 1 64 TRP HE3 1 92 ARG HD2 . . 5.500 4.208 3.720 5.513 0.013 13 0 "[ . 1 . 2]" 1
1736 1 64 TRP HE3 1 92 ARG HD3 . . 5.500 5.247 4.139 5.499 . 0 0 "[ . 1 . 2]" 1
1737 1 64 TRP HE3 1 92 ARG HE . . 5.030 3.717 2.444 4.333 . 0 0 "[ . 1 . 2]" 1
1738 1 64 TRP HE3 1 92 ARG HG2 . . 4.900 3.167 2.714 4.904 0.004 19 0 "[ . 1 . 2]" 1
1739 1 64 TRP HE3 1 92 ARG HG3 . . 4.900 4.552 3.500 4.811 . 0 0 "[ . 1 . 2]" 1
1740 1 64 TRP HH2 1 90 LYS HB2 . . 4.340 2.647 2.411 3.121 . 0 0 "[ . 1 . 2]" 1
1741 1 64 TRP HH2 1 90 LYS HB3 . . 4.350 3.453 2.948 3.801 . 0 0 "[ . 1 . 2]" 1
1742 1 64 TRP HH2 1 107 PRO HB2 . . 3.980 3.375 2.945 3.628 . 0 0 "[ . 1 . 2]" 1
1743 1 64 TRP HH2 1 107 PRO HB3 . . 3.980 2.472 2.193 2.739 . 0 0 "[ . 1 . 2]" 1
1744 1 64 TRP HH2 1 107 PRO HG2 . . 5.500 5.293 4.990 5.499 . 0 0 "[ . 1 . 2]" 1
1745 1 64 TRP HH2 1 107 PRO HG3 . . 5.060 4.775 4.446 5.062 0.002 2 0 "[ . 1 . 2]" 1
1746 1 64 TRP HH2 1 108 SER H . . 4.700 4.353 4.178 4.651 . 0 0 "[ . 1 . 2]" 1
1747 1 64 TRP HZ2 1 90 LYS HB2 . . 4.870 4.236 3.874 4.550 . 0 0 "[ . 1 . 2]" 1
1748 1 64 TRP HZ2 1 90 LYS HB3 . . 5.410 5.297 4.811 5.418 0.008 17 0 "[ . 1 . 2]" 1
1749 1 64 TRP HZ2 1 90 LYS HD2 . . 4.890 4.145 3.769 4.661 . 0 0 "[ . 1 . 2]" 1
1750 1 64 TRP HZ2 1 90 LYS QG . . 5.500 5.159 4.724 5.504 0.004 13 0 "[ . 1 . 2]" 1
1751 1 64 TRP HZ2 1 92 ARG HE . . 4.970 3.999 3.559 4.973 0.003 19 0 "[ . 1 . 2]" 1
1752 1 64 TRP HZ2 1 107 PRO HB2 . . 4.720 3.764 3.492 3.927 . 0 0 "[ . 1 . 2]" 1
1753 1 64 TRP HZ2 1 107 PRO QB . . 4.060 2.380 2.166 2.679 . 0 0 "[ . 1 . 2]" 1
1754 1 64 TRP HZ2 1 107 PRO HB3 . . 4.720 2.407 2.187 2.730 . 0 0 "[ . 1 . 2]" 1
1755 1 64 TRP HZ2 1 107 PRO HG2 . . 5.200 5.119 4.877 5.203 0.003 14 0 "[ . 1 . 2]" 1
1756 1 64 TRP HZ2 1 107 PRO HG3 . . 4.740 3.881 3.635 3.990 . 0 0 "[ . 1 . 2]" 1
1757 1 64 TRP HZ3 1 91 PHE HA . . 3.760 2.890 2.542 3.131 . 0 0 "[ . 1 . 2]" 1
1758 1 64 TRP HZ3 1 92 ARG H . . 3.930 3.569 3.200 3.862 . 0 0 "[ . 1 . 2]" 1
1759 1 64 TRP HZ3 1 92 ARG QG . . 4.750 2.552 2.149 2.851 . 0 0 "[ . 1 . 2]" 1
1760 1 65 ILE H 1 65 ILE HB . . 3.650 2.935 2.846 3.017 . 0 0 "[ . 1 . 2]" 1
1761 1 65 ILE H 1 65 ILE MD . . 4.190 3.348 3.067 3.645 . 0 0 "[ . 1 . 2]" 1
1762 1 65 ILE H 1 65 ILE HG12 . . 3.890 2.317 2.160 2.565 . 0 0 "[ . 1 . 2]" 1
1763 1 65 ILE H 1 65 ILE HG13 . . 4.110 3.842 3.718 4.036 . 0 0 "[ . 1 . 2]" 1
1764 1 65 ILE H 1 65 ILE MG . . 4.110 3.922 3.890 3.974 . 0 0 "[ . 1 . 2]" 1
1765 1 65 ILE H 1 66 LEU H . . 4.620 4.474 4.377 4.510 . 0 0 "[ . 1 . 2]" 1
1766 1 65 ILE HA 1 65 ILE MD . . 3.530 2.298 2.135 2.536 . 0 0 "[ . 1 . 2]" 1
1767 1 65 ILE HA 1 65 ILE HG12 . . 3.790 3.275 3.168 3.462 . 0 0 "[ . 1 . 2]" 1
1768 1 65 ILE HA 1 65 ILE HG13 . . 4.010 3.908 3.863 3.938 . 0 0 "[ . 1 . 2]" 1
1769 1 65 ILE HA 1 65 ILE MG . . 3.120 2.097 2.027 2.165 . 0 0 "[ . 1 . 2]" 1
1770 1 65 ILE HA 1 66 LEU H . . 2.980 2.378 2.214 2.490 . 0 0 "[ . 1 . 2]" 1
1771 1 65 ILE HA 1 66 LEU HB2 . . 4.560 4.420 4.350 4.522 . 0 0 "[ . 1 . 2]" 1
1772 1 65 ILE HA 1 66 LEU HB3 . . 4.740 4.702 4.608 4.750 0.010 7 0 "[ . 1 . 2]" 1
1773 1 65 ILE HB 1 65 ILE MD . . 3.260 3.216 3.208 3.227 . 0 0 "[ . 1 . 2]" 1
1774 1 65 ILE HB 1 66 LEU H . . 4.150 3.294 3.001 3.757 . 0 0 "[ . 1 . 2]" 1
1775 1 65 ILE MD 1 66 LEU H . . 4.490 3.956 3.837 4.127 . 0 0 "[ . 1 . 2]" 1
1776 1 65 ILE HG12 1 65 ILE MG . . 3.350 3.192 3.184 3.200 . 0 0 "[ . 1 . 2]" 1
1777 1 65 ILE HG12 1 66 LEU H . . 5.220 4.947 4.833 5.117 . 0 0 "[ . 1 . 2]" 1
1778 1 65 ILE HG13 1 65 ILE MG . . 3.220 2.366 2.274 2.418 . 0 0 "[ . 1 . 2]" 1
1779 1 65 ILE HG13 1 66 LEU H . . 5.360 5.034 4.853 5.357 . 0 0 "[ . 1 . 2]" 1
1780 1 65 ILE MG 1 66 LEU H . . 3.290 1.998 1.853 2.254 . 0 0 "[ . 1 . 2]" 1
1781 1 65 ILE MG 1 66 LEU HB2 . . 4.470 4.326 4.231 4.472 0.002 13 0 "[ . 1 . 2]" 1
1782 1 65 ILE MG 1 66 LEU HB3 . . 4.380 3.710 3.579 3.872 . 0 0 "[ . 1 . 2]" 1
1783 1 65 ILE MG 1 67 ALA HA . . 4.870 4.604 4.442 4.868 . 0 0 "[ . 1 . 2]" 1
1784 1 66 LEU H 1 66 LEU HB2 . . 3.340 2.787 2.607 2.946 . 0 0 "[ . 1 . 2]" 1
1785 1 66 LEU H 1 66 LEU HB3 . . 3.310 2.472 2.384 2.529 . 0 0 "[ . 1 . 2]" 1
1786 1 66 LEU H 1 66 LEU MD1 . . 4.340 4.197 4.089 4.271 . 0 0 "[ . 1 . 2]" 1
1787 1 66 LEU H 1 66 LEU MD2 . . 4.440 4.328 4.253 4.405 . 0 0 "[ . 1 . 2]" 1
1788 1 66 LEU H 1 66 LEU HG . . 4.490 4.446 4.377 4.491 0.001 18 0 "[ . 1 . 2]" 1
1789 1 66 LEU H 1 67 ALA H . . 4.540 4.426 4.348 4.548 0.008 14 0 "[ . 1 . 2]" 1
1790 1 66 LEU HA 1 66 LEU MD1 . . 3.060 2.046 1.955 2.229 . 0 0 "[ . 1 . 2]" 1
1791 1 66 LEU HA 1 66 LEU MD2 . . 3.960 3.827 3.625 3.892 . 0 0 "[ . 1 . 2]" 1
1792 1 66 LEU HA 1 66 LEU HG . . 4.000 3.257 3.123 3.469 . 0 0 "[ . 1 . 2]" 1
1793 1 66 LEU HA 1 67 ALA H . . 3.340 2.146 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
1794 1 66 LEU HA 1 67 ALA HA . . 4.520 4.388 4.379 4.414 . 0 0 "[ . 1 . 2]" 1
1795 1 66 LEU HA 1 67 ALA MB . . 4.150 3.930 3.898 4.009 . 0 0 "[ . 1 . 2]" 1
1796 1 66 LEU HA 1 68 THR H . . 4.650 4.529 4.260 4.651 0.001 19 0 "[ . 1 . 2]" 1
1797 1 66 LEU HB2 1 66 LEU MD1 . . 3.100 2.423 2.295 2.590 . 0 0 "[ . 1 . 2]" 1
1798 1 66 LEU HB2 1 66 LEU MD2 . . 3.090 2.272 2.080 2.395 . 0 0 "[ . 1 . 2]" 1
1799 1 66 LEU HB2 1 67 ALA H . . 4.700 4.271 4.092 4.389 . 0 0 "[ . 1 . 2]" 1
1800 1 66 LEU HB3 1 66 LEU MD1 . . 3.360 3.189 3.146 3.196 . 0 0 "[ . 1 . 2]" 1
1801 1 66 LEU HB3 1 66 LEU MD2 . . 3.060 2.404 2.286 2.632 . 0 0 "[ . 1 . 2]" 1
1802 1 66 LEU HB3 1 67 ALA H . . 5.120 4.248 4.151 4.347 . 0 0 "[ . 1 . 2]" 1
1803 1 66 LEU MD1 1 67 ALA H . . 3.360 2.237 1.927 2.726 . 0 0 "[ . 1 . 2]" 1
1804 1 66 LEU MD1 1 67 ALA HA . . 4.750 4.422 4.041 4.759 0.009 5 0 "[ . 1 . 2]" 1
1805 1 66 LEU MD1 1 68 THR H . . 3.680 3.089 2.352 3.412 . 0 0 "[ . 1 . 2]" 1
1806 1 66 LEU MD1 1 69 SER HB2 . . 4.250 3.660 2.634 4.052 . 0 0 "[ . 1 . 2]" 1
1807 1 66 LEU MD1 1 69 SER QB . . 3.650 2.723 2.464 3.658 0.008 11 0 "[ . 1 . 2]" 1
1808 1 66 LEU MD1 1 69 SER HB3 . . 4.250 3.003 2.489 4.240 . 0 0 "[ . 1 . 2]" 1
1809 1 66 LEU MD2 1 67 ALA H . . 4.780 4.637 4.379 4.784 0.004 15 0 "[ . 1 . 2]" 1
1810 1 66 LEU MD2 1 68 THR H . . 5.380 5.124 4.909 5.293 . 0 0 "[ . 1 . 2]" 1
1811 1 66 LEU MD2 1 69 SER HB2 . . 4.130 3.674 3.111 3.957 . 0 0 "[ . 1 . 2]" 1
1812 1 66 LEU MD2 1 69 SER QB . . 3.570 2.852 2.363 3.321 . 0 0 "[ . 1 . 2]" 1
1813 1 66 LEU MD2 1 69 SER HB3 . . 4.130 3.073 2.396 4.015 . 0 0 "[ . 1 . 2]" 1
1814 1 66 LEU HG 1 67 ALA H . . 4.400 3.430 3.071 4.043 . 0 0 "[ . 1 . 2]" 1
1815 1 66 LEU HG 1 68 THR H . . 4.210 4.042 3.726 4.205 . 0 0 "[ . 1 . 2]" 1
1816 1 67 ALA H 1 67 ALA MB . . 3.190 2.208 2.103 2.377 . 0 0 "[ . 1 . 2]" 1
1817 1 67 ALA H 1 68 THR H . . 3.460 2.662 2.408 2.769 . 0 0 "[ . 1 . 2]" 1
1818 1 67 ALA H 1 68 THR MG . . 5.100 4.577 4.333 4.808 . 0 0 "[ . 1 . 2]" 1
1819 1 67 ALA HA 1 80 ILE MD . . 4.840 4.558 4.296 4.844 0.004 17 0 "[ . 1 . 2]" 1
1820 1 67 ALA MB 1 68 THR H . . 3.320 2.090 1.920 2.354 . 0 0 "[ . 1 . 2]" 1
1821 1 67 ALA MB 1 68 THR HB . . 4.280 3.276 3.112 3.480 . 0 0 "[ . 1 . 2]" 1
1822 1 67 ALA MB 1 80 ILE HA . . 4.840 3.723 3.479 3.928 . 0 0 "[ . 1 . 2]" 1
1823 1 67 ALA MB 1 80 ILE MD . . 3.050 2.068 1.938 2.266 . 0 0 "[ . 1 . 2]" 1
1824 1 67 ALA MB 1 80 ILE MG . . 3.080 1.804 1.719 1.951 . 0 0 "[ . 1 . 2]" 1
1825 1 67 ALA MB 1 81 THR H . . 4.880 4.582 4.081 4.880 0.000 8 0 "[ . 1 . 2]" 1
1826 1 68 THR H 1 68 THR HB . . 3.950 3.032 2.893 3.229 . 0 0 "[ . 1 . 2]" 1
1827 1 68 THR H 1 68 THR MG . . 3.760 2.388 2.189 2.568 . 0 0 "[ . 1 . 2]" 1
1828 1 68 THR H 1 80 ILE MD . . 4.720 3.155 2.976 3.445 . 0 0 "[ . 1 . 2]" 1
1829 1 68 THR HA 1 68 THR MG . . 3.460 3.188 3.162 3.203 . 0 0 "[ . 1 . 2]" 1
1830 1 68 THR HA 1 69 SER H . . 3.210 2.508 2.344 2.629 . 0 0 "[ . 1 . 2]" 1
1831 1 68 THR HB 1 69 SER H . . 4.190 3.756 3.589 3.961 . 0 0 "[ . 1 . 2]" 1
1832 1 68 THR HB 1 71 ILE MD . . 4.360 4.208 4.016 4.365 0.005 11 0 "[ . 1 . 2]" 1
1833 1 68 THR HB 1 78 VAL MG2 . . 4.100 3.867 3.682 4.050 . 0 0 "[ . 1 . 2]" 1
1834 1 68 THR HB 1 80 ILE MD . . 3.880 2.738 2.459 3.110 . 0 0 "[ . 1 . 2]" 1
1835 1 68 THR HB 1 80 ILE MG . . 4.870 3.947 3.612 4.282 . 0 0 "[ . 1 . 2]" 1
1836 1 68 THR MG 1 69 SER H . . 4.010 2.888 2.537 3.216 . 0 0 "[ . 1 . 2]" 1
1837 1 68 THR MG 1 70 ALA H . . 5.340 5.152 4.974 5.324 . 0 0 "[ . 1 . 2]" 1
1838 1 68 THR MG 1 71 ILE HB . . 4.750 4.531 4.356 4.743 . 0 0 "[ . 1 . 2]" 1
1839 1 68 THR MG 1 71 ILE MD . . 2.840 1.884 1.773 1.995 . 0 0 "[ . 1 . 2]" 1
1840 1 68 THR MG 1 71 ILE HG13 . . 3.450 2.863 2.635 3.240 . 0 0 "[ . 1 . 2]" 1
1841 1 68 THR MG 1 78 VAL HB . . 4.680 3.934 3.706 4.060 . 0 0 "[ . 1 . 2]" 1
1842 1 68 THR MG 1 80 ILE HA . . 4.320 4.085 3.776 4.256 . 0 0 "[ . 1 . 2]" 1
1843 1 68 THR MG 1 80 ILE MD . . 3.100 2.156 1.857 2.339 . 0 0 "[ . 1 . 2]" 1
1844 1 68 THR MG 1 81 THR H . . 5.500 5.371 5.082 5.498 . 0 0 "[ . 1 . 2]" 1
1845 1 69 SER QB 1 70 ALA MB . . 4.190 3.598 3.206 3.798 . 0 0 "[ . 1 . 2]" 1
1846 1 69 SER QB 1 71 ILE HG13 . . 5.340 4.754 4.559 4.916 . 0 0 "[ . 1 . 2]" 1
1847 1 69 SER HB2 1 70 ALA H . . 3.860 2.634 2.067 3.492 . 0 0 "[ . 1 . 2]" 1
1848 1 69 SER HB3 1 70 ALA H . . 3.860 3.463 2.058 3.827 . 0 0 "[ . 1 . 2]" 1
1849 1 70 ALA H 1 70 ALA MB . . 3.240 2.913 2.840 2.951 . 0 0 "[ . 1 . 2]" 1
1850 1 70 ALA H 1 71 ILE H . . 4.060 2.545 2.463 2.676 . 0 0 "[ . 1 . 2]" 1
1851 1 70 ALA H 1 71 ILE HG13 . . 4.930 3.960 3.860 4.080 . 0 0 "[ . 1 . 2]" 1
1852 1 70 ALA HA 1 71 ILE H . . 3.300 2.944 2.856 2.989 . 0 0 "[ . 1 . 2]" 1
1853 1 70 ALA HA 1 71 ILE HB . . 5.490 5.329 5.286 5.383 . 0 0 "[ . 1 . 2]" 1
1854 1 70 ALA MB 1 71 ILE H . . 3.660 3.614 3.586 3.661 0.001 18 0 "[ . 1 . 2]" 1
1855 1 71 ILE H 1 71 ILE HB . . 3.520 2.509 2.482 2.548 . 0 0 "[ . 1 . 2]" 1
1856 1 71 ILE H 1 71 ILE MD . . 3.820 3.647 3.527 3.740 . 0 0 "[ . 1 . 2]" 1
1857 1 71 ILE H 1 71 ILE HG12 . . 3.720 3.535 3.428 3.667 . 0 0 "[ . 1 . 2]" 1
1858 1 71 ILE H 1 71 ILE HG13 . . 3.450 2.283 2.180 2.385 . 0 0 "[ . 1 . 2]" 1
1859 1 71 ILE H 1 71 ILE MG . . 4.000 3.775 3.766 3.786 . 0 0 "[ . 1 . 2]" 1
1860 1 71 ILE HA 1 71 ILE MD . . 3.940 3.834 3.791 3.865 . 0 0 "[ . 1 . 2]" 1
1861 1 71 ILE HA 1 71 ILE HG12 . . 3.920 2.546 2.475 2.611 . 0 0 "[ . 1 . 2]" 1
1862 1 71 ILE HA 1 71 ILE HG13 . . 4.080 3.015 2.910 3.086 . 0 0 "[ . 1 . 2]" 1
1863 1 71 ILE HA 1 71 ILE MG . . 3.270 2.448 2.410 2.468 . 0 0 "[ . 1 . 2]" 1
1864 1 71 ILE HA 1 72 PRO HD2 . . 3.260 2.169 2.155 2.178 . 0 0 "[ . 1 . 2]" 1
1865 1 71 ILE HA 1 72 PRO HD3 . . 3.150 2.253 2.252 2.254 . 0 0 "[ . 1 . 2]" 1
1866 1 71 ILE HA 1 72 PRO QG . . 4.000 3.868 3.860 3.873 . 0 0 "[ . 1 . 2]" 1
1867 1 71 ILE HB 1 71 ILE MD . . 3.130 2.442 2.400 2.513 . 0 0 "[ . 1 . 2]" 1
1868 1 71 ILE HB 1 78 VAL MG1 . . 4.630 4.116 3.977 4.222 . 0 0 "[ . 1 . 2]" 1
1869 1 71 ILE MD 1 71 ILE MG . . 2.840 1.973 1.907 2.069 . 0 0 "[ . 1 . 2]" 1
1870 1 71 ILE MD 1 72 PRO HD2 . . 4.590 4.287 4.190 4.379 . 0 0 "[ . 1 . 2]" 1
1871 1 71 ILE MD 1 78 VAL HB . . 3.800 3.472 3.361 3.601 . 0 0 "[ . 1 . 2]" 1
1872 1 71 ILE MD 1 78 VAL MG1 . . 2.920 1.892 1.785 2.069 . 0 0 "[ . 1 . 2]" 1
1873 1 71 ILE MD 1 78 VAL MG2 . . 3.020 1.966 1.931 2.042 . 0 0 "[ . 1 . 2]" 1
1874 1 71 ILE MD 1 79 GLU H . . 5.500 5.470 5.351 5.506 0.006 8 0 "[ . 1 . 2]" 1
1875 1 71 ILE MD 1 93 VAL MG1 . . 4.520 4.310 4.137 4.525 0.005 14 0 "[ . 1 . 2]" 1
1876 1 71 ILE HG12 1 71 ILE MG . . 3.300 2.296 2.227 2.351 . 0 0 "[ . 1 . 2]" 1
1877 1 71 ILE HG12 1 72 PRO HD2 . . 4.630 3.528 3.453 3.630 . 0 0 "[ . 1 . 2]" 1
1878 1 71 ILE HG12 1 72 PRO HD3 . . 4.850 4.406 4.340 4.490 . 0 0 "[ . 1 . 2]" 1
1879 1 71 ILE HG12 1 75 ARG HD3 . . 4.740 4.116 3.812 4.339 . 0 0 "[ . 1 . 2]" 1
1880 1 71 ILE HG13 1 72 PRO HD2 . . 4.830 4.623 4.525 4.699 . 0 0 "[ . 1 . 2]" 1
1881 1 71 ILE HG13 1 72 PRO HD3 . . 5.380 5.242 5.128 5.317 . 0 0 "[ . 1 . 2]" 1
1882 1 71 ILE HG13 1 78 VAL MG2 . . 5.010 4.408 4.310 4.534 . 0 0 "[ . 1 . 2]" 1
1883 1 71 ILE MG 1 72 PRO HB2 . . 5.030 4.261 4.234 4.309 . 0 0 "[ . 1 . 2]" 1
1884 1 71 ILE MG 1 72 PRO HD2 . . 3.410 1.818 1.808 1.861 . 0 0 "[ . 1 . 2]" 1
1885 1 71 ILE MG 1 72 PRO HD3 . . 3.660 3.151 3.143 3.182 . 0 0 "[ . 1 . 2]" 1
1886 1 71 ILE MG 1 72 PRO QG . . 3.900 2.861 2.844 2.883 . 0 0 "[ . 1 . 2]" 1
1887 1 71 ILE MG 1 75 ARG H . . 3.800 3.619 3.471 3.719 . 0 0 "[ . 1 . 2]" 1
1888 1 71 ILE MG 1 75 ARG HA . . 4.880 4.470 4.341 4.548 . 0 0 "[ . 1 . 2]" 1
1889 1 71 ILE MG 1 75 ARG HB2 . . 3.650 3.470 3.345 3.522 . 0 0 "[ . 1 . 2]" 1
1890 1 71 ILE MG 1 75 ARG QB . . 3.120 2.134 2.025 2.188 . 0 0 "[ . 1 . 2]" 1
1891 1 71 ILE MG 1 75 ARG HB3 . . 3.650 2.154 2.042 2.211 . 0 0 "[ . 1 . 2]" 1
1892 1 71 ILE MG 1 75 ARG HD2 . . 4.140 3.762 3.604 3.864 . 0 0 "[ . 1 . 2]" 1
1893 1 71 ILE MG 1 75 ARG HD3 . . 3.660 2.636 2.465 2.804 . 0 0 "[ . 1 . 2]" 1
1894 1 71 ILE MG 1 75 ARG HG2 . . 3.310 2.464 2.354 2.560 . 0 0 "[ . 1 . 2]" 1
1895 1 71 ILE MG 1 75 ARG HG3 . . 4.080 3.825 3.707 3.908 . 0 0 "[ . 1 . 2]" 1
1896 1 71 ILE MG 1 77 SER H . . 4.830 4.345 4.239 4.495 . 0 0 "[ . 1 . 2]" 1
1897 1 71 ILE MG 1 78 VAL H . . 5.500 5.470 5.391 5.505 0.005 5 0 "[ . 1 . 2]" 1
1898 1 71 ILE MG 1 78 VAL HB . . 4.690 4.356 4.269 4.417 . 0 0 "[ . 1 . 2]" 1
1899 1 71 ILE MG 1 78 VAL MG1 . . 3.040 2.266 2.203 2.316 . 0 0 "[ . 1 . 2]" 1
1900 1 71 ILE MG 1 78 VAL MG2 . . 4.010 3.859 3.775 3.929 . 0 0 "[ . 1 . 2]" 1
1901 1 72 PRO HB2 1 73 PRO HA . . 4.840 4.804 4.787 4.817 . 0 0 "[ . 1 . 2]" 1
1902 1 72 PRO HB2 1 73 PRO HD2 . . 3.250 2.440 2.367 2.493 . 0 0 "[ . 1 . 2]" 1
1903 1 72 PRO HB2 1 73 PRO HD3 . . 3.940 3.814 3.755 3.856 . 0 0 "[ . 1 . 2]" 1
1904 1 72 PRO HB2 1 73 PRO HG2 . . 4.690 4.023 3.961 4.070 . 0 0 "[ . 1 . 2]" 1
1905 1 72 PRO HB2 1 73 PRO HG3 . . 5.260 5.006 4.938 5.056 . 0 0 "[ . 1 . 2]" 1
1906 1 72 PRO HB2 1 74 SER H . . 3.910 2.352 2.221 2.519 . 0 0 "[ . 1 . 2]" 1
1907 1 72 PRO HB2 1 75 ARG H . . 4.570 3.009 2.829 3.139 . 0 0 "[ . 1 . 2]" 1
1908 1 72 PRO HB3 1 73 PRO HD2 . . 3.160 2.910 2.871 2.939 . 0 0 "[ . 1 . 2]" 1
1909 1 72 PRO HB3 1 74 SER H . . 4.440 4.018 3.921 4.155 . 0 0 "[ . 1 . 2]" 1
1910 1 72 PRO HD2 1 75 ARG H . . 4.810 4.370 4.193 4.534 . 0 0 "[ . 1 . 2]" 1
1911 1 72 PRO HD2 1 75 ARG QB . . 3.460 2.494 2.379 2.591 . 0 0 "[ . 1 . 2]" 1
1912 1 72 PRO HD2 1 75 ARG HD2 . . 3.880 3.702 3.532 3.799 . 0 0 "[ . 1 . 2]" 1
1913 1 72 PRO HD2 1 75 ARG HD3 . . 3.680 3.028 2.898 3.133 . 0 0 "[ . 1 . 2]" 1
1914 1 72 PRO HD2 1 75 ARG HG2 . . 4.480 3.781 3.741 3.809 . 0 0 "[ . 1 . 2]" 1
1915 1 72 PRO HD2 1 75 ARG HG3 . . 5.040 4.897 4.800 4.958 . 0 0 "[ . 1 . 2]" 1
1916 1 72 PRO HD3 1 75 ARG HD2 . . 4.900 4.737 4.569 4.866 . 0 0 "[ . 1 . 2]" 1
1917 1 72 PRO HD3 1 75 ARG HD3 . . 4.710 4.332 4.212 4.414 . 0 0 "[ . 1 . 2]" 1
1918 1 72 PRO HD3 1 75 ARG HG2 . . 5.500 5.496 5.464 5.512 0.012 14 0 "[ . 1 . 2]" 1
1919 1 72 PRO QG 1 74 SER H . . 4.050 3.644 3.379 3.877 . 0 0 "[ . 1 . 2]" 1
1920 1 72 PRO QG 1 75 ARG H . . 4.030 2.614 2.417 2.811 . 0 0 "[ . 1 . 2]" 1
1921 1 72 PRO QG 1 75 ARG QB . . 3.200 1.783 1.765 1.868 . 0 0 "[ . 1 . 2]" 1
1922 1 72 PRO QG 1 75 ARG HD2 . . 3.960 3.142 3.070 3.369 . 0 0 "[ . 1 . 2]" 1
1923 1 72 PRO QG 1 75 ARG HD3 . . 4.390 3.550 3.482 3.674 . 0 0 "[ . 1 . 2]" 1
1924 1 72 PRO QG 1 75 ARG HG2 . . 4.110 3.951 3.891 4.079 . 0 0 "[ . 1 . 2]" 1
1925 1 72 PRO QG 1 75 ARG HG3 . . 4.420 4.283 4.251 4.406 . 0 0 "[ . 1 . 2]" 1
1926 1 73 PRO HA 1 75 ARG H . . 4.350 3.929 3.743 4.192 . 0 0 "[ . 1 . 2]" 1
1927 1 73 PRO HB2 1 74 SER H . . 3.910 3.561 3.376 3.741 . 0 0 "[ . 1 . 2]" 1
1928 1 73 PRO HB2 1 76 LEU MD2 . . 5.030 4.884 4.770 4.995 . 0 0 "[ . 1 . 2]" 1
1929 1 73 PRO HB3 1 76 LEU MD2 . . 5.500 5.408 5.269 5.504 0.004 13 0 "[ . 1 . 2]" 1
1930 1 73 PRO HD2 1 74 SER H . . 4.500 2.698 2.647 2.793 . 0 0 "[ . 1 . 2]" 1
1931 1 73 PRO HD2 1 75 ARG H . . 5.190 4.485 4.411 4.584 . 0 0 "[ . 1 . 2]" 1
1932 1 73 PRO HG2 1 74 SER H . . 3.020 2.677 2.421 2.950 . 0 0 "[ . 1 . 2]" 1
1933 1 73 PRO HG2 1 74 SER QB . . 5.110 3.636 3.369 4.212 . 0 0 "[ . 1 . 2]" 1
1934 1 73 PRO HG3 1 74 SER H . . 4.320 4.110 3.919 4.316 . 0 0 "[ . 1 . 2]" 1
1935 1 74 SER H 1 74 SER HB2 . . 3.810 2.851 2.203 3.642 . 0 0 "[ . 1 . 2]" 1
1936 1 74 SER H 1 74 SER QB . . 3.050 2.405 2.181 2.681 . 0 0 "[ . 1 . 2]" 1
1937 1 74 SER H 1 74 SER HB3 . . 3.810 2.924 2.447 3.631 . 0 0 "[ . 1 . 2]" 1
1938 1 74 SER H 1 75 ARG H . . 2.920 2.360 2.224 2.488 . 0 0 "[ . 1 . 2]" 1
1939 1 74 SER H 1 75 ARG QB . . 4.820 4.127 4.013 4.232 . 0 0 "[ . 1 . 2]" 1
1940 1 74 SER HA 1 76 LEU MD1 . . 4.960 4.841 4.636 4.948 . 0 0 "[ . 1 . 2]" 1
1941 1 74 SER HA 1 76 LEU MD2 . . 4.180 3.944 3.718 4.120 . 0 0 "[ . 1 . 2]" 1
1942 1 74 SER HA 1 76 LEU HG . . 4.650 4.234 4.078 4.374 . 0 0 "[ . 1 . 2]" 1
1943 1 74 SER QB 1 75 ARG H . . 4.200 3.304 2.854 3.742 . 0 0 "[ . 1 . 2]" 1
1944 1 75 ARG H 1 75 ARG HB2 . . 3.080 2.822 2.673 2.901 . 0 0 "[ . 1 . 2]" 1
1945 1 75 ARG H 1 75 ARG HB3 . . 3.080 2.500 2.471 2.561 . 0 0 "[ . 1 . 2]" 1
1946 1 75 ARG H 1 75 ARG HD2 . . 5.070 4.881 4.726 4.956 . 0 0 "[ . 1 . 2]" 1
1947 1 75 ARG H 1 75 ARG HD3 . . 5.500 5.399 5.337 5.501 0.001 3 0 "[ . 1 . 2]" 1
1948 1 75 ARG H 1 75 ARG HG2 . . 4.570 4.463 4.433 4.503 . 0 0 "[ . 1 . 2]" 1
1949 1 75 ARG H 1 75 ARG HG3 . . 4.620 4.513 4.467 4.539 . 0 0 "[ . 1 . 2]" 1
1950 1 75 ARG H 1 76 LEU H . . 4.390 4.207 4.124 4.304 . 0 0 "[ . 1 . 2]" 1
1951 1 75 ARG H 1 76 LEU MD2 . . 4.460 3.966 3.791 4.207 . 0 0 "[ . 1 . 2]" 1
1952 1 75 ARG H 1 77 SER H . . 5.500 5.351 5.258 5.468 . 0 0 "[ . 1 . 2]" 1
1953 1 75 ARG HA 1 75 ARG HD2 . . 4.060 3.905 3.869 3.968 . 0 0 "[ . 1 . 2]" 1
1954 1 75 ARG HA 1 75 ARG HD3 . . 5.120 4.748 4.728 4.774 . 0 0 "[ . 1 . 2]" 1
1955 1 75 ARG HA 1 75 ARG HG2 . . 3.770 3.451 3.420 3.475 . 0 0 "[ . 1 . 2]" 1
1956 1 75 ARG HA 1 75 ARG HG3 . . 3.690 2.430 2.404 2.457 . 0 0 "[ . 1 . 2]" 1
1957 1 75 ARG HA 1 76 LEU H . . 2.760 2.175 2.148 2.202 . 0 0 "[ . 1 . 2]" 1
1958 1 75 ARG HA 1 76 LEU HA . . 4.890 4.418 4.402 4.435 . 0 0 "[ . 1 . 2]" 1
1959 1 75 ARG HA 1 76 LEU HB2 . . 4.970 4.752 4.709 4.810 . 0 0 "[ . 1 . 2]" 1
1960 1 75 ARG HA 1 76 LEU MD2 . . 4.570 4.303 4.158 4.481 . 0 0 "[ . 1 . 2]" 1
1961 1 75 ARG HA 1 76 LEU HG . . 4.390 4.034 3.922 4.153 . 0 0 "[ . 1 . 2]" 1
1962 1 75 ARG HA 1 77 SER H . . 3.500 3.274 3.220 3.326 . 0 0 "[ . 1 . 2]" 1
1963 1 75 ARG QB 1 75 ARG HD2 . . 3.480 2.060 2.038 2.089 . 0 0 "[ . 1 . 2]" 1
1964 1 75 ARG QB 1 75 ARG HD3 . . 3.170 2.713 2.673 2.735 . 0 0 "[ . 1 . 2]" 1
1965 1 75 ARG QB 1 76 LEU H . . 4.030 3.956 3.902 3.989 . 0 0 "[ . 1 . 2]" 1
1966 1 75 ARG QB 1 76 LEU MD2 . . 5.210 4.635 4.519 4.795 . 0 0 "[ . 1 . 2]" 1
1967 1 75 ARG QB 1 77 SER H . . 4.100 3.946 3.879 4.017 . 0 0 "[ . 1 . 2]" 1
1968 1 75 ARG QB 1 78 VAL MG1 . . 4.850 3.424 3.352 3.520 . 0 0 "[ . 1 . 2]" 1
1969 1 75 ARG HB2 1 75 ARG HD2 . . 4.040 2.092 2.068 2.123 . 0 0 "[ . 1 . 2]" 1
1970 1 75 ARG HB2 1 76 LEU H . . 4.630 4.463 4.391 4.505 . 0 0 "[ . 1 . 2]" 1
1971 1 75 ARG HB2 1 77 SER H . . 4.720 4.615 4.582 4.650 . 0 0 "[ . 1 . 2]" 1
1972 1 75 ARG HB3 1 75 ARG HD2 . . 4.040 3.080 3.027 3.125 . 0 0 "[ . 1 . 2]" 1
1973 1 75 ARG HB3 1 76 LEU H . . 4.630 4.419 4.369 4.452 . 0 0 "[ . 1 . 2]" 1
1974 1 75 ARG HB3 1 77 SER H . . 4.720 4.286 4.177 4.394 . 0 0 "[ . 1 . 2]" 1
1975 1 75 ARG HD2 1 77 SER H . . 5.160 5.013 4.945 5.091 . 0 0 "[ . 1 . 2]" 1
1976 1 75 ARG HD2 1 78 VAL MG1 . . 3.830 3.473 3.336 3.618 . 0 0 "[ . 1 . 2]" 1
1977 1 75 ARG HD3 1 77 SER H . . 5.080 4.902 4.795 4.982 . 0 0 "[ . 1 . 2]" 1
1978 1 75 ARG HD3 1 78 VAL MG1 . . 3.740 2.210 2.060 2.353 . 0 0 "[ . 1 . 2]" 1
1979 1 75 ARG HD3 1 78 VAL MG2 . . 4.980 4.814 4.667 4.981 0.001 15 0 "[ . 1 . 2]" 1
1980 1 75 ARG HG2 1 76 LEU H . . 4.280 4.199 4.051 4.288 0.008 17 0 "[ . 1 . 2]" 1
1981 1 75 ARG HG2 1 77 SER H . . 3.570 2.829 2.730 2.916 . 0 0 "[ . 1 . 2]" 1
1982 1 75 ARG HG2 1 78 VAL H . . 5.160 4.907 4.802 4.993 . 0 0 "[ . 1 . 2]" 1
1983 1 75 ARG HG2 1 78 VAL HB . . 4.630 4.405 4.337 4.500 . 0 0 "[ . 1 . 2]" 1
1984 1 75 ARG HG2 1 78 VAL MG1 . . 3.310 1.939 1.881 2.041 . 0 0 "[ . 1 . 2]" 1
1985 1 75 ARG HG2 1 78 VAL MG2 . . 5.370 4.497 4.388 4.602 . 0 0 "[ . 1 . 2]" 1
1986 1 75 ARG HG3 1 76 LEU H . . 4.260 3.402 3.166 3.587 . 0 0 "[ . 1 . 2]" 1
1987 1 75 ARG HG3 1 77 SER H . . 3.950 2.415 2.335 2.492 . 0 0 "[ . 1 . 2]" 1
1988 1 75 ARG HG3 1 78 VAL MG1 . . 4.260 2.914 2.773 3.077 . 0 0 "[ . 1 . 2]" 1
1989 1 76 LEU H 1 76 LEU HB2 . . 3.350 2.588 2.531 2.654 . 0 0 "[ . 1 . 2]" 1
1990 1 76 LEU H 1 76 LEU HB3 . . 3.800 3.683 3.652 3.720 . 0 0 "[ . 1 . 2]" 1
1991 1 76 LEU H 1 76 LEU MD1 . . 4.020 3.883 3.827 3.946 . 0 0 "[ . 1 . 2]" 1
1992 1 76 LEU H 1 76 LEU MD2 . . 3.500 3.281 3.175 3.457 . 0 0 "[ . 1 . 2]" 1
1993 1 76 LEU H 1 76 LEU HG . . 3.240 2.509 2.429 2.610 . 0 0 "[ . 1 . 2]" 1
1994 1 76 LEU H 1 77 SER H . . 2.890 2.445 2.276 2.567 . 0 0 "[ . 1 . 2]" 1
1995 1 76 LEU H 1 77 SER HA . . 5.140 4.996 4.880 5.077 . 0 0 "[ . 1 . 2]" 1
1996 1 76 LEU H 1 77 SER HB2 . . 5.120 4.983 4.679 5.122 0.002 12 0 "[ . 1 . 2]" 1
1997 1 76 LEU H 1 77 SER HB3 . . 4.790 4.102 3.948 4.414 . 0 0 "[ . 1 . 2]" 1
1998 1 76 LEU HA 1 76 LEU MD1 . . 3.920 3.863 3.826 3.899 . 0 0 "[ . 1 . 2]" 1
1999 1 76 LEU HA 1 76 LEU MD2 . . 2.770 2.119 2.024 2.266 . 0 0 "[ . 1 . 2]" 1
2000 1 76 LEU HA 1 76 LEU HG . . 3.890 3.311 3.253 3.363 . 0 0 "[ . 1 . 2]" 1
2001 1 76 LEU HA 1 77 SER H . . 3.190 3.145 3.097 3.187 . 0 0 "[ . 1 . 2]" 1
2002 1 76 LEU HB2 1 76 LEU MD1 . . 3.340 2.294 2.228 2.391 . 0 0 "[ . 1 . 2]" 1
2003 1 76 LEU HB2 1 76 LEU MD2 . . 3.220 3.191 3.178 3.194 . 0 0 "[ . 1 . 2]" 1
2004 1 76 LEU HB2 1 77 SER H . . 3.870 3.749 3.679 3.828 . 0 0 "[ . 1 . 2]" 1
2005 1 76 LEU HB3 1 76 LEU MD1 . . 2.980 2.367 2.294 2.414 . 0 0 "[ . 1 . 2]" 1
2006 1 76 LEU HB3 1 76 LEU MD2 . . 3.090 2.398 2.315 2.462 . 0 0 "[ . 1 . 2]" 1
2007 1 76 LEU HB3 1 77 SER H . . 5.060 4.418 4.385 4.463 . 0 0 "[ . 1 . 2]" 1
2008 1 76 LEU HB3 1 77 SER HB2 . . 5.270 5.019 4.719 5.218 . 0 0 "[ . 1 . 2]" 1
2009 1 76 LEU MD1 1 77 SER H . . 5.500 5.368 5.303 5.408 . 0 0 "[ . 1 . 2]" 1
2010 1 76 LEU MD2 1 77 SER H . . 4.640 4.491 4.413 4.605 . 0 0 "[ . 1 . 2]" 1
2011 1 76 LEU HG 1 77 SER H . . 4.740 4.697 4.628 4.746 0.006 9 0 "[ . 1 . 2]" 1
2012 1 77 SER H 1 77 SER HB2 . . 3.670 3.610 3.432 3.674 0.004 17 0 "[ . 1 . 2]" 1
2013 1 77 SER H 1 77 SER HB3 . . 3.450 2.829 2.771 2.933 . 0 0 "[ . 1 . 2]" 1
2014 1 77 SER H 1 78 VAL H . . 4.220 4.200 4.165 4.236 0.016 19 0 "[ . 1 . 2]" 1
2015 1 77 SER H 1 78 VAL HA . . 4.900 4.830 4.811 4.865 . 0 0 "[ . 1 . 2]" 1
2016 1 77 SER H 1 78 VAL MG1 . . 4.160 3.143 3.069 3.224 . 0 0 "[ . 1 . 2]" 1
2017 1 77 SER HA 1 78 VAL H . . 2.700 2.170 2.153 2.191 . 0 0 "[ . 1 . 2]" 1
2018 1 77 SER HA 1 78 VAL MG1 . . 4.040 3.255 3.186 3.300 . 0 0 "[ . 1 . 2]" 1
2019 1 77 SER HA 1 78 VAL MG2 . . 4.260 4.067 3.996 4.097 . 0 0 "[ . 1 . 2]" 1
2020 1 77 SER HB2 1 78 VAL H . . 4.090 3.950 3.854 4.082 . 0 0 "[ . 1 . 2]" 1
2021 1 77 SER HB3 1 78 VAL H . . 4.400 4.286 4.084 4.368 . 0 0 "[ . 1 . 2]" 1
2022 1 78 VAL H 1 78 VAL HB . . 4.000 3.967 3.951 3.985 . 0 0 "[ . 1 . 2]" 1
2023 1 78 VAL H 1 78 VAL MG1 . . 3.370 2.693 2.659 2.786 . 0 0 "[ . 1 . 2]" 1
2024 1 78 VAL H 1 78 VAL MG2 . . 3.480 2.562 2.478 2.610 . 0 0 "[ . 1 . 2]" 1
2025 1 78 VAL H 1 79 GLU H . . 4.440 4.407 4.396 4.417 . 0 0 "[ . 1 . 2]" 1
2026 1 78 VAL HA 1 79 GLU H . . 2.870 2.412 2.360 2.525 . 0 0 "[ . 1 . 2]" 1
2027 1 78 VAL HB 1 79 GLU H . . 3.290 2.488 2.283 2.599 . 0 0 "[ . 1 . 2]" 1
2028 1 78 VAL HB 1 80 ILE MD . . 4.560 4.382 4.174 4.552 . 0 0 "[ . 1 . 2]" 1
2029 1 78 VAL MG1 1 79 GLU H . . 4.000 3.914 3.820 3.967 . 0 0 "[ . 1 . 2]" 1
2030 1 78 VAL MG2 1 79 GLU H . . 3.140 2.922 2.673 3.055 . 0 0 "[ . 1 . 2]" 1
2031 1 78 VAL MG2 1 79 GLU HA . . 4.600 3.622 3.480 3.703 . 0 0 "[ . 1 . 2]" 1
2032 1 78 VAL MG2 1 80 ILE H . . 3.750 3.578 3.348 3.717 . 0 0 "[ . 1 . 2]" 1
2033 1 78 VAL MG2 1 80 ILE HA . . 4.660 3.617 3.475 3.712 . 0 0 "[ . 1 . 2]" 1
2034 1 78 VAL MG2 1 80 ILE MD . . 3.200 2.217 2.065 2.338 . 0 0 "[ . 1 . 2]" 1
2035 1 79 GLU H 1 79 GLU HB2 . . 3.200 2.797 2.705 2.955 . 0 0 "[ . 1 . 2]" 1
2036 1 79 GLU H 1 79 GLU HB3 . . 3.170 2.559 2.500 2.632 . 0 0 "[ . 1 . 2]" 1
2037 1 79 GLU H 1 79 GLU HG2 . . 4.670 4.446 4.393 4.539 . 0 0 "[ . 1 . 2]" 1
2038 1 79 GLU H 1 79 GLU HG3 . . 4.780 4.610 4.520 4.709 . 0 0 "[ . 1 . 2]" 1
2039 1 79 GLU H 1 80 ILE H . . 4.440 4.304 4.200 4.369 . 0 0 "[ . 1 . 2]" 1
2040 1 79 GLU HA 1 79 GLU HG2 . . 4.060 3.003 2.829 3.196 . 0 0 "[ . 1 . 2]" 1
2041 1 79 GLU HA 1 79 GLU HG3 . . 3.800 2.594 2.371 2.716 . 0 0 "[ . 1 . 2]" 1
2042 1 79 GLU HA 1 80 ILE H . . 2.970 2.146 2.138 2.168 . 0 0 "[ . 1 . 2]" 1
2043 1 79 GLU HA 1 80 ILE HB . . 4.730 4.669 4.612 4.720 . 0 0 "[ . 1 . 2]" 1
2044 1 79 GLU HA 1 80 ILE MD . . 4.880 4.590 4.332 4.823 . 0 0 "[ . 1 . 2]" 1
2045 1 79 GLU HA 1 80 ILE HG12 . . 5.040 3.801 3.727 3.999 . 0 0 "[ . 1 . 2]" 1
2046 1 79 GLU HB3 1 80 ILE H . . 4.750 4.320 4.251 4.410 . 0 0 "[ . 1 . 2]" 1
2047 1 79 GLU HB3 1 81 THR MG . . 3.880 3.268 3.110 3.452 . 0 0 "[ . 1 . 2]" 1
2048 1 79 GLU HG2 1 80 ILE H . . 4.360 3.401 3.058 3.814 . 0 0 "[ . 1 . 2]" 1
2049 1 79 GLU HG2 1 81 THR MG . . 3.240 2.342 2.043 2.676 . 0 0 "[ . 1 . 2]" 1
2050 1 79 GLU HG3 1 80 ILE H . . 3.760 3.683 3.402 3.761 0.001 11 0 "[ . 1 . 2]" 1
2051 1 79 GLU HG3 1 81 THR MG . . 4.060 3.818 3.546 4.058 . 0 0 "[ . 1 . 2]" 1
2052 1 80 ILE H 1 80 ILE HB . . 3.280 2.543 2.500 2.591 . 0 0 "[ . 1 . 2]" 1
2053 1 80 ILE H 1 80 ILE MD . . 4.090 3.413 3.190 3.581 . 0 0 "[ . 1 . 2]" 1
2054 1 80 ILE H 1 80 ILE HG12 . . 4.260 2.212 2.106 2.313 . 0 0 "[ . 1 . 2]" 1
2055 1 80 ILE H 1 80 ILE HG13 . . 3.710 3.621 3.480 3.717 0.007 17 0 "[ . 1 . 2]" 1
2056 1 80 ILE H 1 80 ILE MG . . 4.160 3.781 3.765 3.792 . 0 0 "[ . 1 . 2]" 1
2057 1 80 ILE H 1 81 THR H . . 4.460 4.273 4.154 4.359 . 0 0 "[ . 1 . 2]" 1
2058 1 80 ILE H 1 81 THR MG . . 4.690 4.328 4.210 4.482 . 0 0 "[ . 1 . 2]" 1
2059 1 80 ILE HA 1 80 ILE MD . . 3.120 2.068 1.957 2.206 . 0 0 "[ . 1 . 2]" 1
2060 1 80 ILE HA 1 80 ILE MG . . 3.320 2.309 2.237 2.439 . 0 0 "[ . 1 . 2]" 1
2061 1 80 ILE HA 1 81 THR H . . 2.630 2.178 2.150 2.217 . 0 0 "[ . 1 . 2]" 1
2062 1 80 ILE HA 1 81 THR MG . . 4.320 3.793 3.697 3.952 . 0 0 "[ . 1 . 2]" 1
2063 1 80 ILE HA 1 83 LEU MD2 . . 5.250 4.907 4.469 5.131 . 0 0 "[ . 1 . 2]" 1
2064 1 80 ILE HB 1 80 ILE MD . . 3.560 3.221 3.205 3.229 . 0 0 "[ . 1 . 2]" 1
2065 1 80 ILE HB 1 81 THR H . . 4.660 4.391 4.351 4.432 . 0 0 "[ . 1 . 2]" 1
2066 1 80 ILE HB 1 83 LEU MD1 . . 4.310 3.201 2.919 3.338 . 0 0 "[ . 1 . 2]" 1
2067 1 80 ILE HB 1 91 PHE QE . . 5.000 2.785 2.418 3.185 . 0 0 "[ . 1 . 2]" 1
2068 1 80 ILE MD 1 80 ILE MG . . 2.810 1.989 1.893 2.081 . 0 0 "[ . 1 . 2]" 1
2069 1 80 ILE MD 1 81 THR H . . 3.960 3.847 3.753 3.946 . 0 0 "[ . 1 . 2]" 1
2070 1 80 ILE MD 1 83 LEU MD2 . . 4.930 4.617 4.411 4.814 . 0 0 "[ . 1 . 2]" 1
2071 1 80 ILE MD 1 91 PHE HB3 . . 4.980 4.759 4.425 4.953 . 0 0 "[ . 1 . 2]" 1
2072 1 80 ILE MD 1 91 PHE QD . . 4.340 3.653 3.288 3.891 . 0 0 "[ . 1 . 2]" 1
2073 1 80 ILE MD 1 91 PHE QE . . 5.180 4.175 3.953 4.528 . 0 0 "[ . 1 . 2]" 1
2074 1 80 ILE HG12 1 80 ILE MG . . 3.500 3.188 3.174 3.199 . 0 0 "[ . 1 . 2]" 1
2075 1 80 ILE HG12 1 81 THR H . . 5.370 5.099 4.994 5.208 . 0 0 "[ . 1 . 2]" 1
2076 1 80 ILE HG12 1 91 PHE QE . . 4.730 4.444 4.049 4.731 0.001 19 0 "[ . 1 . 2]" 1
2077 1 80 ILE HG13 1 91 PHE QD . . 4.650 2.611 2.329 3.013 . 0 0 "[ . 1 . 2]" 1
2078 1 80 ILE MG 1 81 THR H . . 3.300 3.071 2.824 3.240 . 0 0 "[ . 1 . 2]" 1
2079 1 80 ILE MG 1 83 LEU H . . 5.210 5.068 4.799 5.203 . 0 0 "[ . 1 . 2]" 1
2080 1 80 ILE MG 1 83 LEU MD1 . . 3.700 2.962 2.749 3.116 . 0 0 "[ . 1 . 2]" 1
2081 1 80 ILE MG 1 83 LEU MD2 . . 3.220 2.003 1.874 2.241 . 0 0 "[ . 1 . 2]" 1
2082 1 80 ILE MG 1 91 PHE QD . . 4.320 3.095 2.695 3.352 . 0 0 "[ . 1 . 2]" 1
2083 1 80 ILE MG 1 91 PHE QE . . 3.390 2.172 1.968 2.391 . 0 0 "[ . 1 . 2]" 1
2084 1 81 THR H 1 81 THR MG . . 3.170 2.447 2.133 2.659 . 0 0 "[ . 1 . 2]" 1
2085 1 81 THR H 1 82 GLY H . . 4.630 4.548 4.524 4.566 . 0 0 "[ . 1 . 2]" 1
2086 1 81 THR H 1 82 GLY HA3 . . 5.360 5.189 5.087 5.307 . 0 0 "[ . 1 . 2]" 1
2087 1 81 THR HA 1 81 THR MG . . 3.070 2.445 2.386 2.507 . 0 0 "[ . 1 . 2]" 1
2088 1 81 THR HA 1 82 GLY H . . 3.330 2.443 2.386 2.522 . 0 0 "[ . 1 . 2]" 1
2089 1 81 THR HB 1 82 GLY H . . 2.990 2.348 2.206 2.469 . 0 0 "[ . 1 . 2]" 1
2090 1 81 THR HB 1 82 GLY HA2 . . 4.480 4.211 4.136 4.260 . 0 0 "[ . 1 . 2]" 1
2091 1 81 THR HB 1 82 GLY HA3 . . 4.440 4.378 4.264 4.448 0.008 7 0 "[ . 1 . 2]" 1
2092 1 81 THR HB 1 83 LEU H . . 4.740 4.645 4.548 4.744 0.004 16 0 "[ . 1 . 2]" 1
2093 1 81 THR MG 1 82 GLY H . . 3.870 3.754 3.645 3.814 . 0 0 "[ . 1 . 2]" 1
2094 1 82 GLY H 1 83 LEU H . . 3.280 2.391 2.299 2.548 . 0 0 "[ . 1 . 2]" 1
2095 1 82 GLY H 1 83 LEU HG . . 4.410 3.753 3.454 4.074 . 0 0 "[ . 1 . 2]" 1
2096 1 83 LEU H 1 83 LEU QB . . 3.840 2.525 2.363 2.668 . 0 0 "[ . 1 . 2]" 1
2097 1 83 LEU H 1 83 LEU MD1 . . 3.920 3.805 3.631 3.912 . 0 0 "[ . 1 . 2]" 1
2098 1 83 LEU H 1 83 LEU MD2 . . 3.630 3.493 3.312 3.626 . 0 0 "[ . 1 . 2]" 1
2099 1 83 LEU H 1 83 LEU HG . . 2.840 2.545 2.277 2.774 . 0 0 "[ . 1 . 2]" 1
2100 1 83 LEU HA 1 83 LEU MD1 . . 4.100 3.896 3.799 3.986 . 0 0 "[ . 1 . 2]" 1
2101 1 83 LEU HA 1 83 LEU MD2 . . 3.000 2.192 1.998 2.498 . 0 0 "[ . 1 . 2]" 1
2102 1 83 LEU HA 1 84 GLU H . . 3.170 2.551 2.391 2.650 . 0 0 "[ . 1 . 2]" 1
2103 1 83 LEU HA 1 84 GLU QB . . 4.580 4.329 4.159 4.418 . 0 0 "[ . 1 . 2]" 1
2104 1 83 LEU HA 1 84 GLU QG . . 4.420 3.946 3.533 4.374 . 0 0 "[ . 1 . 2]" 1
2105 1 83 LEU HA 1 89 TYR QE . . 4.620 4.202 3.902 4.457 . 0 0 "[ . 1 . 2]" 1
2106 1 83 LEU QB 1 83 LEU MD2 . . 3.030 2.258 2.130 2.343 . 0 0 "[ . 1 . 2]" 1
2107 1 83 LEU QB 1 84 GLU H . . 3.430 2.136 1.925 2.437 . 0 0 "[ . 1 . 2]" 1
2108 1 83 LEU QB 1 84 GLU HA . . 4.330 4.074 3.986 4.191 . 0 0 "[ . 1 . 2]" 1
2109 1 83 LEU QB 1 85 LYS H . . 5.290 4.910 4.719 5.100 . 0 0 "[ . 1 . 2]" 1
2110 1 83 LEU QB 1 89 TYR QE . . 4.520 3.065 2.923 3.191 . 0 0 "[ . 1 . 2]" 1
2111 1 83 LEU MD1 1 84 GLU H . . 4.670 4.170 3.842 4.452 . 0 0 "[ . 1 . 2]" 1
2112 1 83 LEU MD1 1 91 PHE QE . . 3.900 2.735 2.368 3.057 . 0 0 "[ . 1 . 2]" 1
2113 1 83 LEU MD1 1 91 PHE HZ . . 3.690 2.133 1.973 2.477 . 0 0 "[ . 1 . 2]" 1
2114 1 83 LEU MD1 1 111 TYR QD . . 4.360 4.242 3.998 4.365 0.005 19 0 "[ . 1 . 2]" 1
2115 1 83 LEU MD1 1 113 VAL H . . 5.190 5.089 4.932 5.199 0.009 10 0 "[ . 1 . 2]" 1
2116 1 83 LEU MD1 1 113 VAL HA . . 5.500 5.225 5.050 5.339 . 0 0 "[ . 1 . 2]" 1
2117 1 83 LEU MD1 1 113 VAL HB . . 4.820 4.066 3.909 4.247 . 0 0 "[ . 1 . 2]" 1
2118 1 83 LEU MD1 1 113 VAL MG1 . . 3.710 3.576 3.383 3.674 . 0 0 "[ . 1 . 2]" 1
2119 1 83 LEU MD1 1 113 VAL MG2 . . 2.870 2.195 1.989 2.331 . 0 0 "[ . 1 . 2]" 1
2120 1 83 LEU MD2 1 84 GLU H . . 3.810 3.522 3.164 3.760 . 0 0 "[ . 1 . 2]" 1
2121 1 83 LEU MD2 1 91 PHE QE . . 3.620 2.474 2.161 2.824 . 0 0 "[ . 1 . 2]" 1
2122 1 83 LEU MD2 1 113 VAL MG2 . . 4.250 4.107 3.910 4.269 0.019 10 0 "[ . 1 . 2]" 1
2123 1 84 GLU H 1 84 GLU QB . . 3.210 2.485 2.339 2.598 . 0 0 "[ . 1 . 2]" 1
2124 1 84 GLU H 1 84 GLU QG . . 3.660 3.298 2.834 3.655 . 0 0 "[ . 1 . 2]" 1
2125 1 84 GLU H 1 87 ILE MG . . 5.030 4.299 4.044 4.492 . 0 0 "[ . 1 . 2]" 1
2126 1 84 GLU H 1 89 TYR QE . . 3.840 2.320 2.097 2.683 . 0 0 "[ . 1 . 2]" 1
2127 1 84 GLU H 1 113 VAL MG1 . . 4.920 4.610 4.384 4.897 . 0 0 "[ . 1 . 2]" 1
2128 1 84 GLU HA 1 84 GLU QG . . 3.440 2.334 2.271 2.411 . 0 0 "[ . 1 . 2]" 1
2129 1 84 GLU HA 1 85 LYS H . . 2.590 2.151 2.137 2.181 . 0 0 "[ . 1 . 2]" 1
2130 1 84 GLU HA 1 85 LYS QE . . 5.330 4.247 3.819 5.184 . 0 0 "[ . 1 . 2]" 1
2131 1 84 GLU HA 1 89 TYR QE . . 5.390 4.651 4.388 5.024 . 0 0 "[ . 1 . 2]" 1
2132 1 84 GLU QB 1 85 LYS H . . 3.390 3.227 3.020 3.382 . 0 0 "[ . 1 . 2]" 1
2133 1 84 GLU QB 1 87 ILE H . . 4.690 4.284 4.186 4.444 . 0 0 "[ . 1 . 2]" 1
2134 1 84 GLU QB 1 87 ILE HA . . 5.500 5.045 4.918 5.244 . 0 0 "[ . 1 . 2]" 1
2135 1 84 GLU QB 1 87 ILE HB . . 3.790 2.636 2.426 3.043 . 0 0 "[ . 1 . 2]" 1
2136 1 84 GLU QB 1 87 ILE MD . . 3.980 3.824 3.733 3.946 . 0 0 "[ . 1 . 2]" 1
2137 1 84 GLU QB 1 87 ILE QG . . 3.200 2.366 2.238 2.504 . 0 0 "[ . 1 . 2]" 1
2138 1 84 GLU QB 1 87 ILE MG . . 3.890 3.141 2.928 3.407 . 0 0 "[ . 1 . 2]" 1
2139 1 84 GLU QB 1 89 TYR QE . . 4.510 2.782 2.342 3.264 . 0 0 "[ . 1 . 2]" 1
2140 1 84 GLU QG 1 85 LYS H . . 4.130 4.048 3.923 4.145 0.015 20 0 "[ . 1 . 2]" 1
2141 1 84 GLU QG 1 87 ILE QG . . 4.270 3.912 3.612 4.218 . 0 0 "[ . 1 . 2]" 1
2142 1 85 LYS H 1 85 LYS QB . . 2.750 2.160 2.150 2.202 . 0 0 "[ . 1 . 2]" 1
2143 1 85 LYS H 1 85 LYS QD . . 4.110 3.974 3.368 4.102 . 0 0 "[ . 1 . 2]" 1
2144 1 85 LYS H 1 85 LYS QE . . 4.480 3.090 2.573 4.013 . 0 0 "[ . 1 . 2]" 1
2145 1 85 LYS H 1 85 LYS HG2 . . 4.270 4.230 4.143 4.276 0.006 11 0 "[ . 1 . 2]" 1
2146 1 85 LYS H 1 85 LYS HG3 . . 3.240 3.043 2.895 3.118 . 0 0 "[ . 1 . 2]" 1
2147 1 85 LYS H 1 86 GLY H . . 4.720 4.636 4.626 4.644 . 0 0 "[ . 1 . 2]" 1
2148 1 85 LYS H 1 87 ILE QG . . 5.500 4.648 4.529 4.780 . 0 0 "[ . 1 . 2]" 1
2149 1 85 LYS H 1 113 VAL HB . . 5.220 4.983 4.822 5.140 . 0 0 "[ . 1 . 2]" 1
2150 1 85 LYS H 1 113 VAL MG1 . . 4.050 3.879 3.783 4.058 0.008 10 0 "[ . 1 . 2]" 1
2151 1 85 LYS HA 1 85 LYS QD . . 4.250 4.073 3.994 4.090 . 0 0 "[ . 1 . 2]" 1
2152 1 85 LYS HA 1 85 LYS QE . . 4.270 4.044 3.875 4.279 0.009 5 0 "[ . 1 . 2]" 1
2153 1 85 LYS HA 1 85 LYS HG2 . . 3.670 2.814 2.746 2.826 . 0 0 "[ . 1 . 2]" 1
2154 1 85 LYS HA 1 85 LYS HG3 . . 3.900 2.369 2.348 2.424 . 0 0 "[ . 1 . 2]" 1
2155 1 85 LYS HA 1 86 GLY H . . 2.990 2.330 2.283 2.401 . 0 0 "[ . 1 . 2]" 1
2156 1 85 LYS HA 1 86 GLY HA2 . . 4.540 4.507 4.490 4.534 . 0 0 "[ . 1 . 2]" 1
2157 1 85 LYS HA 1 87 ILE H . . 3.640 3.158 3.107 3.194 . 0 0 "[ . 1 . 2]" 1
2158 1 85 LYS HA 1 113 VAL HB . . 3.660 2.760 2.588 2.864 . 0 0 "[ . 1 . 2]" 1
2159 1 85 LYS HA 1 113 VAL MG1 . . 2.790 2.171 2.046 2.266 . 0 0 "[ . 1 . 2]" 1
2160 1 85 LYS HA 1 113 VAL MG2 . . 4.360 4.215 4.087 4.296 . 0 0 "[ . 1 . 2]" 1
2161 1 85 LYS QB 1 85 LYS QE . . 4.010 2.695 2.071 3.472 . 0 0 "[ . 1 . 2]" 1
2162 1 85 LYS QB 1 86 GLY H . . 3.590 2.677 2.499 2.800 . 0 0 "[ . 1 . 2]" 1
2163 1 85 LYS QB 1 86 GLY HA2 . . 4.720 4.247 4.172 4.292 . 0 0 "[ . 1 . 2]" 1
2164 1 85 LYS QB 1 86 GLY HA3 . . 4.750 3.774 3.717 3.814 . 0 0 "[ . 1 . 2]" 1
2165 1 85 LYS QB 1 87 ILE H . . 4.640 4.399 4.285 4.472 . 0 0 "[ . 1 . 2]" 1
2166 1 85 LYS QB 1 113 VAL HB . . 5.050 4.841 4.657 4.950 . 0 0 "[ . 1 . 2]" 1
2167 1 85 LYS QB 1 113 VAL MG1 . . 3.440 3.388 3.254 3.439 . 0 0 "[ . 1 . 2]" 1
2168 1 85 LYS QD 1 85 LYS HG3 . . 2.710 2.454 2.415 2.484 . 0 0 "[ . 1 . 2]" 1
2169 1 85 LYS QD 1 113 VAL MG1 . . 3.690 3.486 3.407 3.601 . 0 0 "[ . 1 . 2]" 1
2170 1 85 LYS QD 1 115 GLY QA . . 3.520 2.550 1.919 3.328 . 0 0 "[ . 1 . 2]" 1
2171 1 85 LYS QE 1 85 LYS HG2 . . 3.670 3.251 2.752 3.319 . 0 0 "[ . 1 . 2]" 1
2172 1 85 LYS QE 1 85 LYS HG3 . . 3.810 2.164 2.058 2.289 . 0 0 "[ . 1 . 2]" 1
2173 1 85 LYS QE 1 113 VAL MG1 . . 4.520 3.361 2.920 3.585 . 0 0 "[ . 1 . 2]" 1
2174 1 85 LYS HG2 1 86 GLY H . . 4.320 3.555 3.429 3.677 . 0 0 "[ . 1 . 2]" 1
2175 1 85 LYS HG2 1 113 VAL MG1 . . 3.330 2.303 2.095 2.472 . 0 0 "[ . 1 . 2]" 1
2176 1 85 LYS HG2 1 114 SER QB . . 5.300 4.900 4.670 5.262 . 0 0 "[ . 1 . 2]" 1
2177 1 85 LYS HG2 1 115 GLY QA . . 4.710 3.150 2.432 3.739 . 0 0 "[ . 1 . 2]" 1
2178 1 85 LYS HG3 1 86 GLY H . . 4.470 4.173 4.128 4.248 . 0 0 "[ . 1 . 2]" 1
2179 1 85 LYS HG3 1 87 ILE H . . 5.500 5.524 5.508 5.551 0.051 8 0 "[ . 1 . 2]" 1
2180 1 85 LYS HG3 1 113 VAL MG1 . . 3.820 1.950 1.912 2.053 . 0 0 "[ . 1 . 2]" 1
2181 1 85 LYS HG3 1 115 GLY QA . . 4.660 4.078 3.078 4.629 . 0 0 "[ . 1 . 2]" 1
2182 1 86 GLY H 1 87 ILE H . . 3.230 2.652 2.580 2.749 . 0 0 "[ . 1 . 2]" 1
2183 1 86 GLY H 1 87 ILE HB . . 5.340 5.085 5.032 5.162 . 0 0 "[ . 1 . 2]" 1
2184 1 86 GLY H 1 87 ILE QG . . 4.840 4.719 4.609 4.842 0.002 5 0 "[ . 1 . 2]" 1
2185 1 86 GLY H 1 112 VAL MG1 . . 4.530 3.605 3.452 3.736 . 0 0 "[ . 1 . 2]" 1
2186 1 86 GLY H 1 113 VAL H . . 4.870 4.401 4.302 4.582 . 0 0 "[ . 1 . 2]" 1
2187 1 86 GLY H 1 113 VAL HB . . 4.030 3.918 3.723 4.036 0.006 6 0 "[ . 1 . 2]" 1
2188 1 86 GLY H 1 113 VAL MG1 . . 3.640 3.518 3.392 3.644 0.004 9 0 "[ . 1 . 2]" 1
2189 1 86 GLY H 1 114 SER HA . . 4.240 3.093 2.696 3.288 . 0 0 "[ . 1 . 2]" 1
2190 1 86 GLY HA2 1 87 ILE H . . 3.560 3.148 3.093 3.172 . 0 0 "[ . 1 . 2]" 1
2191 1 86 GLY HA2 1 87 ILE MD . . 5.070 5.009 4.785 5.086 0.016 15 0 "[ . 1 . 2]" 1
2192 1 86 GLY HA2 1 112 VAL MG1 . . 3.770 3.189 3.053 3.303 . 0 0 "[ . 1 . 2]" 1
2193 1 86 GLY HA2 1 113 VAL H . . 5.500 5.445 5.344 5.509 0.009 20 0 "[ . 1 . 2]" 1
2194 1 86 GLY HA3 1 87 ILE MD . . 4.650 4.331 4.171 4.439 . 0 0 "[ . 1 . 2]" 1
2195 1 86 GLY HA3 1 87 ILE QG . . 4.770 3.765 3.675 3.893 . 0 0 "[ . 1 . 2]" 1
2196 1 86 GLY HA3 1 112 VAL MG1 . . 4.940 4.590 4.458 4.711 . 0 0 "[ . 1 . 2]" 1
2197 1 87 ILE H 1 87 ILE HB . . 2.970 2.628 2.574 2.681 . 0 0 "[ . 1 . 2]" 1
2198 1 87 ILE H 1 87 ILE MD . . 4.100 3.974 3.842 4.031 . 0 0 "[ . 1 . 2]" 1
2199 1 87 ILE H 1 87 ILE QG . . 3.210 2.955 2.873 3.091 . 0 0 "[ . 1 . 2]" 1
2200 1 87 ILE H 1 87 ILE MG . . 4.030 3.823 3.791 3.854 . 0 0 "[ . 1 . 2]" 1
2201 1 87 ILE H 1 88 SER H . . 4.200 4.095 3.904 4.204 0.004 17 0 "[ . 1 . 2]" 1
2202 1 87 ILE H 1 89 TYR QD . . 5.500 5.490 5.416 5.513 0.013 15 0 "[ . 1 . 2]" 1
2203 1 87 ILE H 1 89 TYR QE . . 4.490 4.213 4.096 4.375 . 0 0 "[ . 1 . 2]" 1
2204 1 87 ILE H 1 112 VAL MG1 . . 4.490 3.836 3.671 4.010 . 0 0 "[ . 1 . 2]" 1
2205 1 87 ILE H 1 112 VAL MG2 . . 5.500 5.513 5.505 5.530 0.030 17 0 "[ . 1 . 2]" 1
2206 1 87 ILE H 1 113 VAL H . . 4.030 3.984 3.909 4.037 0.007 10 0 "[ . 1 . 2]" 1
2207 1 87 ILE H 1 113 VAL HB . . 3.940 3.812 3.735 3.870 . 0 0 "[ . 1 . 2]" 1
2208 1 87 ILE H 1 113 VAL MG1 . . 4.660 4.519 4.414 4.598 . 0 0 "[ . 1 . 2]" 1
2209 1 87 ILE H 1 113 VAL MG2 . . 5.120 5.073 4.980 5.129 0.009 2 0 "[ . 1 . 2]" 1
2210 1 87 ILE HA 1 87 ILE MD . . 2.950 2.104 1.977 2.264 . 0 0 "[ . 1 . 2]" 1
2211 1 87 ILE HA 1 87 ILE QG . . 3.710 2.795 2.770 2.852 . 0 0 "[ . 1 . 2]" 1
2212 1 87 ILE HA 1 87 ILE MG . . 3.210 2.415 2.347 2.465 . 0 0 "[ . 1 . 2]" 1
2213 1 87 ILE HA 1 88 SER H . . 2.840 2.160 2.140 2.224 . 0 0 "[ . 1 . 2]" 1
2214 1 87 ILE HA 1 88 SER HB2 . . 5.440 5.001 4.985 5.024 . 0 0 "[ . 1 . 2]" 1
2215 1 87 ILE HB 1 87 ILE MD . . 3.430 3.216 3.208 3.230 . 0 0 "[ . 1 . 2]" 1
2216 1 87 ILE HB 1 88 SER H . . 4.600 4.412 4.344 4.506 . 0 0 "[ . 1 . 2]" 1
2217 1 87 ILE HB 1 89 TYR QD . . 4.670 3.688 3.538 3.870 . 0 0 "[ . 1 . 2]" 1
2218 1 87 ILE HB 1 89 TYR QE . . 3.730 2.429 2.111 2.710 . 0 0 "[ . 1 . 2]" 1
2219 1 87 ILE MD 1 87 ILE MG . . 2.730 1.963 1.867 2.066 . 0 0 "[ . 1 . 2]" 1
2220 1 87 ILE MD 1 88 SER H . . 3.730 3.652 3.445 3.744 0.014 15 0 "[ . 1 . 2]" 1
2221 1 87 ILE MD 1 89 TYR QE . . 5.080 4.906 4.555 5.090 0.010 13 0 "[ . 1 . 2]" 1
2222 1 87 ILE QG 1 87 ILE MG . . 2.910 2.329 2.223 2.420 . 0 0 "[ . 1 . 2]" 1
2223 1 87 ILE QG 1 88 SER H . . 4.940 4.682 4.634 4.754 . 0 0 "[ . 1 . 2]" 1
2224 1 87 ILE QG 1 89 TYR QE . . 4.510 3.996 3.682 4.199 . 0 0 "[ . 1 . 2]" 1
2225 1 87 ILE MG 1 88 SER H . . 3.240 2.935 2.662 3.201 . 0 0 "[ . 1 . 2]" 1
2226 1 87 ILE MG 1 88 SER HB2 . . 4.810 4.580 4.450 4.690 . 0 0 "[ . 1 . 2]" 1
2227 1 87 ILE MG 1 88 SER HB3 . . 5.500 5.355 5.217 5.471 . 0 0 "[ . 1 . 2]" 1
2228 1 87 ILE MG 1 89 TYR H . . 5.010 4.613 4.325 4.777 . 0 0 "[ . 1 . 2]" 1
2229 1 87 ILE MG 1 89 TYR QD . . 4.330 1.990 1.922 2.148 . 0 0 "[ . 1 . 2]" 1
2230 1 87 ILE MG 1 89 TYR QE . . 3.800 2.509 2.326 2.749 . 0 0 "[ . 1 . 2]" 1
2231 1 88 SER H 1 88 SER HB2 . . 3.510 2.891 2.853 2.940 . 0 0 "[ . 1 . 2]" 1
2232 1 88 SER H 1 88 SER HB3 . . 3.700 3.553 3.510 3.587 . 0 0 "[ . 1 . 2]" 1
2233 1 88 SER H 1 89 TYR H . . 4.760 4.587 4.548 4.612 . 0 0 "[ . 1 . 2]" 1
2234 1 88 SER H 1 112 VAL MG1 . . 4.530 3.743 3.587 3.885 . 0 0 "[ . 1 . 2]" 1
2235 1 88 SER H 1 112 VAL MG2 . . 4.310 3.849 3.719 3.997 . 0 0 "[ . 1 . 2]" 1
2236 1 88 SER HA 1 89 TYR H . . 3.060 2.195 2.165 2.216 . 0 0 "[ . 1 . 2]" 1
2237 1 88 SER HA 1 89 TYR HB2 . . 5.500 5.529 5.499 5.546 0.046 3 0 "[ . 1 . 2]" 1
2238 1 88 SER HA 1 89 TYR QD . . 4.590 3.961 3.706 4.118 . 0 0 "[ . 1 . 2]" 1
2239 1 88 SER HA 1 111 TYR H . . 4.770 4.459 4.175 4.716 . 0 0 "[ . 1 . 2]" 1
2240 1 88 SER HA 1 112 VAL HA . . 3.420 2.364 2.304 2.430 . 0 0 "[ . 1 . 2]" 1
2241 1 88 SER HA 1 112 VAL MG1 . . 3.920 3.538 3.349 3.613 . 0 0 "[ . 1 . 2]" 1
2242 1 88 SER HA 1 112 VAL MG2 . . 3.710 2.887 2.726 3.009 . 0 0 "[ . 1 . 2]" 1
2243 1 88 SER HA 1 113 VAL H . . 3.780 3.656 3.621 3.690 . 0 0 "[ . 1 . 2]" 1
2244 1 88 SER HA 1 113 VAL HB . . 5.500 5.446 5.397 5.491 . 0 0 "[ . 1 . 2]" 1
2245 1 88 SER HB2 1 89 TYR H . . 4.080 3.728 3.660 3.831 . 0 0 "[ . 1 . 2]" 1
2246 1 88 SER HB2 1 110 PRO HB3 . . 4.910 4.832 4.685 4.913 0.003 18 0 "[ . 1 . 2]" 1
2247 1 88 SER HB2 1 112 VAL HA . . 5.060 4.872 4.854 4.892 . 0 0 "[ . 1 . 2]" 1
2248 1 88 SER HB2 1 112 VAL MG1 . . 5.500 4.742 4.539 4.813 . 0 0 "[ . 1 . 2]" 1
2249 1 88 SER HB2 1 112 VAL MG2 . . 3.470 3.435 3.362 3.491 0.021 4 0 "[ . 1 . 2]" 1
2250 1 88 SER HB3 1 89 TYR H . . 3.940 3.179 3.095 3.319 . 0 0 "[ . 1 . 2]" 1
2251 1 88 SER HB3 1 110 PRO HB2 . . 4.360 3.350 3.225 3.455 . 0 0 "[ . 1 . 2]" 1
2252 1 88 SER HB3 1 110 PRO HB3 . . 4.430 4.368 4.236 4.438 0.008 2 0 "[ . 1 . 2]" 1
2253 1 88 SER HB3 1 111 TYR H . . 4.790 4.462 4.188 4.712 . 0 0 "[ . 1 . 2]" 1
2254 1 88 SER HB3 1 112 VAL HA . . 4.050 3.563 3.552 3.576 . 0 0 "[ . 1 . 2]" 1
2255 1 88 SER HB3 1 112 VAL HB . . 5.480 5.020 4.935 5.087 . 0 0 "[ . 1 . 2]" 1
2256 1 88 SER HB3 1 112 VAL MG1 . . 3.970 3.938 3.755 3.978 0.008 8 0 "[ . 1 . 2]" 1
2257 1 88 SER HB3 1 112 VAL MG2 . . 3.220 2.177 2.050 2.279 . 0 0 "[ . 1 . 2]" 1
2258 1 88 SER HB3 1 113 VAL H . . 5.500 5.509 5.500 5.519 0.019 10 0 "[ . 1 . 2]" 1
2259 1 89 TYR H 1 89 TYR HB2 . . 3.800 3.789 3.750 3.820 0.020 8 0 "[ . 1 . 2]" 1
2260 1 89 TYR H 1 89 TYR HB3 . . 3.970 3.753 3.719 3.787 . 0 0 "[ . 1 . 2]" 1
2261 1 89 TYR H 1 89 TYR QD . . 3.830 2.527 2.144 2.791 . 0 0 "[ . 1 . 2]" 1
2262 1 89 TYR H 1 89 TYR QE . . 4.720 3.996 3.796 4.136 . 0 0 "[ . 1 . 2]" 1
2263 1 89 TYR H 1 90 LYS H . . 4.570 4.366 4.348 4.380 . 0 0 "[ . 1 . 2]" 1
2264 1 89 TYR H 1 90 LYS QG . . 5.500 4.621 4.546 4.717 . 0 0 "[ . 1 . 2]" 1
2265 1 89 TYR H 1 91 PHE QE . . 4.800 4.727 4.610 4.802 0.002 2 0 "[ . 1 . 2]" 1
2266 1 89 TYR H 1 110 PRO HA . . 4.600 4.046 3.856 4.244 . 0 0 "[ . 1 . 2]" 1
2267 1 89 TYR H 1 111 TYR H . . 3.740 2.970 2.746 3.167 . 0 0 "[ . 1 . 2]" 1
2268 1 89 TYR H 1 111 TYR QB . . 4.640 4.131 3.999 4.281 . 0 0 "[ . 1 . 2]" 1
2269 1 89 TYR H 1 112 VAL HA . . 3.890 3.832 3.739 3.903 0.013 17 0 "[ . 1 . 2]" 1
2270 1 89 TYR H 1 112 VAL MG1 . . 5.500 5.290 5.130 5.347 . 0 0 "[ . 1 . 2]" 1
2271 1 89 TYR H 1 112 VAL MG2 . . 4.390 4.177 4.057 4.335 . 0 0 "[ . 1 . 2]" 1
2272 1 89 TYR H 1 113 VAL H . . 4.840 4.733 4.601 4.811 . 0 0 "[ . 1 . 2]" 1
2273 1 89 TYR HA 1 90 LYS H . . 2.940 2.406 2.362 2.476 . 0 0 "[ . 1 . 2]" 1
2274 1 89 TYR HA 1 110 PRO HB3 . . 5.500 4.952 4.782 5.163 . 0 0 "[ . 1 . 2]" 1
2275 1 89 TYR HA 1 111 TYR H . . 5.120 4.749 4.636 4.923 . 0 0 "[ . 1 . 2]" 1
2276 1 89 TYR HB2 1 90 LYS H . . 3.840 2.504 2.332 2.616 . 0 0 "[ . 1 . 2]" 1
2277 1 89 TYR HB2 1 111 TYR H . . 5.500 5.423 5.341 5.508 0.008 3 0 "[ . 1 . 2]" 1
2278 1 89 TYR HB3 1 90 LYS H . . 3.690 3.391 3.320 3.451 . 0 0 "[ . 1 . 2]" 1
2279 1 89 TYR QD 1 90 LYS H . . 4.350 4.121 3.972 4.203 . 0 0 "[ . 1 . 2]" 1
2280 1 89 TYR QD 1 113 VAL H . . 5.040 4.774 4.563 5.018 . 0 0 "[ . 1 . 2]" 1
2281 1 89 TYR QD 1 113 VAL MG2 . . 4.060 4.061 4.027 4.084 0.024 14 0 "[ . 1 . 2]" 1
2282 1 89 TYR QE 1 111 TYR H . . 5.330 5.040 4.794 5.226 . 0 0 "[ . 1 . 2]" 1
2283 1 89 TYR QE 1 112 VAL HA . . 5.500 4.473 4.162 4.815 . 0 0 "[ . 1 . 2]" 1
2284 1 89 TYR QE 1 113 VAL H . . 4.160 3.369 3.028 3.761 . 0 0 "[ . 1 . 2]" 1
2285 1 89 TYR QE 1 113 VAL HB . . 4.150 3.456 3.229 3.680 . 0 0 "[ . 1 . 2]" 1
2286 1 89 TYR QE 1 113 VAL MG2 . . 3.190 1.983 1.958 2.048 . 0 0 "[ . 1 . 2]" 1
2287 1 90 LYS H 1 90 LYS HB2 . . 3.890 2.672 2.462 2.753 . 0 0 "[ . 1 . 2]" 1
2288 1 90 LYS H 1 90 LYS QG . . 3.830 2.557 2.379 2.916 . 0 0 "[ . 1 . 2]" 1
2289 1 90 LYS H 1 91 PHE H . . 4.880 4.443 4.416 4.501 . 0 0 "[ . 1 . 2]" 1
2290 1 90 LYS HA 1 91 PHE H . . 3.270 2.609 2.469 2.654 . 0 0 "[ . 1 . 2]" 1
2291 1 90 LYS HA 1 91 PHE HA . . 4.970 4.522 4.456 4.551 . 0 0 "[ . 1 . 2]" 1
2292 1 90 LYS HA 1 91 PHE QD . . 4.020 2.838 2.639 2.987 . 0 0 "[ . 1 . 2]" 1
2293 1 90 LYS HB2 1 91 PHE H . . 4.280 3.052 2.866 3.540 . 0 0 "[ . 1 . 2]" 1
2294 1 90 LYS HB3 1 90 LYS QE . . 4.620 3.706 3.597 4.026 . 0 0 "[ . 1 . 2]" 1
2295 1 90 LYS HB3 1 91 PHE H . . 4.000 2.132 1.930 2.283 . 0 0 "[ . 1 . 2]" 1
2296 1 90 LYS HB3 1 91 PHE QD . . 4.640 4.305 3.973 4.464 . 0 0 "[ . 1 . 2]" 1
2297 1 90 LYS HB3 1 107 PRO HB2 . . 4.460 3.442 3.254 3.632 . 0 0 "[ . 1 . 2]" 1
2298 1 90 LYS HB3 1 107 PRO HB3 . . 4.460 4.265 4.048 4.425 . 0 0 "[ . 1 . 2]" 1
2299 1 90 LYS HD2 1 107 PRO QB . . 4.650 2.435 2.123 3.620 . 0 0 "[ . 1 . 2]" 1
2300 1 90 LYS HD3 1 107 PRO HB2 . . 4.080 2.097 1.971 2.195 . 0 0 "[ . 1 . 2]" 1
2301 1 90 LYS HD3 1 107 PRO HB3 . . 4.080 3.605 3.256 3.749 . 0 0 "[ . 1 . 2]" 1
2302 1 90 LYS HD3 1 107 PRO HG3 . . 4.730 4.621 4.319 4.737 0.007 10 0 "[ . 1 . 2]" 1
2303 1 90 LYS HD3 1 108 SER H . . 5.500 4.412 4.259 5.107 . 0 0 "[ . 1 . 2]" 1
2304 1 90 LYS QE 1 90 LYS QG . . 3.440 2.118 2.048 2.139 . 0 0 "[ . 1 . 2]" 1
2305 1 90 LYS QE 1 109 ARG HA . . 4.560 3.188 2.963 3.782 . 0 0 "[ . 1 . 2]" 1
2306 1 90 LYS QE 1 110 PRO HA . . 5.250 3.293 2.916 3.716 . 0 0 "[ . 1 . 2]" 1
2307 1 90 LYS QE 1 110 PRO HB3 . . 4.360 2.568 2.181 2.760 . 0 0 "[ . 1 . 2]" 1
2308 1 90 LYS QE 1 110 PRO QD . . 3.940 2.094 1.976 2.441 . 0 0 "[ . 1 . 2]" 1
2309 1 90 LYS QE 1 110 PRO HG3 . . 3.450 3.319 3.066 3.446 . 0 0 "[ . 1 . 2]" 1
2310 1 90 LYS HE2 1 110 PRO HG2 . . 5.280 4.742 4.400 5.235 . 0 0 "[ . 1 . 2]" 1
2311 1 90 LYS HE2 1 110 PRO HG3 . . 4.200 3.683 3.446 4.000 . 0 0 "[ . 1 . 2]" 1
2312 1 90 LYS HE3 1 110 PRO HG2 . . 5.280 5.117 4.282 5.289 0.009 14 0 "[ . 1 . 2]" 1
2313 1 90 LYS HE3 1 110 PRO HG3 . . 4.200 3.813 3.188 4.008 . 0 0 "[ . 1 . 2]" 1
2314 1 90 LYS QG 1 91 PHE H . . 4.370 3.965 3.573 4.082 . 0 0 "[ . 1 . 2]" 1
2315 1 90 LYS QG 1 107 PRO HB2 . . 5.000 3.965 3.771 4.138 . 0 0 "[ . 1 . 2]" 1
2316 1 90 LYS QG 1 107 PRO QB . . 4.150 3.797 3.606 3.946 . 0 0 "[ . 1 . 2]" 1
2317 1 90 LYS QG 1 107 PRO HB3 . . 5.000 4.864 4.589 5.058 0.058 14 0 "[ . 1 . 2]" 1
2318 1 91 PHE H 1 91 PHE HB2 . . 4.110 2.812 2.719 2.876 . 0 0 "[ . 1 . 2]" 1
2319 1 91 PHE H 1 91 PHE QD . . 3.780 2.843 2.373 3.088 . 0 0 "[ . 1 . 2]" 1
2320 1 91 PHE H 1 108 SER H . . 3.730 3.295 3.092 3.573 . 0 0 "[ . 1 . 2]" 1
2321 1 91 PHE H 1 108 SER QB . . 4.980 3.283 2.199 3.862 . 0 0 "[ . 1 . 2]" 1
2322 1 91 PHE H 1 108 SER HG . . 3.850 2.663 1.899 3.720 . 0 0 "[ . 1 . 2]" 1
2323 1 91 PHE HA 1 91 PHE QD . . 4.110 3.077 2.988 3.207 . 0 0 "[ . 1 . 2]" 1
2324 1 91 PHE HA 1 92 ARG H . . 3.280 2.329 2.223 2.414 . 0 0 "[ . 1 . 2]" 1
2325 1 91 PHE HB2 1 92 ARG H . . 4.290 3.742 3.588 3.989 . 0 0 "[ . 1 . 2]" 1
2326 1 91 PHE HB2 1 93 VAL MG2 . . 5.320 5.192 5.041 5.314 . 0 0 "[ . 1 . 2]" 1
2327 1 91 PHE HB2 1 108 SER H . . 4.940 4.590 4.421 4.792 . 0 0 "[ . 1 . 2]" 1
2328 1 91 PHE HB3 1 92 ARG H . . 3.950 2.625 2.414 2.937 . 0 0 "[ . 1 . 2]" 1
2329 1 91 PHE QD 1 92 ARG H . . 4.400 3.925 3.732 4.145 . 0 0 "[ . 1 . 2]" 1
2330 1 91 PHE QD 1 108 SER QB . . 5.310 4.163 3.481 4.550 . 0 0 "[ . 1 . 2]" 1
2331 1 91 PHE QD 1 108 SER HG . . 4.490 3.180 2.813 3.934 . 0 0 "[ . 1 . 2]" 1
2332 1 91 PHE QD 1 111 TYR QD . . 5.500 5.467 5.335 5.518 0.018 14 0 "[ . 1 . 2]" 1
2333 1 91 PHE QE 1 111 TYR QB . . 4.110 2.346 1.975 2.681 . 0 0 "[ . 1 . 2]" 1
2334 1 92 ARG H 1 92 ARG QD . . 5.340 4.521 4.339 4.654 . 0 0 "[ . 1 . 2]" 1
2335 1 92 ARG H 1 92 ARG HG2 . . 4.420 2.887 2.704 3.607 . 0 0 "[ . 1 . 2]" 1
2336 1 92 ARG H 1 92 ARG HG3 . . 4.420 2.943 2.558 3.186 . 0 0 "[ . 1 . 2]" 1
2337 1 92 ARG H 1 93 VAL H . . 4.860 4.391 4.372 4.408 . 0 0 "[ . 1 . 2]" 1
2338 1 92 ARG H 1 93 VAL MG2 . . 4.920 4.099 3.969 4.235 . 0 0 "[ . 1 . 2]" 1
2339 1 92 ARG HA 1 93 VAL H . . 3.180 2.552 2.475 2.612 . 0 0 "[ . 1 . 2]" 1
2340 1 92 ARG HA 1 93 VAL HB . . 5.450 4.544 4.508 4.589 . 0 0 "[ . 1 . 2]" 1
2341 1 92 ARG HA 1 93 VAL MG2 . . 4.010 3.375 3.235 3.439 . 0 0 "[ . 1 . 2]" 1
2342 1 92 ARG HA 1 105 SER H . . 5.170 5.090 4.853 5.176 0.006 11 0 "[ . 1 . 2]" 1
2343 1 92 ARG HB2 1 92 ARG HE . . 4.230 3.044 2.756 4.278 0.048 13 0 "[ . 1 . 2]" 1
2344 1 92 ARG HB2 1 93 VAL H . . 3.620 2.211 2.073 2.733 . 0 0 "[ . 1 . 2]" 1
2345 1 92 ARG HB2 1 105 SER H . . 3.940 3.386 3.244 3.859 . 0 0 "[ . 1 . 2]" 1
2346 1 92 ARG HB2 1 108 SER H . . 5.500 5.232 4.991 5.547 0.047 19 0 "[ . 1 . 2]" 1
2347 1 92 ARG HB3 1 92 ARG HE . . 5.080 2.479 2.017 4.030 . 0 0 "[ . 1 . 2]" 1
2348 1 92 ARG HB3 1 93 VAL H . . 3.850 3.593 2.362 3.761 . 0 0 "[ . 1 . 2]" 1
2349 1 92 ARG HB3 1 108 SER H . . 4.840 4.241 4.004 4.457 . 0 0 "[ . 1 . 2]" 1
2350 1 92 ARG QD 1 104 PRO QB . . 3.530 2.644 2.091 3.010 . 0 0 "[ . 1 . 2]" 1
2351 1 92 ARG HD2 1 104 PRO HB2 . . 4.710 4.129 2.131 4.612 . 0 0 "[ . 1 . 2]" 1
2352 1 92 ARG HD2 1 104 PRO HB3 . . 4.710 3.691 3.256 4.042 . 0 0 "[ . 1 . 2]" 1
2353 1 92 ARG HD3 1 104 PRO HB2 . . 4.710 3.185 2.362 3.640 . 0 0 "[ . 1 . 2]" 1
2354 1 92 ARG HD3 1 104 PRO HB3 . . 4.710 3.169 2.687 4.732 0.022 19 0 "[ . 1 . 2]" 1
2355 1 92 ARG HE 1 104 PRO QB . . 4.880 3.351 3.122 3.770 . 0 0 "[ . 1 . 2]" 1
2356 1 92 ARG HE 1 104 PRO QG . . 5.350 5.116 4.839 5.369 0.019 13 0 "[ . 1 . 2]" 1
2357 1 92 ARG QG 1 93 VAL H . . 4.660 3.305 3.025 4.127 . 0 0 "[ . 1 . 2]" 1
2358 1 92 ARG QG 1 104 PRO QB . . 5.170 4.394 4.095 4.658 . 0 0 "[ . 1 . 2]" 1
2359 1 93 VAL H 1 93 VAL HB . . 3.480 2.833 2.779 2.880 . 0 0 "[ . 1 . 2]" 1
2360 1 93 VAL H 1 93 VAL MG1 . . 3.930 3.910 3.887 3.936 0.006 16 0 "[ . 1 . 2]" 1
2361 1 93 VAL H 1 93 VAL MG2 . . 3.680 3.053 2.940 3.125 . 0 0 "[ . 1 . 2]" 1
2362 1 93 VAL H 1 94 ARG H . . 4.450 4.333 4.282 4.371 . 0 0 "[ . 1 . 2]" 1
2363 1 93 VAL H 1 94 ARG HA . . 4.930 4.780 4.737 4.813 . 0 0 "[ . 1 . 2]" 1
2364 1 93 VAL H 1 104 PRO HA . . 4.790 4.544 4.179 4.670 . 0 0 "[ . 1 . 2]" 1
2365 1 93 VAL H 1 105 SER H . . 3.600 3.104 2.759 3.171 . 0 0 "[ . 1 . 2]" 1
2366 1 93 VAL H 1 105 SER HB2 . . 3.940 3.587 3.468 3.744 . 0 0 "[ . 1 . 2]" 1
2367 1 93 VAL H 1 105 SER HB3 . . 4.030 2.732 2.535 3.111 . 0 0 "[ . 1 . 2]" 1
2368 1 93 VAL H 1 105 SER HG . . 3.740 2.484 2.115 2.592 . 0 0 "[ . 1 . 2]" 1
2369 1 93 VAL HA 1 93 VAL MG1 . . 3.480 2.429 2.273 2.470 . 0 0 "[ . 1 . 2]" 1
2370 1 93 VAL HA 1 93 VAL MG2 . . 3.540 2.293 2.260 2.369 . 0 0 "[ . 1 . 2]" 1
2371 1 93 VAL HA 1 94 ARG H . . 2.890 2.212 2.180 2.248 . 0 0 "[ . 1 . 2]" 1
2372 1 93 VAL HB 1 94 ARG H . . 4.310 3.991 3.886 4.082 . 0 0 "[ . 1 . 2]" 1
2373 1 93 VAL HB 1 105 SER HB2 . . 5.170 3.868 3.646 4.066 . 0 0 "[ . 1 . 2]" 1
2374 1 93 VAL HB 1 105 SER HB3 . . 4.540 3.068 2.833 3.306 . 0 0 "[ . 1 . 2]" 1
2375 1 93 VAL MG1 1 94 ARG H . . 3.350 2.228 2.118 2.413 . 0 0 "[ . 1 . 2]" 1
2376 1 93 VAL MG1 1 95 ALA HA . . 4.520 4.260 4.147 4.367 . 0 0 "[ . 1 . 2]" 1
2377 1 93 VAL MG1 1 95 ALA MB . . 4.370 4.131 4.053 4.219 . 0 0 "[ . 1 . 2]" 1
2378 1 93 VAL MG1 1 105 SER H . . 5.120 5.078 4.901 5.127 0.007 16 0 "[ . 1 . 2]" 1
2379 1 93 VAL MG1 1 105 SER HB2 . . 5.500 5.109 4.923 5.298 . 0 0 "[ . 1 . 2]" 1
2380 1 93 VAL MG1 1 105 SER HB3 . . 4.480 4.137 3.930 4.299 . 0 0 "[ . 1 . 2]" 1
2381 1 93 VAL MG2 1 94 ARG H . . 4.030 3.897 3.831 3.981 . 0 0 "[ . 1 . 2]" 1
2382 1 93 VAL MG2 1 105 SER H . . 5.500 5.439 5.162 5.506 0.006 17 0 "[ . 1 . 2]" 1
2383 1 93 VAL MG2 1 105 SER HB3 . . 4.560 4.295 4.084 4.546 . 0 0 "[ . 1 . 2]" 1
2384 1 93 VAL MG2 1 105 SER HG . . 4.680 4.086 3.832 4.329 . 0 0 "[ . 1 . 2]" 1
2385 1 94 ARG H 1 94 ARG HB2 . . 3.520 2.570 2.500 2.643 . 0 0 "[ . 1 . 2]" 1
2386 1 94 ARG H 1 94 ARG HB3 . . 3.900 3.687 3.643 3.718 . 0 0 "[ . 1 . 2]" 1
2387 1 94 ARG H 1 94 ARG HD2 . . 5.500 5.256 5.156 5.354 . 0 0 "[ . 1 . 2]" 1
2388 1 94 ARG H 1 94 ARG HD3 . . 5.500 5.531 5.510 5.567 0.067 14 0 "[ . 1 . 2]" 1
2389 1 94 ARG H 1 94 ARG HG2 . . 4.690 4.116 4.055 4.210 . 0 0 "[ . 1 . 2]" 1
2390 1 94 ARG H 1 94 ARG HG3 . . 4.510 3.674 3.590 3.787 . 0 0 "[ . 1 . 2]" 1
2391 1 94 ARG H 1 95 ALA H . . 4.540 4.383 4.299 4.432 . 0 0 "[ . 1 . 2]" 1
2392 1 94 ARG H 1 96 LEU MD1 . . 4.780 4.497 4.368 4.618 . 0 0 "[ . 1 . 2]" 1
2393 1 94 ARG HA 1 94 ARG HG2 . . 4.200 2.206 2.188 2.219 . 0 0 "[ . 1 . 2]" 1
2394 1 94 ARG HA 1 95 ALA H . . 2.990 2.209 2.175 2.245 . 0 0 "[ . 1 . 2]" 1
2395 1 94 ARG HA 1 95 ALA MB . . 4.590 3.888 3.854 3.951 . 0 0 "[ . 1 . 2]" 1
2396 1 94 ARG HA 1 102 SER H . . 4.570 4.373 4.249 4.449 . 0 0 "[ . 1 . 2]" 1
2397 1 94 ARG HA 1 105 SER H . . 4.020 3.824 3.685 3.981 . 0 0 "[ . 1 . 2]" 1
2398 1 94 ARG HA 1 105 SER HB3 . . 4.610 4.308 4.180 4.519 . 0 0 "[ . 1 . 2]" 1
2399 1 94 ARG HB2 1 94 ARG HD2 . . 3.990 2.829 2.754 2.885 . 0 0 "[ . 1 . 2]" 1
2400 1 94 ARG HB2 1 94 ARG HD3 . . 4.070 3.342 3.281 3.399 . 0 0 "[ . 1 . 2]" 1
2401 1 94 ARG HB2 1 95 ALA H . . 4.360 4.203 4.110 4.292 . 0 0 "[ . 1 . 2]" 1
2402 1 94 ARG HB2 1 96 LEU MD1 . . 4.570 3.233 3.095 3.317 . 0 0 "[ . 1 . 2]" 1
2403 1 94 ARG HB2 1 102 SER H . . 5.500 5.217 5.117 5.323 . 0 0 "[ . 1 . 2]" 1
2404 1 94 ARG HB3 1 94 ARG HD2 . . 3.960 2.750 2.680 2.824 . 0 0 "[ . 1 . 2]" 1
2405 1 94 ARG HB3 1 95 ALA H . . 3.580 3.049 2.901 3.198 . 0 0 "[ . 1 . 2]" 1
2406 1 94 ARG HB3 1 101 GLU QG . . 5.340 4.470 4.273 4.609 . 0 0 "[ . 1 . 2]" 1
2407 1 94 ARG HB3 1 102 SER H . . 4.020 3.479 3.387 3.583 . 0 0 "[ . 1 . 2]" 1
2408 1 94 ARG HD2 1 96 LEU MD1 . . 4.440 3.830 3.633 3.952 . 0 0 "[ . 1 . 2]" 1
2409 1 94 ARG HD2 1 101 GLU HB2 . . 4.470 4.169 4.119 4.226 . 0 0 "[ . 1 . 2]" 1
2410 1 94 ARG HD2 1 101 GLU HB3 . . 5.500 5.508 5.500 5.515 0.015 8 0 "[ . 1 . 2]" 1
2411 1 94 ARG HD2 1 104 PRO HA . . 4.410 4.371 4.279 4.417 0.007 3 0 "[ . 1 . 2]" 1
2412 1 94 ARG HD3 1 95 ALA H . . 4.900 4.442 4.269 4.608 . 0 0 "[ . 1 . 2]" 1
2413 1 94 ARG HD3 1 101 GLU HB2 . . 4.390 3.179 2.973 3.388 . 0 0 "[ . 1 . 2]" 1
2414 1 94 ARG HD3 1 101 GLU HB3 . . 5.500 4.779 4.532 4.975 . 0 0 "[ . 1 . 2]" 1
2415 1 94 ARG HD3 1 101 GLU HG2 . . 5.100 4.173 3.712 4.970 . 0 0 "[ . 1 . 2]" 1
2416 1 94 ARG HD3 1 101 GLU QG . . 4.310 3.226 2.920 3.352 . 0 0 "[ . 1 . 2]" 1
2417 1 94 ARG HD3 1 101 GLU HG3 . . 5.100 3.384 2.949 3.605 . 0 0 "[ . 1 . 2]" 1
2418 1 94 ARG HD3 1 103 GLU HA . . 5.040 4.357 3.989 4.684 . 0 0 "[ . 1 . 2]" 1
2419 1 94 ARG HD3 1 104 PRO HA . . 4.700 4.174 3.996 4.356 . 0 0 "[ . 1 . 2]" 1
2420 1 94 ARG HE 1 94 ARG HG3 . . 4.120 2.732 2.581 2.829 . 0 0 "[ . 1 . 2]" 1
2421 1 94 ARG HE 1 104 PRO HA . . 4.800 2.077 1.946 2.324 . 0 0 "[ . 1 . 2]" 1
2422 1 94 ARG HG2 1 95 ALA H . . 4.080 3.815 3.719 3.916 . 0 0 "[ . 1 . 2]" 1
2423 1 94 ARG HG2 1 104 PRO HA . . 3.660 2.440 2.231 2.545 . 0 0 "[ . 1 . 2]" 1
2424 1 94 ARG HG2 1 104 PRO QB . . 4.910 3.998 3.689 4.126 . 0 0 "[ . 1 . 2]" 1
2425 1 94 ARG HG3 1 104 PRO HA . . 3.830 2.894 2.664 3.089 . 0 0 "[ . 1 . 2]" 1
2426 1 94 ARG HG3 1 105 SER H . . 4.200 3.883 3.678 4.001 . 0 0 "[ . 1 . 2]" 1
2427 1 95 ALA H 1 95 ALA MB . . 3.240 2.207 2.165 2.250 . 0 0 "[ . 1 . 2]" 1
2428 1 95 ALA H 1 96 LEU H . . 4.890 4.458 4.419 4.509 . 0 0 "[ . 1 . 2]" 1
2429 1 95 ALA H 1 96 LEU MD1 . . 4.600 3.701 3.527 3.980 . 0 0 "[ . 1 . 2]" 1
2430 1 95 ALA H 1 101 GLU HB2 . . 4.990 4.751 4.640 4.849 . 0 0 "[ . 1 . 2]" 1
2431 1 95 ALA H 1 102 SER H . . 3.800 2.864 2.780 3.002 . 0 0 "[ . 1 . 2]" 1
2432 1 95 ALA H 1 102 SER HB2 . . 4.090 3.724 3.511 3.945 . 0 0 "[ . 1 . 2]" 1
2433 1 95 ALA H 1 102 SER HB3 . . 3.940 2.814 2.511 3.266 . 0 0 "[ . 1 . 2]" 1
2434 1 95 ALA H 1 102 SER HG . . 3.340 2.609 2.233 2.840 . 0 0 "[ . 1 . 2]" 1
2435 1 95 ALA H 1 103 GLU H . . 5.380 5.056 4.928 5.372 . 0 0 "[ . 1 . 2]" 1
2436 1 95 ALA HA 1 96 LEU H . . 2.910 2.157 2.147 2.170 . 0 0 "[ . 1 . 2]" 1
2437 1 95 ALA HA 1 96 LEU MD1 . . 4.720 3.202 3.036 3.406 . 0 0 "[ . 1 . 2]" 1
2438 1 95 ALA MB 1 96 LEU H . . 3.280 3.122 3.050 3.187 . 0 0 "[ . 1 . 2]" 1
2439 1 95 ALA MB 1 96 LEU MD1 . . 4.280 4.040 3.906 4.242 . 0 0 "[ . 1 . 2]" 1
2440 1 95 ALA MB 1 102 SER H . . 4.520 3.546 3.486 3.612 . 0 0 "[ . 1 . 2]" 1
2441 1 95 ALA MB 1 102 SER HA . . 4.620 4.525 4.408 4.627 0.007 20 0 "[ . 1 . 2]" 1
2442 1 95 ALA MB 1 102 SER HB2 . . 3.760 3.342 3.201 3.480 . 0 0 "[ . 1 . 2]" 1
2443 1 95 ALA MB 1 102 SER HB3 . . 4.050 2.301 2.138 2.478 . 0 0 "[ . 1 . 2]" 1
2444 1 96 LEU H 1 96 LEU HB2 . . 3.210 2.471 2.430 2.500 . 0 0 "[ . 1 . 2]" 1
2445 1 96 LEU H 1 96 LEU HB3 . . 3.890 3.638 3.607 3.664 . 0 0 "[ . 1 . 2]" 1
2446 1 96 LEU H 1 96 LEU MD1 . . 3.360 2.675 2.459 2.886 . 0 0 "[ . 1 . 2]" 1
2447 1 96 LEU H 1 96 LEU MD2 . . 4.720 4.486 4.409 4.597 . 0 0 "[ . 1 . 2]" 1
2448 1 96 LEU H 1 96 LEU HG . . 4.550 4.190 4.094 4.266 . 0 0 "[ . 1 . 2]" 1
2449 1 96 LEU H 1 97 ASN H . . 4.370 4.248 4.205 4.271 . 0 0 "[ . 1 . 2]" 1
2450 1 96 LEU HA 1 96 LEU MD1 . . 3.590 2.966 2.808 3.125 . 0 0 "[ . 1 . 2]" 1
2451 1 96 LEU HA 1 96 LEU MD2 . . 3.920 3.642 3.528 3.713 . 0 0 "[ . 1 . 2]" 1
2452 1 96 LEU HA 1 96 LEU HG . . 3.670 2.335 2.259 2.396 . 0 0 "[ . 1 . 2]" 1
2453 1 96 LEU HA 1 97 ASN H . . 2.770 2.140 2.139 2.142 . 0 0 "[ . 1 . 2]" 1
2454 1 96 LEU HA 1 100 GLY H . . 4.700 4.465 4.434 4.500 . 0 0 "[ . 1 . 2]" 1
2455 1 96 LEU HA 1 102 SER H . . 3.730 3.653 3.609 3.724 . 0 0 "[ . 1 . 2]" 1
2456 1 96 LEU HB2 1 96 LEU MD2 . . 3.460 2.579 2.480 2.700 . 0 0 "[ . 1 . 2]" 1
2457 1 96 LEU HB2 1 97 ASN H . . 4.550 4.429 4.401 4.450 . 0 0 "[ . 1 . 2]" 1
2458 1 96 LEU HB3 1 96 LEU MD2 . . 3.370 2.155 2.046 2.268 . 0 0 "[ . 1 . 2]" 1
2459 1 96 LEU HB3 1 97 ASN H . . 3.660 3.510 3.468 3.579 . 0 0 "[ . 1 . 2]" 1
2460 1 96 LEU HB3 1 97 ASN HA . . 4.720 4.383 4.352 4.438 . 0 0 "[ . 1 . 2]" 1
2461 1 96 LEU MD1 1 97 ASN H . . 4.890 4.757 4.644 4.891 0.001 7 0 "[ . 1 . 2]" 1
2462 1 96 LEU MD1 1 101 GLU H . . 5.160 5.048 4.869 5.166 0.006 12 0 "[ . 1 . 2]" 1
2463 1 96 LEU MD1 1 101 GLU HB2 . . 3.890 2.264 2.029 2.516 . 0 0 "[ . 1 . 2]" 1
2464 1 96 LEU MD1 1 101 GLU HB3 . . 3.750 2.931 2.775 3.125 . 0 0 "[ . 1 . 2]" 1
2465 1 96 LEU MD1 1 101 GLU QG . . 3.870 3.756 3.553 3.868 . 0 0 "[ . 1 . 2]" 1
2466 1 96 LEU MD1 1 102 SER H . . 4.170 3.309 3.126 3.591 . 0 0 "[ . 1 . 2]" 1
2467 1 96 LEU MD2 1 97 ASN H . . 4.840 4.742 4.512 4.844 0.004 19 0 "[ . 1 . 2]" 1
2468 1 96 LEU MD2 1 101 GLU H . . 5.170 4.774 4.431 5.068 . 0 0 "[ . 1 . 2]" 1
2469 1 96 LEU MD2 1 101 GLU HB2 . . 3.840 3.542 3.312 3.697 . 0 0 "[ . 1 . 2]" 1
2470 1 96 LEU MD2 1 101 GLU HB3 . . 3.940 2.787 2.460 2.937 . 0 0 "[ . 1 . 2]" 1
2471 1 96 LEU HG 1 97 ASN H . . 4.310 4.110 4.032 4.200 . 0 0 "[ . 1 . 2]" 1
2472 1 96 LEU HG 1 101 GLU H . . 4.180 4.061 3.945 4.181 0.001 19 0 "[ . 1 . 2]" 1
2473 1 96 LEU HG 1 101 GLU HB3 . . 4.170 2.014 1.991 2.149 . 0 0 "[ . 1 . 2]" 1
2474 1 96 LEU HG 1 101 GLU HG2 . . 4.900 4.639 4.478 4.732 . 0 0 "[ . 1 . 2]" 1
2475 1 96 LEU HG 1 101 GLU QG . . 4.240 4.004 3.897 4.069 . 0 0 "[ . 1 . 2]" 1
2476 1 96 LEU HG 1 101 GLU HG3 . . 4.900 4.383 4.239 4.628 . 0 0 "[ . 1 . 2]" 1
2477 1 96 LEU HG 1 102 SER H . . 4.700 3.932 3.750 4.129 . 0 0 "[ . 1 . 2]" 1
2478 1 97 ASN H 1 99 LEU H . . 4.050 3.632 3.589 3.675 . 0 0 "[ . 1 . 2]" 1
2479 1 97 ASN H 1 100 GLY H . . 3.290 2.762 2.732 2.788 . 0 0 "[ . 1 . 2]" 1
2480 1 97 ASN H 1 100 GLY HA3 . . 4.780 4.670 4.646 4.698 . 0 0 "[ . 1 . 2]" 1
2481 1 97 ASN H 1 101 GLU H . . 5.140 4.836 4.797 4.881 . 0 0 "[ . 1 . 2]" 1
2482 1 97 ASN H 1 101 GLU HA . . 3.690 3.407 3.364 3.426 . 0 0 "[ . 1 . 2]" 1
2483 1 97 ASN H 1 101 GLU HB3 . . 5.350 5.174 5.085 5.282 . 0 0 "[ . 1 . 2]" 1
2484 1 97 ASN H 1 102 SER H . . 5.220 5.192 5.133 5.232 0.012 15 0 "[ . 1 . 2]" 1
2485 1 97 ASN HA 1 98 MET H . . 3.440 2.673 2.660 2.686 . 0 0 "[ . 1 . 2]" 1
2486 1 97 ASN HA 1 98 MET HB3 . . 5.050 4.736 4.557 4.826 . 0 0 "[ . 1 . 2]" 1
2487 1 97 ASN HA 1 99 LEU H . . 4.480 4.000 3.995 4.003 . 0 0 "[ . 1 . 2]" 1
2488 1 97 ASN HB2 1 98 MET H . . 3.490 2.073 2.055 2.086 . 0 0 "[ . 1 . 2]" 1
2489 1 97 ASN HB2 1 99 LEU H . . 4.550 3.263 3.227 3.310 . 0 0 "[ . 1 . 2]" 1
2490 1 97 ASN HB2 1 99 LEU HB2 . . 4.780 4.651 4.595 4.712 . 0 0 "[ . 1 . 2]" 1
2491 1 97 ASN HB3 1 98 MET H . . 3.720 3.595 3.581 3.606 . 0 0 "[ . 1 . 2]" 1
2492 1 97 ASN HD22 1 99 LEU H . . 4.410 3.140 3.088 3.168 . 0 0 "[ . 1 . 2]" 1
2493 1 97 ASN HD22 1 99 LEU MD1 . . 4.310 1.978 1.878 2.182 . 0 0 "[ . 1 . 2]" 1
2494 1 98 MET H 1 98 MET HB2 . . 3.710 3.574 3.527 3.597 . 0 0 "[ . 1 . 2]" 1
2495 1 98 MET H 1 98 MET HB3 . . 3.490 2.531 2.242 2.675 . 0 0 "[ . 1 . 2]" 1
2496 1 98 MET H 1 98 MET ME . . 4.740 4.322 3.338 4.741 0.001 15 0 "[ . 1 . 2]" 1
2497 1 98 MET H 1 98 MET QG . . 3.680 2.151 1.884 2.694 . 0 0 "[ . 1 . 2]" 1
2498 1 98 MET H 1 99 LEU H . . 3.740 2.674 2.664 2.685 . 0 0 "[ . 1 . 2]" 1
2499 1 98 MET H 1 100 GLY H . . 4.410 4.262 4.240 4.281 . 0 0 "[ . 1 . 2]" 1
2500 1 98 MET HA 1 98 MET HB2 . . 3.020 2.425 2.293 2.490 . 0 0 "[ . 1 . 2]" 1
2501 1 98 MET HA 1 98 MET ME . . 4.830 4.658 4.536 4.830 . 0 0 "[ . 1 . 2]" 1
2502 1 98 MET HA 1 98 MET HG2 . . 4.020 3.732 3.685 3.819 . 0 0 "[ . 1 . 2]" 1
2503 1 98 MET HA 1 98 MET HG3 . . 4.020 3.722 3.551 3.808 . 0 0 "[ . 1 . 2]" 1
2504 1 98 MET HA 1 100 GLY H . . 4.370 4.213 4.178 4.240 . 0 0 "[ . 1 . 2]" 1
2505 1 98 MET HB2 1 99 LEU H . . 4.480 4.336 4.246 4.485 0.005 8 0 "[ . 1 . 2]" 1
2506 1 98 MET HB2 1 99 LEU MD2 . . 4.870 3.837 3.582 4.176 . 0 0 "[ . 1 . 2]" 1
2507 1 98 MET HB3 1 99 LEU H . . 4.630 4.322 4.112 4.421 . 0 0 "[ . 1 . 2]" 1
2508 1 98 MET ME 1 99 LEU H . . 5.480 5.002 4.721 5.188 . 0 0 "[ . 1 . 2]" 1
2509 1 98 MET ME 1 99 LEU MD1 . . 4.500 4.416 4.291 4.500 0.000 9 0 "[ . 1 . 2]" 1
2510 1 98 MET ME 1 99 LEU MD2 . . 3.450 2.945 2.633 3.454 0.004 3 0 "[ . 1 . 2]" 1
2511 1 98 MET QG 1 99 LEU H . . 3.610 3.086 3.018 3.132 . 0 0 "[ . 1 . 2]" 1
2512 1 98 MET QG 1 99 LEU HA . . 4.540 3.724 3.369 3.917 . 0 0 "[ . 1 . 2]" 1
2513 1 98 MET QG 1 99 LEU MD2 . . 3.360 2.146 1.826 2.466 . 0 0 "[ . 1 . 2]" 1
2514 1 98 MET QG 1 99 LEU HG . . 3.760 2.568 2.515 2.632 . 0 0 "[ . 1 . 2]" 1
2515 1 98 MET HG2 1 99 LEU H . . 4.220 3.425 3.216 3.541 . 0 0 "[ . 1 . 2]" 1
2516 1 98 MET HG2 1 99 LEU MD2 . . 4.040 3.210 2.143 3.761 . 0 0 "[ . 1 . 2]" 1
2517 1 98 MET HG2 1 99 LEU HG . . 4.380 3.059 2.605 3.309 . 0 0 "[ . 1 . 2]" 1
2518 1 98 MET HG2 1 100 GLY H . . 5.500 5.402 5.239 5.487 . 0 0 "[ . 1 . 2]" 1
2519 1 98 MET HG3 1 99 LEU H . . 4.220 3.530 3.354 3.757 . 0 0 "[ . 1 . 2]" 1
2520 1 98 MET HG3 1 99 LEU MD2 . . 4.040 2.204 1.978 2.500 . 0 0 "[ . 1 . 2]" 1
2521 1 98 MET HG3 1 99 LEU HG . . 4.380 2.921 2.617 3.514 . 0 0 "[ . 1 . 2]" 1
2522 1 98 MET HG3 1 100 GLY H . . 5.500 5.412 5.310 5.497 . 0 0 "[ . 1 . 2]" 1
2523 1 99 LEU H 1 99 LEU HB2 . . 3.130 2.611 2.561 2.674 . 0 0 "[ . 1 . 2]" 1
2524 1 99 LEU H 1 99 LEU HB3 . . 3.760 3.714 3.696 3.727 . 0 0 "[ . 1 . 2]" 1
2525 1 99 LEU H 1 99 LEU MD1 . . 4.040 3.968 3.891 4.044 0.004 6 0 "[ . 1 . 2]" 1
2526 1 99 LEU H 1 99 LEU MD2 . . 3.460 3.348 3.299 3.432 . 0 0 "[ . 1 . 2]" 1
2527 1 99 LEU H 1 99 LEU HG . . 3.150 2.633 2.488 2.730 . 0 0 "[ . 1 . 2]" 1
2528 1 99 LEU H 1 100 GLY HA2 . . 4.820 4.515 4.480 4.548 . 0 0 "[ . 1 . 2]" 1
2529 1 99 LEU H 1 100 GLY HA3 . . 5.040 4.759 4.729 4.791 . 0 0 "[ . 1 . 2]" 1
2530 1 99 LEU HA 1 99 LEU MD1 . . 4.000 3.842 3.811 3.883 . 0 0 "[ . 1 . 2]" 1
2531 1 99 LEU HA 1 99 LEU MD2 . . 2.610 2.069 1.966 2.186 . 0 0 "[ . 1 . 2]" 1
2532 1 99 LEU HA 1 99 LEU HG . . 3.780 3.324 3.256 3.371 . 0 0 "[ . 1 . 2]" 1
2533 1 99 LEU HA 1 100 GLY H . . 3.550 3.465 3.455 3.471 . 0 0 "[ . 1 . 2]" 1
2534 1 99 LEU HB2 1 99 LEU MD1 . . 3.380 2.443 2.407 2.471 . 0 0 "[ . 1 . 2]" 1
2535 1 99 LEU HB2 1 100 GLY H . . 3.500 2.956 2.933 3.002 . 0 0 "[ . 1 . 2]" 1
2536 1 99 LEU HB3 1 99 LEU MD1 . . 3.330 2.220 2.172 2.270 . 0 0 "[ . 1 . 2]" 1
2537 1 99 LEU HB3 1 99 LEU MD2 . . 3.470 2.407 2.369 2.460 . 0 0 "[ . 1 . 2]" 1
2538 1 99 LEU MD1 1 100 GLY H . . 4.940 4.834 4.798 4.866 . 0 0 "[ . 1 . 2]" 1
2539 1 99 LEU MD2 1 100 GLY H . . 4.650 4.544 4.518 4.588 . 0 0 "[ . 1 . 2]" 1
2540 1 99 LEU HG 1 100 GLY H . . 4.330 4.268 4.167 4.327 . 0 0 "[ . 1 . 2]" 1
2541 1 100 GLY H 1 101 GLU H . . 4.550 4.425 4.415 4.430 . 0 0 "[ . 1 . 2]" 1
2542 1 100 GLY H 1 101 GLU HA . . 5.040 4.771 4.750 4.793 . 0 0 "[ . 1 . 2]" 1
2543 1 100 GLY HA2 1 101 GLU H . . 2.940 2.733 2.688 2.779 . 0 0 "[ . 1 . 2]" 1
2544 1 100 GLY HA2 1 101 GLU HB3 . . 4.870 4.423 4.327 4.487 . 0 0 "[ . 1 . 2]" 1
2545 1 100 GLY HA3 1 101 GLU H . . 2.820 2.407 2.367 2.445 . 0 0 "[ . 1 . 2]" 1
2546 1 101 GLU H 1 101 GLU HB2 . . 3.780 3.703 3.677 3.738 . 0 0 "[ . 1 . 2]" 1
2547 1 101 GLU H 1 101 GLU HB3 . . 3.170 2.773 2.649 2.845 . 0 0 "[ . 1 . 2]" 1
2548 1 101 GLU H 1 101 GLU HG2 . . 3.880 2.798 2.118 3.139 . 0 0 "[ . 1 . 2]" 1
2549 1 101 GLU H 1 101 GLU QG . . 3.320 2.728 2.105 3.006 . 0 0 "[ . 1 . 2]" 1
2550 1 101 GLU H 1 101 GLU HG3 . . 3.880 3.838 3.628 3.911 0.031 19 0 "[ . 1 . 2]" 1
2551 1 101 GLU H 1 102 SER H . . 4.560 4.553 4.531 4.569 0.009 14 0 "[ . 1 . 2]" 1
2552 1 101 GLU HA 1 102 SER H . . 3.060 2.345 2.324 2.354 . 0 0 "[ . 1 . 2]" 1
2553 1 101 GLU HB2 1 101 GLU QG . . 2.620 2.157 2.141 2.241 . 0 0 "[ . 1 . 2]" 1
2554 1 101 GLU HB2 1 102 SER H . . 3.680 2.609 2.579 2.673 . 0 0 "[ . 1 . 2]" 1
2555 1 101 GLU HB2 1 102 SER HA . . 5.040 4.840 4.781 4.946 . 0 0 "[ . 1 . 2]" 1
2556 1 101 GLU HB3 1 102 SER H . . 4.170 3.928 3.880 4.001 . 0 0 "[ . 1 . 2]" 1
2557 1 101 GLU HG2 1 102 SER H . . 4.430 3.763 3.540 4.338 . 0 0 "[ . 1 . 2]" 1
2558 1 101 GLU HG3 1 102 SER H . . 4.430 4.225 3.430 4.428 . 0 0 "[ . 1 . 2]" 1
2559 1 102 SER H 1 102 SER HB2 . . 3.790 3.664 3.647 3.692 . 0 0 "[ . 1 . 2]" 1
2560 1 102 SER H 1 102 SER HB3 . . 3.730 2.538 2.464 2.710 . 0 0 "[ . 1 . 2]" 1
2561 1 102 SER H 1 103 GLU H . . 4.580 4.523 4.514 4.544 . 0 0 "[ . 1 . 2]" 1
2562 1 102 SER HA 1 103 GLU H . . 2.940 2.527 2.444 2.537 . 0 0 "[ . 1 . 2]" 1
2563 1 102 SER HB2 1 103 GLU H . . 3.640 2.389 2.276 2.438 . 0 0 "[ . 1 . 2]" 1
2564 1 102 SER HB2 1 103 GLU HB2 . . 4.270 4.233 4.077 4.292 0.022 14 0 "[ . 1 . 2]" 1
2565 1 102 SER HB3 1 103 GLU H . . 3.890 3.804 3.744 3.850 . 0 0 "[ . 1 . 2]" 1
2566 1 102 SER HG 1 103 GLU H . . 3.720 2.877 2.531 3.400 . 0 0 "[ . 1 . 2]" 1
2567 1 102 SER HG 1 105 SER H . . 5.370 4.685 4.480 5.092 . 0 0 "[ . 1 . 2]" 1
2568 1 103 GLU H 1 103 GLU HB2 . . 3.130 2.199 2.175 2.297 . 0 0 "[ . 1 . 2]" 1
2569 1 103 GLU H 1 103 GLU HB3 . . 3.680 3.499 3.483 3.554 . 0 0 "[ . 1 . 2]" 1
2570 1 103 GLU H 1 103 GLU HG2 . . 4.220 4.054 3.897 4.207 . 0 0 "[ . 1 . 2]" 1
2571 1 103 GLU H 1 103 GLU HG3 . . 3.340 3.003 2.856 3.379 0.039 19 0 "[ . 1 . 2]" 1
2572 1 103 GLU H 1 104 PRO HD3 . . 5.220 5.075 5.054 5.086 . 0 0 "[ . 1 . 2]" 1
2573 1 103 GLU HA 1 103 GLU HG2 . . 3.710 2.580 2.293 3.465 . 0 0 "[ . 1 . 2]" 1
2574 1 103 GLU HA 1 103 GLU HG3 . . 3.750 2.647 2.217 2.911 . 0 0 "[ . 1 . 2]" 1
2575 1 103 GLU HA 1 104 PRO HD2 . . 3.220 2.481 2.453 2.511 . 0 0 "[ . 1 . 2]" 1
2576 1 103 GLU HA 1 104 PRO HD3 . . 3.170 2.333 2.320 2.347 . 0 0 "[ . 1 . 2]" 1
2577 1 103 GLU HB2 1 104 PRO HD2 . . 3.860 3.629 3.585 3.682 . 0 0 "[ . 1 . 2]" 1
2578 1 103 GLU HB3 1 104 PRO HD2 . . 3.500 2.062 1.987 2.139 . 0 0 "[ . 1 . 2]" 1
2579 1 103 GLU HB3 1 104 PRO HD3 . . 3.730 3.498 3.439 3.563 . 0 0 "[ . 1 . 2]" 1
2580 1 103 GLU HG2 1 104 PRO HD2 . . 4.230 2.536 2.371 3.316 . 0 0 "[ . 1 . 2]" 1
2581 1 103 GLU HG2 1 104 PRO HD3 . . 4.580 3.520 3.290 4.625 0.045 19 0 "[ . 1 . 2]" 1
2582 1 103 GLU HG3 1 104 PRO HD2 . . 4.310 3.737 3.053 3.955 . 0 0 "[ . 1 . 2]" 1
2583 1 104 PRO HA 1 105 SER H . . 2.970 2.193 2.161 2.216 . 0 0 "[ . 1 . 2]" 1
2584 1 104 PRO HA 1 105 SER HB3 . . 4.640 4.462 4.404 4.587 . 0 0 "[ . 1 . 2]" 1
2585 1 104 PRO QB 1 105 SER H . . 3.860 3.633 3.519 3.692 . 0 0 "[ . 1 . 2]" 1
2586 1 104 PRO HB2 1 105 SER H . . 4.410 3.927 3.787 4.000 . 0 0 "[ . 1 . 2]" 1
2587 1 104 PRO HB3 1 105 SER H . . 4.410 4.282 4.179 4.337 . 0 0 "[ . 1 . 2]" 1
2588 1 105 SER H 1 105 SER HB2 . . 3.590 3.552 3.529 3.585 . 0 0 "[ . 1 . 2]" 1
2589 1 105 SER H 1 105 SER HB3 . . 3.400 2.296 2.235 2.430 . 0 0 "[ . 1 . 2]" 1
2590 1 105 SER H 1 105 SER HG . . 4.050 3.599 2.895 3.874 . 0 0 "[ . 1 . 2]" 1
2591 1 105 SER H 1 106 ALA H . . 4.690 4.643 4.636 4.648 . 0 0 "[ . 1 . 2]" 1
2592 1 105 SER HA 1 106 ALA H . . 2.930 2.305 2.260 2.355 . 0 0 "[ . 1 . 2]" 1
2593 1 105 SER HA 1 106 ALA MB . . 4.010 4.064 4.036 4.083 0.073 15 0 "[ . 1 . 2]" 1
2594 1 105 SER HB2 1 106 ALA H . . 3.280 2.761 2.577 2.873 . 0 0 "[ . 1 . 2]" 1
2595 1 105 SER HB3 1 106 ALA H . . 4.100 4.047 3.898 4.118 0.018 13 0 "[ . 1 . 2]" 1
2596 1 105 SER HG 1 106 ALA H . . 3.710 3.434 3.229 3.704 . 0 0 "[ . 1 . 2]" 1
2597 1 106 ALA H 1 106 ALA MB . . 2.820 2.043 2.030 2.087 . 0 0 "[ . 1 . 2]" 1
2598 1 106 ALA H 1 107 PRO QD . . 4.860 4.286 4.240 4.317 . 0 0 "[ . 1 . 2]" 1
2599 1 106 ALA HA 1 107 PRO HD2 . . 3.230 2.204 2.158 2.243 . 0 0 "[ . 1 . 2]" 1
2600 1 106 ALA HA 1 107 PRO HD3 . . 3.230 2.254 2.252 2.257 . 0 0 "[ . 1 . 2]" 1
2601 1 106 ALA HA 1 107 PRO HG2 . . 4.540 4.355 4.320 4.386 . 0 0 "[ . 1 . 2]" 1
2602 1 106 ALA HA 1 107 PRO HG3 . . 4.590 4.370 4.352 4.388 . 0 0 "[ . 1 . 2]" 1
2603 1 106 ALA MB 1 107 PRO HD2 . . 3.660 2.459 2.331 2.538 . 0 0 "[ . 1 . 2]" 1
2604 1 106 ALA MB 1 107 PRO QD . . 2.930 2.415 2.296 2.489 . 0 0 "[ . 1 . 2]" 1
2605 1 106 ALA MB 1 107 PRO HD3 . . 3.660 3.526 3.462 3.590 . 0 0 "[ . 1 . 2]" 1
2606 1 106 ALA MB 1 107 PRO HG2 . . 4.180 4.100 4.021 4.171 . 0 0 "[ . 1 . 2]" 1
2607 1 106 ALA MB 1 107 PRO HG3 . . 4.930 4.774 4.696 4.848 . 0 0 "[ . 1 . 2]" 1
2608 1 106 ALA MB 1 108 SER H . . 4.650 4.378 4.133 4.563 . 0 0 "[ . 1 . 2]" 1
2609 1 107 PRO QB 1 108 SER H . . 3.920 3.749 3.668 3.835 . 0 0 "[ . 1 . 2]" 1
2610 1 107 PRO HB2 1 108 SER H . . 4.580 4.067 3.970 4.171 . 0 0 "[ . 1 . 2]" 1
2611 1 107 PRO HB3 1 108 SER H . . 4.580 4.391 4.314 4.476 . 0 0 "[ . 1 . 2]" 1
2612 1 108 SER H 1 108 SER HB2 . . 4.190 3.397 2.780 3.599 . 0 0 "[ . 1 . 2]" 1
2613 1 108 SER H 1 108 SER QB . . 3.380 2.258 2.165 2.403 . 0 0 "[ . 1 . 2]" 1
2614 1 108 SER H 1 108 SER HB3 . . 4.190 2.302 2.186 2.441 . 0 0 "[ . 1 . 2]" 1
2615 1 108 SER H 1 108 SER HG . . 4.160 3.546 2.812 4.158 . 0 0 "[ . 1 . 2]" 1
2616 1 108 SER H 1 109 ARG H . . 4.800 4.642 4.626 4.650 . 0 0 "[ . 1 . 2]" 1
2617 1 108 SER HA 1 109 ARG H . . 3.070 2.369 2.250 2.490 . 0 0 "[ . 1 . 2]" 1
2618 1 108 SER HA 1 109 ARG QG . . 4.500 4.061 3.712 4.380 . 0 0 "[ . 1 . 2]" 1
2619 1 108 SER QB 1 109 ARG H . . 3.680 2.725 2.350 3.465 . 0 0 "[ . 1 . 2]" 1
2620 1 108 SER HG 1 109 ARG H . . 4.110 3.352 2.510 3.945 . 0 0 "[ . 1 . 2]" 1
2621 1 109 ARG H 1 109 ARG HB2 . . 3.740 2.987 2.274 3.594 . 0 0 "[ . 1 . 2]" 1
2622 1 109 ARG H 1 109 ARG QB . . 3.020 2.465 2.248 2.582 . 0 0 "[ . 1 . 2]" 1
2623 1 109 ARG H 1 109 ARG HB3 . . 3.740 3.112 2.474 3.600 . 0 0 "[ . 1 . 2]" 1
2624 1 109 ARG H 1 109 ARG QD . . 4.350 3.710 3.150 4.244 . 0 0 "[ . 1 . 2]" 1
2625 1 109 ARG H 1 109 ARG QG . . 3.390 2.166 1.893 2.596 . 0 0 "[ . 1 . 2]" 1
2626 1 109 ARG H 1 110 PRO HD2 . . 5.040 4.753 4.725 4.774 . 0 0 "[ . 1 . 2]" 1
2627 1 109 ARG H 1 110 PRO QD . . 4.410 4.332 4.309 4.349 . 0 0 "[ . 1 . 2]" 1
2628 1 109 ARG H 1 110 PRO HD3 . . 5.040 4.992 4.947 5.017 . 0 0 "[ . 1 . 2]" 1
2629 1 109 ARG HA 1 109 ARG QG . . 3.700 2.896 2.337 3.424 . 0 0 "[ . 1 . 2]" 1
2630 1 109 ARG HA 1 110 PRO QD . . 3.150 2.075 2.054 2.112 . 0 0 "[ . 1 . 2]" 1
2631 1 109 ARG HA 1 110 PRO HG2 . . 4.550 4.492 4.461 4.545 . 0 0 "[ . 1 . 2]" 1
2632 1 109 ARG HA 1 110 PRO HG3 . . 4.600 4.456 4.435 4.495 . 0 0 "[ . 1 . 2]" 1
2633 1 109 ARG QB 1 110 PRO QD . . 3.550 2.041 1.978 2.241 . 0 0 "[ . 1 . 2]" 1
2634 1 110 PRO HB2 1 111 TYR H . . 4.000 3.550 3.201 3.722 . 0 0 "[ . 1 . 2]" 1
2635 1 110 PRO HB2 1 112 VAL MG2 . . 4.010 3.680 3.553 3.834 . 0 0 "[ . 1 . 2]" 1
2636 1 110 PRO HB3 1 111 TYR H . . 4.280 4.014 3.786 4.132 . 0 0 "[ . 1 . 2]" 1
2637 1 110 PRO HB3 1 112 VAL MG2 . . 5.280 5.070 4.929 5.232 . 0 0 "[ . 1 . 2]" 1
2638 1 111 TYR H 1 111 TYR QB . . 3.380 2.487 2.415 2.604 . 0 0 "[ . 1 . 2]" 1
2639 1 111 TYR H 1 111 TYR QD . . 4.480 4.310 4.250 4.361 . 0 0 "[ . 1 . 2]" 1
2640 1 111 TYR H 1 112 VAL H . . 4.350 4.279 4.137 4.369 0.019 14 0 "[ . 1 . 2]" 1
2641 1 111 TYR QB 1 112 VAL H . . 4.070 3.828 3.760 3.877 . 0 0 "[ . 1 . 2]" 1
2642 1 111 TYR QD 1 112 VAL H . . 4.160 3.736 3.562 3.872 . 0 0 "[ . 1 . 2]" 1
2643 1 111 TYR QD 1 113 VAL H . . 4.480 3.425 3.085 3.629 . 0 0 "[ . 1 . 2]" 1
2644 1 111 TYR QD 1 113 VAL HA . . 4.200 3.514 3.307 3.734 . 0 0 "[ . 1 . 2]" 1
2645 1 111 TYR QD 1 113 VAL HB . . 4.830 4.419 4.271 4.544 . 0 0 "[ . 1 . 2]" 1
2646 1 111 TYR QD 1 113 VAL MG1 . . 4.730 4.650 4.562 4.731 0.001 10 0 "[ . 1 . 2]" 1
2647 1 111 TYR QD 1 113 VAL MG2 . . 3.400 2.143 1.997 2.307 . 0 0 "[ . 1 . 2]" 1
2648 1 111 TYR QE 1 112 VAL H . . 5.130 4.767 4.577 4.934 . 0 0 "[ . 1 . 2]" 1
2649 1 111 TYR QE 1 113 VAL HA . . 3.280 2.531 2.240 2.656 . 0 0 "[ . 1 . 2]" 1
2650 1 111 TYR QE 1 113 VAL MG1 . . 3.780 3.735 3.571 3.786 0.006 17 0 "[ . 1 . 2]" 1
2651 1 111 TYR QE 1 113 VAL MG2 . . 3.420 2.009 1.920 2.146 . 0 0 "[ . 1 . 2]" 1
2652 1 111 TYR QE 1 114 SER H . . 4.230 4.108 3.803 4.235 0.005 14 0 "[ . 1 . 2]" 1
2653 1 112 VAL H 1 112 VAL HB . . 2.960 2.558 2.507 2.621 . 0 0 "[ . 1 . 2]" 1
2654 1 112 VAL H 1 112 VAL MG1 . . 3.860 3.804 3.788 3.827 . 0 0 "[ . 1 . 2]" 1
2655 1 112 VAL H 1 112 VAL MG2 . . 3.090 2.310 2.170 2.473 . 0 0 "[ . 1 . 2]" 1
2656 1 112 VAL H 1 113 VAL H . . 4.370 4.240 4.180 4.302 . 0 0 "[ . 1 . 2]" 1
2657 1 112 VAL HA 1 112 VAL MG1 . . 2.930 2.421 2.382 2.457 . 0 0 "[ . 1 . 2]" 1
2658 1 112 VAL HA 1 112 VAL MG2 . . 3.060 2.438 2.380 2.499 . 0 0 "[ . 1 . 2]" 1
2659 1 112 VAL HA 1 113 VAL H . . 2.850 2.173 2.160 2.184 . 0 0 "[ . 1 . 2]" 1
2660 1 112 VAL HA 1 113 VAL HA . . 5.030 4.442 4.427 4.454 . 0 0 "[ . 1 . 2]" 1
2661 1 112 VAL HA 1 113 VAL HB . . 4.540 4.458 4.438 4.491 . 0 0 "[ . 1 . 2]" 1
2662 1 112 VAL HA 1 113 VAL MG2 . . 4.250 4.195 4.118 4.243 . 0 0 "[ . 1 . 2]" 1
2663 1 112 VAL HB 1 113 VAL H . . 4.450 4.381 4.350 4.412 . 0 0 "[ . 1 . 2]" 1
2664 1 112 VAL HB 1 114 SER QB . . 4.510 4.360 4.103 4.495 . 0 0 "[ . 1 . 2]" 1
2665 1 112 VAL MG1 1 113 VAL H . . 3.360 3.106 3.012 3.175 . 0 0 "[ . 1 . 2]" 1
2666 1 112 VAL MG1 1 113 VAL HB . . 4.600 4.527 4.460 4.587 . 0 0 "[ . 1 . 2]" 1
2667 1 112 VAL MG1 1 113 VAL MG2 . . 4.910 4.751 4.706 4.812 . 0 0 "[ . 1 . 2]" 1
2668 1 112 VAL MG1 1 114 SER H . . 4.390 4.104 3.914 4.265 . 0 0 "[ . 1 . 2]" 1
2669 1 112 VAL MG1 1 114 SER HA . . 4.150 3.955 3.699 4.154 0.004 19 0 "[ . 1 . 2]" 1
2670 1 112 VAL MG1 1 114 SER QB . . 3.660 3.339 2.935 3.524 . 0 0 "[ . 1 . 2]" 1
2671 1 112 VAL MG2 1 113 VAL H . . 4.410 4.232 4.187 4.288 . 0 0 "[ . 1 . 2]" 1
2672 1 112 VAL MG2 1 114 SER QB . . 5.500 5.378 5.166 5.496 . 0 0 "[ . 1 . 2]" 1
2673 1 113 VAL H 1 113 VAL HB . . 3.220 2.334 2.319 2.359 . 0 0 "[ . 1 . 2]" 1
2674 1 113 VAL H 1 113 VAL MG1 . . 3.770 3.705 3.695 3.718 . 0 0 "[ . 1 . 2]" 1
2675 1 113 VAL H 1 113 VAL MG2 . . 3.070 2.606 2.515 2.698 . 0 0 "[ . 1 . 2]" 1
2676 1 113 VAL H 1 114 SER H . . 4.490 4.356 4.300 4.418 . 0 0 "[ . 1 . 2]" 1
2677 1 113 VAL HA 1 113 VAL MG1 . . 3.310 2.533 2.514 2.554 . 0 0 "[ . 1 . 2]" 1
2678 1 113 VAL HA 1 113 VAL MG2 . . 3.190 2.170 2.127 2.233 . 0 0 "[ . 1 . 2]" 1
2679 1 113 VAL HA 1 114 SER H . . 2.830 2.160 2.145 2.179 . 0 0 "[ . 1 . 2]" 1
2680 1 113 VAL HA 1 114 SER HA . . 5.390 4.405 4.392 4.428 . 0 0 "[ . 1 . 2]" 1
2681 1 113 VAL HB 1 114 SER H . . 4.780 4.480 4.441 4.512 . 0 0 "[ . 1 . 2]" 1
2682 1 113 VAL MG1 1 114 SER H . . 3.320 3.124 3.018 3.208 . 0 0 "[ . 1 . 2]" 1
2683 1 113 VAL MG1 1 114 SER HA . . 3.880 3.603 3.450 3.800 . 0 0 "[ . 1 . 2]" 1
2684 1 113 VAL MG1 1 114 SER QB . . 4.500 4.476 4.423 4.514 0.014 17 0 "[ . 1 . 2]" 1
2685 1 113 VAL MG1 1 115 GLY QA . . 4.530 3.734 2.923 4.445 . 0 0 "[ . 1 . 2]" 1
2686 1 113 VAL MG2 1 114 SER H . . 4.030 3.983 3.917 4.045 0.015 10 0 "[ . 1 . 2]" 1
2687 1 113 VAL MG2 1 114 SER QB . . 5.500 5.461 5.434 5.480 . 0 0 "[ . 1 . 2]" 1
2688 1 114 SER H 1 114 SER QB . . 3.200 2.431 2.342 2.540 . 0 0 "[ . 1 . 2]" 1
2689 1 116 SER QB 1 117 GLY H . . 4.410 3.268 2.120 4.060 . 0 0 "[ . 1 . 2]" 1
2690 1 117 GLY QA 1 118 PRO QD . . 2.530 1.967 1.878 2.035 . 0 0 "[ . 1 . 2]" 1
2691 1 117 GLY QA 1 118 PRO QG . . 4.500 3.678 3.650 3.700 . 0 0 "[ . 1 . 2]" 1
2692 1 117 GLY HA2 1 118 PRO HD2 . . 3.370 2.921 2.544 3.226 . 0 0 "[ . 1 . 2]" 1
2693 1 117 GLY HA2 1 118 PRO HD3 . . 3.370 2.660 2.365 2.945 . 0 0 "[ . 1 . 2]" 1
2694 1 117 GLY HA3 1 118 PRO HD2 . . 3.370 2.167 1.957 2.482 . 0 0 "[ . 1 . 2]" 1
2695 1 117 GLY HA3 1 118 PRO HD3 . . 3.370 3.000 2.692 3.368 . 0 0 "[ . 1 . 2]" 1
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