NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
414943 |
2d7o   |
10330 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2d7o
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 1750
_Distance_constraint_stats_list.Viol_count 645
_Distance_constraint_stats_list.Viol_total 135.985
_Distance_constraint_stats_list.Viol_max 0.112
_Distance_constraint_stats_list.Viol_rms 0.0025
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0105
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 SER 0.030 0.020 20 0 "[ . 1 . 2]"
1 12 ARG 0.196 0.074 7 0 "[ . 1 . 2]"
1 13 HIS 0.079 0.074 7 0 "[ . 1 . 2]"
1 14 VAL 0.010 0.003 13 0 "[ . 1 . 2]"
1 15 SER 0.002 0.001 14 0 "[ . 1 . 2]"
1 16 ALA 0.003 0.001 14 0 "[ . 1 . 2]"
1 17 TYR 0.028 0.008 4 0 "[ . 1 . 2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 PRO 0.003 0.001 2 0 "[ . 1 . 2]"
1 20 GLY 0.046 0.018 14 0 "[ . 1 . 2]"
1 21 LEU 0.006 0.003 19 0 "[ . 1 . 2]"
1 22 SER 0.014 0.011 10 0 "[ . 1 . 2]"
1 23 HIS 0.024 0.006 14 0 "[ . 1 . 2]"
1 24 GLY 0.027 0.014 20 0 "[ . 1 . 2]"
1 25 MET 0.156 0.063 10 0 "[ . 1 . 2]"
1 26 VAL 0.147 0.035 20 0 "[ . 1 . 2]"
1 27 ASN 0.180 0.033 12 0 "[ . 1 . 2]"
1 28 LYS 0.440 0.078 10 0 "[ . 1 . 2]"
1 29 PRO 0.079 0.054 10 0 "[ . 1 . 2]"
1 30 ALA 0.092 0.020 9 0 "[ . 1 . 2]"
1 31 THR 0.057 0.020 9 0 "[ . 1 . 2]"
1 32 PHE 0.073 0.008 4 0 "[ . 1 . 2]"
1 33 THR 0.741 0.041 9 0 "[ . 1 . 2]"
1 34 ILE 0.030 0.005 4 0 "[ . 1 . 2]"
1 35 VAL 0.013 0.007 19 0 "[ . 1 . 2]"
1 36 THR 0.015 0.006 10 0 "[ . 1 . 2]"
1 37 LYS 0.035 0.009 10 0 "[ . 1 . 2]"
1 38 ASP 0.022 0.009 10 0 "[ . 1 . 2]"
1 39 ALA 0.004 0.002 17 0 "[ . 1 . 2]"
1 40 GLY 0.011 0.009 20 0 "[ . 1 . 2]"
1 41 GLU 0.002 0.002 2 0 "[ . 1 . 2]"
1 42 GLY 0.087 0.082 17 0 "[ . 1 . 2]"
1 43 GLY 0.082 0.082 17 0 "[ . 1 . 2]"
1 44 LEU 0.006 0.006 19 0 "[ . 1 . 2]"
1 45 SER 0.001 0.001 4 0 "[ . 1 . 2]"
1 46 LEU 0.023 0.006 7 0 "[ . 1 . 2]"
1 47 ALA 0.033 0.006 7 0 "[ . 1 . 2]"
1 48 VAL 0.031 0.006 13 0 "[ . 1 . 2]"
1 49 GLU 0.157 0.018 6 0 "[ . 1 . 2]"
1 50 GLY 0.022 0.011 1 0 "[ . 1 . 2]"
1 51 PRO 0.012 0.003 15 0 "[ . 1 . 2]"
1 52 SER 0.603 0.062 8 0 "[ . 1 . 2]"
1 53 LYS 0.243 0.049 15 0 "[ . 1 . 2]"
1 54 ALA 0.183 0.049 15 0 "[ . 1 . 2]"
1 55 GLU 0.161 0.094 2 0 "[ . 1 . 2]"
1 56 ILE 0.113 0.009 15 0 "[ . 1 . 2]"
1 57 THR 0.252 0.057 12 0 "[ . 1 . 2]"
1 58 CYS 0.033 0.019 1 0 "[ . 1 . 2]"
1 59 LYS 0.156 0.036 9 0 "[ . 1 . 2]"
1 60 ASP 0.054 0.016 10 0 "[ . 1 . 2]"
1 61 ASN 0.088 0.016 10 0 "[ . 1 . 2]"
1 62 LYS 0.240 0.091 9 0 "[ . 1 . 2]"
1 63 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 GLY 0.002 0.002 2 0 "[ . 1 . 2]"
1 65 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 CYS 0.060 0.020 2 0 "[ . 1 . 2]"
1 67 THR 0.046 0.020 2 0 "[ . 1 . 2]"
1 68 VAL 0.059 0.009 15 0 "[ . 1 . 2]"
1 69 SER 0.020 0.005 10 0 "[ . 1 . 2]"
1 70 TYR 0.180 0.021 10 0 "[ . 1 . 2]"
1 71 LEU 0.199 0.021 10 0 "[ . 1 . 2]"
1 72 PRO 0.027 0.007 20 0 "[ . 1 . 2]"
1 73 THR 0.052 0.012 10 0 "[ . 1 . 2]"
1 74 ALA 0.037 0.005 18 0 "[ . 1 . 2]"
1 75 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLY 0.005 0.003 19 0 "[ . 1 . 2]"
1 77 ASP 0.035 0.007 15 0 "[ . 1 . 2]"
1 78 TYR 0.140 0.019 13 0 "[ . 1 . 2]"
1 79 SER 0.137 0.062 19 0 "[ . 1 . 2]"
1 80 ILE 0.198 0.062 19 0 "[ . 1 . 2]"
1 81 ILE 0.079 0.024 19 0 "[ . 1 . 2]"
1 82 VAL 0.052 0.024 19 0 "[ . 1 . 2]"
1 83 ARG 0.030 0.009 8 0 "[ . 1 . 2]"
1 84 PHE 0.075 0.016 12 0 "[ . 1 . 2]"
1 85 ASP 0.037 0.015 3 0 "[ . 1 . 2]"
1 86 ASP 0.025 0.008 14 0 "[ . 1 . 2]"
1 87 LYS 0.048 0.015 3 0 "[ . 1 . 2]"
1 88 HIS 0.609 0.034 12 0 "[ . 1 . 2]"
1 89 ILE 0.259 0.023 3 0 "[ . 1 . 2]"
1 90 PRO 0.502 0.043 17 0 "[ . 1 . 2]"
1 91 GLY 0.502 0.043 17 0 "[ . 1 . 2]"
1 92 SER 0.496 0.026 14 0 "[ . 1 . 2]"
1 93 PRO 0.544 0.034 12 0 "[ . 1 . 2]"
1 94 PHE 0.099 0.010 19 0 "[ . 1 . 2]"
1 95 THR 0.041 0.009 16 0 "[ . 1 . 2]"
1 96 ALA 0.026 0.006 19 0 "[ . 1 . 2]"
1 97 LYS 0.256 0.028 16 0 "[ . 1 . 2]"
1 98 ILE 0.062 0.024 16 0 "[ . 1 . 2]"
1 99 THR 0.231 0.112 20 0 "[ . 1 . 2]"
1 100 GLY 0.135 0.112 20 0 "[ . 1 . 2]"
1 101 ASP 0.107 0.078 20 0 "[ . 1 . 2]"
1 102 ASP 0.092 0.078 20 0 "[ . 1 . 2]"
1 103 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 MET 0.140 0.105 4 0 "[ . 1 . 2]"
1 105 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 ALA HA 1 9 ILE H . . 3.120 2.319 2.150 2.881 . 0 0 "[ . 1 . 2]" 1
2 1 8 ALA MB 1 9 ILE H . . 4.000 3.093 2.213 3.695 . 0 0 "[ . 1 . 2]" 1
3 1 9 ILE H 1 9 ILE HB . . 3.820 3.076 2.504 3.800 . 0 0 "[ . 1 . 2]" 1
4 1 9 ILE H 1 9 ILE HG12 . . 3.970 2.962 2.060 3.932 . 0 0 "[ . 1 . 2]" 1
5 1 9 ILE H 1 9 ILE HG13 . . 3.970 3.127 1.929 3.814 . 0 0 "[ . 1 . 2]" 1
6 1 9 ILE H 1 9 ILE MG . . 4.090 3.233 1.974 3.831 . 0 0 "[ . 1 . 2]" 1
7 1 9 ILE HA 1 9 ILE MD . . 4.240 3.199 1.972 4.150 . 0 0 "[ . 1 . 2]" 1
8 1 9 ILE HA 1 9 ILE QG . . 3.740 2.984 2.300 3.419 . 0 0 "[ . 1 . 2]" 1
9 1 9 ILE HA 1 9 ILE MG . . 3.530 2.358 2.260 2.534 . 0 0 "[ . 1 . 2]" 1
10 1 9 ILE HB 1 9 ILE MD . . 3.470 2.710 2.084 3.230 . 0 0 "[ . 1 . 2]" 1
11 1 9 ILE HB 1 10 ASN H . . 5.500 3.712 2.116 4.475 . 0 0 "[ . 1 . 2]" 1
12 1 9 ILE HG12 1 9 ILE MG . . 3.660 2.670 2.039 3.202 . 0 0 "[ . 1 . 2]" 1
13 1 9 ILE HG13 1 9 ILE MG . . 3.660 2.651 2.341 3.188 . 0 0 "[ . 1 . 2]" 1
14 1 9 ILE MG 1 10 ASN H . . 5.500 3.429 1.988 4.355 . 0 0 "[ . 1 . 2]" 1
15 1 10 ASN HA 1 10 ASN HD21 . . 3.950 2.589 2.141 3.109 . 0 0 "[ . 1 . 2]" 1
16 1 10 ASN HA 1 10 ASN QD . . 3.450 2.530 2.127 2.999 . 0 0 "[ . 1 . 2]" 1
17 1 10 ASN HA 1 10 ASN HD22 . . 3.950 3.687 3.429 3.942 . 0 0 "[ . 1 . 2]" 1
18 1 11 SER HA 1 12 ARG H . . 3.550 2.504 2.138 3.570 0.020 20 0 "[ . 1 . 2]" 1
19 1 11 SER QB 1 12 ARG H . . 4.820 3.037 2.234 3.898 . 0 0 "[ . 1 . 2]" 1
20 1 12 ARG H 1 12 ARG QB . . 3.650 2.714 2.145 3.342 . 0 0 "[ . 1 . 2]" 1
21 1 12 ARG H 1 12 ARG QD . . 5.110 3.555 1.889 5.008 . 0 0 "[ . 1 . 2]" 1
22 1 12 ARG H 1 12 ARG QG . . 3.860 2.917 1.908 3.910 0.050 3 0 "[ . 1 . 2]" 1
23 1 12 ARG H 1 13 HIS H . . 4.690 4.203 2.030 4.599 . 0 0 "[ . 1 . 2]" 1
24 1 12 ARG HA 1 12 ARG QD . . 4.690 3.662 2.106 4.480 . 0 0 "[ . 1 . 2]" 1
25 1 12 ARG HA 1 12 ARG QG . . 3.770 2.951 2.217 3.438 . 0 0 "[ . 1 . 2]" 1
26 1 12 ARG HA 1 13 HIS H . . 3.440 2.275 2.142 3.514 0.074 7 0 "[ . 1 . 2]" 1
27 1 12 ARG QB 1 12 ARG QD . . 3.450 2.239 2.050 2.574 . 0 0 "[ . 1 . 2]" 1
28 1 12 ARG QB 1 13 HIS H . . 4.220 3.183 2.343 4.018 . 0 0 "[ . 1 . 2]" 1
29 1 12 ARG QG 1 13 HIS H . . 5.260 3.910 2.645 4.758 . 0 0 "[ . 1 . 2]" 1
30 1 13 HIS H 1 13 HIS QB . . 3.640 2.946 2.516 3.376 . 0 0 "[ . 1 . 2]" 1
31 1 13 HIS H 1 14 VAL H . . 5.030 4.303 4.125 4.486 . 0 0 "[ . 1 . 2]" 1
32 1 13 HIS H 1 14 VAL MG2 . . 5.400 3.652 3.099 4.116 . 0 0 "[ . 1 . 2]" 1
33 1 13 HIS H 1 39 ALA H . . 5.460 3.851 2.988 4.864 . 0 0 "[ . 1 . 2]" 1
34 1 13 HIS H 1 39 ALA HA . . 5.080 3.735 2.300 5.075 . 0 0 "[ . 1 . 2]" 1
35 1 13 HIS H 1 39 ALA MB . . 5.400 3.880 3.055 4.776 . 0 0 "[ . 1 . 2]" 1
36 1 13 HIS HA 1 14 VAL H . . 2.950 2.315 2.166 2.486 . 0 0 "[ . 1 . 2]" 1
37 1 13 HIS QB 1 14 VAL H . . 3.420 2.900 2.248 3.423 0.003 13 0 "[ . 1 . 2]" 1
38 1 13 HIS HB2 1 14 VAL H . . 4.260 3.597 2.279 4.261 0.001 16 0 "[ . 1 . 2]" 1
39 1 13 HIS HB3 1 14 VAL H . . 4.260 3.400 2.490 4.009 . 0 0 "[ . 1 . 2]" 1
40 1 13 HIS HD2 1 14 VAL H . . 4.520 3.748 2.215 4.408 . 0 0 "[ . 1 . 2]" 1
41 1 14 VAL H 1 14 VAL HB . . 3.130 2.786 2.644 2.954 . 0 0 "[ . 1 . 2]" 1
42 1 14 VAL H 1 14 VAL MG1 . . 4.090 3.891 3.849 3.930 . 0 0 "[ . 1 . 2]" 1
43 1 14 VAL H 1 14 VAL MG2 . . 3.240 3.004 2.664 3.243 0.003 9 0 "[ . 1 . 2]" 1
44 1 14 VAL H 1 89 ILE HB . . 5.060 4.201 3.106 4.771 . 0 0 "[ . 1 . 2]" 1
45 1 14 VAL H 1 90 PRO HD2 . . 4.940 3.363 2.493 3.668 . 0 0 "[ . 1 . 2]" 1
46 1 14 VAL H 1 90 PRO QD . . 4.280 3.226 2.443 3.484 . 0 0 "[ . 1 . 2]" 1
47 1 14 VAL H 1 90 PRO HD3 . . 4.940 4.177 3.510 4.536 . 0 0 "[ . 1 . 2]" 1
48 1 14 VAL H 1 90 PRO HG3 . . 5.460 4.064 3.373 4.782 . 0 0 "[ . 1 . 2]" 1
49 1 14 VAL HA 1 14 VAL MG1 . . 3.580 2.403 2.297 2.485 . 0 0 "[ . 1 . 2]" 1
50 1 14 VAL HA 1 14 VAL MG2 . . 3.610 2.327 2.210 2.418 . 0 0 "[ . 1 . 2]" 1
51 1 14 VAL HA 1 15 SER H . . 2.820 2.201 2.153 2.281 . 0 0 "[ . 1 . 2]" 1
52 1 14 VAL HA 1 35 VAL H . . 5.300 5.039 4.819 5.255 . 0 0 "[ . 1 . 2]" 1
53 1 14 VAL HB 1 15 SER H . . 4.230 4.031 3.855 4.193 . 0 0 "[ . 1 . 2]" 1
54 1 14 VAL HB 1 89 ILE HB . . 4.510 3.063 2.470 3.679 . 0 0 "[ . 1 . 2]" 1
55 1 14 VAL HB 1 89 ILE MG . . 3.580 2.032 1.879 2.399 . 0 0 "[ . 1 . 2]" 1
56 1 14 VAL MG1 1 15 SER H . . 3.470 2.191 1.914 2.623 . 0 0 "[ . 1 . 2]" 1
57 1 14 VAL MG1 1 16 ALA H . . 4.930 4.311 3.896 4.927 . 0 0 "[ . 1 . 2]" 1
58 1 14 VAL MG1 1 35 VAL H . . 4.450 3.779 3.256 4.168 . 0 0 "[ . 1 . 2]" 1
59 1 14 VAL MG1 1 89 ILE MG . . 3.060 2.373 1.883 3.042 . 0 0 "[ . 1 . 2]" 1
60 1 14 VAL MG2 1 15 SER H . . 4.020 3.911 3.779 4.008 . 0 0 "[ . 1 . 2]" 1
61 1 14 VAL MG2 1 34 ILE MG . . 4.340 4.122 3.724 4.341 0.001 10 0 "[ . 1 . 2]" 1
62 1 14 VAL MG2 1 36 THR HA . . 3.690 3.068 2.687 3.438 . 0 0 "[ . 1 . 2]" 1
63 1 14 VAL MG2 1 36 THR MG . . 3.800 3.044 2.390 3.632 . 0 0 "[ . 1 . 2]" 1
64 1 14 VAL MG2 1 39 ALA H . . 4.310 3.531 3.128 4.140 . 0 0 "[ . 1 . 2]" 1
65 1 14 VAL MG2 1 39 ALA MB . . 3.070 2.013 1.698 2.510 . 0 0 "[ . 1 . 2]" 1
66 1 14 VAL MG2 1 84 PHE HB2 . . 4.130 3.321 2.599 3.905 . 0 0 "[ . 1 . 2]" 1
67 1 14 VAL MG2 1 84 PHE HB3 . . 4.160 3.695 3.052 4.134 . 0 0 "[ . 1 . 2]" 1
68 1 14 VAL MG2 1 84 PHE QD . . 4.150 3.334 2.638 3.950 . 0 0 "[ . 1 . 2]" 1
69 1 14 VAL MG2 1 84 PHE QE . . 4.520 3.900 3.377 4.521 0.001 9 0 "[ . 1 . 2]" 1
70 1 14 VAL MG2 1 89 ILE MG . . 3.290 2.966 2.391 3.289 . 0 0 "[ . 1 . 2]" 1
71 1 15 SER H 1 15 SER QB . . 3.810 2.768 2.614 3.225 . 0 0 "[ . 1 . 2]" 1
72 1 15 SER H 1 16 ALA H . . 4.450 4.269 4.063 4.412 . 0 0 "[ . 1 . 2]" 1
73 1 15 SER H 1 16 ALA HA . . 5.160 4.653 4.542 4.754 . 0 0 "[ . 1 . 2]" 1
74 1 15 SER H 1 34 ILE MG . . 4.340 3.823 3.210 4.341 0.001 16 0 "[ . 1 . 2]" 1
75 1 15 SER H 1 35 VAL H . . 3.750 3.301 3.123 3.573 . 0 0 "[ . 1 . 2]" 1
76 1 15 SER H 1 35 VAL HB . . 3.660 2.064 1.897 2.638 . 0 0 "[ . 1 . 2]" 1
77 1 15 SER H 1 35 VAL QG . . 3.980 3.024 2.864 3.458 . 0 0 "[ . 1 . 2]" 1
78 1 15 SER HA 1 16 ALA H . . 2.730 2.233 2.138 2.455 . 0 0 "[ . 1 . 2]" 1
79 1 15 SER HA 1 16 ALA MB . . 4.620 3.890 3.774 3.983 . 0 0 "[ . 1 . 2]" 1
80 1 15 SER QB 1 16 ALA H . . 3.610 3.308 2.302 3.611 0.001 14 0 "[ . 1 . 2]" 1
81 1 15 SER QB 1 35 VAL H . . 4.950 4.187 3.521 4.742 . 0 0 "[ . 1 . 2]" 1
82 1 15 SER QB 1 35 VAL HB . . 4.290 2.990 2.119 3.658 . 0 0 "[ . 1 . 2]" 1
83 1 16 ALA H 1 16 ALA MB . . 3.200 2.385 2.199 2.592 . 0 0 "[ . 1 . 2]" 1
84 1 16 ALA H 1 17 TYR H . . 4.570 4.492 4.380 4.552 . 0 0 "[ . 1 . 2]" 1
85 1 16 ALA H 1 21 LEU MD1 . . 4.990 4.292 4.048 4.534 . 0 0 "[ . 1 . 2]" 1
86 1 16 ALA H 1 34 ILE HA . . 5.070 4.794 4.505 4.982 . 0 0 "[ . 1 . 2]" 1
87 1 16 ALA H 1 89 ILE MD . . 3.630 3.286 2.921 3.631 0.001 5 0 "[ . 1 . 2]" 1
88 1 16 ALA H 1 94 PHE HZ . . 4.900 2.625 2.065 3.404 . 0 0 "[ . 1 . 2]" 1
89 1 16 ALA HA 1 17 TYR H . . 2.650 2.243 2.189 2.343 . 0 0 "[ . 1 . 2]" 1
90 1 16 ALA HA 1 17 TYR QD . . 4.820 3.571 2.928 4.042 . 0 0 "[ . 1 . 2]" 1
91 1 16 ALA HA 1 33 THR H . . 5.210 5.061 4.943 5.150 . 0 0 "[ . 1 . 2]" 1
92 1 16 ALA HA 1 34 ILE H . . 5.160 4.852 4.661 4.997 . 0 0 "[ . 1 . 2]" 1
93 1 16 ALA HA 1 34 ILE HA . . 4.010 2.254 2.061 2.460 . 0 0 "[ . 1 . 2]" 1
94 1 16 ALA HA 1 34 ILE HG12 . . 4.540 3.708 3.427 4.120 . 0 0 "[ . 1 . 2]" 1
95 1 16 ALA HA 1 34 ILE MG . . 4.700 3.493 3.085 3.878 . 0 0 "[ . 1 . 2]" 1
96 1 16 ALA HA 1 35 VAL H . . 3.670 2.871 2.469 3.088 . 0 0 "[ . 1 . 2]" 1
97 1 16 ALA HA 1 35 VAL QG . . 4.320 3.652 3.132 4.066 . 0 0 "[ . 1 . 2]" 1
98 1 16 ALA MB 1 17 TYR H . . 3.190 2.813 2.509 2.944 . 0 0 "[ . 1 . 2]" 1
99 1 16 ALA MB 1 21 LEU MD1 . . 3.260 1.843 1.684 2.072 . 0 0 "[ . 1 . 2]" 1
100 1 16 ALA MB 1 21 LEU MD2 . . 3.700 2.896 2.177 3.387 . 0 0 "[ . 1 . 2]" 1
101 1 16 ALA MB 1 32 PHE QD . . 3.850 2.688 2.145 3.225 . 0 0 "[ . 1 . 2]" 1
102 1 16 ALA MB 1 32 PHE QE . . 4.210 3.229 2.782 3.644 . 0 0 "[ . 1 . 2]" 1
103 1 16 ALA MB 1 34 ILE H . . 5.300 4.930 4.260 5.268 . 0 0 "[ . 1 . 2]" 1
104 1 16 ALA MB 1 34 ILE HA . . 4.580 2.892 2.153 3.245 . 0 0 "[ . 1 . 2]" 1
105 1 16 ALA MB 1 34 ILE HG12 . . 4.300 2.464 1.985 2.954 . 0 0 "[ . 1 . 2]" 1
106 1 16 ALA MB 1 34 ILE MG . . 3.980 2.849 2.387 3.214 . 0 0 "[ . 1 . 2]" 1
107 1 16 ALA MB 1 94 PHE QD . . 4.420 3.533 3.131 4.204 . 0 0 "[ . 1 . 2]" 1
108 1 16 ALA MB 1 94 PHE QE . . 4.370 2.800 2.221 3.734 . 0 0 "[ . 1 . 2]" 1
109 1 16 ALA MB 1 94 PHE HZ . . 4.640 3.298 2.560 4.389 . 0 0 "[ . 1 . 2]" 1
110 1 17 TYR H 1 17 TYR QB . . 3.680 3.149 3.032 3.278 . 0 0 "[ . 1 . 2]" 1
111 1 17 TYR H 1 17 TYR QD . . 3.650 3.091 2.607 3.377 . 0 0 "[ . 1 . 2]" 1
112 1 17 TYR H 1 17 TYR QE . . 4.760 4.535 4.201 4.757 . 0 0 "[ . 1 . 2]" 1
113 1 17 TYR H 1 18 GLY HA2 . . 5.500 5.229 5.054 5.313 . 0 0 "[ . 1 . 2]" 1
114 1 17 TYR H 1 18 GLY QA . . 4.730 4.332 4.254 4.407 . 0 0 "[ . 1 . 2]" 1
115 1 17 TYR H 1 18 GLY HA3 . . 5.500 4.624 4.562 4.709 . 0 0 "[ . 1 . 2]" 1
116 1 17 TYR H 1 21 LEU MD1 . . 3.700 2.661 2.476 2.945 . 0 0 "[ . 1 . 2]" 1
117 1 17 TYR H 1 21 LEU MD2 . . 5.380 4.969 4.505 5.363 . 0 0 "[ . 1 . 2]" 1
118 1 17 TYR H 1 21 LEU HG . . 5.320 5.031 4.888 5.229 . 0 0 "[ . 1 . 2]" 1
119 1 17 TYR H 1 32 PHE HB2 . . 5.100 3.779 3.657 3.818 . 0 0 "[ . 1 . 2]" 1
120 1 17 TYR H 1 32 PHE HB3 . . 5.500 5.493 5.377 5.508 0.008 4 0 "[ . 1 . 2]" 1
121 1 17 TYR H 1 32 PHE QD . . 4.220 3.643 3.363 3.865 . 0 0 "[ . 1 . 2]" 1
122 1 17 TYR H 1 33 THR H . . 3.470 3.270 3.017 3.350 . 0 0 "[ . 1 . 2]" 1
123 1 17 TYR H 1 33 THR HB . . 3.890 3.724 3.226 3.873 . 0 0 "[ . 1 . 2]" 1
124 1 17 TYR H 1 33 THR MG . . 4.060 3.663 3.334 3.853 . 0 0 "[ . 1 . 2]" 1
125 1 17 TYR H 1 34 ILE HA . . 3.860 3.533 3.437 3.742 . 0 0 "[ . 1 . 2]" 1
126 1 17 TYR H 1 35 VAL H . . 4.750 4.430 4.260 4.655 . 0 0 "[ . 1 . 2]" 1
127 1 17 TYR HA 1 18 GLY H . . 3.120 2.196 2.142 2.369 . 0 0 "[ . 1 . 2]" 1
128 1 17 TYR HA 1 21 LEU MD1 . . 4.060 2.440 2.061 2.810 . 0 0 "[ . 1 . 2]" 1
129 1 17 TYR QB 1 18 GLY H . . 3.390 3.053 2.497 3.387 . 0 0 "[ . 1 . 2]" 1
130 1 17 TYR QD 1 18 GLY H . . 4.240 3.792 3.409 4.104 . 0 0 "[ . 1 . 2]" 1
131 1 17 TYR QD 1 18 GLY HA2 . . 4.700 3.296 2.839 3.535 . 0 0 "[ . 1 . 2]" 1
132 1 17 TYR QD 1 18 GLY QA . . 3.990 3.202 2.772 3.430 . 0 0 "[ . 1 . 2]" 1
133 1 17 TYR QD 1 18 GLY HA3 . . 4.700 4.363 3.881 4.635 . 0 0 "[ . 1 . 2]" 1
134 1 17 TYR QD 1 33 THR HB . . 4.660 3.579 3.034 3.933 . 0 0 "[ . 1 . 2]" 1
135 1 17 TYR QD 1 35 VAL QG . . 3.680 2.638 2.249 3.379 . 0 0 "[ . 1 . 2]" 1
136 1 17 TYR QE 1 33 THR HB . . 4.420 3.161 2.747 3.536 . 0 0 "[ . 1 . 2]" 1
137 1 17 TYR QE 1 33 THR MG . . 4.140 2.386 1.920 2.670 . 0 0 "[ . 1 . 2]" 1
138 1 17 TYR QE 1 35 VAL QG . . 3.040 2.260 1.871 3.037 . 0 0 "[ . 1 . 2]" 1
139 1 18 GLY H 1 19 PRO HD2 . . 5.150 4.797 4.769 4.813 . 0 0 "[ . 1 . 2]" 1
140 1 18 GLY H 1 19 PRO QD . . 4.490 4.316 4.290 4.331 . 0 0 "[ . 1 . 2]" 1
141 1 18 GLY H 1 19 PRO HD3 . . 5.150 4.897 4.821 4.968 . 0 0 "[ . 1 . 2]" 1
142 1 18 GLY H 1 21 LEU H . . 4.690 4.238 4.042 4.445 . 0 0 "[ . 1 . 2]" 1
143 1 18 GLY H 1 21 LEU MD1 . . 3.920 2.754 2.155 3.168 . 0 0 "[ . 1 . 2]" 1
144 1 18 GLY H 1 32 PHE HB2 . . 5.500 4.144 3.793 4.374 . 0 0 "[ . 1 . 2]" 1
145 1 18 GLY QA 1 19 PRO QD . . 2.930 2.032 2.016 2.035 . 0 0 "[ . 1 . 2]" 1
146 1 18 GLY QA 1 19 PRO QG . . 4.340 3.698 3.693 3.700 . 0 0 "[ . 1 . 2]" 1
147 1 18 GLY QA 1 20 GLY H . . 4.240 3.565 3.428 3.653 . 0 0 "[ . 1 . 2]" 1
148 1 18 GLY QA 1 21 LEU H . . 4.540 3.535 3.467 3.635 . 0 0 "[ . 1 . 2]" 1
149 1 18 GLY QA 1 33 THR H . . 3.770 2.800 2.647 2.939 . 0 0 "[ . 1 . 2]" 1
150 1 18 GLY HA2 1 19 PRO HD2 . . 3.880 2.697 2.632 2.820 . 0 0 "[ . 1 . 2]" 1
151 1 18 GLY HA2 1 19 PRO HD3 . . 3.880 2.461 2.417 2.553 . 0 0 "[ . 1 . 2]" 1
152 1 18 GLY HA2 1 20 GLY H . . 4.880 4.614 4.479 4.751 . 0 0 "[ . 1 . 2]" 1
153 1 18 GLY HA2 1 32 PHE HA . . 4.350 3.664 3.398 3.957 . 0 0 "[ . 1 . 2]" 1
154 1 18 GLY HA2 1 33 THR H . . 4.570 3.852 3.658 4.000 . 0 0 "[ . 1 . 2]" 1
155 1 18 GLY HA3 1 19 PRO HD2 . . 3.880 2.337 2.228 2.396 . 0 0 "[ . 1 . 2]" 1
156 1 18 GLY HA3 1 19 PRO HD3 . . 3.880 3.224 3.105 3.285 . 0 0 "[ . 1 . 2]" 1
157 1 18 GLY HA3 1 20 GLY H . . 4.880 3.710 3.554 3.809 . 0 0 "[ . 1 . 2]" 1
158 1 18 GLY HA3 1 32 PHE HA . . 4.350 2.323 2.122 2.434 . 0 0 "[ . 1 . 2]" 1
159 1 18 GLY HA3 1 33 THR H . . 4.570 2.877 2.696 3.036 . 0 0 "[ . 1 . 2]" 1
160 1 19 PRO HA 1 21 LEU H . . 4.460 4.141 3.901 4.327 . 0 0 "[ . 1 . 2]" 1
161 1 19 PRO HA 1 22 SER H . . 4.380 3.525 3.278 3.717 . 0 0 "[ . 1 . 2]" 1
162 1 19 PRO HA 1 22 SER QB . . 5.220 3.046 2.695 3.946 . 0 0 "[ . 1 . 2]" 1
163 1 19 PRO HA 1 23 HIS H . . 4.030 3.933 3.796 4.027 . 0 0 "[ . 1 . 2]" 1
164 1 19 PRO HA 1 23 HIS HE1 . . 4.460 4.213 3.921 4.431 . 0 0 "[ . 1 . 2]" 1
165 1 19 PRO HB2 1 20 GLY H . . 3.760 3.059 2.971 3.196 . 0 0 "[ . 1 . 2]" 1
166 1 19 PRO HB2 1 31 THR H . . 5.280 5.198 4.973 5.280 0.000 7 0 "[ . 1 . 2]" 1
167 1 19 PRO HB3 1 20 GLY H . . 4.130 3.983 3.933 4.062 . 0 0 "[ . 1 . 2]" 1
168 1 19 PRO HB3 1 23 HIS HE1 . . 4.910 4.792 4.080 4.911 0.001 2 0 "[ . 1 . 2]" 1
169 1 19 PRO QD 1 20 GLY H . . 3.760 2.646 2.613 2.674 . 0 0 "[ . 1 . 2]" 1
170 1 19 PRO QD 1 33 THR H . . 4.820 4.212 3.974 4.329 . 0 0 "[ . 1 . 2]" 1
171 1 19 PRO HD2 1 20 GLY H . . 4.400 2.695 2.659 2.726 . 0 0 "[ . 1 . 2]" 1
172 1 19 PRO HD2 1 33 THR H . . 5.500 4.392 4.116 4.542 . 0 0 "[ . 1 . 2]" 1
173 1 19 PRO HD3 1 20 GLY H . . 4.400 3.853 3.840 3.865 . 0 0 "[ . 1 . 2]" 1
174 1 19 PRO HD3 1 33 THR H . . 5.500 5.412 5.241 5.499 . 0 0 "[ . 1 . 2]" 1
175 1 19 PRO QG 1 20 GLY H . . 3.230 2.052 1.970 2.190 . 0 0 "[ . 1 . 2]" 1
176 1 19 PRO QG 1 31 THR H . . 4.210 3.611 3.386 3.780 . 0 0 "[ . 1 . 2]" 1
177 1 20 GLY H 1 21 LEU H . . 3.340 2.676 2.605 2.755 . 0 0 "[ . 1 . 2]" 1
178 1 20 GLY H 1 21 LEU HG . . 4.590 4.433 4.178 4.544 . 0 0 "[ . 1 . 2]" 1
179 1 20 GLY H 1 22 SER H . . 4.910 4.335 4.209 4.434 . 0 0 "[ . 1 . 2]" 1
180 1 20 GLY H 1 30 ALA HA . . 4.790 4.309 4.110 4.609 . 0 0 "[ . 1 . 2]" 1
181 1 20 GLY H 1 30 ALA MB . . 4.000 3.824 3.657 4.018 0.018 14 0 "[ . 1 . 2]" 1
182 1 20 GLY H 1 31 THR H . . 3.970 3.900 3.768 3.974 0.004 2 0 "[ . 1 . 2]" 1
183 1 20 GLY H 1 31 THR MG . . 5.500 5.467 5.413 5.502 0.002 19 0 "[ . 1 . 2]" 1
184 1 20 GLY H 1 32 PHE HA . . 4.260 3.932 3.636 4.141 . 0 0 "[ . 1 . 2]" 1
185 1 20 GLY H 1 32 PHE HB2 . . 5.040 4.720 4.472 4.933 . 0 0 "[ . 1 . 2]" 1
186 1 20 GLY H 1 32 PHE HB3 . . 3.920 3.304 3.073 3.503 . 0 0 "[ . 1 . 2]" 1
187 1 20 GLY H 1 32 PHE QD . . 4.650 4.528 4.264 4.652 0.002 16 0 "[ . 1 . 2]" 1
188 1 20 GLY HA2 1 22 SER H . . 4.670 4.533 4.241 4.681 0.011 10 0 "[ . 1 . 2]" 1
189 1 20 GLY HA2 1 23 HIS H . . 3.830 3.661 3.565 3.828 . 0 0 "[ . 1 . 2]" 1
190 1 20 GLY HA2 1 30 ALA MB . . 3.560 2.087 1.953 2.407 . 0 0 "[ . 1 . 2]" 1
191 1 20 GLY HA2 1 31 THR H . . 4.500 4.392 4.110 4.501 0.001 19 0 "[ . 1 . 2]" 1
192 1 20 GLY HA3 1 21 LEU HA . . 5.100 4.365 4.345 4.391 . 0 0 "[ . 1 . 2]" 1
193 1 20 GLY HA3 1 22 SER H . . 5.090 4.905 4.752 5.033 . 0 0 "[ . 1 . 2]" 1
194 1 20 GLY HA3 1 30 ALA H . . 5.260 4.932 4.760 5.259 . 0 0 "[ . 1 . 2]" 1
195 1 20 GLY HA3 1 30 ALA MB . . 3.560 1.943 1.844 2.048 . 0 0 "[ . 1 . 2]" 1
196 1 20 GLY HA3 1 31 THR H . . 3.970 3.547 3.435 3.639 . 0 0 "[ . 1 . 2]" 1
197 1 20 GLY HA3 1 31 THR HA . . 5.390 4.645 4.339 4.837 . 0 0 "[ . 1 . 2]" 1
198 1 20 GLY HA3 1 32 PHE H . . 5.500 5.179 4.885 5.396 . 0 0 "[ . 1 . 2]" 1
199 1 20 GLY HA3 1 32 PHE QD . . 4.600 3.556 3.212 3.840 . 0 0 "[ . 1 . 2]" 1
200 1 21 LEU H 1 21 LEU HB2 . . 3.190 2.401 2.343 2.480 . 0 0 "[ . 1 . 2]" 1
201 1 21 LEU H 1 21 LEU HB3 . . 3.690 3.588 3.567 3.609 . 0 0 "[ . 1 . 2]" 1
202 1 21 LEU H 1 21 LEU MD1 . . 3.810 3.641 3.323 3.796 . 0 0 "[ . 1 . 2]" 1
203 1 21 LEU H 1 21 LEU MD2 . . 3.760 3.563 3.391 3.716 . 0 0 "[ . 1 . 2]" 1
204 1 21 LEU H 1 21 LEU HG . . 3.050 2.487 2.341 2.675 . 0 0 "[ . 1 . 2]" 1
205 1 21 LEU H 1 22 SER H . . 3.110 2.510 2.282 2.617 . 0 0 "[ . 1 . 2]" 1
206 1 21 LEU H 1 23 HIS H . . 4.030 3.972 3.871 4.027 . 0 0 "[ . 1 . 2]" 1
207 1 21 LEU H 1 32 PHE HA . . 4.960 4.609 4.328 4.725 . 0 0 "[ . 1 . 2]" 1
208 1 21 LEU H 1 32 PHE HB2 . . 4.170 3.875 3.506 4.059 . 0 0 "[ . 1 . 2]" 1
209 1 21 LEU H 1 32 PHE HB3 . . 3.970 2.819 2.507 2.967 . 0 0 "[ . 1 . 2]" 1
210 1 21 LEU H 1 32 PHE QD . . 4.450 4.331 4.083 4.452 0.002 11 0 "[ . 1 . 2]" 1
211 1 21 LEU HA 1 21 LEU MD1 . . 4.130 3.870 3.832 3.934 . 0 0 "[ . 1 . 2]" 1
212 1 21 LEU HA 1 21 LEU MD2 . . 3.140 2.117 1.967 2.310 . 0 0 "[ . 1 . 2]" 1
213 1 21 LEU HA 1 21 LEU HG . . 3.600 3.038 2.940 3.128 . 0 0 "[ . 1 . 2]" 1
214 1 21 LEU HA 1 23 HIS H . . 4.950 4.573 4.453 4.693 . 0 0 "[ . 1 . 2]" 1
215 1 21 LEU HA 1 80 ILE MD . . 3.520 2.649 2.425 2.840 . 0 0 "[ . 1 . 2]" 1
216 1 21 LEU HA 1 94 PHE HB3 . . 5.490 4.151 3.832 4.447 . 0 0 "[ . 1 . 2]" 1
217 1 21 LEU HA 1 96 ALA MB . . 3.730 2.563 2.371 2.793 . 0 0 "[ . 1 . 2]" 1
218 1 21 LEU HB2 1 21 LEU MD1 . . 3.420 2.293 2.174 2.382 . 0 0 "[ . 1 . 2]" 1
219 1 21 LEU HB2 1 22 SER H . . 3.960 2.602 2.468 2.867 . 0 0 "[ . 1 . 2]" 1
220 1 21 LEU HB2 1 23 HIS H . . 5.320 5.000 4.900 5.196 . 0 0 "[ . 1 . 2]" 1
221 1 21 LEU HB3 1 21 LEU MD1 . . 3.400 2.394 2.280 2.570 . 0 0 "[ . 1 . 2]" 1
222 1 21 LEU HB3 1 21 LEU MD2 . . 3.320 2.292 2.165 2.382 . 0 0 "[ . 1 . 2]" 1
223 1 21 LEU HB3 1 22 SER H . . 4.110 3.580 3.416 3.781 . 0 0 "[ . 1 . 2]" 1
224 1 21 LEU HB3 1 22 SER HA . . 4.430 4.342 4.226 4.426 . 0 0 "[ . 1 . 2]" 1
225 1 21 LEU HB3 1 32 PHE HB2 . . 4.920 4.883 4.788 4.923 0.003 19 0 "[ . 1 . 2]" 1
226 1 21 LEU HB3 1 94 PHE HB2 . . 4.870 4.070 3.866 4.336 . 0 0 "[ . 1 . 2]" 1
227 1 21 LEU HB3 1 94 PHE HB3 . . 4.450 3.187 2.961 3.516 . 0 0 "[ . 1 . 2]" 1
228 1 21 LEU MD1 1 22 SER H . . 5.010 4.472 4.201 4.744 . 0 0 "[ . 1 . 2]" 1
229 1 21 LEU MD1 1 32 PHE HB2 . . 4.380 2.091 1.942 2.262 . 0 0 "[ . 1 . 2]" 1
230 1 21 LEU MD1 1 32 PHE HB3 . . 4.640 3.141 3.028 3.280 . 0 0 "[ . 1 . 2]" 1
231 1 21 LEU MD1 1 32 PHE QD . . 4.520 2.183 1.978 2.549 . 0 0 "[ . 1 . 2]" 1
232 1 21 LEU MD1 1 33 THR H . . 4.810 3.417 3.130 3.686 . 0 0 "[ . 1 . 2]" 1
233 1 21 LEU MD1 1 94 PHE QD . . 4.250 3.839 3.598 4.081 . 0 0 "[ . 1 . 2]" 1
234 1 21 LEU MD2 1 22 SER H . . 5.010 4.684 4.620 4.760 . 0 0 "[ . 1 . 2]" 1
235 1 21 LEU MD2 1 32 PHE HB3 . . 4.710 3.410 3.258 3.631 . 0 0 "[ . 1 . 2]" 1
236 1 21 LEU MD2 1 32 PHE QD . . 4.190 2.935 2.768 3.081 . 0 0 "[ . 1 . 2]" 1
237 1 21 LEU MD2 1 32 PHE QE . . 4.340 3.166 2.998 3.320 . 0 0 "[ . 1 . 2]" 1
238 1 21 LEU MD2 1 80 ILE H . . 5.130 4.963 4.784 5.130 0.000 19 0 "[ . 1 . 2]" 1
239 1 21 LEU MD2 1 80 ILE HB . . 4.320 3.293 3.156 3.463 . 0 0 "[ . 1 . 2]" 1
240 1 21 LEU MD2 1 80 ILE MD . . 3.080 1.785 1.683 2.006 . 0 0 "[ . 1 . 2]" 1
241 1 21 LEU MD2 1 80 ILE QG . . 4.280 3.527 3.377 3.820 . 0 0 "[ . 1 . 2]" 1
242 1 21 LEU MD2 1 80 ILE MG . . 3.550 2.902 2.730 3.190 . 0 0 "[ . 1 . 2]" 1
243 1 21 LEU MD2 1 94 PHE H . . 5.210 4.617 4.410 4.790 . 0 0 "[ . 1 . 2]" 1
244 1 21 LEU MD2 1 94 PHE HB2 . . 4.200 2.742 2.501 3.020 . 0 0 "[ . 1 . 2]" 1
245 1 21 LEU MD2 1 94 PHE HB3 . . 4.360 3.029 2.763 3.414 . 0 0 "[ . 1 . 2]" 1
246 1 21 LEU MD2 1 94 PHE QD . . 3.900 3.467 3.094 3.819 . 0 0 "[ . 1 . 2]" 1
247 1 21 LEU HG 1 22 SER H . . 4.520 4.403 4.283 4.515 . 0 0 "[ . 1 . 2]" 1
248 1 21 LEU HG 1 32 PHE HB2 . . 4.260 2.273 2.178 2.385 . 0 0 "[ . 1 . 2]" 1
249 1 21 LEU HG 1 32 PHE HB3 . . 4.300 2.036 2.000 2.119 . 0 0 "[ . 1 . 2]" 1
250 1 21 LEU HG 1 32 PHE QD . . 3.940 3.107 2.962 3.191 . 0 0 "[ . 1 . 2]" 1
251 1 21 LEU HG 1 33 THR H . . 4.830 4.598 4.418 4.781 . 0 0 "[ . 1 . 2]" 1
252 1 22 SER H 1 22 SER HB2 . . 4.040 2.565 2.202 3.612 . 0 0 "[ . 1 . 2]" 1
253 1 22 SER H 1 22 SER HB3 . . 4.040 3.079 2.442 3.623 . 0 0 "[ . 1 . 2]" 1
254 1 22 SER H 1 23 HIS H . . 2.640 2.562 2.395 2.641 0.001 2 0 "[ . 1 . 2]" 1
255 1 22 SER H 1 23 HIS HA . . 5.370 5.027 4.873 5.089 . 0 0 "[ . 1 . 2]" 1
256 1 22 SER H 1 96 ALA HA . . 5.420 5.278 5.116 5.366 . 0 0 "[ . 1 . 2]" 1
257 1 22 SER HA 1 96 ALA HA . . 4.100 4.013 3.806 4.100 0.000 2 0 "[ . 1 . 2]" 1
258 1 22 SER HA 1 97 LYS H . . 4.710 4.646 4.546 4.712 0.002 7 0 "[ . 1 . 2]" 1
259 1 22 SER HB2 1 23 HIS H . . 4.140 3.241 2.585 3.944 . 0 0 "[ . 1 . 2]" 1
260 1 22 SER HB3 1 23 HIS H . . 4.140 3.204 2.551 3.958 . 0 0 "[ . 1 . 2]" 1
261 1 23 HIS H 1 23 HIS HB2 . . 4.120 4.045 4.006 4.073 . 0 0 "[ . 1 . 2]" 1
262 1 23 HIS H 1 23 HIS QB . . 3.560 3.281 3.192 3.336 . 0 0 "[ . 1 . 2]" 1
263 1 23 HIS H 1 23 HIS HB3 . . 4.120 3.471 3.341 3.559 . 0 0 "[ . 1 . 2]" 1
264 1 23 HIS H 1 23 HIS HD2 . . 4.900 4.827 4.545 4.903 0.003 10 0 "[ . 1 . 2]" 1
265 1 23 HIS H 1 24 GLY H . . 4.510 4.365 4.359 4.370 . 0 0 "[ . 1 . 2]" 1
266 1 23 HIS H 1 30 ALA MB . . 5.170 5.032 4.842 5.176 0.006 14 0 "[ . 1 . 2]" 1
267 1 23 HIS H 1 96 ALA HA . . 5.130 4.723 4.571 4.849 . 0 0 "[ . 1 . 2]" 1
268 1 23 HIS H 1 96 ALA MB . . 4.280 3.908 3.629 4.208 . 0 0 "[ . 1 . 2]" 1
269 1 23 HIS H 1 97 LYS H . . 4.520 4.480 4.397 4.523 0.003 5 0 "[ . 1 . 2]" 1
270 1 23 HIS H 1 98 ILE MD . . 5.070 4.895 4.710 5.051 . 0 0 "[ . 1 . 2]" 1
271 1 23 HIS HA 1 24 GLY H . . 2.860 2.601 2.530 2.641 . 0 0 "[ . 1 . 2]" 1
272 1 23 HIS HA 1 24 GLY QA . . 4.710 3.973 3.956 3.991 . 0 0 "[ . 1 . 2]" 1
273 1 23 HIS HA 1 96 ALA HA . . 4.750 3.624 3.391 3.791 . 0 0 "[ . 1 . 2]" 1
274 1 23 HIS HA 1 96 ALA MB . . 4.050 3.292 2.906 3.468 . 0 0 "[ . 1 . 2]" 1
275 1 23 HIS HA 1 97 LYS H . . 3.310 2.258 2.138 2.387 . 0 0 "[ . 1 . 2]" 1
276 1 23 HIS HA 1 97 LYS QB . . 4.330 3.045 2.837 3.997 . 0 0 "[ . 1 . 2]" 1
277 1 23 HIS HA 1 98 ILE MD . . 4.230 3.576 3.370 3.818 . 0 0 "[ . 1 . 2]" 1
278 1 23 HIS QB 1 24 GLY H . . 3.090 2.104 2.023 2.178 . 0 0 "[ . 1 . 2]" 1
279 1 23 HIS QB 1 97 LYS H . . 3.990 3.390 3.061 3.666 . 0 0 "[ . 1 . 2]" 1
280 1 23 HIS HB2 1 24 GLY H . . 3.740 2.118 2.035 2.195 . 0 0 "[ . 1 . 2]" 1
281 1 23 HIS HB2 1 97 LYS H . . 4.600 4.037 3.768 4.469 . 0 0 "[ . 1 . 2]" 1
282 1 23 HIS HB3 1 24 GLY H . . 3.740 3.618 3.550 3.675 . 0 0 "[ . 1 . 2]" 1
283 1 23 HIS HB3 1 97 LYS H . . 4.600 3.650 3.239 3.961 . 0 0 "[ . 1 . 2]" 1
284 1 23 HIS HD2 1 24 GLY H . . 4.860 3.103 2.598 3.580 . 0 0 "[ . 1 . 2]" 1
285 1 24 GLY H 1 25 MET H . . 4.480 4.365 4.332 4.383 . 0 0 "[ . 1 . 2]" 1
286 1 24 GLY H 1 25 MET HA . . 5.220 4.643 4.627 4.666 . 0 0 "[ . 1 . 2]" 1
287 1 24 GLY H 1 96 ALA MB . . 4.970 4.769 4.481 4.937 . 0 0 "[ . 1 . 2]" 1
288 1 24 GLY H 1 97 LYS QB . . 4.820 3.864 3.602 4.803 . 0 0 "[ . 1 . 2]" 1
289 1 24 GLY H 1 98 ILE HA . . 3.580 2.801 2.662 2.881 . 0 0 "[ . 1 . 2]" 1
290 1 24 GLY H 1 98 ILE MD . . 3.300 2.855 2.746 2.990 . 0 0 "[ . 1 . 2]" 1
291 1 24 GLY H 1 98 ILE MG . . 4.420 4.404 4.317 4.423 0.003 7 0 "[ . 1 . 2]" 1
292 1 24 GLY H 1 99 THR H . . 3.820 3.735 3.529 3.834 0.014 20 0 "[ . 1 . 2]" 1
293 1 24 GLY H 1 99 THR MG . . 4.620 4.365 3.747 4.622 0.002 14 0 "[ . 1 . 2]" 1
294 1 24 GLY QA 1 25 MET H . . 2.760 2.267 2.243 2.282 . 0 0 "[ . 1 . 2]" 1
295 1 24 GLY QA 1 25 MET HA . . 4.930 3.948 3.941 3.955 . 0 0 "[ . 1 . 2]" 1
296 1 24 GLY QA 1 30 ALA MB . . 3.730 3.254 3.101 3.402 . 0 0 "[ . 1 . 2]" 1
297 1 24 GLY QA 1 98 ILE MD . . 3.440 2.062 1.877 2.271 . 0 0 "[ . 1 . 2]" 1
298 1 24 GLY QA 1 99 THR H . . 4.790 4.365 4.253 4.459 . 0 0 "[ . 1 . 2]" 1
299 1 25 MET H 1 25 MET HB2 . . 3.520 2.760 2.588 2.854 . 0 0 "[ . 1 . 2]" 1
300 1 25 MET H 1 25 MET HB3 . . 4.000 3.842 3.696 3.894 . 0 0 "[ . 1 . 2]" 1
301 1 25 MET H 1 25 MET ME . . 5.000 3.825 2.885 4.994 . 0 0 "[ . 1 . 2]" 1
302 1 25 MET H 1 25 MET HG2 . . 4.660 4.459 4.342 4.658 . 0 0 "[ . 1 . 2]" 1
303 1 25 MET H 1 25 MET QG . . 4.090 3.263 2.984 3.795 . 0 0 "[ . 1 . 2]" 1
304 1 25 MET H 1 25 MET HG3 . . 4.660 3.368 3.040 4.020 . 0 0 "[ . 1 . 2]" 1
305 1 25 MET H 1 26 VAL H . . 4.510 4.419 4.377 4.463 . 0 0 "[ . 1 . 2]" 1
306 1 25 MET H 1 28 LYS H . . 5.050 4.808 4.648 5.018 . 0 0 "[ . 1 . 2]" 1
307 1 25 MET H 1 28 LYS HB2 . . 4.270 2.815 2.561 4.318 0.048 10 0 "[ . 1 . 2]" 1
308 1 25 MET H 1 28 LYS QB . . 3.680 2.742 2.525 3.743 0.063 10 0 "[ . 1 . 2]" 1
309 1 25 MET H 1 28 LYS HB3 . . 4.270 3.976 3.822 4.110 . 0 0 "[ . 1 . 2]" 1
310 1 25 MET H 1 28 LYS QG . . 4.890 3.583 1.828 3.916 . 0 0 "[ . 1 . 2]" 1
311 1 25 MET H 1 98 ILE MD . . 3.900 2.955 2.675 3.296 . 0 0 "[ . 1 . 2]" 1
312 1 25 MET H 1 98 ILE MG . . 3.980 3.321 2.976 3.690 . 0 0 "[ . 1 . 2]" 1
313 1 25 MET HA 1 25 MET HG2 . . 4.190 3.056 2.694 3.684 . 0 0 "[ . 1 . 2]" 1
314 1 25 MET HA 1 25 MET HG3 . . 4.190 2.645 2.293 2.844 . 0 0 "[ . 1 . 2]" 1
315 1 25 MET HA 1 26 VAL H . . 2.720 2.338 2.253 2.541 . 0 0 "[ . 1 . 2]" 1
316 1 25 MET HA 1 26 VAL HB . . 4.940 4.875 4.633 4.957 0.017 10 0 "[ . 1 . 2]" 1
317 1 25 MET HA 1 26 VAL MG2 . . 4.580 3.578 3.448 3.987 . 0 0 "[ . 1 . 2]" 1
318 1 25 MET HA 1 98 ILE MG . . 3.880 2.484 2.264 2.730 . 0 0 "[ . 1 . 2]" 1
319 1 25 MET HA 1 99 THR H . . 3.230 2.342 2.079 2.492 . 0 0 "[ . 1 . 2]" 1
320 1 25 MET HB2 1 25 MET ME . . 4.410 2.615 1.974 3.975 . 0 0 "[ . 1 . 2]" 1
321 1 25 MET HB2 1 26 VAL H . . 3.900 3.755 3.499 3.910 0.010 20 0 "[ . 1 . 2]" 1
322 1 25 MET HB2 1 28 LYS H . . 5.290 5.108 4.970 5.238 . 0 0 "[ . 1 . 2]" 1
323 1 25 MET HB2 1 28 LYS HB2 . . 4.320 3.088 2.854 3.875 . 0 0 "[ . 1 . 2]" 1
324 1 25 MET HB2 1 28 LYS QB . . 3.750 2.945 2.774 3.086 . 0 0 "[ . 1 . 2]" 1
325 1 25 MET HB2 1 28 LYS HB3 . . 4.320 3.866 3.051 4.176 . 0 0 "[ . 1 . 2]" 1
326 1 25 MET HB2 1 28 LYS QG . . 3.400 2.040 1.979 2.369 . 0 0 "[ . 1 . 2]" 1
327 1 25 MET HB2 1 99 THR H . . 5.500 5.160 4.800 5.345 . 0 0 "[ . 1 . 2]" 1
328 1 25 MET HB3 1 25 MET ME . . 4.270 3.203 2.123 4.263 . 0 0 "[ . 1 . 2]" 1
329 1 25 MET HB3 1 26 VAL H . . 3.230 2.607 2.133 2.836 . 0 0 "[ . 1 . 2]" 1
330 1 25 MET HB3 1 28 LYS QB . . 4.520 4.172 3.816 4.389 . 0 0 "[ . 1 . 2]" 1
331 1 25 MET HB3 1 28 LYS QG . . 3.560 3.137 2.603 3.544 . 0 0 "[ . 1 . 2]" 1
332 1 25 MET HB3 1 99 THR H . . 4.720 4.527 4.293 4.722 0.002 2 0 "[ . 1 . 2]" 1
333 1 25 MET ME 1 26 VAL H . . 5.440 5.081 4.345 5.445 0.005 2 0 "[ . 1 . 2]" 1
334 1 25 MET QG 1 26 VAL H . . 3.990 3.871 3.410 3.997 0.007 20 0 "[ . 1 . 2]" 1
335 1 25 MET QG 1 99 THR H . . 4.400 3.311 2.999 3.531 . 0 0 "[ . 1 . 2]" 1
336 1 25 MET HG2 1 26 VAL H . . 4.780 4.281 3.561 4.729 . 0 0 "[ . 1 . 2]" 1
337 1 25 MET HG3 1 26 VAL H . . 4.780 4.515 3.814 4.780 . 0 0 "[ . 1 . 2]" 1
338 1 26 VAL H 1 26 VAL HB . . 3.020 2.545 2.396 2.624 . 0 0 "[ . 1 . 2]" 1
339 1 26 VAL H 1 26 VAL MG1 . . 3.780 3.762 3.734 3.771 . 0 0 "[ . 1 . 2]" 1
340 1 26 VAL H 1 26 VAL MG2 . . 3.060 2.056 1.878 2.474 . 0 0 "[ . 1 . 2]" 1
341 1 26 VAL H 1 27 ASN H . . 4.730 4.624 4.581 4.634 . 0 0 "[ . 1 . 2]" 1
342 1 26 VAL H 1 28 LYS QG . . 4.770 4.297 4.001 4.729 . 0 0 "[ . 1 . 2]" 1
343 1 26 VAL H 1 98 ILE MG . . 3.250 2.817 2.657 3.074 . 0 0 "[ . 1 . 2]" 1
344 1 26 VAL H 1 99 THR H . . 4.100 4.034 3.714 4.105 0.005 10 0 "[ . 1 . 2]" 1
345 1 26 VAL H 1 99 THR HB . . 5.500 5.384 5.181 5.535 0.035 20 0 "[ . 1 . 2]" 1
346 1 26 VAL H 1 100 GLY HA2 . . 4.220 3.248 2.666 4.065 . 0 0 "[ . 1 . 2]" 1
347 1 26 VAL H 1 100 GLY QA . . 3.670 2.909 2.551 3.231 . 0 0 "[ . 1 . 2]" 1
348 1 26 VAL H 1 100 GLY HA3 . . 4.220 3.747 2.578 4.219 . 0 0 "[ . 1 . 2]" 1
349 1 26 VAL HA 1 26 VAL MG1 . . 3.550 2.434 2.293 2.546 . 0 0 "[ . 1 . 2]" 1
350 1 26 VAL HA 1 26 VAL MG2 . . 3.420 2.428 2.204 2.491 . 0 0 "[ . 1 . 2]" 1
351 1 26 VAL HA 1 27 ASN H . . 2.790 2.235 2.205 2.261 . 0 0 "[ . 1 . 2]" 1
352 1 26 VAL HA 1 27 ASN HA . . 4.510 4.425 4.404 4.446 . 0 0 "[ . 1 . 2]" 1
353 1 26 VAL HA 1 28 LYS H . . 3.720 3.476 3.318 3.721 0.001 10 0 "[ . 1 . 2]" 1
354 1 26 VAL HA 1 72 PRO QB . . 4.800 3.273 2.935 3.429 . 0 0 "[ . 1 . 2]" 1
355 1 26 VAL HA 1 72 PRO HG2 . . 3.920 2.352 2.087 2.599 . 0 0 "[ . 1 . 2]" 1
356 1 26 VAL HA 1 72 PRO HG3 . . 4.390 3.753 3.422 4.018 . 0 0 "[ . 1 . 2]" 1
357 1 26 VAL HA 1 73 THR HA . . 4.870 4.726 4.582 4.877 0.007 10 0 "[ . 1 . 2]" 1
358 1 26 VAL HA 1 98 ILE MG . . 3.720 2.752 2.514 2.892 . 0 0 "[ . 1 . 2]" 1
359 1 26 VAL HB 1 27 ASN H . . 4.150 3.932 3.832 4.032 . 0 0 "[ . 1 . 2]" 1
360 1 26 VAL HB 1 27 ASN HD21 . . 5.180 3.840 3.506 5.189 0.009 12 0 "[ . 1 . 2]" 1
361 1 26 VAL HB 1 27 ASN HD22 . . 5.430 5.082 4.144 5.431 0.001 20 0 "[ . 1 . 2]" 1
362 1 26 VAL HB 1 100 GLY HA2 . . 4.540 3.190 2.319 4.059 . 0 0 "[ . 1 . 2]" 1
363 1 26 VAL HB 1 100 GLY HA3 . . 4.540 3.305 2.435 3.748 . 0 0 "[ . 1 . 2]" 1
364 1 26 VAL HB 1 101 ASP H . . 4.570 4.112 3.566 4.475 . 0 0 "[ . 1 . 2]" 1
365 1 26 VAL MG1 1 27 ASN H . . 3.400 2.171 2.100 2.268 . 0 0 "[ . 1 . 2]" 1
366 1 26 VAL MG1 1 27 ASN HA . . 4.760 3.422 3.374 3.510 . 0 0 "[ . 1 . 2]" 1
367 1 26 VAL MG1 1 27 ASN HB2 . . 4.080 2.859 2.404 3.904 . 0 0 "[ . 1 . 2]" 1
368 1 26 VAL MG1 1 27 ASN QB . . 3.580 2.781 2.380 3.513 . 0 0 "[ . 1 . 2]" 1
369 1 26 VAL MG1 1 27 ASN HB3 . . 4.080 4.040 3.822 4.082 0.002 8 0 "[ . 1 . 2]" 1
370 1 26 VAL MG1 1 27 ASN HD21 . . 3.790 2.143 1.864 3.538 . 0 0 "[ . 1 . 2]" 1
371 1 26 VAL MG1 1 27 ASN HD22 . . 3.850 2.916 2.377 3.326 . 0 0 "[ . 1 . 2]" 1
372 1 26 VAL MG1 1 28 LYS H . . 4.590 4.265 4.179 4.442 . 0 0 "[ . 1 . 2]" 1
373 1 26 VAL MG1 1 73 THR HA . . 3.940 2.900 2.653 3.095 . 0 0 "[ . 1 . 2]" 1
374 1 26 VAL MG1 1 74 ALA HA . . 4.610 3.053 2.693 3.604 . 0 0 "[ . 1 . 2]" 1
375 1 26 VAL MG2 1 27 ASN H . . 3.950 3.878 3.658 3.959 0.009 12 0 "[ . 1 . 2]" 1
376 1 26 VAL MG2 1 72 PRO HG2 . . 4.790 4.030 3.756 4.255 . 0 0 "[ . 1 . 2]" 1
377 1 26 VAL MG2 1 73 THR H . . 5.260 4.897 4.436 5.123 . 0 0 "[ . 1 . 2]" 1
378 1 26 VAL MG2 1 74 ALA H . . 4.040 3.802 3.455 4.021 . 0 0 "[ . 1 . 2]" 1
379 1 26 VAL MG2 1 74 ALA HA . . 4.430 2.720 2.507 2.892 . 0 0 "[ . 1 . 2]" 1
380 1 26 VAL MG2 1 75 PRO HA . . 3.930 2.684 2.407 2.863 . 0 0 "[ . 1 . 2]" 1
381 1 26 VAL MG2 1 75 PRO HB2 . . 4.490 3.808 3.577 4.133 . 0 0 "[ . 1 . 2]" 1
382 1 26 VAL MG2 1 75 PRO HB3 . . 3.930 2.457 2.237 2.825 . 0 0 "[ . 1 . 2]" 1
383 1 26 VAL MG2 1 75 PRO QD . . 3.610 1.949 1.782 2.165 . 0 0 "[ . 1 . 2]" 1
384 1 26 VAL MG2 1 75 PRO QG . . 5.280 2.984 2.741 3.317 . 0 0 "[ . 1 . 2]" 1
385 1 26 VAL MG2 1 98 ILE MG . . 3.260 2.212 1.931 2.360 . 0 0 "[ . 1 . 2]" 1
386 1 26 VAL MG2 1 100 GLY H . . 4.810 3.729 3.399 4.010 . 0 0 "[ . 1 . 2]" 1
387 1 26 VAL MG2 1 100 GLY HA2 . . 3.960 2.759 2.191 3.652 . 0 0 "[ . 1 . 2]" 1
388 1 26 VAL MG2 1 100 GLY QA . . 3.420 1.954 1.864 2.295 . 0 0 "[ . 1 . 2]" 1
389 1 26 VAL MG2 1 100 GLY HA3 . . 3.960 2.026 1.896 2.319 . 0 0 "[ . 1 . 2]" 1
390 1 26 VAL MG2 1 101 ASP H . . 4.130 3.778 3.052 4.143 0.013 20 0 "[ . 1 . 2]" 1
391 1 27 ASN H 1 27 ASN HA . . 2.830 2.275 2.273 2.279 . 0 0 "[ . 1 . 2]" 1
392 1 27 ASN H 1 27 ASN QB . . 3.530 3.222 3.170 3.477 . 0 0 "[ . 1 . 2]" 1
393 1 27 ASN H 1 27 ASN HD21 . . 5.100 3.816 3.560 5.078 . 0 0 "[ . 1 . 2]" 1
394 1 27 ASN H 1 27 ASN HD22 . . 5.110 4.557 4.306 5.106 . 0 0 "[ . 1 . 2]" 1
395 1 27 ASN H 1 28 LYS H . . 3.160 2.626 2.525 2.698 . 0 0 "[ . 1 . 2]" 1
396 1 27 ASN H 1 28 LYS QG . . 4.960 4.382 4.185 4.576 . 0 0 "[ . 1 . 2]" 1
397 1 27 ASN H 1 71 LEU MD1 . . 3.930 3.451 2.942 3.850 . 0 0 "[ . 1 . 2]" 1
398 1 27 ASN H 1 71 LEU HG . . 5.480 4.045 3.708 4.226 . 0 0 "[ . 1 . 2]" 1
399 1 27 ASN H 1 72 PRO QD . . 4.170 3.842 3.472 4.014 . 0 0 "[ . 1 . 2]" 1
400 1 27 ASN H 1 72 PRO HG2 . . 3.980 2.923 2.233 3.091 . 0 0 "[ . 1 . 2]" 1
401 1 27 ASN H 1 72 PRO HG3 . . 4.860 4.693 4.001 4.862 0.002 5 0 "[ . 1 . 2]" 1
402 1 27 ASN H 1 73 THR HA . . 3.700 3.627 3.445 3.702 0.002 14 0 "[ . 1 . 2]" 1
403 1 27 ASN H 1 98 ILE MG . . 4.570 4.443 4.150 4.572 0.002 8 0 "[ . 1 . 2]" 1
404 1 27 ASN HA 1 27 ASN HD21 . . 4.540 3.779 3.028 4.430 . 0 0 "[ . 1 . 2]" 1
405 1 27 ASN HA 1 27 ASN HD22 . . 4.830 4.200 4.120 4.618 . 0 0 "[ . 1 . 2]" 1
406 1 27 ASN HA 1 28 LYS H . . 3.360 2.888 2.764 2.985 . 0 0 "[ . 1 . 2]" 1
407 1 27 ASN HA 1 28 LYS QG . . 4.850 4.384 4.187 4.878 0.028 10 0 "[ . 1 . 2]" 1
408 1 27 ASN HA 1 71 LEU MD1 . . 3.300 2.115 2.003 2.279 . 0 0 "[ . 1 . 2]" 1
409 1 27 ASN HA 1 71 LEU MD2 . . 3.930 3.578 3.307 3.754 . 0 0 "[ . 1 . 2]" 1
410 1 27 ASN HA 1 71 LEU HG . . 4.480 3.264 2.682 3.577 . 0 0 "[ . 1 . 2]" 1
411 1 27 ASN HA 1 73 THR HA . . 4.760 4.512 4.057 4.711 . 0 0 "[ . 1 . 2]" 1
412 1 27 ASN QB 1 27 ASN HD21 . . 2.900 2.142 2.094 2.239 . 0 0 "[ . 1 . 2]" 1
413 1 27 ASN QB 1 27 ASN HD22 . . 3.370 3.258 3.214 3.290 . 0 0 "[ . 1 . 2]" 1
414 1 27 ASN QB 1 71 LEU MD1 . . 4.100 3.533 3.154 3.703 . 0 0 "[ . 1 . 2]" 1
415 1 27 ASN HB2 1 27 ASN HD21 . . 3.430 2.295 2.119 3.463 0.033 19 0 "[ . 1 . 2]" 1
416 1 27 ASN HB2 1 28 LYS H . . 4.560 4.201 4.028 4.295 . 0 0 "[ . 1 . 2]" 1
417 1 27 ASN HB3 1 27 ASN HD21 . . 3.430 3.224 2.222 3.407 . 0 0 "[ . 1 . 2]" 1
418 1 27 ASN HB3 1 28 LYS H . . 4.560 4.357 4.285 4.593 0.033 12 0 "[ . 1 . 2]" 1
419 1 27 ASN HD21 1 73 THR MG . . 5.470 5.191 4.583 5.472 0.002 10 0 "[ . 1 . 2]" 1
420 1 27 ASN HD22 1 73 THR MG . . 4.730 4.442 4.102 4.681 . 0 0 "[ . 1 . 2]" 1
421 1 28 LYS H 1 28 LYS QB . . 2.930 2.746 2.659 3.008 0.078 10 0 "[ . 1 . 2]" 1
422 1 28 LYS H 1 28 LYS QE . . 5.180 4.920 4.106 5.220 0.040 8 0 "[ . 1 . 2]" 1
423 1 28 LYS H 1 28 LYS HG2 . . 4.310 3.152 2.819 3.748 . 0 0 "[ . 1 . 2]" 1
424 1 28 LYS H 1 28 LYS QG . . 3.440 2.983 2.354 3.152 . 0 0 "[ . 1 . 2]" 1
425 1 28 LYS H 1 28 LYS HG3 . . 4.310 4.060 2.379 4.311 0.001 6 0 "[ . 1 . 2]" 1
426 1 28 LYS H 1 29 PRO HA . . 5.010 4.820 4.726 4.927 . 0 0 "[ . 1 . 2]" 1
427 1 28 LYS H 1 29 PRO HD2 . . 5.000 4.719 4.663 4.782 . 0 0 "[ . 1 . 2]" 1
428 1 28 LYS H 1 29 PRO HD3 . . 4.650 4.440 4.307 4.614 . 0 0 "[ . 1 . 2]" 1
429 1 28 LYS H 1 71 LEU HA . . 4.520 3.841 3.484 4.011 . 0 0 "[ . 1 . 2]" 1
430 1 28 LYS H 1 71 LEU MD1 . . 3.570 2.468 2.171 2.750 . 0 0 "[ . 1 . 2]" 1
431 1 28 LYS H 1 71 LEU MD2 . . 4.950 4.942 4.881 4.964 0.014 10 0 "[ . 1 . 2]" 1
432 1 28 LYS H 1 72 PRO HD2 . . 4.430 2.650 2.123 2.747 . 0 0 "[ . 1 . 2]" 1
433 1 28 LYS H 1 72 PRO QD . . 3.690 2.628 2.112 2.722 . 0 0 "[ . 1 . 2]" 1
434 1 28 LYS H 1 72 PRO HD3 . . 4.430 4.355 3.795 4.437 0.007 20 0 "[ . 1 . 2]" 1
435 1 28 LYS H 1 72 PRO HG2 . . 4.320 2.961 2.535 3.061 . 0 0 "[ . 1 . 2]" 1
436 1 28 LYS H 1 72 PRO HG3 . . 4.490 4.215 3.680 4.332 . 0 0 "[ . 1 . 2]" 1
437 1 28 LYS HA 1 28 LYS QD . . 4.320 2.530 2.000 3.664 . 0 0 "[ . 1 . 2]" 1
438 1 28 LYS HA 1 28 LYS QE . . 4.830 3.349 1.963 4.701 . 0 0 "[ . 1 . 2]" 1
439 1 28 LYS HA 1 29 PRO HD2 . . 3.560 2.022 1.988 2.114 . 0 0 "[ . 1 . 2]" 1
440 1 28 LYS HA 1 29 PRO HD3 . . 3.440 2.295 2.259 2.317 . 0 0 "[ . 1 . 2]" 1
441 1 28 LYS HA 1 29 PRO HG2 . . 4.800 4.211 4.183 4.284 . 0 0 "[ . 1 . 2]" 1
442 1 28 LYS HA 1 29 PRO HG3 . . 4.780 4.320 4.316 4.338 . 0 0 "[ . 1 . 2]" 1
443 1 28 LYS HA 1 71 LEU MD1 . . 4.600 2.897 2.792 3.098 . 0 0 "[ . 1 . 2]" 1
444 1 28 LYS QB 1 29 PRO HD2 . . 3.560 2.908 2.586 3.025 . 0 0 "[ . 1 . 2]" 1
445 1 28 LYS QB 1 29 PRO HD3 . . 4.260 4.020 3.774 4.095 . 0 0 "[ . 1 . 2]" 1
446 1 28 LYS QB 1 71 LEU MD1 . . 4.440 4.016 3.897 4.192 . 0 0 "[ . 1 . 2]" 1
447 1 28 LYS HB2 1 29 PRO HD2 . . 4.340 4.175 2.628 4.332 . 0 0 "[ . 1 . 2]" 1
448 1 28 LYS HB2 1 29 PRO HD3 . . 5.060 4.975 3.973 5.062 0.002 19 0 "[ . 1 . 2]" 1
449 1 28 LYS HB3 1 29 PRO HD2 . . 4.340 3.023 2.698 3.841 . 0 0 "[ . 1 . 2]" 1
450 1 28 LYS HB3 1 29 PRO HD3 . . 5.060 4.270 4.032 4.707 . 0 0 "[ . 1 . 2]" 1
451 1 28 LYS QD 1 29 PRO HD2 . . 4.090 3.149 2.806 3.913 . 0 0 "[ . 1 . 2]" 1
452 1 28 LYS QD 1 29 PRO HD3 . . 5.170 4.144 3.581 5.166 . 0 0 "[ . 1 . 2]" 1
453 1 28 LYS QE 1 28 LYS HG2 . . 3.840 2.733 2.140 3.431 . 0 0 "[ . 1 . 2]" 1
454 1 28 LYS QE 1 28 LYS HG3 . . 3.840 2.678 2.175 3.488 . 0 0 "[ . 1 . 2]" 1
455 1 28 LYS QG 1 29 PRO HD2 . . 4.420 4.261 3.694 4.414 . 0 0 "[ . 1 . 2]" 1
456 1 28 LYS QG 1 29 PRO HD3 . . 5.030 4.852 4.342 5.084 0.054 10 0 "[ . 1 . 2]" 1
457 1 28 LYS HG2 1 29 PRO HD2 . . 5.240 4.607 3.807 5.148 . 0 0 "[ . 1 . 2]" 1
458 1 28 LYS HG3 1 29 PRO HD2 . . 5.240 5.063 4.802 5.220 . 0 0 "[ . 1 . 2]" 1
459 1 29 PRO HA 1 30 ALA H . . 2.650 2.232 2.190 2.283 . 0 0 "[ . 1 . 2]" 1
460 1 29 PRO HA 1 70 TYR H . . 4.000 3.844 3.683 3.965 . 0 0 "[ . 1 . 2]" 1
461 1 29 PRO HA 1 71 LEU H . . 4.720 4.084 3.864 4.561 . 0 0 "[ . 1 . 2]" 1
462 1 29 PRO HA 1 71 LEU HA . . 4.030 2.534 2.251 3.055 . 0 0 "[ . 1 . 2]" 1
463 1 29 PRO HA 1 71 LEU HB2 . . 4.700 2.937 2.776 3.289 . 0 0 "[ . 1 . 2]" 1
464 1 29 PRO HA 1 71 LEU MD1 . . 3.620 3.086 2.869 3.266 . 0 0 "[ . 1 . 2]" 1
465 1 29 PRO HA 1 72 PRO QD . . 4.540 3.400 3.167 3.807 . 0 0 "[ . 1 . 2]" 1
466 1 29 PRO HB2 1 30 ALA H . . 4.160 4.029 3.927 4.121 . 0 0 "[ . 1 . 2]" 1
467 1 29 PRO HB2 1 31 THR MG . . 3.810 2.918 2.733 3.092 . 0 0 "[ . 1 . 2]" 1
468 1 29 PRO HB2 1 69 SER HB2 . . 4.490 3.569 3.325 3.954 . 0 0 "[ . 1 . 2]" 1
469 1 29 PRO HB2 1 69 SER HB3 . . 4.200 2.484 2.226 2.961 . 0 0 "[ . 1 . 2]" 1
470 1 29 PRO HB2 1 70 TYR H . . 4.880 4.622 4.406 4.890 0.010 10 0 "[ . 1 . 2]" 1
471 1 29 PRO HB3 1 30 ALA H . . 4.550 4.361 4.281 4.434 . 0 0 "[ . 1 . 2]" 1
472 1 29 PRO HB3 1 31 THR MG . . 4.670 4.419 4.216 4.615 . 0 0 "[ . 1 . 2]" 1
473 1 29 PRO HB3 1 69 SER HB2 . . 4.350 4.221 4.008 4.355 0.005 10 0 "[ . 1 . 2]" 1
474 1 29 PRO HB3 1 69 SER HB3 . . 4.210 3.676 3.466 4.083 . 0 0 "[ . 1 . 2]" 1
475 1 29 PRO HB3 1 70 TYR H . . 5.270 5.145 4.944 5.273 0.003 15 0 "[ . 1 . 2]" 1
476 1 29 PRO HD2 1 71 LEU MD1 . . 4.620 3.651 3.457 3.921 . 0 0 "[ . 1 . 2]" 1
477 1 29 PRO HD3 1 71 LEU MD1 . . 4.120 2.393 2.085 2.737 . 0 0 "[ . 1 . 2]" 1
478 1 30 ALA H 1 30 ALA MB . . 3.030 2.084 2.030 2.236 . 0 0 "[ . 1 . 2]" 1
479 1 30 ALA H 1 31 THR H . . 4.390 4.312 4.235 4.383 . 0 0 "[ . 1 . 2]" 1
480 1 30 ALA H 1 31 THR MG . . 4.780 4.565 4.437 4.673 . 0 0 "[ . 1 . 2]" 1
481 1 30 ALA H 1 69 SER HA . . 4.710 4.542 4.400 4.679 . 0 0 "[ . 1 . 2]" 1
482 1 30 ALA H 1 70 TYR QD . . 5.310 3.857 3.739 3.981 . 0 0 "[ . 1 . 2]" 1
483 1 30 ALA H 1 71 LEU HA . . 3.860 3.357 3.242 3.566 . 0 0 "[ . 1 . 2]" 1
484 1 30 ALA H 1 71 LEU HB2 . . 4.900 4.821 4.673 4.915 0.015 10 0 "[ . 1 . 2]" 1
485 1 30 ALA H 1 72 PRO QD . . 3.800 3.055 2.968 3.325 . 0 0 "[ . 1 . 2]" 1
486 1 30 ALA HA 1 31 THR H . . 2.710 2.176 2.153 2.207 . 0 0 "[ . 1 . 2]" 1
487 1 30 ALA HA 1 70 TYR H . . 4.760 4.575 4.471 4.645 . 0 0 "[ . 1 . 2]" 1
488 1 30 ALA MB 1 31 THR H . . 3.500 3.461 3.398 3.520 0.020 9 0 "[ . 1 . 2]" 1
489 1 30 ALA MB 1 70 TYR H . . 3.520 3.075 2.776 3.203 . 0 0 "[ . 1 . 2]" 1
490 1 30 ALA MB 1 70 TYR QD . . 4.690 2.866 2.668 3.099 . 0 0 "[ . 1 . 2]" 1
491 1 30 ALA MB 1 70 TYR QE . . 4.030 2.287 2.115 2.515 . 0 0 "[ . 1 . 2]" 1
492 1 30 ALA MB 1 70 TYR HH . . 4.030 3.165 2.654 3.487 . 0 0 "[ . 1 . 2]" 1
493 1 30 ALA MB 1 72 PRO HD2 . . 4.360 4.180 4.012 4.266 . 0 0 "[ . 1 . 2]" 1
494 1 30 ALA MB 1 72 PRO HD3 . . 4.360 3.336 3.205 3.453 . 0 0 "[ . 1 . 2]" 1
495 1 31 THR H 1 31 THR HB . . 3.720 3.681 3.665 3.692 . 0 0 "[ . 1 . 2]" 1
496 1 31 THR H 1 31 THR MG . . 3.560 2.448 2.374 2.559 . 0 0 "[ . 1 . 2]" 1
497 1 31 THR H 1 32 PHE H . . 4.610 4.548 4.496 4.576 . 0 0 "[ . 1 . 2]" 1
498 1 31 THR H 1 69 SER HA . . 4.910 4.525 4.402 4.596 . 0 0 "[ . 1 . 2]" 1
499 1 31 THR HA 1 31 THR MG . . 3.400 2.389 2.307 2.460 . 0 0 "[ . 1 . 2]" 1
500 1 31 THR HA 1 32 PHE H . . 2.680 2.197 2.154 2.230 . 0 0 "[ . 1 . 2]" 1
501 1 31 THR HA 1 32 PHE QD . . 4.970 3.164 2.838 3.598 . 0 0 "[ . 1 . 2]" 1
502 1 31 THR HA 1 68 VAL H . . 5.040 4.702 4.501 4.936 . 0 0 "[ . 1 . 2]" 1
503 1 31 THR HA 1 69 SER H . . 5.110 4.809 4.618 4.887 . 0 0 "[ . 1 . 2]" 1
504 1 31 THR HA 1 69 SER HA . . 3.490 2.519 2.321 2.598 . 0 0 "[ . 1 . 2]" 1
505 1 31 THR HA 1 69 SER HB2 . . 4.780 4.478 4.166 4.633 . 0 0 "[ . 1 . 2]" 1
506 1 31 THR HA 1 69 SER HB3 . . 4.770 3.302 2.850 3.458 . 0 0 "[ . 1 . 2]" 1
507 1 31 THR HA 1 70 TYR H . . 4.390 4.128 3.945 4.236 . 0 0 "[ . 1 . 2]" 1
508 1 31 THR HB 1 32 PHE H . . 3.380 3.024 2.884 3.260 . 0 0 "[ . 1 . 2]" 1
509 1 31 THR MG 1 32 PHE H . . 4.110 4.026 3.948 4.108 . 0 0 "[ . 1 . 2]" 1
510 1 31 THR MG 1 69 SER HA . . 3.870 3.435 3.186 3.632 . 0 0 "[ . 1 . 2]" 1
511 1 31 THR MG 1 69 SER HB2 . . 3.930 3.600 3.275 3.814 . 0 0 "[ . 1 . 2]" 1
512 1 31 THR MG 1 69 SER HB3 . . 3.990 2.346 2.001 2.667 . 0 0 "[ . 1 . 2]" 1
513 1 31 THR MG 1 70 TYR H . . 4.570 4.455 4.235 4.568 . 0 0 "[ . 1 . 2]" 1
514 1 32 PHE H 1 32 PHE QD . . 3.880 2.733 2.490 3.034 . 0 0 "[ . 1 . 2]" 1
515 1 32 PHE H 1 32 PHE QE . . 4.990 4.208 4.055 4.375 . 0 0 "[ . 1 . 2]" 1
516 1 32 PHE H 1 33 THR H . . 4.520 4.396 4.382 4.415 . 0 0 "[ . 1 . 2]" 1
517 1 32 PHE H 1 67 THR HA . . 4.670 4.548 4.426 4.650 . 0 0 "[ . 1 . 2]" 1
518 1 32 PHE H 1 68 VAL HB . . 4.320 4.262 4.172 4.322 0.002 10 0 "[ . 1 . 2]" 1
519 1 32 PHE H 1 68 VAL MG1 . . 5.010 4.949 4.801 5.012 0.002 8 0 "[ . 1 . 2]" 1
520 1 32 PHE H 1 69 SER HA . . 3.910 3.834 3.665 3.913 0.003 20 0 "[ . 1 . 2]" 1
521 1 32 PHE H 1 69 SER HB3 . . 5.330 5.248 4.886 5.334 0.004 19 0 "[ . 1 . 2]" 1
522 1 32 PHE HA 1 33 THR H . . 3.070 2.432 2.379 2.495 . 0 0 "[ . 1 . 2]" 1
523 1 32 PHE HB2 1 33 THR H . . 3.180 2.377 2.235 2.504 . 0 0 "[ . 1 . 2]" 1
524 1 32 PHE HB3 1 33 THR H . . 3.930 3.735 3.626 3.834 . 0 0 "[ . 1 . 2]" 1
525 1 32 PHE QD 1 33 THR H . . 3.760 3.342 3.290 3.388 . 0 0 "[ . 1 . 2]" 1
526 1 32 PHE QD 1 33 THR HA . . 5.500 4.135 3.846 4.433 . 0 0 "[ . 1 . 2]" 1
527 1 32 PHE QD 1 34 ILE H . . 5.390 4.552 4.319 4.877 . 0 0 "[ . 1 . 2]" 1
528 1 32 PHE QD 1 34 ILE MD . . 4.130 3.566 3.380 3.786 . 0 0 "[ . 1 . 2]" 1
529 1 32 PHE QD 1 34 ILE HG12 . . 4.140 2.771 2.535 3.012 . 0 0 "[ . 1 . 2]" 1
530 1 32 PHE QD 1 34 ILE HG13 . . 4.530 2.874 2.671 3.260 . 0 0 "[ . 1 . 2]" 1
531 1 32 PHE QD 1 68 VAL H . . 5.210 4.399 4.229 4.503 . 0 0 "[ . 1 . 2]" 1
532 1 32 PHE QD 1 68 VAL HB . . 4.830 3.854 3.765 3.918 . 0 0 "[ . 1 . 2]" 1
533 1 32 PHE QE 1 33 THR H . . 5.500 5.495 5.461 5.504 0.004 2 0 "[ . 1 . 2]" 1
534 1 32 PHE QE 1 34 ILE MD . . 3.550 1.986 1.925 2.301 . 0 0 "[ . 1 . 2]" 1
535 1 32 PHE QE 1 34 ILE HG12 . . 4.260 2.134 1.996 2.479 . 0 0 "[ . 1 . 2]" 1
536 1 32 PHE QE 1 34 ILE HG13 . . 4.140 2.726 2.374 3.091 . 0 0 "[ . 1 . 2]" 1
537 1 32 PHE QE 1 34 ILE MG . . 4.350 3.765 3.423 4.109 . 0 0 "[ . 1 . 2]" 1
538 1 32 PHE QE 1 46 LEU MD2 . . 4.440 3.392 3.016 3.621 . 0 0 "[ . 1 . 2]" 1
539 1 32 PHE QE 1 68 VAL H . . 5.460 4.436 4.256 4.536 . 0 0 "[ . 1 . 2]" 1
540 1 32 PHE QE 1 68 VAL HB . . 4.710 2.810 2.646 2.889 . 0 0 "[ . 1 . 2]" 1
541 1 32 PHE QE 1 68 VAL MG1 . . 3.780 2.583 2.220 3.043 . 0 0 "[ . 1 . 2]" 1
542 1 32 PHE QE 1 70 TYR QD . . 4.470 2.603 2.323 2.822 . 0 0 "[ . 1 . 2]" 1
543 1 32 PHE QE 1 70 TYR QE . . 4.720 4.258 3.971 4.492 . 0 0 "[ . 1 . 2]" 1
544 1 32 PHE QE 1 80 ILE MD . . 4.400 3.839 3.277 4.173 . 0 0 "[ . 1 . 2]" 1
545 1 32 PHE QE 1 80 ILE MG . . 3.720 3.593 3.430 3.711 . 0 0 "[ . 1 . 2]" 1
546 1 32 PHE QE 1 82 VAL MG2 . . 4.000 3.791 3.561 3.988 . 0 0 "[ . 1 . 2]" 1
547 1 32 PHE HZ 1 46 LEU MD1 . . 4.510 4.254 3.724 4.509 . 0 0 "[ . 1 . 2]" 1
548 1 32 PHE HZ 1 46 LEU MD2 . . 4.250 2.826 2.550 3.096 . 0 0 "[ . 1 . 2]" 1
549 1 32 PHE HZ 1 68 VAL MG1 . . 3.800 2.443 2.219 2.735 . 0 0 "[ . 1 . 2]" 1
550 1 32 PHE HZ 1 68 VAL MG2 . . 4.410 3.244 3.065 3.383 . 0 0 "[ . 1 . 2]" 1
551 1 32 PHE HZ 1 80 ILE MG . . 3.610 3.256 3.016 3.425 . 0 0 "[ . 1 . 2]" 1
552 1 32 PHE HZ 1 82 VAL MG2 . . 4.710 4.237 3.937 4.495 . 0 0 "[ . 1 . 2]" 1
553 1 33 THR H 1 33 THR HB . . 3.040 2.413 2.381 2.449 . 0 0 "[ . 1 . 2]" 1
554 1 33 THR H 1 33 THR MG . . 3.640 3.676 3.669 3.681 0.041 9 0 "[ . 1 . 2]" 1
555 1 33 THR HA 1 33 THR MG . . 3.630 2.583 2.577 2.592 . 0 0 "[ . 1 . 2]" 1
556 1 33 THR HA 1 34 ILE H . . 2.740 2.215 2.177 2.261 . 0 0 "[ . 1 . 2]" 1
557 1 33 THR HA 1 66 CYS H . . 4.650 4.373 4.147 4.656 0.006 16 0 "[ . 1 . 2]" 1
558 1 33 THR HA 1 68 VAL H . . 4.130 4.004 3.765 4.132 0.002 9 0 "[ . 1 . 2]" 1
559 1 33 THR HB 1 34 ILE H . . 4.340 4.156 4.055 4.253 . 0 0 "[ . 1 . 2]" 1
560 1 33 THR MG 1 34 ILE H . . 3.080 2.320 2.147 2.502 . 0 0 "[ . 1 . 2]" 1
561 1 33 THR MG 1 65 THR HB . . 3.310 2.551 1.965 3.016 . 0 0 "[ . 1 . 2]" 1
562 1 33 THR MG 1 66 CYS H . . 3.720 3.440 3.178 3.678 . 0 0 "[ . 1 . 2]" 1
563 1 34 ILE H 1 34 ILE HB . . 3.240 2.729 2.617 2.855 . 0 0 "[ . 1 . 2]" 1
564 1 34 ILE H 1 34 ILE MD . . 4.130 3.934 3.723 4.112 . 0 0 "[ . 1 . 2]" 1
565 1 34 ILE H 1 34 ILE HG13 . . 3.640 2.667 2.446 2.943 . 0 0 "[ . 1 . 2]" 1
566 1 34 ILE H 1 34 ILE MG . . 4.100 3.884 3.838 3.933 . 0 0 "[ . 1 . 2]" 1
567 1 34 ILE H 1 35 VAL H . . 4.410 4.199 4.025 4.333 . 0 0 "[ . 1 . 2]" 1
568 1 34 ILE H 1 65 THR HA . . 5.450 4.701 4.334 4.983 . 0 0 "[ . 1 . 2]" 1
569 1 34 ILE H 1 65 THR HB . . 4.450 3.399 3.038 3.806 . 0 0 "[ . 1 . 2]" 1
570 1 34 ILE H 1 65 THR MG . . 5.500 4.468 4.240 4.746 . 0 0 "[ . 1 . 2]" 1
571 1 34 ILE H 1 66 CYS H . . 3.350 2.749 2.467 2.998 . 0 0 "[ . 1 . 2]" 1
572 1 34 ILE H 1 66 CYS HB2 . . 5.070 4.164 3.785 5.044 . 0 0 "[ . 1 . 2]" 1
573 1 34 ILE H 1 66 CYS QB . . 4.240 3.801 3.632 4.007 . 0 0 "[ . 1 . 2]" 1
574 1 34 ILE H 1 66 CYS HB3 . . 5.070 4.623 3.950 4.967 . 0 0 "[ . 1 . 2]" 1
575 1 34 ILE H 1 67 THR HA . . 4.590 4.109 3.811 4.343 . 0 0 "[ . 1 . 2]" 1
576 1 34 ILE H 1 68 VAL H . . 5.050 4.850 4.710 5.004 . 0 0 "[ . 1 . 2]" 1
577 1 34 ILE H 1 68 VAL MG2 . . 4.670 4.654 4.545 4.675 0.005 4 0 "[ . 1 . 2]" 1
578 1 34 ILE HA 1 35 VAL H . . 3.100 2.144 2.140 2.160 . 0 0 "[ . 1 . 2]" 1
579 1 34 ILE HA 1 35 VAL QG . . 4.760 3.700 3.544 3.985 . 0 0 "[ . 1 . 2]" 1
580 1 34 ILE HB 1 34 ILE MD . . 3.250 2.318 2.227 2.431 . 0 0 "[ . 1 . 2]" 1
581 1 34 ILE HB 1 35 VAL H . . 4.500 4.265 4.130 4.383 . 0 0 "[ . 1 . 2]" 1
582 1 34 ILE HB 1 36 THR MG . . 3.890 2.977 2.482 3.327 . 0 0 "[ . 1 . 2]" 1
583 1 34 ILE HB 1 66 CYS H . . 4.060 3.225 2.835 3.657 . 0 0 "[ . 1 . 2]" 1
584 1 34 ILE HB 1 66 CYS HB2 . . 3.960 2.545 1.998 3.606 . 0 0 "[ . 1 . 2]" 1
585 1 34 ILE HB 1 66 CYS HB3 . . 3.960 3.256 2.576 3.722 . 0 0 "[ . 1 . 2]" 1
586 1 34 ILE MD 1 66 CYS HB2 . . 4.230 3.300 2.497 4.077 . 0 0 "[ . 1 . 2]" 1
587 1 34 ILE MD 1 66 CYS HB3 . . 4.230 2.985 2.505 3.411 . 0 0 "[ . 1 . 2]" 1
588 1 34 ILE MD 1 68 VAL HB . . 4.450 2.651 2.227 3.150 . 0 0 "[ . 1 . 2]" 1
589 1 34 ILE MD 1 68 VAL MG2 . . 2.960 1.816 1.700 1.960 . 0 0 "[ . 1 . 2]" 1
590 1 34 ILE HG12 1 34 ILE MG . . 2.760 2.267 2.178 2.388 . 0 0 "[ . 1 . 2]" 1
591 1 34 ILE HG13 1 34 ILE MG . . 3.450 3.188 3.170 3.202 . 0 0 "[ . 1 . 2]" 1
592 1 34 ILE HG13 1 68 VAL MG2 . . 3.900 3.172 2.864 3.380 . 0 0 "[ . 1 . 2]" 1
593 1 34 ILE MG 1 35 VAL H . . 3.390 2.795 2.560 2.953 . 0 0 "[ . 1 . 2]" 1
594 1 35 VAL H 1 35 VAL HB . . 3.260 2.520 2.365 2.656 . 0 0 "[ . 1 . 2]" 1
595 1 35 VAL H 1 35 VAL QG . . 3.210 2.209 2.088 2.508 . 0 0 "[ . 1 . 2]" 1
596 1 35 VAL H 1 36 THR H . . 4.770 4.290 4.174 4.466 . 0 0 "[ . 1 . 2]" 1
597 1 35 VAL HA 1 35 VAL QG . . 3.280 2.097 2.017 2.143 . 0 0 "[ . 1 . 2]" 1
598 1 35 VAL HA 1 36 THR H . . 2.890 2.187 2.140 2.238 . 0 0 "[ . 1 . 2]" 1
599 1 35 VAL HA 1 36 THR HA . . 4.930 4.390 4.379 4.402 . 0 0 "[ . 1 . 2]" 1
600 1 35 VAL HA 1 37 LYS H . . 3.690 3.422 3.304 3.577 . 0 0 "[ . 1 . 2]" 1
601 1 35 VAL HA 1 65 THR HA . . 3.840 3.555 3.268 3.835 . 0 0 "[ . 1 . 2]" 1
602 1 35 VAL HA 1 66 CYS H . . 4.820 4.675 4.344 4.820 . 0 0 "[ . 1 . 2]" 1
603 1 35 VAL HB 1 36 THR H . . 4.760 4.419 4.290 4.494 . 0 0 "[ . 1 . 2]" 1
604 1 35 VAL HB 1 36 THR HA . . 5.000 4.821 4.683 4.989 . 0 0 "[ . 1 . 2]" 1
605 1 35 VAL HB 1 37 LYS H . . 5.390 4.948 4.819 5.384 . 0 0 "[ . 1 . 2]" 1
606 1 35 VAL QG 1 36 THR H . . 3.400 3.021 2.808 3.178 . 0 0 "[ . 1 . 2]" 1
607 1 35 VAL QG 1 36 THR HA . . 4.390 3.637 3.455 3.780 . 0 0 "[ . 1 . 2]" 1
608 1 35 VAL QG 1 37 LYS H . . 3.180 2.552 2.315 3.042 . 0 0 "[ . 1 . 2]" 1
609 1 35 VAL QG 1 37 LYS HA . . 4.890 4.809 4.682 4.893 0.003 2 0 "[ . 1 . 2]" 1
610 1 35 VAL QG 1 37 LYS QG . . 4.550 3.542 2.137 4.557 0.007 19 0 "[ . 1 . 2]" 1
611 1 35 VAL QG 1 38 ASP H . . 4.320 3.357 2.420 3.822 . 0 0 "[ . 1 . 2]" 1
612 1 35 VAL QG 1 65 THR HA . . 4.910 4.448 4.190 4.648 . 0 0 "[ . 1 . 2]" 1
613 1 36 THR H 1 36 THR MG . . 3.510 3.026 2.810 3.278 . 0 0 "[ . 1 . 2]" 1
614 1 36 THR H 1 37 LYS H . . 2.920 2.272 1.843 2.528 . 0 0 "[ . 1 . 2]" 1
615 1 36 THR H 1 37 LYS HA . . 4.510 4.317 4.210 4.513 0.003 16 0 "[ . 1 . 2]" 1
616 1 36 THR H 1 37 LYS QB . . 4.470 3.872 3.616 4.068 . 0 0 "[ . 1 . 2]" 1
617 1 36 THR H 1 64 GLY QA . . 5.340 4.725 4.415 5.031 . 0 0 "[ . 1 . 2]" 1
618 1 36 THR H 1 65 THR HA . . 3.490 2.441 2.202 2.844 . 0 0 "[ . 1 . 2]" 1
619 1 36 THR H 1 66 CYS H . . 4.370 4.215 3.957 4.364 . 0 0 "[ . 1 . 2]" 1
620 1 36 THR HA 1 36 THR MG . . 2.980 2.306 2.166 2.421 . 0 0 "[ . 1 . 2]" 1
621 1 36 THR HA 1 37 LYS H . . 3.540 3.045 2.875 3.464 . 0 0 "[ . 1 . 2]" 1
622 1 36 THR HA 1 37 LYS HA . . 5.410 4.757 4.644 4.875 . 0 0 "[ . 1 . 2]" 1
623 1 36 THR HA 1 38 ASP H . . 4.350 4.047 3.494 4.356 0.006 10 0 "[ . 1 . 2]" 1
624 1 36 THR HA 1 39 ALA H . . 3.720 3.327 2.972 3.599 . 0 0 "[ . 1 . 2]" 1
625 1 36 THR HA 1 39 ALA MB . . 3.570 2.471 2.201 2.850 . 0 0 "[ . 1 . 2]" 1
626 1 36 THR HA 1 40 GLY H . . 4.540 4.108 3.347 4.534 . 0 0 "[ . 1 . 2]" 1
627 1 36 THR MG 1 66 CYS HB2 . . 4.340 2.828 2.447 3.607 . 0 0 "[ . 1 . 2]" 1
628 1 36 THR MG 1 66 CYS HB3 . . 4.340 4.020 3.365 4.324 . 0 0 "[ . 1 . 2]" 1
629 1 36 THR MG 1 84 PHE QE . . 4.650 4.372 2.631 4.653 0.003 12 0 "[ . 1 . 2]" 1
630 1 37 LYS H 1 37 LYS HB2 . . 3.600 3.095 2.199 3.600 . 0 0 "[ . 1 . 2]" 1
631 1 37 LYS H 1 37 LYS QB . . 3.010 2.322 2.136 2.588 . 0 0 "[ . 1 . 2]" 1
632 1 37 LYS H 1 37 LYS HB3 . . 3.600 2.463 2.242 2.901 . 0 0 "[ . 1 . 2]" 1
633 1 37 LYS H 1 37 LYS QD . . 4.530 4.186 3.207 4.506 . 0 0 "[ . 1 . 2]" 1
634 1 37 LYS H 1 37 LYS QG . . 3.970 3.116 1.934 3.965 . 0 0 "[ . 1 . 2]" 1
635 1 37 LYS H 1 38 ASP H . . 3.820 2.715 2.500 3.014 . 0 0 "[ . 1 . 2]" 1
636 1 37 LYS H 1 39 ALA H . . 4.350 4.145 3.813 4.350 0.000 10 0 "[ . 1 . 2]" 1
637 1 37 LYS H 1 64 GLY QA . . 4.450 4.148 3.844 4.452 0.002 2 0 "[ . 1 . 2]" 1
638 1 37 LYS H 1 65 THR HA . . 4.340 4.022 3.359 4.303 . 0 0 "[ . 1 . 2]" 1
639 1 37 LYS HA 1 37 LYS QD . . 4.440 3.716 2.297 4.440 . 0 0 "[ . 1 . 2]" 1
640 1 37 LYS HA 1 37 LYS QG . . 3.840 2.954 2.188 3.436 . 0 0 "[ . 1 . 2]" 1
641 1 37 LYS HA 1 64 GLY QA . . 4.190 2.555 2.096 3.719 . 0 0 "[ . 1 . 2]" 1
642 1 37 LYS QB 1 64 GLY QA . . 3.460 2.509 1.946 3.090 . 0 0 "[ . 1 . 2]" 1
643 1 37 LYS HB2 1 37 LYS QD . . 3.660 2.459 2.063 3.237 . 0 0 "[ . 1 . 2]" 1
644 1 37 LYS HB2 1 38 ASP H . . 3.950 3.736 3.320 3.912 . 0 0 "[ . 1 . 2]" 1
645 1 37 LYS HB2 1 64 GLY HA2 . . 4.540 3.423 2.041 4.384 . 0 0 "[ . 1 . 2]" 1
646 1 37 LYS HB2 1 64 GLY HA3 . . 4.540 2.945 2.075 3.750 . 0 0 "[ . 1 . 2]" 1
647 1 37 LYS HB3 1 37 LYS QD . . 3.660 2.716 2.094 3.406 . 0 0 "[ . 1 . 2]" 1
648 1 37 LYS HB3 1 38 ASP H . . 3.950 3.035 2.034 3.957 0.007 1 0 "[ . 1 . 2]" 1
649 1 37 LYS HB3 1 64 GLY HA2 . . 4.540 4.130 3.492 4.540 . 0 0 "[ . 1 . 2]" 1
650 1 37 LYS HB3 1 64 GLY HA3 . . 4.540 3.635 2.794 4.474 . 0 0 "[ . 1 . 2]" 1
651 1 37 LYS QD 1 38 ASP H . . 4.890 3.895 2.536 4.878 . 0 0 "[ . 1 . 2]" 1
652 1 37 LYS QG 1 38 ASP H . . 4.040 2.633 1.804 4.049 0.009 10 0 "[ . 1 . 2]" 1
653 1 38 ASP H 1 38 ASP HB2 . . 3.830 2.779 2.210 3.669 . 0 0 "[ . 1 . 2]" 1
654 1 38 ASP H 1 38 ASP QB . . 3.270 2.452 2.150 2.808 . 0 0 "[ . 1 . 2]" 1
655 1 38 ASP H 1 38 ASP HB3 . . 3.830 3.130 2.326 3.660 . 0 0 "[ . 1 . 2]" 1
656 1 38 ASP H 1 39 ALA H . . 3.120 2.612 2.276 2.895 . 0 0 "[ . 1 . 2]" 1
657 1 38 ASP H 1 39 ALA MB . . 4.370 4.131 3.841 4.360 . 0 0 "[ . 1 . 2]" 1
658 1 38 ASP H 1 40 GLY H . . 4.900 4.236 4.019 4.564 . 0 0 "[ . 1 . 2]" 1
659 1 38 ASP HA 1 40 GLY H . . 4.690 4.314 3.909 4.680 . 0 0 "[ . 1 . 2]" 1
660 1 38 ASP QB 1 39 ALA H . . 3.750 2.594 2.246 3.354 . 0 0 "[ . 1 . 2]" 1
661 1 38 ASP HB2 1 39 ALA H . . 4.280 3.018 2.271 3.890 . 0 0 "[ . 1 . 2]" 1
662 1 38 ASP HB3 1 39 ALA H . . 4.280 3.297 2.269 4.003 . 0 0 "[ . 1 . 2]" 1
663 1 39 ALA H 1 39 ALA MB . . 2.780 2.138 2.032 2.270 . 0 0 "[ . 1 . 2]" 1
664 1 39 ALA H 1 40 GLY H . . 3.150 2.974 2.726 3.094 . 0 0 "[ . 1 . 2]" 1
665 1 39 ALA HA 1 84 PHE QE . . 4.670 3.918 2.907 4.622 . 0 0 "[ . 1 . 2]" 1
666 1 39 ALA HA 1 84 PHE HZ . . 5.150 3.999 3.179 4.786 . 0 0 "[ . 1 . 2]" 1
667 1 39 ALA MB 1 40 GLY H . . 3.420 2.527 2.278 2.700 . 0 0 "[ . 1 . 2]" 1
668 1 39 ALA MB 1 42 GLY H . . 5.430 5.131 4.756 5.432 0.002 17 0 "[ . 1 . 2]" 1
669 1 39 ALA MB 1 84 PHE QD . . 4.340 3.613 3.253 4.002 . 0 0 "[ . 1 . 2]" 1
670 1 39 ALA MB 1 84 PHE QE . . 3.960 2.757 2.196 3.205 . 0 0 "[ . 1 . 2]" 1
671 1 39 ALA MB 1 84 PHE HZ . . 4.310 2.798 2.190 3.519 . 0 0 "[ . 1 . 2]" 1
672 1 40 GLY H 1 40 GLY HA2 . . 2.940 2.322 2.295 2.422 . 0 0 "[ . 1 . 2]" 1
673 1 40 GLY H 1 40 GLY HA3 . . 2.940 2.875 2.815 2.949 0.009 20 0 "[ . 1 . 2]" 1
674 1 40 GLY H 1 41 GLU H . . 4.250 4.158 3.647 4.249 . 0 0 "[ . 1 . 2]" 1
675 1 40 GLY H 1 84 PHE QE . . 5.500 5.092 4.384 5.496 . 0 0 "[ . 1 . 2]" 1
676 1 40 GLY H 1 84 PHE HZ . . 5.500 4.871 3.840 5.249 . 0 0 "[ . 1 . 2]" 1
677 1 40 GLY QA 1 41 GLU H . . 2.870 2.167 2.117 2.212 . 0 0 "[ . 1 . 2]" 1
678 1 40 GLY QA 1 41 GLU HA . . 4.540 4.031 3.962 4.146 . 0 0 "[ . 1 . 2]" 1
679 1 40 GLY HA2 1 41 GLU H . . 3.480 2.759 2.150 3.467 . 0 0 "[ . 1 . 2]" 1
680 1 40 GLY HA3 1 41 GLU H . . 3.480 2.672 2.154 3.361 . 0 0 "[ . 1 . 2]" 1
681 1 41 GLU H 1 41 GLU QB . . 3.170 2.626 2.257 3.161 . 0 0 "[ . 1 . 2]" 1
682 1 41 GLU H 1 41 GLU QG . . 3.620 2.737 2.247 3.597 . 0 0 "[ . 1 . 2]" 1
683 1 41 GLU H 1 42 GLY H . . 4.590 4.374 4.149 4.554 . 0 0 "[ . 1 . 2]" 1
684 1 41 GLU HA 1 41 GLU QG . . 3.590 2.945 2.199 3.515 . 0 0 "[ . 1 . 2]" 1
685 1 41 GLU HA 1 42 GLY H . . 2.890 2.165 2.142 2.240 . 0 0 "[ . 1 . 2]" 1
686 1 41 GLU HA 1 42 GLY QA . . 4.510 3.913 3.905 3.943 . 0 0 "[ . 1 . 2]" 1
687 1 41 GLU QB 1 42 GLY H . . 3.670 3.246 2.824 3.648 . 0 0 "[ . 1 . 2]" 1
688 1 41 GLU QG 1 42 GLY H . . 4.170 4.050 3.732 4.172 0.002 2 0 "[ . 1 . 2]" 1
689 1 42 GLY H 1 43 GLY H . . 4.180 3.761 1.803 4.112 . 0 0 "[ . 1 . 2]" 1
690 1 42 GLY H 1 44 LEU H . . 5.470 3.939 2.925 5.062 . 0 0 "[ . 1 . 2]" 1
691 1 42 GLY H 1 84 PHE QE . . 4.230 3.329 2.219 4.089 . 0 0 "[ . 1 . 2]" 1
692 1 42 GLY H 1 84 PHE HZ . . 4.550 4.051 3.225 4.540 . 0 0 "[ . 1 . 2]" 1
693 1 42 GLY QA 1 43 GLY H . . 2.860 2.161 2.113 2.785 . 0 0 "[ . 1 . 2]" 1
694 1 42 GLY QA 1 44 LEU H . . 4.970 4.176 3.732 4.788 . 0 0 "[ . 1 . 2]" 1
695 1 42 GLY HA2 1 43 GLY H . . 3.430 3.203 3.065 3.512 0.082 17 0 "[ . 1 . 2]" 1
696 1 42 GLY HA3 1 43 GLY H . . 3.430 2.200 2.140 2.921 . 0 0 "[ . 1 . 2]" 1
697 1 43 GLY H 1 44 LEU H . . 3.770 3.186 2.192 3.722 . 0 0 "[ . 1 . 2]" 1
698 1 43 GLY H 1 44 LEU HA . . 5.100 4.452 4.096 4.766 . 0 0 "[ . 1 . 2]" 1
699 1 43 GLY H 1 44 LEU QB . . 4.790 4.394 3.536 4.682 . 0 0 "[ . 1 . 2]" 1
700 1 43 GLY H 1 84 PHE HA . . 4.830 4.274 3.981 4.663 . 0 0 "[ . 1 . 2]" 1
701 1 43 GLY H 1 84 PHE QD . . 5.010 3.929 3.527 4.460 . 0 0 "[ . 1 . 2]" 1
702 1 43 GLY H 1 84 PHE QE . . 4.820 3.460 3.022 4.339 . 0 0 "[ . 1 . 2]" 1
703 1 43 GLY H 1 84 PHE HZ . . 5.500 4.130 3.390 4.868 . 0 0 "[ . 1 . 2]" 1
704 1 43 GLY H 1 85 ASP H . . 4.000 3.590 2.929 4.000 . 0 0 "[ . 1 . 2]" 1
705 1 43 GLY H 1 85 ASP QB . . 4.860 3.735 2.858 4.837 . 0 0 "[ . 1 . 2]" 1
706 1 43 GLY HA2 1 44 LEU H . . 2.870 2.570 2.276 2.814 . 0 0 "[ . 1 . 2]" 1
707 1 43 GLY HA3 1 85 ASP H . . 4.570 3.406 2.844 3.997 . 0 0 "[ . 1 . 2]" 1
708 1 44 LEU H 1 44 LEU QB . . 2.790 2.250 2.159 2.338 . 0 0 "[ . 1 . 2]" 1
709 1 44 LEU H 1 44 LEU MD1 . . 4.590 4.032 3.743 4.223 . 0 0 "[ . 1 . 2]" 1
710 1 44 LEU H 1 44 LEU MD2 . . 5.010 4.248 4.172 4.326 . 0 0 "[ . 1 . 2]" 1
711 1 44 LEU H 1 45 SER H . . 4.750 4.583 4.474 4.640 . 0 0 "[ . 1 . 2]" 1
712 1 44 LEU H 1 84 PHE QD . . 4.870 3.691 2.868 4.792 . 0 0 "[ . 1 . 2]" 1
713 1 44 LEU H 1 84 PHE QE . . 4.850 3.776 2.493 4.568 . 0 0 "[ . 1 . 2]" 1
714 1 44 LEU HA 1 44 LEU MD1 . . 3.580 2.309 1.996 2.546 . 0 0 "[ . 1 . 2]" 1
715 1 44 LEU HA 1 44 LEU MD2 . . 4.080 3.897 3.865 3.935 . 0 0 "[ . 1 . 2]" 1
716 1 44 LEU HA 1 45 SER H . . 2.670 2.224 2.147 2.319 . 0 0 "[ . 1 . 2]" 1
717 1 44 LEU HA 1 84 PHE HB2 . . 4.770 3.710 3.188 4.007 . 0 0 "[ . 1 . 2]" 1
718 1 44 LEU HA 1 85 ASP H . . 3.780 3.599 3.319 3.777 . 0 0 "[ . 1 . 2]" 1
719 1 44 LEU QB 1 44 LEU MD1 . . 3.090 2.158 2.024 2.291 . 0 0 "[ . 1 . 2]" 1
720 1 44 LEU QB 1 44 LEU MD2 . . 3.060 2.044 1.965 2.097 . 0 0 "[ . 1 . 2]" 1
721 1 44 LEU QB 1 45 SER H . . 4.230 3.561 3.388 3.758 . 0 0 "[ . 1 . 2]" 1
722 1 44 LEU QB 1 84 PHE QD . . 4.100 2.381 1.988 3.076 . 0 0 "[ . 1 . 2]" 1
723 1 44 LEU QB 1 84 PHE QE . . 4.480 3.039 2.356 3.725 . 0 0 "[ . 1 . 2]" 1
724 1 44 LEU MD1 1 45 SER H . . 3.280 2.949 2.299 3.185 . 0 0 "[ . 1 . 2]" 1
725 1 44 LEU MD1 1 84 PHE HA . . 3.860 2.949 2.310 3.200 . 0 0 "[ . 1 . 2]" 1
726 1 44 LEU MD1 1 84 PHE HB2 . . 3.730 2.367 1.965 2.738 . 0 0 "[ . 1 . 2]" 1
727 1 44 LEU MD1 1 84 PHE HB3 . . 4.120 3.853 3.438 4.103 . 0 0 "[ . 1 . 2]" 1
728 1 44 LEU MD1 1 84 PHE QD . . 3.640 2.048 1.866 2.306 . 0 0 "[ . 1 . 2]" 1
729 1 44 LEU MD1 1 84 PHE QE . . 4.360 3.595 3.002 4.158 . 0 0 "[ . 1 . 2]" 1
730 1 44 LEU MD1 1 85 ASP H . . 4.940 4.763 4.199 4.946 0.006 19 0 "[ . 1 . 2]" 1
731 1 44 LEU HG 1 45 SER H . . 3.320 2.405 1.905 2.900 . 0 0 "[ . 1 . 2]" 1
732 1 45 SER H 1 45 SER QB . . 3.340 2.626 2.287 3.000 . 0 0 "[ . 1 . 2]" 1
733 1 45 SER H 1 46 LEU H . . 4.660 4.443 4.292 4.536 . 0 0 "[ . 1 . 2]" 1
734 1 45 SER H 1 83 ARG H . . 3.490 3.058 2.752 3.246 . 0 0 "[ . 1 . 2]" 1
735 1 45 SER H 1 83 ARG HB2 . . 4.060 3.787 3.464 4.061 0.001 4 0 "[ . 1 . 2]" 1
736 1 45 SER H 1 83 ARG HB3 . . 5.500 4.989 4.680 5.242 . 0 0 "[ . 1 . 2]" 1
737 1 45 SER H 1 83 ARG HG3 . . 5.500 5.292 4.918 5.497 . 0 0 "[ . 1 . 2]" 1
738 1 45 SER H 1 84 PHE QD . . 5.110 4.577 3.986 4.987 . 0 0 "[ . 1 . 2]" 1
739 1 45 SER HA 1 46 LEU H . . 2.790 2.253 2.155 2.367 . 0 0 "[ . 1 . 2]" 1
740 1 45 SER QB 1 46 LEU H . . 3.560 3.018 2.682 3.461 . 0 0 "[ . 1 . 2]" 1
741 1 45 SER QB 1 83 ARG H . . 4.110 2.965 2.183 3.978 . 0 0 "[ . 1 . 2]" 1
742 1 45 SER QB 1 83 ARG HB2 . . 3.570 2.680 2.140 3.419 . 0 0 "[ . 1 . 2]" 1
743 1 45 SER QB 1 83 ARG HB3 . . 4.830 4.235 3.761 4.821 . 0 0 "[ . 1 . 2]" 1
744 1 45 SER QB 1 83 ARG HG3 . . 5.500 3.943 3.452 5.013 . 0 0 "[ . 1 . 2]" 1
745 1 46 LEU H 1 46 LEU HB2 . . 3.260 2.607 2.447 2.689 . 0 0 "[ . 1 . 2]" 1
746 1 46 LEU H 1 46 LEU HB3 . . 3.870 3.743 3.645 3.806 . 0 0 "[ . 1 . 2]" 1
747 1 46 LEU H 1 46 LEU MD1 . . 4.190 3.935 3.700 4.110 . 0 0 "[ . 1 . 2]" 1
748 1 46 LEU H 1 46 LEU MD2 . . 4.400 4.329 4.240 4.400 0.000 7 0 "[ . 1 . 2]" 1
749 1 46 LEU H 1 46 LEU HG . . 3.550 3.412 3.258 3.543 . 0 0 "[ . 1 . 2]" 1
750 1 46 LEU H 1 47 ALA H . . 4.350 4.265 4.148 4.356 0.006 7 0 "[ . 1 . 2]" 1
751 1 46 LEU HA 1 46 LEU MD1 . . 4.240 3.871 3.843 3.905 . 0 0 "[ . 1 . 2]" 1
752 1 46 LEU HA 1 46 LEU MD2 . . 3.560 2.315 2.093 2.551 . 0 0 "[ . 1 . 2]" 1
753 1 46 LEU HA 1 46 LEU HG . . 4.230 2.729 2.646 2.824 . 0 0 "[ . 1 . 2]" 1
754 1 46 LEU HA 1 47 ALA H . . 2.630 2.153 2.139 2.196 . 0 0 "[ . 1 . 2]" 1
755 1 46 LEU HA 1 47 ALA HA . . 4.920 4.413 4.388 4.456 . 0 0 "[ . 1 . 2]" 1
756 1 46 LEU HA 1 47 ALA MB . . 4.360 3.953 3.848 4.019 . 0 0 "[ . 1 . 2]" 1
757 1 46 LEU HA 1 81 ILE H . . 5.400 5.277 5.170 5.391 . 0 0 "[ . 1 . 2]" 1
758 1 46 LEU HA 1 82 VAL HA . . 4.460 3.172 2.841 3.438 . 0 0 "[ . 1 . 2]" 1
759 1 46 LEU HA 1 83 ARG H . . 4.670 4.461 4.042 4.627 . 0 0 "[ . 1 . 2]" 1
760 1 46 LEU HB2 1 46 LEU MD1 . . 3.630 2.106 2.007 2.224 . 0 0 "[ . 1 . 2]" 1
761 1 46 LEU HB2 1 47 ALA H . . 4.630 4.294 4.151 4.422 . 0 0 "[ . 1 . 2]" 1
762 1 46 LEU HB2 1 56 ILE MG . . 3.890 3.754 3.358 3.893 0.003 7 0 "[ . 1 . 2]" 1
763 1 46 LEU HB3 1 46 LEU MD1 . . 3.650 2.590 2.507 2.666 . 0 0 "[ . 1 . 2]" 1
764 1 46 LEU HB3 1 47 ALA H . . 4.360 3.314 3.038 3.518 . 0 0 "[ . 1 . 2]" 1
765 1 46 LEU HB3 1 56 ILE MD . . 3.420 2.752 2.170 3.126 . 0 0 "[ . 1 . 2]" 1
766 1 46 LEU HB3 1 56 ILE MG . . 4.000 2.734 2.383 3.162 . 0 0 "[ . 1 . 2]" 1
767 1 46 LEU MD1 1 58 CYS HB2 . . 4.590 3.564 2.843 4.501 . 0 0 "[ . 1 . 2]" 1
768 1 46 LEU MD1 1 58 CYS QB . . 3.830 2.817 2.092 3.827 . 0 0 "[ . 1 . 2]" 1
769 1 46 LEU MD1 1 58 CYS HB3 . . 4.590 3.132 2.137 4.491 . 0 0 "[ . 1 . 2]" 1
770 1 46 LEU MD1 1 68 VAL MG1 . . 3.500 2.538 2.214 2.999 . 0 0 "[ . 1 . 2]" 1
771 1 46 LEU MD1 1 68 VAL MG2 . . 3.610 2.135 1.884 2.492 . 0 0 "[ . 1 . 2]" 1
772 1 46 LEU MD2 1 47 ALA H . . 3.910 3.398 3.163 3.679 . 0 0 "[ . 1 . 2]" 1
773 1 46 LEU MD2 1 68 VAL MG1 . . 3.470 2.590 2.149 3.164 . 0 0 "[ . 1 . 2]" 1
774 1 46 LEU MD2 1 68 VAL MG2 . . 3.280 2.504 2.113 2.822 . 0 0 "[ . 1 . 2]" 1
775 1 46 LEU MD2 1 82 VAL HA . . 4.520 3.607 3.246 3.835 . 0 0 "[ . 1 . 2]" 1
776 1 46 LEU HG 1 47 ALA H . . 4.870 4.781 4.661 4.871 0.001 8 0 "[ . 1 . 2]" 1
777 1 47 ALA H 1 47 ALA MB . . 3.000 2.766 2.645 2.833 . 0 0 "[ . 1 . 2]" 1
778 1 47 ALA H 1 48 VAL H . . 4.450 4.262 4.110 4.398 . 0 0 "[ . 1 . 2]" 1
779 1 47 ALA H 1 48 VAL HA . . 4.880 4.632 4.543 4.744 . 0 0 "[ . 1 . 2]" 1
780 1 47 ALA H 1 48 VAL MG2 . . 4.360 3.913 3.664 4.224 . 0 0 "[ . 1 . 2]" 1
781 1 47 ALA H 1 56 ILE MD . . 3.480 3.314 2.998 3.482 0.002 19 0 "[ . 1 . 2]" 1
782 1 47 ALA H 1 80 ILE MG . . 4.530 3.536 3.237 3.852 . 0 0 "[ . 1 . 2]" 1
783 1 47 ALA H 1 81 ILE H . . 3.540 3.528 3.498 3.545 0.005 6 0 "[ . 1 . 2]" 1
784 1 47 ALA H 1 81 ILE HB . . 3.950 3.535 3.252 3.799 . 0 0 "[ . 1 . 2]" 1
785 1 47 ALA H 1 82 VAL HA . . 4.530 4.122 3.855 4.498 . 0 0 "[ . 1 . 2]" 1
786 1 47 ALA H 1 82 VAL MG2 . . 4.350 3.753 3.367 4.057 . 0 0 "[ . 1 . 2]" 1
787 1 47 ALA HA 1 48 VAL H . . 2.610 2.253 2.166 2.425 . 0 0 "[ . 1 . 2]" 1
788 1 47 ALA HA 1 48 VAL HB . . 4.710 4.525 4.376 4.673 . 0 0 "[ . 1 . 2]" 1
789 1 47 ALA HA 1 48 VAL MG2 . . 4.780 3.622 3.303 3.945 . 0 0 "[ . 1 . 2]" 1
790 1 47 ALA HA 1 56 ILE MD . . 3.570 2.266 2.022 2.679 . 0 0 "[ . 1 . 2]" 1
791 1 47 ALA HA 1 81 ILE HB . . 5.400 4.932 4.609 5.376 . 0 0 "[ . 1 . 2]" 1
792 1 47 ALA MB 1 48 VAL H . . 3.010 2.792 2.375 3.015 0.005 10 0 "[ . 1 . 2]" 1
793 1 47 ALA MB 1 49 GLU H . . 5.290 5.064 4.839 5.238 . 0 0 "[ . 1 . 2]" 1
794 1 47 ALA MB 1 81 ILE H . . 4.000 3.705 3.388 3.973 . 0 0 "[ . 1 . 2]" 1
795 1 47 ALA MB 1 81 ILE HB . . 3.150 2.512 2.013 2.965 . 0 0 "[ . 1 . 2]" 1
796 1 47 ALA MB 1 81 ILE MD . . 3.060 2.729 2.391 2.912 . 0 0 "[ . 1 . 2]" 1
797 1 48 VAL H 1 48 VAL HB . . 3.130 2.629 2.446 2.801 . 0 0 "[ . 1 . 2]" 1
798 1 48 VAL H 1 48 VAL MG1 . . 3.910 3.831 3.753 3.916 0.006 13 0 "[ . 1 . 2]" 1
799 1 48 VAL H 1 48 VAL MG2 . . 3.480 2.877 2.585 3.220 . 0 0 "[ . 1 . 2]" 1
800 1 48 VAL H 1 49 GLU H . . 4.580 4.407 4.284 4.505 . 0 0 "[ . 1 . 2]" 1
801 1 48 VAL H 1 49 GLU QG . . 4.700 4.271 3.931 4.532 . 0 0 "[ . 1 . 2]" 1
802 1 48 VAL H 1 56 ILE MD . . 3.330 2.399 1.891 3.154 . 0 0 "[ . 1 . 2]" 1
803 1 48 VAL HA 1 48 VAL MG1 . . 3.490 2.397 2.277 2.488 . 0 0 "[ . 1 . 2]" 1
804 1 48 VAL HA 1 48 VAL MG2 . . 3.540 2.304 2.150 2.463 . 0 0 "[ . 1 . 2]" 1
805 1 48 VAL HA 1 49 GLU H . . 2.800 2.188 2.146 2.239 . 0 0 "[ . 1 . 2]" 1
806 1 48 VAL HA 1 80 ILE HA . . 4.420 2.476 2.315 2.706 . 0 0 "[ . 1 . 2]" 1
807 1 48 VAL HA 1 81 ILE H . . 3.780 2.969 2.687 3.554 . 0 0 "[ . 1 . 2]" 1
808 1 48 VAL HB 1 49 GLU H . . 4.270 4.093 3.931 4.269 . 0 0 "[ . 1 . 2]" 1
809 1 48 VAL HB 1 54 ALA H . . 3.670 3.412 3.022 3.674 0.004 5 0 "[ . 1 . 2]" 1
810 1 48 VAL HB 1 54 ALA MB . . 3.870 3.438 2.905 3.746 . 0 0 "[ . 1 . 2]" 1
811 1 48 VAL HB 1 56 ILE MD . . 3.880 2.859 2.333 3.376 . 0 0 "[ . 1 . 2]" 1
812 1 48 VAL MG1 1 49 GLU H . . 3.450 2.343 1.968 2.542 . 0 0 "[ . 1 . 2]" 1
813 1 48 VAL MG1 1 49 GLU HA . . 4.800 3.463 3.172 3.620 . 0 0 "[ . 1 . 2]" 1
814 1 48 VAL MG1 1 50 GLY H . . 4.690 3.440 3.288 3.677 . 0 0 "[ . 1 . 2]" 1
815 1 48 VAL MG1 1 52 SER H . . 5.050 4.941 4.603 5.055 0.005 1 0 "[ . 1 . 2]" 1
816 1 48 VAL MG1 1 54 ALA H . . 4.290 3.398 2.616 3.823 . 0 0 "[ . 1 . 2]" 1
817 1 48 VAL MG1 1 54 ALA MB . . 3.300 2.876 2.182 3.243 . 0 0 "[ . 1 . 2]" 1
818 1 48 VAL MG1 1 78 TYR HB2 . . 4.250 3.755 3.433 4.116 . 0 0 "[ . 1 . 2]" 1
819 1 48 VAL MG1 1 78 TYR HB3 . . 3.850 2.347 2.003 2.632 . 0 0 "[ . 1 . 2]" 1
820 1 48 VAL MG1 1 78 TYR QD . . 3.290 1.841 1.771 1.909 . 0 0 "[ . 1 . 2]" 1
821 1 48 VAL MG1 1 79 SER H . . 4.280 2.928 2.605 3.406 . 0 0 "[ . 1 . 2]" 1
822 1 48 VAL MG1 1 80 ILE HA . . 4.270 3.429 2.975 3.935 . 0 0 "[ . 1 . 2]" 1
823 1 48 VAL MG1 1 80 ILE QG . . 4.310 3.014 2.689 3.534 . 0 0 "[ . 1 . 2]" 1
824 1 48 VAL MG2 1 49 GLU H . . 4.000 3.904 3.786 4.004 0.004 1 0 "[ . 1 . 2]" 1
825 1 48 VAL MG2 1 54 ALA H . . 4.840 4.509 3.780 4.833 . 0 0 "[ . 1 . 2]" 1
826 1 48 VAL MG2 1 56 ILE H . . 5.500 5.231 4.944 5.488 . 0 0 "[ . 1 . 2]" 1
827 1 48 VAL MG2 1 56 ILE MD . . 3.150 1.856 1.746 1.997 . 0 0 "[ . 1 . 2]" 1
828 1 48 VAL MG2 1 56 ILE HG12 . . 3.880 2.259 1.969 2.576 . 0 0 "[ . 1 . 2]" 1
829 1 48 VAL MG2 1 56 ILE HG13 . . 3.430 3.066 2.695 3.293 . 0 0 "[ . 1 . 2]" 1
830 1 48 VAL MG2 1 70 TYR HA . . 5.360 4.857 4.453 5.292 . 0 0 "[ . 1 . 2]" 1
831 1 48 VAL MG2 1 70 TYR HB2 . . 4.060 3.086 2.648 3.459 . 0 0 "[ . 1 . 2]" 1
832 1 48 VAL MG2 1 70 TYR HB3 . . 4.120 3.216 2.719 3.646 . 0 0 "[ . 1 . 2]" 1
833 1 48 VAL MG2 1 70 TYR QD . . 4.440 3.571 3.238 3.901 . 0 0 "[ . 1 . 2]" 1
834 1 48 VAL MG2 1 78 TYR HB3 . . 4.390 3.895 3.624 4.139 . 0 0 "[ . 1 . 2]" 1
835 1 48 VAL MG2 1 78 TYR QD . . 4.610 3.951 3.706 4.149 . 0 0 "[ . 1 . 2]" 1
836 1 48 VAL MG2 1 79 SER H . . 5.200 4.954 4.732 5.192 . 0 0 "[ . 1 . 2]" 1
837 1 48 VAL MG2 1 80 ILE HA . . 3.820 2.542 2.076 3.123 . 0 0 "[ . 1 . 2]" 1
838 1 48 VAL MG2 1 80 ILE HG12 . . 3.880 2.337 2.103 3.018 . 0 0 "[ . 1 . 2]" 1
839 1 48 VAL MG2 1 80 ILE QG . . 3.350 2.267 2.048 2.890 . 0 0 "[ . 1 . 2]" 1
840 1 48 VAL MG2 1 80 ILE HG13 . . 3.880 3.071 2.734 3.695 . 0 0 "[ . 1 . 2]" 1
841 1 49 GLU H 1 49 GLU HB2 . . 3.420 2.583 2.506 2.717 . 0 0 "[ . 1 . 2]" 1
842 1 49 GLU H 1 49 GLU HB3 . . 4.050 3.711 3.648 3.791 . 0 0 "[ . 1 . 2]" 1
843 1 49 GLU H 1 49 GLU QG . . 3.640 3.330 3.093 3.555 . 0 0 "[ . 1 . 2]" 1
844 1 49 GLU H 1 50 GLY H . . 4.230 4.027 3.916 4.120 . 0 0 "[ . 1 . 2]" 1
845 1 49 GLU H 1 78 TYR HB3 . . 4.960 4.441 4.160 4.663 . 0 0 "[ . 1 . 2]" 1
846 1 49 GLU H 1 78 TYR QD . . 4.910 4.386 4.019 4.626 . 0 0 "[ . 1 . 2]" 1
847 1 49 GLU H 1 79 SER HA . . 5.180 4.417 4.291 4.574 . 0 0 "[ . 1 . 2]" 1
848 1 49 GLU H 1 79 SER QB . . 3.680 2.774 2.509 3.117 . 0 0 "[ . 1 . 2]" 1
849 1 49 GLU H 1 80 ILE HA . . 4.040 3.826 3.459 3.959 . 0 0 "[ . 1 . 2]" 1
850 1 49 GLU H 1 81 ILE MD . . 4.350 3.892 3.583 4.227 . 0 0 "[ . 1 . 2]" 1
851 1 49 GLU HA 1 49 GLU QG . . 3.800 2.420 2.168 2.613 . 0 0 "[ . 1 . 2]" 1
852 1 49 GLU HA 1 50 GLY H . . 2.750 2.165 2.143 2.178 . 0 0 "[ . 1 . 2]" 1
853 1 49 GLU HA 1 52 SER H . . 5.500 5.475 5.356 5.518 0.018 6 0 "[ . 1 . 2]" 1
854 1 49 GLU HB2 1 50 GLY H . . 4.750 4.512 4.453 4.547 . 0 0 "[ . 1 . 2]" 1
855 1 49 GLU HB2 1 79 SER H . . 4.370 4.001 3.664 4.223 . 0 0 "[ . 1 . 2]" 1
856 1 49 GLU HB2 1 79 SER QB . . 3.270 2.329 2.022 2.585 . 0 0 "[ . 1 . 2]" 1
857 1 49 GLU HB2 1 81 ILE MD . . 4.380 2.738 2.463 3.108 . 0 0 "[ . 1 . 2]" 1
858 1 49 GLU HB3 1 50 GLY H . . 3.800 3.760 3.572 3.811 0.011 1 0 "[ . 1 . 2]" 1
859 1 49 GLU HB3 1 79 SER H . . 5.050 4.672 4.390 4.973 . 0 0 "[ . 1 . 2]" 1
860 1 49 GLU HB3 1 79 SER QB . . 3.700 3.371 3.027 3.696 . 0 0 "[ . 1 . 2]" 1
861 1 49 GLU HB3 1 81 ILE MD . . 4.530 3.974 3.683 4.346 . 0 0 "[ . 1 . 2]" 1
862 1 49 GLU QG 1 50 GLY H . . 4.540 4.353 4.012 4.540 0.000 12 0 "[ . 1 . 2]" 1
863 1 49 GLU QG 1 79 SER H . . 5.500 5.348 5.072 5.501 0.001 9 0 "[ . 1 . 2]" 1
864 1 49 GLU QG 1 79 SER QB . . 4.300 4.008 3.738 4.267 . 0 0 "[ . 1 . 2]" 1
865 1 49 GLU QG 1 81 ILE MD . . 3.330 2.345 2.047 2.744 . 0 0 "[ . 1 . 2]" 1
866 1 50 GLY H 1 51 PRO HD2 . . 4.470 4.271 4.128 4.372 . 0 0 "[ . 1 . 2]" 1
867 1 50 GLY H 1 51 PRO HD3 . . 5.160 5.007 4.949 5.037 . 0 0 "[ . 1 . 2]" 1
868 1 50 GLY H 1 52 SER H . . 4.130 3.403 3.285 3.507 . 0 0 "[ . 1 . 2]" 1
869 1 50 GLY H 1 78 TYR QE . . 5.000 4.548 3.887 4.830 . 0 0 "[ . 1 . 2]" 1
870 1 50 GLY HA2 1 51 PRO HD2 . . 3.540 3.219 3.145 3.325 . 0 0 "[ . 1 . 2]" 1
871 1 50 GLY HA2 1 51 PRO HD3 . . 3.570 2.936 2.855 3.060 . 0 0 "[ . 1 . 2]" 1
872 1 50 GLY HA2 1 51 PRO HG2 . . 5.440 5.215 5.149 5.310 . 0 0 "[ . 1 . 2]" 1
873 1 50 GLY HA2 1 51 PRO HG3 . . 5.500 5.159 5.081 5.275 . 0 0 "[ . 1 . 2]" 1
874 1 50 GLY HA2 1 78 TYR HA . . 4.190 3.222 2.392 3.686 . 0 0 "[ . 1 . 2]" 1
875 1 50 GLY HA2 1 79 SER H . . 4.330 3.679 3.173 3.969 . 0 0 "[ . 1 . 2]" 1
876 1 50 GLY HA3 1 51 PRO HD2 . . 3.550 1.963 1.926 1.997 . 0 0 "[ . 1 . 2]" 1
877 1 50 GLY HA3 1 51 PRO HD3 . . 3.560 2.701 2.590 2.776 . 0 0 "[ . 1 . 2]" 1
878 1 50 GLY HA3 1 51 PRO HG2 . . 4.690 4.137 4.117 4.157 . 0 0 "[ . 1 . 2]" 1
879 1 50 GLY HA3 1 51 PRO HG3 . . 4.620 4.505 4.433 4.557 . 0 0 "[ . 1 . 2]" 1
880 1 50 GLY HA3 1 52 SER H . . 4.010 3.176 3.134 3.269 . 0 0 "[ . 1 . 2]" 1
881 1 50 GLY HA3 1 78 TYR HA . . 4.400 2.573 2.297 2.798 . 0 0 "[ . 1 . 2]" 1
882 1 50 GLY HA3 1 78 TYR QD . . 4.340 3.231 2.683 3.634 . 0 0 "[ . 1 . 2]" 1
883 1 50 GLY HA3 1 78 TYR QE . . 4.760 3.863 3.346 4.232 . 0 0 "[ . 1 . 2]" 1
884 1 50 GLY HA3 1 79 SER H . . 4.310 3.587 3.420 3.729 . 0 0 "[ . 1 . 2]" 1
885 1 51 PRO QB 1 52 SER H . . 3.750 3.655 3.534 3.736 . 0 0 "[ . 1 . 2]" 1
886 1 51 PRO QB 1 74 ALA MB . . 3.420 2.377 2.042 2.763 . 0 0 "[ . 1 . 2]" 1
887 1 51 PRO HB2 1 52 SER H . . 4.620 3.883 3.732 3.985 . 0 0 "[ . 1 . 2]" 1
888 1 51 PRO HB2 1 74 ALA MB . . 4.250 2.401 2.055 2.802 . 0 0 "[ . 1 . 2]" 1
889 1 51 PRO HB3 1 52 SER H . . 4.620 4.458 4.372 4.515 . 0 0 "[ . 1 . 2]" 1
890 1 51 PRO HB3 1 74 ALA MB . . 4.250 3.822 3.553 4.205 . 0 0 "[ . 1 . 2]" 1
891 1 51 PRO HD2 1 52 SER H . . 3.530 2.934 2.786 3.056 . 0 0 "[ . 1 . 2]" 1
892 1 51 PRO HD2 1 78 TYR H . . 5.090 4.846 4.614 5.035 . 0 0 "[ . 1 . 2]" 1
893 1 51 PRO HD2 1 78 TYR QD . . 4.680 3.485 3.103 3.746 . 0 0 "[ . 1 . 2]" 1
894 1 51 PRO HD2 1 78 TYR QE . . 4.660 3.324 2.821 3.599 . 0 0 "[ . 1 . 2]" 1
895 1 51 PRO HD3 1 52 SER H . . 4.210 3.994 3.916 4.058 . 0 0 "[ . 1 . 2]" 1
896 1 51 PRO HD3 1 77 ASP H . . 4.660 3.534 3.115 3.817 . 0 0 "[ . 1 . 2]" 1
897 1 51 PRO HD3 1 78 TYR QE . . 5.090 4.541 3.826 4.940 . 0 0 "[ . 1 . 2]" 1
898 1 51 PRO HG2 1 52 SER H . . 3.740 3.199 2.936 3.386 . 0 0 "[ . 1 . 2]" 1
899 1 51 PRO HG2 1 52 SER QB . . 4.620 3.375 3.232 3.487 . 0 0 "[ . 1 . 2]" 1
900 1 51 PRO HG2 1 74 ALA H . . 4.660 3.906 3.430 4.458 . 0 0 "[ . 1 . 2]" 1
901 1 51 PRO HG2 1 74 ALA MB . . 3.940 2.799 2.645 3.038 . 0 0 "[ . 1 . 2]" 1
902 1 51 PRO HG2 1 76 GLY HA2 . . 5.500 5.423 5.214 5.503 0.003 19 0 "[ . 1 . 2]" 1
903 1 51 PRO HG2 1 76 GLY HA3 . . 4.400 3.766 3.532 3.886 . 0 0 "[ . 1 . 2]" 1
904 1 51 PRO HG2 1 77 ASP H . . 5.500 5.424 5.212 5.503 0.003 15 0 "[ . 1 . 2]" 1
905 1 51 PRO HG2 1 78 TYR QD . . 4.850 4.587 4.323 4.850 0.000 4 0 "[ . 1 . 2]" 1
906 1 51 PRO HG2 1 78 TYR QE . . 3.950 3.340 2.890 3.736 . 0 0 "[ . 1 . 2]" 1
907 1 51 PRO HG2 1 78 TYR HH . . 4.630 2.498 2.101 3.147 . 0 0 "[ . 1 . 2]" 1
908 1 51 PRO HG3 1 52 SER QB . . 5.340 4.924 4.879 4.952 . 0 0 "[ . 1 . 2]" 1
909 1 51 PRO HG3 1 74 ALA MB . . 3.850 3.573 3.415 3.740 . 0 0 "[ . 1 . 2]" 1
910 1 51 PRO HG3 1 76 GLY HA2 . . 4.360 3.864 3.748 3.998 . 0 0 "[ . 1 . 2]" 1
911 1 51 PRO HG3 1 76 GLY HA3 . . 4.090 2.147 2.040 2.271 . 0 0 "[ . 1 . 2]" 1
912 1 51 PRO HG3 1 77 ASP H . . 4.000 3.880 3.610 3.961 . 0 0 "[ . 1 . 2]" 1
913 1 51 PRO HG3 1 78 TYR QE . . 4.480 3.864 3.105 4.456 . 0 0 "[ . 1 . 2]" 1
914 1 52 SER H 1 52 SER HB2 . . 3.770 3.145 2.870 3.405 . 0 0 "[ . 1 . 2]" 1
915 1 52 SER H 1 52 SER QB . . 3.220 2.899 2.789 2.967 . 0 0 "[ . 1 . 2]" 1
916 1 52 SER H 1 52 SER HB3 . . 3.770 3.520 3.227 3.832 0.062 8 0 "[ . 1 . 2]" 1
917 1 52 SER H 1 52 SER HG . . 4.760 4.523 4.023 4.760 0.000 8 0 "[ . 1 . 2]" 1
918 1 52 SER H 1 53 LYS H . . 4.430 4.253 4.128 4.376 . 0 0 "[ . 1 . 2]" 1
919 1 52 SER H 1 53 LYS HA . . 4.800 4.619 4.558 4.702 . 0 0 "[ . 1 . 2]" 1
920 1 52 SER H 1 54 ALA H . . 5.500 5.406 5.091 5.549 0.049 15 0 "[ . 1 . 2]" 1
921 1 52 SER H 1 54 ALA MB . . 5.500 5.248 4.779 5.457 . 0 0 "[ . 1 . 2]" 1
922 1 52 SER H 1 74 ALA MB . . 4.570 4.423 4.183 4.570 0.000 5 0 "[ . 1 . 2]" 1
923 1 52 SER H 1 78 TYR QE . . 3.510 3.387 2.926 3.513 0.003 1 0 "[ . 1 . 2]" 1
924 1 52 SER H 1 78 TYR HH . . 4.100 3.761 3.203 4.101 0.001 6 0 "[ . 1 . 2]" 1
925 1 52 SER QB 1 74 ALA H . . 3.430 2.684 2.475 3.024 . 0 0 "[ . 1 . 2]" 1
926 1 52 SER QB 1 78 TYR QE . . 4.580 3.422 3.211 3.829 . 0 0 "[ . 1 . 2]" 1
927 1 52 SER HB2 1 53 LYS H . . 4.240 4.108 3.744 4.264 0.024 15 0 "[ . 1 . 2]" 1
928 1 52 SER HB2 1 73 THR H . . 4.160 3.639 3.013 4.158 . 0 0 "[ . 1 . 2]" 1
929 1 52 SER HB2 1 74 ALA H . . 4.180 3.084 2.690 3.493 . 0 0 "[ . 1 . 2]" 1
930 1 52 SER HB2 1 74 ALA MB . . 3.760 2.392 2.000 2.747 . 0 0 "[ . 1 . 2]" 1
931 1 52 SER HB3 1 53 LYS H . . 4.240 3.256 2.294 3.837 . 0 0 "[ . 1 . 2]" 1
932 1 52 SER HB3 1 73 THR H . . 4.160 2.862 2.473 3.577 . 0 0 "[ . 1 . 2]" 1
933 1 52 SER HB3 1 74 ALA H . . 4.180 3.169 2.572 3.911 . 0 0 "[ . 1 . 2]" 1
934 1 52 SER HB3 1 74 ALA MB . . 3.760 3.403 2.976 3.763 0.003 18 0 "[ . 1 . 2]" 1
935 1 52 SER HG 1 73 THR H . . 5.080 4.577 4.060 4.990 . 0 0 "[ . 1 . 2]" 1
936 1 52 SER HG 1 74 ALA H . . 5.010 4.516 3.455 5.012 0.002 12 0 "[ . 1 . 2]" 1
937 1 53 LYS H 1 53 LYS HB2 . . 3.960 2.493 2.243 2.790 . 0 0 "[ . 1 . 2]" 1
938 1 53 LYS H 1 53 LYS QB . . 3.470 2.259 2.169 2.341 . 0 0 "[ . 1 . 2]" 1
939 1 53 LYS H 1 53 LYS HB3 . . 3.960 2.651 2.372 2.878 . 0 0 "[ . 1 . 2]" 1
940 1 53 LYS H 1 53 LYS HG2 . . 5.080 4.509 4.335 4.648 . 0 0 "[ . 1 . 2]" 1
941 1 53 LYS H 1 53 LYS QG . . 4.330 3.976 3.907 4.035 . 0 0 "[ . 1 . 2]" 1
942 1 53 LYS H 1 53 LYS HG3 . . 5.080 4.434 4.219 4.632 . 0 0 "[ . 1 . 2]" 1
943 1 53 LYS HA 1 53 LYS QD . . 4.260 3.938 2.454 4.226 . 0 0 "[ . 1 . 2]" 1
944 1 53 LYS HA 1 54 ALA H . . 2.560 2.148 2.140 2.178 . 0 0 "[ . 1 . 2]" 1
945 1 53 LYS HA 1 54 ALA MB . . 4.620 3.998 3.951 4.069 . 0 0 "[ . 1 . 2]" 1
946 1 53 LYS QB 1 53 LYS QE . . 3.310 2.554 1.998 3.349 0.039 11 0 "[ . 1 . 2]" 1
947 1 53 LYS QB 1 54 ALA H . . 4.000 3.859 3.716 3.914 . 0 0 "[ . 1 . 2]" 1
948 1 53 LYS HB2 1 54 ALA H . . 4.620 4.442 4.259 4.592 . 0 0 "[ . 1 . 2]" 1
949 1 53 LYS HB3 1 54 ALA H . . 4.620 4.244 4.025 4.376 . 0 0 "[ . 1 . 2]" 1
950 1 53 LYS QE 1 53 LYS HG2 . . 3.870 2.542 2.097 3.477 . 0 0 "[ . 1 . 2]" 1
951 1 53 LYS QE 1 53 LYS HG3 . . 3.870 2.919 2.078 3.434 . 0 0 "[ . 1 . 2]" 1
952 1 53 LYS HG2 1 54 ALA H . . 4.280 3.474 3.021 4.329 0.049 15 0 "[ . 1 . 2]" 1
953 1 53 LYS HG3 1 54 ALA H . . 4.280 3.666 2.662 4.254 . 0 0 "[ . 1 . 2]" 1
954 1 54 ALA H 1 54 ALA MB . . 2.870 2.344 2.204 2.487 . 0 0 "[ . 1 . 2]" 1
955 1 54 ALA H 1 78 TYR QD . . 5.210 4.456 4.079 4.724 . 0 0 "[ . 1 . 2]" 1
956 1 54 ALA H 1 78 TYR QE . . 4.550 3.651 3.198 3.918 . 0 0 "[ . 1 . 2]" 1
957 1 54 ALA HA 1 55 GLU H . . 2.680 2.155 2.142 2.215 . 0 0 "[ . 1 . 2]" 1
958 1 54 ALA HA 1 71 LEU H . . 4.880 4.402 4.277 4.500 . 0 0 "[ . 1 . 2]" 1
959 1 54 ALA MB 1 55 GLU H . . 3.310 3.149 2.889 3.313 0.003 15 0 "[ . 1 . 2]" 1
960 1 54 ALA MB 1 70 TYR H . . 5.500 5.439 5.297 5.510 0.010 18 0 "[ . 1 . 2]" 1
961 1 54 ALA MB 1 70 TYR HA . . 4.200 3.877 3.571 4.047 . 0 0 "[ . 1 . 2]" 1
962 1 54 ALA MB 1 70 TYR HB2 . . 3.660 2.530 2.305 2.678 . 0 0 "[ . 1 . 2]" 1
963 1 54 ALA MB 1 70 TYR HB3 . . 4.210 4.045 3.878 4.146 . 0 0 "[ . 1 . 2]" 1
964 1 54 ALA MB 1 70 TYR QD . . 3.770 2.458 2.251 2.794 . 0 0 "[ . 1 . 2]" 1
965 1 54 ALA MB 1 71 LEU H . . 3.470 3.013 2.471 3.228 . 0 0 "[ . 1 . 2]" 1
966 1 54 ALA MB 1 72 PRO HA . . 3.120 1.937 1.855 1.981 . 0 0 "[ . 1 . 2]" 1
967 1 54 ALA MB 1 72 PRO QB . . 4.560 3.087 2.778 3.428 . 0 0 "[ . 1 . 2]" 1
968 1 54 ALA MB 1 72 PRO HD2 . . 5.090 4.351 4.177 4.657 . 0 0 "[ . 1 . 2]" 1
969 1 54 ALA MB 1 72 PRO QD . . 4.310 3.380 3.186 3.674 . 0 0 "[ . 1 . 2]" 1
970 1 54 ALA MB 1 72 PRO HD3 . . 5.090 3.523 3.301 3.865 . 0 0 "[ . 1 . 2]" 1
971 1 54 ALA MB 1 73 THR H . . 3.570 3.561 3.527 3.582 0.012 10 0 "[ . 1 . 2]" 1
972 1 54 ALA MB 1 78 TYR QD . . 4.480 3.434 3.086 3.767 . 0 0 "[ . 1 . 2]" 1
973 1 54 ALA MB 1 78 TYR QE . . 3.850 2.544 2.236 2.956 . 0 0 "[ . 1 . 2]" 1
974 1 55 GLU H 1 55 GLU QB . . 2.770 2.291 2.178 2.443 . 0 0 "[ . 1 . 2]" 1
975 1 55 GLU H 1 55 GLU HG2 . . 4.060 3.156 2.286 4.042 . 0 0 "[ . 1 . 2]" 1
976 1 55 GLU H 1 55 GLU QG . . 3.470 2.627 2.266 3.252 . 0 0 "[ . 1 . 2]" 1
977 1 55 GLU H 1 55 GLU HG3 . . 4.060 3.362 2.467 3.955 . 0 0 "[ . 1 . 2]" 1
978 1 55 GLU H 1 71 LEU H . . 4.050 3.693 3.475 3.931 . 0 0 "[ . 1 . 2]" 1
979 1 55 GLU H 1 71 LEU HB3 . . 4.620 3.971 3.636 4.318 . 0 0 "[ . 1 . 2]" 1
980 1 55 GLU H 1 71 LEU MD2 . . 5.420 4.523 4.058 4.858 . 0 0 "[ . 1 . 2]" 1
981 1 55 GLU HA 1 55 GLU HG2 . . 4.140 3.103 2.495 4.234 0.094 2 0 "[ . 1 . 2]" 1
982 1 55 GLU HA 1 55 GLU HG3 . . 4.140 3.350 2.243 4.167 0.027 8 0 "[ . 1 . 2]" 1
983 1 55 GLU HA 1 56 ILE H . . 2.540 2.216 2.142 2.310 . 0 0 "[ . 1 . 2]" 1
984 1 55 GLU HA 1 56 ILE HB . . 4.770 4.754 4.704 4.776 0.006 19 0 "[ . 1 . 2]" 1
985 1 55 GLU HA 1 56 ILE HG13 . . 4.050 3.334 3.141 3.531 . 0 0 "[ . 1 . 2]" 1
986 1 55 GLU QB 1 56 ILE H . . 3.310 2.988 2.709 3.300 . 0 0 "[ . 1 . 2]" 1
987 1 55 GLU QG 1 56 ILE H . . 4.020 3.889 3.528 4.021 0.001 16 0 "[ . 1 . 2]" 1
988 1 55 GLU HG2 1 56 ILE H . . 4.760 4.388 3.719 4.765 0.005 2 0 "[ . 1 . 2]" 1
989 1 55 GLU HG3 1 56 ILE H . . 4.760 4.449 3.888 4.765 0.005 1 0 "[ . 1 . 2]" 1
990 1 56 ILE H 1 56 ILE HB . . 2.950 2.754 2.616 2.888 . 0 0 "[ . 1 . 2]" 1
991 1 56 ILE H 1 56 ILE HG12 . . 4.140 3.910 3.770 4.027 . 0 0 "[ . 1 . 2]" 1
992 1 56 ILE H 1 56 ILE HG13 . . 3.480 2.488 2.314 2.644 . 0 0 "[ . 1 . 2]" 1
993 1 56 ILE H 1 56 ILE MG . . 3.960 3.891 3.833 3.950 . 0 0 "[ . 1 . 2]" 1
994 1 56 ILE H 1 57 THR H . . 4.520 4.345 4.173 4.462 . 0 0 "[ . 1 . 2]" 1
995 1 56 ILE H 1 57 THR HA . . 5.140 4.913 4.715 5.082 . 0 0 "[ . 1 . 2]" 1
996 1 56 ILE H 1 68 VAL MG1 . . 5.500 5.489 5.454 5.509 0.009 15 0 "[ . 1 . 2]" 1
997 1 56 ILE H 1 70 TYR HA . . 5.130 4.863 4.679 5.029 . 0 0 "[ . 1 . 2]" 1
998 1 56 ILE HA 1 56 ILE MG . . 3.710 2.219 2.194 2.263 . 0 0 "[ . 1 . 2]" 1
999 1 56 ILE HA 1 57 THR H . . 2.880 2.148 2.139 2.167 . 0 0 "[ . 1 . 2]" 1
1000 1 56 ILE HA 1 69 SER H . . 4.930 4.164 3.972 4.463 . 0 0 "[ . 1 . 2]" 1
1001 1 56 ILE HA 1 70 TYR HA . . 3.940 2.591 2.345 2.718 . 0 0 "[ . 1 . 2]" 1
1002 1 56 ILE HA 1 71 LEU H . . 4.440 4.225 3.968 4.391 . 0 0 "[ . 1 . 2]" 1
1003 1 56 ILE HB 1 56 ILE MD . . 3.110 2.228 2.122 2.347 . 0 0 "[ . 1 . 2]" 1
1004 1 56 ILE HB 1 57 THR H . . 4.290 4.092 3.993 4.180 . 0 0 "[ . 1 . 2]" 1
1005 1 56 ILE HG12 1 57 THR H . . 4.840 4.742 4.578 4.848 0.008 5 0 "[ . 1 . 2]" 1
1006 1 56 ILE HG12 1 70 TYR HA . . 4.620 3.911 3.659 4.157 . 0 0 "[ . 1 . 2]" 1
1007 1 56 ILE HG12 1 70 TYR HB2 . . 4.400 2.963 2.664 3.324 . 0 0 "[ . 1 . 2]" 1
1008 1 56 ILE HG12 1 70 TYR HB3 . . 4.290 2.713 2.371 3.025 . 0 0 "[ . 1 . 2]" 1
1009 1 56 ILE HG13 1 56 ILE MG . . 3.330 3.164 3.148 3.182 . 0 0 "[ . 1 . 2]" 1
1010 1 56 ILE HG13 1 57 THR H . . 5.170 4.952 4.897 5.048 . 0 0 "[ . 1 . 2]" 1
1011 1 56 ILE HG13 1 70 TYR HB2 . . 4.810 3.659 3.296 4.047 . 0 0 "[ . 1 . 2]" 1
1012 1 56 ILE HG13 1 70 TYR HB3 . . 4.690 4.055 3.706 4.434 . 0 0 "[ . 1 . 2]" 1
1013 1 56 ILE MG 1 57 THR H . . 3.210 2.696 2.517 2.922 . 0 0 "[ . 1 . 2]" 1
1014 1 56 ILE MG 1 58 CYS H . . 5.300 4.540 3.528 5.303 0.003 18 0 "[ . 1 . 2]" 1
1015 1 56 ILE MG 1 58 CYS QB . . 4.300 3.978 3.523 4.304 0.004 16 0 "[ . 1 . 2]" 1
1016 1 56 ILE MG 1 68 VAL MG1 . . 3.100 1.741 1.667 1.823 . 0 0 "[ . 1 . 2]" 1
1017 1 56 ILE MG 1 69 SER H . . 4.290 3.228 2.901 3.632 . 0 0 "[ . 1 . 2]" 1
1018 1 56 ILE MG 1 70 TYR H . . 5.170 4.408 4.136 4.559 . 0 0 "[ . 1 . 2]" 1
1019 1 56 ILE MG 1 71 LEU H . . 5.500 5.464 5.261 5.507 0.007 18 0 "[ . 1 . 2]" 1
1020 1 57 THR H 1 57 THR HB . . 3.450 2.819 2.578 3.507 0.057 12 0 "[ . 1 . 2]" 1
1021 1 57 THR H 1 57 THR MG . . 4.100 3.560 2.339 3.911 . 0 0 "[ . 1 . 2]" 1
1022 1 57 THR H 1 58 CYS H . . 5.050 4.403 4.079 4.573 . 0 0 "[ . 1 . 2]" 1
1023 1 57 THR H 1 68 VAL MG1 . . 3.940 2.981 2.737 3.179 . 0 0 "[ . 1 . 2]" 1
1024 1 57 THR H 1 69 SER H . . 3.530 2.705 2.462 2.862 . 0 0 "[ . 1 . 2]" 1
1025 1 57 THR H 1 69 SER HB2 . . 5.000 3.922 3.473 4.224 . 0 0 "[ . 1 . 2]" 1
1026 1 57 THR H 1 69 SER HB3 . . 5.490 5.228 4.838 5.455 . 0 0 "[ . 1 . 2]" 1
1027 1 57 THR H 1 70 TYR HA . . 3.810 3.659 3.490 3.798 . 0 0 "[ . 1 . 2]" 1
1028 1 57 THR H 1 70 TYR HB2 . . 5.500 5.398 5.233 5.503 0.003 10 0 "[ . 1 . 2]" 1
1029 1 57 THR H 1 70 TYR HB3 . . 4.770 4.713 4.567 4.773 0.003 18 0 "[ . 1 . 2]" 1
1030 1 57 THR H 1 71 LEU H . . 5.500 5.352 5.089 5.507 0.007 2 0 "[ . 1 . 2]" 1
1031 1 57 THR HA 1 57 THR MG . . 3.630 2.373 2.119 3.185 . 0 0 "[ . 1 . 2]" 1
1032 1 57 THR HA 1 58 CYS H . . 3.150 2.268 2.142 2.651 . 0 0 "[ . 1 . 2]" 1
1033 1 57 THR HB 1 58 CYS H . . 4.400 3.718 1.921 4.395 . 0 0 "[ . 1 . 2]" 1
1034 1 57 THR HB 1 69 SER H . . 4.180 3.513 2.841 4.182 0.002 1 0 "[ . 1 . 2]" 1
1035 1 57 THR MG 1 58 CYS H . . 4.120 2.785 2.081 3.432 . 0 0 "[ . 1 . 2]" 1
1036 1 57 THR MG 1 69 SER H . . 5.010 4.153 1.838 4.674 . 0 0 "[ . 1 . 2]" 1
1037 1 58 CYS H 1 58 CYS HB2 . . 4.150 3.521 2.255 3.979 . 0 0 "[ . 1 . 2]" 1
1038 1 58 CYS H 1 58 CYS QB . . 3.600 2.792 2.230 3.258 . 0 0 "[ . 1 . 2]" 1
1039 1 58 CYS H 1 58 CYS HB3 . . 4.150 3.041 2.650 3.549 . 0 0 "[ . 1 . 2]" 1
1040 1 58 CYS HA 1 59 LYS H . . 2.790 2.209 2.138 2.391 . 0 0 "[ . 1 . 2]" 1
1041 1 58 CYS HA 1 68 VAL HA . . 4.830 2.730 2.110 3.253 . 0 0 "[ . 1 . 2]" 1
1042 1 58 CYS HA 1 68 VAL MG2 . . 4.540 2.375 2.080 2.726 . 0 0 "[ . 1 . 2]" 1
1043 1 58 CYS HA 1 69 SER H . . 4.940 4.243 3.749 4.762 . 0 0 "[ . 1 . 2]" 1
1044 1 58 CYS QB 1 59 LYS H . . 3.710 3.067 2.462 3.729 0.019 1 0 "[ . 1 . 2]" 1
1045 1 58 CYS HB2 1 59 LYS H . . 4.350 3.332 2.491 4.332 . 0 0 "[ . 1 . 2]" 1
1046 1 58 CYS HB3 1 59 LYS H . . 4.350 3.984 2.920 4.334 . 0 0 "[ . 1 . 2]" 1
1047 1 59 LYS H 1 59 LYS HB2 . . 3.540 2.688 2.320 3.122 . 0 0 "[ . 1 . 2]" 1
1048 1 59 LYS H 1 59 LYS QB . . 3.020 2.494 2.290 2.692 . 0 0 "[ . 1 . 2]" 1
1049 1 59 LYS H 1 59 LYS HB3 . . 3.540 3.155 2.788 3.576 0.036 9 0 "[ . 1 . 2]" 1
1050 1 59 LYS H 1 59 LYS HG2 . . 4.970 4.656 4.339 4.982 0.012 8 0 "[ . 1 . 2]" 1
1051 1 59 LYS H 1 59 LYS QG . . 4.290 3.982 3.270 4.245 . 0 0 "[ . 1 . 2]" 1
1052 1 59 LYS H 1 59 LYS HG3 . . 4.970 4.385 3.382 4.961 . 0 0 "[ . 1 . 2]" 1
1053 1 59 LYS H 1 66 CYS HA . . 5.260 4.643 4.348 4.889 . 0 0 "[ . 1 . 2]" 1
1054 1 59 LYS H 1 66 CYS QB . . 4.520 4.357 3.867 4.520 0.000 2 0 "[ . 1 . 2]" 1
1055 1 59 LYS H 1 67 THR H . . 3.580 3.396 2.789 3.585 0.005 14 0 "[ . 1 . 2]" 1
1056 1 59 LYS H 1 67 THR HB . . 3.950 3.814 3.596 3.943 . 0 0 "[ . 1 . 2]" 1
1057 1 59 LYS H 1 67 THR MG . . 4.530 4.401 4.196 4.528 . 0 0 "[ . 1 . 2]" 1
1058 1 59 LYS H 1 68 VAL HA . . 4.120 3.661 3.173 4.123 0.003 18 0 "[ . 1 . 2]" 1
1059 1 59 LYS H 1 68 VAL MG2 . . 4.070 3.252 2.951 3.505 . 0 0 "[ . 1 . 2]" 1
1060 1 59 LYS HA 1 60 ASP H . . 2.890 2.285 2.195 2.390 . 0 0 "[ . 1 . 2]" 1
1061 1 59 LYS QB 1 60 ASP H . . 3.750 3.143 2.507 3.603 . 0 0 "[ . 1 . 2]" 1
1062 1 59 LYS QB 1 61 ASN H . . 5.140 4.708 4.316 4.939 . 0 0 "[ . 1 . 2]" 1
1063 1 59 LYS QB 1 67 THR H . . 3.810 2.988 2.755 3.317 . 0 0 "[ . 1 . 2]" 1
1064 1 59 LYS QB 1 67 THR HB . . 3.410 1.995 1.967 2.127 . 0 0 "[ . 1 . 2]" 1
1065 1 59 LYS QB 1 67 THR MG . . 4.060 2.963 2.746 3.272 . 0 0 "[ . 1 . 2]" 1
1066 1 59 LYS HB2 1 60 ASP H . . 4.440 4.116 3.908 4.268 . 0 0 "[ . 1 . 2]" 1
1067 1 59 LYS HB2 1 67 THR H . . 4.450 3.935 3.015 4.451 0.001 15 0 "[ . 1 . 2]" 1
1068 1 59 LYS HB2 1 67 THR HB . . 3.970 2.666 2.003 3.302 . 0 0 "[ . 1 . 2]" 1
1069 1 59 LYS HB2 1 67 THR MG . . 4.630 3.208 2.862 3.469 . 0 0 "[ . 1 . 2]" 1
1070 1 59 LYS HB3 1 60 ASP H . . 4.440 3.293 2.538 3.932 . 0 0 "[ . 1 . 2]" 1
1071 1 59 LYS HB3 1 67 THR H . . 4.450 3.285 2.799 4.074 . 0 0 "[ . 1 . 2]" 1
1072 1 59 LYS HB3 1 67 THR HB . . 3.970 2.334 1.998 3.148 . 0 0 "[ . 1 . 2]" 1
1073 1 59 LYS HB3 1 67 THR MG . . 4.630 3.601 3.032 4.417 . 0 0 "[ . 1 . 2]" 1
1074 1 59 LYS QD 1 67 THR MG . . 4.850 3.566 2.136 4.848 . 0 0 "[ . 1 . 2]" 1
1075 1 59 LYS QE 1 59 LYS HG2 . . 3.830 2.672 2.160 3.477 . 0 0 "[ . 1 . 2]" 1
1076 1 59 LYS QE 1 59 LYS HG3 . . 3.830 2.618 2.163 3.472 . 0 0 "[ . 1 . 2]" 1
1077 1 59 LYS QG 1 60 ASP H . . 4.000 2.664 1.895 3.517 . 0 0 "[ . 1 . 2]" 1
1078 1 59 LYS QG 1 67 THR HB . . 4.650 3.693 3.159 4.009 . 0 0 "[ . 1 . 2]" 1
1079 1 59 LYS HG2 1 60 ASP H . . 4.620 3.354 2.044 4.320 . 0 0 "[ . 1 . 2]" 1
1080 1 59 LYS HG3 1 60 ASP H . . 4.620 3.371 1.902 4.525 . 0 0 "[ . 1 . 2]" 1
1081 1 60 ASP H 1 60 ASP HB2 . . 3.730 3.018 2.342 3.659 . 0 0 "[ . 1 . 2]" 1
1082 1 60 ASP H 1 60 ASP QB . . 3.060 2.521 2.216 3.041 . 0 0 "[ . 1 . 2]" 1
1083 1 60 ASP H 1 60 ASP HB3 . . 3.730 3.028 2.258 3.726 . 0 0 "[ . 1 . 2]" 1
1084 1 60 ASP HA 1 61 ASN H . . 2.930 2.150 2.139 2.178 . 0 0 "[ . 1 . 2]" 1
1085 1 60 ASP HA 1 61 ASN HD21 . . 5.270 4.454 3.847 4.894 . 0 0 "[ . 1 . 2]" 1
1086 1 60 ASP HA 1 61 ASN HD22 . . 5.360 5.074 4.722 5.323 . 0 0 "[ . 1 . 2]" 1
1087 1 60 ASP HA 1 66 CYS HA . . 4.520 4.068 3.846 4.312 . 0 0 "[ . 1 . 2]" 1
1088 1 60 ASP HA 1 67 THR H . . 4.790 4.571 4.293 4.792 0.002 9 0 "[ . 1 . 2]" 1
1089 1 60 ASP QB 1 61 ASN H . . 3.750 3.617 3.347 3.766 0.016 10 0 "[ . 1 . 2]" 1
1090 1 60 ASP HB2 1 61 ASN H . . 4.630 4.132 3.563 4.566 . 0 0 "[ . 1 . 2]" 1
1091 1 60 ASP HB3 1 61 ASN H . . 4.630 4.127 3.649 4.480 . 0 0 "[ . 1 . 2]" 1
1092 1 61 ASN H 1 61 ASN HB2 . . 3.780 2.474 2.364 2.598 . 0 0 "[ . 1 . 2]" 1
1093 1 61 ASN H 1 61 ASN QB . . 3.190 2.435 2.333 2.546 . 0 0 "[ . 1 . 2]" 1
1094 1 61 ASN H 1 61 ASN HB3 . . 3.780 3.633 3.590 3.685 . 0 0 "[ . 1 . 2]" 1
1095 1 61 ASN H 1 61 ASN HD21 . . 4.000 2.860 2.469 3.325 . 0 0 "[ . 1 . 2]" 1
1096 1 61 ASN H 1 61 ASN HD22 . . 4.290 3.840 3.496 4.199 . 0 0 "[ . 1 . 2]" 1
1097 1 61 ASN H 1 62 LYS H . . 3.490 2.291 2.164 2.450 . 0 0 "[ . 1 . 2]" 1
1098 1 61 ASN H 1 62 LYS HA . . 4.670 4.529 4.383 4.669 . 0 0 "[ . 1 . 2]" 1
1099 1 61 ASN H 1 63 ASP H . . 4.350 4.186 3.977 4.303 . 0 0 "[ . 1 . 2]" 1
1100 1 61 ASN H 1 66 CYS HA . . 3.610 3.533 3.252 3.620 0.010 14 0 "[ . 1 . 2]" 1
1101 1 61 ASN H 1 67 THR H . . 4.320 4.281 4.181 4.326 0.006 19 0 "[ . 1 . 2]" 1
1102 1 61 ASN HA 1 63 ASP H . . 4.660 4.469 4.160 4.606 . 0 0 "[ . 1 . 2]" 1
1103 1 61 ASN QB 1 61 ASN HD22 . . 3.570 3.244 3.224 3.277 . 0 0 "[ . 1 . 2]" 1
1104 1 61 ASN QB 1 63 ASP H . . 3.320 2.650 2.545 2.733 . 0 0 "[ . 1 . 2]" 1
1105 1 61 ASN QB 1 65 THR H . . 4.110 2.973 2.612 3.216 . 0 0 "[ . 1 . 2]" 1
1106 1 61 ASN HB2 1 62 LYS H . . 5.500 2.908 2.616 3.422 . 0 0 "[ . 1 . 2]" 1
1107 1 61 ASN HB2 1 63 ASP H . . 3.940 2.793 2.628 2.940 . 0 0 "[ . 1 . 2]" 1
1108 1 61 ASN HB2 1 65 THR H . . 4.700 3.030 2.660 3.290 . 0 0 "[ . 1 . 2]" 1
1109 1 61 ASN HB3 1 62 LYS H . . 5.500 3.878 3.581 4.268 . 0 0 "[ . 1 . 2]" 1
1110 1 61 ASN HB3 1 63 ASP H . . 3.940 3.327 3.080 3.597 . 0 0 "[ . 1 . 2]" 1
1111 1 61 ASN HB3 1 65 THR H . . 4.700 4.314 3.801 4.694 . 0 0 "[ . 1 . 2]" 1
1112 1 61 ASN HD21 1 63 ASP H . . 5.360 4.724 4.440 4.982 . 0 0 "[ . 1 . 2]" 1
1113 1 61 ASN HD21 1 65 THR H . . 4.980 3.585 3.205 3.977 . 0 0 "[ . 1 . 2]" 1
1114 1 61 ASN HD21 1 65 THR HB . . 4.890 3.800 3.293 4.469 . 0 0 "[ . 1 . 2]" 1
1115 1 61 ASN HD21 1 66 CYS H . . 5.020 3.471 3.143 3.909 . 0 0 "[ . 1 . 2]" 1
1116 1 61 ASN HD21 1 66 CYS HA . . 4.770 2.233 1.906 2.909 . 0 0 "[ . 1 . 2]" 1
1117 1 61 ASN HD21 1 67 THR H . . 4.210 3.048 2.814 3.336 . 0 0 "[ . 1 . 2]" 1
1118 1 61 ASN HD21 1 67 THR HA . . 5.500 5.024 4.705 5.412 . 0 0 "[ . 1 . 2]" 1
1119 1 61 ASN HD21 1 67 THR HB . . 4.990 4.715 4.171 4.992 0.002 14 0 "[ . 1 . 2]" 1
1120 1 61 ASN HD22 1 65 THR H . . 5.500 5.188 4.809 5.498 . 0 0 "[ . 1 . 2]" 1
1121 1 61 ASN HD22 1 66 CYS HA . . 4.720 2.721 2.298 3.247 . 0 0 "[ . 1 . 2]" 1
1122 1 61 ASN HD22 1 67 THR H . . 3.910 2.151 1.811 2.589 . 0 0 "[ . 1 . 2]" 1
1123 1 61 ASN HD22 1 67 THR HA . . 5.420 3.680 3.309 3.900 . 0 0 "[ . 1 . 2]" 1
1124 1 61 ASN HD22 1 67 THR HB . . 4.720 3.181 2.679 3.564 . 0 0 "[ . 1 . 2]" 1
1125 1 61 ASN HD22 1 67 THR MG . . 4.860 4.198 3.902 4.523 . 0 0 "[ . 1 . 2]" 1
1126 1 62 LYS H 1 62 LYS HG2 . . 5.170 4.298 2.888 5.167 . 0 0 "[ . 1 . 2]" 1
1127 1 62 LYS H 1 62 LYS QG . . 4.450 3.654 2.807 4.391 . 0 0 "[ . 1 . 2]" 1
1128 1 62 LYS H 1 62 LYS HG3 . . 5.170 4.176 3.019 4.934 . 0 0 "[ . 1 . 2]" 1
1129 1 62 LYS H 1 63 ASP H . . 3.870 2.683 2.471 2.991 . 0 0 "[ . 1 . 2]" 1
1130 1 62 LYS HA 1 62 LYS HD2 . . 4.540 3.432 2.002 4.577 0.037 9 0 "[ . 1 . 2]" 1
1131 1 62 LYS HA 1 62 LYS QD . . 3.900 3.022 1.969 3.991 0.091 9 0 "[ . 1 . 2]" 1
1132 1 62 LYS HA 1 62 LYS HD3 . . 4.540 3.691 2.291 4.611 0.071 7 0 "[ . 1 . 2]" 1
1133 1 62 LYS HA 1 62 LYS QG . . 3.610 2.405 2.116 3.461 . 0 0 "[ . 1 . 2]" 1
1134 1 62 LYS HA 1 64 GLY H . . 4.630 4.154 3.704 4.626 . 0 0 "[ . 1 . 2]" 1
1135 1 62 LYS QB 1 62 LYS QD . . 3.320 2.236 2.095 2.500 . 0 0 "[ . 1 . 2]" 1
1136 1 62 LYS QB 1 63 ASP H . . 4.300 3.793 3.730 3.980 . 0 0 "[ . 1 . 2]" 1
1137 1 62 LYS HB2 1 63 ASP H . . 4.940 4.331 4.128 4.505 . 0 0 "[ . 1 . 2]" 1
1138 1 62 LYS HB3 1 63 ASP H . . 4.940 4.222 4.014 4.669 . 0 0 "[ . 1 . 2]" 1
1139 1 63 ASP H 1 63 ASP HB2 . . 3.810 2.878 2.469 3.722 . 0 0 "[ . 1 . 2]" 1
1140 1 63 ASP H 1 63 ASP QB . . 3.340 2.537 2.338 3.092 . 0 0 "[ . 1 . 2]" 1
1141 1 63 ASP H 1 63 ASP HB3 . . 3.810 3.175 2.388 3.737 . 0 0 "[ . 1 . 2]" 1
1142 1 63 ASP H 1 64 GLY H . . 3.090 1.858 1.781 2.002 . 0 0 "[ . 1 . 2]" 1
1143 1 63 ASP H 1 64 GLY HA2 . . 4.710 4.223 4.119 4.442 . 0 0 "[ . 1 . 2]" 1
1144 1 63 ASP H 1 64 GLY QA . . 4.140 3.905 3.844 4.057 . 0 0 "[ . 1 . 2]" 1
1145 1 63 ASP H 1 64 GLY HA3 . . 4.710 4.602 4.551 4.687 . 0 0 "[ . 1 . 2]" 1
1146 1 63 ASP H 1 65 THR H . . 3.350 3.085 2.880 3.229 . 0 0 "[ . 1 . 2]" 1
1147 1 63 ASP H 1 65 THR MG . . 5.360 5.193 5.030 5.360 . 0 0 "[ . 1 . 2]" 1
1148 1 63 ASP QB 1 65 THR H . . 4.430 3.855 3.184 4.428 . 0 0 "[ . 1 . 2]" 1
1149 1 63 ASP HB2 1 64 GLY H . . 5.370 3.535 2.664 4.345 . 0 0 "[ . 1 . 2]" 1
1150 1 63 ASP HB3 1 64 GLY H . . 5.370 3.317 2.514 4.301 . 0 0 "[ . 1 . 2]" 1
1151 1 64 GLY H 1 65 THR H . . 3.160 1.810 1.781 2.006 . 0 0 "[ . 1 . 2]" 1
1152 1 65 THR H 1 65 THR MG . . 3.540 3.150 2.713 3.274 . 0 0 "[ . 1 . 2]" 1
1153 1 65 THR H 1 66 CYS H . . 4.650 4.378 4.356 4.455 . 0 0 "[ . 1 . 2]" 1
1154 1 65 THR H 1 66 CYS HA . . 5.500 4.690 4.643 4.854 . 0 0 "[ . 1 . 2]" 1
1155 1 65 THR HA 1 65 THR MG . . 3.500 2.329 2.256 2.457 . 0 0 "[ . 1 . 2]" 1
1156 1 65 THR HA 1 66 CYS H . . 2.860 2.574 2.421 2.649 . 0 0 "[ . 1 . 2]" 1
1157 1 65 THR HB 1 66 CYS H . . 3.160 2.065 1.922 2.385 . 0 0 "[ . 1 . 2]" 1
1158 1 65 THR MG 1 66 CYS H . . 3.780 3.589 3.481 3.778 . 0 0 "[ . 1 . 2]" 1
1159 1 66 CYS H 1 66 CYS HB2 . . 3.780 2.736 2.495 3.015 . 0 0 "[ . 1 . 2]" 1
1160 1 66 CYS H 1 66 CYS HB3 . . 3.780 3.591 2.992 3.783 0.003 14 0 "[ . 1 . 2]" 1
1161 1 66 CYS H 1 67 THR HA . . 5.500 4.628 4.510 4.836 . 0 0 "[ . 1 . 2]" 1
1162 1 66 CYS HA 1 67 THR H . . 2.720 2.156 2.137 2.230 . 0 0 "[ . 1 . 2]" 1
1163 1 66 CYS HA 1 67 THR HB . . 4.740 4.579 4.389 4.684 . 0 0 "[ . 1 . 2]" 1
1164 1 66 CYS QB 1 67 THR H . . 3.490 3.408 3.183 3.510 0.020 2 0 "[ . 1 . 2]" 1
1165 1 66 CYS HB2 1 68 VAL MG2 . . 4.460 4.016 3.730 4.438 . 0 0 "[ . 1 . 2]" 1
1166 1 66 CYS HB3 1 68 VAL MG2 . . 4.460 2.922 2.697 3.115 . 0 0 "[ . 1 . 2]" 1
1167 1 67 THR H 1 67 THR HB . . 3.020 2.491 2.422 2.558 . 0 0 "[ . 1 . 2]" 1
1168 1 67 THR H 1 67 THR MG . . 3.990 3.781 3.721 3.802 . 0 0 "[ . 1 . 2]" 1
1169 1 67 THR H 1 68 VAL MG2 . . 4.940 4.050 3.921 4.171 . 0 0 "[ . 1 . 2]" 1
1170 1 67 THR HA 1 67 THR MG . . 3.700 2.377 2.307 2.490 . 0 0 "[ . 1 . 2]" 1
1171 1 67 THR HA 1 68 VAL H . . 2.780 2.152 2.141 2.184 . 0 0 "[ . 1 . 2]" 1
1172 1 67 THR HA 1 68 VAL MG2 . . 4.730 3.642 3.467 3.842 . 0 0 "[ . 1 . 2]" 1
1173 1 67 THR HB 1 68 VAL H . . 4.630 4.332 4.178 4.508 . 0 0 "[ . 1 . 2]" 1
1174 1 67 THR HB 1 68 VAL HA . . 5.090 4.846 4.751 5.085 . 0 0 "[ . 1 . 2]" 1
1175 1 67 THR MG 1 68 VAL H . . 3.230 2.738 2.246 3.067 . 0 0 "[ . 1 . 2]" 1
1176 1 67 THR MG 1 68 VAL HA . . 4.320 3.670 3.486 3.784 . 0 0 "[ . 1 . 2]" 1
1177 1 67 THR MG 1 69 SER H . . 5.490 4.687 4.520 4.882 . 0 0 "[ . 1 . 2]" 1
1178 1 68 VAL H 1 68 VAL HB . . 3.210 2.736 2.629 2.829 . 0 0 "[ . 1 . 2]" 1
1179 1 68 VAL H 1 68 VAL MG1 . . 4.300 3.893 3.849 3.933 . 0 0 "[ . 1 . 2]" 1
1180 1 68 VAL H 1 68 VAL MG2 . . 3.160 2.652 2.343 2.899 . 0 0 "[ . 1 . 2]" 1
1181 1 68 VAL H 1 69 SER H . . 4.540 4.465 4.398 4.527 . 0 0 "[ . 1 . 2]" 1
1182 1 68 VAL HA 1 68 VAL MG1 . . 3.590 2.299 2.200 2.380 . 0 0 "[ . 1 . 2]" 1
1183 1 68 VAL HA 1 68 VAL MG2 . . 3.610 2.412 2.350 2.486 . 0 0 "[ . 1 . 2]" 1
1184 1 68 VAL HA 1 69 SER H . . 2.690 2.270 2.197 2.309 . 0 0 "[ . 1 . 2]" 1
1185 1 68 VAL HB 1 69 SER H . . 4.370 3.769 3.662 3.968 . 0 0 "[ . 1 . 2]" 1
1186 1 68 VAL MG1 1 69 SER H . . 3.060 2.000 1.880 2.135 . 0 0 "[ . 1 . 2]" 1
1187 1 68 VAL MG1 1 69 SER HA . . 4.170 3.498 3.402 3.633 . 0 0 "[ . 1 . 2]" 1
1188 1 68 VAL MG1 1 69 SER HB2 . . 4.750 4.518 4.419 4.591 . 0 0 "[ . 1 . 2]" 1
1189 1 68 VAL MG1 1 69 SER HB3 . . 5.400 5.089 5.008 5.172 . 0 0 "[ . 1 . 2]" 1
1190 1 68 VAL MG1 1 70 TYR HA . . 5.500 4.547 4.424 4.766 . 0 0 "[ . 1 . 2]" 1
1191 1 68 VAL MG1 1 70 TYR HB3 . . 5.190 3.761 3.530 4.028 . 0 0 "[ . 1 . 2]" 1
1192 1 68 VAL MG2 1 69 SER H . . 4.420 3.925 3.847 4.012 . 0 0 "[ . 1 . 2]" 1
1193 1 69 SER H 1 69 SER HB2 . . 3.690 2.978 2.831 3.095 . 0 0 "[ . 1 . 2]" 1
1194 1 69 SER H 1 69 SER HB3 . . 4.110 3.937 3.863 3.963 . 0 0 "[ . 1 . 2]" 1
1195 1 69 SER H 1 70 TYR H . . 4.510 4.238 4.169 4.335 . 0 0 "[ . 1 . 2]" 1
1196 1 69 SER HA 1 70 TYR H . . 2.690 2.169 2.146 2.241 . 0 0 "[ . 1 . 2]" 1
1197 1 69 SER HB2 1 70 TYR H . . 4.140 3.991 3.710 4.113 . 0 0 "[ . 1 . 2]" 1
1198 1 69 SER HB3 1 70 TYR H . . 3.660 3.232 2.929 3.429 . 0 0 "[ . 1 . 2]" 1
1199 1 70 TYR H 1 70 TYR HB2 . . 4.180 3.806 3.776 3.859 . 0 0 "[ . 1 . 2]" 1
1200 1 70 TYR H 1 70 TYR HB3 . . 4.130 2.900 2.813 3.077 . 0 0 "[ . 1 . 2]" 1
1201 1 70 TYR H 1 70 TYR QD . . 3.690 2.959 2.816 3.196 . 0 0 "[ . 1 . 2]" 1
1202 1 70 TYR H 1 71 LEU H . . 4.410 4.399 4.364 4.431 0.021 10 0 "[ . 1 . 2]" 1
1203 1 70 TYR H 1 71 LEU HA . . 4.900 4.880 4.811 4.921 0.021 16 0 "[ . 1 . 2]" 1
1204 1 70 TYR HA 1 71 LEU H . . 2.820 2.181 2.151 2.268 . 0 0 "[ . 1 . 2]" 1
1205 1 70 TYR HA 1 71 LEU HB3 . . 4.490 4.442 4.388 4.488 . 0 0 "[ . 1 . 2]" 1
1206 1 70 TYR HB2 1 71 LEU H . . 3.420 3.164 2.809 3.313 . 0 0 "[ . 1 . 2]" 1
1207 1 70 TYR HB3 1 71 LEU H . . 4.310 4.254 4.039 4.310 . 0 0 "[ . 1 . 2]" 1
1208 1 70 TYR QD 1 71 LEU H . . 4.510 3.465 3.243 3.734 . 0 0 "[ . 1 . 2]" 1
1209 1 70 TYR QD 1 72 PRO HD2 . . 4.790 3.626 3.542 3.754 . 0 0 "[ . 1 . 2]" 1
1210 1 70 TYR QD 1 72 PRO HD3 . . 4.790 2.022 1.995 2.117 . 0 0 "[ . 1 . 2]" 1
1211 1 70 TYR QE 1 80 ILE MD . . 4.110 2.462 2.132 2.675 . 0 0 "[ . 1 . 2]" 1
1212 1 70 TYR QE 1 96 ALA MB . . 4.920 3.275 3.067 3.556 . 0 0 "[ . 1 . 2]" 1
1213 1 70 TYR QE 1 98 ILE MD . . 4.270 2.470 2.115 2.802 . 0 0 "[ . 1 . 2]" 1
1214 1 70 TYR HH 1 80 ILE MD . . 3.500 3.308 2.709 3.504 0.004 6 0 "[ . 1 . 2]" 1
1215 1 70 TYR HH 1 98 ILE MD . . 4.220 2.526 2.079 2.910 . 0 0 "[ . 1 . 2]" 1
1216 1 71 LEU H 1 71 LEU HB2 . . 3.700 3.023 2.960 3.099 . 0 0 "[ . 1 . 2]" 1
1217 1 71 LEU H 1 71 LEU HB3 . . 3.070 2.441 2.395 2.539 . 0 0 "[ . 1 . 2]" 1
1218 1 71 LEU H 1 71 LEU MD1 . . 4.460 4.427 4.341 4.464 0.004 10 0 "[ . 1 . 2]" 1
1219 1 71 LEU H 1 71 LEU MD2 . . 4.470 4.206 4.146 4.265 . 0 0 "[ . 1 . 2]" 1
1220 1 71 LEU H 1 71 LEU HG . . 4.460 4.357 4.291 4.409 . 0 0 "[ . 1 . 2]" 1
1221 1 71 LEU H 1 72 PRO HD2 . . 4.800 4.589 4.563 4.639 . 0 0 "[ . 1 . 2]" 1
1222 1 71 LEU H 1 72 PRO HD3 . . 4.800 4.172 4.112 4.261 . 0 0 "[ . 1 . 2]" 1
1223 1 71 LEU HA 1 71 LEU MD1 . . 3.400 2.539 2.326 2.673 . 0 0 "[ . 1 . 2]" 1
1224 1 71 LEU HA 1 71 LEU MD2 . . 4.210 3.972 3.953 3.993 . 0 0 "[ . 1 . 2]" 1
1225 1 71 LEU HA 1 72 PRO HD2 . . 3.810 1.912 1.911 1.916 . 0 0 "[ . 1 . 2]" 1
1226 1 71 LEU HA 1 72 PRO QD . . 3.320 1.854 1.851 1.858 . 0 0 "[ . 1 . 2]" 1
1227 1 71 LEU HA 1 72 PRO HD3 . . 3.810 2.500 2.444 2.526 . 0 0 "[ . 1 . 2]" 1
1228 1 71 LEU HB2 1 71 LEU MD1 . . 3.120 2.111 2.000 2.242 . 0 0 "[ . 1 . 2]" 1
1229 1 71 LEU HB2 1 71 LEU MD2 . . 3.130 2.605 2.466 2.707 . 0 0 "[ . 1 . 2]" 1
1230 1 71 LEU HB2 1 72 PRO QD . . 5.180 3.908 3.860 3.955 . 0 0 "[ . 1 . 2]" 1
1231 1 71 LEU HB3 1 71 LEU MD1 . . 3.520 3.127 3.107 3.162 . 0 0 "[ . 1 . 2]" 1
1232 1 71 LEU HB3 1 71 LEU MD2 . . 3.250 2.150 1.965 2.226 . 0 0 "[ . 1 . 2]" 1
1233 1 71 LEU MD1 1 72 PRO QD . . 4.230 2.930 2.629 3.131 . 0 0 "[ . 1 . 2]" 1
1234 1 71 LEU MD1 1 72 PRO HG2 . . 4.580 4.236 3.805 4.401 . 0 0 "[ . 1 . 2]" 1
1235 1 71 LEU HG 1 72 PRO QD . . 4.880 3.454 3.203 3.682 . 0 0 "[ . 1 . 2]" 1
1236 1 72 PRO HA 1 73 THR H . . 2.740 2.323 2.280 2.405 . 0 0 "[ . 1 . 2]" 1
1237 1 72 PRO HA 1 74 ALA H . . 4.110 3.964 3.781 4.087 . 0 0 "[ . 1 . 2]" 1
1238 1 72 PRO HA 1 78 TYR QE . . 4.530 3.270 2.918 3.674 . 0 0 "[ . 1 . 2]" 1
1239 1 72 PRO QB 1 73 THR H . . 3.560 2.718 2.527 2.824 . 0 0 "[ . 1 . 2]" 1
1240 1 72 PRO QB 1 74 ALA H . . 3.790 3.002 2.645 3.158 . 0 0 "[ . 1 . 2]" 1
1241 1 72 PRO QB 1 78 TYR QE . . 4.250 2.677 2.496 2.914 . 0 0 "[ . 1 . 2]" 1
1242 1 72 PRO QB 1 98 ILE HG13 . . 3.950 2.822 2.505 3.069 . 0 0 "[ . 1 . 2]" 1
1243 1 72 PRO QB 1 98 ILE MG . . 3.310 2.508 2.234 2.854 . 0 0 "[ . 1 . 2]" 1
1244 1 72 PRO HB2 1 73 THR H . . 4.100 2.820 2.599 2.944 . 0 0 "[ . 1 . 2]" 1
1245 1 72 PRO HB2 1 98 ILE HG13 . . 4.550 3.578 3.386 3.771 . 0 0 "[ . 1 . 2]" 1
1246 1 72 PRO HB2 1 98 ILE MG . . 4.060 2.601 2.302 2.990 . 0 0 "[ . 1 . 2]" 1
1247 1 72 PRO HB3 1 73 THR H . . 4.100 3.564 3.446 3.632 . 0 0 "[ . 1 . 2]" 1
1248 1 72 PRO HB3 1 98 ILE HG13 . . 4.550 2.958 2.580 3.249 . 0 0 "[ . 1 . 2]" 1
1249 1 72 PRO HB3 1 98 ILE MG . . 4.060 3.301 2.926 3.644 . 0 0 "[ . 1 . 2]" 1
1250 1 72 PRO HG2 1 98 ILE MD . . 4.120 3.602 3.202 3.840 . 0 0 "[ . 1 . 2]" 1
1251 1 72 PRO HG2 1 98 ILE MG . . 3.690 2.788 2.614 3.026 . 0 0 "[ . 1 . 2]" 1
1252 1 72 PRO HG3 1 98 ILE MD . . 3.450 2.220 1.976 2.517 . 0 0 "[ . 1 . 2]" 1
1253 1 72 PRO HG3 1 98 ILE MG . . 3.650 2.511 2.258 2.668 . 0 0 "[ . 1 . 2]" 1
1254 1 73 THR H 1 73 THR HB . . 3.870 2.722 2.608 2.832 . 0 0 "[ . 1 . 2]" 1
1255 1 73 THR H 1 73 THR MG . . 4.060 3.883 3.843 3.922 . 0 0 "[ . 1 . 2]" 1
1256 1 73 THR H 1 74 ALA H . . 2.950 1.936 1.834 2.033 . 0 0 "[ . 1 . 2]" 1
1257 1 73 THR H 1 78 TYR QE . . 4.700 3.646 3.392 3.790 . 0 0 "[ . 1 . 2]" 1
1258 1 73 THR H 1 78 TYR HH . . 4.160 2.755 1.977 3.090 . 0 0 "[ . 1 . 2]" 1
1259 1 73 THR HA 1 73 THR MG . . 3.230 2.234 2.116 2.326 . 0 0 "[ . 1 . 2]" 1
1260 1 73 THR HB 1 74 ALA H . . 4.430 3.032 2.856 3.415 . 0 0 "[ . 1 . 2]" 1
1261 1 73 THR MG 1 74 ALA H . . 4.160 3.940 3.720 4.139 . 0 0 "[ . 1 . 2]" 1
1262 1 74 ALA H 1 74 ALA MB . . 3.140 2.583 2.506 2.734 . 0 0 "[ . 1 . 2]" 1
1263 1 74 ALA H 1 78 TYR QE . . 3.860 3.819 3.677 3.865 0.005 18 0 "[ . 1 . 2]" 1
1264 1 74 ALA H 1 78 TYR HH . . 2.900 2.086 1.984 2.229 . 0 0 "[ . 1 . 2]" 1
1265 1 74 ALA H 1 98 ILE MG . . 4.480 4.426 4.152 4.483 0.003 5 0 "[ . 1 . 2]" 1
1266 1 74 ALA HA 1 75 PRO QD . . 3.720 2.027 1.998 2.066 . 0 0 "[ . 1 . 2]" 1
1267 1 74 ALA MB 1 75 PRO QD . . 3.090 2.291 2.100 2.406 . 0 0 "[ . 1 . 2]" 1
1268 1 74 ALA MB 1 78 TYR HH . . 3.820 3.147 2.915 3.562 . 0 0 "[ . 1 . 2]" 1
1269 1 75 PRO HA 1 76 GLY H . . 2.890 2.199 2.184 2.226 . 0 0 "[ . 1 . 2]" 1
1270 1 75 PRO HA 1 78 TYR QE . . 4.440 3.344 3.214 3.622 . 0 0 "[ . 1 . 2]" 1
1271 1 75 PRO HA 1 98 ILE H . . 4.730 4.441 4.215 4.662 . 0 0 "[ . 1 . 2]" 1
1272 1 75 PRO HA 1 98 ILE HB . . 4.040 2.640 2.226 2.942 . 0 0 "[ . 1 . 2]" 1
1273 1 75 PRO HA 1 98 ILE MG . . 3.610 2.289 1.981 2.517 . 0 0 "[ . 1 . 2]" 1
1274 1 75 PRO HB2 1 76 GLY H . . 3.350 3.265 3.150 3.340 . 0 0 "[ . 1 . 2]" 1
1275 1 75 PRO HB2 1 76 GLY HA3 . . 4.930 4.686 4.611 4.744 . 0 0 "[ . 1 . 2]" 1
1276 1 75 PRO HB2 1 100 GLY H . . 4.240 3.419 2.992 3.954 . 0 0 "[ . 1 . 2]" 1
1277 1 75 PRO HB3 1 76 GLY H . . 4.020 3.828 3.757 3.875 . 0 0 "[ . 1 . 2]" 1
1278 1 75 PRO HB3 1 98 ILE MG . . 4.420 3.354 2.985 3.633 . 0 0 "[ . 1 . 2]" 1
1279 1 75 PRO HB3 1 100 GLY H . . 4.200 2.685 2.032 3.172 . 0 0 "[ . 1 . 2]" 1
1280 1 76 GLY H 1 77 ASP H . . 4.450 4.404 4.374 4.419 . 0 0 "[ . 1 . 2]" 1
1281 1 76 GLY H 1 77 ASP HA . . 4.790 4.768 4.722 4.791 0.001 20 0 "[ . 1 . 2]" 1
1282 1 76 GLY H 1 78 TYR QD . . 4.580 3.986 3.777 4.137 . 0 0 "[ . 1 . 2]" 1
1283 1 76 GLY H 1 78 TYR QE . . 3.900 3.327 3.193 3.484 . 0 0 "[ . 1 . 2]" 1
1284 1 76 GLY H 1 97 LYS HA . . 4.880 4.648 4.424 4.837 . 0 0 "[ . 1 . 2]" 1
1285 1 76 GLY H 1 98 ILE H . . 3.580 2.742 2.543 2.902 . 0 0 "[ . 1 . 2]" 1
1286 1 76 GLY H 1 98 ILE HB . . 3.300 2.155 1.928 2.531 . 0 0 "[ . 1 . 2]" 1
1287 1 76 GLY H 1 98 ILE HG12 . . 4.590 4.208 3.750 4.591 0.001 20 0 "[ . 1 . 2]" 1
1288 1 76 GLY H 1 98 ILE MG . . 3.730 3.289 3.036 3.550 . 0 0 "[ . 1 . 2]" 1
1289 1 76 GLY HA2 1 77 ASP H . . 3.080 2.689 2.618 2.834 . 0 0 "[ . 1 . 2]" 1
1290 1 76 GLY HA2 1 98 ILE H . . 4.920 4.060 3.915 4.256 . 0 0 "[ . 1 . 2]" 1
1291 1 76 GLY HA3 1 77 ASP H . . 2.990 2.443 2.323 2.506 . 0 0 "[ . 1 . 2]" 1
1292 1 77 ASP H 1 77 ASP HB2 . . 3.670 3.380 2.520 3.654 . 0 0 "[ . 1 . 2]" 1
1293 1 77 ASP H 1 77 ASP QB . . 2.970 2.850 2.478 2.942 . 0 0 "[ . 1 . 2]" 1
1294 1 77 ASP H 1 77 ASP HB3 . . 3.670 3.205 2.997 3.676 0.006 14 0 "[ . 1 . 2]" 1
1295 1 77 ASP H 1 78 TYR H . . 4.410 4.276 4.221 4.372 . 0 0 "[ . 1 . 2]" 1
1296 1 77 ASP H 1 95 THR MG . . 5.090 4.988 4.869 5.088 . 0 0 "[ . 1 . 2]" 1
1297 1 77 ASP H 1 98 ILE H . . 5.140 4.820 4.665 5.026 . 0 0 "[ . 1 . 2]" 1
1298 1 77 ASP HA 1 78 TYR H . . 2.730 2.160 2.139 2.177 . 0 0 "[ . 1 . 2]" 1
1299 1 77 ASP HA 1 78 TYR QD . . 4.530 3.804 3.485 4.174 . 0 0 "[ . 1 . 2]" 1
1300 1 77 ASP HA 1 95 THR MG . . 4.230 3.276 3.158 3.456 . 0 0 "[ . 1 . 2]" 1
1301 1 77 ASP HA 1 96 ALA H . . 4.700 4.455 4.195 4.706 0.006 19 0 "[ . 1 . 2]" 1
1302 1 77 ASP HA 1 97 LYS HA . . 4.240 2.671 2.570 2.875 . 0 0 "[ . 1 . 2]" 1
1303 1 77 ASP HA 1 98 ILE H . . 3.960 3.490 3.222 3.759 . 0 0 "[ . 1 . 2]" 1
1304 1 77 ASP QB 1 78 TYR H . . 3.600 3.526 3.383 3.592 . 0 0 "[ . 1 . 2]" 1
1305 1 77 ASP QB 1 95 THR MG . . 3.220 2.087 1.910 2.221 . 0 0 "[ . 1 . 2]" 1
1306 1 77 ASP HB2 1 78 TYR H . . 4.300 3.875 3.656 4.307 0.007 15 0 "[ . 1 . 2]" 1
1307 1 77 ASP HB2 1 95 THR MG . . 3.910 2.372 2.035 3.338 . 0 0 "[ . 1 . 2]" 1
1308 1 77 ASP HB3 1 78 TYR H . . 4.300 4.158 3.537 4.306 0.006 5 0 "[ . 1 . 2]" 1
1309 1 77 ASP HB3 1 95 THR MG . . 3.910 2.707 1.933 3.141 . 0 0 "[ . 1 . 2]" 1
1310 1 78 TYR H 1 78 TYR HB2 . . 3.370 2.299 2.271 2.343 . 0 0 "[ . 1 . 2]" 1
1311 1 78 TYR H 1 78 TYR HB3 . . 3.700 3.568 3.550 3.595 . 0 0 "[ . 1 . 2]" 1
1312 1 78 TYR H 1 78 TYR QD . . 3.370 2.494 2.326 2.709 . 0 0 "[ . 1 . 2]" 1
1313 1 78 TYR H 1 78 TYR QE . . 4.800 4.712 4.608 4.801 0.001 15 0 "[ . 1 . 2]" 1
1314 1 78 TYR H 1 79 SER H . . 4.810 4.563 4.525 4.592 . 0 0 "[ . 1 . 2]" 1
1315 1 78 TYR H 1 80 ILE MD . . 5.500 5.463 5.334 5.504 0.004 13 0 "[ . 1 . 2]" 1
1316 1 78 TYR H 1 95 THR HA . . 4.630 4.506 4.361 4.637 0.007 19 0 "[ . 1 . 2]" 1
1317 1 78 TYR H 1 96 ALA H . . 3.530 3.269 3.100 3.424 . 0 0 "[ . 1 . 2]" 1
1318 1 78 TYR H 1 96 ALA MB . . 3.800 3.436 3.232 3.621 . 0 0 "[ . 1 . 2]" 1
1319 1 78 TYR H 1 97 LYS HA . . 4.260 3.686 3.538 3.875 . 0 0 "[ . 1 . 2]" 1
1320 1 78 TYR H 1 97 LYS QB . . 5.500 5.486 5.402 5.519 0.019 13 0 "[ . 1 . 2]" 1
1321 1 78 TYR H 1 98 ILE H . . 4.590 4.078 3.779 4.381 . 0 0 "[ . 1 . 2]" 1
1322 1 78 TYR H 1 98 ILE HG12 . . 4.700 3.566 3.422 3.739 . 0 0 "[ . 1 . 2]" 1
1323 1 78 TYR H 1 98 ILE HG13 . . 4.700 4.566 4.430 4.674 . 0 0 "[ . 1 . 2]" 1
1324 1 78 TYR HA 1 79 SER H . . 2.750 2.205 2.163 2.244 . 0 0 "[ . 1 . 2]" 1
1325 1 78 TYR HB2 1 79 SER H . . 4.270 4.171 4.084 4.270 . 0 0 "[ . 1 . 2]" 1
1326 1 78 TYR HB2 1 80 ILE MD . . 4.060 4.009 3.927 4.062 0.002 15 0 "[ . 1 . 2]" 1
1327 1 78 TYR HB2 1 96 ALA H . . 4.410 3.413 3.318 3.531 . 0 0 "[ . 1 . 2]" 1
1328 1 78 TYR HB2 1 96 ALA MB . . 3.690 2.607 2.213 2.960 . 0 0 "[ . 1 . 2]" 1
1329 1 78 TYR HB3 1 79 SER H . . 3.650 3.035 2.886 3.224 . 0 0 "[ . 1 . 2]" 1
1330 1 78 TYR HB3 1 80 ILE MD . . 4.150 4.050 3.884 4.156 0.006 19 0 "[ . 1 . 2]" 1
1331 1 78 TYR HB3 1 96 ALA H . . 4.730 4.240 4.074 4.486 . 0 0 "[ . 1 . 2]" 1
1332 1 78 TYR HB3 1 96 ALA MB . . 4.110 3.665 3.239 4.041 . 0 0 "[ . 1 . 2]" 1
1333 1 78 TYR QD 1 79 SER H . . 4.260 3.798 3.447 3.969 . 0 0 "[ . 1 . 2]" 1
1334 1 78 TYR QD 1 96 ALA H . . 5.100 5.047 4.970 5.104 0.004 13 0 "[ . 1 . 2]" 1
1335 1 78 TYR QD 1 98 ILE H . . 4.030 3.592 3.265 3.912 . 0 0 "[ . 1 . 2]" 1
1336 1 78 TYR QD 1 98 ILE HB . . 4.240 2.813 2.520 3.202 . 0 0 "[ . 1 . 2]" 1
1337 1 78 TYR QD 1 98 ILE MD . . 4.340 3.629 3.355 3.945 . 0 0 "[ . 1 . 2]" 1
1338 1 78 TYR QD 1 98 ILE HG12 . . 4.120 2.187 1.999 2.562 . 0 0 "[ . 1 . 2]" 1
1339 1 78 TYR QD 1 98 ILE HG13 . . 4.460 2.363 2.023 2.697 . 0 0 "[ . 1 . 2]" 1
1340 1 78 TYR QE 1 98 ILE H . . 4.650 4.434 4.265 4.596 . 0 0 "[ . 1 . 2]" 1
1341 1 78 TYR QE 1 98 ILE HB . . 3.660 2.203 2.007 2.440 . 0 0 "[ . 1 . 2]" 1
1342 1 78 TYR QE 1 98 ILE HG12 . . 3.940 3.469 3.234 3.733 . 0 0 "[ . 1 . 2]" 1
1343 1 78 TYR QE 1 98 ILE HG13 . . 3.800 2.528 2.081 2.799 . 0 0 "[ . 1 . 2]" 1
1344 1 78 TYR QE 1 98 ILE MG . . 3.710 2.656 2.357 2.877 . 0 0 "[ . 1 . 2]" 1
1345 1 79 SER H 1 79 SER QB . . 3.030 2.451 2.327 2.600 . 0 0 "[ . 1 . 2]" 1
1346 1 79 SER H 1 80 ILE H . . 4.320 4.126 4.016 4.340 0.020 19 0 "[ . 1 . 2]" 1
1347 1 79 SER H 1 80 ILE HA . . 5.300 4.872 4.776 4.984 . 0 0 "[ . 1 . 2]" 1
1348 1 79 SER HA 1 80 ILE H . . 2.750 2.181 2.139 2.206 . 0 0 "[ . 1 . 2]" 1
1349 1 79 SER HA 1 80 ILE HB . . 4.800 4.664 4.634 4.712 . 0 0 "[ . 1 . 2]" 1
1350 1 79 SER HA 1 80 ILE MD . . 4.750 4.736 4.616 4.760 0.010 13 0 "[ . 1 . 2]" 1
1351 1 79 SER HA 1 93 PRO HB3 . . 5.010 4.425 4.240 4.800 . 0 0 "[ . 1 . 2]" 1
1352 1 79 SER HA 1 93 PRO HG2 . . 5.450 4.646 4.418 5.012 . 0 0 "[ . 1 . 2]" 1
1353 1 79 SER HA 1 95 THR HA . . 3.900 2.820 2.618 3.057 . 0 0 "[ . 1 . 2]" 1
1354 1 79 SER HA 1 96 ALA H . . 4.090 3.732 3.574 4.039 . 0 0 "[ . 1 . 2]" 1
1355 1 79 SER QB 1 80 ILE H . . 3.690 3.639 3.507 3.752 0.062 19 0 "[ . 1 . 2]" 1
1356 1 79 SER QB 1 81 ILE MD . . 3.620 3.439 3.238 3.554 . 0 0 "[ . 1 . 2]" 1
1357 1 79 SER QB 1 81 ILE HG12 . . 4.380 4.131 4.043 4.398 0.018 19 0 "[ . 1 . 2]" 1
1358 1 79 SER QB 1 81 ILE HG13 . . 4.380 3.212 3.075 3.420 . 0 0 "[ . 1 . 2]" 1
1359 1 79 SER QB 1 93 PRO HB2 . . 3.720 2.395 2.160 3.646 . 0 0 "[ . 1 . 2]" 1
1360 1 79 SER QB 1 93 PRO HB3 . . 4.400 3.128 2.876 4.225 . 0 0 "[ . 1 . 2]" 1
1361 1 80 ILE H 1 80 ILE HB . . 3.390 2.506 2.482 2.565 . 0 0 "[ . 1 . 2]" 1
1362 1 80 ILE H 1 80 ILE MD . . 3.480 3.271 3.185 3.461 . 0 0 "[ . 1 . 2]" 1
1363 1 80 ILE H 1 80 ILE HG12 . . 4.040 3.861 3.782 4.048 0.008 19 0 "[ . 1 . 2]" 1
1364 1 80 ILE H 1 80 ILE QG . . 3.480 2.397 2.295 2.621 . 0 0 "[ . 1 . 2]" 1
1365 1 80 ILE H 1 80 ILE HG13 . . 4.040 2.420 2.315 2.654 . 0 0 "[ . 1 . 2]" 1
1366 1 80 ILE H 1 80 ILE MG . . 4.600 3.782 3.772 3.820 . 0 0 "[ . 1 . 2]" 1
1367 1 80 ILE H 1 81 ILE H . . 4.780 4.200 4.069 4.255 . 0 0 "[ . 1 . 2]" 1
1368 1 80 ILE H 1 93 PRO HB2 . . 3.910 3.284 3.028 3.401 . 0 0 "[ . 1 . 2]" 1
1369 1 80 ILE H 1 93 PRO HB3 . . 4.470 4.301 4.104 4.415 . 0 0 "[ . 1 . 2]" 1
1370 1 80 ILE H 1 94 PHE HA . . 5.200 4.682 4.540 4.836 . 0 0 "[ . 1 . 2]" 1
1371 1 80 ILE H 1 94 PHE HB2 . . 4.080 3.682 3.530 3.846 . 0 0 "[ . 1 . 2]" 1
1372 1 80 ILE H 1 94 PHE HB3 . . 5.040 4.706 4.573 4.820 . 0 0 "[ . 1 . 2]" 1
1373 1 80 ILE H 1 94 PHE QD . . 5.260 4.983 4.578 5.169 . 0 0 "[ . 1 . 2]" 1
1374 1 80 ILE H 1 95 THR HA . . 3.990 3.800 3.549 3.947 . 0 0 "[ . 1 . 2]" 1
1375 1 80 ILE H 1 96 ALA H . . 4.770 3.969 3.768 4.166 . 0 0 "[ . 1 . 2]" 1
1376 1 80 ILE HA 1 80 ILE MD . . 4.020 3.882 3.872 3.902 . 0 0 "[ . 1 . 2]" 1
1377 1 80 ILE HA 1 80 ILE QG . . 3.620 2.454 2.438 2.488 . 0 0 "[ . 1 . 2]" 1
1378 1 80 ILE HA 1 80 ILE MG . . 3.500 2.329 2.263 2.439 . 0 0 "[ . 1 . 2]" 1
1379 1 80 ILE HA 1 81 ILE H . . 2.810 2.198 2.186 2.218 . 0 0 "[ . 1 . 2]" 1
1380 1 80 ILE HA 1 81 ILE HB . . 5.500 4.671 4.644 4.787 . 0 0 "[ . 1 . 2]" 1
1381 1 80 ILE HA 1 94 PHE H . . 5.500 4.623 4.520 4.724 . 0 0 "[ . 1 . 2]" 1
1382 1 80 ILE HB 1 80 ILE MD . . 3.610 2.132 2.097 2.240 . 0 0 "[ . 1 . 2]" 1
1383 1 80 ILE HB 1 81 ILE H . . 4.840 4.435 4.418 4.453 . 0 0 "[ . 1 . 2]" 1
1384 1 80 ILE HB 1 94 PHE H . . 3.680 2.687 2.571 2.786 . 0 0 "[ . 1 . 2]" 1
1385 1 80 ILE HB 1 94 PHE HB2 . . 3.570 2.276 2.185 2.367 . 0 0 "[ . 1 . 2]" 1
1386 1 80 ILE HB 1 94 PHE HB3 . . 3.880 3.868 3.817 3.885 0.005 16 0 "[ . 1 . 2]" 1
1387 1 80 ILE HB 1 94 PHE QD . . 3.740 3.346 3.014 3.706 . 0 0 "[ . 1 . 2]" 1
1388 1 80 ILE MD 1 94 PHE H . . 4.960 4.058 3.924 4.197 . 0 0 "[ . 1 . 2]" 1
1389 1 80 ILE MD 1 94 PHE HB2 . . 3.940 2.538 2.268 2.876 . 0 0 "[ . 1 . 2]" 1
1390 1 80 ILE MD 1 94 PHE HB3 . . 4.290 3.245 3.152 3.423 . 0 0 "[ . 1 . 2]" 1
1391 1 80 ILE MD 1 95 THR H . . 5.500 5.375 5.266 5.504 0.004 15 0 "[ . 1 . 2]" 1
1392 1 80 ILE MD 1 96 ALA H . . 3.910 3.647 3.458 3.800 . 0 0 "[ . 1 . 2]" 1
1393 1 80 ILE MD 1 96 ALA MB . . 2.990 2.187 1.943 2.356 . 0 0 "[ . 1 . 2]" 1
1394 1 80 ILE QG 1 94 PHE HB2 . . 5.340 4.068 3.900 4.207 . 0 0 "[ . 1 . 2]" 1
1395 1 80 ILE MG 1 81 ILE H . . 3.330 3.146 3.072 3.250 . 0 0 "[ . 1 . 2]" 1
1396 1 80 ILE MG 1 82 VAL H . . 4.910 4.339 4.126 4.500 . 0 0 "[ . 1 . 2]" 1
1397 1 80 ILE MG 1 82 VAL MG2 . . 2.860 2.111 1.924 2.288 . 0 0 "[ . 1 . 2]" 1
1398 1 80 ILE MG 1 94 PHE H . . 4.440 3.690 3.583 3.801 . 0 0 "[ . 1 . 2]" 1
1399 1 80 ILE MG 1 94 PHE HB2 . . 4.230 3.452 3.337 3.584 . 0 0 "[ . 1 . 2]" 1
1400 1 80 ILE MG 1 94 PHE QD . . 3.820 3.300 2.854 3.792 . 0 0 "[ . 1 . 2]" 1
1401 1 81 ILE H 1 81 ILE HB . . 3.150 2.501 2.476 2.603 . 0 0 "[ . 1 . 2]" 1
1402 1 81 ILE H 1 81 ILE MD . . 3.460 3.275 3.217 3.361 . 0 0 "[ . 1 . 2]" 1
1403 1 81 ILE H 1 81 ILE HG12 . . 4.420 3.805 3.600 3.870 . 0 0 "[ . 1 . 2]" 1
1404 1 81 ILE H 1 81 ILE QG . . 3.720 2.338 2.123 2.409 . 0 0 "[ . 1 . 2]" 1
1405 1 81 ILE H 1 81 ILE HG13 . . 4.420 2.360 2.138 2.433 . 0 0 "[ . 1 . 2]" 1
1406 1 81 ILE H 1 81 ILE MG . . 4.250 3.776 3.768 3.796 . 0 0 "[ . 1 . 2]" 1
1407 1 81 ILE H 1 82 VAL H . . 4.640 4.476 4.420 4.514 . 0 0 "[ . 1 . 2]" 1
1408 1 81 ILE H 1 82 VAL MG2 . . 4.230 4.064 3.959 4.200 . 0 0 "[ . 1 . 2]" 1
1409 1 81 ILE HA 1 81 ILE MD . . 4.380 3.883 3.874 3.927 . 0 0 "[ . 1 . 2]" 1
1410 1 81 ILE HA 1 81 ILE HG12 . . 3.950 2.800 2.752 2.825 . 0 0 "[ . 1 . 2]" 1
1411 1 81 ILE HA 1 81 ILE QG . . 3.380 2.455 2.439 2.535 . 0 0 "[ . 1 . 2]" 1
1412 1 81 ILE HA 1 81 ILE HG13 . . 3.950 2.719 2.681 2.905 . 0 0 "[ . 1 . 2]" 1
1413 1 81 ILE HA 1 81 ILE MG . . 3.550 2.363 2.215 2.462 . 0 0 "[ . 1 . 2]" 1
1414 1 81 ILE HA 1 82 VAL H . . 2.890 2.143 2.139 2.154 . 0 0 "[ . 1 . 2]" 1
1415 1 81 ILE HA 1 82 VAL MG2 . . 3.720 3.613 3.426 3.716 . 0 0 "[ . 1 . 2]" 1
1416 1 81 ILE HA 1 92 SER HB2 . . 4.900 3.878 3.671 4.061 . 0 0 "[ . 1 . 2]" 1
1417 1 81 ILE HA 1 92 SER HG . . 4.530 3.032 2.895 3.147 . 0 0 "[ . 1 . 2]" 1
1418 1 81 ILE HA 1 93 PRO HA . . 3.960 2.538 2.347 2.672 . 0 0 "[ . 1 . 2]" 1
1419 1 81 ILE HA 1 93 PRO HB2 . . 4.900 3.936 3.748 4.137 . 0 0 "[ . 1 . 2]" 1
1420 1 81 ILE HA 1 93 PRO HB3 . . 4.830 2.497 2.317 2.693 . 0 0 "[ . 1 . 2]" 1
1421 1 81 ILE HA 1 94 PHE H . . 4.330 4.139 3.938 4.273 . 0 0 "[ . 1 . 2]" 1
1422 1 81 ILE HB 1 81 ILE MD . . 2.960 2.158 2.102 2.291 . 0 0 "[ . 1 . 2]" 1
1423 1 81 ILE HB 1 82 VAL H . . 4.810 4.239 4.091 4.304 . 0 0 "[ . 1 . 2]" 1
1424 1 81 ILE MD 1 88 HIS HE1 . . 4.440 4.023 3.800 4.306 . 0 0 "[ . 1 . 2]" 1
1425 1 81 ILE QG 1 81 ILE MG . . 3.340 2.120 2.016 2.221 . 0 0 "[ . 1 . 2]" 1
1426 1 81 ILE QG 1 82 VAL H . . 4.270 4.178 4.151 4.243 . 0 0 "[ . 1 . 2]" 1
1427 1 81 ILE QG 1 88 HIS HE1 . . 4.070 2.863 2.700 3.058 . 0 0 "[ . 1 . 2]" 1
1428 1 81 ILE QG 1 93 PRO HB2 . . 3.780 3.293 3.084 3.450 . 0 0 "[ . 1 . 2]" 1
1429 1 81 ILE QG 1 93 PRO HB3 . . 3.650 2.118 1.900 2.244 . 0 0 "[ . 1 . 2]" 1
1430 1 81 ILE QG 1 94 PHE H . . 5.340 5.037 4.868 5.191 . 0 0 "[ . 1 . 2]" 1
1431 1 81 ILE HG12 1 82 VAL H . . 4.920 4.588 4.534 4.649 . 0 0 "[ . 1 . 2]" 1
1432 1 81 ILE HG12 1 88 HIS HE1 . . 4.690 2.896 2.725 3.099 . 0 0 "[ . 1 . 2]" 1
1433 1 81 ILE HG12 1 93 PRO HA . . 4.890 4.283 4.037 4.546 . 0 0 "[ . 1 . 2]" 1
1434 1 81 ILE HG12 1 93 PRO HB2 . . 4.360 4.055 3.569 4.277 . 0 0 "[ . 1 . 2]" 1
1435 1 81 ILE HG12 1 93 PRO HB3 . . 4.220 2.451 2.040 2.696 . 0 0 "[ . 1 . 2]" 1
1436 1 81 ILE HG13 1 82 VAL H . . 4.920 4.809 4.777 4.944 0.024 19 0 "[ . 1 . 2]" 1
1437 1 81 ILE HG13 1 88 HIS HE1 . . 4.690 4.508 4.350 4.697 0.007 19 0 "[ . 1 . 2]" 1
1438 1 81 ILE HG13 1 93 PRO HA . . 4.890 4.118 3.871 4.265 . 0 0 "[ . 1 . 2]" 1
1439 1 81 ILE HG13 1 93 PRO HB2 . . 4.360 3.488 3.237 3.687 . 0 0 "[ . 1 . 2]" 1
1440 1 81 ILE HG13 1 93 PRO HB3 . . 4.220 2.328 2.046 2.505 . 0 0 "[ . 1 . 2]" 1
1441 1 81 ILE MG 1 82 VAL H . . 3.550 2.610 2.387 2.829 . 0 0 "[ . 1 . 2]" 1
1442 1 81 ILE MG 1 83 ARG H . . 4.080 3.414 3.222 3.751 . 0 0 "[ . 1 . 2]" 1
1443 1 81 ILE MG 1 83 ARG HD2 . . 4.220 3.892 3.664 4.066 . 0 0 "[ . 1 . 2]" 1
1444 1 81 ILE MG 1 83 ARG QD . . 3.600 3.549 3.417 3.609 0.009 8 0 "[ . 1 . 2]" 1
1445 1 81 ILE MG 1 83 ARG HD3 . . 4.220 4.101 4.029 4.194 . 0 0 "[ . 1 . 2]" 1
1446 1 81 ILE MG 1 83 ARG HG2 . . 3.680 3.233 3.013 3.483 . 0 0 "[ . 1 . 2]" 1
1447 1 81 ILE MG 1 83 ARG HG3 . . 3.150 2.282 2.163 2.415 . 0 0 "[ . 1 . 2]" 1
1448 1 81 ILE MG 1 88 HIS HE1 . . 3.390 2.179 1.825 2.631 . 0 0 "[ . 1 . 2]" 1
1449 1 81 ILE MG 1 92 SER HG . . 4.220 3.319 2.957 3.565 . 0 0 "[ . 1 . 2]" 1
1450 1 81 ILE MG 1 93 PRO HA . . 4.730 4.251 3.882 4.428 . 0 0 "[ . 1 . 2]" 1
1451 1 82 VAL H 1 82 VAL HB . . 3.800 2.744 2.693 2.809 . 0 0 "[ . 1 . 2]" 1
1452 1 82 VAL H 1 82 VAL MG1 . . 4.730 3.889 3.869 3.925 . 0 0 "[ . 1 . 2]" 1
1453 1 82 VAL H 1 82 VAL MG2 . . 3.510 2.817 2.632 2.942 . 0 0 "[ . 1 . 2]" 1
1454 1 82 VAL H 1 83 ARG H . . 4.720 3.936 3.871 4.018 . 0 0 "[ . 1 . 2]" 1
1455 1 82 VAL H 1 83 ARG HG2 . . 5.500 4.640 4.423 4.929 . 0 0 "[ . 1 . 2]" 1
1456 1 82 VAL H 1 83 ARG HG3 . . 4.400 4.080 3.855 4.327 . 0 0 "[ . 1 . 2]" 1
1457 1 82 VAL H 1 88 HIS HE1 . . 5.010 4.350 4.141 4.636 . 0 0 "[ . 1 . 2]" 1
1458 1 82 VAL H 1 89 ILE QG . . 4.230 3.623 3.507 3.772 . 0 0 "[ . 1 . 2]" 1
1459 1 82 VAL H 1 92 SER H . . 5.500 5.456 5.368 5.503 0.003 13 0 "[ . 1 . 2]" 1
1460 1 82 VAL H 1 92 SER HA . . 4.730 4.659 4.534 4.731 0.001 18 0 "[ . 1 . 2]" 1
1461 1 82 VAL H 1 92 SER HB2 . . 3.910 2.995 2.914 3.131 . 0 0 "[ . 1 . 2]" 1
1462 1 82 VAL H 1 92 SER HG . . 3.430 2.381 2.201 2.621 . 0 0 "[ . 1 . 2]" 1
1463 1 82 VAL H 1 93 PRO HA . . 4.260 3.420 3.248 3.545 . 0 0 "[ . 1 . 2]" 1
1464 1 82 VAL H 1 93 PRO HD3 . . 5.390 5.120 4.925 5.331 . 0 0 "[ . 1 . 2]" 1
1465 1 82 VAL H 1 94 PHE H . . 5.030 4.795 4.636 4.905 . 0 0 "[ . 1 . 2]" 1
1466 1 82 VAL H 1 94 PHE QD . . 5.050 4.821 4.412 5.052 0.002 20 0 "[ . 1 . 2]" 1
1467 1 82 VAL H 1 94 PHE QE . . 5.500 5.337 4.567 5.505 0.005 9 0 "[ . 1 . 2]" 1
1468 1 82 VAL HA 1 83 ARG H . . 2.890 2.187 2.161 2.203 . 0 0 "[ . 1 . 2]" 1
1469 1 82 VAL HB 1 83 ARG H . . 4.670 4.416 4.360 4.449 . 0 0 "[ . 1 . 2]" 1
1470 1 82 VAL HB 1 89 ILE H . . 4.500 4.338 4.154 4.506 0.006 3 0 "[ . 1 . 2]" 1
1471 1 82 VAL HB 1 89 ILE MD . . 3.390 2.011 1.918 2.202 . 0 0 "[ . 1 . 2]" 1
1472 1 82 VAL HB 1 89 ILE QG . . 3.570 2.501 2.221 2.708 . 0 0 "[ . 1 . 2]" 1
1473 1 82 VAL HB 1 89 ILE MG . . 3.550 3.250 2.986 3.470 . 0 0 "[ . 1 . 2]" 1
1474 1 82 VAL HB 1 92 SER H . . 5.460 5.323 5.099 5.464 0.004 5 0 "[ . 1 . 2]" 1
1475 1 82 VAL HB 1 92 SER HB2 . . 4.490 2.885 2.681 3.107 . 0 0 "[ . 1 . 2]" 1
1476 1 82 VAL HB 1 92 SER HB3 . . 4.840 3.150 2.954 3.307 . 0 0 "[ . 1 . 2]" 1
1477 1 82 VAL HB 1 94 PHE QE . . 4.920 3.683 3.020 4.081 . 0 0 "[ . 1 . 2]" 1
1478 1 82 VAL MG1 1 83 ARG H . . 3.140 3.066 2.906 3.139 . 0 0 "[ . 1 . 2]" 1
1479 1 82 VAL MG1 1 83 ARG HA . . 4.880 3.923 3.782 4.167 . 0 0 "[ . 1 . 2]" 1
1480 1 82 VAL MG1 1 89 ILE QG . . 3.860 3.121 2.866 3.443 . 0 0 "[ . 1 . 2]" 1
1481 1 82 VAL MG2 1 89 ILE QG . . 4.170 3.950 3.753 4.100 . 0 0 "[ . 1 . 2]" 1
1482 1 82 VAL MG2 1 94 PHE H . . 4.540 4.240 4.087 4.468 . 0 0 "[ . 1 . 2]" 1
1483 1 82 VAL MG2 1 94 PHE HB2 . . 5.480 4.575 4.446 4.728 . 0 0 "[ . 1 . 2]" 1
1484 1 82 VAL MG2 1 94 PHE QD . . 3.550 3.244 2.909 3.481 . 0 0 "[ . 1 . 2]" 1
1485 1 82 VAL MG2 1 94 PHE QE . . 4.010 3.669 3.035 4.010 . 0 0 "[ . 1 . 2]" 1
1486 1 83 ARG H 1 83 ARG HB2 . . 3.450 2.570 2.493 2.635 . 0 0 "[ . 1 . 2]" 1
1487 1 83 ARG H 1 83 ARG QD . . 4.680 4.152 3.999 4.287 . 0 0 "[ . 1 . 2]" 1
1488 1 83 ARG H 1 83 ARG HG2 . . 4.140 3.692 3.461 3.878 . 0 0 "[ . 1 . 2]" 1
1489 1 83 ARG H 1 83 ARG HG3 . . 3.460 2.596 2.420 2.698 . 0 0 "[ . 1 . 2]" 1
1490 1 83 ARG H 1 84 PHE H . . 4.670 4.541 4.513 4.558 . 0 0 "[ . 1 . 2]" 1
1491 1 83 ARG HA 1 83 ARG QD . . 4.800 3.982 3.903 4.056 . 0 0 "[ . 1 . 2]" 1
1492 1 83 ARG HA 1 83 ARG HG2 . . 4.190 2.591 2.532 2.664 . 0 0 "[ . 1 . 2]" 1
1493 1 83 ARG HA 1 84 PHE H . . 2.800 2.339 2.274 2.462 . 0 0 "[ . 1 . 2]" 1
1494 1 83 ARG HA 1 84 PHE HB2 . . 5.480 4.271 4.120 4.375 . 0 0 "[ . 1 . 2]" 1
1495 1 83 ARG HA 1 87 LYS H . . 4.200 4.013 3.906 4.192 . 0 0 "[ . 1 . 2]" 1
1496 1 83 ARG HA 1 88 HIS HA . . 4.280 2.467 2.316 2.713 . 0 0 "[ . 1 . 2]" 1
1497 1 83 ARG HA 1 89 ILE H . . 3.730 3.063 2.881 3.230 . 0 0 "[ . 1 . 2]" 1
1498 1 83 ARG HA 1 89 ILE MG . . 4.040 3.129 2.853 3.364 . 0 0 "[ . 1 . 2]" 1
1499 1 83 ARG HB2 1 83 ARG HD2 . . 4.050 2.362 2.235 2.465 . 0 0 "[ . 1 . 2]" 1
1500 1 83 ARG HB2 1 83 ARG HD3 . . 4.050 3.372 3.220 3.490 . 0 0 "[ . 1 . 2]" 1
1501 1 83 ARG HB2 1 84 PHE H . . 3.930 3.680 3.457 3.800 . 0 0 "[ . 1 . 2]" 1
1502 1 83 ARG HB2 1 86 ASP H . . 4.380 4.269 4.172 4.378 . 0 0 "[ . 1 . 2]" 1
1503 1 83 ARG HB2 1 86 ASP HA . . 4.660 4.579 4.445 4.663 0.003 19 0 "[ . 1 . 2]" 1
1504 1 83 ARG HB2 1 87 LYS H . . 4.420 4.194 3.850 4.394 . 0 0 "[ . 1 . 2]" 1
1505 1 83 ARG HB3 1 83 ARG HD2 . . 3.850 2.706 2.559 2.878 . 0 0 "[ . 1 . 2]" 1
1506 1 83 ARG HB3 1 83 ARG HD3 . . 3.850 2.761 2.676 2.867 . 0 0 "[ . 1 . 2]" 1
1507 1 83 ARG HB3 1 84 PHE H . . 3.450 2.605 2.313 2.778 . 0 0 "[ . 1 . 2]" 1
1508 1 83 ARG HB3 1 86 ASP H . . 4.160 3.618 3.455 3.900 . 0 0 "[ . 1 . 2]" 1
1509 1 83 ARG HB3 1 86 ASP HA . . 4.340 3.623 3.515 3.826 . 0 0 "[ . 1 . 2]" 1
1510 1 83 ARG HB3 1 87 LYS H . . 3.500 2.662 2.365 2.859 . 0 0 "[ . 1 . 2]" 1
1511 1 83 ARG HB3 1 88 HIS H . . 4.800 4.634 4.383 4.781 . 0 0 "[ . 1 . 2]" 1
1512 1 83 ARG HB3 1 88 HIS HA . . 4.700 3.707 3.409 3.836 . 0 0 "[ . 1 . 2]" 1
1513 1 83 ARG QD 1 86 ASP H . . 4.760 4.549 4.377 4.694 . 0 0 "[ . 1 . 2]" 1
1514 1 83 ARG QD 1 87 LYS H . . 4.380 4.093 3.805 4.295 . 0 0 "[ . 1 . 2]" 1
1515 1 83 ARG QD 1 88 HIS HE1 . . 5.310 4.854 4.606 5.167 . 0 0 "[ . 1 . 2]" 1
1516 1 83 ARG HD2 1 86 ASP H . . 5.500 4.941 4.725 5.163 . 0 0 "[ . 1 . 2]" 1
1517 1 83 ARG HD2 1 86 ASP HA . . 4.420 4.117 3.915 4.421 0.001 5 0 "[ . 1 . 2]" 1
1518 1 83 ARG HD2 1 87 LYS H . . 5.050 4.832 4.457 5.037 . 0 0 "[ . 1 . 2]" 1
1519 1 83 ARG HD3 1 86 ASP H . . 5.500 5.324 5.113 5.499 . 0 0 "[ . 1 . 2]" 1
1520 1 83 ARG HD3 1 86 ASP HA . . 4.420 4.038 3.835 4.221 . 0 0 "[ . 1 . 2]" 1
1521 1 83 ARG HD3 1 87 LYS H . . 5.050 4.422 4.128 4.660 . 0 0 "[ . 1 . 2]" 1
1522 1 83 ARG HG2 1 84 PHE H . . 4.410 4.226 4.079 4.343 . 0 0 "[ . 1 . 2]" 1
1523 1 83 ARG HG2 1 87 LYS H . . 4.830 4.581 4.305 4.812 . 0 0 "[ . 1 . 2]" 1
1524 1 83 ARG HG2 1 88 HIS H . . 4.630 4.253 3.991 4.468 . 0 0 "[ . 1 . 2]" 1
1525 1 83 ARG HG2 1 88 HIS HA . . 4.270 2.617 2.354 2.880 . 0 0 "[ . 1 . 2]" 1
1526 1 83 ARG HG2 1 89 ILE H . . 4.510 4.289 4.059 4.511 0.001 19 0 "[ . 1 . 2]" 1
1527 1 83 ARG HG3 1 88 HIS HA . . 4.740 4.092 3.779 4.396 . 0 0 "[ . 1 . 2]" 1
1528 1 83 ARG HG3 1 88 HIS HE1 . . 5.440 4.331 4.025 4.534 . 0 0 "[ . 1 . 2]" 1
1529 1 84 PHE H 1 84 PHE HB2 . . 3.740 3.165 2.944 3.332 . 0 0 "[ . 1 . 2]" 1
1530 1 84 PHE H 1 84 PHE HB3 . . 3.570 2.842 2.743 2.973 . 0 0 "[ . 1 . 2]" 1
1531 1 84 PHE H 1 84 PHE QD . . 4.440 4.374 4.280 4.439 . 0 0 "[ . 1 . 2]" 1
1532 1 84 PHE H 1 86 ASP H . . 4.310 3.929 3.779 4.102 . 0 0 "[ . 1 . 2]" 1
1533 1 84 PHE H 1 86 ASP HA . . 4.950 4.877 4.788 4.958 0.008 14 0 "[ . 1 . 2]" 1
1534 1 84 PHE H 1 87 LYS H . . 3.220 2.428 2.285 2.557 . 0 0 "[ . 1 . 2]" 1
1535 1 84 PHE H 1 87 LYS HA . . 5.040 4.448 4.328 4.577 . 0 0 "[ . 1 . 2]" 1
1536 1 84 PHE H 1 87 LYS HB2 . . 4.780 3.705 3.326 4.787 0.007 4 0 "[ . 1 . 2]" 1
1537 1 84 PHE H 1 87 LYS QB . . 4.050 3.465 3.243 3.998 . 0 0 "[ . 1 . 2]" 1
1538 1 84 PHE H 1 87 LYS HB3 . . 4.780 4.503 4.048 4.702 . 0 0 "[ . 1 . 2]" 1
1539 1 84 PHE H 1 88 HIS HA . . 4.070 3.785 3.637 4.034 . 0 0 "[ . 1 . 2]" 1
1540 1 84 PHE H 1 89 ILE H . . 4.800 4.453 4.228 4.685 . 0 0 "[ . 1 . 2]" 1
1541 1 84 PHE H 1 89 ILE MG . . 3.630 3.521 3.299 3.646 0.016 12 0 "[ . 1 . 2]" 1
1542 1 84 PHE HA 1 84 PHE QD . . 3.980 2.672 2.009 3.065 . 0 0 "[ . 1 . 2]" 1
1543 1 84 PHE HA 1 85 ASP H . . 2.900 2.172 2.154 2.239 . 0 0 "[ . 1 . 2]" 1
1544 1 84 PHE HA 1 85 ASP HA . . 4.480 4.378 4.367 4.402 . 0 0 "[ . 1 . 2]" 1
1545 1 84 PHE HA 1 86 ASP H . . 4.310 4.095 3.956 4.294 . 0 0 "[ . 1 . 2]" 1
1546 1 84 PHE HA 1 87 LYS H . . 4.790 4.371 4.264 4.493 . 0 0 "[ . 1 . 2]" 1
1547 1 84 PHE HB2 1 85 ASP H . . 4.640 4.495 4.412 4.564 . 0 0 "[ . 1 . 2]" 1
1548 1 84 PHE HB2 1 89 ILE MG . . 3.680 2.947 2.706 3.287 . 0 0 "[ . 1 . 2]" 1
1549 1 84 PHE HB3 1 87 LYS H . . 4.690 4.487 4.327 4.676 . 0 0 "[ . 1 . 2]" 1
1550 1 84 PHE HB3 1 89 ILE MG . . 3.770 3.271 3.080 3.618 . 0 0 "[ . 1 . 2]" 1
1551 1 84 PHE QD 1 85 ASP H . . 4.320 3.914 3.308 4.268 . 0 0 "[ . 1 . 2]" 1
1552 1 84 PHE QD 1 85 ASP QB . . 4.770 3.122 2.295 3.784 . 0 0 "[ . 1 . 2]" 1
1553 1 85 ASP H 1 85 ASP HA . . 2.890 2.276 2.274 2.282 . 0 0 "[ . 1 . 2]" 1
1554 1 85 ASP H 1 85 ASP HB2 . . 4.150 3.258 3.089 3.787 . 0 0 "[ . 1 . 2]" 1
1555 1 85 ASP H 1 85 ASP QB . . 3.550 3.090 2.956 3.468 . 0 0 "[ . 1 . 2]" 1
1556 1 85 ASP H 1 85 ASP HB3 . . 4.150 3.856 3.573 4.108 . 0 0 "[ . 1 . 2]" 1
1557 1 85 ASP H 1 86 ASP H . . 3.480 2.663 2.566 2.752 . 0 0 "[ . 1 . 2]" 1
1558 1 85 ASP H 1 87 LYS H . . 4.280 4.073 3.886 4.182 . 0 0 "[ . 1 . 2]" 1
1559 1 85 ASP HA 1 86 ASP H . . 3.230 2.761 2.694 2.814 . 0 0 "[ . 1 . 2]" 1
1560 1 85 ASP HA 1 87 LYS H . . 4.760 4.695 4.559 4.775 0.015 3 0 "[ . 1 . 2]" 1
1561 1 85 ASP QB 1 86 ASP H . . 4.080 3.900 3.854 3.971 . 0 0 "[ . 1 . 2]" 1
1562 1 85 ASP QB 1 87 LYS H . . 4.720 4.290 4.047 4.481 . 0 0 "[ . 1 . 2]" 1
1563 1 85 ASP HB2 1 86 ASP H . . 4.810 4.486 4.221 4.646 . 0 0 "[ . 1 . 2]" 1
1564 1 85 ASP HB3 1 86 ASP H . . 4.810 4.305 4.196 4.516 . 0 0 "[ . 1 . 2]" 1
1565 1 86 ASP H 1 86 ASP HA . . 2.890 2.279 2.274 2.284 . 0 0 "[ . 1 . 2]" 1
1566 1 86 ASP H 1 86 ASP HB2 . . 4.140 3.490 3.125 3.827 . 0 0 "[ . 1 . 2]" 1
1567 1 86 ASP H 1 86 ASP QB . . 3.610 3.265 2.990 3.484 . 0 0 "[ . 1 . 2]" 1
1568 1 86 ASP H 1 86 ASP HB3 . . 4.140 3.952 3.715 4.104 . 0 0 "[ . 1 . 2]" 1
1569 1 86 ASP H 1 87 LYS H . . 3.320 2.593 2.499 2.704 . 0 0 "[ . 1 . 2]" 1
1570 1 86 ASP HA 1 87 LYS H . . 3.490 2.802 2.739 2.891 . 0 0 "[ . 1 . 2]" 1
1571 1 86 ASP QB 1 87 LYS H . . 4.010 3.870 3.828 3.896 . 0 0 "[ . 1 . 2]" 1
1572 1 86 ASP HB2 1 87 LYS H . . 4.660 4.345 4.120 4.593 . 0 0 "[ . 1 . 2]" 1
1573 1 86 ASP HB3 1 87 LYS H . . 4.660 4.385 4.128 4.560 . 0 0 "[ . 1 . 2]" 1
1574 1 87 LYS H 1 87 LYS QB . . 2.960 2.824 2.683 2.950 . 0 0 "[ . 1 . 2]" 1
1575 1 87 LYS H 1 87 LYS QG . . 3.230 3.093 2.722 3.224 . 0 0 "[ . 1 . 2]" 1
1576 1 87 LYS H 1 88 HIS H . . 4.540 4.120 3.959 4.364 . 0 0 "[ . 1 . 2]" 1
1577 1 87 LYS H 1 88 HIS HA . . 5.090 4.591 4.494 4.703 . 0 0 "[ . 1 . 2]" 1
1578 1 87 LYS HA 1 88 HIS H . . 3.000 2.160 2.140 2.274 . 0 0 "[ . 1 . 2]" 1
1579 1 87 LYS QB 1 87 LYS QE . . 3.600 2.806 2.114 3.604 0.004 15 0 "[ . 1 . 2]" 1
1580 1 87 LYS QB 1 88 HIS H . . 3.430 3.260 2.874 3.435 0.005 19 0 "[ . 1 . 2]" 1
1581 1 87 LYS QE 1 87 LYS QG . . 3.470 2.287 2.106 2.650 . 0 0 "[ . 1 . 2]" 1
1582 1 87 LYS QG 1 88 HIS H . . 5.380 4.165 3.237 4.689 . 0 0 "[ . 1 . 2]" 1
1583 1 88 HIS H 1 88 HIS HB2 . . 3.300 2.156 2.136 2.217 . 0 0 "[ . 1 . 2]" 1
1584 1 88 HIS H 1 88 HIS HB3 . . 3.630 3.456 3.446 3.464 . 0 0 "[ . 1 . 2]" 1
1585 1 88 HIS H 1 88 HIS HD2 . . 3.590 3.147 2.999 3.489 . 0 0 "[ . 1 . 2]" 1
1586 1 88 HIS H 1 89 ILE H . . 4.730 4.563 4.498 4.592 . 0 0 "[ . 1 . 2]" 1
1587 1 88 HIS HA 1 89 ILE H . . 2.990 2.170 2.158 2.186 . 0 0 "[ . 1 . 2]" 1
1588 1 88 HIS HA 1 89 ILE MG . . 4.410 3.614 3.436 3.797 . 0 0 "[ . 1 . 2]" 1
1589 1 88 HIS HB2 1 89 ILE H . . 4.380 4.366 4.326 4.403 0.023 3 0 "[ . 1 . 2]" 1
1590 1 88 HIS HB3 1 89 ILE H . . 3.970 3.302 3.223 3.375 . 0 0 "[ . 1 . 2]" 1
1591 1 88 HIS HB3 1 92 SER H . . 4.970 4.723 4.621 4.825 . 0 0 "[ . 1 . 2]" 1
1592 1 88 HIS HB3 1 92 SER HB3 . . 4.820 4.646 4.482 4.820 0.000 14 0 "[ . 1 . 2]" 1
1593 1 88 HIS HE1 1 92 SER HG . . 4.470 3.381 3.202 3.432 . 0 0 "[ . 1 . 2]" 1
1594 1 88 HIS HE1 1 93 PRO HB2 . . 5.500 5.527 5.523 5.534 0.034 12 0 "[ . 1 . 2]" 1
1595 1 88 HIS HE1 1 93 PRO HB3 . . 4.550 3.917 3.887 3.958 . 0 0 "[ . 1 . 2]" 1
1596 1 88 HIS HE1 1 93 PRO HG3 . . 4.620 4.041 3.980 4.174 . 0 0 "[ . 1 . 2]" 1
1597 1 89 ILE H 1 89 ILE MD . . 3.960 3.796 3.677 3.885 . 0 0 "[ . 1 . 2]" 1
1598 1 89 ILE H 1 89 ILE QG . . 3.280 2.159 2.027 2.263 . 0 0 "[ . 1 . 2]" 1
1599 1 89 ILE H 1 89 ILE MG . . 3.120 2.288 2.137 2.441 . 0 0 "[ . 1 . 2]" 1
1600 1 89 ILE H 1 90 PRO QD . . 4.830 4.366 4.362 4.370 . 0 0 "[ . 1 . 2]" 1
1601 1 89 ILE H 1 92 SER H . . 4.540 4.409 4.305 4.481 . 0 0 "[ . 1 . 2]" 1
1602 1 89 ILE H 1 92 SER HB2 . . 4.890 4.893 4.856 4.908 0.018 16 0 "[ . 1 . 2]" 1
1603 1 89 ILE H 1 92 SER HB3 . . 3.770 3.304 3.257 3.336 . 0 0 "[ . 1 . 2]" 1
1604 1 89 ILE HA 1 89 ILE MD . . 4.720 4.146 4.111 4.178 . 0 0 "[ . 1 . 2]" 1
1605 1 89 ILE HB 1 89 ILE MD . . 3.350 2.341 2.227 2.416 . 0 0 "[ . 1 . 2]" 1
1606 1 89 ILE HB 1 90 PRO HD2 . . 3.780 1.945 1.925 1.958 . 0 0 "[ . 1 . 2]" 1
1607 1 89 ILE HB 1 90 PRO QD . . 3.290 1.934 1.914 1.947 . 0 0 "[ . 1 . 2]" 1
1608 1 89 ILE HB 1 90 PRO HD3 . . 3.780 3.394 3.363 3.411 . 0 0 "[ . 1 . 2]" 1
1609 1 89 ILE HB 1 90 PRO HG2 . . 4.060 3.784 3.761 3.822 . 0 0 "[ . 1 . 2]" 1
1610 1 89 ILE MD 1 92 SER H . . 4.230 3.603 3.412 3.776 . 0 0 "[ . 1 . 2]" 1
1611 1 89 ILE MD 1 92 SER HB2 . . 4.350 2.722 2.565 3.067 . 0 0 "[ . 1 . 2]" 1
1612 1 89 ILE MD 1 92 SER HB3 . . 4.840 2.720 2.628 2.981 . 0 0 "[ . 1 . 2]" 1
1613 1 89 ILE MD 1 94 PHE QD . . 4.140 3.402 3.188 3.818 . 0 0 "[ . 1 . 2]" 1
1614 1 89 ILE MD 1 94 PHE QE . . 3.640 1.836 1.771 1.928 . 0 0 "[ . 1 . 2]" 1
1615 1 89 ILE MD 1 94 PHE HZ . . 4.320 2.808 2.074 3.329 . 0 0 "[ . 1 . 2]" 1
1616 1 89 ILE QG 1 92 SER H . . 3.720 2.349 2.261 2.511 . 0 0 "[ . 1 . 2]" 1
1617 1 89 ILE QG 1 92 SER HB2 . . 4.140 2.904 2.870 2.957 . 0 0 "[ . 1 . 2]" 1
1618 1 89 ILE QG 1 92 SER HB3 . . 4.530 1.809 1.796 1.900 . 0 0 "[ . 1 . 2]" 1
1619 1 89 ILE QG 1 94 PHE QE . . 4.990 3.086 2.759 3.364 . 0 0 "[ . 1 . 2]" 1
1620 1 89 ILE MG 1 90 PRO HD2 . . 4.520 3.215 3.153 3.352 . 0 0 "[ . 1 . 2]" 1
1621 1 89 ILE MG 1 90 PRO QD . . 3.870 3.087 3.030 3.213 . 0 0 "[ . 1 . 2]" 1
1622 1 89 ILE MG 1 90 PRO HD3 . . 4.520 3.988 3.901 4.119 . 0 0 "[ . 1 . 2]" 1
1623 1 90 PRO HA 1 91 GLY H . . 2.700 2.374 2.319 2.400 . 0 0 "[ . 1 . 2]" 1
1624 1 90 PRO HA 1 91 GLY QA . . 4.450 3.921 3.912 3.926 . 0 0 "[ . 1 . 2]" 1
1625 1 90 PRO HA 1 92 SER H . . 4.000 3.944 3.873 3.975 . 0 0 "[ . 1 . 2]" 1
1626 1 90 PRO HB2 1 91 GLY H . . 4.500 4.223 4.167 4.246 . 0 0 "[ . 1 . 2]" 1
1627 1 90 PRO HB3 1 91 GLY H . . 4.500 4.523 4.474 4.543 0.043 17 0 "[ . 1 . 2]" 1
1628 1 91 GLY H 1 92 SER H . . 3.340 1.823 1.796 1.959 . 0 0 "[ . 1 . 2]" 1
1629 1 91 GLY H 1 92 SER HB3 . . 4.840 4.073 4.036 4.165 . 0 0 "[ . 1 . 2]" 1
1630 1 91 GLY QA 1 94 PHE QE . . 3.840 2.772 2.345 3.074 . 0 0 "[ . 1 . 2]" 1
1631 1 91 GLY QA 1 94 PHE HZ . . 3.900 2.410 2.163 2.802 . 0 0 "[ . 1 . 2]" 1
1632 1 91 GLY HA2 1 94 PHE QE . . 4.540 3.764 3.218 4.245 . 0 0 "[ . 1 . 2]" 1
1633 1 91 GLY HA2 1 94 PHE HZ . . 4.630 4.095 3.829 4.500 . 0 0 "[ . 1 . 2]" 1
1634 1 91 GLY HA3 1 94 PHE QE . . 4.540 2.854 2.409 3.171 . 0 0 "[ . 1 . 2]" 1
1635 1 91 GLY HA3 1 94 PHE HZ . . 4.630 2.428 2.175 2.830 . 0 0 "[ . 1 . 2]" 1
1636 1 92 SER H 1 92 SER HB2 . . 3.360 3.374 3.331 3.386 0.026 14 0 "[ . 1 . 2]" 1
1637 1 92 SER H 1 92 SER HB3 . . 3.240 2.349 2.293 2.374 . 0 0 "[ . 1 . 2]" 1
1638 1 92 SER H 1 92 SER HG . . 4.050 3.762 3.719 3.800 . 0 0 "[ . 1 . 2]" 1
1639 1 92 SER H 1 93 PRO HA . . 4.950 4.769 4.760 4.774 . 0 0 "[ . 1 . 2]" 1
1640 1 92 SER H 1 94 PHE H . . 5.500 5.424 5.295 5.510 0.010 19 0 "[ . 1 . 2]" 1
1641 1 92 SER H 1 94 PHE QD . . 5.050 4.728 4.350 4.992 . 0 0 "[ . 1 . 2]" 1
1642 1 92 SER H 1 94 PHE QE . . 4.490 3.907 3.400 4.255 . 0 0 "[ . 1 . 2]" 1
1643 1 92 SER H 1 94 PHE HZ . . 5.350 4.458 4.200 4.782 . 0 0 "[ . 1 . 2]" 1
1644 1 92 SER HA 1 93 PRO HA . . 3.410 2.394 2.385 2.408 . 0 0 "[ . 1 . 2]" 1
1645 1 92 SER HA 1 93 PRO HB3 . . 4.540 4.497 4.491 4.509 . 0 0 "[ . 1 . 2]" 1
1646 1 92 SER HA 1 93 PRO HG2 . . 5.500 4.766 4.765 4.769 . 0 0 "[ . 1 . 2]" 1
1647 1 92 SER HA 1 94 PHE H . . 3.490 2.581 2.459 2.688 . 0 0 "[ . 1 . 2]" 1
1648 1 92 SER HA 1 94 PHE QD . . 4.050 3.055 2.488 3.445 . 0 0 "[ . 1 . 2]" 1
1649 1 92 SER HA 1 94 PHE QE . . 4.860 3.815 3.396 4.034 . 0 0 "[ . 1 . 2]" 1
1650 1 92 SER HB2 1 93 PRO HA . . 4.550 2.752 2.714 2.779 . 0 0 "[ . 1 . 2]" 1
1651 1 92 SER HB2 1 94 PHE H . . 4.550 3.127 3.015 3.228 . 0 0 "[ . 1 . 2]" 1
1652 1 92 SER HB2 1 94 PHE QD . . 4.440 2.426 2.061 2.768 . 0 0 "[ . 1 . 2]" 1
1653 1 92 SER HB2 1 94 PHE QE . . 4.970 2.805 2.055 3.062 . 0 0 "[ . 1 . 2]" 1
1654 1 92 SER HB3 1 93 PRO HA . . 4.110 3.716 3.698 3.728 . 0 0 "[ . 1 . 2]" 1
1655 1 92 SER HG 1 93 PRO HA . . 4.290 2.866 2.787 2.962 . 0 0 "[ . 1 . 2]" 1
1656 1 92 SER HG 1 94 PHE H . . 4.830 4.711 4.601 4.820 . 0 0 "[ . 1 . 2]" 1
1657 1 93 PRO HA 1 94 PHE H . . 3.000 2.175 2.161 2.189 . 0 0 "[ . 1 . 2]" 1
1658 1 93 PRO HA 1 94 PHE QD . . 4.400 3.772 3.166 4.091 . 0 0 "[ . 1 . 2]" 1
1659 1 93 PRO HB2 1 94 PHE H . . 3.910 3.367 3.291 3.457 . 0 0 "[ . 1 . 2]" 1
1660 1 93 PRO HB2 1 95 THR H . . 5.020 4.884 4.639 5.024 0.004 2 0 "[ . 1 . 2]" 1
1661 1 93 PRO HB3 1 94 PHE H . . 4.000 3.891 3.842 3.949 . 0 0 "[ . 1 . 2]" 1
1662 1 93 PRO HG2 1 95 THR H . . 5.410 5.180 4.913 5.337 . 0 0 "[ . 1 . 2]" 1
1663 1 94 PHE H 1 94 PHE HB2 . . 3.570 2.340 2.290 2.433 . 0 0 "[ . 1 . 2]" 1
1664 1 94 PHE H 1 94 PHE HB3 . . 3.920 3.582 3.560 3.612 . 0 0 "[ . 1 . 2]" 1
1665 1 94 PHE H 1 94 PHE QD . . 3.230 2.510 2.014 2.780 . 0 0 "[ . 1 . 2]" 1
1666 1 94 PHE H 1 94 PHE QE . . 4.820 4.570 4.248 4.704 . 0 0 "[ . 1 . 2]" 1
1667 1 94 PHE H 1 95 THR H . . 4.440 4.350 4.254 4.402 . 0 0 "[ . 1 . 2]" 1
1668 1 94 PHE HA 1 94 PHE QD . . 4.190 2.865 2.638 3.128 . 0 0 "[ . 1 . 2]" 1
1669 1 94 PHE HA 1 95 THR H . . 2.640 2.152 2.140 2.177 . 0 0 "[ . 1 . 2]" 1
1670 1 94 PHE HA 1 95 THR HB . . 4.710 4.666 4.614 4.705 . 0 0 "[ . 1 . 2]" 1
1671 1 94 PHE HB2 1 95 THR H . . 4.510 4.457 4.368 4.503 . 0 0 "[ . 1 . 2]" 1
1672 1 94 PHE HB3 1 95 THR H . . 3.830 3.689 3.582 3.827 . 0 0 "[ . 1 . 2]" 1
1673 1 94 PHE QD 1 95 THR H . . 4.620 4.287 4.133 4.629 0.009 16 0 "[ . 1 . 2]" 1
1674 1 95 THR H 1 95 THR HB . . 2.940 2.560 2.497 2.604 . 0 0 "[ . 1 . 2]" 1
1675 1 95 THR H 1 95 THR MG . . 3.850 3.774 3.769 3.782 . 0 0 "[ . 1 . 2]" 1
1676 1 95 THR H 1 96 ALA H . . 4.480 4.294 4.260 4.374 . 0 0 "[ . 1 . 2]" 1
1677 1 95 THR HA 1 95 THR MG . . 3.360 2.334 2.259 2.429 . 0 0 "[ . 1 . 2]" 1
1678 1 95 THR HA 1 96 ALA H . . 2.690 2.182 2.156 2.195 . 0 0 "[ . 1 . 2]" 1
1679 1 95 THR HA 1 96 ALA MB . . 4.140 4.051 3.996 4.115 . 0 0 "[ . 1 . 2]" 1
1680 1 95 THR HB 1 96 ALA H . . 4.590 4.401 4.354 4.426 . 0 0 "[ . 1 . 2]" 1
1681 1 95 THR MG 1 96 ALA H . . 3.100 3.066 2.948 3.105 0.005 18 0 "[ . 1 . 2]" 1
1682 1 96 ALA H 1 96 ALA MB . . 3.060 2.240 2.170 2.346 . 0 0 "[ . 1 . 2]" 1
1683 1 96 ALA H 1 97 LYS H . . 4.700 4.498 4.457 4.531 . 0 0 "[ . 1 . 2]" 1
1684 1 96 ALA H 1 97 LYS HA . . 5.290 5.141 5.083 5.207 . 0 0 "[ . 1 . 2]" 1
1685 1 96 ALA HA 1 97 LYS H . . 2.720 2.172 2.156 2.192 . 0 0 "[ . 1 . 2]" 1
1686 1 96 ALA HA 1 97 LYS QB . . 4.280 4.078 3.998 4.263 . 0 0 "[ . 1 . 2]" 1
1687 1 96 ALA MB 1 97 LYS H . . 3.370 3.036 2.903 3.122 . 0 0 "[ . 1 . 2]" 1
1688 1 96 ALA MB 1 98 ILE H . . 4.980 4.832 4.455 4.982 0.002 9 0 "[ . 1 . 2]" 1
1689 1 96 ALA MB 1 98 ILE MD . . 3.300 2.918 2.706 3.207 . 0 0 "[ . 1 . 2]" 1
1690 1 96 ALA MB 1 98 ILE HG12 . . 4.240 3.273 3.036 3.484 . 0 0 "[ . 1 . 2]" 1
1691 1 97 LYS H 1 97 LYS QB . . 2.970 2.270 2.191 2.660 . 0 0 "[ . 1 . 2]" 1
1692 1 97 LYS H 1 97 LYS HG2 . . 4.540 4.219 2.092 4.556 0.016 2 0 "[ . 1 . 2]" 1
1693 1 97 LYS H 1 97 LYS QG . . 3.950 3.564 2.071 3.964 0.014 12 0 "[ . 1 . 2]" 1
1694 1 97 LYS H 1 97 LYS HG3 . . 4.540 3.973 3.130 4.568 0.028 16 0 "[ . 1 . 2]" 1
1695 1 97 LYS H 1 98 ILE H . . 4.520 4.456 4.296 4.518 . 0 0 "[ . 1 . 2]" 1
1696 1 97 LYS H 1 98 ILE MD . . 4.570 4.391 4.142 4.574 0.004 13 0 "[ . 1 . 2]" 1
1697 1 97 LYS HA 1 98 ILE H . . 2.990 2.149 2.140 2.166 . 0 0 "[ . 1 . 2]" 1
1698 1 97 LYS QB 1 97 LYS QE . . 4.530 3.115 2.022 3.754 . 0 0 "[ . 1 . 2]" 1
1699 1 97 LYS QB 1 98 ILE H . . 3.840 3.561 3.185 3.864 0.024 16 0 "[ . 1 . 2]" 1
1700 1 97 LYS QB 1 99 THR H . . 5.500 5.128 4.700 5.508 0.008 20 0 "[ . 1 . 2]" 1
1701 1 97 LYS QG 1 98 ILE H . . 4.310 3.321 2.591 4.188 . 0 0 "[ . 1 . 2]" 1
1702 1 98 ILE H 1 98 ILE HB . . 3.240 2.632 2.542 2.695 . 0 0 "[ . 1 . 2]" 1
1703 1 98 ILE H 1 98 ILE MD . . 3.980 3.779 3.655 3.932 . 0 0 "[ . 1 . 2]" 1
1704 1 98 ILE H 1 98 ILE HG12 . . 3.520 2.809 2.615 2.986 . 0 0 "[ . 1 . 2]" 1
1705 1 98 ILE H 1 98 ILE HG13 . . 4.370 4.115 3.928 4.291 . 0 0 "[ . 1 . 2]" 1
1706 1 98 ILE H 1 98 ILE MG . . 4.050 3.842 3.806 3.869 . 0 0 "[ . 1 . 2]" 1
1707 1 98 ILE H 1 99 THR H . . 4.900 4.301 4.193 4.426 . 0 0 "[ . 1 . 2]" 1
1708 1 98 ILE HA 1 98 ILE MD . . 3.650 1.981 1.957 2.012 . 0 0 "[ . 1 . 2]" 1
1709 1 98 ILE HA 1 99 THR H . . 2.880 2.142 2.138 2.168 . 0 0 "[ . 1 . 2]" 1
1710 1 98 ILE HB 1 99 THR H . . 4.670 4.250 4.104 4.314 . 0 0 "[ . 1 . 2]" 1
1711 1 98 ILE MD 1 98 ILE MG . . 3.200 1.968 1.910 2.100 . 0 0 "[ . 1 . 2]" 1
1712 1 98 ILE MD 1 99 THR H . . 3.540 3.510 3.382 3.547 0.007 13 0 "[ . 1 . 2]" 1
1713 1 98 ILE HG12 1 98 ILE MG . . 3.580 3.196 3.186 3.202 . 0 0 "[ . 1 . 2]" 1
1714 1 98 ILE HG12 1 99 THR H . . 5.180 5.063 4.971 5.139 . 0 0 "[ . 1 . 2]" 1
1715 1 98 ILE MG 1 99 THR H . . 3.420 2.702 2.265 2.876 . 0 0 "[ . 1 . 2]" 1
1716 1 99 THR H 1 99 THR HB . . 3.780 3.647 3.207 3.716 . 0 0 "[ . 1 . 2]" 1
1717 1 99 THR H 1 99 THR MG . . 3.320 2.664 1.764 2.998 . 0 0 "[ . 1 . 2]" 1
1718 1 99 THR H 1 100 GLY H . . 4.640 4.558 4.462 4.596 . 0 0 "[ . 1 . 2]" 1
1719 1 99 THR HA 1 100 GLY H . . 3.090 2.328 2.192 2.536 . 0 0 "[ . 1 . 2]" 1
1720 1 99 THR HB 1 100 GLY H . . 3.100 2.662 2.311 3.212 0.112 20 0 "[ . 1 . 2]" 1
1721 1 99 THR MG 1 100 GLY H . . 3.720 3.654 3.515 3.740 0.020 20 0 "[ . 1 . 2]" 1
1722 1 100 GLY H 1 101 ASP H . . 4.300 4.227 3.865 4.302 0.002 8 0 "[ . 1 . 2]" 1
1723 1 100 GLY QA 1 101 ASP H . . 3.010 2.169 2.108 2.238 . 0 0 "[ . 1 . 2]" 1
1724 1 100 GLY HA2 1 101 ASP H . . 3.440 2.424 2.138 3.238 . 0 0 "[ . 1 . 2]" 1
1725 1 100 GLY HA3 1 101 ASP H . . 3.440 2.832 2.136 3.301 . 0 0 "[ . 1 . 2]" 1
1726 1 101 ASP H 1 101 ASP QB . . 3.450 2.790 2.182 3.362 . 0 0 "[ . 1 . 2]" 1
1727 1 101 ASP H 1 102 ASP H . . 4.530 4.152 2.469 4.527 . 0 0 "[ . 1 . 2]" 1
1728 1 101 ASP HA 1 102 ASP H . . 3.490 2.434 2.145 3.568 0.078 20 0 "[ . 1 . 2]" 1
1729 1 101 ASP QB 1 102 ASP H . . 3.750 2.971 2.095 3.714 . 0 0 "[ . 1 . 2]" 1
1730 1 102 ASP H 1 102 ASP QB . . 3.890 2.530 2.198 3.091 . 0 0 "[ . 1 . 2]" 1
1731 1 102 ASP QB 1 103 SER H . . 4.280 3.215 1.996 4.041 . 0 0 "[ . 1 . 2]" 1
1732 1 103 SER H 1 103 SER QB . . 3.460 2.662 2.246 3.337 . 0 0 "[ . 1 . 2]" 1
1733 1 103 SER H 1 104 MET H . . 4.480 4.001 2.120 4.462 . 0 0 "[ . 1 . 2]" 1
1734 1 104 MET H 1 104 MET QB . . 3.620 2.559 2.209 3.332 . 0 0 "[ . 1 . 2]" 1
1735 1 104 MET H 1 104 MET HG2 . . 4.880 3.941 2.144 4.689 . 0 0 "[ . 1 . 2]" 1
1736 1 104 MET H 1 104 MET HG3 . . 4.880 4.062 2.021 4.822 . 0 0 "[ . 1 . 2]" 1
1737 1 104 MET QB 1 104 MET QG . . 2.330 2.034 1.979 2.070 . 0 0 "[ . 1 . 2]" 1
1738 1 104 MET HB2 1 104 MET HG2 . . 2.990 2.735 2.382 2.985 . 0 0 "[ . 1 . 2]" 1
1739 1 104 MET HB2 1 104 MET HG3 . . 2.990 2.599 2.263 3.004 0.014 15 0 "[ . 1 . 2]" 1
1740 1 104 MET HB3 1 104 MET HG2 . . 2.990 2.539 2.276 3.000 0.010 4 0 "[ . 1 . 2]" 1
1741 1 104 MET HB3 1 104 MET HG3 . . 2.990 2.734 2.387 2.982 . 0 0 "[ . 1 . 2]" 1
1742 1 104 MET ME 1 104 MET HG2 . . 2.880 2.581 2.145 2.985 0.105 4 0 "[ . 1 . 2]" 1
1743 1 104 MET ME 1 104 MET HG3 . . 2.880 2.388 2.009 2.749 . 0 0 "[ . 1 . 2]" 1
1744 1 105 ARG H 1 105 ARG QG . . 4.890 3.244 2.176 4.147 . 0 0 "[ . 1 . 2]" 1
1745 1 105 ARG HA 1 105 ARG QD . . 4.980 3.613 2.158 4.451 . 0 0 "[ . 1 . 2]" 1
1746 1 105 ARG HA 1 105 ARG QG . . 3.720 2.610 2.155 3.441 . 0 0 "[ . 1 . 2]" 1
1747 1 107 GLY H 1 108 PRO HA . . 4.970 4.603 4.217 4.931 . 0 0 "[ . 1 . 2]" 1
1748 1 107 GLY QA 1 108 PRO QD . . 3.210 1.973 1.842 2.190 . 0 0 "[ . 1 . 2]" 1
1749 1 107 GLY HA2 1 108 PRO QD . . 3.750 2.067 1.855 3.459 . 0 0 "[ . 1 . 2]" 1
1750 1 107 GLY HA3 1 108 PRO QD . . 3.750 3.030 2.214 3.468 . 0 0 "[ . 1 . 2]" 1
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