NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
419284 |
2e9j   |
10143 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2e9j
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 1901
_Distance_constraint_stats_list.Viol_count 497
_Distance_constraint_stats_list.Viol_total 99.217
_Distance_constraint_stats_list.Viol_max 0.169
_Distance_constraint_stats_list.Viol_rms 0.0022
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0100
_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 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 PRO 0.044 0.029 1 0 "[ . 1 . 2]"
1 11 PHE 0.044 0.029 1 0 "[ . 1 . 2]"
1 12 LYS 0.010 0.010 16 0 "[ . 1 . 2]"
1 13 VAL 0.016 0.010 16 0 "[ . 1 . 2]"
1 14 LYS 0.213 0.048 17 0 "[ . 1 . 2]"
1 15 VAL 0.336 0.056 17 0 "[ . 1 . 2]"
1 16 LEU 0.083 0.052 17 0 "[ . 1 . 2]"
1 17 PRO 0.019 0.016 3 0 "[ . 1 . 2]"
1 18 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 TYR 0.066 0.016 3 0 "[ . 1 . 2]"
1 20 ASP 0.006 0.006 17 0 "[ . 1 . 2]"
1 21 ALA 0.020 0.008 20 0 "[ . 1 . 2]"
1 22 SER 0.071 0.028 20 0 "[ . 1 . 2]"
1 23 LYS 0.338 0.051 18 0 "[ . 1 . 2]"
1 24 VAL 0.113 0.033 10 0 "[ . 1 . 2]"
1 25 THR 0.065 0.015 10 0 "[ . 1 . 2]"
1 26 ALA 0.020 0.009 20 0 "[ . 1 . 2]"
1 27 SER 0.024 0.011 3 0 "[ . 1 . 2]"
1 28 GLY 0.020 0.009 16 0 "[ . 1 . 2]"
1 29 PRO 0.029 0.009 16 0 "[ . 1 . 2]"
1 30 GLY 0.006 0.002 19 0 "[ . 1 . 2]"
1 31 LEU 0.559 0.038 14 0 "[ . 1 . 2]"
1 32 SER 0.570 0.038 14 0 "[ . 1 . 2]"
1 33 SER 0.021 0.013 19 0 "[ . 1 . 2]"
1 34 TYR 0.018 0.007 9 0 "[ . 1 . 2]"
1 35 GLY 0.014 0.006 9 0 "[ . 1 . 2]"
1 36 VAL 0.025 0.014 3 0 "[ . 1 . 2]"
1 37 PRO 0.019 0.007 17 0 "[ . 1 . 2]"
1 38 ALA 0.025 0.007 17 0 "[ . 1 . 2]"
1 39 SER 0.042 0.016 19 0 "[ . 1 . 2]"
1 40 LEU 0.024 0.013 9 0 "[ . 1 . 2]"
1 41 PRO 0.233 0.028 9 0 "[ . 1 . 2]"
1 42 VAL 0.229 0.028 9 0 "[ . 1 . 2]"
1 43 ASP 0.036 0.014 9 0 "[ . 1 . 2]"
1 44 PHE 0.044 0.009 14 0 "[ . 1 . 2]"
1 45 ALA 0.009 0.004 6 0 "[ . 1 . 2]"
1 46 ILE 0.070 0.011 3 0 "[ . 1 . 2]"
1 47 ASP 0.067 0.019 3 0 "[ . 1 . 2]"
1 48 ALA 0.086 0.020 16 0 "[ . 1 . 2]"
1 49 ARG 0.068 0.026 9 0 "[ . 1 . 2]"
1 50 ASP 0.300 0.050 18 0 "[ . 1 . 2]"
1 51 ALA 0.219 0.050 2 0 "[ . 1 . 2]"
1 52 GLY 0.023 0.014 16 0 "[ . 1 . 2]"
1 53 GLU 0.123 0.047 12 0 "[ . 1 . 2]"
1 54 GLY 0.011 0.007 3 0 "[ . 1 . 2]"
1 55 LEU 0.104 0.028 18 0 "[ . 1 . 2]"
1 56 LEU 0.177 0.028 10 0 "[ . 1 . 2]"
1 57 ALA 0.012 0.008 3 0 "[ . 1 . 2]"
1 58 VAL 0.001 0.001 18 0 "[ . 1 . 2]"
1 59 GLN 0.024 0.011 13 0 "[ . 1 . 2]"
1 60 ILE 0.074 0.013 19 0 "[ . 1 . 2]"
1 61 THR 0.017 0.008 19 0 "[ . 1 . 2]"
1 62 ASP 0.005 0.005 15 0 "[ . 1 . 2]"
1 63 GLN 0.004 0.004 6 0 "[ . 1 . 2]"
1 64 GLU 0.052 0.019 8 0 "[ . 1 . 2]"
1 65 GLY 0.023 0.009 3 0 "[ . 1 . 2]"
1 66 LYS 0.038 0.019 8 0 "[ . 1 . 2]"
1 67 PRO 0.000 0.000 12 0 "[ . 1 . 2]"
1 68 LYS 0.057 0.025 7 0 "[ . 1 . 2]"
1 69 ARG 0.011 0.008 9 0 "[ . 1 . 2]"
1 70 ALA 0.010 0.003 10 0 "[ . 1 . 2]"
1 71 ILE 0.006 0.003 15 0 "[ . 1 . 2]"
1 72 VAL 0.002 0.001 11 0 "[ . 1 . 2]"
1 73 HIS 0.003 0.003 9 0 "[ . 1 . 2]"
1 74 ASP 0.003 0.003 9 0 "[ . 1 . 2]"
1 75 ASN 0.004 0.003 18 0 "[ . 1 . 2]"
1 76 LYS 0.211 0.169 18 0 "[ . 1 . 2]"
1 77 ASP 0.006 0.002 2 0 "[ . 1 . 2]"
1 78 GLY 0.004 0.002 16 0 "[ . 1 . 2]"
1 79 THR 0.011 0.005 12 0 "[ . 1 . 2]"
1 80 TYR 0.026 0.010 3 0 "[ . 1 . 2]"
1 81 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 VAL 0.017 0.006 3 0 "[ . 1 . 2]"
1 83 THR 0.006 0.003 15 0 "[ . 1 . 2]"
1 84 TYR 0.029 0.011 3 0 "[ . 1 . 2]"
1 85 ILE 0.046 0.009 6 0 "[ . 1 . 2]"
1 86 PRO 0.045 0.016 19 0 "[ . 1 . 2]"
1 87 ASP 0.027 0.012 15 0 "[ . 1 . 2]"
1 88 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 THR 0.067 0.066 1 0 "[ . 1 . 2]"
1 90 GLY 0.067 0.066 1 0 "[ . 1 . 2]"
1 91 ARG 0.254 0.099 8 0 "[ . 1 . 2]"
1 92 TYR 0.374 0.066 19 0 "[ . 1 . 2]"
1 93 MET 0.066 0.016 17 0 "[ . 1 . 2]"
1 94 ILE 0.066 0.012 9 0 "[ . 1 . 2]"
1 95 GLY 0.019 0.010 3 0 "[ . 1 . 2]"
1 96 VAL 0.015 0.010 3 0 "[ . 1 . 2]"
1 97 THR 0.024 0.007 17 0 "[ . 1 . 2]"
1 98 TYR 0.134 0.028 10 0 "[ . 1 . 2]"
1 99 GLY 0.019 0.007 3 0 "[ . 1 . 2]"
1 100 GLY 0.013 0.005 20 0 "[ . 1 . 2]"
1 101 ASP 0.022 0.008 17 0 "[ . 1 . 2]"
1 102 ASP 0.091 0.029 17 0 "[ . 1 . 2]"
1 103 ILE 0.085 0.012 20 0 "[ . 1 . 2]"
1 104 PRO 0.071 0.028 20 0 "[ . 1 . 2]"
1 105 LEU 0.019 0.018 20 0 "[ . 1 . 2]"
1 106 SER 0.113 0.029 17 0 "[ . 1 . 2]"
1 107 PRO 0.018 0.010 3 0 "[ . 1 . 2]"
1 108 TYR 0.095 0.023 17 0 "[ . 1 . 2]"
1 109 ARG 0.502 0.139 20 0 "[ . 1 . 2]"
1 110 ILE 0.176 0.030 12 0 "[ . 1 . 2]"
1 111 ARG 0.451 0.072 19 0 "[ . 1 . 2]"
1 112 ALA 0.022 0.014 3 0 "[ . 1 . 2]"
1 113 THR 0.004 0.002 4 0 "[ . 1 . 2]"
1 114 GLN 0.004 0.004 6 0 "[ . 1 . 2]"
1 115 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 SER 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 SER HA 1 10 PRO HD2 . . 3.260 2.128 1.925 2.476 . 0 0 "[ . 1 . 2]" 1
2 1 9 SER HA 1 10 PRO HD3 . . 3.260 2.484 2.252 3.201 . 0 0 "[ . 1 . 2]" 1
3 1 10 PRO HA 1 11 PHE H . . 3.470 2.574 2.151 3.499 0.029 1 0 "[ . 1 . 2]" 1
4 1 11 PHE H 1 11 PHE QB . . 3.590 2.821 2.298 3.307 . 0 0 "[ . 1 . 2]" 1
5 1 11 PHE HA 1 11 PHE QD . . 4.440 3.081 2.241 3.720 . 0 0 "[ . 1 . 2]" 1
6 1 12 LYS H 1 12 LYS QD . . 5.270 3.553 1.900 5.263 . 0 0 "[ . 1 . 2]" 1
7 1 12 LYS HA 1 12 LYS QD . . 4.030 3.235 2.098 4.030 . 0 0 "[ . 1 . 2]" 1
8 1 12 LYS HA 1 12 LYS QG . . 3.760 2.704 2.134 3.436 . 0 0 "[ . 1 . 2]" 1
9 1 12 LYS HA 1 13 VAL H . . 2.940 2.444 2.145 2.829 . 0 0 "[ . 1 . 2]" 1
10 1 12 LYS HA 1 13 VAL HA . . 4.920 4.360 4.297 4.537 . 0 0 "[ . 1 . 2]" 1
11 1 12 LYS QB 1 13 VAL H . . 4.030 3.102 2.062 4.040 0.010 16 0 "[ . 1 . 2]" 1
12 1 12 LYS HB2 1 13 VAL H . . 4.790 3.764 2.250 4.652 . 0 0 "[ . 1 . 2]" 1
13 1 12 LYS HB3 1 13 VAL H . . 4.790 3.620 2.089 4.632 . 0 0 "[ . 1 . 2]" 1
14 1 12 LYS QD 1 13 VAL H . . 5.240 4.407 3.171 5.221 . 0 0 "[ . 1 . 2]" 1
15 1 13 VAL H 1 13 VAL HB . . 3.700 3.073 2.457 3.706 0.006 11 0 "[ . 1 . 2]" 1
16 1 13 VAL H 1 13 VAL QG . . 3.640 2.296 1.825 3.027 . 0 0 "[ . 1 . 2]" 1
17 1 13 VAL H 1 14 LYS H . . 4.780 4.437 3.988 4.637 . 0 0 "[ . 1 . 2]" 1
18 1 13 VAL HA 1 14 LYS H . . 2.920 2.223 2.140 2.508 . 0 0 "[ . 1 . 2]" 1
19 1 13 VAL HA 1 14 LYS HA . . 5.280 4.407 4.353 4.598 . 0 0 "[ . 1 . 2]" 1
20 1 13 VAL HB 1 14 LYS H . . 4.320 3.674 2.165 4.302 . 0 0 "[ . 1 . 2]" 1
21 1 13 VAL QG 1 14 LYS H . . 4.130 2.641 1.951 3.615 . 0 0 "[ . 1 . 2]" 1
22 1 13 VAL MG1 1 14 LYS H . . 4.900 3.036 1.956 4.028 . 0 0 "[ . 1 . 2]" 1
23 1 13 VAL MG2 1 14 LYS H . . 4.900 3.623 2.080 4.210 . 0 0 "[ . 1 . 2]" 1
24 1 14 LYS H 1 14 LYS HB2 . . 3.670 2.684 2.346 3.591 . 0 0 "[ . 1 . 2]" 1
25 1 14 LYS H 1 14 LYS QB . . 3.200 2.518 2.315 2.931 . 0 0 "[ . 1 . 2]" 1
26 1 14 LYS H 1 14 LYS HB3 . . 3.670 3.396 2.684 3.683 0.013 20 0 "[ . 1 . 2]" 1
27 1 14 LYS H 1 15 VAL H . . 4.950 3.947 2.607 4.437 . 0 0 "[ . 1 . 2]" 1
28 1 14 LYS H 1 15 VAL QG . . 4.810 3.618 2.765 4.581 . 0 0 "[ . 1 . 2]" 1
29 1 14 LYS HA 1 15 VAL H . . 2.780 2.311 2.142 2.797 0.017 17 0 "[ . 1 . 2]" 1
30 1 14 LYS HA 1 15 VAL MG1 . . 4.570 3.989 3.481 4.570 . 1 0 "[ . 1 . 2]" 1
31 1 14 LYS HA 1 15 VAL QG . . 3.840 3.522 3.233 3.887 0.047 17 0 "[ . 1 . 2]" 1
32 1 14 LYS HA 1 15 VAL MG2 . . 4.570 3.937 3.598 4.522 . 0 0 "[ . 1 . 2]" 1
33 1 14 LYS QB 1 15 VAL H . . 3.860 3.627 2.972 3.902 0.042 10 0 "[ . 1 . 2]" 1
34 1 14 LYS HB2 1 15 VAL H . . 4.490 4.360 3.569 4.538 0.048 17 0 "[ . 1 . 2]" 1
35 1 14 LYS HB3 1 15 VAL H . . 4.490 3.933 3.038 4.343 . 0 0 "[ . 1 . 2]" 1
36 1 15 VAL H 1 15 VAL HB . . 3.810 3.789 3.635 3.866 0.056 17 0 "[ . 1 . 2]" 1
37 1 15 VAL H 1 15 VAL MG1 . . 3.860 2.891 2.413 3.111 . 0 0 "[ . 1 . 2]" 1
38 1 15 VAL H 1 15 VAL QG . . 3.350 2.020 1.846 2.215 . 0 0 "[ . 1 . 2]" 1
39 1 15 VAL H 1 15 VAL MG2 . . 3.860 2.066 1.889 2.281 . 0 0 "[ . 1 . 2]" 1
40 1 15 VAL H 1 16 LEU H . . 4.610 4.448 4.280 4.565 . 0 0 "[ . 1 . 2]" 1
41 1 15 VAL HA 1 15 VAL MG1 . . 3.380 2.330 2.212 2.423 . 0 0 "[ . 1 . 2]" 1
42 1 15 VAL HA 1 15 VAL QG . . 2.900 2.275 2.174 2.354 . 0 0 "[ . 1 . 2]" 1
43 1 15 VAL HA 1 15 VAL MG2 . . 3.380 3.195 3.185 3.202 . 0 0 "[ . 1 . 2]" 1
44 1 15 VAL HA 1 16 LEU H . . 2.640 2.379 2.150 2.604 . 0 0 "[ . 1 . 2]" 1
45 1 15 VAL HA 1 16 LEU HA . . 4.640 4.319 4.293 4.393 . 0 0 "[ . 1 . 2]" 1
46 1 15 VAL HB 1 16 LEU H . . 4.180 2.492 1.980 3.279 . 0 0 "[ . 1 . 2]" 1
47 1 15 VAL QG 1 16 LEU H . . 4.110 3.186 2.926 3.543 . 0 0 "[ . 1 . 2]" 1
48 1 15 VAL MG1 1 16 LEU H . . 5.060 3.692 3.483 3.928 . 0 0 "[ . 1 . 2]" 1
49 1 15 VAL MG2 1 16 LEU H . . 5.060 3.493 3.144 4.030 . 0 0 "[ . 1 . 2]" 1
50 1 16 LEU H 1 16 LEU HB2 . . 3.670 3.075 2.525 3.702 0.032 11 0 "[ . 1 . 2]" 1
51 1 16 LEU H 1 16 LEU QB . . 2.920 2.548 2.293 2.842 . 0 0 "[ . 1 . 2]" 1
52 1 16 LEU H 1 16 LEU HB3 . . 3.670 3.131 2.321 3.667 . 0 0 "[ . 1 . 2]" 1
53 1 16 LEU H 1 16 LEU QD . . 4.140 2.349 1.786 3.022 . 0 0 "[ . 1 . 2]" 1
54 1 16 LEU H 1 16 LEU HG . . 3.290 2.545 1.913 3.342 0.052 17 0 "[ . 1 . 2]" 1
55 1 16 LEU H 1 17 PRO HD2 . . 5.070 4.784 4.725 4.840 . 0 0 "[ . 1 . 2]" 1
56 1 16 LEU H 1 17 PRO HD3 . . 5.110 4.922 4.854 4.968 . 0 0 "[ . 1 . 2]" 1
57 1 16 LEU HA 1 16 LEU MD1 . . 4.370 3.802 3.424 4.085 . 0 0 "[ . 1 . 2]" 1
58 1 16 LEU HA 1 16 LEU QD . . 3.530 2.976 2.155 3.406 . 0 0 "[ . 1 . 2]" 1
59 1 16 LEU HA 1 16 LEU MD2 . . 4.370 3.266 2.165 4.077 . 0 0 "[ . 1 . 2]" 1
60 1 16 LEU HA 1 16 LEU HG . . 4.210 3.199 2.521 3.729 . 0 0 "[ . 1 . 2]" 1
61 1 16 LEU HA 1 17 PRO HD2 . . 2.950 2.242 2.174 2.291 . 0 0 "[ . 1 . 2]" 1
62 1 16 LEU HA 1 17 PRO HD3 . . 2.810 2.258 2.253 2.267 . 0 0 "[ . 1 . 2]" 1
63 1 16 LEU HA 1 17 PRO QG . . 3.970 3.908 3.870 3.936 . 0 0 "[ . 1 . 2]" 1
64 1 16 LEU QB 1 16 LEU QD . . 2.590 1.835 1.735 1.919 . 0 0 "[ . 1 . 2]" 1
65 1 16 LEU QB 1 17 PRO HD2 . . 3.200 2.283 2.187 2.424 . 0 0 "[ . 1 . 2]" 1
66 1 16 LEU QB 1 17 PRO HD3 . . 3.790 3.563 3.513 3.650 . 0 0 "[ . 1 . 2]" 1
67 1 16 LEU HB2 1 16 LEU MD1 . . 3.460 2.121 1.997 2.241 . 0 0 "[ . 1 . 2]" 1
68 1 16 LEU HB2 1 16 LEU MD2 . . 3.460 2.953 2.614 3.172 . 0 0 "[ . 1 . 2]" 1
69 1 16 LEU HB2 1 17 PRO HD2 . . 3.840 3.120 2.308 3.774 . 0 0 "[ . 1 . 2]" 1
70 1 16 LEU HB3 1 16 LEU MD1 . . 3.460 2.787 2.486 3.137 . 0 0 "[ . 1 . 2]" 1
71 1 16 LEU HB3 1 16 LEU MD2 . . 3.460 2.137 1.964 2.298 . 0 0 "[ . 1 . 2]" 1
72 1 16 LEU HB3 1 17 PRO HD2 . . 3.840 2.851 2.203 3.695 . 0 0 "[ . 1 . 2]" 1
73 1 16 LEU QD 1 17 PRO HD2 . . 4.580 3.299 2.588 3.943 . 0 0 "[ . 1 . 2]" 1
74 1 17 PRO HA 1 18 THR H . . 2.880 2.315 2.238 2.482 . 0 0 "[ . 1 . 2]" 1
75 1 17 PRO HA 1 19 TYR H . . 4.110 4.055 3.951 4.126 0.016 3 0 "[ . 1 . 2]" 1
76 1 17 PRO HA 1 19 TYR QE . . 5.140 4.762 4.286 5.023 . 0 0 "[ . 1 . 2]" 1
77 1 17 PRO HB2 1 18 THR H . . 4.000 2.851 2.415 3.082 . 0 0 "[ . 1 . 2]" 1
78 1 17 PRO HB2 1 19 TYR H . . 3.580 2.602 2.360 2.729 . 0 0 "[ . 1 . 2]" 1
79 1 17 PRO HB2 1 19 TYR QD . . 3.960 2.141 2.000 2.417 . 0 0 "[ . 1 . 2]" 1
80 1 17 PRO HB2 1 19 TYR QE . . 3.970 2.724 2.484 2.925 . 0 0 "[ . 1 . 2]" 1
81 1 17 PRO HB3 1 18 THR H . . 3.980 3.582 3.356 3.713 . 0 0 "[ . 1 . 2]" 1
82 1 17 PRO HB3 1 19 TYR H . . 4.370 4.125 3.935 4.269 . 0 0 "[ . 1 . 2]" 1
83 1 17 PRO HB3 1 19 TYR QD . . 5.240 3.078 2.892 3.434 . 0 0 "[ . 1 . 2]" 1
84 1 17 PRO HB3 1 19 TYR QE . . 5.400 2.648 2.350 2.881 . 0 0 "[ . 1 . 2]" 1
85 1 17 PRO QG 1 18 THR H . . 4.480 4.315 4.026 4.452 . 0 0 "[ . 1 . 2]" 1
86 1 17 PRO QG 1 19 TYR H . . 4.190 4.126 3.875 4.193 0.003 13 0 "[ . 1 . 2]" 1
87 1 17 PRO QG 1 19 TYR QD . . 4.910 3.583 3.363 3.880 . 0 0 "[ . 1 . 2]" 1
88 1 17 PRO QG 1 19 TYR QE . . 5.140 2.589 2.225 3.114 . 0 0 "[ . 1 . 2]" 1
89 1 18 THR H 1 18 THR HB . . 3.140 2.570 2.505 2.674 . 0 0 "[ . 1 . 2]" 1
90 1 18 THR H 1 18 THR MG . . 3.940 3.795 3.769 3.872 . 0 0 "[ . 1 . 2]" 1
91 1 18 THR H 1 19 TYR H . . 3.240 2.338 1.914 2.619 . 0 0 "[ . 1 . 2]" 1
92 1 18 THR H 1 19 TYR QD . . 3.860 3.639 3.294 3.835 . 0 0 "[ . 1 . 2]" 1
93 1 18 THR HA 1 18 THR MG . . 3.250 2.367 2.255 2.438 . 0 0 "[ . 1 . 2]" 1
94 1 18 THR HB 1 19 TYR H . . 3.510 2.947 2.721 3.232 . 0 0 "[ . 1 . 2]" 1
95 1 18 THR MG 1 19 TYR H . . 3.960 3.774 3.576 3.954 . 0 0 "[ . 1 . 2]" 1
96 1 19 TYR H 1 19 TYR HB2 . . 3.900 3.569 3.536 3.625 . 0 0 "[ . 1 . 2]" 1
97 1 19 TYR H 1 19 TYR HB3 . . 3.750 2.349 2.261 2.503 . 0 0 "[ . 1 . 2]" 1
98 1 19 TYR H 1 19 TYR QD . . 3.110 2.444 1.968 2.664 . 0 0 "[ . 1 . 2]" 1
99 1 19 TYR H 1 20 ASP H . . 4.660 4.616 4.550 4.638 . 0 0 "[ . 1 . 2]" 1
100 1 19 TYR H 1 53 GLU H . . 4.620 4.286 3.559 4.624 0.004 1 0 "[ . 1 . 2]" 1
101 1 19 TYR HA 1 19 TYR QD . . 4.160 3.676 3.636 3.733 . 0 0 "[ . 1 . 2]" 1
102 1 19 TYR HA 1 20 ASP H . . 3.160 2.348 2.242 2.549 . 0 0 "[ . 1 . 2]" 1
103 1 19 TYR HA 1 52 GLY H . . 4.490 4.172 3.619 4.420 . 0 0 "[ . 1 . 2]" 1
104 1 19 TYR HA 1 52 GLY HA2 . . 4.300 4.122 3.708 4.298 . 0 0 "[ . 1 . 2]" 1
105 1 19 TYR HA 1 52 GLY QA . . 3.440 2.408 1.989 2.587 . 0 0 "[ . 1 . 2]" 1
106 1 19 TYR HA 1 52 GLY HA3 . . 4.300 2.424 1.997 2.608 . 0 0 "[ . 1 . 2]" 1
107 1 19 TYR HA 1 53 GLU H . . 3.650 3.337 2.410 3.655 0.005 8 0 "[ . 1 . 2]" 1
108 1 19 TYR HA 1 98 TYR QE . . 4.720 4.049 3.292 4.443 . 0 0 "[ . 1 . 2]" 1
109 1 19 TYR HB2 1 20 ASP H . . 3.490 2.691 2.279 2.945 . 0 0 "[ . 1 . 2]" 1
110 1 19 TYR HB2 1 53 GLU H . . 4.390 3.589 3.243 3.986 . 0 0 "[ . 1 . 2]" 1
111 1 19 TYR HB2 1 54 GLY H . . 5.060 4.443 3.739 4.852 . 0 0 "[ . 1 . 2]" 1
112 1 19 TYR HB2 1 54 GLY QA . . 4.810 3.233 2.620 3.592 . 0 0 "[ . 1 . 2]" 1
113 1 19 TYR HB2 1 98 TYR QD . . 4.150 3.122 2.961 3.279 . 0 0 "[ . 1 . 2]" 1
114 1 19 TYR HB2 1 98 TYR QE . . 3.760 2.442 1.994 2.739 . 0 0 "[ . 1 . 2]" 1
115 1 19 TYR HB3 1 20 ASP H . . 4.160 4.009 3.743 4.159 . 0 0 "[ . 1 . 2]" 1
116 1 19 TYR HB3 1 53 GLU H . . 4.050 3.063 2.771 3.241 . 0 0 "[ . 1 . 2]" 1
117 1 19 TYR HB3 1 54 GLY H . . 5.260 4.867 4.264 5.209 . 0 0 "[ . 1 . 2]" 1
118 1 19 TYR HB3 1 54 GLY QA . . 4.680 3.549 2.988 3.819 . 0 0 "[ . 1 . 2]" 1
119 1 19 TYR HB3 1 98 TYR QD . . 4.750 4.710 4.520 4.756 0.006 17 0 "[ . 1 . 2]" 1
120 1 19 TYR HB3 1 98 TYR QE . . 4.180 3.807 3.477 4.180 . 0 0 "[ . 1 . 2]" 1
121 1 19 TYR QD 1 20 ASP H . . 4.300 2.872 2.366 3.217 . 0 0 "[ . 1 . 2]" 1
122 1 19 TYR QD 1 20 ASP HA . . 4.000 3.137 2.743 3.489 . 0 0 "[ . 1 . 2]" 1
123 1 19 TYR QD 1 21 ALA H . . 3.960 3.360 3.056 3.802 . 0 0 "[ . 1 . 2]" 1
124 1 19 TYR QD 1 53 GLU H . . 5.020 4.908 4.648 5.023 0.003 18 0 "[ . 1 . 2]" 1
125 1 19 TYR QD 1 54 GLY QA . . 4.730 3.653 3.353 4.004 . 0 0 "[ . 1 . 2]" 1
126 1 19 TYR QD 1 98 TYR QD . . 4.060 2.370 2.006 2.698 . 0 0 "[ . 1 . 2]" 1
127 1 19 TYR QD 1 98 TYR QE . . 4.340 3.662 3.102 4.068 . 0 0 "[ . 1 . 2]" 1
128 1 19 TYR QD 1 99 GLY H . . 5.500 5.105 4.612 5.371 . 0 0 "[ . 1 . 2]" 1
129 1 19 TYR QD 1 99 GLY HA2 . . 5.040 4.806 4.322 5.042 0.002 1 0 "[ . 1 . 2]" 1
130 1 19 TYR QD 1 99 GLY HA3 . . 4.200 3.431 2.878 3.823 . 0 0 "[ . 1 . 2]" 1
131 1 19 TYR QE 1 20 ASP HA . . 5.390 4.025 3.688 4.426 . 0 0 "[ . 1 . 2]" 1
132 1 19 TYR QE 1 21 ALA H . . 4.280 3.587 3.061 4.162 . 0 0 "[ . 1 . 2]" 1
133 1 19 TYR QE 1 21 ALA MB . . 3.790 3.493 3.144 3.791 0.001 18 0 "[ . 1 . 2]" 1
134 1 19 TYR QE 1 99 GLY H . . 5.500 4.856 4.487 5.208 . 0 0 "[ . 1 . 2]" 1
135 1 19 TYR QE 1 99 GLY HA2 . . 4.380 4.159 3.869 4.383 0.003 16 0 "[ . 1 . 2]" 1
136 1 19 TYR QE 1 99 GLY HA3 . . 4.090 2.682 2.333 3.003 . 0 0 "[ . 1 . 2]" 1
137 1 19 TYR QE 1 101 ASP H . . 4.880 4.535 4.132 4.856 . 0 0 "[ . 1 . 2]" 1
138 1 19 TYR QE 1 101 ASP HB2 . . 3.670 2.900 2.367 3.494 . 0 0 "[ . 1 . 2]" 1
139 1 19 TYR QE 1 101 ASP HB3 . . 4.810 4.285 3.814 4.781 . 0 0 "[ . 1 . 2]" 1
140 1 20 ASP H 1 20 ASP HB2 . . 3.950 2.805 2.707 3.072 . 0 0 "[ . 1 . 2]" 1
141 1 20 ASP H 1 20 ASP QB . . 3.280 2.722 2.645 2.885 . 0 0 "[ . 1 . 2]" 1
142 1 20 ASP H 1 20 ASP HB3 . . 3.950 3.733 3.170 3.873 . 0 0 "[ . 1 . 2]" 1
143 1 20 ASP H 1 21 ALA H . . 4.710 4.017 3.696 4.206 . 0 0 "[ . 1 . 2]" 1
144 1 20 ASP H 1 51 ALA HA . . 4.210 2.530 2.242 3.128 . 0 0 "[ . 1 . 2]" 1
145 1 20 ASP H 1 51 ALA MB . . 3.930 3.329 3.106 3.718 . 0 0 "[ . 1 . 2]" 1
146 1 20 ASP H 1 98 TYR QD . . 4.160 3.594 3.141 3.940 . 0 0 "[ . 1 . 2]" 1
147 1 20 ASP H 1 98 TYR QE . . 4.350 3.681 2.919 4.148 . 0 0 "[ . 1 . 2]" 1
148 1 20 ASP HA 1 21 ALA H . . 2.900 2.149 2.139 2.170 . 0 0 "[ . 1 . 2]" 1
149 1 20 ASP HA 1 21 ALA HA . . 4.450 4.393 4.352 4.434 . 0 0 "[ . 1 . 2]" 1
150 1 20 ASP HA 1 22 SER H . . 4.320 4.024 3.796 4.316 . 0 0 "[ . 1 . 2]" 1
151 1 20 ASP HA 1 23 LYS H . . 4.790 4.433 4.303 4.615 . 0 0 "[ . 1 . 2]" 1
152 1 20 ASP QB 1 21 ALA H . . 4.000 3.446 3.171 3.873 . 0 0 "[ . 1 . 2]" 1
153 1 20 ASP QB 1 22 SER H . . 4.640 3.520 3.289 4.190 . 0 0 "[ . 1 . 2]" 1
154 1 20 ASP QB 1 23 LYS H . . 4.020 2.588 2.425 2.720 . 0 0 "[ . 1 . 2]" 1
155 1 20 ASP QB 1 23 LYS QB . . 3.720 2.435 1.973 2.716 . 0 0 "[ . 1 . 2]" 1
156 1 20 ASP QB 1 23 LYS QG . . 3.590 2.462 2.073 2.795 . 0 0 "[ . 1 . 2]" 1
157 1 20 ASP QB 1 51 ALA HA . . 3.890 2.649 2.205 3.217 . 0 0 "[ . 1 . 2]" 1
158 1 20 ASP HB2 1 22 SER H . . 5.500 5.149 4.918 5.476 . 0 0 "[ . 1 . 2]" 1
159 1 20 ASP HB2 1 23 LYS H . . 4.650 3.820 3.646 4.406 . 0 0 "[ . 1 . 2]" 1
160 1 20 ASP HB2 1 23 LYS HB2 . . 4.930 2.811 2.472 3.543 . 0 0 "[ . 1 . 2]" 1
161 1 20 ASP HB2 1 23 LYS HB3 . . 4.930 4.253 3.720 4.936 0.006 17 0 "[ . 1 . 2]" 1
162 1 20 ASP HB2 1 23 LYS HG2 . . 4.630 3.625 3.044 3.998 . 0 0 "[ . 1 . 2]" 1
163 1 20 ASP HB2 1 23 LYS HG3 . . 4.630 3.092 2.642 3.514 . 0 0 "[ . 1 . 2]" 1
164 1 20 ASP HB2 1 51 ALA HA . . 4.460 2.756 2.240 3.893 . 0 0 "[ . 1 . 2]" 1
165 1 20 ASP HB3 1 22 SER H . . 5.500 3.585 3.341 4.352 . 0 0 "[ . 1 . 2]" 1
166 1 20 ASP HB3 1 23 LYS H . . 4.650 2.633 2.462 2.774 . 0 0 "[ . 1 . 2]" 1
167 1 20 ASP HB3 1 23 LYS HB2 . . 4.930 2.785 1.994 3.214 . 0 0 "[ . 1 . 2]" 1
168 1 20 ASP HB3 1 23 LYS HB3 . . 4.930 4.389 3.575 4.787 . 0 0 "[ . 1 . 2]" 1
169 1 20 ASP HB3 1 23 LYS HG2 . . 4.630 2.870 2.301 3.291 . 0 0 "[ . 1 . 2]" 1
170 1 20 ASP HB3 1 23 LYS HG3 . . 4.630 3.254 2.606 3.634 . 0 0 "[ . 1 . 2]" 1
171 1 20 ASP HB3 1 51 ALA HA . . 4.460 3.664 3.086 4.339 . 0 0 "[ . 1 . 2]" 1
172 1 21 ALA H 1 21 ALA MB . . 3.130 2.143 2.027 2.244 . 0 0 "[ . 1 . 2]" 1
173 1 21 ALA H 1 22 SER H . . 3.530 2.695 2.478 2.967 . 0 0 "[ . 1 . 2]" 1
174 1 21 ALA H 1 23 LYS H . . 5.050 4.024 3.750 4.190 . 0 0 "[ . 1 . 2]" 1
175 1 21 ALA H 1 101 ASP HB2 . . 4.690 4.213 3.603 4.661 . 0 0 "[ . 1 . 2]" 1
176 1 21 ALA H 1 101 ASP HB3 . . 5.310 4.330 3.791 4.890 . 0 0 "[ . 1 . 2]" 1
177 1 21 ALA HA 1 23 LYS H . . 4.180 3.877 3.770 3.980 . 0 0 "[ . 1 . 2]" 1
178 1 21 ALA HA 1 24 VAL H . . 4.940 4.205 3.817 4.447 . 0 0 "[ . 1 . 2]" 1
179 1 21 ALA HA 1 24 VAL HB . . 4.670 3.404 3.182 3.781 . 0 0 "[ . 1 . 2]" 1
180 1 21 ALA HA 1 24 VAL MG2 . . 3.310 2.128 1.940 2.665 . 0 0 "[ . 1 . 2]" 1
181 1 21 ALA HA 1 51 ALA MB . . 4.360 3.785 3.517 4.218 . 0 0 "[ . 1 . 2]" 1
182 1 21 ALA HA 1 98 TYR H . . 4.860 4.560 4.194 4.842 . 0 0 "[ . 1 . 2]" 1
183 1 21 ALA HA 1 98 TYR HB2 . . 4.190 3.163 2.892 3.401 . 0 0 "[ . 1 . 2]" 1
184 1 21 ALA HA 1 98 TYR QB . . 3.560 2.212 1.961 2.478 . 0 0 "[ . 1 . 2]" 1
185 1 21 ALA HA 1 98 TYR HB3 . . 4.190 2.260 1.994 2.549 . 0 0 "[ . 1 . 2]" 1
186 1 21 ALA HA 1 98 TYR QD . . 3.950 3.293 2.989 3.593 . 0 0 "[ . 1 . 2]" 1
187 1 21 ALA HA 1 103 ILE MG . . 3.900 3.117 2.798 3.392 . 0 0 "[ . 1 . 2]" 1
188 1 21 ALA MB 1 22 SER H . . 3.800 2.488 2.249 2.633 . 0 0 "[ . 1 . 2]" 1
189 1 21 ALA MB 1 24 VAL MG2 . . 4.020 3.418 3.245 3.892 . 0 0 "[ . 1 . 2]" 1
190 1 21 ALA MB 1 98 TYR H . . 3.890 2.916 2.420 3.257 . 0 0 "[ . 1 . 2]" 1
191 1 21 ALA MB 1 98 TYR HB2 . . 3.860 3.154 2.350 3.498 . 0 0 "[ . 1 . 2]" 1
192 1 21 ALA MB 1 98 TYR HB3 . . 3.860 2.349 2.000 2.817 . 0 0 "[ . 1 . 2]" 1
193 1 21 ALA MB 1 98 TYR QD . . 4.120 3.780 3.416 4.120 . 18 0 "[ . 1 . 2]" 1
194 1 21 ALA MB 1 101 ASP H . . 4.210 3.965 3.720 4.209 . 0 0 "[ . 1 . 2]" 1
195 1 21 ALA MB 1 101 ASP HB2 . . 3.100 2.724 2.385 3.108 0.008 17 0 "[ . 1 . 2]" 1
196 1 21 ALA MB 1 101 ASP HB3 . . 3.290 2.527 1.906 2.932 . 0 0 "[ . 1 . 2]" 1
197 1 21 ALA MB 1 103 ILE H . . 4.610 3.717 3.305 4.013 . 0 0 "[ . 1 . 2]" 1
198 1 21 ALA MB 1 103 ILE HA . . 3.390 2.776 2.393 3.398 0.008 20 0 "[ . 1 . 2]" 1
199 1 21 ALA MB 1 103 ILE MG . . 3.340 2.217 2.031 2.575 . 0 0 "[ . 1 . 2]" 1
200 1 22 SER H 1 22 SER HB2 . . 3.670 2.927 2.170 3.594 . 0 0 "[ . 1 . 2]" 1
201 1 22 SER H 1 22 SER HB3 . . 3.670 3.024 2.364 3.597 . 0 0 "[ . 1 . 2]" 1
202 1 22 SER H 1 23 LYS H . . 3.320 2.777 2.671 2.808 . 0 0 "[ . 1 . 2]" 1
203 1 22 SER H 1 24 VAL H . . 4.590 4.467 4.202 4.589 . 0 0 "[ . 1 . 2]" 1
204 1 22 SER H 1 101 ASP HB3 . . 5.500 5.148 4.719 5.494 . 0 0 "[ . 1 . 2]" 1
205 1 22 SER H 1 103 ILE HA . . 4.770 4.366 4.008 4.762 . 0 0 "[ . 1 . 2]" 1
206 1 22 SER HA 1 24 VAL H . . 3.960 3.448 3.309 3.524 . 0 0 "[ . 1 . 2]" 1
207 1 22 SER HA 1 103 ILE HB . . 4.420 3.826 3.197 4.384 . 0 0 "[ . 1 . 2]" 1
208 1 22 SER HA 1 103 ILE MG . . 4.530 3.111 2.408 3.776 . 0 0 "[ . 1 . 2]" 1
209 1 22 SER HA 1 104 PRO QD . . 4.070 2.141 1.848 2.521 . 0 0 "[ . 1 . 2]" 1
210 1 22 SER HA 1 104 PRO HG2 . . 4.570 3.626 2.956 4.218 . 0 0 "[ . 1 . 2]" 1
211 1 22 SER HA 1 104 PRO QG . . 3.700 2.934 2.310 3.563 . 0 0 "[ . 1 . 2]" 1
212 1 22 SER HA 1 104 PRO HG3 . . 4.570 3.108 2.412 3.906 . 0 0 "[ . 1 . 2]" 1
213 1 22 SER QB 1 23 LYS H . . 4.180 3.080 2.746 3.640 . 0 0 "[ . 1 . 2]" 1
214 1 22 SER QB 1 104 PRO QD . . 4.120 3.185 2.560 3.681 . 0 0 "[ . 1 . 2]" 1
215 1 22 SER QB 1 104 PRO QG . . 3.830 3.009 2.338 3.736 . 0 0 "[ . 1 . 2]" 1
216 1 22 SER HB2 1 23 LYS H . . 4.780 3.478 2.809 4.177 . 0 0 "[ . 1 . 2]" 1
217 1 22 SER HB2 1 104 PRO HG2 . . 5.500 5.141 4.241 5.514 0.014 17 0 "[ . 1 . 2]" 1
218 1 22 SER HB2 1 104 PRO HG3 . . 5.500 3.900 2.854 4.457 . 0 0 "[ . 1 . 2]" 1
219 1 22 SER HB3 1 23 LYS H . . 4.780 3.763 2.865 4.191 . 0 0 "[ . 1 . 2]" 1
220 1 22 SER HB3 1 104 PRO HG2 . . 5.500 4.795 3.833 5.528 0.028 20 0 "[ . 1 . 2]" 1
221 1 22 SER HB3 1 104 PRO HG3 . . 5.500 3.526 2.375 4.648 . 0 0 "[ . 1 . 2]" 1
222 1 23 LYS H 1 23 LYS HB2 . . 3.830 2.343 2.278 2.512 . 0 0 "[ . 1 . 2]" 1
223 1 23 LYS H 1 23 LYS QB . . 3.150 2.313 2.253 2.469 . 0 0 "[ . 1 . 2]" 1
224 1 23 LYS H 1 23 LYS HB3 . . 3.830 3.585 3.554 3.639 . 0 0 "[ . 1 . 2]" 1
225 1 23 LYS H 1 23 LYS HD2 . . 5.060 4.766 3.722 5.067 0.007 9 0 "[ . 1 . 2]" 1
226 1 23 LYS H 1 23 LYS QD . . 4.320 3.991 3.538 4.276 . 0 0 "[ . 1 . 2]" 1
227 1 23 LYS H 1 23 LYS HD3 . . 5.060 4.378 3.961 5.056 . 0 0 "[ . 1 . 2]" 1
228 1 23 LYS H 1 23 LYS HG2 . . 3.920 2.750 2.366 2.921 . 0 0 "[ . 1 . 2]" 1
229 1 23 LYS H 1 23 LYS QG . . 3.320 2.690 2.342 2.832 . 0 0 "[ . 1 . 2]" 1
230 1 23 LYS H 1 23 LYS HG3 . . 3.920 3.842 3.740 3.944 0.024 18 0 "[ . 1 . 2]" 1
231 1 23 LYS H 1 24 VAL HB . . 5.020 4.684 4.466 4.801 . 0 0 "[ . 1 . 2]" 1
232 1 23 LYS H 1 24 VAL MG2 . . 4.090 3.491 3.233 3.738 . 0 0 "[ . 1 . 2]" 1
233 1 23 LYS H 1 51 ALA HA . . 4.180 3.987 3.821 4.174 . 0 0 "[ . 1 . 2]" 1
234 1 23 LYS H 1 51 ALA MB . . 4.070 3.832 3.540 4.076 0.006 18 0 "[ . 1 . 2]" 1
235 1 23 LYS HA 1 23 LYS HD2 . . 3.610 2.910 1.989 3.313 . 0 0 "[ . 1 . 2]" 1
236 1 23 LYS HA 1 23 LYS QD . . 3.060 2.121 1.973 2.396 . 0 0 "[ . 1 . 2]" 1
237 1 23 LYS HA 1 23 LYS HD3 . . 3.610 2.467 2.001 3.661 0.051 18 0 "[ . 1 . 2]" 1
238 1 23 LYS HA 1 23 LYS QE . . 4.330 3.857 2.059 4.227 . 0 0 "[ . 1 . 2]" 1
239 1 23 LYS HA 1 23 LYS HG2 . . 3.860 2.813 2.572 3.101 . 0 0 "[ . 1 . 2]" 1
240 1 23 LYS HA 1 23 LYS QG . . 3.270 2.731 2.525 2.967 . 0 0 "[ . 1 . 2]" 1
241 1 23 LYS HA 1 23 LYS HG3 . . 3.860 3.715 3.687 3.784 . 0 0 "[ . 1 . 2]" 1
242 1 23 LYS QB 1 23 LYS QD . . 3.200 2.323 2.117 2.893 . 0 0 "[ . 1 . 2]" 1
243 1 23 LYS QB 1 23 LYS QE . . 4.270 3.278 1.875 3.833 . 0 0 "[ . 1 . 2]" 1
244 1 23 LYS QB 1 24 VAL H . . 3.840 3.748 3.504 3.822 . 0 0 "[ . 1 . 2]" 1
245 1 23 LYS QB 1 50 ASP H . . 4.270 2.521 2.260 2.764 . 0 0 "[ . 1 . 2]" 1
246 1 23 LYS QB 1 50 ASP HB2 . . 4.010 3.376 2.633 3.928 . 0 0 "[ . 1 . 2]" 1
247 1 23 LYS QB 1 50 ASP HB3 . . 3.740 3.138 2.681 3.679 . 0 0 "[ . 1 . 2]" 1
248 1 23 LYS QB 1 51 ALA H . . 4.230 3.005 2.354 3.301 . 0 0 "[ . 1 . 2]" 1
249 1 23 LYS QB 1 51 ALA MB . . 3.400 2.612 2.435 2.769 . 0 0 "[ . 1 . 2]" 1
250 1 23 LYS HB2 1 24 VAL H . . 4.440 4.076 3.727 4.176 . 0 0 "[ . 1 . 2]" 1
251 1 23 LYS HB2 1 50 ASP HB3 . . 4.290 3.891 3.483 4.293 0.003 16 0 "[ . 1 . 2]" 1
252 1 23 LYS HB2 1 51 ALA H . . 4.870 3.774 3.294 4.029 . 0 0 "[ . 1 . 2]" 1
253 1 23 LYS HB2 1 51 ALA HA . . 3.560 2.234 2.001 2.376 . 0 0 "[ . 1 . 2]" 1
254 1 23 LYS HB2 1 51 ALA MB . . 3.940 2.839 2.609 3.111 . 0 0 "[ . 1 . 2]" 1
255 1 23 LYS HB3 1 24 VAL H . . 4.440 4.379 4.262 4.473 0.033 10 0 "[ . 1 . 2]" 1
256 1 23 LYS HB3 1 50 ASP HB3 . . 4.290 3.323 2.777 4.002 . 0 0 "[ . 1 . 2]" 1
257 1 23 LYS HB3 1 51 ALA H . . 4.870 3.172 2.411 3.643 . 0 0 "[ . 1 . 2]" 1
258 1 23 LYS HB3 1 51 ALA HA . . 3.560 3.197 2.750 3.527 . 0 0 "[ . 1 . 2]" 1
259 1 23 LYS HB3 1 51 ALA MB . . 3.940 3.075 2.883 3.526 . 0 0 "[ . 1 . 2]" 1
260 1 23 LYS QD 1 50 ASP HB2 . . 4.000 2.670 2.000 4.006 0.006 10 0 "[ . 1 . 2]" 1
261 1 23 LYS QD 1 50 ASP HB3 . . 4.160 2.923 2.014 4.205 0.045 10 0 "[ . 1 . 2]" 1
262 1 23 LYS HD2 1 50 ASP HB2 . . 4.600 2.835 2.012 4.650 0.050 18 0 "[ . 1 . 2]" 1
263 1 23 LYS HD3 1 50 ASP HB2 . . 4.600 4.089 3.413 4.580 . 0 0 "[ . 1 . 2]" 1
264 1 23 LYS QE 1 23 LYS HG2 . . 3.710 2.751 2.361 3.402 . 0 0 "[ . 1 . 2]" 1
265 1 23 LYS QE 1 23 LYS QG . . 3.130 2.210 2.083 2.514 . 0 0 "[ . 1 . 2]" 1
266 1 23 LYS QE 1 23 LYS HG3 . . 3.710 2.365 2.184 3.006 . 0 0 "[ . 1 . 2]" 1
267 1 23 LYS QE 1 50 ASP HB2 . . 3.210 2.721 1.777 3.214 0.004 9 0 "[ . 1 . 2]" 1
268 1 23 LYS QG 1 50 ASP HB3 . . 4.840 2.310 1.977 2.950 . 0 0 "[ . 1 . 2]" 1
269 1 23 LYS QG 1 51 ALA HA . . 3.740 3.655 3.339 3.746 0.006 20 0 "[ . 1 . 2]" 1
270 1 24 VAL H 1 24 VAL HB . . 3.180 2.588 2.445 2.711 . 0 0 "[ . 1 . 2]" 1
271 1 24 VAL H 1 24 VAL MG1 . . 4.060 3.814 3.740 3.884 . 0 0 "[ . 1 . 2]" 1
272 1 24 VAL H 1 24 VAL MG2 . . 3.220 2.843 2.682 3.059 . 0 0 "[ . 1 . 2]" 1
273 1 24 VAL H 1 25 THR H . . 4.390 4.331 4.159 4.400 0.010 18 0 "[ . 1 . 2]" 1
274 1 24 VAL H 1 25 THR MG . . 4.240 3.767 3.517 4.205 . 0 0 "[ . 1 . 2]" 1
275 1 24 VAL H 1 51 ALA MB . . 4.070 3.857 3.652 4.074 0.004 16 0 "[ . 1 . 2]" 1
276 1 24 VAL H 1 103 ILE HB . . 5.030 4.746 4.442 5.039 0.009 16 0 "[ . 1 . 2]" 1
277 1 24 VAL H 1 103 ILE MG . . 4.090 3.039 2.619 3.495 . 0 0 "[ . 1 . 2]" 1
278 1 24 VAL H 1 104 PRO QD . . 5.350 4.397 4.096 4.771 . 0 0 "[ . 1 . 2]" 1
279 1 24 VAL HA 1 24 VAL MG1 . . 3.430 2.414 2.278 2.489 . 0 0 "[ . 1 . 2]" 1
280 1 24 VAL HA 1 24 VAL MG2 . . 3.600 2.309 2.160 2.441 . 0 0 "[ . 1 . 2]" 1
281 1 24 VAL HA 1 25 THR H . . 2.850 2.147 2.139 2.158 . 0 0 "[ . 1 . 2]" 1
282 1 24 VAL HA 1 25 THR HA . . 4.550 4.403 4.393 4.415 . 0 0 "[ . 1 . 2]" 1
283 1 24 VAL HA 1 46 ILE MG . . 4.210 3.958 3.588 4.211 0.001 8 0 "[ . 1 . 2]" 1
284 1 24 VAL HA 1 48 ALA HA . . 3.960 3.233 2.869 3.437 . 0 0 "[ . 1 . 2]" 1
285 1 24 VAL HA 1 48 ALA MB . . 4.320 3.148 2.789 3.487 . 0 0 "[ . 1 . 2]" 1
286 1 24 VAL HA 1 51 ALA MB . . 3.900 2.966 2.778 3.155 . 0 0 "[ . 1 . 2]" 1
287 1 24 VAL HB 1 25 THR H . . 4.510 4.256 4.186 4.360 . 0 0 "[ . 1 . 2]" 1
288 1 24 VAL HB 1 103 ILE HB . . 4.490 4.219 3.694 4.494 0.004 17 0 "[ . 1 . 2]" 1
289 1 24 VAL HB 1 103 ILE MG . . 3.280 1.974 1.870 2.109 . 0 0 "[ . 1 . 2]" 1
290 1 24 VAL MG1 1 25 THR H . . 3.310 2.571 2.374 2.881 . 0 0 "[ . 1 . 2]" 1
291 1 24 VAL MG1 1 25 THR HA . . 4.410 3.446 3.205 3.766 . 0 0 "[ . 1 . 2]" 1
292 1 24 VAL MG1 1 48 ALA MB . . 3.940 3.491 3.095 3.907 . 0 0 "[ . 1 . 2]" 1
293 1 24 VAL MG1 1 103 ILE MG . . 3.190 2.683 2.192 3.003 . 0 0 "[ . 1 . 2]" 1
294 1 24 VAL MG2 1 25 THR H . . 4.230 3.969 3.846 4.161 . 0 0 "[ . 1 . 2]" 1
295 1 24 VAL MG2 1 48 ALA MB . . 3.420 2.780 2.415 3.222 . 0 0 "[ . 1 . 2]" 1
296 1 24 VAL MG2 1 51 ALA H . . 4.730 4.469 4.163 4.656 . 0 0 "[ . 1 . 2]" 1
297 1 24 VAL MG2 1 51 ALA HA . . 4.330 3.547 3.332 3.909 . 0 0 "[ . 1 . 2]" 1
298 1 24 VAL MG2 1 51 ALA MB . . 3.000 1.797 1.706 1.985 . 0 0 "[ . 1 . 2]" 1
299 1 24 VAL MG2 1 98 TYR HB2 . . 4.040 2.631 2.379 3.022 . 0 0 "[ . 1 . 2]" 1
300 1 24 VAL MG2 1 98 TYR HB3 . . 4.040 2.930 2.677 3.334 . 0 0 "[ . 1 . 2]" 1
301 1 24 VAL MG2 1 98 TYR QD . . 3.940 2.941 2.684 3.255 . 0 0 "[ . 1 . 2]" 1
302 1 24 VAL MG2 1 98 TYR QE . . 4.440 3.609 3.230 3.988 . 0 0 "[ . 1 . 2]" 1
303 1 25 THR H 1 25 THR HB . . 3.970 3.839 3.781 3.893 . 0 0 "[ . 1 . 2]" 1
304 1 25 THR H 1 25 THR MG . . 3.530 3.087 2.769 3.300 . 0 0 "[ . 1 . 2]" 1
305 1 25 THR H 1 46 ILE MG . . 4.210 3.295 2.988 3.690 . 0 0 "[ . 1 . 2]" 1
306 1 25 THR H 1 47 ASP H . . 4.420 4.239 3.777 4.435 0.015 10 0 "[ . 1 . 2]" 1
307 1 25 THR H 1 47 ASP QB . . 5.340 4.946 4.365 5.343 0.003 8 0 "[ . 1 . 2]" 1
308 1 25 THR H 1 48 ALA HA . . 4.220 3.508 3.237 3.743 . 0 0 "[ . 1 . 2]" 1
309 1 25 THR HA 1 25 THR HB . . 3.020 2.492 2.453 2.542 . 0 0 "[ . 1 . 2]" 1
310 1 25 THR HA 1 25 THR MG . . 2.950 2.303 2.156 2.397 . 0 0 "[ . 1 . 2]" 1
311 1 25 THR HA 1 26 ALA H . . 2.870 2.306 2.168 2.431 . 0 0 "[ . 1 . 2]" 1
312 1 25 THR HA 1 26 ALA HA . . 4.550 4.449 4.393 4.497 . 0 0 "[ . 1 . 2]" 1
313 1 25 THR HA 1 103 ILE MD . . 3.920 3.734 3.408 3.925 0.005 9 0 "[ . 1 . 2]" 1
314 1 25 THR HB 1 26 ALA H . . 3.170 2.653 2.322 3.156 . 0 0 "[ . 1 . 2]" 1
315 1 26 ALA H 1 26 ALA MB . . 3.350 2.537 2.414 2.645 . 0 0 "[ . 1 . 2]" 1
316 1 26 ALA H 1 27 SER H . . 4.550 4.409 4.284 4.493 . 0 0 "[ . 1 . 2]" 1
317 1 26 ALA H 1 31 LEU MD1 . . 4.790 3.923 3.616 4.090 . 0 0 "[ . 1 . 2]" 1
318 1 26 ALA H 1 103 ILE MD . . 4.720 4.620 4.259 4.729 0.009 20 0 "[ . 1 . 2]" 1
319 1 26 ALA HA 1 27 SER H . . 2.880 2.262 2.165 2.314 . 0 0 "[ . 1 . 2]" 1
320 1 26 ALA HA 1 31 LEU MD1 . . 4.790 3.808 3.396 3.998 . 0 0 "[ . 1 . 2]" 1
321 1 26 ALA HA 1 45 ALA H . . 5.000 4.670 4.473 4.942 . 0 0 "[ . 1 . 2]" 1
322 1 26 ALA HA 1 46 ILE H . . 5.350 4.857 4.615 5.096 . 0 0 "[ . 1 . 2]" 1
323 1 26 ALA HA 1 46 ILE HA . . 3.570 2.313 2.062 2.642 . 0 0 "[ . 1 . 2]" 1
324 1 26 ALA HA 1 46 ILE HG12 . . 4.980 3.851 3.275 4.196 . 0 0 "[ . 1 . 2]" 1
325 1 26 ALA HA 1 46 ILE QG . . 4.270 3.580 3.092 3.815 . 0 0 "[ . 1 . 2]" 1
326 1 26 ALA HA 1 46 ILE HG13 . . 4.980 4.261 3.796 4.468 . 0 0 "[ . 1 . 2]" 1
327 1 26 ALA HA 1 46 ILE MG . . 4.090 3.600 3.220 3.773 . 0 0 "[ . 1 . 2]" 1
328 1 26 ALA HA 1 47 ASP H . . 3.900 2.936 2.630 3.893 . 0 0 "[ . 1 . 2]" 1
329 1 26 ALA MB 1 27 SER H . . 3.420 2.751 2.595 3.050 . 0 0 "[ . 1 . 2]" 1
330 1 26 ALA MB 1 31 LEU MD1 . . 2.980 1.772 1.651 1.842 . 0 0 "[ . 1 . 2]" 1
331 1 26 ALA MB 1 44 PHE QD . . 3.730 2.589 2.267 2.822 . 0 0 "[ . 1 . 2]" 1
332 1 26 ALA MB 1 44 PHE QE . . 4.480 3.505 3.226 3.814 . 0 0 "[ . 1 . 2]" 1
333 1 26 ALA MB 1 46 ILE HA . . 3.820 2.679 2.194 3.764 . 0 0 "[ . 1 . 2]" 1
334 1 26 ALA MB 1 108 TYR QE . . 4.280 4.034 3.333 4.285 0.005 17 0 "[ . 1 . 2]" 1
335 1 27 SER H 1 27 SER QB . . 3.860 2.800 2.634 3.187 . 0 0 "[ . 1 . 2]" 1
336 1 27 SER H 1 28 GLY H . . 4.980 4.364 4.262 4.424 . 0 0 "[ . 1 . 2]" 1
337 1 27 SER H 1 31 LEU MD1 . . 4.080 3.307 2.861 3.495 . 0 0 "[ . 1 . 2]" 1
338 1 27 SER H 1 44 PHE HB2 . . 4.690 3.597 3.467 3.734 . 0 0 "[ . 1 . 2]" 1
339 1 27 SER H 1 44 PHE HB3 . . 5.250 5.110 4.917 5.245 . 0 0 "[ . 1 . 2]" 1
340 1 27 SER H 1 44 PHE QD . . 4.380 4.241 3.955 4.382 0.002 7 0 "[ . 1 . 2]" 1
341 1 27 SER H 1 45 ALA H . . 3.710 3.080 2.817 3.284 . 0 0 "[ . 1 . 2]" 1
342 1 27 SER H 1 45 ALA MB . . 3.970 3.663 3.304 3.886 . 0 0 "[ . 1 . 2]" 1
343 1 27 SER H 1 46 ILE HA . . 3.960 3.728 3.283 3.885 . 0 0 "[ . 1 . 2]" 1
344 1 27 SER H 1 46 ILE MG . . 5.390 5.310 4.938 5.401 0.011 3 0 "[ . 1 . 2]" 1
345 1 27 SER H 1 47 ASP H . . 4.620 4.259 3.964 4.611 . 0 0 "[ . 1 . 2]" 1
346 1 27 SER HA 1 28 GLY H . . 3.240 2.290 2.177 2.485 . 0 0 "[ . 1 . 2]" 1
347 1 27 SER HA 1 28 GLY HA3 . . 4.630 4.360 4.353 4.396 . 0 0 "[ . 1 . 2]" 1
348 1 27 SER HA 1 31 LEU MD1 . . 4.140 2.961 1.988 3.227 . 0 0 "[ . 1 . 2]" 1
349 1 27 SER QB 1 28 GLY H . . 3.190 2.722 2.241 3.072 . 0 0 "[ . 1 . 2]" 1
350 1 27 SER QB 1 45 ALA H . . 4.960 4.673 4.388 4.964 0.004 6 0 "[ . 1 . 2]" 1
351 1 28 GLY H 1 31 LEU HB2 . . 4.080 3.808 3.459 4.004 . 0 0 "[ . 1 . 2]" 1
352 1 28 GLY H 1 31 LEU MD1 . . 4.920 3.922 3.330 4.175 . 0 0 "[ . 1 . 2]" 1
353 1 28 GLY HA2 1 29 PRO QB . . 5.230 4.728 4.686 4.743 . 0 0 "[ . 1 . 2]" 1
354 1 28 GLY HA2 1 29 PRO QD . . 3.330 2.420 2.344 2.447 . 0 0 "[ . 1 . 2]" 1
355 1 28 GLY HA2 1 29 PRO HG2 . . 4.950 4.914 4.832 4.943 . 0 0 "[ . 1 . 2]" 1
356 1 28 GLY HA2 1 29 PRO HG3 . . 4.850 4.828 4.747 4.859 0.009 16 0 "[ . 1 . 2]" 1
357 1 28 GLY HA2 1 30 GLY H . . 4.610 4.572 4.467 4.612 0.002 19 0 "[ . 1 . 2]" 1
358 1 28 GLY HA2 1 31 LEU H . . 5.070 4.986 4.878 5.043 . 0 0 "[ . 1 . 2]" 1
359 1 28 GLY HA3 1 29 PRO HA . . 4.770 4.678 4.670 4.702 . 0 0 "[ . 1 . 2]" 1
360 1 28 GLY HA3 1 29 PRO HD2 . . 3.520 2.181 2.154 2.260 . 0 0 "[ . 1 . 2]" 1
361 1 28 GLY HA3 1 29 PRO QD . . 3.050 2.135 2.109 2.211 . 0 0 "[ . 1 . 2]" 1
362 1 28 GLY HA3 1 29 PRO HD3 . . 3.520 3.047 3.013 3.140 . 0 0 "[ . 1 . 2]" 1
363 1 28 GLY HA3 1 29 PRO HG2 . . 4.360 4.279 4.259 4.335 . 0 0 "[ . 1 . 2]" 1
364 1 28 GLY HA3 1 29 PRO HG3 . . 5.030 4.774 4.745 4.857 . 0 0 "[ . 1 . 2]" 1
365 1 28 GLY HA3 1 44 PHE HA . . 3.490 2.806 2.536 3.000 . 0 0 "[ . 1 . 2]" 1
366 1 28 GLY HA3 1 45 ALA H . . 4.480 3.417 3.122 3.611 . 0 0 "[ . 1 . 2]" 1
367 1 29 PRO HA 1 31 LEU H . . 4.270 3.965 3.781 4.129 . 0 0 "[ . 1 . 2]" 1
368 1 29 PRO HA 1 32 SER H . . 3.970 3.391 3.127 3.678 . 0 0 "[ . 1 . 2]" 1
369 1 29 PRO HA 1 32 SER HA . . 4.610 4.133 3.996 4.346 . 0 0 "[ . 1 . 2]" 1
370 1 29 PRO HA 1 32 SER HB2 . . 3.970 2.207 2.013 2.446 . 0 0 "[ . 1 . 2]" 1
371 1 29 PRO HA 1 32 SER HB3 . . 4.110 3.313 3.163 3.499 . 0 0 "[ . 1 . 2]" 1
372 1 29 PRO HA 1 36 VAL MG1 . . 4.330 4.042 3.703 4.231 . 0 0 "[ . 1 . 2]" 1
373 1 29 PRO QB 1 30 GLY H . . 3.600 3.123 3.067 3.185 . 0 0 "[ . 1 . 2]" 1
374 1 29 PRO QB 1 42 VAL MG2 . . 3.040 2.021 1.865 2.235 . 0 0 "[ . 1 . 2]" 1
375 1 29 PRO HB2 1 30 GLY H . . 4.390 3.241 3.176 3.313 . 0 0 "[ . 1 . 2]" 1
376 1 29 PRO HB3 1 30 GLY H . . 4.390 4.088 4.051 4.130 . 0 0 "[ . 1 . 2]" 1
377 1 29 PRO QD 1 30 GLY H . . 3.850 2.608 2.603 2.616 . 0 0 "[ . 1 . 2]" 1
378 1 29 PRO QD 1 42 VAL MG2 . . 4.560 3.523 3.401 3.716 . 0 0 "[ . 1 . 2]" 1
379 1 29 PRO QD 1 44 PHE HA . . 4.710 2.819 2.616 2.956 . 0 0 "[ . 1 . 2]" 1
380 1 29 PRO HD2 1 30 GLY H . . 4.610 2.654 2.648 2.662 . 0 0 "[ . 1 . 2]" 1
381 1 29 PRO HD3 1 30 GLY H . . 4.610 3.839 3.838 3.841 . 0 0 "[ . 1 . 2]" 1
382 1 29 PRO HG2 1 30 GLY H . . 4.270 2.256 2.183 2.341 . 0 0 "[ . 1 . 2]" 1
383 1 29 PRO HG2 1 42 VAL MG2 . . 3.780 1.971 1.857 2.190 . 0 0 "[ . 1 . 2]" 1
384 1 29 PRO HG2 1 43 ASP H . . 4.780 3.211 2.766 3.429 . 0 0 "[ . 1 . 2]" 1
385 1 29 PRO HG2 1 44 PHE HA . . 4.270 4.134 3.954 4.239 . 0 0 "[ . 1 . 2]" 1
386 1 29 PRO HG3 1 30 GLY H . . 4.170 3.798 3.744 3.861 . 0 0 "[ . 1 . 2]" 1
387 1 29 PRO HG3 1 42 VAL MG2 . . 3.970 2.966 2.738 3.222 . 0 0 "[ . 1 . 2]" 1
388 1 29 PRO HG3 1 43 ASP H . . 4.380 4.287 3.860 4.385 0.005 4 0 "[ . 1 . 2]" 1
389 1 29 PRO HG3 1 44 PHE HA . . 5.310 5.186 5.030 5.306 . 0 0 "[ . 1 . 2]" 1
390 1 30 GLY H 1 31 LEU H . . 3.710 2.761 2.671 2.820 . 0 0 "[ . 1 . 2]" 1
391 1 30 GLY H 1 32 SER H . . 4.840 4.180 3.959 4.280 . 0 0 "[ . 1 . 2]" 1
392 1 30 GLY H 1 42 VAL MG1 . . 4.400 4.047 3.798 4.321 . 0 0 "[ . 1 . 2]" 1
393 1 30 GLY H 1 42 VAL MG2 . . 3.580 2.436 2.247 2.575 . 0 0 "[ . 1 . 2]" 1
394 1 30 GLY H 1 43 ASP H . . 4.940 4.280 3.939 4.593 . 0 0 "[ . 1 . 2]" 1
395 1 30 GLY H 1 44 PHE HA . . 4.080 3.456 3.189 3.704 . 0 0 "[ . 1 . 2]" 1
396 1 30 GLY H 1 44 PHE HB2 . . 4.660 4.537 4.325 4.662 0.002 18 0 "[ . 1 . 2]" 1
397 1 30 GLY H 1 44 PHE HB3 . . 3.890 2.983 2.792 3.121 . 0 0 "[ . 1 . 2]" 1
398 1 30 GLY H 1 44 PHE QD . . 4.120 3.879 3.643 4.093 . 0 0 "[ . 1 . 2]" 1
399 1 30 GLY HA2 1 36 VAL MG1 . . 3.690 2.735 2.106 3.030 . 0 0 "[ . 1 . 2]" 1
400 1 30 GLY HA2 1 42 VAL MG1 . . 3.720 2.148 1.966 2.383 . 0 0 "[ . 1 . 2]" 1
401 1 30 GLY HA2 1 42 VAL MG2 . . 3.550 2.102 1.935 2.396 . 0 0 "[ . 1 . 2]" 1
402 1 30 GLY HA2 1 44 PHE QD . . 4.400 3.783 3.587 4.352 . 0 0 "[ . 1 . 2]" 1
403 1 30 GLY HA2 1 84 TYR QE . . 4.750 2.281 2.017 2.877 . 0 0 "[ . 1 . 2]" 1
404 1 30 GLY HA3 1 32 SER H . . 4.960 4.493 4.361 4.598 . 0 0 "[ . 1 . 2]" 1
405 1 30 GLY HA3 1 36 VAL MG1 . . 4.450 4.151 3.666 4.442 . 0 0 "[ . 1 . 2]" 1
406 1 30 GLY HA3 1 42 VAL MG1 . . 3.650 3.153 2.703 3.384 . 0 0 "[ . 1 . 2]" 1
407 1 30 GLY HA3 1 42 VAL MG2 . . 3.680 2.698 2.375 2.933 . 0 0 "[ . 1 . 2]" 1
408 1 30 GLY HA3 1 44 PHE HB2 . . 4.960 4.526 4.282 4.811 . 0 0 "[ . 1 . 2]" 1
409 1 30 GLY HA3 1 44 PHE HB3 . . 4.980 2.794 2.551 3.068 . 0 0 "[ . 1 . 2]" 1
410 1 30 GLY HA3 1 44 PHE QD . . 4.030 2.178 2.006 2.688 . 0 0 "[ . 1 . 2]" 1
411 1 30 GLY HA3 1 84 TYR QE . . 4.470 2.494 2.238 2.824 . 0 0 "[ . 1 . 2]" 1
412 1 31 LEU H 1 31 LEU HB2 . . 3.430 2.661 2.467 2.709 . 0 0 "[ . 1 . 2]" 1
413 1 31 LEU H 1 31 LEU HB3 . . 3.900 3.746 3.622 3.787 . 0 0 "[ . 1 . 2]" 1
414 1 31 LEU H 1 31 LEU MD1 . . 3.930 3.572 3.434 3.657 . 0 0 "[ . 1 . 2]" 1
415 1 31 LEU H 1 31 LEU MD2 . . 4.050 3.871 3.693 3.964 . 0 0 "[ . 1 . 2]" 1
416 1 31 LEU H 1 31 LEU HG . . 3.570 2.631 2.463 2.757 . 0 0 "[ . 1 . 2]" 1
417 1 31 LEU H 1 32 SER H . . 3.020 2.511 2.320 2.672 . 0 0 "[ . 1 . 2]" 1
418 1 31 LEU H 1 32 SER HA . . 4.920 4.442 4.348 4.769 . 0 0 "[ . 1 . 2]" 1
419 1 31 LEU H 1 32 SER HB2 . . 4.590 4.448 4.127 4.586 . 0 0 "[ . 1 . 2]" 1
420 1 31 LEU H 1 32 SER HB3 . . 4.760 4.724 4.653 4.764 0.004 20 0 "[ . 1 . 2]" 1
421 1 31 LEU H 1 42 VAL MG2 . . 4.500 4.296 4.143 4.480 . 0 0 "[ . 1 . 2]" 1
422 1 31 LEU H 1 44 PHE HB2 . . 4.460 4.360 4.084 4.467 0.007 7 0 "[ . 1 . 2]" 1
423 1 31 LEU H 1 44 PHE HB3 . . 4.290 3.087 2.783 3.303 . 0 0 "[ . 1 . 2]" 1
424 1 31 LEU HA 1 31 LEU MD1 . . 4.250 3.968 3.924 3.980 . 0 0 "[ . 1 . 2]" 1
425 1 31 LEU HA 1 31 LEU MD2 . . 3.260 2.323 2.199 2.399 . 0 0 "[ . 1 . 2]" 1
426 1 31 LEU HA 1 32 SER H . . 3.530 3.006 2.935 3.414 . 0 0 "[ . 1 . 2]" 1
427 1 31 LEU HA 1 94 ILE MD . . 4.420 3.955 3.539 4.420 . 0 0 "[ . 1 . 2]" 1
428 1 31 LEU HA 1 110 ILE MD . . 3.460 1.974 1.935 2.072 . 0 0 "[ . 1 . 2]" 1
429 1 31 LEU HA 1 110 ILE HG12 . . 3.930 3.364 3.082 3.926 . 0 0 "[ . 1 . 2]" 1
430 1 31 LEU HA 1 110 ILE MG . . 3.850 3.465 3.163 3.668 . 0 0 "[ . 1 . 2]" 1
431 1 31 LEU HB2 1 31 LEU MD1 . . 3.490 2.134 2.017 2.266 . 0 0 "[ . 1 . 2]" 1
432 1 31 LEU HB2 1 32 SER H . . 4.250 3.945 3.126 4.048 . 0 0 "[ . 1 . 2]" 1
433 1 31 LEU HB3 1 31 LEU MD1 . . 3.470 2.578 2.457 2.656 . 0 0 "[ . 1 . 2]" 1
434 1 31 LEU HB3 1 32 SER H . . 4.460 4.460 4.055 4.498 0.038 14 0 "[ . 1 . 2]" 1
435 1 31 LEU MD1 1 44 PHE HB2 . . 4.310 2.559 2.151 2.850 . 0 0 "[ . 1 . 2]" 1
436 1 31 LEU MD1 1 44 PHE HB3 . . 4.420 3.056 2.703 3.403 . 0 0 "[ . 1 . 2]" 1
437 1 31 LEU MD1 1 44 PHE QD . . 3.950 2.868 2.529 3.212 . 0 0 "[ . 1 . 2]" 1
438 1 31 LEU MD1 1 44 PHE QE . . 4.850 3.787 3.394 4.457 . 0 0 "[ . 1 . 2]" 1
439 1 31 LEU MD1 1 45 ALA H . . 4.600 3.919 3.668 4.099 . 0 0 "[ . 1 . 2]" 1
440 1 31 LEU MD1 1 108 TYR QE . . 4.520 3.329 2.772 4.209 . 0 0 "[ . 1 . 2]" 1
441 1 31 LEU MD2 1 32 SER H . . 4.870 4.853 4.773 4.874 0.004 15 0 "[ . 1 . 2]" 1
442 1 31 LEU MD2 1 44 PHE QD . . 4.380 3.627 3.455 3.806 . 0 0 "[ . 1 . 2]" 1
443 1 31 LEU MD2 1 44 PHE QE . . 4.670 3.564 3.287 4.030 . 0 0 "[ . 1 . 2]" 1
444 1 31 LEU MD2 1 94 ILE HB . . 4.370 3.631 3.306 4.161 . 0 0 "[ . 1 . 2]" 1
445 1 31 LEU MD2 1 94 ILE MD . . 3.330 2.439 2.105 2.918 . 0 0 "[ . 1 . 2]" 1
446 1 31 LEU MD2 1 94 ILE MG . . 3.750 3.308 2.939 3.748 . 0 0 "[ . 1 . 2]" 1
447 1 31 LEU MD2 1 108 TYR HB2 . . 4.680 3.515 3.140 4.073 . 0 0 "[ . 1 . 2]" 1
448 1 31 LEU MD2 1 108 TYR HB3 . . 4.350 3.161 2.870 3.593 . 0 0 "[ . 1 . 2]" 1
449 1 31 LEU MD2 1 108 TYR QD . . 4.030 2.815 2.403 3.629 . 0 0 "[ . 1 . 2]" 1
450 1 31 LEU MD2 1 110 ILE MD . . 3.780 2.171 1.946 2.491 . 0 0 "[ . 1 . 2]" 1
451 1 31 LEU MD2 1 110 ILE HG12 . . 4.870 4.061 3.833 4.502 . 0 0 "[ . 1 . 2]" 1
452 1 31 LEU MD2 1 110 ILE HG13 . . 4.820 4.219 4.015 4.587 . 0 0 "[ . 1 . 2]" 1
453 1 31 LEU MD2 1 110 ILE MG . . 4.820 4.513 4.222 4.704 . 0 0 "[ . 1 . 2]" 1
454 1 31 LEU HG 1 32 SER H . . 4.690 4.685 4.470 4.701 0.011 11 0 "[ . 1 . 2]" 1
455 1 31 LEU HG 1 44 PHE HB2 . . 4.510 3.415 3.176 3.603 . 0 0 "[ . 1 . 2]" 1
456 1 31 LEU HG 1 44 PHE HB3 . . 4.560 2.710 2.471 2.976 . 0 0 "[ . 1 . 2]" 1
457 1 31 LEU HG 1 44 PHE QD . . 4.180 3.215 2.902 3.619 . 0 0 "[ . 1 . 2]" 1
458 1 31 LEU HG 1 45 ALA H . . 5.480 5.369 5.086 5.480 . 11 0 "[ . 1 . 2]" 1
459 1 32 SER H 1 32 SER HB2 . . 3.130 2.706 2.501 2.798 . 0 0 "[ . 1 . 2]" 1
460 1 32 SER H 1 32 SER HB3 . . 3.060 2.397 2.310 2.677 . 0 0 "[ . 1 . 2]" 1
461 1 32 SER H 1 33 SER H . . 4.790 4.470 4.388 4.534 . 0 0 "[ . 1 . 2]" 1
462 1 32 SER H 1 36 VAL MG1 . . 3.970 2.914 2.693 3.535 . 0 0 "[ . 1 . 2]" 1
463 1 32 SER H 1 42 VAL MG2 . . 5.020 4.648 4.409 4.909 . 0 0 "[ . 1 . 2]" 1
464 1 32 SER H 1 110 ILE MD . . 4.590 3.904 3.689 4.471 . 0 0 "[ . 1 . 2]" 1
465 1 32 SER H 1 110 ILE MG . . 4.830 3.877 3.651 4.397 . 0 0 "[ . 1 . 2]" 1
466 1 32 SER HA 1 33 SER H . . 3.380 2.140 2.138 2.148 . 0 0 "[ . 1 . 2]" 1
467 1 32 SER HA 1 33 SER HA . . 5.080 4.386 4.365 4.417 . 0 0 "[ . 1 . 2]" 1
468 1 32 SER HA 1 34 TYR H . . 3.910 3.734 3.442 3.860 . 0 0 "[ . 1 . 2]" 1
469 1 32 SER HB2 1 33 SER H . . 4.720 4.233 4.126 4.403 . 0 0 "[ . 1 . 2]" 1
470 1 32 SER HB2 1 34 TYR H . . 4.740 4.624 4.151 4.743 0.003 17 0 "[ . 1 . 2]" 1
471 1 32 SER HB2 1 35 GLY H . . 4.640 4.392 4.253 4.640 0.000 8 0 "[ . 1 . 2]" 1
472 1 32 SER HB2 1 36 VAL MG1 . . 4.300 3.672 3.409 3.843 . 0 0 "[ . 1 . 2]" 1
473 1 32 SER HB2 1 42 VAL MG2 . . 5.500 5.236 4.998 5.391 . 0 0 "[ . 1 . 2]" 1
474 1 32 SER HB2 1 110 ILE MG . . 5.500 5.472 5.348 5.508 0.008 10 0 "[ . 1 . 2]" 1
475 1 32 SER HB3 1 34 TYR H . . 4.900 4.389 3.700 4.666 . 0 0 "[ . 1 . 2]" 1
476 1 32 SER HB3 1 35 GLY H . . 3.910 3.274 2.929 3.576 . 0 0 "[ . 1 . 2]" 1
477 1 32 SER HB3 1 36 VAL H . . 5.240 4.929 4.695 5.175 . 0 0 "[ . 1 . 2]" 1
478 1 32 SER HB3 1 36 VAL MG1 . . 3.770 2.361 2.067 2.647 . 0 0 "[ . 1 . 2]" 1
479 1 32 SER HB3 1 36 VAL MG2 . . 5.460 4.839 4.603 5.154 . 0 0 "[ . 1 . 2]" 1
480 1 32 SER HB3 1 42 VAL MG2 . . 5.500 5.061 4.763 5.432 . 0 0 "[ . 1 . 2]" 1
481 1 32 SER HB3 1 110 ILE MG . . 5.500 4.220 4.094 4.369 . 0 0 "[ . 1 . 2]" 1
482 1 33 SER H 1 33 SER HB2 . . 4.080 3.208 2.310 3.623 . 0 0 "[ . 1 . 2]" 1
483 1 33 SER H 1 33 SER HB3 . . 4.080 2.653 2.339 3.595 . 0 0 "[ . 1 . 2]" 1
484 1 33 SER H 1 34 TYR H . . 3.660 2.620 2.467 2.897 . 0 0 "[ . 1 . 2]" 1
485 1 33 SER H 1 35 GLY H . . 4.850 4.191 4.060 4.720 . 0 0 "[ . 1 . 2]" 1
486 1 33 SER HA 1 35 GLY H . . 4.720 4.011 3.764 4.179 . 0 0 "[ . 1 . 2]" 1
487 1 33 SER HA 1 110 ILE MD . . 5.430 5.249 4.724 5.429 . 0 0 "[ . 1 . 2]" 1
488 1 33 SER HA 1 110 ILE MG . . 4.360 3.968 3.465 4.296 . 0 0 "[ . 1 . 2]" 1
489 1 33 SER HA 1 111 ARG H . . 5.200 4.936 4.107 5.213 0.013 19 0 "[ . 1 . 2]" 1
490 1 33 SER QB 1 34 TYR H . . 3.950 3.285 2.626 3.957 0.007 9 0 "[ . 1 . 2]" 1
491 1 34 TYR H 1 34 TYR HB2 . . 3.760 2.522 2.209 3.193 . 0 0 "[ . 1 . 2]" 1
492 1 34 TYR H 1 34 TYR QB . . 3.090 2.362 2.146 2.671 . 0 0 "[ . 1 . 2]" 1
493 1 34 TYR H 1 34 TYR HB3 . . 3.760 3.337 2.210 3.610 . 0 0 "[ . 1 . 2]" 1
494 1 34 TYR H 1 34 TYR QD . . 3.960 2.910 1.944 3.960 . 0 0 "[ . 1 . 2]" 1
495 1 34 TYR H 1 35 GLY H . . 3.240 2.593 1.968 2.686 . 0 0 "[ . 1 . 2]" 1
496 1 34 TYR HA 1 34 TYR QD . . 3.720 2.748 2.119 3.271 . 0 0 "[ . 1 . 2]" 1
497 1 34 TYR QB 1 35 GLY H . . 3.690 2.822 2.724 2.972 . 0 0 "[ . 1 . 2]" 1
498 1 34 TYR HB2 1 35 GLY H . . 4.210 3.131 2.791 4.216 0.006 9 0 "[ . 1 . 2]" 1
499 1 34 TYR HB3 1 35 GLY H . . 4.210 3.612 2.975 4.091 . 0 0 "[ . 1 . 2]" 1
500 1 35 GLY H 1 36 VAL H . . 4.260 4.194 3.766 4.264 0.004 16 0 "[ . 1 . 2]" 1
501 1 35 GLY H 1 110 ILE MG . . 4.510 4.248 3.951 4.495 . 0 0 "[ . 1 . 2]" 1
502 1 35 GLY H 1 113 THR MG . . 5.020 4.834 4.213 5.019 . 0 0 "[ . 1 . 2]" 1
503 1 35 GLY QA 1 36 VAL MG2 . . 4.300 3.560 3.437 3.711 . 0 0 "[ . 1 . 2]" 1
504 1 35 GLY QA 1 110 ILE MG . . 5.170 3.291 2.790 4.121 . 0 0 "[ . 1 . 2]" 1
505 1 35 GLY QA 1 111 ARG H . . 4.170 3.114 2.758 4.002 . 0 0 "[ . 1 . 2]" 1
506 1 35 GLY QA 1 113 THR H . . 4.720 3.843 3.391 4.286 . 0 0 "[ . 1 . 2]" 1
507 1 35 GLY QA 1 113 THR MG . . 3.090 2.325 1.963 2.538 . 0 0 "[ . 1 . 2]" 1
508 1 35 GLY HA2 1 36 VAL H . . 3.240 2.299 2.140 2.338 . 0 0 "[ . 1 . 2]" 1
509 1 35 GLY HA2 1 36 VAL MG2 . . 4.990 3.718 3.568 3.893 . 0 0 "[ . 1 . 2]" 1
510 1 35 GLY HA2 1 113 THR MG . . 3.580 3.419 2.777 3.582 0.002 4 0 "[ . 1 . 2]" 1
511 1 35 GLY HA3 1 36 VAL H . . 3.240 2.884 2.818 3.219 . 0 0 "[ . 1 . 2]" 1
512 1 35 GLY HA3 1 36 VAL MG2 . . 4.990 4.562 4.464 4.795 . 0 0 "[ . 1 . 2]" 1
513 1 35 GLY HA3 1 113 THR MG . . 3.580 2.376 1.983 2.654 . 0 0 "[ . 1 . 2]" 1
514 1 36 VAL H 1 36 VAL HB . . 3.830 3.769 3.733 3.816 . 0 0 "[ . 1 . 2]" 1
515 1 36 VAL H 1 36 VAL MG1 . . 3.740 2.888 2.780 3.056 . 0 0 "[ . 1 . 2]" 1
516 1 36 VAL H 1 36 VAL MG2 . . 3.120 2.032 1.879 2.309 . 0 0 "[ . 1 . 2]" 1
517 1 36 VAL H 1 37 PRO QD . . 5.350 4.354 4.320 4.368 . 0 0 "[ . 1 . 2]" 1
518 1 36 VAL H 1 111 ARG H . . 4.640 3.975 3.749 4.399 . 0 0 "[ . 1 . 2]" 1
519 1 36 VAL H 1 112 ALA HA . . 3.430 2.786 2.311 3.201 . 0 0 "[ . 1 . 2]" 1
520 1 36 VAL H 1 112 ALA MB . . 4.820 4.320 3.946 4.698 . 0 0 "[ . 1 . 2]" 1
521 1 36 VAL H 1 113 THR H . . 3.450 2.952 2.540 3.417 . 0 0 "[ . 1 . 2]" 1
522 1 36 VAL H 1 113 THR MG . . 3.920 3.136 2.705 3.451 . 0 0 "[ . 1 . 2]" 1
523 1 36 VAL HA 1 36 VAL MG1 . . 3.320 2.310 2.236 2.399 . 0 0 "[ . 1 . 2]" 1
524 1 36 VAL HA 1 37 PRO HD2 . . 3.470 2.330 2.249 2.374 . 0 0 "[ . 1 . 2]" 1
525 1 36 VAL HA 1 37 PRO QD . . 2.990 2.051 2.008 2.075 . 0 0 "[ . 1 . 2]" 1
526 1 36 VAL HA 1 37 PRO HD3 . . 3.470 2.277 2.259 2.290 . 0 0 "[ . 1 . 2]" 1
527 1 36 VAL HA 1 37 PRO HG2 . . 4.720 4.456 4.391 4.492 . 0 0 "[ . 1 . 2]" 1
528 1 36 VAL HA 1 37 PRO QG . . 4.140 3.959 3.911 3.986 . 0 0 "[ . 1 . 2]" 1
529 1 36 VAL HA 1 37 PRO HG3 . . 4.720 4.432 4.390 4.456 . 0 0 "[ . 1 . 2]" 1
530 1 36 VAL HB 1 37 PRO HD2 . . 4.010 2.097 2.001 2.280 . 0 0 "[ . 1 . 2]" 1
531 1 36 VAL HB 1 37 PRO QD . . 3.370 2.082 1.988 2.260 . 0 0 "[ . 1 . 2]" 1
532 1 36 VAL HB 1 37 PRO HD3 . . 4.010 3.535 3.451 3.692 . 0 0 "[ . 1 . 2]" 1
533 1 36 VAL HB 1 42 VAL MG1 . . 3.860 3.008 2.763 3.424 . 0 0 "[ . 1 . 2]" 1
534 1 36 VAL HB 1 112 ALA HA . . 4.640 4.551 4.282 4.654 0.014 3 0 "[ . 1 . 2]" 1
535 1 36 VAL MG1 1 37 PRO HD2 . . 4.150 3.123 2.966 3.256 . 0 0 "[ . 1 . 2]" 1
536 1 36 VAL MG1 1 37 PRO HD3 . . 4.150 3.895 3.727 3.995 . 0 0 "[ . 1 . 2]" 1
537 1 36 VAL MG1 1 42 VAL MG1 . . 3.470 2.952 2.610 3.457 . 0 0 "[ . 1 . 2]" 1
538 1 36 VAL MG1 1 42 VAL MG2 . . 3.280 3.131 2.780 3.281 0.001 4 0 "[ . 1 . 2]" 1
539 1 36 VAL MG2 1 37 PRO QD . . 4.150 3.508 3.435 3.631 . 0 0 "[ . 1 . 2]" 1
540 1 36 VAL MG2 1 84 TYR QE . . 4.460 3.200 2.785 3.674 . 0 0 "[ . 1 . 2]" 1
541 1 36 VAL MG2 1 86 PRO QD . . 4.640 4.096 3.661 4.517 . 0 0 "[ . 1 . 2]" 1
542 1 36 VAL MG2 1 86 PRO HG2 . . 4.210 3.836 3.561 4.160 . 0 0 "[ . 1 . 2]" 1
543 1 36 VAL MG2 1 86 PRO QG . . 3.530 2.665 2.268 3.101 . 0 0 "[ . 1 . 2]" 1
544 1 36 VAL MG2 1 86 PRO HG3 . . 4.210 2.722 2.293 3.202 . 0 0 "[ . 1 . 2]" 1
545 1 36 VAL MG2 1 111 ARG H . . 4.400 3.813 3.445 4.061 . 0 0 "[ . 1 . 2]" 1
546 1 36 VAL MG2 1 112 ALA HA . . 3.470 2.007 1.918 2.172 . 0 0 "[ . 1 . 2]" 1
547 1 36 VAL MG2 1 112 ALA MB . . 3.420 2.635 2.303 2.846 . 0 0 "[ . 1 . 2]" 1
548 1 36 VAL MG2 1 113 THR H . . 3.830 3.277 3.027 3.610 . 0 0 "[ . 1 . 2]" 1
549 1 37 PRO HA 1 38 ALA H . . 2.800 2.157 2.151 2.165 . 0 0 "[ . 1 . 2]" 1
550 1 37 PRO HB2 1 38 ALA H . . 4.000 3.737 3.570 3.813 . 0 0 "[ . 1 . 2]" 1
551 1 37 PRO HB2 1 40 LEU H . . 4.940 4.688 4.202 4.937 . 0 0 "[ . 1 . 2]" 1
552 1 37 PRO HB2 1 40 LEU QB . . 3.600 2.262 2.035 2.429 . 0 0 "[ . 1 . 2]" 1
553 1 37 PRO HB3 1 38 ALA H . . 4.190 4.143 4.026 4.197 0.007 17 0 "[ . 1 . 2]" 1
554 1 37 PRO QG 1 40 LEU QB . . 4.260 2.117 1.990 2.375 . 0 0 "[ . 1 . 2]" 1
555 1 38 ALA H 1 38 ALA MB . . 2.950 2.139 2.036 2.235 . 0 0 "[ . 1 . 2]" 1
556 1 38 ALA H 1 112 ALA HA . . 5.050 4.602 4.296 4.868 . 0 0 "[ . 1 . 2]" 1
557 1 38 ALA H 1 112 ALA MB . . 4.250 3.817 3.259 4.247 . 0 0 "[ . 1 . 2]" 1
558 1 38 ALA H 1 113 THR H . . 4.170 3.882 3.142 4.172 0.002 14 0 "[ . 1 . 2]" 1
559 1 38 ALA H 1 114 GLN HA . . 3.640 3.382 2.970 3.644 0.004 6 0 "[ . 1 . 2]" 1
560 1 38 ALA HA 1 39 SER H . . 3.100 2.370 2.200 2.509 . 0 0 "[ . 1 . 2]" 1
561 1 38 ALA HA 1 39 SER HA . . 4.540 4.455 4.410 4.500 . 0 0 "[ . 1 . 2]" 1
562 1 38 ALA HA 1 40 LEU H . . 3.780 3.478 3.249 3.621 . 0 0 "[ . 1 . 2]" 1
563 1 38 ALA HA 1 86 PRO QB . . 4.350 3.369 3.044 3.733 . 0 0 "[ . 1 . 2]" 1
564 1 38 ALA HA 1 86 PRO HG2 . . 4.260 2.437 2.145 2.724 . 0 0 "[ . 1 . 2]" 1
565 1 38 ALA HA 1 86 PRO QG . . 3.670 2.398 2.121 2.677 . 0 0 "[ . 1 . 2]" 1
566 1 38 ALA HA 1 86 PRO HG3 . . 4.260 3.586 3.089 3.932 . 0 0 "[ . 1 . 2]" 1
567 1 38 ALA HA 1 112 ALA MB . . 3.770 2.822 2.447 3.072 . 0 0 "[ . 1 . 2]" 1
568 1 38 ALA MB 1 39 SER H . . 3.460 2.527 2.298 2.878 . 0 0 "[ . 1 . 2]" 1
569 1 38 ALA MB 1 40 LEU H . . 4.680 4.407 4.201 4.559 . 0 0 "[ . 1 . 2]" 1
570 1 38 ALA MB 1 112 ALA HA . . 4.770 4.230 3.787 4.590 . 0 0 "[ . 1 . 2]" 1
571 1 38 ALA MB 1 112 ALA MB . . 3.190 2.480 2.051 3.080 . 0 0 "[ . 1 . 2]" 1
572 1 38 ALA MB 1 114 GLN HA . . 3.570 2.514 1.961 3.348 . 0 0 "[ . 1 . 2]" 1
573 1 39 SER H 1 39 SER QB . . 3.660 2.972 2.716 3.320 . 0 0 "[ . 1 . 2]" 1
574 1 39 SER H 1 40 LEU H . . 3.440 2.882 2.538 3.022 . 0 0 "[ . 1 . 2]" 1
575 1 39 SER H 1 85 ILE MG . . 4.270 4.044 3.660 4.262 . 0 0 "[ . 1 . 2]" 1
576 1 39 SER H 1 86 PRO QB . . 4.490 3.738 3.326 3.946 . 0 0 "[ . 1 . 2]" 1
577 1 39 SER H 1 86 PRO QD . . 5.200 4.100 3.609 4.274 . 0 0 "[ . 1 . 2]" 1
578 1 39 SER H 1 86 PRO HG2 . . 4.720 2.848 2.306 2.984 . 0 0 "[ . 1 . 2]" 1
579 1 39 SER H 1 86 PRO QG . . 3.910 2.821 2.294 2.953 . 0 0 "[ . 1 . 2]" 1
580 1 39 SER H 1 86 PRO HG3 . . 4.720 4.590 4.058 4.736 0.016 19 0 "[ . 1 . 2]" 1
581 1 39 SER H 1 87 ASP HA . . 4.240 3.744 3.058 4.199 . 0 0 "[ . 1 . 2]" 1
582 1 39 SER H 1 112 ALA MB . . 4.640 4.374 4.046 4.637 . 0 0 "[ . 1 . 2]" 1
583 1 39 SER HA 1 40 LEU H . . 3.570 2.817 2.728 2.973 . 0 0 "[ . 1 . 2]" 1
584 1 39 SER HA 1 85 ILE MG . . 3.600 2.800 2.573 3.051 . 0 0 "[ . 1 . 2]" 1
585 1 39 SER HA 1 87 ASP HA . . 4.000 3.511 2.994 3.883 . 0 0 "[ . 1 . 2]" 1
586 1 40 LEU H 1 40 LEU QB . . 3.000 2.609 2.399 2.688 . 0 0 "[ . 1 . 2]" 1
587 1 40 LEU H 1 40 LEU MD1 . . 5.040 4.176 4.007 4.259 . 0 0 "[ . 1 . 2]" 1
588 1 40 LEU H 1 40 LEU QD . . 4.330 3.595 2.912 3.761 . 0 0 "[ . 1 . 2]" 1
589 1 40 LEU H 1 40 LEU MD2 . . 5.040 3.991 2.969 4.283 . 0 0 "[ . 1 . 2]" 1
590 1 40 LEU H 1 41 PRO HD2 . . 4.980 4.735 4.653 4.826 . 0 0 "[ . 1 . 2]" 1
591 1 40 LEU H 1 85 ILE HA . . 4.370 4.021 3.728 4.361 . 0 0 "[ . 1 . 2]" 1
592 1 40 LEU H 1 85 ILE MG . . 3.840 3.206 2.831 3.565 . 0 0 "[ . 1 . 2]" 1
593 1 40 LEU H 1 86 PRO QD . . 3.570 2.743 2.402 3.102 . 0 0 "[ . 1 . 2]" 1
594 1 40 LEU H 1 86 PRO QG . . 4.170 2.837 2.561 3.199 . 0 0 "[ . 1 . 2]" 1
595 1 40 LEU HA 1 40 LEU MD1 . . 4.210 2.618 1.971 2.866 . 0 0 "[ . 1 . 2]" 1
596 1 40 LEU HA 1 40 LEU QD . . 2.960 1.951 1.897 2.130 . 0 0 "[ . 1 . 2]" 1
597 1 40 LEU HA 1 40 LEU MD2 . . 4.210 2.076 1.946 2.474 . 0 0 "[ . 1 . 2]" 1
598 1 40 LEU HA 1 40 LEU HG . . 3.870 3.698 3.657 3.769 . 0 0 "[ . 1 . 2]" 1
599 1 40 LEU HA 1 41 PRO HD2 . . 3.340 2.037 1.966 2.153 . 0 0 "[ . 1 . 2]" 1
600 1 40 LEU HA 1 41 PRO HD3 . . 3.280 2.287 2.254 2.335 . 0 0 "[ . 1 . 2]" 1
601 1 40 LEU HA 1 41 PRO HG2 . . 4.500 4.223 4.165 4.314 . 0 0 "[ . 1 . 2]" 1
602 1 40 LEU HA 1 41 PRO QG . . 3.960 3.804 3.774 3.859 . 0 0 "[ . 1 . 2]" 1
603 1 40 LEU HA 1 41 PRO HG3 . . 4.500 4.321 4.315 4.349 . 0 0 "[ . 1 . 2]" 1
604 1 40 LEU QB 1 40 LEU QD . . 2.700 2.011 1.970 2.046 . 0 0 "[ . 1 . 2]" 1
605 1 40 LEU QB 1 41 PRO HD2 . . 3.790 3.515 2.806 3.745 . 0 0 "[ . 1 . 2]" 1
606 1 40 LEU QB 1 41 PRO HD3 . . 4.420 4.294 3.939 4.402 . 0 0 "[ . 1 . 2]" 1
607 1 40 LEU QB 1 86 PRO QD . . 5.180 4.080 3.838 4.436 . 0 0 "[ . 1 . 2]" 1
608 1 40 LEU HB2 1 41 PRO HD2 . . 4.320 4.115 3.911 4.252 . 0 0 "[ . 1 . 2]" 1
609 1 40 LEU HB2 1 41 PRO HD3 . . 5.070 4.890 4.742 5.042 . 0 0 "[ . 1 . 2]" 1
610 1 40 LEU HB3 1 41 PRO HD2 . . 4.320 3.886 2.852 4.214 . 0 0 "[ . 1 . 2]" 1
611 1 40 LEU HB3 1 41 PRO HD3 . . 5.070 4.791 4.122 4.979 . 0 0 "[ . 1 . 2]" 1
612 1 40 LEU QD 1 41 PRO HD2 . . 3.170 1.761 1.699 1.944 . 0 0 "[ . 1 . 2]" 1
613 1 40 LEU QD 1 41 PRO HD3 . . 3.370 2.906 2.774 3.029 . 0 0 "[ . 1 . 2]" 1
614 1 40 LEU MD1 1 41 PRO HD2 . . 4.040 1.940 1.855 1.988 . 0 0 "[ . 1 . 2]" 1
615 1 40 LEU MD1 1 41 PRO HD3 . . 4.270 3.279 2.897 3.445 . 0 0 "[ . 1 . 2]" 1
616 1 40 LEU MD2 1 41 PRO HD2 . . 4.040 2.252 1.851 3.895 . 0 0 "[ . 1 . 2]" 1
617 1 40 LEU MD2 1 41 PRO HD3 . . 4.270 3.363 3.032 4.283 0.013 9 0 "[ . 1 . 2]" 1
618 1 41 PRO HA 1 42 VAL H . . 2.990 2.247 2.217 2.262 . 0 0 "[ . 1 . 2]" 1
619 1 41 PRO HA 1 83 THR MG . . 3.750 3.205 3.019 3.439 . 0 0 "[ . 1 . 2]" 1
620 1 41 PRO HA 1 84 TYR H . . 4.330 4.029 3.721 4.294 . 0 0 "[ . 1 . 2]" 1
621 1 41 PRO HA 1 85 ILE HB . . 4.670 4.574 4.345 4.677 0.007 19 0 "[ . 1 . 2]" 1
622 1 41 PRO HA 1 85 ILE MD . . 3.940 3.538 3.319 3.639 . 0 0 "[ . 1 . 2]" 1
623 1 41 PRO HA 1 85 ILE HG12 . . 4.000 2.175 2.007 2.337 . 0 0 "[ . 1 . 2]" 1
624 1 41 PRO HA 1 85 ILE HG13 . . 3.860 2.485 2.263 2.641 . 0 0 "[ . 1 . 2]" 1
625 1 41 PRO QB 1 42 VAL H . . 3.830 3.744 3.693 3.766 . 0 0 "[ . 1 . 2]" 1
626 1 41 PRO QB 1 83 THR MG . . 3.010 2.657 2.344 2.944 . 0 0 "[ . 1 . 2]" 1
627 1 41 PRO QB 1 85 ILE MD . . 3.480 2.347 2.084 2.595 . 0 0 "[ . 1 . 2]" 1
628 1 41 PRO QB 1 85 ILE HG12 . . 3.540 2.176 1.989 2.585 . 0 0 "[ . 1 . 2]" 1
629 1 41 PRO HB2 1 42 VAL H . . 4.380 4.062 4.000 4.087 . 0 0 "[ . 1 . 2]" 1
630 1 41 PRO HB2 1 83 THR MG . . 3.570 2.791 2.433 3.141 . 0 0 "[ . 1 . 2]" 1
631 1 41 PRO HB2 1 85 ILE MD . . 4.150 3.785 3.539 4.015 . 0 0 "[ . 1 . 2]" 1
632 1 41 PRO HB2 1 85 ILE HG12 . . 4.160 3.722 3.514 4.001 . 0 0 "[ . 1 . 2]" 1
633 1 41 PRO HB2 1 85 ILE HG13 . . 4.480 3.991 3.577 4.409 . 0 0 "[ . 1 . 2]" 1
634 1 41 PRO HB3 1 42 VAL H . . 4.380 4.387 4.338 4.408 0.028 9 0 "[ . 1 . 2]" 1
635 1 41 PRO HB3 1 83 THR MG . . 3.570 3.342 3.062 3.558 . 0 0 "[ . 1 . 2]" 1
636 1 41 PRO HB3 1 85 ILE MD . . 4.150 2.371 2.099 2.628 . 0 0 "[ . 1 . 2]" 1
637 1 41 PRO HB3 1 85 ILE HG12 . . 4.160 2.192 1.998 2.618 . 0 0 "[ . 1 . 2]" 1
638 1 41 PRO HB3 1 85 ILE HG13 . . 4.480 2.822 2.341 3.348 . 0 0 "[ . 1 . 2]" 1
639 1 41 PRO HD3 1 85 ILE HG12 . . 3.960 3.119 2.736 3.464 . 0 0 "[ . 1 . 2]" 1
640 1 41 PRO QG 1 85 ILE MD . . 4.700 3.615 3.228 4.060 . 0 0 "[ . 1 . 2]" 1
641 1 42 VAL H 1 42 VAL HB . . 3.830 2.986 2.890 3.117 . 0 0 "[ . 1 . 2]" 1
642 1 42 VAL H 1 42 VAL MG1 . . 3.390 2.064 1.895 2.239 . 0 0 "[ . 1 . 2]" 1
643 1 42 VAL H 1 42 VAL MG2 . . 3.880 3.841 3.783 3.872 . 0 0 "[ . 1 . 2]" 1
644 1 42 VAL H 1 43 ASP H . . 4.730 4.506 4.481 4.527 . 0 0 "[ . 1 . 2]" 1
645 1 42 VAL H 1 83 THR HA . . 5.020 4.797 4.639 4.984 . 0 0 "[ . 1 . 2]" 1
646 1 42 VAL H 1 83 THR MG . . 3.740 3.443 3.185 3.734 . 0 0 "[ . 1 . 2]" 1
647 1 42 VAL H 1 85 ILE HA . . 3.580 3.497 3.233 3.586 0.006 12 0 "[ . 1 . 2]" 1
648 1 42 VAL H 1 85 ILE HG13 . . 4.230 4.169 3.898 4.239 0.009 6 0 "[ . 1 . 2]" 1
649 1 42 VAL H 1 86 PRO HD2 . . 4.980 3.776 3.586 3.882 . 0 0 "[ . 1 . 2]" 1
650 1 42 VAL H 1 86 PRO QD . . 4.340 3.387 3.124 3.488 . 0 0 "[ . 1 . 2]" 1
651 1 42 VAL H 1 86 PRO HD3 . . 4.980 3.836 3.387 4.018 . 0 0 "[ . 1 . 2]" 1
652 1 42 VAL HA 1 42 VAL MG1 . . 3.720 3.194 3.184 3.204 . 0 0 "[ . 1 . 2]" 1
653 1 42 VAL HA 1 42 VAL MG2 . . 3.200 2.359 2.237 2.468 . 0 0 "[ . 1 . 2]" 1
654 1 42 VAL HA 1 43 ASP H . . 2.940 2.238 2.200 2.297 . 0 0 "[ . 1 . 2]" 1
655 1 42 VAL HA 1 43 ASP HA . . 4.780 4.437 4.416 4.460 . 0 0 "[ . 1 . 2]" 1
656 1 42 VAL HB 1 43 ASP H . . 4.300 3.992 3.788 4.087 . 0 0 "[ . 1 . 2]" 1
657 1 42 VAL MG1 1 43 ASP H . . 4.210 3.764 3.515 3.923 . 0 0 "[ . 1 . 2]" 1
658 1 42 VAL MG1 1 44 PHE QD . . 4.690 4.247 3.968 4.464 . 0 0 "[ . 1 . 2]" 1
659 1 42 VAL MG1 1 84 TYR H . . 4.120 3.302 2.887 3.669 . 0 0 "[ . 1 . 2]" 1
660 1 42 VAL MG1 1 84 TYR QD . . 4.290 3.023 2.774 3.219 . 0 0 "[ . 1 . 2]" 1
661 1 42 VAL MG1 1 84 TYR QE . . 3.800 2.275 2.110 2.464 . 0 0 "[ . 1 . 2]" 1
662 1 42 VAL MG1 1 86 PRO HD2 . . 4.090 3.531 3.209 3.803 . 0 0 "[ . 1 . 2]" 1
663 1 42 VAL MG1 1 86 PRO QD . . 3.430 2.863 2.649 3.009 . 0 0 "[ . 1 . 2]" 1
664 1 42 VAL MG1 1 86 PRO HD3 . . 4.090 3.033 2.772 3.215 . 0 0 "[ . 1 . 2]" 1
665 1 42 VAL MG1 1 86 PRO HG2 . . 4.670 4.447 4.088 4.642 . 0 0 "[ . 1 . 2]" 1
666 1 42 VAL MG1 1 86 PRO QG . . 3.960 3.352 3.063 3.514 . 0 0 "[ . 1 . 2]" 1
667 1 42 VAL MG1 1 86 PRO HG3 . . 4.670 3.469 3.164 3.640 . 0 0 "[ . 1 . 2]" 1
668 1 42 VAL MG2 1 43 ASP H . . 3.250 2.064 1.885 2.236 . 0 0 "[ . 1 . 2]" 1
669 1 42 VAL MG2 1 43 ASP HA . . 4.890 3.470 3.229 3.708 . 0 0 "[ . 1 . 2]" 1
670 1 42 VAL MG2 1 44 PHE H . . 4.810 4.440 4.211 4.740 . 0 0 "[ . 1 . 2]" 1
671 1 42 VAL MG2 1 44 PHE QD . . 4.470 4.059 3.578 4.279 . 0 0 "[ . 1 . 2]" 1
672 1 42 VAL MG2 1 84 TYR H . . 5.120 4.882 4.660 5.113 . 0 0 "[ . 1 . 2]" 1
673 1 42 VAL MG2 1 84 TYR QD . . 4.660 4.484 4.202 4.640 . 0 0 "[ . 1 . 2]" 1
674 1 42 VAL MG2 1 84 TYR QE . . 4.970 3.442 3.132 3.694 . 0 0 "[ . 1 . 2]" 1
675 1 43 ASP H 1 43 ASP HB2 . . 3.920 3.837 3.715 3.934 0.014 9 0 "[ . 1 . 2]" 1
676 1 43 ASP H 1 43 ASP QB . . 3.420 3.118 3.012 3.234 . 0 0 "[ . 1 . 2]" 1
677 1 43 ASP H 1 43 ASP HB3 . . 3.920 3.305 3.132 3.502 . 0 0 "[ . 1 . 2]" 1
678 1 43 ASP H 1 44 PHE H . . 4.430 4.375 4.330 4.439 0.009 14 0 "[ . 1 . 2]" 1
679 1 43 ASP HA 1 44 PHE H . . 2.930 2.239 2.180 2.362 . 0 0 "[ . 1 . 2]" 1
680 1 43 ASP HA 1 44 PHE HA . . 4.850 4.384 4.371 4.428 . 0 0 "[ . 1 . 2]" 1
681 1 43 ASP HA 1 44 PHE QD . . 4.970 3.268 2.956 3.570 . 0 0 "[ . 1 . 2]" 1
682 1 43 ASP HA 1 82 VAL H . . 4.480 4.099 3.860 4.282 . 0 0 "[ . 1 . 2]" 1
683 1 43 ASP HA 1 83 THR HA . . 3.470 2.436 2.262 2.747 . 0 0 "[ . 1 . 2]" 1
684 1 43 ASP HA 1 83 THR MG . . 4.330 3.873 3.417 4.122 . 0 0 "[ . 1 . 2]" 1
685 1 43 ASP HA 1 84 TYR H . . 4.030 3.629 3.462 3.778 . 0 0 "[ . 1 . 2]" 1
686 1 43 ASP QB 1 44 PHE H . . 3.350 2.834 2.493 3.024 . 0 0 "[ . 1 . 2]" 1
687 1 43 ASP QB 1 83 THR MG . . 4.510 2.612 2.341 2.912 . 0 0 "[ . 1 . 2]" 1
688 1 43 ASP HB2 1 44 PHE H . . 4.190 2.904 2.530 3.115 . 0 0 "[ . 1 . 2]" 1
689 1 43 ASP HB2 1 82 VAL H . . 4.770 3.022 2.751 3.253 . 0 0 "[ . 1 . 2]" 1
690 1 43 ASP HB2 1 83 THR HA . . 4.720 3.154 2.533 3.527 . 0 0 "[ . 1 . 2]" 1
691 1 43 ASP HB3 1 44 PHE H . . 4.190 3.969 3.728 4.159 . 0 0 "[ . 1 . 2]" 1
692 1 43 ASP HB3 1 82 VAL H . . 4.770 4.424 4.139 4.727 . 0 0 "[ . 1 . 2]" 1
693 1 43 ASP HB3 1 83 THR HA . . 4.720 2.140 2.006 2.472 . 0 0 "[ . 1 . 2]" 1
694 1 44 PHE H 1 44 PHE HB3 . . 3.410 3.156 3.028 3.302 . 0 0 "[ . 1 . 2]" 1
695 1 44 PHE H 1 44 PHE QD . . 3.970 2.462 2.200 2.770 . 0 0 "[ . 1 . 2]" 1
696 1 44 PHE H 1 45 ALA H . . 4.740 4.449 4.414 4.495 . 0 0 "[ . 1 . 2]" 1
697 1 44 PHE H 1 81 ALA MB . . 4.860 4.580 4.202 4.813 . 0 0 "[ . 1 . 2]" 1
698 1 44 PHE H 1 82 VAL H . . 3.460 2.917 2.629 3.182 . 0 0 "[ . 1 . 2]" 1
699 1 44 PHE H 1 82 VAL HB . . 3.890 3.719 3.568 3.831 . 0 0 "[ . 1 . 2]" 1
700 1 44 PHE H 1 82 VAL MG2 . . 4.940 4.771 4.628 4.900 . 0 0 "[ . 1 . 2]" 1
701 1 44 PHE H 1 83 THR HA . . 4.500 4.192 3.968 4.452 . 0 0 "[ . 1 . 2]" 1
702 1 44 PHE HA 1 44 PHE QD . . 4.350 3.677 3.588 3.712 . 0 0 "[ . 1 . 2]" 1
703 1 44 PHE HA 1 45 ALA H . . 3.110 2.600 2.504 2.654 . 0 0 "[ . 1 . 2]" 1
704 1 44 PHE HB2 1 45 ALA H . . 3.490 2.022 1.927 2.221 . 0 0 "[ . 1 . 2]" 1
705 1 44 PHE HB3 1 45 ALA H . . 3.690 3.423 3.372 3.502 . 0 0 "[ . 1 . 2]" 1
706 1 44 PHE QD 1 45 ALA H . . 3.800 3.230 2.947 3.724 . 0 0 "[ . 1 . 2]" 1
707 1 44 PHE QD 1 46 ILE MD . . 4.600 3.448 2.968 3.675 . 0 0 "[ . 1 . 2]" 1
708 1 44 PHE QD 1 46 ILE HG12 . . 4.230 3.333 3.151 3.569 . 0 0 "[ . 1 . 2]" 1
709 1 44 PHE QD 1 46 ILE QG . . 3.690 2.441 2.359 2.571 . 0 0 "[ . 1 . 2]" 1
710 1 44 PHE QD 1 46 ILE HG13 . . 4.230 2.514 2.401 2.677 . 0 0 "[ . 1 . 2]" 1
711 1 44 PHE QD 1 82 VAL H . . 4.930 4.182 3.983 4.315 . 0 0 "[ . 1 . 2]" 1
712 1 44 PHE QD 1 82 VAL HB . . 4.250 3.841 3.714 3.995 . 0 0 "[ . 1 . 2]" 1
713 1 44 PHE QD 1 82 VAL MG2 . . 4.290 4.179 3.906 4.296 0.006 3 0 "[ . 1 . 2]" 1
714 1 44 PHE QD 1 84 TYR QD . . 4.380 3.420 3.084 3.744 . 0 0 "[ . 1 . 2]" 1
715 1 44 PHE QD 1 84 TYR QE . . 3.590 3.234 2.923 3.516 . 0 0 "[ . 1 . 2]" 1
716 1 44 PHE QE 1 46 ILE MD . . 3.280 2.118 1.977 2.379 . 0 0 "[ . 1 . 2]" 1
717 1 44 PHE QE 1 46 ILE HG12 . . 4.460 3.091 2.746 3.627 . 0 0 "[ . 1 . 2]" 1
718 1 44 PHE QE 1 46 ILE QG . . 3.860 2.657 2.353 3.197 . 0 0 "[ . 1 . 2]" 1
719 1 44 PHE QE 1 46 ILE HG13 . . 4.460 2.911 2.513 3.553 . 0 0 "[ . 1 . 2]" 1
720 1 44 PHE QE 1 60 ILE MD . . 4.310 3.835 3.503 4.190 . 0 0 "[ . 1 . 2]" 1
721 1 44 PHE QE 1 82 VAL H . . 5.390 4.402 4.147 4.520 . 0 0 "[ . 1 . 2]" 1
722 1 44 PHE QE 1 82 VAL HB . . 4.210 2.858 2.744 2.974 . 0 0 "[ . 1 . 2]" 1
723 1 44 PHE QE 1 82 VAL MG1 . . 3.580 3.016 2.774 3.212 . 0 0 "[ . 1 . 2]" 1
724 1 44 PHE QE 1 82 VAL MG2 . . 3.830 2.960 2.634 3.177 . 0 0 "[ . 1 . 2]" 1
725 1 44 PHE QE 1 84 TYR QD . . 4.030 2.775 2.390 3.177 . 0 0 "[ . 1 . 2]" 1
726 1 44 PHE QE 1 84 TYR QE . . 4.010 3.768 3.388 3.965 . 0 0 "[ . 1 . 2]" 1
727 1 44 PHE QE 1 94 ILE MD . . 3.700 3.521 3.313 3.705 0.005 3 0 "[ . 1 . 2]" 1
728 1 44 PHE QE 1 96 VAL MG2 . . 3.790 3.580 3.252 3.769 . 0 0 "[ . 1 . 2]" 1
729 1 44 PHE HZ 1 46 ILE MD . . 4.260 3.869 3.532 4.097 . 0 0 "[ . 1 . 2]" 1
730 1 44 PHE HZ 1 58 VAL MG1 . . 3.960 3.191 2.342 3.961 0.001 18 0 "[ . 1 . 2]" 1
731 1 44 PHE HZ 1 58 VAL QG . . 3.410 2.740 2.213 3.273 . 0 0 "[ . 1 . 2]" 1
732 1 44 PHE HZ 1 58 VAL MG2 . . 3.960 3.149 2.498 3.747 . 0 0 "[ . 1 . 2]" 1
733 1 44 PHE HZ 1 82 VAL HB . . 4.680 2.544 2.417 2.658 . 0 0 "[ . 1 . 2]" 1
734 1 44 PHE HZ 1 82 VAL MG1 . . 3.920 2.722 2.371 3.164 . 0 0 "[ . 1 . 2]" 1
735 1 44 PHE HZ 1 82 VAL MG2 . . 3.890 3.067 2.748 3.322 . 0 0 "[ . 1 . 2]" 1
736 1 44 PHE HZ 1 94 ILE MG . . 3.900 3.635 3.449 3.837 . 0 0 "[ . 1 . 2]" 1
737 1 44 PHE HZ 1 96 VAL MG2 . . 4.040 3.829 3.546 4.024 . 0 0 "[ . 1 . 2]" 1
738 1 45 ALA H 1 45 ALA MB . . 3.210 2.515 2.411 2.593 . 0 0 "[ . 1 . 2]" 1
739 1 45 ALA H 1 46 ILE H . . 4.660 4.326 4.228 4.426 . 0 0 "[ . 1 . 2]" 1
740 1 45 ALA HA 1 46 ILE H . . 2.860 2.163 2.145 2.195 . 0 0 "[ . 1 . 2]" 1
741 1 45 ALA HA 1 46 ILE HA . . 4.990 4.384 4.379 4.395 . 0 0 "[ . 1 . 2]" 1
742 1 45 ALA HA 1 46 ILE HB . . 4.950 4.640 4.596 4.680 . 0 0 "[ . 1 . 2]" 1
743 1 45 ALA HA 1 46 ILE MD . . 4.870 4.595 4.468 4.803 . 0 0 "[ . 1 . 2]" 1
744 1 45 ALA HA 1 80 TYR H . . 4.620 4.130 3.731 4.445 . 0 0 "[ . 1 . 2]" 1
745 1 45 ALA HA 1 81 ALA HA . . 3.610 2.824 2.605 3.023 . 0 0 "[ . 1 . 2]" 1
746 1 45 ALA HA 1 81 ALA MB . . 3.970 3.603 3.325 3.858 . 0 0 "[ . 1 . 2]" 1
747 1 45 ALA HA 1 82 VAL H . . 4.420 4.314 4.167 4.423 0.003 19 0 "[ . 1 . 2]" 1
748 1 45 ALA MB 1 46 ILE H . . 3.180 3.045 2.899 3.160 . 0 0 "[ . 1 . 2]" 1
749 1 45 ALA MB 1 80 TYR H . . 4.480 4.186 3.813 4.467 . 0 0 "[ . 1 . 2]" 1
750 1 46 ILE H 1 46 ILE HB . . 3.540 2.573 2.526 2.642 . 0 0 "[ . 1 . 2]" 1
751 1 46 ILE H 1 46 ILE MD . . 3.980 3.491 3.291 3.653 . 0 0 "[ . 1 . 2]" 1
752 1 46 ILE H 1 46 ILE HG12 . . 4.290 3.952 3.816 4.126 . 0 0 "[ . 1 . 2]" 1
753 1 46 ILE H 1 46 ILE QG . . 3.770 2.534 2.429 2.741 . 0 0 "[ . 1 . 2]" 1
754 1 46 ILE H 1 46 ILE HG13 . . 4.290 2.564 2.455 2.783 . 0 0 "[ . 1 . 2]" 1
755 1 46 ILE H 1 46 ILE MG . . 3.840 3.821 3.796 3.850 0.010 9 0 "[ . 1 . 2]" 1
756 1 46 ILE H 1 47 ASP H . . 4.650 4.197 4.007 4.321 . 0 0 "[ . 1 . 2]" 1
757 1 46 ILE H 1 79 THR HA . . 5.500 4.622 4.406 4.838 . 0 0 "[ . 1 . 2]" 1
758 1 46 ILE H 1 79 THR HB . . 4.860 3.653 3.378 3.993 . 0 0 "[ . 1 . 2]" 1
759 1 46 ILE H 1 80 TYR H . . 3.680 2.564 2.392 2.751 . 0 0 "[ . 1 . 2]" 1
760 1 46 ILE H 1 80 TYR HB2 . . 4.170 3.671 3.331 3.895 . 0 0 "[ . 1 . 2]" 1
761 1 46 ILE H 1 80 TYR HB3 . . 5.080 4.831 4.482 5.015 . 0 0 "[ . 1 . 2]" 1
762 1 46 ILE H 1 80 TYR QD . . 4.970 4.787 4.156 4.973 0.003 1 0 "[ . 1 . 2]" 1
763 1 46 ILE H 1 81 ALA HA . . 3.950 3.664 3.443 3.928 . 0 0 "[ . 1 . 2]" 1
764 1 46 ILE H 1 82 VAL MG2 . . 5.180 5.062 4.779 5.181 0.001 11 0 "[ . 1 . 2]" 1
765 1 46 ILE HA 1 46 ILE MD . . 4.050 3.896 3.882 3.917 . 0 0 "[ . 1 . 2]" 1
766 1 46 ILE HA 1 46 ILE QG . . 3.570 2.477 2.458 2.513 . 0 0 "[ . 1 . 2]" 1
767 1 46 ILE HA 1 46 ILE MG . . 3.450 2.330 2.257 2.441 . 0 0 "[ . 1 . 2]" 1
768 1 46 ILE HA 1 47 ASP H . . 3.310 2.168 2.145 2.197 . 0 0 "[ . 1 . 2]" 1
769 1 46 ILE HB 1 46 ILE MD . . 3.510 2.257 2.140 2.359 . 0 0 "[ . 1 . 2]" 1
770 1 46 ILE HB 1 47 ASP H . . 4.470 4.380 4.307 4.431 . 0 0 "[ . 1 . 2]" 1
771 1 46 ILE HB 1 56 LEU MD2 . . 4.190 3.810 3.394 4.192 0.002 5 0 "[ . 1 . 2]" 1
772 1 46 ILE HB 1 80 TYR H . . 4.140 2.870 2.512 3.205 . 0 0 "[ . 1 . 2]" 1
773 1 46 ILE HB 1 80 TYR HA . . 5.490 4.590 4.345 4.781 . 0 0 "[ . 1 . 2]" 1
774 1 46 ILE HB 1 80 TYR HB2 . . 3.730 2.142 2.003 2.345 . 0 0 "[ . 1 . 2]" 1
775 1 46 ILE HB 1 80 TYR HB3 . . 4.050 3.833 3.599 4.046 . 0 0 "[ . 1 . 2]" 1
776 1 46 ILE HB 1 80 TYR QD . . 3.830 2.901 2.608 3.220 . 0 0 "[ . 1 . 2]" 1
777 1 46 ILE MD 1 56 LEU MD2 . . 2.830 2.196 1.783 2.679 . 0 0 "[ . 1 . 2]" 1
778 1 46 ILE MD 1 80 TYR H . . 4.930 4.147 3.899 4.574 . 0 0 "[ . 1 . 2]" 1
779 1 46 ILE MD 1 80 TYR HA . . 4.790 4.504 4.289 4.797 0.007 3 0 "[ . 1 . 2]" 1
780 1 46 ILE MD 1 80 TYR HB2 . . 4.000 2.198 1.982 2.605 . 0 0 "[ . 1 . 2]" 1
781 1 46 ILE MD 1 80 TYR HB3 . . 3.910 2.922 2.669 3.279 . 0 0 "[ . 1 . 2]" 1
782 1 46 ILE MD 1 80 TYR QD . . 4.480 3.626 3.415 4.152 . 0 0 "[ . 1 . 2]" 1
783 1 46 ILE MD 1 82 VAL HB . . 4.340 3.931 3.535 4.239 . 0 0 "[ . 1 . 2]" 1
784 1 46 ILE MD 1 82 VAL MG2 . . 2.830 2.432 2.049 2.742 . 0 0 "[ . 1 . 2]" 1
785 1 46 ILE QG 1 46 ILE MG . . 2.950 2.165 2.014 2.274 . 0 0 "[ . 1 . 2]" 1
786 1 46 ILE HG12 1 46 ILE MG . . 3.480 2.206 2.039 2.329 . 0 0 "[ . 1 . 2]" 1
787 1 46 ILE HG13 1 46 ILE MG . . 3.480 3.161 3.128 3.187 . 0 0 "[ . 1 . 2]" 1
788 1 46 ILE MG 1 47 ASP H . . 3.470 3.055 2.813 3.237 . 0 0 "[ . 1 . 2]" 1
789 1 46 ILE MG 1 48 ALA H . . 4.600 4.066 3.776 4.216 . 0 0 "[ . 1 . 2]" 1
790 1 46 ILE MG 1 48 ALA MB . . 3.510 3.305 3.021 3.511 0.001 12 0 "[ . 1 . 2]" 1
791 1 46 ILE MG 1 80 TYR H . . 4.610 4.111 3.751 4.326 . 0 0 "[ . 1 . 2]" 1
792 1 46 ILE MG 1 80 TYR QD . . 3.270 2.950 2.639 3.280 0.010 3 0 "[ . 1 . 2]" 1
793 1 47 ASP H 1 47 ASP HB2 . . 3.790 2.914 2.242 3.671 . 0 0 "[ . 1 . 2]" 1
794 1 47 ASP H 1 47 ASP HB3 . . 3.790 3.085 2.359 3.734 . 0 0 "[ . 1 . 2]" 1
795 1 47 ASP H 1 48 ALA H . . 4.390 4.366 4.298 4.409 0.019 3 0 "[ . 1 . 2]" 1
796 1 47 ASP HA 1 48 ALA H . . 3.070 2.141 2.139 2.154 . 0 0 "[ . 1 . 2]" 1
797 1 47 ASP HA 1 79 THR HA . . 3.940 3.184 2.803 3.628 . 0 0 "[ . 1 . 2]" 1
798 1 47 ASP HA 1 79 THR HB . . 4.680 3.930 3.540 4.346 . 0 0 "[ . 1 . 2]" 1
799 1 47 ASP HA 1 79 THR MG . . 3.480 2.288 2.042 2.715 . 0 0 "[ . 1 . 2]" 1
800 1 47 ASP HA 1 80 TYR H . . 4.690 4.438 3.969 4.655 . 0 0 "[ . 1 . 2]" 1
801 1 47 ASP QB 1 48 ALA H . . 4.060 3.555 3.308 3.892 . 0 0 "[ . 1 . 2]" 1
802 1 47 ASP QB 1 79 THR MG . . 4.160 3.160 2.655 3.656 . 0 0 "[ . 1 . 2]" 1
803 1 47 ASP HB2 1 48 ALA H . . 4.740 4.122 3.488 4.532 . 0 0 "[ . 1 . 2]" 1
804 1 47 ASP HB3 1 48 ALA H . . 4.740 3.988 3.442 4.399 . 0 0 "[ . 1 . 2]" 1
805 1 48 ALA H 1 48 ALA MB . . 3.470 2.304 2.209 2.419 . 0 0 "[ . 1 . 2]" 1
806 1 48 ALA H 1 49 ARG H . . 4.410 4.389 4.358 4.427 0.017 18 0 "[ . 1 . 2]" 1
807 1 48 ALA H 1 79 THR HA . . 3.890 3.570 3.106 3.758 . 0 0 "[ . 1 . 2]" 1
808 1 48 ALA H 1 79 THR HB . . 5.500 5.336 4.887 5.503 0.003 20 0 "[ . 1 . 2]" 1
809 1 48 ALA H 1 79 THR MG . . 3.860 3.350 3.080 3.848 . 0 0 "[ . 1 . 2]" 1
810 1 48 ALA HA 1 50 ASP H . . 4.600 4.267 4.185 4.299 . 0 0 "[ . 1 . 2]" 1
811 1 48 ALA HA 1 51 ALA H . . 4.140 4.044 3.856 4.160 0.020 16 0 "[ . 1 . 2]" 1
812 1 48 ALA HA 1 51 ALA MB . . 3.700 3.133 2.980 3.316 . 0 0 "[ . 1 . 2]" 1
813 1 48 ALA MB 1 49 ARG H . . 4.180 3.166 3.124 3.192 . 0 0 "[ . 1 . 2]" 1
814 1 48 ALA MB 1 51 ALA H . . 4.120 2.760 2.628 2.967 . 0 0 "[ . 1 . 2]" 1
815 1 48 ALA MB 1 51 ALA HA . . 5.110 4.181 4.009 4.300 . 0 0 "[ . 1 . 2]" 1
816 1 48 ALA MB 1 79 THR HA . . 4.900 4.250 3.869 4.558 . 0 0 "[ . 1 . 2]" 1
817 1 48 ALA MB 1 80 TYR QD . . 4.440 4.063 3.448 4.431 . 0 0 "[ . 1 . 2]" 1
818 1 48 ALA MB 1 98 TYR QE . . 4.340 4.237 3.924 4.344 0.004 20 0 "[ . 1 . 2]" 1
819 1 49 ARG H 1 49 ARG HB2 . . 3.850 2.560 2.298 3.658 . 0 0 "[ . 1 . 2]" 1
820 1 49 ARG H 1 49 ARG QB . . 3.340 2.437 2.271 2.754 . 0 0 "[ . 1 . 2]" 1
821 1 49 ARG H 1 49 ARG HB3 . . 3.850 3.553 2.837 3.672 . 0 0 "[ . 1 . 2]" 1
822 1 49 ARG H 1 49 ARG HE . . 4.620 4.328 3.549 4.620 . 20 0 "[ . 1 . 2]" 1
823 1 49 ARG H 1 49 ARG HG2 . . 4.150 3.145 1.894 4.145 . 0 0 "[ . 1 . 2]" 1
824 1 49 ARG H 1 49 ARG QG . . 3.280 2.574 1.881 3.002 . 0 0 "[ . 1 . 2]" 1
825 1 49 ARG H 1 49 ARG HG3 . . 4.150 3.255 2.452 3.909 . 0 0 "[ . 1 . 2]" 1
826 1 49 ARG H 1 50 ASP H . . 3.660 2.426 2.378 2.439 . 0 0 "[ . 1 . 2]" 1
827 1 49 ARG H 1 51 ALA H . . 4.800 3.280 2.955 3.435 . 0 0 "[ . 1 . 2]" 1
828 1 49 ARG HA 1 49 ARG HD2 . . 4.840 4.035 2.287 4.786 . 0 0 "[ . 1 . 2]" 1
829 1 49 ARG HA 1 49 ARG QD . . 4.230 3.415 2.038 4.243 0.013 6 0 "[ . 1 . 2]" 1
830 1 49 ARG HA 1 49 ARG HD3 . . 4.840 3.919 2.049 4.786 . 0 0 "[ . 1 . 2]" 1
831 1 49 ARG HA 1 49 ARG HG2 . . 3.890 2.819 2.315 3.673 . 0 0 "[ . 1 . 2]" 1
832 1 49 ARG HA 1 49 ARG QG . . 3.370 2.668 2.270 3.343 . 0 0 "[ . 1 . 2]" 1
833 1 49 ARG HA 1 49 ARG HG3 . . 3.890 3.411 2.699 3.862 . 0 0 "[ . 1 . 2]" 1
834 1 49 ARG HA 1 51 ALA H . . 4.530 4.370 4.252 4.556 0.026 9 0 "[ . 1 . 2]" 1
835 1 49 ARG QB 1 49 ARG QD . . 3.110 2.219 2.034 2.915 . 0 0 "[ . 1 . 2]" 1
836 1 49 ARG QB 1 49 ARG HE . . 4.050 3.252 1.891 4.056 0.006 3 0 "[ . 1 . 2]" 1
837 1 49 ARG QB 1 50 ASP H . . 4.000 2.354 2.192 3.148 . 0 0 "[ . 1 . 2]" 1
838 1 49 ARG QB 1 50 ASP HB2 . . 4.780 3.491 3.271 4.292 . 0 0 "[ . 1 . 2]" 1
839 1 49 ARG HB2 1 49 ARG HE . . 4.690 3.779 2.210 4.653 . 0 0 "[ . 1 . 2]" 1
840 1 49 ARG HB2 1 50 ASP H . . 4.770 2.419 2.219 3.390 . 0 0 "[ . 1 . 2]" 1
841 1 49 ARG HB3 1 49 ARG HE . . 4.690 3.792 1.900 4.604 . 0 0 "[ . 1 . 2]" 1
842 1 49 ARG HB3 1 50 ASP H . . 4.770 3.333 3.076 3.736 . 0 0 "[ . 1 . 2]" 1
843 1 49 ARG QG 1 50 ASP H . . 4.890 3.754 1.761 4.151 . 0 0 "[ . 1 . 2]" 1
844 1 50 ASP H 1 50 ASP HB2 . . 3.420 2.608 2.452 2.762 . 0 0 "[ . 1 . 2]" 1
845 1 50 ASP H 1 50 ASP HB3 . . 3.700 3.285 2.910 3.681 . 0 0 "[ . 1 . 2]" 1
846 1 50 ASP H 1 51 ALA H . . 3.130 2.443 1.973 2.594 . 0 0 "[ . 1 . 2]" 1
847 1 50 ASP H 1 51 ALA HA . . 4.950 4.447 4.368 4.518 . 0 0 "[ . 1 . 2]" 1
848 1 50 ASP H 1 51 ALA MB . . 4.220 3.693 3.548 3.894 . 0 0 "[ . 1 . 2]" 1
849 1 50 ASP H 1 52 GLY H . . 4.630 4.538 4.081 4.644 0.014 16 0 "[ . 1 . 2]" 1
850 1 50 ASP HA 1 52 GLY H . . 3.890 3.219 2.920 3.582 . 0 0 "[ . 1 . 2]" 1
851 1 50 ASP HB2 1 51 ALA H . . 4.410 4.270 4.048 4.460 0.050 2 0 "[ . 1 . 2]" 1
852 1 50 ASP HB3 1 51 ALA H . . 4.510 4.145 3.458 4.376 . 0 0 "[ . 1 . 2]" 1
853 1 51 ALA H 1 51 ALA MB . . 3.040 2.170 2.085 2.338 . 0 0 "[ . 1 . 2]" 1
854 1 51 ALA H 1 52 GLY H . . 3.110 2.504 2.178 2.760 . 0 0 "[ . 1 . 2]" 1
855 1 51 ALA H 1 52 GLY QA . . 4.830 4.339 4.119 4.554 . 0 0 "[ . 1 . 2]" 1
856 1 51 ALA MB 1 52 GLY H . . 3.750 3.222 2.834 3.525 . 0 0 "[ . 1 . 2]" 1
857 1 51 ALA MB 1 98 TYR QD . . 4.200 3.661 3.306 3.872 . 0 0 "[ . 1 . 2]" 1
858 1 51 ALA MB 1 98 TYR QE . . 3.630 3.229 2.996 3.525 . 0 0 "[ . 1 . 2]" 1
859 1 52 GLY H 1 53 GLU H . . 4.680 4.608 4.548 4.642 . 0 0 "[ . 1 . 2]" 1
860 1 52 GLY QA 1 53 GLU H . . 2.810 2.150 2.113 2.191 . 0 0 "[ . 1 . 2]" 1
861 1 52 GLY HA2 1 53 GLU H . . 3.270 3.040 2.922 3.180 . 0 0 "[ . 1 . 2]" 1
862 1 52 GLY HA3 1 53 GLU H . . 3.270 2.201 2.145 2.263 . 0 0 "[ . 1 . 2]" 1
863 1 53 GLU H 1 53 GLU QB . . 3.110 2.547 2.353 3.032 . 0 0 "[ . 1 . 2]" 1
864 1 53 GLU H 1 53 GLU HG2 . . 4.830 4.055 2.078 4.738 . 0 0 "[ . 1 . 2]" 1
865 1 53 GLU H 1 53 GLU QG . . 3.970 3.515 2.064 4.017 0.047 12 0 "[ . 1 . 2]" 1
866 1 53 GLU H 1 53 GLU HG3 . . 4.830 4.118 3.369 4.629 . 0 0 "[ . 1 . 2]" 1
867 1 53 GLU H 1 54 GLY H . . 4.540 4.332 4.001 4.473 . 0 0 "[ . 1 . 2]" 1
868 1 53 GLU H 1 98 TYR QE . . 4.770 4.082 3.778 4.644 . 0 0 "[ . 1 . 2]" 1
869 1 53 GLU HA 1 53 GLU HG2 . . 4.110 3.257 2.406 3.879 . 0 0 "[ . 1 . 2]" 1
870 1 53 GLU HA 1 53 GLU HG3 . . 4.110 2.952 2.475 3.894 . 0 0 "[ . 1 . 2]" 1
871 1 53 GLU HA 1 54 GLY H . . 2.780 2.167 2.143 2.233 . 0 0 "[ . 1 . 2]" 1
872 1 53 GLU HA 1 98 TYR QE . . 4.840 3.395 2.785 4.013 . 0 0 "[ . 1 . 2]" 1
873 1 53 GLU QB 1 54 GLY H . . 3.780 3.537 3.050 3.779 . 0 0 "[ . 1 . 2]" 1
874 1 53 GLU QG 1 54 GLY H . . 4.090 3.168 2.308 4.079 . 0 0 "[ . 1 . 2]" 1
875 1 53 GLU HG2 1 54 GLY H . . 4.880 3.916 2.664 4.767 . 0 0 "[ . 1 . 2]" 1
876 1 53 GLU HG3 1 54 GLY H . . 4.880 3.615 2.403 4.761 . 0 0 "[ . 1 . 2]" 1
877 1 54 GLY H 1 98 TYR QE . . 3.760 2.896 2.453 3.351 . 0 0 "[ . 1 . 2]" 1
878 1 54 GLY QA 1 55 LEU H . . 2.830 2.240 2.139 2.282 . 0 0 "[ . 1 . 2]" 1
879 1 54 GLY QA 1 55 LEU QB . . 4.100 3.855 3.796 3.992 . 0 0 "[ . 1 . 2]" 1
880 1 54 GLY QA 1 98 TYR QD . . 5.100 3.272 2.542 3.733 . 0 0 "[ . 1 . 2]" 1
881 1 54 GLY QA 1 98 TYR QE . . 4.300 2.805 2.336 3.187 . 0 0 "[ . 1 . 2]" 1
882 1 54 GLY QA 1 99 GLY H . . 4.240 3.513 3.166 3.765 . 0 0 "[ . 1 . 2]" 1
883 1 54 GLY QA 1 99 GLY HA3 . . 4.820 3.389 3.052 3.768 . 0 0 "[ . 1 . 2]" 1
884 1 54 GLY HA2 1 55 LEU H . . 3.250 2.397 2.184 2.708 . 0 0 "[ . 1 . 2]" 1
885 1 54 GLY HA2 1 55 LEU QB . . 4.730 4.163 4.025 4.460 . 0 0 "[ . 1 . 2]" 1
886 1 54 GLY HA2 1 98 TYR QE . . 4.890 4.145 3.671 4.520 . 0 0 "[ . 1 . 2]" 1
887 1 54 GLY HA2 1 99 GLY H . . 5.050 4.651 4.107 5.057 0.007 3 0 "[ . 1 . 2]" 1
888 1 54 GLY HA3 1 55 LEU H . . 3.250 2.758 2.427 3.067 . 0 0 "[ . 1 . 2]" 1
889 1 54 GLY HA3 1 55 LEU QB . . 4.730 4.564 4.477 4.687 . 0 0 "[ . 1 . 2]" 1
890 1 54 GLY HA3 1 98 TYR QE . . 4.890 2.853 2.359 3.267 . 0 0 "[ . 1 . 2]" 1
891 1 54 GLY HA3 1 99 GLY H . . 5.050 3.639 3.270 3.884 . 0 0 "[ . 1 . 2]" 1
892 1 55 LEU H 1 55 LEU QB . . 2.840 2.189 2.116 2.288 . 0 0 "[ . 1 . 2]" 1
893 1 55 LEU H 1 55 LEU QD . . 4.300 3.555 2.553 3.753 . 0 0 "[ . 1 . 2]" 1
894 1 55 LEU H 1 55 LEU HG . . 4.530 4.342 3.054 4.520 . 0 0 "[ . 1 . 2]" 1
895 1 55 LEU H 1 56 LEU H . . 4.510 4.379 4.267 4.538 0.028 18 0 "[ . 1 . 2]" 1
896 1 55 LEU H 1 56 LEU HA . . 5.500 5.336 5.144 5.506 0.006 1 0 "[ . 1 . 2]" 1
897 1 55 LEU H 1 98 TYR HA . . 5.500 4.906 4.474 5.353 . 0 0 "[ . 1 . 2]" 1
898 1 55 LEU H 1 99 GLY H . . 3.780 3.125 2.727 3.512 . 0 0 "[ . 1 . 2]" 1
899 1 55 LEU H 1 99 GLY HA2 . . 3.730 2.682 2.283 2.964 . 0 0 "[ . 1 . 2]" 1
900 1 55 LEU H 1 99 GLY HA3 . . 4.010 3.805 3.432 4.008 . 0 0 "[ . 1 . 2]" 1
901 1 55 LEU HA 1 55 LEU MD1 . . 3.890 2.988 2.180 3.788 . 0 0 "[ . 1 . 2]" 1
902 1 55 LEU HA 1 55 LEU QD . . 3.240 2.599 2.168 3.110 . 0 0 "[ . 1 . 2]" 1
903 1 55 LEU HA 1 55 LEU MD2 . . 3.890 3.443 2.554 3.890 . 0 0 "[ . 1 . 2]" 1
904 1 55 LEU HA 1 55 LEU HG . . 4.040 2.521 2.238 2.737 . 0 0 "[ . 1 . 2]" 1
905 1 55 LEU HA 1 56 LEU H . . 2.850 2.158 2.140 2.208 . 0 0 "[ . 1 . 2]" 1
906 1 55 LEU HA 1 56 LEU HB2 . . 4.780 4.680 4.403 4.785 0.005 6 0 "[ . 1 . 2]" 1
907 1 55 LEU HA 1 56 LEU HB3 . . 4.780 4.536 4.445 4.637 . 0 0 "[ . 1 . 2]" 1
908 1 55 LEU HA 1 99 GLY H . . 5.100 4.522 4.121 4.895 . 0 0 "[ . 1 . 2]" 1
909 1 55 LEU QB 1 55 LEU MD1 . . 3.120 2.087 1.965 2.216 . 0 0 "[ . 1 . 2]" 1
910 1 55 LEU QB 1 55 LEU MD2 . . 3.120 2.085 1.938 2.263 . 0 0 "[ . 1 . 2]" 1
911 1 55 LEU QB 1 56 LEU H . . 3.880 3.816 3.006 3.890 0.010 11 0 "[ . 1 . 2]" 1
912 1 55 LEU QB 1 99 GLY H . . 4.180 3.236 2.540 3.795 . 0 0 "[ . 1 . 2]" 1
913 1 55 LEU QD 1 56 LEU H . . 3.800 3.397 2.781 3.810 0.010 18 0 "[ . 1 . 2]" 1
914 1 55 LEU HG 1 56 LEU H . . 4.740 3.528 3.085 4.673 . 0 0 "[ . 1 . 2]" 1
915 1 56 LEU H 1 56 LEU HB2 . . 3.350 2.796 2.616 2.970 . 0 0 "[ . 1 . 2]" 1
916 1 56 LEU H 1 56 LEU HB3 . . 3.350 2.411 2.334 2.577 . 0 0 "[ . 1 . 2]" 1
917 1 56 LEU H 1 56 LEU MD1 . . 4.450 4.278 4.164 4.419 . 0 0 "[ . 1 . 2]" 1
918 1 56 LEU H 1 56 LEU MD2 . . 4.280 4.177 4.100 4.285 0.005 18 0 "[ . 1 . 2]" 1
919 1 56 LEU H 1 56 LEU HG . . 4.480 4.392 4.300 4.467 . 0 0 "[ . 1 . 2]" 1
920 1 56 LEU H 1 98 TYR QD . . 5.300 4.900 4.187 5.299 . 0 0 "[ . 1 . 2]" 1
921 1 56 LEU H 1 98 TYR QE . . 5.500 4.536 3.646 5.061 . 0 0 "[ . 1 . 2]" 1
922 1 56 LEU HA 1 56 LEU MD1 . . 3.320 2.380 2.004 2.662 . 0 0 "[ . 1 . 2]" 1
923 1 56 LEU HA 1 56 LEU MD2 . . 4.120 3.951 3.917 3.986 . 0 0 "[ . 1 . 2]" 1
924 1 56 LEU HA 1 56 LEU HG . . 4.110 2.988 2.793 3.250 . 0 0 "[ . 1 . 2]" 1
925 1 56 LEU HA 1 57 ALA H . . 2.970 2.192 2.153 2.233 . 0 0 "[ . 1 . 2]" 1
926 1 56 LEU HA 1 98 TYR QD . . 3.970 3.036 2.514 3.353 . 0 0 "[ . 1 . 2]" 1
927 1 56 LEU HA 1 98 TYR QE . . 4.660 4.093 3.824 4.320 . 0 0 "[ . 1 . 2]" 1
928 1 56 LEU QB 1 56 LEU MD1 . . 2.990 2.147 1.972 2.323 . 0 0 "[ . 1 . 2]" 1
929 1 56 LEU QB 1 56 LEU MD2 . . 3.170 2.016 1.956 2.091 . 0 0 "[ . 1 . 2]" 1
930 1 56 LEU QB 1 57 ALA H . . 4.350 3.639 3.547 3.741 . 0 0 "[ . 1 . 2]" 1
931 1 56 LEU QB 1 80 TYR QD . . 4.910 4.188 3.824 4.382 . 0 0 "[ . 1 . 2]" 1
932 1 56 LEU QB 1 98 TYR QD . . 3.710 2.930 2.618 3.325 . 0 0 "[ . 1 . 2]" 1
933 1 56 LEU QB 1 98 TYR QE . . 3.600 2.464 2.210 2.683 . 0 0 "[ . 1 . 2]" 1
934 1 56 LEU HB2 1 56 LEU MD1 . . 3.620 2.186 1.994 2.387 . 0 0 "[ . 1 . 2]" 1
935 1 56 LEU HB2 1 98 TYR QE . . 4.390 2.484 2.223 2.710 . 0 0 "[ . 1 . 2]" 1
936 1 56 LEU HB3 1 56 LEU MD1 . . 3.620 3.146 3.104 3.187 . 0 0 "[ . 1 . 2]" 1
937 1 56 LEU HB3 1 98 TYR QE . . 4.390 4.084 3.779 4.358 . 0 0 "[ . 1 . 2]" 1
938 1 56 LEU MD1 1 57 ALA H . . 3.560 2.756 2.213 3.085 . 0 0 "[ . 1 . 2]" 1
939 1 56 LEU MD1 1 96 VAL MG1 . . 2.990 2.367 1.882 2.737 . 0 0 "[ . 1 . 2]" 1
940 1 56 LEU MD1 1 98 TYR QD . . 3.650 1.984 1.812 2.180 . 0 0 "[ . 1 . 2]" 1
941 1 56 LEU MD1 1 98 TYR QE . . 4.160 2.735 1.979 3.486 . 0 0 "[ . 1 . 2]" 1
942 1 56 LEU MD2 1 57 ALA H . . 4.400 4.214 3.899 4.392 . 0 0 "[ . 1 . 2]" 1
943 1 56 LEU MD2 1 80 TYR HB2 . . 4.180 2.717 2.352 3.046 . 0 0 "[ . 1 . 2]" 1
944 1 56 LEU MD2 1 80 TYR HB3 . . 4.260 2.585 2.386 3.135 . 0 0 "[ . 1 . 2]" 1
945 1 56 LEU MD2 1 80 TYR QD . . 3.790 3.025 2.687 3.456 . 0 0 "[ . 1 . 2]" 1
946 1 56 LEU MD2 1 82 VAL MG2 . . 3.880 3.059 2.387 3.599 . 0 0 "[ . 1 . 2]" 1
947 1 56 LEU MD2 1 98 TYR QD . . 4.420 4.215 3.561 4.448 0.028 10 0 "[ . 1 . 2]" 1
948 1 56 LEU MD2 1 98 TYR QE . . 4.740 3.739 3.295 4.451 . 0 0 "[ . 1 . 2]" 1
949 1 56 LEU HG 1 57 ALA H . . 3.590 2.630 2.231 2.891 . 0 0 "[ . 1 . 2]" 1
950 1 56 LEU HG 1 98 TYR QD . . 4.550 4.437 4.099 4.560 0.010 6 0 "[ . 1 . 2]" 1
951 1 57 ALA H 1 57 ALA MB . . 3.440 2.561 2.382 2.772 . 0 0 "[ . 1 . 2]" 1
952 1 57 ALA H 1 58 VAL H . . 4.500 4.362 4.252 4.465 . 0 0 "[ . 1 . 2]" 1
953 1 57 ALA H 1 96 VAL HA . . 5.160 4.707 4.460 5.019 . 0 0 "[ . 1 . 2]" 1
954 1 57 ALA H 1 97 THR H . . 3.790 3.210 2.918 3.687 . 0 0 "[ . 1 . 2]" 1
955 1 57 ALA H 1 98 TYR QD . . 4.510 4.410 4.122 4.518 0.008 3 0 "[ . 1 . 2]" 1
956 1 57 ALA HA 1 58 VAL H . . 2.730 2.231 2.148 2.341 . 0 0 "[ . 1 . 2]" 1
957 1 57 ALA HA 1 58 VAL HB . . 4.680 4.547 4.419 4.646 . 0 0 "[ . 1 . 2]" 1
958 1 57 ALA MB 1 58 VAL H . . 3.190 2.831 2.531 3.157 . 0 0 "[ . 1 . 2]" 1
959 1 57 ALA MB 1 97 THR H . . 4.200 3.505 3.217 4.045 . 0 0 "[ . 1 . 2]" 1
960 1 57 ALA MB 1 97 THR HG1 . . 4.540 2.193 1.951 3.334 . 0 0 "[ . 1 . 2]" 1
961 1 58 VAL H 1 58 VAL HB . . 3.260 2.714 2.500 3.146 . 0 0 "[ . 1 . 2]" 1
962 1 58 VAL H 1 58 VAL MG1 . . 4.470 3.485 1.968 3.881 . 0 0 "[ . 1 . 2]" 1
963 1 58 VAL H 1 58 VAL QG . . 3.890 2.602 1.962 2.886 . 0 0 "[ . 1 . 2]" 1
964 1 58 VAL H 1 58 VAL MG2 . . 4.470 3.014 2.503 3.884 . 0 0 "[ . 1 . 2]" 1
965 1 58 VAL H 1 59 GLN H . . 4.690 4.284 3.888 4.493 . 0 0 "[ . 1 . 2]" 1
966 1 58 VAL HA 1 58 VAL MG1 . . 3.550 2.535 2.309 3.203 . 0 0 "[ . 1 . 2]" 1
967 1 58 VAL HA 1 58 VAL QG . . 3.080 2.148 2.043 2.354 . 0 0 "[ . 1 . 2]" 1
968 1 58 VAL HA 1 58 VAL MG2 . . 3.550 2.363 2.256 2.432 . 0 0 "[ . 1 . 2]" 1
969 1 58 VAL HA 1 59 GLN H . . 2.810 2.163 2.141 2.216 . 0 0 "[ . 1 . 2]" 1
970 1 58 VAL HA 1 96 VAL MG2 . . 4.290 3.631 3.117 4.110 . 0 0 "[ . 1 . 2]" 1
971 1 58 VAL HA 1 97 THR H . . 4.680 4.228 3.502 4.669 . 0 0 "[ . 1 . 2]" 1
972 1 58 VAL HB 1 59 GLN H . . 4.860 4.250 3.976 4.440 . 0 0 "[ . 1 . 2]" 1
973 1 58 VAL HB 1 70 ALA MB . . 4.280 3.731 3.063 4.279 . 0 0 "[ . 1 . 2]" 1
974 1 58 VAL HB 1 82 VAL MG1 . . 4.460 3.331 2.515 3.889 . 0 0 "[ . 1 . 2]" 1
975 1 58 VAL QG 1 59 GLN H . . 3.880 2.559 1.981 3.045 . 0 0 "[ . 1 . 2]" 1
976 1 58 VAL QG 1 70 ALA MB . . 2.900 2.463 1.726 2.899 . 0 0 "[ . 1 . 2]" 1
977 1 58 VAL QG 1 82 VAL MG1 . . 2.840 1.905 1.735 2.136 . 0 0 "[ . 1 . 2]" 1
978 1 58 VAL MG1 1 59 GLN H . . 4.570 2.916 1.995 4.036 . 0 0 "[ . 1 . 2]" 1
979 1 58 VAL MG1 1 82 VAL MG1 . . 3.280 2.035 1.787 2.335 . 0 0 "[ . 1 . 2]" 1
980 1 58 VAL MG2 1 59 GLN H . . 4.570 3.717 1.989 4.208 . 0 0 "[ . 1 . 2]" 1
981 1 58 VAL MG2 1 82 VAL MG1 . . 3.280 2.382 1.958 2.845 . 0 0 "[ . 1 . 2]" 1
982 1 59 GLN H 1 59 GLN HB2 . . 3.780 2.767 2.415 3.173 . 0 0 "[ . 1 . 2]" 1
983 1 59 GLN H 1 59 GLN QB . . 3.300 2.486 2.383 2.621 . 0 0 "[ . 1 . 2]" 1
984 1 59 GLN H 1 59 GLN HB3 . . 3.780 3.105 2.534 3.777 . 0 0 "[ . 1 . 2]" 1
985 1 59 GLN H 1 59 GLN QG . . 4.240 3.780 2.872 4.197 . 0 0 "[ . 1 . 2]" 1
986 1 59 GLN H 1 60 ILE H . . 4.380 4.156 3.964 4.310 . 0 0 "[ . 1 . 2]" 1
987 1 59 GLN H 1 94 ILE HA . . 4.810 4.579 4.069 4.807 . 0 0 "[ . 1 . 2]" 1
988 1 59 GLN H 1 94 ILE MG . . 4.440 3.175 2.791 3.480 . 0 0 "[ . 1 . 2]" 1
989 1 59 GLN H 1 95 GLY H . . 3.880 3.291 2.736 3.618 . 0 0 "[ . 1 . 2]" 1
990 1 59 GLN H 1 95 GLY HA3 . . 5.050 4.556 3.988 4.924 . 0 0 "[ . 1 . 2]" 1
991 1 59 GLN H 1 96 VAL HA . . 4.010 3.683 3.284 3.972 . 0 0 "[ . 1 . 2]" 1
992 1 59 GLN HA 1 59 GLN QG . . 3.860 2.435 2.223 2.942 . 0 0 "[ . 1 . 2]" 1
993 1 59 GLN HA 1 60 ILE H . . 3.020 2.153 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
994 1 59 GLN HA 1 60 ILE HB . . 4.960 4.661 4.574 4.739 . 0 0 "[ . 1 . 2]" 1
995 1 59 GLN QB 1 95 GLY H . . 4.000 2.687 2.298 3.181 . 0 0 "[ . 1 . 2]" 1
996 1 59 GLN QB 1 95 GLY HA3 . . 4.360 3.119 2.611 3.390 . 0 0 "[ . 1 . 2]" 1
997 1 59 GLN HB2 1 60 ILE H . . 4.490 4.462 4.352 4.501 0.011 13 0 "[ . 1 . 2]" 1
998 1 59 GLN HB2 1 95 GLY H . . 4.670 3.724 2.710 4.555 . 0 0 "[ . 1 . 2]" 1
999 1 59 GLN HB2 1 95 GLY HA3 . . 4.980 4.026 2.941 4.814 . 0 0 "[ . 1 . 2]" 1
1000 1 59 GLN HB3 1 60 ILE H . . 4.490 4.048 3.447 4.422 . 0 0 "[ . 1 . 2]" 1
1001 1 59 GLN HB3 1 95 GLY H . . 4.670 3.071 2.312 3.969 . 0 0 "[ . 1 . 2]" 1
1002 1 59 GLN HB3 1 95 GLY HA3 . . 4.980 3.634 2.643 4.762 . 0 0 "[ . 1 . 2]" 1
1003 1 59 GLN QG 1 60 ILE H . . 4.230 3.629 3.057 4.232 0.002 12 0 "[ . 1 . 2]" 1
1004 1 60 ILE H 1 60 ILE HB . . 3.420 2.595 2.454 2.729 . 0 0 "[ . 1 . 2]" 1
1005 1 60 ILE H 1 60 ILE MD . . 4.370 3.758 3.400 4.025 . 0 0 "[ . 1 . 2]" 1
1006 1 60 ILE H 1 60 ILE HG12 . . 4.350 4.036 3.810 4.279 . 0 0 "[ . 1 . 2]" 1
1007 1 60 ILE H 1 60 ILE QG . . 3.590 2.710 2.488 2.916 . 0 0 "[ . 1 . 2]" 1
1008 1 60 ILE H 1 60 ILE HG13 . . 4.350 2.754 2.522 2.968 . 0 0 "[ . 1 . 2]" 1
1009 1 60 ILE H 1 60 ILE MG . . 4.090 3.829 3.766 3.886 . 0 0 "[ . 1 . 2]" 1
1010 1 60 ILE H 1 61 THR H . . 4.660 4.421 4.290 4.506 . 0 0 "[ . 1 . 2]" 1
1011 1 60 ILE H 1 68 LYS H . . 4.640 4.279 3.834 4.630 . 0 0 "[ . 1 . 2]" 1
1012 1 60 ILE HA 1 60 ILE MD . . 4.310 3.867 3.834 3.891 . 0 0 "[ . 1 . 2]" 1
1013 1 60 ILE HA 1 60 ILE QG . . 3.670 2.437 2.384 2.470 . 0 0 "[ . 1 . 2]" 1
1014 1 60 ILE HA 1 60 ILE MG . . 3.390 2.353 2.286 2.469 . 0 0 "[ . 1 . 2]" 1
1015 1 60 ILE HA 1 61 THR H . . 2.910 2.170 2.140 2.208 . 0 0 "[ . 1 . 2]" 1
1016 1 60 ILE HA 1 93 MET H . . 5.500 4.942 4.563 5.305 . 0 0 "[ . 1 . 2]" 1
1017 1 60 ILE HA 1 94 ILE HA . . 3.930 2.662 2.467 2.795 . 0 0 "[ . 1 . 2]" 1
1018 1 60 ILE HA 1 94 ILE HG12 . . 4.920 2.981 2.453 3.455 . 0 0 "[ . 1 . 2]" 1
1019 1 60 ILE HA 1 95 GLY H . . 4.050 3.903 3.609 4.052 0.002 12 0 "[ . 1 . 2]" 1
1020 1 60 ILE HB 1 60 ILE MD . . 3.480 2.295 2.147 2.412 . 0 0 "[ . 1 . 2]" 1
1021 1 60 ILE HB 1 61 THR H . . 4.480 4.118 3.986 4.276 . 0 0 "[ . 1 . 2]" 1
1022 1 60 ILE HB 1 68 LYS H . . 3.960 3.718 3.170 3.930 . 0 0 "[ . 1 . 2]" 1
1023 1 60 ILE HB 1 68 LYS HB2 . . 3.850 2.545 2.002 3.168 . 0 0 "[ . 1 . 2]" 1
1024 1 60 ILE MD 1 60 ILE MG . . 3.020 2.176 1.937 2.363 . 0 0 "[ . 1 . 2]" 1
1025 1 60 ILE MD 1 61 THR H . . 5.500 5.104 4.902 5.294 . 0 0 "[ . 1 . 2]" 1
1026 1 60 ILE MD 1 70 ALA H . . 4.670 4.526 4.247 4.673 0.003 10 0 "[ . 1 . 2]" 1
1027 1 60 ILE MD 1 70 ALA HA . . 4.240 3.451 2.952 3.787 . 0 0 "[ . 1 . 2]" 1
1028 1 60 ILE MD 1 70 ALA MB . . 3.150 1.864 1.753 1.958 . 0 0 "[ . 1 . 2]" 1
1029 1 60 ILE MD 1 71 ILE H . . 5.500 4.613 4.353 4.940 . 0 0 "[ . 1 . 2]" 1
1030 1 60 ILE MD 1 84 TYR HA . . 4.250 3.892 3.657 4.181 . 0 0 "[ . 1 . 2]" 1
1031 1 60 ILE MD 1 84 TYR QB . . 3.360 2.125 1.842 2.414 . 0 0 "[ . 1 . 2]" 1
1032 1 60 ILE MD 1 84 TYR QD . . 3.770 3.325 2.939 3.643 . 0 0 "[ . 1 . 2]" 1
1033 1 60 ILE MD 1 85 ILE H . . 5.110 4.894 4.559 5.106 . 0 0 "[ . 1 . 2]" 1
1034 1 60 ILE QG 1 60 ILE MG . . 3.210 2.207 2.052 2.312 . 0 0 "[ . 1 . 2]" 1
1035 1 60 ILE QG 1 61 THR H . . 4.160 4.077 3.971 4.159 . 0 0 "[ . 1 . 2]" 1
1036 1 60 ILE QG 1 94 ILE HG12 . . 4.390 2.056 1.971 2.305 . 0 0 "[ . 1 . 2]" 1
1037 1 60 ILE QG 1 94 ILE MG . . 3.150 2.582 2.000 2.891 . 0 0 "[ . 1 . 2]" 1
1038 1 60 ILE HG12 1 60 ILE MG . . 3.700 2.253 2.080 2.373 . 0 0 "[ . 1 . 2]" 1
1039 1 60 ILE HG12 1 61 THR H . . 4.970 4.373 4.202 4.526 . 0 0 "[ . 1 . 2]" 1
1040 1 60 ILE HG12 1 94 ILE HA . . 4.710 3.842 3.450 4.138 . 0 0 "[ . 1 . 2]" 1
1041 1 60 ILE HG12 1 94 ILE MG . . 3.690 2.787 2.055 3.473 . 0 0 "[ . 1 . 2]" 1
1042 1 60 ILE HG13 1 60 ILE MG . . 3.700 3.176 3.143 3.198 . 0 0 "[ . 1 . 2]" 1
1043 1 60 ILE HG13 1 61 THR H . . 4.970 4.879 4.675 4.978 0.008 19 0 "[ . 1 . 2]" 1
1044 1 60 ILE HG13 1 94 ILE HA . . 4.710 4.307 3.827 4.557 . 0 0 "[ . 1 . 2]" 1
1045 1 60 ILE HG13 1 94 ILE MG . . 3.690 3.107 2.734 3.562 . 0 0 "[ . 1 . 2]" 1
1046 1 60 ILE MG 1 61 THR H . . 3.430 2.322 1.985 2.594 . 0 0 "[ . 1 . 2]" 1
1047 1 60 ILE MG 1 61 THR HA . . 4.990 3.505 3.243 3.700 . 0 0 "[ . 1 . 2]" 1
1048 1 60 ILE MG 1 68 LYS H . . 4.260 4.028 3.436 4.265 0.005 20 0 "[ . 1 . 2]" 1
1049 1 60 ILE MG 1 68 LYS HB2 . . 3.700 2.197 1.971 2.497 . 0 0 "[ . 1 . 2]" 1
1050 1 60 ILE MG 1 68 LYS HB3 . . 3.460 3.033 2.580 3.460 0.000 10 0 "[ . 1 . 2]" 1
1051 1 60 ILE MG 1 68 LYS HG2 . . 4.490 3.488 2.862 4.008 . 0 0 "[ . 1 . 2]" 1
1052 1 60 ILE MG 1 68 LYS QG . . 3.760 2.484 1.974 2.926 . 0 0 "[ . 1 . 2]" 1
1053 1 60 ILE MG 1 68 LYS HG3 . . 4.490 2.570 1.988 3.188 . 0 0 "[ . 1 . 2]" 1
1054 1 60 ILE MG 1 84 TYR QD . . 4.370 3.805 3.358 4.122 . 0 0 "[ . 1 . 2]" 1
1055 1 60 ILE MG 1 92 TYR HB2 . . 5.090 4.935 4.614 5.103 0.013 19 0 "[ . 1 . 2]" 1
1056 1 60 ILE MG 1 92 TYR HB3 . . 4.090 3.543 3.240 3.749 . 0 0 "[ . 1 . 2]" 1
1057 1 60 ILE MG 1 92 TYR QD . . 3.520 2.815 2.121 3.509 . 0 0 "[ . 1 . 2]" 1
1058 1 60 ILE MG 1 92 TYR QE . . 4.270 3.532 2.708 4.268 . 0 0 "[ . 1 . 2]" 1
1059 1 60 ILE MG 1 93 MET H . . 4.430 4.164 3.879 4.424 . 0 0 "[ . 1 . 2]" 1
1060 1 60 ILE MG 1 94 ILE HG12 . . 3.570 2.903 2.314 3.413 . 0 0 "[ . 1 . 2]" 1
1061 1 60 ILE MG 1 94 ILE HG13 . . 4.110 3.565 3.098 3.888 . 0 0 "[ . 1 . 2]" 1
1062 1 61 THR H 1 61 THR HB . . 4.090 3.756 3.697 3.818 . 0 0 "[ . 1 . 2]" 1
1063 1 61 THR H 1 61 THR HG1 . . 5.040 2.994 1.974 3.667 . 0 0 "[ . 1 . 2]" 1
1064 1 61 THR H 1 61 THR MG . . 4.100 3.328 3.111 3.552 . 0 0 "[ . 1 . 2]" 1
1065 1 61 THR H 1 62 ASP H . . 4.640 4.440 4.415 4.479 . 0 0 "[ . 1 . 2]" 1
1066 1 61 THR H 1 92 TYR HA . . 4.790 4.621 4.236 4.791 0.001 13 0 "[ . 1 . 2]" 1
1067 1 61 THR H 1 92 TYR QD . . 4.740 3.866 3.446 4.240 . 0 0 "[ . 1 . 2]" 1
1068 1 61 THR H 1 93 MET H . . 3.800 3.266 2.978 3.525 . 0 0 "[ . 1 . 2]" 1
1069 1 61 THR H 1 93 MET QB . . 3.980 3.835 3.675 3.981 0.001 20 0 "[ . 1 . 2]" 1
1070 1 61 THR H 1 94 ILE HA . . 4.240 3.693 3.353 3.921 . 0 0 "[ . 1 . 2]" 1
1071 1 61 THR H 1 94 ILE HG13 . . 5.220 4.314 3.855 4.650 . 0 0 "[ . 1 . 2]" 1
1072 1 61 THR HA 1 61 THR MG . . 3.180 2.175 1.993 2.297 . 0 0 "[ . 1 . 2]" 1
1073 1 61 THR HA 1 62 ASP H . . 3.020 2.412 2.306 2.507 . 0 0 "[ . 1 . 2]" 1
1074 1 61 THR HA 1 66 LYS H . . 4.650 4.064 3.578 4.490 . 0 0 "[ . 1 . 2]" 1
1075 1 61 THR HA 1 67 PRO HA . . 4.160 3.738 3.447 4.153 . 0 0 "[ . 1 . 2]" 1
1076 1 61 THR HA 1 68 LYS H . . 4.220 3.857 3.603 4.199 . 0 0 "[ . 1 . 2]" 1
1077 1 61 THR HA 1 93 MET H . . 5.500 5.091 4.940 5.305 . 0 0 "[ . 1 . 2]" 1
1078 1 61 THR HB 1 62 ASP H . . 3.450 2.390 2.154 2.684 . 0 0 "[ . 1 . 2]" 1
1079 1 61 THR HB 1 65 GLY H . . 4.290 3.731 3.638 3.870 . 0 0 "[ . 1 . 2]" 1
1080 1 61 THR HB 1 65 GLY HA2 . . 4.200 2.090 1.998 2.443 . 0 0 "[ . 1 . 2]" 1
1081 1 61 THR HB 1 65 GLY QA . . 3.570 2.080 1.990 2.426 . 0 0 "[ . 1 . 2]" 1
1082 1 61 THR HB 1 65 GLY HA3 . . 4.200 3.766 3.655 4.164 . 0 0 "[ . 1 . 2]" 1
1083 1 61 THR HB 1 66 LYS H . . 4.460 3.698 3.334 4.462 0.002 5 0 "[ . 1 . 2]" 1
1084 1 61 THR HB 1 93 MET H . . 5.080 4.524 4.319 4.752 . 0 0 "[ . 1 . 2]" 1
1085 1 61 THR HB 1 93 MET QB . . 4.240 4.014 3.786 4.218 . 0 0 "[ . 1 . 2]" 1
1086 1 61 THR MG 1 62 ASP H . . 3.490 3.357 3.195 3.443 . 0 0 "[ . 1 . 2]" 1
1087 1 61 THR MG 1 65 GLY H . . 4.750 4.661 4.323 4.750 . 0 0 "[ . 1 . 2]" 1
1088 1 61 THR MG 1 65 GLY HA2 . . 4.090 2.924 2.412 3.093 . 0 0 "[ . 1 . 2]" 1
1089 1 61 THR MG 1 65 GLY QA . . 3.420 2.836 2.354 2.993 . 0 0 "[ . 1 . 2]" 1
1090 1 61 THR MG 1 65 GLY HA3 . . 4.090 3.821 3.280 4.094 0.004 10 0 "[ . 1 . 2]" 1
1091 1 61 THR MG 1 66 LYS H . . 4.160 3.916 3.460 4.160 . 0 0 "[ . 1 . 2]" 1
1092 1 61 THR MG 1 67 PRO HA . . 3.840 3.250 3.018 3.599 . 0 0 "[ . 1 . 2]" 1
1093 1 61 THR MG 1 68 LYS H . . 4.420 4.119 3.671 4.403 . 0 0 "[ . 1 . 2]" 1
1094 1 62 ASP H 1 62 ASP HB2 . . 4.000 3.349 2.448 3.774 . 0 0 "[ . 1 . 2]" 1
1095 1 62 ASP H 1 62 ASP QB . . 3.450 2.700 2.286 3.074 . 0 0 "[ . 1 . 2]" 1
1096 1 62 ASP H 1 62 ASP HB3 . . 4.000 2.949 2.557 3.656 . 0 0 "[ . 1 . 2]" 1
1097 1 62 ASP H 1 63 GLN H . . 4.530 4.454 4.415 4.520 . 0 0 "[ . 1 . 2]" 1
1098 1 62 ASP H 1 65 GLY H . . 4.580 2.893 2.744 3.190 . 0 0 "[ . 1 . 2]" 1
1099 1 62 ASP H 1 92 TYR QE . . 5.320 5.017 4.394 5.318 . 0 0 "[ . 1 . 2]" 1
1100 1 62 ASP HA 1 63 GLN H . . 3.500 2.608 2.511 2.651 . 0 0 "[ . 1 . 2]" 1
1101 1 62 ASP HA 1 92 TYR HA . . 4.090 2.978 2.653 3.271 . 0 0 "[ . 1 . 2]" 1
1102 1 62 ASP HA 1 92 TYR QD . . 4.260 2.974 2.182 3.694 . 0 0 "[ . 1 . 2]" 1
1103 1 62 ASP HA 1 92 TYR QE . . 4.010 3.460 2.653 4.000 . 0 0 "[ . 1 . 2]" 1
1104 1 62 ASP HA 1 93 MET H . . 4.120 3.860 3.443 4.125 0.005 15 0 "[ . 1 . 2]" 1
1105 1 62 ASP QB 1 63 GLN H . . 3.190 2.311 1.934 3.059 . 0 0 "[ . 1 . 2]" 1
1106 1 62 ASP QB 1 64 GLU H . . 4.460 2.958 2.391 3.509 . 0 0 "[ . 1 . 2]" 1
1107 1 62 ASP QB 1 92 TYR QE . . 3.770 3.145 2.614 3.745 . 0 0 "[ . 1 . 2]" 1
1108 1 62 ASP HB2 1 63 GLN H . . 3.860 2.586 1.946 3.746 . 0 0 "[ . 1 . 2]" 1
1109 1 62 ASP HB2 1 92 TYR QE . . 4.570 3.976 2.895 4.570 0.000 19 0 "[ . 1 . 2]" 1
1110 1 62 ASP HB3 1 63 GLN H . . 3.860 3.307 2.060 3.840 . 0 0 "[ . 1 . 2]" 1
1111 1 62 ASP HB3 1 92 TYR QE . . 4.570 3.640 2.656 4.563 . 0 0 "[ . 1 . 2]" 1
1112 1 63 GLN H 1 63 GLN HB2 . . 3.620 3.579 3.533 3.597 . 0 0 "[ . 1 . 2]" 1
1113 1 63 GLN H 1 63 GLN HB3 . . 3.620 2.427 2.254 2.520 . 0 0 "[ . 1 . 2]" 1
1114 1 63 GLN H 1 63 GLN HE21 . . 5.500 3.717 2.987 4.977 . 0 0 "[ . 1 . 2]" 1
1115 1 63 GLN H 1 63 GLN HE22 . . 5.500 4.885 2.949 5.497 . 0 0 "[ . 1 . 2]" 1
1116 1 63 GLN H 1 63 GLN HG2 . . 4.060 2.449 2.154 3.789 . 0 0 "[ . 1 . 2]" 1
1117 1 63 GLN H 1 63 GLN HG3 . . 4.060 3.659 3.322 4.011 . 0 0 "[ . 1 . 2]" 1
1118 1 63 GLN H 1 64 GLU H . . 3.880 2.797 2.745 2.933 . 0 0 "[ . 1 . 2]" 1
1119 1 63 GLN H 1 92 TYR HA . . 5.010 4.487 3.980 4.784 . 0 0 "[ . 1 . 2]" 1
1120 1 63 GLN HA 1 63 GLN QG . . 3.540 3.346 3.314 3.468 . 0 0 "[ . 1 . 2]" 1
1121 1 63 GLN HA 1 65 GLY H . . 4.570 4.226 4.057 4.378 . 0 0 "[ . 1 . 2]" 1
1122 1 63 GLN HA 1 91 ARG H . . 4.670 4.180 3.401 4.495 . 0 0 "[ . 1 . 2]" 1
1123 1 63 GLN QB 1 63 GLN QE . . 4.040 2.740 2.032 3.561 . 0 0 "[ . 1 . 2]" 1
1124 1 63 GLN QB 1 64 GLU H . . 4.320 3.459 3.343 3.619 . 0 0 "[ . 1 . 2]" 1
1125 1 63 GLN HB2 1 64 GLU H . . 4.940 3.857 3.679 4.176 . 0 0 "[ . 1 . 2]" 1
1126 1 63 GLN HB2 1 91 ARG H . . 4.110 3.969 3.269 4.114 0.004 6 0 "[ . 1 . 2]" 1
1127 1 63 GLN HB3 1 64 GLU H . . 4.940 3.919 3.837 4.022 . 0 0 "[ . 1 . 2]" 1
1128 1 63 GLN HB3 1 91 ARG H . . 4.110 2.599 2.110 2.870 . 0 0 "[ . 1 . 2]" 1
1129 1 63 GLN QE 1 63 GLN QG . . 3.030 2.249 2.074 2.469 . 0 0 "[ . 1 . 2]" 1
1130 1 63 GLN HE21 1 91 ARG H . . 5.500 4.288 2.750 5.449 . 0 0 "[ . 1 . 2]" 1
1131 1 63 GLN HE22 1 91 ARG H . . 5.500 4.784 4.087 5.295 . 0 0 "[ . 1 . 2]" 1
1132 1 63 GLN HG2 1 64 GLU H . . 4.340 2.337 2.052 2.915 . 0 0 "[ . 1 . 2]" 1
1133 1 63 GLN HG3 1 64 GLU H . . 4.340 2.751 2.244 4.150 . 0 0 "[ . 1 . 2]" 1
1134 1 64 GLU H 1 64 GLU HB2 . . 3.350 2.759 2.646 2.899 . 0 0 "[ . 1 . 2]" 1
1135 1 64 GLU H 1 64 GLU QB . . 2.890 2.265 2.213 2.310 . 0 0 "[ . 1 . 2]" 1
1136 1 64 GLU H 1 64 GLU HB3 . . 3.350 2.412 2.299 2.480 . 0 0 "[ . 1 . 2]" 1
1137 1 64 GLU H 1 64 GLU QG . . 4.030 3.966 3.888 4.021 . 0 0 "[ . 1 . 2]" 1
1138 1 64 GLU H 1 65 GLY H . . 2.950 2.346 2.230 2.401 . 0 0 "[ . 1 . 2]" 1
1139 1 64 GLU H 1 65 GLY QA . . 4.340 4.310 4.211 4.349 0.009 3 0 "[ . 1 . 2]" 1
1140 1 64 GLU H 1 66 LYS H . . 3.980 3.914 3.805 3.999 0.019 8 0 "[ . 1 . 2]" 1
1141 1 64 GLU HA 1 64 GLU QG . . 3.090 2.767 2.403 3.027 . 0 0 "[ . 1 . 2]" 1
1142 1 64 GLU QB 1 65 GLY H . . 3.820 2.946 2.912 3.019 . 0 0 "[ . 1 . 2]" 1
1143 1 64 GLU QB 1 66 LYS H . . 5.230 3.445 2.831 3.931 . 0 0 "[ . 1 . 2]" 1
1144 1 64 GLU QG 1 65 GLY H . . 3.940 3.812 3.607 3.935 . 0 0 "[ . 1 . 2]" 1
1145 1 64 GLU QG 1 66 LYS H . . 4.700 4.080 2.700 4.686 . 0 0 "[ . 1 . 2]" 1
1146 1 64 GLU QG 1 66 LYS HG2 . . 4.250 3.288 2.608 3.964 . 0 0 "[ . 1 . 2]" 1
1147 1 64 GLU QG 1 66 LYS HG3 . . 4.250 3.465 2.436 4.255 0.005 5 0 "[ . 1 . 2]" 1
1148 1 65 GLY H 1 66 LYS H . . 3.200 2.255 2.115 2.397 . 0 0 "[ . 1 . 2]" 1
1149 1 66 LYS H 1 66 LYS HB2 . . 3.700 2.594 2.307 3.676 . 0 0 "[ . 1 . 2]" 1
1150 1 66 LYS H 1 66 LYS QB . . 3.210 2.397 2.280 2.556 . 0 0 "[ . 1 . 2]" 1
1151 1 66 LYS H 1 66 LYS HB3 . . 3.700 3.468 2.571 3.662 . 0 0 "[ . 1 . 2]" 1
1152 1 66 LYS H 1 66 LYS HG2 . . 3.970 3.233 2.309 3.908 . 0 0 "[ . 1 . 2]" 1
1153 1 66 LYS H 1 66 LYS QG . . 3.330 2.694 2.286 3.052 . 0 0 "[ . 1 . 2]" 1
1154 1 66 LYS H 1 66 LYS HG3 . . 3.970 3.257 2.514 3.967 . 0 0 "[ . 1 . 2]" 1
1155 1 66 LYS H 1 67 PRO HD3 . . 5.280 5.047 5.015 5.070 . 0 0 "[ . 1 . 2]" 1
1156 1 66 LYS HA 1 66 LYS QD . . 4.550 3.474 2.127 4.317 . 0 0 "[ . 1 . 2]" 1
1157 1 66 LYS HA 1 66 LYS HG2 . . 3.860 2.713 2.337 3.863 0.003 10 0 "[ . 1 . 2]" 1
1158 1 66 LYS HA 1 66 LYS HG3 . . 3.860 3.441 2.796 3.746 . 0 0 "[ . 1 . 2]" 1
1159 1 66 LYS HA 1 67 PRO HD2 . . 3.250 2.391 2.320 2.459 . 0 0 "[ . 1 . 2]" 1
1160 1 66 LYS HA 1 67 PRO HD3 . . 3.160 2.298 2.274 2.325 . 0 0 "[ . 1 . 2]" 1
1161 1 66 LYS HA 1 67 PRO HG2 . . 4.670 4.505 4.447 4.562 . 0 0 "[ . 1 . 2]" 1
1162 1 66 LYS HA 1 67 PRO HG3 . . 4.670 4.467 4.426 4.509 . 0 0 "[ . 1 . 2]" 1
1163 1 66 LYS QB 1 67 PRO HD2 . . 3.090 2.050 1.988 2.164 . 0 0 "[ . 1 . 2]" 1
1164 1 66 LYS QB 1 67 PRO HD3 . . 3.500 3.405 3.310 3.500 0.000 12 0 "[ . 1 . 2]" 1
1165 1 66 LYS HB2 1 67 PRO HD2 . . 3.870 3.406 1.998 3.739 . 0 0 "[ . 1 . 2]" 1
1166 1 66 LYS HB3 1 67 PRO HD2 . . 3.870 2.293 1.998 3.547 . 0 0 "[ . 1 . 2]" 1
1167 1 66 LYS QE 1 66 LYS HG2 . . 3.690 2.629 2.065 3.500 . 0 0 "[ . 1 . 2]" 1
1168 1 66 LYS QE 1 66 LYS QG . . 3.160 2.229 2.043 2.621 . 0 0 "[ . 1 . 2]" 1
1169 1 66 LYS QE 1 66 LYS HG3 . . 3.690 2.722 2.111 3.471 . 0 0 "[ . 1 . 2]" 1
1170 1 66 LYS QG 1 67 PRO HD2 . . 4.040 3.391 2.988 3.706 . 0 0 "[ . 1 . 2]" 1
1171 1 66 LYS QG 1 67 PRO HD3 . . 4.430 4.172 3.727 4.429 . 0 0 "[ . 1 . 2]" 1
1172 1 66 LYS HG2 1 67 PRO HD2 . . 4.610 3.737 3.046 4.600 . 0 0 "[ . 1 . 2]" 1
1173 1 66 LYS HG3 1 67 PRO HD2 . . 4.610 4.203 3.423 4.601 . 0 0 "[ . 1 . 2]" 1
1174 1 67 PRO HA 1 68 LYS H . . 2.930 2.162 2.150 2.225 . 0 0 "[ . 1 . 2]" 1
1175 1 67 PRO QB 1 68 LYS H . . 3.460 3.263 2.980 3.404 . 0 0 "[ . 1 . 2]" 1
1176 1 67 PRO HB2 1 68 LYS H . . 4.110 3.474 3.130 3.646 . 0 0 "[ . 1 . 2]" 1
1177 1 67 PRO HB3 1 68 LYS H . . 4.110 3.962 3.742 4.078 . 0 0 "[ . 1 . 2]" 1
1178 1 68 LYS H 1 68 LYS HB2 . . 3.460 2.509 2.273 2.692 . 0 0 "[ . 1 . 2]" 1
1179 1 68 LYS H 1 68 LYS HB3 . . 3.950 3.671 3.547 3.804 . 0 0 "[ . 1 . 2]" 1
1180 1 68 LYS H 1 68 LYS QG . . 3.550 3.042 2.586 3.511 . 0 0 "[ . 1 . 2]" 1
1181 1 68 LYS H 1 69 ARG H . . 5.050 4.469 4.346 4.566 . 0 0 "[ . 1 . 2]" 1
1182 1 68 LYS HA 1 68 LYS HD2 . . 4.080 2.762 1.990 4.069 . 0 0 "[ . 1 . 2]" 1
1183 1 68 LYS HA 1 68 LYS QD . . 3.490 2.228 1.980 3.194 . 0 0 "[ . 1 . 2]" 1
1184 1 68 LYS HA 1 68 LYS HD3 . . 4.080 3.206 2.224 3.661 . 0 0 "[ . 1 . 2]" 1
1185 1 68 LYS HA 1 68 LYS QE . . 3.270 3.138 1.966 3.295 0.025 7 0 "[ . 1 . 2]" 1
1186 1 68 LYS HA 1 68 LYS QG . . 3.690 2.712 2.372 3.038 . 0 0 "[ . 1 . 2]" 1
1187 1 68 LYS HA 1 69 ARG H . . 3.070 2.274 2.160 2.566 . 0 0 "[ . 1 . 2]" 1
1188 1 68 LYS HA 1 69 ARG HA . . 4.430 4.333 4.308 4.356 . 0 0 "[ . 1 . 2]" 1
1189 1 68 LYS HB2 1 68 LYS QE . . 4.930 3.796 3.384 4.448 . 0 0 "[ . 1 . 2]" 1
1190 1 68 LYS HB2 1 69 ARG H . . 4.310 3.991 3.548 4.307 . 0 0 "[ . 1 . 2]" 1
1191 1 68 LYS HB3 1 68 LYS QD . . 3.400 2.584 2.064 3.022 . 0 0 "[ . 1 . 2]" 1
1192 1 68 LYS HB3 1 68 LYS HE2 . . 5.120 3.464 1.999 4.626 . 0 0 "[ . 1 . 2]" 1
1193 1 68 LYS HB3 1 68 LYS QE . . 4.440 2.813 1.988 3.991 . 0 0 "[ . 1 . 2]" 1
1194 1 68 LYS HB3 1 68 LYS HE3 . . 5.120 3.288 2.058 4.574 . 0 0 "[ . 1 . 2]" 1
1195 1 68 LYS HB3 1 69 ARG H . . 3.240 2.841 2.098 3.248 0.008 9 0 "[ . 1 . 2]" 1
1196 1 68 LYS QD 1 92 TYR QE . . 3.920 3.400 1.998 3.923 0.003 12 0 "[ . 1 . 2]" 1
1197 1 68 LYS QE 1 68 LYS QG . . 3.250 2.251 2.059 2.752 . 0 0 "[ . 1 . 2]" 1
1198 1 68 LYS QE 1 69 ARG H . . 5.050 3.764 2.379 4.527 . 0 0 "[ . 1 . 2]" 1
1199 1 68 LYS QE 1 92 TYR QE . . 4.160 3.252 2.005 4.160 0.000 2 0 "[ . 1 . 2]" 1
1200 1 68 LYS HE2 1 87 ASP H . . 4.540 3.781 2.524 4.541 0.001 8 0 "[ . 1 . 2]" 1
1201 1 68 LYS HE2 1 92 TYR QE . . 5.030 3.923 2.015 5.027 . 0 0 "[ . 1 . 2]" 1
1202 1 68 LYS HE3 1 87 ASP H . . 4.540 3.728 2.249 4.513 . 0 0 "[ . 1 . 2]" 1
1203 1 68 LYS HE3 1 92 TYR QE . . 5.030 3.918 2.308 4.859 . 0 0 "[ . 1 . 2]" 1
1204 1 68 LYS QG 1 92 TYR QE . . 3.920 2.572 2.050 3.192 . 0 0 "[ . 1 . 2]" 1
1205 1 68 LYS HG2 1 92 TYR QE . . 4.490 3.954 3.147 4.482 . 0 0 "[ . 1 . 2]" 1
1206 1 68 LYS HG3 1 92 TYR QE . . 4.490 2.613 2.066 3.366 . 0 0 "[ . 1 . 2]" 1
1207 1 69 ARG H 1 69 ARG QB . . 3.040 2.249 2.166 2.346 . 0 0 "[ . 1 . 2]" 1
1208 1 69 ARG H 1 69 ARG QD . . 5.490 4.600 4.364 4.838 . 0 0 "[ . 1 . 2]" 1
1209 1 69 ARG H 1 69 ARG QG . . 4.370 3.965 3.887 4.050 . 0 0 "[ . 1 . 2]" 1
1210 1 69 ARG H 1 70 ALA H . . 4.560 4.489 4.342 4.559 . 0 0 "[ . 1 . 2]" 1
1211 1 69 ARG HA 1 69 ARG QD . . 4.820 3.995 2.312 4.273 . 0 0 "[ . 1 . 2]" 1
1212 1 69 ARG HA 1 69 ARG HG2 . . 4.020 3.095 2.557 3.778 . 0 0 "[ . 1 . 2]" 1
1213 1 69 ARG HA 1 69 ARG QG . . 3.510 2.408 2.200 2.694 . 0 0 "[ . 1 . 2]" 1
1214 1 69 ARG HA 1 69 ARG HG3 . . 4.020 2.549 2.249 2.836 . 0 0 "[ . 1 . 2]" 1
1215 1 69 ARG HA 1 70 ALA H . . 2.660 2.153 2.140 2.232 . 0 0 "[ . 1 . 2]" 1
1216 1 69 ARG HA 1 70 ALA MB . . 4.340 3.959 3.829 4.039 . 0 0 "[ . 1 . 2]" 1
1217 1 69 ARG QB 1 69 ARG QD . . 3.160 2.250 2.055 2.413 . 0 0 "[ . 1 . 2]" 1
1218 1 69 ARG QB 1 70 ALA H . . 3.930 3.763 3.548 3.867 . 0 0 "[ . 1 . 2]" 1
1219 1 69 ARG QG 1 70 ALA H . . 3.510 2.851 2.180 3.252 . 0 0 "[ . 1 . 2]" 1
1220 1 69 ARG HG2 1 70 ALA H . . 4.020 3.330 2.646 4.022 0.002 18 0 "[ . 1 . 2]" 1
1221 1 69 ARG HG3 1 70 ALA H . . 4.020 3.318 2.191 3.911 . 0 0 "[ . 1 . 2]" 1
1222 1 70 ALA H 1 70 ALA MB . . 3.160 2.503 2.377 2.601 . 0 0 "[ . 1 . 2]" 1
1223 1 70 ALA H 1 71 ILE H . . 4.760 4.371 4.209 4.444 . 0 0 "[ . 1 . 2]" 1
1224 1 70 ALA HA 1 71 ILE H . . 3.220 2.206 2.142 2.296 . 0 0 "[ . 1 . 2]" 1
1225 1 70 ALA HA 1 71 ILE HB . . 4.750 4.651 4.576 4.709 . 0 0 "[ . 1 . 2]" 1
1226 1 70 ALA HA 1 82 VAL MG1 . . 4.520 4.176 3.798 4.513 . 0 0 "[ . 1 . 2]" 1
1227 1 70 ALA HA 1 84 TYR QB . . 4.560 3.494 3.170 3.755 . 0 0 "[ . 1 . 2]" 1
1228 1 70 ALA MB 1 71 ILE H . . 3.200 2.931 2.610 3.197 . 0 0 "[ . 1 . 2]" 1
1229 1 70 ALA MB 1 82 VAL MG1 . . 3.190 2.731 2.435 2.951 . 0 0 "[ . 1 . 2]" 1
1230 1 70 ALA MB 1 84 TYR QD . . 5.130 4.861 4.363 5.131 0.001 16 0 "[ . 1 . 2]" 1
1231 1 71 ILE H 1 71 ILE HB . . 3.300 2.540 2.486 2.646 . 0 0 "[ . 1 . 2]" 1
1232 1 71 ILE H 1 71 ILE MD . . 3.620 3.443 3.275 3.595 . 0 0 "[ . 1 . 2]" 1
1233 1 71 ILE H 1 71 ILE HG12 . . 4.240 3.910 3.584 4.130 . 0 0 "[ . 1 . 2]" 1
1234 1 71 ILE H 1 71 ILE HG13 . . 3.320 2.512 2.153 2.745 . 0 0 "[ . 1 . 2]" 1
1235 1 71 ILE H 1 71 ILE MG . . 4.010 3.802 3.777 3.855 . 0 0 "[ . 1 . 2]" 1
1236 1 71 ILE H 1 72 VAL H . . 4.700 4.544 4.470 4.606 . 0 0 "[ . 1 . 2]" 1
1237 1 71 ILE H 1 82 VAL MG1 . . 4.040 3.452 3.184 3.878 . 0 0 "[ . 1 . 2]" 1
1238 1 71 ILE H 1 83 THR H . . 3.630 3.440 3.239 3.626 . 0 0 "[ . 1 . 2]" 1
1239 1 71 ILE H 1 83 THR HB . . 4.090 3.539 3.244 3.958 . 0 0 "[ . 1 . 2]" 1
1240 1 71 ILE H 1 84 TYR QB . . 4.460 4.233 3.906 4.455 . 0 0 "[ . 1 . 2]" 1
1241 1 71 ILE HA 1 71 ILE MD . . 3.970 3.888 3.873 3.902 . 0 0 "[ . 1 . 2]" 1
1242 1 71 ILE HA 1 71 ILE HG12 . . 3.660 2.765 2.683 2.841 . 0 0 "[ . 1 . 2]" 1
1243 1 71 ILE HA 1 71 ILE HG13 . . 3.700 2.772 2.701 2.878 . 0 0 "[ . 1 . 2]" 1
1244 1 71 ILE HA 1 71 ILE MG . . 3.130 2.342 2.265 2.452 . 0 0 "[ . 1 . 2]" 1
1245 1 71 ILE HA 1 72 VAL H . . 2.800 2.226 2.171 2.270 . 0 0 "[ . 1 . 2]" 1
1246 1 71 ILE HA 1 72 VAL HB . . 4.700 4.587 4.390 4.699 . 0 0 "[ . 1 . 2]" 1
1247 1 71 ILE HB 1 71 ILE MD . . 3.320 2.220 2.104 2.370 . 0 0 "[ . 1 . 2]" 1
1248 1 71 ILE HB 1 72 VAL H . . 4.490 3.940 3.839 4.092 . 0 0 "[ . 1 . 2]" 1
1249 1 71 ILE HB 1 82 VAL HA . . 4.980 4.501 4.308 4.679 . 0 0 "[ . 1 . 2]" 1
1250 1 71 ILE HB 1 83 THR H . . 3.870 2.793 2.539 2.931 . 0 0 "[ . 1 . 2]" 1
1251 1 71 ILE HB 1 83 THR HB . . 3.220 2.103 2.000 2.347 . 0 0 "[ . 1 . 2]" 1
1252 1 71 ILE MD 1 83 THR H . . 4.300 4.212 3.906 4.303 0.003 15 0 "[ . 1 . 2]" 1
1253 1 71 ILE MD 1 83 THR HB . . 3.570 2.242 1.995 2.448 . 0 0 "[ . 1 . 2]" 1
1254 1 71 ILE HG12 1 71 ILE MG . . 3.080 2.225 2.068 2.318 . 0 0 "[ . 1 . 2]" 1
1255 1 71 ILE HG12 1 72 VAL H . . 4.420 4.319 4.224 4.416 . 0 0 "[ . 1 . 2]" 1
1256 1 71 ILE HG13 1 71 ILE MG . . 3.320 3.162 3.132 3.184 . 0 0 "[ . 1 . 2]" 1
1257 1 71 ILE HG13 1 72 VAL H . . 4.990 4.779 4.707 4.896 . 0 0 "[ . 1 . 2]" 1
1258 1 71 ILE HG13 1 83 THR H . . 5.500 5.030 4.785 5.185 . 0 0 "[ . 1 . 2]" 1
1259 1 71 ILE HG13 1 83 THR HB . . 4.540 3.881 3.536 4.198 . 0 0 "[ . 1 . 2]" 1
1260 1 71 ILE MG 1 72 VAL H . . 3.200 2.132 1.919 2.423 . 0 0 "[ . 1 . 2]" 1
1261 1 71 ILE MG 1 72 VAL HA . . 4.640 3.685 3.538 3.853 . 0 0 "[ . 1 . 2]" 1
1262 1 71 ILE MG 1 73 HIS HB2 . . 4.960 4.139 3.607 4.683 . 0 0 "[ . 1 . 2]" 1
1263 1 71 ILE MG 1 73 HIS HB3 . . 5.500 5.186 5.006 5.375 . 0 0 "[ . 1 . 2]" 1
1264 1 71 ILE MG 1 83 THR H . . 3.800 3.650 3.304 3.797 . 0 0 "[ . 1 . 2]" 1
1265 1 71 ILE MG 1 83 THR HB . . 3.890 3.399 3.046 3.655 . 0 0 "[ . 1 . 2]" 1
1266 1 72 VAL H 1 72 VAL HB . . 3.160 2.938 2.554 3.161 0.001 11 0 "[ . 1 . 2]" 1
1267 1 72 VAL H 1 72 VAL QG . . 3.360 2.206 1.875 2.710 . 0 0 "[ . 1 . 2]" 1
1268 1 72 VAL H 1 73 HIS H . . 4.610 4.302 4.135 4.429 . 0 0 "[ . 1 . 2]" 1
1269 1 72 VAL HA 1 73 HIS H . . 3.050 2.150 2.140 2.166 . 0 0 "[ . 1 . 2]" 1
1270 1 72 VAL HA 1 73 HIS HB2 . . 4.890 4.328 4.239 4.468 . 0 0 "[ . 1 . 2]" 1
1271 1 72 VAL HA 1 82 VAL HA . . 3.920 3.092 2.791 3.361 . 0 0 "[ . 1 . 2]" 1
1272 1 72 VAL HA 1 82 VAL MG1 . . 4.240 3.453 3.025 3.806 . 0 0 "[ . 1 . 2]" 1
1273 1 72 VAL HA 1 82 VAL MG2 . . 4.000 2.996 2.651 3.363 . 0 0 "[ . 1 . 2]" 1
1274 1 72 VAL HA 1 83 THR H . . 4.280 4.138 3.888 4.277 . 0 0 "[ . 1 . 2]" 1
1275 1 72 VAL HB 1 73 HIS H . . 4.660 4.242 4.044 4.402 . 0 0 "[ . 1 . 2]" 1
1276 1 72 VAL QG 1 73 HIS H . . 3.330 2.658 2.390 3.066 . 0 0 "[ . 1 . 2]" 1
1277 1 72 VAL QG 1 73 HIS HB2 . . 5.440 4.497 4.335 4.767 . 0 0 "[ . 1 . 2]" 1
1278 1 72 VAL QG 1 73 HIS HB3 . . 5.440 4.800 4.455 5.161 . 0 0 "[ . 1 . 2]" 1
1279 1 73 HIS H 1 73 HIS HB2 . . 3.590 2.448 2.246 2.772 . 0 0 "[ . 1 . 2]" 1
1280 1 73 HIS H 1 73 HIS HB3 . . 3.670 3.249 2.741 3.656 . 0 0 "[ . 1 . 2]" 1
1281 1 73 HIS H 1 74 ASP H . . 4.930 4.425 4.308 4.569 . 0 0 "[ . 1 . 2]" 1
1282 1 73 HIS H 1 81 ALA H . . 3.990 3.848 3.575 3.965 . 0 0 "[ . 1 . 2]" 1
1283 1 73 HIS H 1 81 ALA MB . . 4.180 3.762 3.369 4.149 . 0 0 "[ . 1 . 2]" 1
1284 1 73 HIS H 1 82 VAL HA . . 4.130 3.107 2.741 3.398 . 0 0 "[ . 1 . 2]" 1
1285 1 73 HIS H 1 82 VAL MG2 . . 4.520 3.322 2.912 3.847 . 0 0 "[ . 1 . 2]" 1
1286 1 73 HIS H 1 83 THR H . . 4.970 4.404 4.010 4.724 . 0 0 "[ . 1 . 2]" 1
1287 1 73 HIS HA 1 74 ASP H . . 3.400 2.163 2.140 2.225 . 0 0 "[ . 1 . 2]" 1
1288 1 73 HIS HB2 1 74 ASP H . . 4.720 4.368 4.186 4.535 . 0 0 "[ . 1 . 2]" 1
1289 1 73 HIS HB2 1 81 ALA H . . 4.360 3.742 3.155 4.239 . 0 0 "[ . 1 . 2]" 1
1290 1 73 HIS HB2 1 81 ALA MB . . 3.370 2.277 1.971 2.930 . 0 0 "[ . 1 . 2]" 1
1291 1 73 HIS HB3 1 74 ASP H . . 4.410 3.605 2.998 4.100 . 0 0 "[ . 1 . 2]" 1
1292 1 73 HIS HB3 1 74 ASP HA . . 4.710 4.563 4.421 4.713 0.003 9 0 "[ . 1 . 2]" 1
1293 1 73 HIS HB3 1 81 ALA H . . 4.210 3.314 2.410 4.180 . 0 0 "[ . 1 . 2]" 1
1294 1 73 HIS HB3 1 81 ALA MB . . 3.540 2.375 1.875 3.017 . 0 0 "[ . 1 . 2]" 1
1295 1 73 HIS HD2 1 81 ALA MB . . 4.050 3.349 2.275 4.045 . 0 0 "[ . 1 . 2]" 1
1296 1 74 ASP H 1 74 ASP HB2 . . 3.800 3.043 2.393 3.742 . 0 0 "[ . 1 . 2]" 1
1297 1 74 ASP H 1 74 ASP QB . . 3.320 2.632 2.362 3.017 . 0 0 "[ . 1 . 2]" 1
1298 1 74 ASP H 1 74 ASP HB3 . . 3.800 3.281 2.728 3.737 . 0 0 "[ . 1 . 2]" 1
1299 1 74 ASP H 1 75 ASN H . . 5.030 4.333 4.204 4.452 . 0 0 "[ . 1 . 2]" 1
1300 1 74 ASP HA 1 75 ASN H . . 2.970 2.143 2.139 2.151 . 0 0 "[ . 1 . 2]" 1
1301 1 74 ASP HA 1 76 LYS H . . 4.050 3.637 3.355 3.793 . 0 0 "[ . 1 . 2]" 1
1302 1 74 ASP HA 1 80 TYR HA . . 4.150 4.022 3.709 4.150 0.000 19 0 "[ . 1 . 2]" 1
1303 1 74 ASP HA 1 80 TYR QD . . 3.670 3.289 2.897 3.557 . 0 0 "[ . 1 . 2]" 1
1304 1 74 ASP HA 1 81 ALA H . . 4.600 4.251 3.995 4.420 . 0 0 "[ . 1 . 2]" 1
1305 1 74 ASP QB 1 75 ASN H . . 3.800 3.408 3.212 3.757 . 0 0 "[ . 1 . 2]" 1
1306 1 75 ASN H 1 75 ASN HB2 . . 3.430 2.659 2.609 2.744 . 0 0 "[ . 1 . 2]" 1
1307 1 75 ASN H 1 75 ASN HB3 . . 3.900 3.702 3.657 3.734 . 0 0 "[ . 1 . 2]" 1
1308 1 75 ASN H 1 75 ASN HD21 . . 4.100 3.154 2.360 3.403 . 0 0 "[ . 1 . 2]" 1
1309 1 75 ASN H 1 75 ASN HD22 . . 4.450 3.854 3.331 4.078 . 0 0 "[ . 1 . 2]" 1
1310 1 75 ASN H 1 76 LYS H . . 3.170 2.105 2.009 2.236 . 0 0 "[ . 1 . 2]" 1
1311 1 75 ASN H 1 76 LYS HA . . 4.540 4.352 4.257 4.494 . 0 0 "[ . 1 . 2]" 1
1312 1 75 ASN H 1 80 TYR HA . . 3.700 3.514 3.177 3.697 . 0 0 "[ . 1 . 2]" 1
1313 1 75 ASN H 1 80 TYR QD . . 4.220 3.866 3.473 4.128 . 0 0 "[ . 1 . 2]" 1
1314 1 75 ASN H 1 81 ALA H . . 4.600 4.350 3.973 4.555 . 0 0 "[ . 1 . 2]" 1
1315 1 75 ASN HA 1 75 ASN HD21 . . 4.910 4.384 4.137 4.449 . 0 0 "[ . 1 . 2]" 1
1316 1 75 ASN HA 1 77 ASP H . . 4.840 4.475 4.264 4.692 . 0 0 "[ . 1 . 2]" 1
1317 1 75 ASN HB2 1 75 ASN HD22 . . 3.770 3.437 3.433 3.470 . 0 0 "[ . 1 . 2]" 1
1318 1 75 ASN HB2 1 76 LYS H . . 4.230 2.895 2.713 3.311 . 0 0 "[ . 1 . 2]" 1
1319 1 75 ASN HB2 1 77 ASP H . . 3.920 2.621 2.497 2.737 . 0 0 "[ . 1 . 2]" 1
1320 1 75 ASN HB2 1 79 THR H . . 4.360 3.535 3.143 3.877 . 0 0 "[ . 1 . 2]" 1
1321 1 75 ASN HB3 1 75 ASN HD22 . . 4.040 3.933 3.904 4.041 0.001 18 0 "[ . 1 . 2]" 1
1322 1 75 ASN HB3 1 76 LYS H . . 4.310 4.020 3.889 4.313 0.003 18 0 "[ . 1 . 2]" 1
1323 1 75 ASN HB3 1 77 ASP H . . 4.090 3.564 3.395 3.799 . 0 0 "[ . 1 . 2]" 1
1324 1 75 ASN HB3 1 77 ASP QB . . 3.880 3.050 2.899 3.191 . 0 0 "[ . 1 . 2]" 1
1325 1 75 ASN HB3 1 79 THR H . . 5.170 4.937 4.635 5.166 . 0 0 "[ . 1 . 2]" 1
1326 1 75 ASN HD21 1 77 ASP H . . 4.420 4.363 4.178 4.420 0.000 18 0 "[ . 1 . 2]" 1
1327 1 75 ASN HD21 1 79 THR H . . 5.260 3.954 3.429 4.222 . 0 0 "[ . 1 . 2]" 1
1328 1 75 ASN HD21 1 79 THR HB . . 4.630 3.479 2.821 4.320 . 0 0 "[ . 1 . 2]" 1
1329 1 75 ASN HD21 1 80 TYR HA . . 5.120 2.496 1.954 2.881 . 0 0 "[ . 1 . 2]" 1
1330 1 75 ASN HD21 1 81 ALA MB . . 4.340 3.775 3.563 4.107 . 0 0 "[ . 1 . 2]" 1
1331 1 75 ASN HD22 1 79 THR HB . . 5.260 4.277 3.691 4.863 . 0 0 "[ . 1 . 2]" 1
1332 1 75 ASN HD22 1 80 TYR HA . . 4.980 2.889 2.339 3.187 . 0 0 "[ . 1 . 2]" 1
1333 1 75 ASN HD22 1 81 ALA MB . . 3.980 2.258 1.988 2.580 . 0 0 "[ . 1 . 2]" 1
1334 1 76 LYS H 1 76 LYS HA . . 2.830 2.278 2.274 2.325 . 0 0 "[ . 1 . 2]" 1
1335 1 76 LYS H 1 76 LYS QB . . 3.700 3.300 2.840 3.405 . 0 0 "[ . 1 . 2]" 1
1336 1 76 LYS H 1 76 LYS HD2 . . 4.680 3.739 2.624 4.664 . 0 0 "[ . 1 . 2]" 1
1337 1 76 LYS H 1 76 LYS QD . . 4.030 3.122 2.569 3.929 . 0 0 "[ . 1 . 2]" 1
1338 1 76 LYS H 1 76 LYS HD3 . . 4.680 3.627 2.637 4.440 . 0 0 "[ . 1 . 2]" 1
1339 1 76 LYS H 1 76 LYS HG2 . . 4.560 3.476 2.606 4.555 . 0 0 "[ . 1 . 2]" 1
1340 1 76 LYS H 1 76 LYS QG . . 3.680 2.895 2.582 3.528 . 0 0 "[ . 1 . 2]" 1
1341 1 76 LYS H 1 76 LYS HG3 . . 4.560 3.846 3.010 4.597 0.037 18 0 "[ . 1 . 2]" 1
1342 1 76 LYS H 1 77 ASP H . . 3.680 2.703 2.622 3.037 . 0 0 "[ . 1 . 2]" 1
1343 1 76 LYS H 1 78 GLY H . . 4.360 4.280 3.925 4.361 0.001 12 0 "[ . 1 . 2]" 1
1344 1 76 LYS H 1 80 TYR HA . . 4.970 4.848 4.646 4.969 . 0 0 "[ . 1 . 2]" 1
1345 1 76 LYS HA 1 76 LYS HD2 . . 4.170 3.325 2.004 4.164 . 0 0 "[ . 1 . 2]" 1
1346 1 76 LYS HA 1 76 LYS HD3 . . 4.170 3.402 2.384 4.158 . 0 0 "[ . 1 . 2]" 1
1347 1 76 LYS HA 1 76 LYS HG2 . . 4.060 3.228 2.705 3.636 . 0 0 "[ . 1 . 2]" 1
1348 1 76 LYS HA 1 76 LYS QG . . 3.490 2.675 2.225 3.436 . 0 0 "[ . 1 . 2]" 1
1349 1 76 LYS HA 1 76 LYS HG3 . . 4.060 3.244 2.251 4.229 0.169 18 0 "[ . 1 . 2]" 1
1350 1 76 LYS HA 1 78 GLY H . . 4.290 3.465 3.401 3.671 . 0 0 "[ . 1 . 2]" 1
1351 1 76 LYS QB 1 76 LYS QD . . 3.230 2.259 2.036 2.594 . 0 0 "[ . 1 . 2]" 1
1352 1 76 LYS QB 1 76 LYS QE . . 4.400 2.946 1.974 3.726 . 0 0 "[ . 1 . 2]" 1
1353 1 76 LYS HB2 1 77 ASP H . . 5.160 4.126 4.038 4.433 . 0 0 "[ . 1 . 2]" 1
1354 1 76 LYS HB3 1 77 ASP H . . 5.160 4.456 4.379 4.640 . 0 0 "[ . 1 . 2]" 1
1355 1 77 ASP H 1 77 ASP HB2 . . 4.040 2.832 2.520 3.133 . 0 0 "[ . 1 . 2]" 1
1356 1 77 ASP H 1 77 ASP HB3 . . 4.040 3.131 2.696 3.813 . 0 0 "[ . 1 . 2]" 1
1357 1 77 ASP H 1 78 GLY H . . 2.970 2.351 1.818 2.509 . 0 0 "[ . 1 . 2]" 1
1358 1 77 ASP H 1 78 GLY HA2 . . 4.840 4.565 4.349 4.676 . 0 0 "[ . 1 . 2]" 1
1359 1 77 ASP H 1 78 GLY HA3 . . 4.840 4.770 4.569 4.842 0.002 16 0 "[ . 1 . 2]" 1
1360 1 77 ASP H 1 79 THR H . . 3.440 2.801 2.615 3.128 . 0 0 "[ . 1 . 2]" 1
1361 1 77 ASP H 1 79 THR MG . . 5.030 4.961 4.859 5.032 0.002 2 0 "[ . 1 . 2]" 1
1362 1 77 ASP HB2 1 78 GLY H . . 4.660 4.312 3.629 4.568 . 0 0 "[ . 1 . 2]" 1
1363 1 77 ASP HB3 1 78 GLY H . . 4.660 4.105 3.259 4.527 . 0 0 "[ . 1 . 2]" 1
1364 1 78 GLY H 1 79 THR H . . 3.130 2.425 1.799 2.937 . 0 0 "[ . 1 . 2]" 1
1365 1 79 THR H 1 79 THR MG . . 3.530 3.077 2.436 3.369 . 0 0 "[ . 1 . 2]" 1
1366 1 79 THR H 1 80 TYR H . . 4.500 4.420 4.385 4.505 0.005 12 0 "[ . 1 . 2]" 1
1367 1 79 THR HA 1 79 THR MG . . 3.440 2.270 2.140 2.472 . 0 0 "[ . 1 . 2]" 1
1368 1 79 THR HA 1 80 TYR H . . 3.100 2.533 2.475 2.568 . 0 0 "[ . 1 . 2]" 1
1369 1 79 THR HA 1 80 TYR HA . . 5.100 4.543 4.507 4.557 . 0 0 "[ . 1 . 2]" 1
1370 1 79 THR HA 1 80 TYR QD . . 4.010 3.282 2.647 3.520 . 0 0 "[ . 1 . 2]" 1
1371 1 79 THR HB 1 80 TYR H . . 3.320 2.122 2.034 2.226 . 0 0 "[ . 1 . 2]" 1
1372 1 79 THR MG 1 80 TYR H . . 3.870 3.535 3.420 3.731 . 0 0 "[ . 1 . 2]" 1
1373 1 79 THR MG 1 80 TYR QD . . 5.050 4.942 4.610 5.046 . 0 0 "[ . 1 . 2]" 1
1374 1 80 TYR H 1 80 TYR HB2 . . 3.900 2.898 2.814 2.978 . 0 0 "[ . 1 . 2]" 1
1375 1 80 TYR H 1 80 TYR QD . . 3.510 3.307 2.649 3.477 . 0 0 "[ . 1 . 2]" 1
1376 1 80 TYR H 1 81 ALA H . . 4.350 4.246 4.117 4.339 . 0 0 "[ . 1 . 2]" 1
1377 1 80 TYR HA 1 80 TYR QD . . 4.040 2.842 2.715 3.192 . 0 0 "[ . 1 . 2]" 1
1378 1 80 TYR HA 1 81 ALA H . . 2.970 2.186 2.145 2.234 . 0 0 "[ . 1 . 2]" 1
1379 1 80 TYR HA 1 81 ALA HA . . 4.920 4.393 4.386 4.408 . 0 0 "[ . 1 . 2]" 1
1380 1 80 TYR HA 1 81 ALA MB . . 4.250 3.877 3.809 3.961 . 0 0 "[ . 1 . 2]" 1
1381 1 80 TYR HB2 1 81 ALA H . . 4.160 4.075 3.849 4.160 . 0 0 "[ . 1 . 2]" 1
1382 1 80 TYR HB2 1 82 VAL MG2 . . 4.640 4.226 4.077 4.380 . 0 0 "[ . 1 . 2]" 1
1383 1 80 TYR HB3 1 81 ALA H . . 3.670 3.092 2.907 3.352 . 0 0 "[ . 1 . 2]" 1
1384 1 80 TYR HB3 1 82 VAL MG2 . . 4.670 3.682 3.467 3.874 . 0 0 "[ . 1 . 2]" 1
1385 1 80 TYR QD 1 81 ALA H . . 4.510 4.029 3.829 4.321 . 0 0 "[ . 1 . 2]" 1
1386 1 81 ALA H 1 81 ALA MB . . 3.220 2.393 2.282 2.482 . 0 0 "[ . 1 . 2]" 1
1387 1 81 ALA H 1 82 VAL H . . 4.740 4.484 4.408 4.526 . 0 0 "[ . 1 . 2]" 1
1388 1 81 ALA H 1 82 VAL MG2 . . 5.370 3.987 3.809 4.101 . 0 0 "[ . 1 . 2]" 1
1389 1 81 ALA HA 1 82 VAL H . . 2.950 2.237 2.182 2.274 . 0 0 "[ . 1 . 2]" 1
1390 1 81 ALA HA 1 82 VAL HB . . 4.860 4.540 4.488 4.608 . 0 0 "[ . 1 . 2]" 1
1391 1 81 ALA HA 1 82 VAL MG2 . . 4.390 3.511 3.310 3.677 . 0 0 "[ . 1 . 2]" 1
1392 1 81 ALA MB 1 82 VAL H . . 3.520 2.846 2.667 3.026 . 0 0 "[ . 1 . 2]" 1
1393 1 82 VAL H 1 82 VAL HB . . 3.420 2.820 2.756 2.895 . 0 0 "[ . 1 . 2]" 1
1394 1 82 VAL H 1 82 VAL MG1 . . 4.490 3.915 3.884 3.952 . 0 0 "[ . 1 . 2]" 1
1395 1 82 VAL H 1 82 VAL MG2 . . 3.420 2.968 2.810 3.100 . 0 0 "[ . 1 . 2]" 1
1396 1 82 VAL H 1 83 THR HA . . 5.340 4.645 4.556 4.732 . 0 0 "[ . 1 . 2]" 1
1397 1 82 VAL HA 1 82 VAL MG1 . . 3.410 2.363 2.268 2.458 . 0 0 "[ . 1 . 2]" 1
1398 1 82 VAL HA 1 82 VAL MG2 . . 3.530 2.351 2.268 2.468 . 0 0 "[ . 1 . 2]" 1
1399 1 82 VAL HA 1 83 THR H . . 2.940 2.143 2.139 2.155 . 0 0 "[ . 1 . 2]" 1
1400 1 82 VAL HA 1 83 THR HA . . 4.710 4.393 4.386 4.403 . 0 0 "[ . 1 . 2]" 1
1401 1 82 VAL HB 1 83 THR H . . 4.550 4.248 4.141 4.339 . 0 0 "[ . 1 . 2]" 1
1402 1 82 VAL MG1 1 83 THR H . . 3.390 2.667 2.354 2.972 . 0 0 "[ . 1 . 2]" 1
1403 1 82 VAL MG1 1 83 THR HA . . 4.490 3.877 3.686 4.039 . 0 0 "[ . 1 . 2]" 1
1404 1 82 VAL MG1 1 84 TYR H . . 5.110 4.608 4.445 4.737 . 0 0 "[ . 1 . 2]" 1
1405 1 82 VAL MG1 1 84 TYR QD . . 4.010 3.901 3.691 4.011 0.001 5 0 "[ . 1 . 2]" 1
1406 1 83 THR H 1 83 THR HB . . 3.460 2.608 2.529 2.718 . 0 0 "[ . 1 . 2]" 1
1407 1 83 THR H 1 83 THR MG . . 4.050 3.829 3.799 3.862 . 0 0 "[ . 1 . 2]" 1
1408 1 83 THR H 1 84 TYR H . . 4.620 4.536 4.501 4.576 . 0 0 "[ . 1 . 2]" 1
1409 1 83 THR HA 1 83 THR MG . . 3.420 2.364 2.180 2.442 . 0 0 "[ . 1 . 2]" 1
1410 1 83 THR HA 1 84 TYR H . . 2.970 2.224 2.193 2.249 . 0 0 "[ . 1 . 2]" 1
1411 1 83 THR HA 1 84 TYR HA . . 4.830 4.452 4.431 4.464 . 0 0 "[ . 1 . 2]" 1
1412 1 83 THR HB 1 84 TYR H . . 4.290 3.897 3.744 4.017 . 0 0 "[ . 1 . 2]" 1
1413 1 83 THR HB 1 84 TYR HA . . 4.780 4.529 4.398 4.621 . 0 0 "[ . 1 . 2]" 1
1414 1 83 THR MG 1 84 TYR H . . 3.350 2.171 1.894 2.430 . 0 0 "[ . 1 . 2]" 1
1415 1 83 THR MG 1 84 TYR QD . . 5.500 4.598 4.323 4.832 . 0 0 "[ . 1 . 2]" 1
1416 1 83 THR MG 1 85 ILE H . . 4.500 4.225 3.994 4.490 . 0 0 "[ . 1 . 2]" 1
1417 1 84 TYR H 1 84 TYR QD . . 3.770 3.093 2.880 3.298 . 0 0 "[ . 1 . 2]" 1
1418 1 84 TYR H 1 85 ILE H . . 4.590 4.211 4.153 4.280 . 0 0 "[ . 1 . 2]" 1
1419 1 84 TYR H 1 85 ILE HA . . 4.900 4.617 4.580 4.662 . 0 0 "[ . 1 . 2]" 1
1420 1 84 TYR H 1 85 ILE HG13 . . 5.320 4.182 4.056 4.286 . 0 0 "[ . 1 . 2]" 1
1421 1 84 TYR HA 1 84 TYR QD . . 4.580 3.661 3.611 3.720 . 0 0 "[ . 1 . 2]" 1
1422 1 84 TYR HA 1 85 ILE H . . 3.120 2.169 2.149 2.205 . 0 0 "[ . 1 . 2]" 1
1423 1 84 TYR HA 1 85 ILE HB . . 4.890 4.560 4.525 4.593 . 0 0 "[ . 1 . 2]" 1
1424 1 84 TYR HA 1 85 ILE HG12 . . 5.500 5.394 5.278 5.504 0.004 12 0 "[ . 1 . 2]" 1
1425 1 84 TYR QB 1 85 ILE H . . 3.270 3.156 3.025 3.259 . 0 0 "[ . 1 . 2]" 1
1426 1 84 TYR QD 1 85 ILE H . . 4.040 3.538 3.215 3.906 . 0 0 "[ . 1 . 2]" 1
1427 1 84 TYR QD 1 86 PRO HD2 . . 5.050 3.927 3.713 4.344 . 0 0 "[ . 1 . 2]" 1
1428 1 84 TYR QD 1 86 PRO QD . . 4.380 2.333 2.070 2.929 . 0 0 "[ . 1 . 2]" 1
1429 1 84 TYR QD 1 86 PRO HD3 . . 5.050 2.352 2.081 2.977 . 0 0 "[ . 1 . 2]" 1
1430 1 84 TYR QE 1 86 PRO HB2 . . 4.760 3.767 3.589 3.930 . 0 0 "[ . 1 . 2]" 1
1431 1 84 TYR QE 1 86 PRO QB . . 4.110 2.234 1.990 2.495 . 0 0 "[ . 1 . 2]" 1
1432 1 84 TYR QE 1 86 PRO HB3 . . 4.760 2.251 1.998 2.524 . 0 0 "[ . 1 . 2]" 1
1433 1 84 TYR QE 1 86 PRO QD . . 4.540 2.336 2.093 2.642 . 0 0 "[ . 1 . 2]" 1
1434 1 84 TYR QE 1 86 PRO QG . . 4.320 2.320 2.066 3.101 . 0 0 "[ . 1 . 2]" 1
1435 1 84 TYR QE 1 94 ILE MD . . 3.870 3.765 3.620 3.881 0.011 3 0 "[ . 1 . 2]" 1
1436 1 84 TYR HH 1 94 ILE MD . . 4.490 3.985 3.524 4.495 0.005 15 0 "[ . 1 . 2]" 1
1437 1 84 TYR HH 1 110 ILE MD . . 3.600 3.062 2.661 3.508 . 0 0 "[ . 1 . 2]" 1
1438 1 84 TYR HH 1 110 ILE MG . . 3.410 2.918 2.376 3.154 . 0 0 "[ . 1 . 2]" 1
1439 1 85 ILE H 1 85 ILE HB . . 3.390 2.542 2.484 2.603 . 0 0 "[ . 1 . 2]" 1
1440 1 85 ILE H 1 85 ILE MD . . 4.090 3.593 3.467 3.739 . 0 0 "[ . 1 . 2]" 1
1441 1 85 ILE H 1 85 ILE HG12 . . 4.310 4.109 3.997 4.192 . 0 0 "[ . 1 . 2]" 1
1442 1 85 ILE H 1 85 ILE HG13 . . 3.960 2.775 2.665 2.855 . 0 0 "[ . 1 . 2]" 1
1443 1 85 ILE H 1 85 ILE MG . . 3.870 3.805 3.777 3.831 . 0 0 "[ . 1 . 2]" 1
1444 1 85 ILE H 1 86 PRO HD2 . . 5.140 4.579 4.523 4.719 . 0 0 "[ . 1 . 2]" 1
1445 1 85 ILE H 1 86 PRO HD3 . . 5.140 4.156 4.052 4.439 . 0 0 "[ . 1 . 2]" 1
1446 1 85 ILE HA 1 85 ILE MD . . 4.040 3.868 3.851 3.884 . 0 0 "[ . 1 . 2]" 1
1447 1 85 ILE HA 1 85 ILE HG13 . . 4.220 2.722 2.653 2.795 . 0 0 "[ . 1 . 2]" 1
1448 1 85 ILE HA 1 85 ILE MG . . 3.310 2.391 2.330 2.461 . 0 0 "[ . 1 . 2]" 1
1449 1 85 ILE HA 1 86 PRO HD2 . . 3.650 1.915 1.911 1.936 . 0 0 "[ . 1 . 2]" 1
1450 1 85 ILE HA 1 86 PRO QD . . 3.180 1.858 1.850 1.869 . 0 0 "[ . 1 . 2]" 1
1451 1 85 ILE HA 1 86 PRO HD3 . . 3.650 2.509 2.380 2.578 . 0 0 "[ . 1 . 2]" 1
1452 1 85 ILE HA 1 86 PRO QG . . 4.560 3.775 3.765 3.786 . 0 0 "[ . 1 . 2]" 1
1453 1 85 ILE HB 1 85 ILE MD . . 3.180 2.274 2.128 2.369 . 0 0 "[ . 1 . 2]" 1
1454 1 85 ILE MD 1 85 ILE MG . . 2.850 2.261 2.058 2.454 . 0 0 "[ . 1 . 2]" 1
1455 1 85 ILE HG12 1 85 ILE MG . . 3.470 2.194 2.073 2.296 . 0 0 "[ . 1 . 2]" 1
1456 1 85 ILE HG12 1 86 PRO QD . . 5.350 3.998 3.812 4.101 . 0 0 "[ . 1 . 2]" 1
1457 1 85 ILE MG 1 86 PRO HD2 . . 4.260 2.889 2.610 3.099 . 0 0 "[ . 1 . 2]" 1
1458 1 85 ILE MG 1 86 PRO QD . . 3.660 2.829 2.570 3.020 . 0 0 "[ . 1 . 2]" 1
1459 1 85 ILE MG 1 86 PRO HD3 . . 4.260 4.053 3.858 4.187 . 0 0 "[ . 1 . 2]" 1
1460 1 85 ILE MG 1 87 ASP H . . 4.550 3.851 3.300 4.393 . 0 0 "[ . 1 . 2]" 1
1461 1 85 ILE MG 1 87 ASP HA . . 4.000 3.643 3.271 3.954 . 0 0 "[ . 1 . 2]" 1
1462 1 85 ILE MG 1 87 ASP QB . . 4.280 3.839 2.857 4.282 0.002 15 0 "[ . 1 . 2]" 1
1463 1 86 PRO HA 1 87 ASP H . . 3.160 2.248 2.152 2.387 . 0 0 "[ . 1 . 2]" 1
1464 1 86 PRO HA 1 88 LYS H . . 4.720 3.983 3.345 4.374 . 0 0 "[ . 1 . 2]" 1
1465 1 86 PRO HA 1 92 TYR QE . . 4.270 3.456 3.130 3.755 . 0 0 "[ . 1 . 2]" 1
1466 1 86 PRO HA 1 112 ALA MB . . 5.130 4.917 4.498 5.132 0.002 2 0 "[ . 1 . 2]" 1
1467 1 86 PRO QB 1 92 TYR QD . . 4.350 3.597 3.176 3.932 . 0 0 "[ . 1 . 2]" 1
1468 1 86 PRO QB 1 92 TYR QE . . 3.770 2.408 1.813 2.880 . 0 0 "[ . 1 . 2]" 1
1469 1 86 PRO QB 1 112 ALA MB . . 3.290 2.668 2.277 2.850 . 0 0 "[ . 1 . 2]" 1
1470 1 86 PRO HB2 1 92 TYR QD . . 5.000 4.370 4.017 4.683 . 0 0 "[ . 1 . 2]" 1
1471 1 86 PRO HB2 1 92 TYR QE . . 4.420 2.597 1.997 3.149 . 0 0 "[ . 1 . 2]" 1
1472 1 86 PRO HB2 1 112 ALA MB . . 3.980 2.777 2.331 2.973 . 0 0 "[ . 1 . 2]" 1
1473 1 86 PRO HB3 1 92 TYR QD . . 5.000 3.835 3.310 4.226 . 0 0 "[ . 1 . 2]" 1
1474 1 86 PRO HB3 1 92 TYR QE . . 4.420 2.874 2.034 3.336 . 0 0 "[ . 1 . 2]" 1
1475 1 86 PRO HB3 1 112 ALA MB . . 3.980 3.466 3.149 3.752 . 0 0 "[ . 1 . 2]" 1
1476 1 86 PRO QG 1 112 ALA MB . . 3.590 3.147 2.973 3.388 . 0 0 "[ . 1 . 2]" 1
1477 1 86 PRO HG2 1 112 ALA MB . . 4.160 3.600 3.308 3.920 . 0 0 "[ . 1 . 2]" 1
1478 1 86 PRO HG3 1 112 ALA MB . . 4.160 3.479 3.202 3.729 . 0 0 "[ . 1 . 2]" 1
1479 1 87 ASP H 1 87 ASP QB . . 3.530 2.339 2.176 2.673 . 0 0 "[ . 1 . 2]" 1
1480 1 87 ASP H 1 88 LYS H . . 3.820 2.680 2.360 3.017 . 0 0 "[ . 1 . 2]" 1
1481 1 87 ASP H 1 92 TYR QE . . 4.670 4.433 4.049 4.682 0.012 15 0 "[ . 1 . 2]" 1
1482 1 87 ASP QB 1 88 LYS H . . 4.050 2.479 2.040 3.861 . 0 0 "[ . 1 . 2]" 1
1483 1 88 LYS H 1 88 LYS HB2 . . 4.150 2.462 2.196 3.649 . 0 0 "[ . 1 . 2]" 1
1484 1 88 LYS H 1 88 LYS QB . . 3.520 2.359 2.174 2.777 . 0 0 "[ . 1 . 2]" 1
1485 1 88 LYS H 1 88 LYS HB3 . . 4.150 3.490 2.364 3.760 . 0 0 "[ . 1 . 2]" 1
1486 1 88 LYS H 1 88 LYS QG . . 3.930 2.906 2.235 3.927 . 0 0 "[ . 1 . 2]" 1
1487 1 88 LYS HA 1 88 LYS QD . . 4.790 3.251 2.028 4.158 . 0 0 "[ . 1 . 2]" 1
1488 1 88 LYS HA 1 88 LYS QG . . 3.930 2.508 2.231 3.425 . 0 0 "[ . 1 . 2]" 1
1489 1 88 LYS HA 1 89 THR H . . 3.560 2.331 2.140 2.546 . 0 0 "[ . 1 . 2]" 1
1490 1 88 LYS QB 1 89 THR H . . 4.000 2.900 2.114 3.988 . 0 0 "[ . 1 . 2]" 1
1491 1 88 LYS QB 1 89 THR HA . . 5.340 4.386 4.027 5.117 . 0 0 "[ . 1 . 2]" 1
1492 1 88 LYS HB2 1 89 THR H . . 4.700 3.975 3.027 4.546 . 0 0 "[ . 1 . 2]" 1
1493 1 88 LYS HB3 1 89 THR H . . 4.700 3.065 2.137 4.503 . 0 0 "[ . 1 . 2]" 1
1494 1 88 LYS QG 1 89 THR H . . 4.680 3.954 3.258 4.628 . 0 0 "[ . 1 . 2]" 1
1495 1 89 THR H 1 89 THR MG . . 3.770 2.625 1.822 3.168 . 0 0 "[ . 1 . 2]" 1
1496 1 89 THR H 1 90 GLY H . . 4.720 4.525 4.325 4.652 . 0 0 "[ . 1 . 2]" 1
1497 1 89 THR HA 1 89 THR MG . . 3.210 2.318 2.195 3.130 . 0 0 "[ . 1 . 2]" 1
1498 1 89 THR HA 1 90 GLY H . . 3.000 2.264 2.162 2.509 . 0 0 "[ . 1 . 2]" 1
1499 1 89 THR HA 1 112 ALA H . . 5.090 4.302 3.885 4.664 . 0 0 "[ . 1 . 2]" 1
1500 1 89 THR HA 1 112 ALA MB . . 3.410 2.385 1.963 3.006 . 0 0 "[ . 1 . 2]" 1
1501 1 89 THR HB 1 90 GLY H . . 3.240 2.893 2.207 3.306 0.066 1 0 "[ . 1 . 2]" 1
1502 1 89 THR MG 1 90 GLY H . . 3.930 3.785 3.553 3.908 . 0 0 "[ . 1 . 2]" 1
1503 1 89 THR MG 1 112 ALA MB . . 4.130 2.902 2.237 3.760 . 0 0 "[ . 1 . 2]" 1
1504 1 89 THR MG 1 114 GLN H . . 4.580 3.815 3.181 4.530 . 0 0 "[ . 1 . 2]" 1
1505 1 89 THR MG 1 114 GLN HB2 . . 4.000 2.474 1.852 3.532 . 0 0 "[ . 1 . 2]" 1
1506 1 89 THR MG 1 114 GLN QB . . 3.460 2.239 1.822 2.776 . 0 0 "[ . 1 . 2]" 1
1507 1 89 THR MG 1 114 GLN HB3 . . 4.000 3.152 2.018 3.911 . 0 0 "[ . 1 . 2]" 1
1508 1 89 THR MG 1 114 GLN QG . . 4.080 2.988 1.848 3.860 . 0 0 "[ . 1 . 2]" 1
1509 1 90 GLY H 1 91 ARG H . . 4.460 4.274 4.060 4.438 . 0 0 "[ . 1 . 2]" 1
1510 1 90 GLY H 1 111 ARG HA . . 4.680 4.409 3.943 4.659 . 0 0 "[ . 1 . 2]" 1
1511 1 90 GLY H 1 112 ALA H . . 3.770 2.969 2.584 3.278 . 0 0 "[ . 1 . 2]" 1
1512 1 90 GLY H 1 112 ALA MB . . 3.400 2.591 1.925 3.259 . 0 0 "[ . 1 . 2]" 1
1513 1 90 GLY QA 1 91 ARG H . . 2.810 2.150 2.109 2.284 . 0 0 "[ . 1 . 2]" 1
1514 1 90 GLY HA2 1 91 ARG H . . 3.270 3.055 2.545 3.250 . 0 0 "[ . 1 . 2]" 1
1515 1 90 GLY HA3 1 91 ARG H . . 3.270 2.221 2.137 2.579 . 0 0 "[ . 1 . 2]" 1
1516 1 91 ARG H 1 91 ARG HB2 . . 3.760 3.118 2.234 3.780 0.020 7 0 "[ . 1 . 2]" 1
1517 1 91 ARG H 1 91 ARG QB . . 3.250 2.557 2.159 2.932 . 0 0 "[ . 1 . 2]" 1
1518 1 91 ARG H 1 91 ARG HB3 . . 3.760 3.032 2.325 3.741 . 0 0 "[ . 1 . 2]" 1
1519 1 91 ARG H 1 91 ARG HG2 . . 4.410 3.272 1.904 4.509 0.099 8 0 "[ . 1 . 2]" 1
1520 1 91 ARG H 1 91 ARG HG3 . . 4.410 3.592 2.654 4.476 0.066 9 0 "[ . 1 . 2]" 1
1521 1 91 ARG H 1 92 TYR H . . 4.570 4.465 4.362 4.574 0.004 8 0 "[ . 1 . 2]" 1
1522 1 91 ARG H 1 92 TYR QD . . 5.500 5.267 4.655 5.497 . 0 0 "[ . 1 . 2]" 1
1523 1 91 ARG HA 1 91 ARG HG2 . . 4.210 3.457 2.487 3.938 . 0 0 "[ . 1 . 2]" 1
1524 1 91 ARG HA 1 91 ARG QG . . 3.600 2.891 2.315 3.392 . 0 0 "[ . 1 . 2]" 1
1525 1 91 ARG HA 1 91 ARG HG3 . . 4.210 3.226 2.345 4.181 . 0 0 "[ . 1 . 2]" 1
1526 1 91 ARG HA 1 92 TYR H . . 2.960 2.184 2.140 2.264 . 0 0 "[ . 1 . 2]" 1
1527 1 91 ARG HA 1 110 ILE H . . 4.710 4.422 3.950 4.674 . 0 0 "[ . 1 . 2]" 1
1528 1 91 ARG QB 1 91 ARG QD . . 2.850 2.227 2.071 2.486 . 0 0 "[ . 1 . 2]" 1
1529 1 91 ARG QB 1 92 TYR H . . 3.890 3.184 2.796 3.896 0.006 1 0 "[ . 1 . 2]" 1
1530 1 91 ARG HB2 1 92 TYR H . . 4.600 3.657 2.855 4.425 . 0 0 "[ . 1 . 2]" 1
1531 1 91 ARG HB3 1 92 TYR H . . 4.600 3.879 2.883 4.465 . 0 0 "[ . 1 . 2]" 1
1532 1 91 ARG QG 1 92 TYR H . . 4.390 3.686 2.544 4.160 . 0 0 "[ . 1 . 2]" 1
1533 1 91 ARG HG2 1 92 TYR H . . 5.210 4.485 2.829 5.175 . 0 0 "[ . 1 . 2]" 1
1534 1 91 ARG HG3 1 92 TYR H . . 5.210 4.076 2.566 4.835 . 0 0 "[ . 1 . 2]" 1
1535 1 92 TYR H 1 92 TYR HB2 . . 3.570 2.459 2.304 2.604 . 0 0 "[ . 1 . 2]" 1
1536 1 92 TYR H 1 92 TYR HB3 . . 4.030 3.633 3.551 3.719 . 0 0 "[ . 1 . 2]" 1
1537 1 92 TYR H 1 92 TYR QD . . 3.950 3.504 3.195 3.930 . 0 0 "[ . 1 . 2]" 1
1538 1 92 TYR H 1 93 MET H . . 4.450 4.340 4.098 4.462 0.012 20 0 "[ . 1 . 2]" 1
1539 1 92 TYR H 1 109 ARG HA . . 4.720 4.628 4.443 4.767 0.047 19 0 "[ . 1 . 2]" 1
1540 1 92 TYR H 1 110 ILE H . . 3.840 2.986 2.776 3.131 . 0 0 "[ . 1 . 2]" 1
1541 1 92 TYR H 1 110 ILE HB . . 4.410 3.646 3.255 3.974 . 0 0 "[ . 1 . 2]" 1
1542 1 92 TYR H 1 110 ILE MD . . 5.500 5.301 4.955 5.530 0.030 12 0 "[ . 1 . 2]" 1
1543 1 92 TYR H 1 111 ARG HA . . 3.900 3.543 3.140 3.787 . 0 0 "[ . 1 . 2]" 1
1544 1 92 TYR H 1 111 ARG QG . . 5.340 4.576 3.834 5.406 0.066 19 0 "[ . 1 . 2]" 1
1545 1 92 TYR HA 1 92 TYR QD . . 3.950 2.560 2.097 2.938 . 0 0 "[ . 1 . 2]" 1
1546 1 92 TYR HA 1 92 TYR QE . . 4.730 4.384 4.224 4.521 . 0 0 "[ . 1 . 2]" 1
1547 1 92 TYR HA 1 93 MET H . . 2.920 2.159 2.140 2.203 . 0 0 "[ . 1 . 2]" 1
1548 1 92 TYR HA 1 93 MET HA . . 4.990 4.392 4.384 4.400 . 0 0 "[ . 1 . 2]" 1
1549 1 92 TYR HB2 1 93 MET H . . 4.530 4.362 4.172 4.505 . 0 0 "[ . 1 . 2]" 1
1550 1 92 TYR HB2 1 94 ILE HG13 . . 5.210 4.716 4.274 5.029 . 0 0 "[ . 1 . 2]" 1
1551 1 92 TYR HB2 1 110 ILE H . . 4.330 3.863 3.593 4.081 . 0 0 "[ . 1 . 2]" 1
1552 1 92 TYR HB2 1 110 ILE HB . . 4.030 2.468 2.172 2.623 . 0 0 "[ . 1 . 2]" 1
1553 1 92 TYR HB2 1 110 ILE MD . . 4.720 3.858 3.501 4.072 . 0 0 "[ . 1 . 2]" 1
1554 1 92 TYR HB2 1 110 ILE HG12 . . 5.500 5.411 5.192 5.506 0.006 2 0 "[ . 1 . 2]" 1
1555 1 92 TYR HB2 1 110 ILE HG13 . . 4.820 4.398 4.006 4.606 . 0 0 "[ . 1 . 2]" 1
1556 1 92 TYR HB2 1 110 ILE MG . . 4.110 3.628 3.228 3.922 . 0 0 "[ . 1 . 2]" 1
1557 1 92 TYR HB3 1 93 MET H . . 3.770 3.360 3.036 3.668 . 0 0 "[ . 1 . 2]" 1
1558 1 92 TYR HB3 1 94 ILE HG12 . . 5.500 4.370 4.113 4.715 . 0 0 "[ . 1 . 2]" 1
1559 1 92 TYR HB3 1 94 ILE HG13 . . 5.010 3.395 3.203 3.619 . 0 0 "[ . 1 . 2]" 1
1560 1 92 TYR HB3 1 110 ILE H . . 4.980 4.728 4.436 4.982 0.002 7 0 "[ . 1 . 2]" 1
1561 1 92 TYR HB3 1 110 ILE HB . . 4.610 3.455 3.116 3.815 . 0 0 "[ . 1 . 2]" 1
1562 1 92 TYR HB3 1 110 ILE MD . . 5.500 3.849 3.623 4.113 . 0 0 "[ . 1 . 2]" 1
1563 1 92 TYR QD 1 93 MET H . . 4.280 3.513 3.211 3.812 . 0 0 "[ . 1 . 2]" 1
1564 1 92 TYR QD 1 110 ILE HB . . 4.540 3.979 3.628 4.263 . 0 0 "[ . 1 . 2]" 1
1565 1 92 TYR QD 1 110 ILE MD . . 5.040 4.885 4.431 5.053 0.013 19 0 "[ . 1 . 2]" 1
1566 1 92 TYR QD 1 112 ALA H . . 4.590 3.305 2.733 4.180 . 0 0 "[ . 1 . 2]" 1
1567 1 92 TYR QD 1 112 ALA MB . . 3.950 2.870 2.387 3.635 . 0 0 "[ . 1 . 2]" 1
1568 1 92 TYR QE 1 112 ALA MB . . 3.190 2.291 1.833 2.854 . 0 0 "[ . 1 . 2]" 1
1569 1 93 MET H 1 93 MET QB . . 3.290 2.439 2.344 2.526 . 0 0 "[ . 1 . 2]" 1
1570 1 93 MET H 1 93 MET HG2 . . 4.830 4.669 4.310 4.818 . 0 0 "[ . 1 . 2]" 1
1571 1 93 MET H 1 93 MET QG . . 4.180 4.108 3.977 4.196 0.016 17 0 "[ . 1 . 2]" 1
1572 1 93 MET H 1 93 MET HG3 . . 4.830 4.574 4.425 4.712 . 0 0 "[ . 1 . 2]" 1
1573 1 93 MET H 1 94 ILE H . . 4.590 4.315 4.144 4.466 . 0 0 "[ . 1 . 2]" 1
1574 1 93 MET HA 1 93 MET ME . . 4.850 3.455 1.873 4.655 . 0 0 "[ . 1 . 2]" 1
1575 1 93 MET HA 1 93 MET HG2 . . 4.130 3.345 2.838 3.697 . 0 0 "[ . 1 . 2]" 1
1576 1 93 MET HA 1 93 MET HG3 . . 4.130 2.508 2.171 2.947 . 0 0 "[ . 1 . 2]" 1
1577 1 93 MET HA 1 94 ILE H . . 2.970 2.149 2.140 2.165 . 0 0 "[ . 1 . 2]" 1
1578 1 93 MET HA 1 94 ILE HB . . 4.850 4.662 4.577 4.778 . 0 0 "[ . 1 . 2]" 1
1579 1 93 MET HA 1 109 ARG HA . . 3.790 3.540 3.033 3.788 . 0 0 "[ . 1 . 2]" 1
1580 1 93 MET HA 1 110 ILE H . . 4.260 4.188 3.935 4.266 0.006 14 0 "[ . 1 . 2]" 1
1581 1 93 MET QB 1 94 ILE H . . 4.080 3.788 3.663 3.926 . 0 0 "[ . 1 . 2]" 1
1582 1 93 MET ME 1 93 MET QG . . 3.510 2.195 2.013 2.455 . 0 0 "[ . 1 . 2]" 1
1583 1 93 MET ME 1 109 ARG QG . . 4.780 3.996 1.766 4.783 0.003 17 0 "[ . 1 . 2]" 1
1584 1 93 MET QG 1 107 PRO QB . . 3.130 1.980 1.726 2.277 . 0 0 "[ . 1 . 2]" 1
1585 1 93 MET HG2 1 94 ILE H . . 4.710 3.973 2.678 4.620 . 0 0 "[ . 1 . 2]" 1
1586 1 93 MET HG2 1 107 PRO HB2 . . 4.070 2.914 1.997 3.548 . 0 0 "[ . 1 . 2]" 1
1587 1 93 MET HG2 1 107 PRO HB3 . . 4.070 3.123 2.228 3.965 . 0 0 "[ . 1 . 2]" 1
1588 1 93 MET HG3 1 94 ILE H . . 4.710 3.215 2.728 3.736 . 0 0 "[ . 1 . 2]" 1
1589 1 93 MET HG3 1 107 PRO HB2 . . 4.070 2.140 1.996 2.426 . 0 0 "[ . 1 . 2]" 1
1590 1 93 MET HG3 1 107 PRO HB3 . . 4.070 3.038 2.551 3.493 . 0 0 "[ . 1 . 2]" 1
1591 1 94 ILE H 1 94 ILE HB . . 3.660 2.637 2.538 2.723 . 0 0 "[ . 1 . 2]" 1
1592 1 94 ILE H 1 94 ILE MD . . 4.370 3.718 3.463 3.933 . 0 0 "[ . 1 . 2]" 1
1593 1 94 ILE H 1 94 ILE HG12 . . 4.460 3.990 3.818 4.194 . 0 0 "[ . 1 . 2]" 1
1594 1 94 ILE H 1 94 ILE HG13 . . 3.940 2.673 2.426 2.903 . 0 0 "[ . 1 . 2]" 1
1595 1 94 ILE H 1 94 ILE MG . . 4.460 3.848 3.800 3.887 . 0 0 "[ . 1 . 2]" 1
1596 1 94 ILE H 1 95 GLY H . . 4.630 4.377 4.207 4.484 . 0 0 "[ . 1 . 2]" 1
1597 1 94 ILE H 1 108 TYR HB2 . . 4.270 2.951 2.598 3.475 . 0 0 "[ . 1 . 2]" 1
1598 1 94 ILE H 1 108 TYR HB3 . . 4.270 3.935 3.553 4.274 0.004 9 0 "[ . 1 . 2]" 1
1599 1 94 ILE H 1 109 ARG H . . 5.500 5.243 4.934 5.353 . 0 0 "[ . 1 . 2]" 1
1600 1 94 ILE H 1 109 ARG HA . . 4.900 4.569 4.201 4.864 . 0 0 "[ . 1 . 2]" 1
1601 1 94 ILE H 1 110 ILE H . . 5.500 5.275 4.984 5.482 . 0 0 "[ . 1 . 2]" 1
1602 1 94 ILE H 1 110 ILE MD . . 4.960 4.486 4.118 4.877 . 0 0 "[ . 1 . 2]" 1
1603 1 94 ILE HA 1 94 ILE MD . . 4.200 3.890 3.863 3.928 . 0 0 "[ . 1 . 2]" 1
1604 1 94 ILE HA 1 94 ILE HG12 . . 4.240 2.704 2.614 2.817 . 0 0 "[ . 1 . 2]" 1
1605 1 94 ILE HA 1 94 ILE MG . . 3.400 2.345 2.270 2.450 . 0 0 "[ . 1 . 2]" 1
1606 1 94 ILE HA 1 95 GLY H . . 2.960 2.163 2.143 2.255 . 0 0 "[ . 1 . 2]" 1
1607 1 94 ILE HA 1 108 TYR H . . 5.090 4.442 4.215 4.633 . 0 0 "[ . 1 . 2]" 1
1608 1 94 ILE HB 1 94 ILE MD . . 3.440 2.315 2.162 2.410 . 0 0 "[ . 1 . 2]" 1
1609 1 94 ILE HB 1 95 GLY H . . 4.880 4.154 3.801 4.322 . 0 0 "[ . 1 . 2]" 1
1610 1 94 ILE HB 1 108 TYR H . . 4.140 3.415 2.860 3.752 . 0 0 "[ . 1 . 2]" 1
1611 1 94 ILE HB 1 108 TYR HB2 . . 3.670 2.050 1.994 2.197 . 0 0 "[ . 1 . 2]" 1
1612 1 94 ILE HB 1 108 TYR HB3 . . 4.050 3.341 3.144 3.546 . 0 0 "[ . 1 . 2]" 1
1613 1 94 ILE HB 1 108 TYR QD . . 3.940 3.692 3.226 3.943 0.003 10 0 "[ . 1 . 2]" 1
1614 1 94 ILE HB 1 110 ILE MD . . 4.910 3.696 3.303 3.840 . 0 0 "[ . 1 . 2]" 1
1615 1 94 ILE MD 1 108 TYR HB3 . . 3.840 3.441 3.070 3.769 . 0 0 "[ . 1 . 2]" 1
1616 1 94 ILE MD 1 110 ILE HB . . 3.910 3.834 3.655 3.921 0.011 17 0 "[ . 1 . 2]" 1
1617 1 94 ILE MD 1 110 ILE MD . . 3.760 1.775 1.666 1.876 . 0 0 "[ . 1 . 2]" 1
1618 1 94 ILE MD 1 110 ILE HG12 . . 4.180 4.073 3.862 4.174 . 0 0 "[ . 1 . 2]" 1
1619 1 94 ILE MD 1 110 ILE HG13 . . 3.360 3.270 2.937 3.364 0.004 12 0 "[ . 1 . 2]" 1
1620 1 94 ILE MD 1 110 ILE MG . . 4.110 3.967 3.742 4.122 0.012 9 0 "[ . 1 . 2]" 1
1621 1 94 ILE HG12 1 94 ILE MG . . 3.390 2.236 2.105 2.336 . 0 0 "[ . 1 . 2]" 1
1622 1 94 ILE HG12 1 95 GLY H . . 4.730 4.513 4.378 4.721 . 0 0 "[ . 1 . 2]" 1
1623 1 94 ILE HG13 1 94 ILE MG . . 3.630 3.176 3.146 3.194 . 0 0 "[ . 1 . 2]" 1
1624 1 94 ILE HG13 1 95 GLY H . . 5.010 4.930 4.766 5.003 . 0 0 "[ . 1 . 2]" 1
1625 1 94 ILE HG13 1 108 TYR HB2 . . 4.610 4.012 3.729 4.287 . 0 0 "[ . 1 . 2]" 1
1626 1 94 ILE HG13 1 108 TYR HB3 . . 5.500 4.649 4.396 5.008 . 0 0 "[ . 1 . 2]" 1
1627 1 94 ILE MG 1 95 GLY H . . 3.840 2.502 2.098 2.844 . 0 0 "[ . 1 . 2]" 1
1628 1 94 ILE MG 1 96 VAL H . . 4.430 3.379 3.136 3.633 . 0 0 "[ . 1 . 2]" 1
1629 1 94 ILE MG 1 96 VAL MG2 . . 3.110 2.223 2.042 2.609 . 0 0 "[ . 1 . 2]" 1
1630 1 94 ILE MG 1 108 TYR HB2 . . 4.440 3.465 3.229 3.639 . 0 0 "[ . 1 . 2]" 1
1631 1 94 ILE MG 1 108 TYR QD . . 4.230 3.890 3.019 4.226 . 0 0 "[ . 1 . 2]" 1
1632 1 95 GLY H 1 96 VAL H . . 4.210 4.003 3.930 4.154 . 0 0 "[ . 1 . 2]" 1
1633 1 95 GLY HA2 1 96 VAL H . . 3.420 2.226 2.170 2.273 . 0 0 "[ . 1 . 2]" 1
1634 1 95 GLY HA2 1 107 PRO HA . . 4.050 2.559 2.230 2.784 . 0 0 "[ . 1 . 2]" 1
1635 1 95 GLY HA2 1 107 PRO HB2 . . 4.720 4.538 3.796 4.730 0.010 3 0 "[ . 1 . 2]" 1
1636 1 95 GLY HA2 1 107 PRO QB . . 4.010 3.470 2.488 3.748 . 0 0 "[ . 1 . 2]" 1
1637 1 95 GLY HA2 1 107 PRO HB3 . . 4.720 3.606 2.523 3.932 . 0 0 "[ . 1 . 2]" 1
1638 1 95 GLY HA2 1 108 TYR H . . 5.280 3.953 3.494 4.183 . 0 0 "[ . 1 . 2]" 1
1639 1 95 GLY HA3 1 106 SER QB . . 4.890 3.673 3.273 4.073 . 0 0 "[ . 1 . 2]" 1
1640 1 95 GLY HA3 1 107 PRO HA . . 4.390 3.902 3.467 4.271 . 0 0 "[ . 1 . 2]" 1
1641 1 95 GLY HA3 1 107 PRO QB . . 4.320 3.911 3.147 4.206 . 0 0 "[ . 1 . 2]" 1
1642 1 96 VAL H 1 96 VAL HB . . 4.090 2.499 2.476 2.550 . 0 0 "[ . 1 . 2]" 1
1643 1 96 VAL H 1 96 VAL MG1 . . 4.750 3.776 3.767 3.794 . 0 0 "[ . 1 . 2]" 1
1644 1 96 VAL H 1 96 VAL MG2 . . 3.890 2.377 2.210 2.491 . 0 0 "[ . 1 . 2]" 1
1645 1 96 VAL H 1 97 THR H . . 4.790 4.520 4.348 4.610 . 0 0 "[ . 1 . 2]" 1
1646 1 96 VAL H 1 103 ILE MD . . 4.280 3.887 3.541 4.178 . 0 0 "[ . 1 . 2]" 1
1647 1 96 VAL H 1 106 SER HB2 . . 4.460 2.981 2.302 3.597 . 0 0 "[ . 1 . 2]" 1
1648 1 96 VAL H 1 106 SER QB . . 3.860 2.583 2.220 3.090 . 0 0 "[ . 1 . 2]" 1
1649 1 96 VAL H 1 106 SER HB3 . . 4.460 2.927 2.302 3.367 . 0 0 "[ . 1 . 2]" 1
1650 1 96 VAL H 1 108 TYR QD . . 3.860 3.567 2.790 3.870 0.010 3 0 "[ . 1 . 2]" 1
1651 1 96 VAL HA 1 96 VAL MG1 . . 3.390 2.377 2.298 2.466 . 0 0 "[ . 1 . 2]" 1
1652 1 96 VAL HA 1 96 VAL MG2 . . 3.570 2.370 2.277 2.457 . 0 0 "[ . 1 . 2]" 1
1653 1 96 VAL HA 1 97 THR H . . 3.010 2.178 2.139 2.284 . 0 0 "[ . 1 . 2]" 1
1654 1 96 VAL HB 1 97 THR H . . 4.700 4.119 3.813 4.379 . 0 0 "[ . 1 . 2]" 1
1655 1 96 VAL HB 1 103 ILE H . . 4.560 4.361 4.061 4.565 0.005 7 0 "[ . 1 . 2]" 1
1656 1 96 VAL HB 1 103 ILE MD . . 3.300 2.231 1.955 2.837 . 0 0 "[ . 1 . 2]" 1
1657 1 96 VAL HB 1 103 ILE QG . . 3.700 2.783 2.518 3.209 . 0 0 "[ . 1 . 2]" 1
1658 1 96 VAL HB 1 106 SER QB . . 4.270 3.484 2.897 3.894 . 0 0 "[ . 1 . 2]" 1
1659 1 96 VAL MG1 1 97 THR H . . 3.420 2.397 1.901 3.011 . 0 0 "[ . 1 . 2]" 1
1660 1 96 VAL MG2 1 106 SER HB2 . . 5.240 4.595 4.044 5.190 . 0 0 "[ . 1 . 2]" 1
1661 1 96 VAL MG2 1 106 SER QB . . 4.480 3.988 3.561 4.413 . 0 0 "[ . 1 . 2]" 1
1662 1 96 VAL MG2 1 106 SER HB3 . . 5.240 4.430 3.697 5.029 . 0 0 "[ . 1 . 2]" 1
1663 1 96 VAL MG2 1 108 TYR QD . . 3.880 3.513 2.798 3.860 . 0 0 "[ . 1 . 2]" 1
1664 1 96 VAL MG2 1 108 TYR QE . . 3.940 3.480 2.562 3.939 . 0 0 "[ . 1 . 2]" 1
1665 1 97 THR H 1 97 THR MG . . 3.490 3.086 2.795 3.256 . 0 0 "[ . 1 . 2]" 1
1666 1 97 THR H 1 98 TYR H . . 4.630 4.427 4.340 4.509 . 0 0 "[ . 1 . 2]" 1
1667 1 97 THR HA 1 97 THR MG . . 3.300 2.264 2.084 2.357 . 0 0 "[ . 1 . 2]" 1
1668 1 97 THR HA 1 98 TYR H . . 3.000 2.237 2.179 2.269 . 0 0 "[ . 1 . 2]" 1
1669 1 97 THR HA 1 101 ASP H . . 4.420 4.234 4.082 4.360 . 0 0 "[ . 1 . 2]" 1
1670 1 97 THR HA 1 102 ASP HA . . 3.830 2.116 1.996 2.563 . 0 0 "[ . 1 . 2]" 1
1671 1 97 THR HA 1 103 ILE H . . 3.980 3.195 2.823 3.603 . 0 0 "[ . 1 . 2]" 1
1672 1 97 THR HA 1 103 ILE MG . . 4.320 3.925 3.421 4.324 0.004 20 0 "[ . 1 . 2]" 1
1673 1 97 THR HB 1 98 TYR H . . 3.450 2.856 2.749 3.090 . 0 0 "[ . 1 . 2]" 1
1674 1 97 THR HB 1 100 GLY H . . 3.890 3.865 3.707 3.895 0.005 20 0 "[ . 1 . 2]" 1
1675 1 97 THR HB 1 100 GLY HA2 . . 4.630 3.868 3.758 3.963 . 0 0 "[ . 1 . 2]" 1
1676 1 97 THR HB 1 100 GLY HA3 . . 5.500 5.389 5.323 5.463 . 0 0 "[ . 1 . 2]" 1
1677 1 97 THR HB 1 101 ASP H . . 3.680 3.016 2.746 3.409 . 0 0 "[ . 1 . 2]" 1
1678 1 97 THR HB 1 102 ASP HA . . 4.760 3.605 3.306 4.065 . 0 0 "[ . 1 . 2]" 1
1679 1 97 THR MG 1 98 TYR H . . 3.860 3.689 3.560 3.805 . 0 0 "[ . 1 . 2]" 1
1680 1 97 THR MG 1 100 GLY H . . 5.380 5.150 4.917 5.212 . 0 0 "[ . 1 . 2]" 1
1681 1 97 THR MG 1 101 ASP H . . 4.180 4.036 3.850 4.187 0.007 17 0 "[ . 1 . 2]" 1
1682 1 97 THR MG 1 102 ASP H . . 3.930 3.265 2.851 3.651 . 0 0 "[ . 1 . 2]" 1
1683 1 97 THR MG 1 102 ASP HA . . 3.260 2.196 1.970 2.654 . 0 0 "[ . 1 . 2]" 1
1684 1 97 THR MG 1 102 ASP HB2 . . 4.700 3.394 3.089 3.829 . 0 0 "[ . 1 . 2]" 1
1685 1 97 THR MG 1 102 ASP QB . . 4.130 2.179 1.856 2.867 . 0 0 "[ . 1 . 2]" 1
1686 1 97 THR MG 1 102 ASP HB3 . . 4.700 2.209 1.869 2.962 . 0 0 "[ . 1 . 2]" 1
1687 1 98 TYR H 1 98 TYR HB2 . . 4.020 2.899 2.822 2.990 . 0 0 "[ . 1 . 2]" 1
1688 1 98 TYR H 1 98 TYR QB . . 3.480 2.625 2.560 2.678 . 0 0 "[ . 1 . 2]" 1
1689 1 98 TYR H 1 98 TYR HB3 . . 4.020 3.002 2.861 3.069 . 0 0 "[ . 1 . 2]" 1
1690 1 98 TYR H 1 98 TYR QD . . 4.590 4.405 4.376 4.434 . 0 0 "[ . 1 . 2]" 1
1691 1 98 TYR H 1 99 GLY H . . 4.670 4.162 3.993 4.318 . 0 0 "[ . 1 . 2]" 1
1692 1 98 TYR H 1 100 GLY H . . 4.540 4.340 3.943 4.505 . 0 0 "[ . 1 . 2]" 1
1693 1 98 TYR H 1 101 ASP H . . 3.520 2.794 2.628 2.925 . 0 0 "[ . 1 . 2]" 1
1694 1 98 TYR H 1 101 ASP HB2 . . 4.960 4.082 3.881 4.597 . 0 0 "[ . 1 . 2]" 1
1695 1 98 TYR H 1 101 ASP HB3 . . 4.870 4.484 3.489 4.699 . 0 0 "[ . 1 . 2]" 1
1696 1 98 TYR H 1 102 ASP HA . . 4.250 3.333 3.091 3.796 . 0 0 "[ . 1 . 2]" 1
1697 1 98 TYR H 1 103 ILE H . . 4.730 4.340 3.934 4.668 . 0 0 "[ . 1 . 2]" 1
1698 1 98 TYR H 1 103 ILE MG . . 4.280 3.980 3.432 4.292 0.012 20 0 "[ . 1 . 2]" 1
1699 1 98 TYR HA 1 98 TYR QD . . 3.960 2.771 2.540 2.914 . 0 0 "[ . 1 . 2]" 1
1700 1 98 TYR HA 1 98 TYR QE . . 5.150 4.452 4.360 4.539 . 0 0 "[ . 1 . 2]" 1
1701 1 98 TYR HA 1 99 GLY H . . 3.040 2.145 2.141 2.155 . 0 0 "[ . 1 . 2]" 1
1702 1 98 TYR HA 1 99 GLY HA2 . . 4.580 4.380 4.378 4.383 . 0 0 "[ . 1 . 2]" 1
1703 1 98 TYR HA 1 99 GLY HA3 . . 4.440 4.389 4.363 4.427 . 0 0 "[ . 1 . 2]" 1
1704 1 98 TYR HA 1 100 GLY H . . 4.200 4.024 3.712 4.147 . 0 0 "[ . 1 . 2]" 1
1705 1 98 TYR HA 1 101 ASP H . . 4.590 4.325 4.207 4.436 . 0 0 "[ . 1 . 2]" 1
1706 1 98 TYR QB 1 103 ILE MG . . 3.550 3.209 2.714 3.520 . 0 0 "[ . 1 . 2]" 1
1707 1 98 TYR HB2 1 99 GLY H . . 4.720 4.485 4.381 4.560 . 0 0 "[ . 1 . 2]" 1
1708 1 98 TYR HB2 1 103 ILE MG . . 4.180 3.420 2.833 3.844 . 0 0 "[ . 1 . 2]" 1
1709 1 98 TYR HB3 1 99 GLY H . . 4.720 4.078 3.943 4.169 . 0 0 "[ . 1 . 2]" 1
1710 1 98 TYR HB3 1 103 ILE MG . . 4.180 3.903 3.474 4.187 0.007 20 0 "[ . 1 . 2]" 1
1711 1 98 TYR QD 1 99 GLY H . . 4.160 3.839 3.571 4.052 . 0 0 "[ . 1 . 2]" 1
1712 1 99 GLY H 1 100 GLY H . . 3.580 2.766 2.617 2.921 . 0 0 "[ . 1 . 2]" 1
1713 1 99 GLY H 1 101 ASP H . . 4.760 4.111 3.990 4.217 . 0 0 "[ . 1 . 2]" 1
1714 1 99 GLY HA2 1 100 GLY H . . 3.540 2.772 2.716 2.915 . 0 0 "[ . 1 . 2]" 1
1715 1 99 GLY HA2 1 101 ASP H . . 4.610 4.558 4.443 4.611 0.001 13 0 "[ . 1 . 2]" 1
1716 1 99 GLY HA3 1 101 ASP H . . 4.410 4.248 4.098 4.371 . 0 0 "[ . 1 . 2]" 1
1717 1 100 GLY H 1 101 ASP H . . 3.520 2.667 2.501 2.719 . 0 0 "[ . 1 . 2]" 1
1718 1 101 ASP H 1 101 ASP HB2 . . 3.250 2.777 2.680 2.997 . 0 0 "[ . 1 . 2]" 1
1719 1 101 ASP H 1 101 ASP HB3 . . 3.920 3.736 3.105 3.803 . 0 0 "[ . 1 . 2]" 1
1720 1 101 ASP H 1 102 ASP H . . 4.410 4.068 4.000 4.364 . 0 0 "[ . 1 . 2]" 1
1721 1 101 ASP HA 1 102 ASP H . . 2.840 2.145 2.137 2.255 . 0 0 "[ . 1 . 2]" 1
1722 1 101 ASP HB2 1 102 ASP H . . 4.500 4.448 4.191 4.485 . 0 0 "[ . 1 . 2]" 1
1723 1 101 ASP HB3 1 102 ASP H . . 3.580 3.549 3.377 3.583 0.003 7 0 "[ . 1 . 2]" 1
1724 1 102 ASP H 1 102 ASP HB2 . . 3.670 3.390 2.703 3.601 . 0 0 "[ . 1 . 2]" 1
1725 1 102 ASP H 1 102 ASP QB . . 3.200 2.780 2.575 2.944 . 0 0 "[ . 1 . 2]" 1
1726 1 102 ASP H 1 102 ASP HB3 . . 3.670 3.068 2.638 3.607 . 0 0 "[ . 1 . 2]" 1
1727 1 102 ASP H 1 103 ILE H . . 4.720 4.587 4.494 4.619 . 0 0 "[ . 1 . 2]" 1
1728 1 102 ASP HA 1 103 ILE H . . 3.270 2.214 2.148 2.323 . 0 0 "[ . 1 . 2]" 1
1729 1 102 ASP HA 1 103 ILE MG . . 4.420 3.960 3.684 4.126 . 0 0 "[ . 1 . 2]" 1
1730 1 102 ASP QB 1 106 SER H . . 4.930 4.666 4.475 4.929 . 0 0 "[ . 1 . 2]" 1
1731 1 102 ASP QB 1 106 SER QB . . 3.850 3.524 3.194 3.854 0.004 2 0 "[ . 1 . 2]" 1
1732 1 102 ASP HB2 1 103 ILE H . . 4.190 3.186 2.760 3.882 . 0 0 "[ . 1 . 2]" 1
1733 1 102 ASP HB2 1 106 SER HB2 . . 5.380 4.344 3.490 5.391 0.011 19 0 "[ . 1 . 2]" 1
1734 1 102 ASP HB2 1 106 SER HB3 . . 5.380 4.478 3.982 5.409 0.029 17 0 "[ . 1 . 2]" 1
1735 1 102 ASP HB3 1 103 ILE H . . 4.190 3.682 2.810 4.054 . 0 0 "[ . 1 . 2]" 1
1736 1 102 ASP HB3 1 106 SER HB2 . . 5.380 4.848 3.551 5.399 0.019 14 0 "[ . 1 . 2]" 1
1737 1 102 ASP HB3 1 106 SER HB3 . . 5.380 4.987 3.689 5.386 0.006 8 0 "[ . 1 . 2]" 1
1738 1 103 ILE H 1 103 ILE HB . . 4.170 3.593 3.555 3.620 . 0 0 "[ . 1 . 2]" 1
1739 1 103 ILE H 1 103 ILE MD . . 3.620 3.575 3.504 3.598 . 0 0 "[ . 1 . 2]" 1
1740 1 103 ILE H 1 103 ILE QG . . 3.470 1.858 1.821 1.884 . 0 0 "[ . 1 . 2]" 1
1741 1 103 ILE H 1 103 ILE MG . . 3.310 2.615 2.351 2.923 . 0 0 "[ . 1 . 2]" 1
1742 1 103 ILE H 1 104 PRO QD . . 4.830 4.361 4.343 4.372 . 0 0 "[ . 1 . 2]" 1
1743 1 103 ILE H 1 106 SER H . . 4.850 4.181 3.988 4.427 . 0 0 "[ . 1 . 2]" 1
1744 1 103 ILE H 1 106 SER QB . . 3.860 3.512 3.178 3.863 0.003 16 0 "[ . 1 . 2]" 1
1745 1 103 ILE HA 1 103 ILE MG . . 3.530 2.185 2.049 2.324 . 0 0 "[ . 1 . 2]" 1
1746 1 103 ILE HA 1 104 PRO HG2 . . 4.960 4.517 4.467 4.554 . 0 0 "[ . 1 . 2]" 1
1747 1 103 ILE HA 1 104 PRO QG . . 4.320 4.005 3.967 4.034 . 0 0 "[ . 1 . 2]" 1
1748 1 103 ILE HA 1 104 PRO HG3 . . 4.960 4.475 4.440 4.503 . 0 0 "[ . 1 . 2]" 1
1749 1 103 ILE HB 1 103 ILE MD . . 3.400 2.286 2.243 2.403 . 0 0 "[ . 1 . 2]" 1
1750 1 103 ILE HB 1 104 PRO HD2 . . 3.940 2.012 1.951 2.141 . 0 0 "[ . 1 . 2]" 1
1751 1 103 ILE HB 1 104 PRO HD3 . . 3.940 3.460 3.408 3.571 . 0 0 "[ . 1 . 2]" 1
1752 1 103 ILE HB 1 104 PRO QG . . 4.760 3.581 3.527 3.676 . 0 0 "[ . 1 . 2]" 1
1753 1 103 ILE HB 1 105 LEU H . . 4.740 2.413 2.255 2.587 . 0 0 "[ . 1 . 2]" 1
1754 1 103 ILE HB 1 105 LEU MD2 . . 5.500 4.082 2.901 5.018 . 0 0 "[ . 1 . 2]" 1
1755 1 103 ILE MD 1 103 ILE MG . . 2.970 2.177 1.994 2.280 . 0 0 "[ . 1 . 2]" 1
1756 1 103 ILE MD 1 105 LEU H . . 4.520 3.176 3.108 3.364 . 0 0 "[ . 1 . 2]" 1
1757 1 103 ILE MD 1 105 LEU QB . . 3.080 2.120 1.946 2.329 . 0 0 "[ . 1 . 2]" 1
1758 1 103 ILE MD 1 106 SER H . . 4.250 3.029 2.611 3.439 . 0 0 "[ . 1 . 2]" 1
1759 1 103 ILE MD 1 106 SER QB . . 3.700 2.992 2.469 3.360 . 0 0 "[ . 1 . 2]" 1
1760 1 103 ILE MD 1 108 TYR QD . . 4.110 3.792 3.405 4.084 . 0 0 "[ . 1 . 2]" 1
1761 1 103 ILE MD 1 108 TYR QE . . 3.480 1.952 1.777 2.063 . 0 0 "[ . 1 . 2]" 1
1762 1 103 ILE QG 1 104 PRO QD . . 4.520 3.780 3.644 3.856 . 0 0 "[ . 1 . 2]" 1
1763 1 103 ILE QG 1 106 SER H . . 3.860 1.971 1.886 2.510 . 0 0 "[ . 1 . 2]" 1
1764 1 103 ILE QG 1 106 SER HA . . 4.570 3.976 3.751 4.133 . 0 0 "[ . 1 . 2]" 1
1765 1 103 ILE QG 1 106 SER HB2 . . 4.330 3.088 2.012 3.945 . 0 0 "[ . 1 . 2]" 1
1766 1 103 ILE QG 1 106 SER QB . . 3.660 2.204 1.938 2.665 . 0 0 "[ . 1 . 2]" 1
1767 1 103 ILE QG 1 106 SER HB3 . . 4.330 2.842 1.947 3.877 . 0 0 "[ . 1 . 2]" 1
1768 1 103 ILE MG 1 104 PRO QD . . 3.810 2.714 2.395 2.877 . 0 0 "[ . 1 . 2]" 1
1769 1 103 ILE MG 1 106 SER H . . 5.170 4.677 4.546 4.946 . 0 0 "[ . 1 . 2]" 1
1770 1 103 ILE MG 1 106 SER QB . . 5.340 4.578 4.355 4.989 . 0 0 "[ . 1 . 2]" 1
1771 1 104 PRO HA 1 105 LEU H . . 3.570 3.290 3.258 3.338 . 0 0 "[ . 1 . 2]" 1
1772 1 104 PRO HA 1 106 SER H . . 4.680 4.189 3.797 4.511 . 0 0 "[ . 1 . 2]" 1
1773 1 104 PRO QD 1 105 LEU H . . 4.630 2.964 2.871 3.025 . 0 0 "[ . 1 . 2]" 1
1774 1 104 PRO QG 1 105 LEU H . . 4.670 3.296 3.153 3.382 . 0 0 "[ . 1 . 2]" 1
1775 1 104 PRO QG 1 105 LEU MD2 . . 3.960 2.909 1.972 3.605 . 0 0 "[ . 1 . 2]" 1
1776 1 105 LEU H 1 105 LEU MD1 . . 4.320 3.874 3.554 4.142 . 0 0 "[ . 1 . 2]" 1
1777 1 105 LEU H 1 105 LEU MD2 . . 3.870 3.219 2.391 3.759 . 0 0 "[ . 1 . 2]" 1
1778 1 105 LEU H 1 105 LEU HG . . 4.570 3.272 2.432 4.347 . 0 0 "[ . 1 . 2]" 1
1779 1 105 LEU H 1 106 SER H . . 3.840 2.120 2.049 2.224 . 0 0 "[ . 1 . 2]" 1
1780 1 105 LEU HA 1 105 LEU MD1 . . 4.570 3.166 1.972 3.955 . 0 0 "[ . 1 . 2]" 1
1781 1 105 LEU HA 1 105 LEU MD2 . . 3.430 2.300 1.985 2.680 . 0 0 "[ . 1 . 2]" 1
1782 1 105 LEU QB 1 106 SER H . . 4.720 2.869 2.585 3.459 . 0 0 "[ . 1 . 2]" 1
1783 1 105 LEU QB 1 108 TYR QD . . 4.430 4.157 3.899 4.448 0.018 20 0 "[ . 1 . 2]" 1
1784 1 105 LEU QB 1 108 TYR QE . . 3.780 2.590 2.087 3.318 . 0 0 "[ . 1 . 2]" 1
1785 1 105 LEU MD1 1 106 SER H . . 5.500 4.686 4.282 5.257 . 0 0 "[ . 1 . 2]" 1
1786 1 105 LEU MD1 1 108 TYR QE . . 4.130 3.639 3.222 4.113 . 0 0 "[ . 1 . 2]" 1
1787 1 106 SER H 1 106 SER HB2 . . 3.770 3.039 2.184 3.717 . 0 0 "[ . 1 . 2]" 1
1788 1 106 SER H 1 106 SER QB . . 3.220 2.358 2.163 2.900 . 0 0 "[ . 1 . 2]" 1
1789 1 106 SER H 1 106 SER HB3 . . 3.770 2.914 2.313 3.491 . 0 0 "[ . 1 . 2]" 1
1790 1 106 SER H 1 107 PRO HA . . 4.780 4.728 4.699 4.778 . 0 0 "[ . 1 . 2]" 1
1791 1 106 SER H 1 108 TYR QD . . 5.180 4.577 4.094 5.203 0.023 17 0 "[ . 1 . 2]" 1
1792 1 106 SER HA 1 107 PRO HA . . 3.520 2.429 2.359 2.505 . 0 0 "[ . 1 . 2]" 1
1793 1 106 SER HA 1 107 PRO HB2 . . 4.960 4.425 4.382 4.473 . 0 0 "[ . 1 . 2]" 1
1794 1 106 SER HA 1 107 PRO QB . . 4.320 3.985 3.941 4.034 . 0 0 "[ . 1 . 2]" 1
1795 1 106 SER HA 1 107 PRO HB3 . . 4.960 4.526 4.469 4.589 . 0 0 "[ . 1 . 2]" 1
1796 1 106 SER HA 1 108 TYR H . . 3.830 3.655 3.496 3.698 . 0 0 "[ . 1 . 2]" 1
1797 1 106 SER HA 1 108 TYR QD . . 3.990 2.523 2.004 3.500 . 0 0 "[ . 1 . 2]" 1
1798 1 106 SER HA 1 108 TYR QE . . 4.580 3.322 2.931 3.988 . 0 0 "[ . 1 . 2]" 1
1799 1 106 SER QB 1 107 PRO HA . . 4.140 1.969 1.949 1.979 . 0 0 "[ . 1 . 2]" 1
1800 1 106 SER QB 1 108 TYR QD . . 3.580 3.145 2.727 3.575 . 0 0 "[ . 1 . 2]" 1
1801 1 106 SER HB2 1 107 PRO HA . . 4.740 2.606 1.964 3.552 . 0 0 "[ . 1 . 2]" 1
1802 1 106 SER HB2 1 108 TYR QD . . 4.160 3.648 2.858 4.160 0.000 12 0 "[ . 1 . 2]" 1
1803 1 106 SER HB3 1 107 PRO HA . . 4.740 2.839 1.976 3.589 . 0 0 "[ . 1 . 2]" 1
1804 1 106 SER HB3 1 108 TYR QD . . 4.160 3.528 2.970 3.900 . 0 0 "[ . 1 . 2]" 1
1805 1 107 PRO HA 1 108 TYR H . . 3.240 2.544 2.426 2.574 . 0 0 "[ . 1 . 2]" 1
1806 1 107 PRO HA 1 108 TYR QD . . 4.200 3.311 2.967 3.886 . 0 0 "[ . 1 . 2]" 1
1807 1 107 PRO HB2 1 108 TYR H . . 4.150 2.275 2.206 2.548 . 0 0 "[ . 1 . 2]" 1
1808 1 107 PRO HB3 1 108 TYR H . . 4.150 3.293 3.263 3.421 . 0 0 "[ . 1 . 2]" 1
1809 1 107 PRO QG 1 108 TYR H . . 4.750 3.919 3.865 4.122 . 0 0 "[ . 1 . 2]" 1
1810 1 108 TYR H 1 108 TYR HB2 . . 3.660 2.437 2.352 2.469 . 0 0 "[ . 1 . 2]" 1
1811 1 108 TYR H 1 108 TYR HB3 . . 3.840 3.600 3.518 3.655 . 0 0 "[ . 1 . 2]" 1
1812 1 108 TYR H 1 108 TYR QD . . 3.410 3.119 2.624 3.403 . 0 0 "[ . 1 . 2]" 1
1813 1 108 TYR H 1 109 ARG H . . 4.520 4.356 4.205 4.477 . 0 0 "[ . 1 . 2]" 1
1814 1 108 TYR H 1 109 ARG HA . . 5.500 4.882 4.813 5.007 . 0 0 "[ . 1 . 2]" 1
1815 1 108 TYR H 1 110 ILE MD . . 5.500 5.395 5.099 5.502 0.002 13 0 "[ . 1 . 2]" 1
1816 1 108 TYR HA 1 108 TYR QD . . 3.830 2.999 2.692 3.108 . 0 0 "[ . 1 . 2]" 1
1817 1 108 TYR HA 1 108 TYR QE . . 5.080 4.519 4.434 4.618 . 0 0 "[ . 1 . 2]" 1
1818 1 108 TYR HA 1 109 ARG H . . 2.770 2.156 2.138 2.194 . 0 0 "[ . 1 . 2]" 1
1819 1 108 TYR HA 1 109 ARG QB . . 4.640 4.331 4.160 4.485 . 0 0 "[ . 1 . 2]" 1
1820 1 108 TYR HA 1 110 ILE MD . . 5.500 5.110 4.718 5.296 . 0 0 "[ . 1 . 2]" 1
1821 1 108 TYR HB2 1 109 ARG H . . 4.540 4.375 4.180 4.483 . 0 0 "[ . 1 . 2]" 1
1822 1 108 TYR HB2 1 110 ILE MD . . 4.610 3.692 3.406 3.905 . 0 0 "[ . 1 . 2]" 1
1823 1 108 TYR HB2 1 110 ILE HG12 . . 5.500 5.229 4.865 5.436 . 0 0 "[ . 1 . 2]" 1
1824 1 108 TYR HB2 1 110 ILE HG13 . . 4.330 4.214 3.953 4.332 0.002 17 0 "[ . 1 . 2]" 1
1825 1 108 TYR HB3 1 109 ARG H . . 3.640 3.363 3.067 3.651 0.011 19 0 "[ . 1 . 2]" 1
1826 1 108 TYR HB3 1 110 ILE MD . . 3.490 2.852 2.441 3.120 . 0 0 "[ . 1 . 2]" 1
1827 1 108 TYR HB3 1 110 ILE HG12 . . 4.280 3.701 3.316 3.866 . 0 0 "[ . 1 . 2]" 1
1828 1 108 TYR HB3 1 110 ILE HG13 . . 4.210 3.051 2.879 3.235 . 0 0 "[ . 1 . 2]" 1
1829 1 108 TYR QD 1 109 ARG H . . 4.130 4.013 3.571 4.132 0.002 8 0 "[ . 1 . 2]" 1
1830 1 108 TYR QD 1 110 ILE MD . . 4.110 3.747 3.312 4.112 0.002 7 0 "[ . 1 . 2]" 1
1831 1 109 ARG H 1 109 ARG QB . . 3.110 2.485 2.227 2.825 . 0 0 "[ . 1 . 2]" 1
1832 1 109 ARG H 1 109 ARG HG2 . . 4.220 3.257 1.900 4.116 . 0 0 "[ . 1 . 2]" 1
1833 1 109 ARG H 1 109 ARG QG . . 3.580 2.530 1.869 3.327 . 0 0 "[ . 1 . 2]" 1
1834 1 109 ARG H 1 109 ARG HG3 . . 4.220 2.940 2.034 3.969 . 0 0 "[ . 1 . 2]" 1
1835 1 109 ARG H 1 110 ILE MD . . 5.160 5.022 4.931 5.120 . 0 0 "[ . 1 . 2]" 1
1836 1 109 ARG H 1 110 ILE HG13 . . 5.070 4.095 3.949 4.349 . 0 0 "[ . 1 . 2]" 1
1837 1 109 ARG HA 1 109 ARG QD . . 4.310 3.981 2.108 4.382 0.072 19 0 "[ . 1 . 2]" 1
1838 1 109 ARG HA 1 109 ARG HG2 . . 4.070 3.071 2.230 4.209 0.139 20 0 "[ . 1 . 2]" 1
1839 1 109 ARG HA 1 109 ARG QG . . 3.570 2.784 2.186 3.417 . 0 0 "[ . 1 . 2]" 1
1840 1 109 ARG HA 1 109 ARG HG3 . . 4.070 3.313 2.684 4.197 0.127 11 0 "[ . 1 . 2]" 1
1841 1 109 ARG HA 1 110 ILE H . . 2.860 2.150 2.140 2.176 . 0 0 "[ . 1 . 2]" 1
1842 1 109 ARG HA 1 110 ILE HA . . 4.960 4.406 4.391 4.431 . 0 0 "[ . 1 . 2]" 1
1843 1 109 ARG HA 1 110 ILE HG12 . . 4.990 4.708 4.201 4.989 . 0 0 "[ . 1 . 2]" 1
1844 1 109 ARG HA 1 110 ILE HG13 . . 4.780 3.571 3.408 3.701 . 0 0 "[ . 1 . 2]" 1
1845 1 109 ARG QB 1 109 ARG QD . . 3.050 2.187 2.048 2.459 . 0 0 "[ . 1 . 2]" 1
1846 1 109 ARG QB 1 110 ILE H . . 3.640 3.247 3.082 3.427 . 0 0 "[ . 1 . 2]" 1
1847 1 110 ILE H 1 110 ILE HB . . 3.450 2.969 2.837 3.113 . 0 0 "[ . 1 . 2]" 1
1848 1 110 ILE H 1 110 ILE MD . . 4.360 4.211 4.048 4.362 0.002 11 0 "[ . 1 . 2]" 1
1849 1 110 ILE H 1 110 ILE HG12 . . 4.060 3.857 3.495 4.000 . 0 0 "[ . 1 . 2]" 1
1850 1 110 ILE H 1 110 ILE HG13 . . 3.580 2.855 2.723 3.031 . 0 0 "[ . 1 . 2]" 1
1851 1 110 ILE H 1 110 ILE MG . . 4.120 3.980 3.934 4.031 . 0 0 "[ . 1 . 2]" 1
1852 1 110 ILE HA 1 110 ILE MD . . 3.960 3.868 3.812 3.921 . 0 0 "[ . 1 . 2]" 1
1853 1 110 ILE HA 1 110 ILE MG . . 3.410 2.259 2.113 2.350 . 0 0 "[ . 1 . 2]" 1
1854 1 110 ILE HA 1 111 ARG H . . 2.960 2.293 2.249 2.379 . 0 0 "[ . 1 . 2]" 1
1855 1 110 ILE HB 1 110 ILE MD . . 3.590 2.393 2.332 2.524 . 0 0 "[ . 1 . 2]" 1
1856 1 110 ILE HB 1 111 ARG H . . 3.790 3.633 3.387 3.772 . 0 0 "[ . 1 . 2]" 1
1857 1 110 ILE MD 1 110 ILE MG . . 3.020 1.993 1.909 2.121 . 0 0 "[ . 1 . 2]" 1
1858 1 110 ILE MD 1 111 ARG H . . 4.800 4.753 4.595 4.819 0.019 12 0 "[ . 1 . 2]" 1
1859 1 110 ILE HG12 1 110 ILE MG . . 3.260 2.388 2.324 2.476 . 0 0 "[ . 1 . 2]" 1
1860 1 110 ILE HG13 1 110 ILE MG . . 3.390 3.196 3.186 3.203 . 0 0 "[ . 1 . 2]" 1
1861 1 110 ILE HG13 1 111 ARG H . . 5.500 5.022 4.925 5.145 . 0 0 "[ . 1 . 2]" 1
1862 1 110 ILE MG 1 111 ARG H . . 3.390 1.939 1.832 2.151 . 0 0 "[ . 1 . 2]" 1
1863 1 111 ARG H 1 111 ARG HB2 . . 3.950 2.927 2.468 3.868 . 0 0 "[ . 1 . 2]" 1
1864 1 111 ARG H 1 111 ARG QB . . 3.260 2.676 2.427 3.230 . 0 0 "[ . 1 . 2]" 1
1865 1 111 ARG H 1 111 ARG HB3 . . 3.950 3.560 2.498 3.830 . 0 0 "[ . 1 . 2]" 1
1866 1 111 ARG H 1 111 ARG QD . . 4.870 4.247 2.310 4.891 0.021 19 0 "[ . 1 . 2]" 1
1867 1 111 ARG H 1 111 ARG HG2 . . 4.500 3.949 2.408 4.496 . 0 0 "[ . 1 . 2]" 1
1868 1 111 ARG H 1 111 ARG QG . . 3.740 3.113 2.164 3.812 0.072 19 0 "[ . 1 . 2]" 1
1869 1 111 ARG H 1 111 ARG HG3 . . 4.500 3.342 2.177 4.541 0.041 12 0 "[ . 1 . 2]" 1
1870 1 111 ARG H 1 112 ALA H . . 4.800 4.282 4.187 4.469 . 0 0 "[ . 1 . 2]" 1
1871 1 111 ARG HA 1 111 ARG HG2 . . 4.250 2.960 2.196 4.179 . 0 0 "[ . 1 . 2]" 1
1872 1 111 ARG HA 1 111 ARG QG . . 3.700 2.572 2.151 3.386 . 0 0 "[ . 1 . 2]" 1
1873 1 111 ARG HA 1 111 ARG HG3 . . 4.250 3.057 2.399 3.792 . 0 0 "[ . 1 . 2]" 1
1874 1 111 ARG HA 1 112 ALA H . . 3.120 2.171 2.140 2.312 . 0 0 "[ . 1 . 2]" 1
1875 1 111 ARG QB 1 111 ARG QD . . 3.000 2.219 2.063 2.536 . 0 0 "[ . 1 . 2]" 1
1876 1 111 ARG QB 1 112 ALA H . . 3.940 3.234 2.798 3.659 . 0 0 "[ . 1 . 2]" 1
1877 1 111 ARG HB2 1 111 ARG QD . . 3.570 2.516 2.118 2.868 . 0 0 "[ . 1 . 2]" 1
1878 1 111 ARG HB2 1 112 ALA H . . 4.570 4.019 2.867 4.440 . 0 0 "[ . 1 . 2]" 1
1879 1 111 ARG HB3 1 111 ARG QD . . 3.570 2.628 2.168 3.495 . 0 0 "[ . 1 . 2]" 1
1880 1 111 ARG HB3 1 112 ALA H . . 4.570 3.578 2.872 4.342 . 0 0 "[ . 1 . 2]" 1
1881 1 112 ALA H 1 112 ALA MB . . 3.480 2.231 2.072 2.389 . 0 0 "[ . 1 . 2]" 1
1882 1 112 ALA H 1 113 THR H . . 4.640 4.348 4.098 4.597 . 0 0 "[ . 1 . 2]" 1
1883 1 112 ALA HA 1 113 THR H . . 2.850 2.166 2.141 2.220 . 0 0 "[ . 1 . 2]" 1
1884 1 112 ALA HA 1 113 THR MG . . 4.230 3.835 3.667 3.991 . 0 0 "[ . 1 . 2]" 1
1885 1 112 ALA MB 1 113 THR H . . 3.510 3.324 2.818 3.502 . 0 0 "[ . 1 . 2]" 1
1886 1 113 THR H 1 113 THR HB . . 4.060 3.446 2.898 3.733 . 0 0 "[ . 1 . 2]" 1
1887 1 113 THR H 1 113 THR MG . . 3.510 2.327 2.058 2.735 . 0 0 "[ . 1 . 2]" 1
1888 1 113 THR H 1 114 GLN H . . 4.720 4.274 2.547 4.552 . 0 0 "[ . 1 . 2]" 1
1889 1 113 THR HA 1 114 GLN H . . 3.560 2.263 2.142 3.523 . 0 0 "[ . 1 . 2]" 1
1890 1 113 THR HB 1 114 GLN H . . 4.060 3.792 3.338 4.060 . 0 0 "[ . 1 . 2]" 1
1891 1 114 GLN H 1 114 GLN QG . . 4.940 3.669 1.869 4.254 . 0 0 "[ . 1 . 2]" 1
1892 1 114 GLN HA 1 115 THR H . . 3.550 2.362 2.138 3.531 . 0 0 "[ . 1 . 2]" 1
1893 1 114 GLN QB 1 115 THR H . . 4.190 3.544 2.298 4.042 . 0 0 "[ . 1 . 2]" 1
1894 1 114 GLN HB2 1 115 THR H . . 5.030 4.073 2.319 4.610 . 0 0 "[ . 1 . 2]" 1
1895 1 114 GLN HB3 1 115 THR H . . 5.030 4.034 2.664 4.638 . 0 0 "[ . 1 . 2]" 1
1896 1 115 THR H 1 115 THR MG . . 4.530 3.088 1.894 4.006 . 0 0 "[ . 1 . 2]" 1
1897 1 115 THR HA 1 115 THR MG . . 3.260 2.540 2.204 3.207 . 0 0 "[ . 1 . 2]" 1
1898 1 115 THR HB 1 116 GLY H . . 4.880 3.748 2.355 4.393 . 0 0 "[ . 1 . 2]" 1
1899 1 117 ASP HB2 1 118 ALA H . . 4.850 3.808 2.309 4.597 . 0 0 "[ . 1 . 2]" 1
1900 1 117 ASP HB3 1 118 ALA H . . 4.850 3.885 2.158 4.668 . 0 0 "[ . 1 . 2]" 1
1901 1 118 ALA MB 1 119 SER H . . 5.090 2.887 2.090 3.473 . 0 0 "[ . 1 . 2]" 1
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