NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
442920 |
2kdn   |
16118 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kdn
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 1588
_Distance_constraint_stats_list.Viol_count 635
_Distance_constraint_stats_list.Viol_total 85.735
_Distance_constraint_stats_list.Viol_max 0.069
_Distance_constraint_stats_list.Viol_rms 0.0015
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0068
_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 11 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 SER 0.016 0.013 4 0 "[ . 1 . 2]"
1 13 GLY 0.056 0.018 14 0 "[ . 1 . 2]"
1 14 ARG 0.107 0.014 8 0 "[ . 1 . 2]"
1 15 GLU 0.101 0.018 14 0 "[ . 1 . 2]"
1 16 ASN 0.096 0.014 8 0 "[ . 1 . 2]"
1 17 LEU 0.030 0.008 10 0 "[ . 1 . 2]"
1 18 TYR 0.082 0.016 17 0 "[ . 1 . 2]"
1 19 PHE 0.107 0.016 17 0 "[ . 1 . 2]"
1 20 GLN 0.106 0.017 9 0 "[ . 1 . 2]"
1 21 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ILE 0.021 0.005 9 0 "[ . 1 . 2]"
1 26 GLN 0.039 0.009 9 0 "[ . 1 . 2]"
1 27 LYS 0.004 0.004 9 0 "[ . 1 . 2]"
1 28 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 ILE 0.009 0.005 19 0 "[ . 1 . 2]"
1 30 GLU 0.027 0.005 6 0 "[ . 1 . 2]"
1 31 ASP 0.045 0.013 17 0 "[ . 1 . 2]"
1 32 LYS 0.020 0.008 19 0 "[ . 1 . 2]"
1 33 LEU 0.138 0.012 17 0 "[ . 1 . 2]"
1 34 SER 0.013 0.013 17 0 "[ . 1 . 2]"
1 35 SER 0.032 0.008 15 0 "[ . 1 . 2]"
1 36 ALA 0.021 0.012 17 0 "[ . 1 . 2]"
1 37 LEU 0.035 0.005 17 0 "[ . 1 . 2]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 PRO 0.025 0.006 16 0 "[ . 1 . 2]"
1 40 THR 0.049 0.008 19 0 "[ . 1 . 2]"
1 41 PHE 0.004 0.001 10 0 "[ . 1 . 2]"
1 42 LEU 0.002 0.002 11 0 "[ . 1 . 2]"
1 43 GLU 0.008 0.004 10 0 "[ . 1 . 2]"
1 44 LEU 0.060 0.011 2 0 "[ . 1 . 2]"
1 45 VAL 0.111 0.029 13 0 "[ . 1 . 2]"
1 46 ASP 0.035 0.029 13 0 "[ . 1 . 2]"
1 47 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 SER 0.003 0.003 14 0 "[ . 1 . 2]"
1 55 PHE 0.015 0.004 2 0 "[ . 1 . 2]"
1 56 ASP 0.050 0.012 5 0 "[ . 1 . 2]"
1 57 ALA 0.020 0.011 2 0 "[ . 1 . 2]"
1 58 VAL 0.006 0.004 10 0 "[ . 1 . 2]"
1 59 ILE 0.205 0.018 15 0 "[ . 1 . 2]"
1 60 VAL 0.031 0.012 10 0 "[ . 1 . 2]"
1 61 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ASN 0.207 0.019 2 0 "[ . 1 . 2]"
1 63 ASN 0.103 0.009 19 0 "[ . 1 . 2]"
1 64 PHE 0.018 0.009 9 0 "[ . 1 . 2]"
1 65 GLU 0.458 0.069 17 0 "[ . 1 . 2]"
1 66 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LYS 0.134 0.019 13 0 "[ . 1 . 2]"
1 69 LEU 0.047 0.014 2 0 "[ . 1 . 2]"
1 70 LEU 0.220 0.019 13 0 "[ . 1 . 2]"
1 71 ASP 0.090 0.011 10 0 "[ . 1 . 2]"
1 72 ARG 0.010 0.009 7 0 "[ . 1 . 2]"
1 73 HIS 0.031 0.009 7 0 "[ . 1 . 2]"
1 74 ARG 0.028 0.010 11 0 "[ . 1 . 2]"
1 75 LEU 0.003 0.003 4 0 "[ . 1 . 2]"
1 76 VAL 0.035 0.007 14 0 "[ . 1 . 2]"
1 77 ASN 0.119 0.016 14 0 "[ . 1 . 2]"
1 78 THR 0.028 0.006 7 0 "[ . 1 . 2]"
1 79 ILE 0.126 0.010 12 0 "[ . 1 . 2]"
1 80 LEU 0.109 0.012 17 0 "[ . 1 . 2]"
1 81 LYS 0.070 0.015 10 0 "[ . 1 . 2]"
1 82 GLU 0.353 0.021 20 0 "[ . 1 . 2]"
1 83 GLU 0.610 0.069 8 0 "[ . 1 . 2]"
1 84 LEU 0.758 0.069 8 0 "[ . 1 . 2]"
1 85 GLN 0.464 0.021 20 0 "[ . 1 . 2]"
1 86 ASN 0.025 0.005 9 0 "[ . 1 . 2]"
1 87 ILE 0.228 0.012 8 0 "[ . 1 . 2]"
1 88 HIS 0.042 0.016 12 0 "[ . 1 . 2]"
1 89 ALA 0.016 0.016 12 0 "[ . 1 . 2]"
1 90 PHE 0.184 0.012 7 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 MET 0.015 0.006 6 0 "[ . 1 . 2]"
1 93 LYS 0.042 0.015 5 0 "[ . 1 . 2]"
1 94 CYS 0.045 0.015 5 0 "[ . 1 . 2]"
1 95 HIS 0.088 0.018 15 0 "[ . 1 . 2]"
1 96 THR 0.176 0.015 17 0 "[ . 1 . 2]"
1 97 PRO 0.024 0.016 11 0 "[ . 1 . 2]"
1 98 LEU 0.054 0.016 11 0 "[ . 1 . 2]"
1 99 GLU 0.042 0.008 1 0 "[ . 1 . 2]"
1 100 TYR 0.049 0.009 19 0 "[ . 1 . 2]"
1 101 ASP 0.031 0.005 9 0 "[ . 1 . 2]"
1 102 LYS 0.079 0.014 1 0 "[ . 1 . 2]"
1 103 LEU 0.051 0.006 1 0 "[ . 1 . 2]"
1 104 LYS 0.180 0.015 16 0 "[ . 1 . 2]"
1 105 SER 0.009 0.008 3 0 "[ . 1 . 2]"
1 106 LYS 0.437 0.030 19 0 "[ . 1 . 2]"
1 107 GLY 0.273 0.030 19 0 "[ . 1 . 2]"
1 108 SER 0.037 0.018 16 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 40 THR MG 1 62 ASN H 4.610 . 5.300 3.519 2.885 4.322 . 0 0 "[ . 1 . 2]" 1
2 1 62 ASN H 1 62 ASN HB2 3.870 . 4.450 2.297 2.069 2.507 . 0 0 "[ . 1 . 2]" 1
3 1 62 ASN H 1 62 ASN HB3 3.810 . 4.380 3.507 3.018 3.600 . 0 0 "[ . 1 . 2]" 1
4 1 61 SER HB2 1 62 ASN H 5.500 . 6.330 3.723 2.738 4.039 . 0 0 "[ . 1 . 2]" 1
5 1 61 SER HB3 1 62 ASN H 5.500 . 6.330 3.913 3.708 4.088 . 0 0 "[ . 1 . 2]" 1
6 1 68 LYS H 1 70 LEU MD1 5.020 . 5.770 5.143 4.699 5.583 . 0 0 "[ . 1 . 2]" 1
7 1 68 LYS H 1 68 LYS HB3 3.870 . 4.450 3.611 3.515 3.674 . 0 0 "[ . 1 . 2]" 1
8 1 68 LYS H 1 68 LYS HB2 3.870 . 4.450 2.472 2.222 2.670 . 0 0 "[ . 1 . 2]" 1
9 1 68 LYS H 1 69 LEU H 4.570 . 5.260 4.201 4.036 4.523 . 0 0 "[ . 1 . 2]" 1
10 1 87 ILE MD 1 88 HIS H 4.390 . 5.050 4.857 4.490 5.062 0.012 8 0 "[ . 1 . 2]" 1
11 1 87 ILE MG 1 88 HIS H 3.530 . 4.060 2.152 1.798 2.517 0.002 12 0 "[ . 1 . 2]" 1
12 1 87 ILE HG13 1 88 HIS H 4.910 . 5.650 5.091 4.797 5.245 . 0 0 "[ . 1 . 2]" 1
13 1 88 HIS H 1 89 ALA MB 4.400 . 5.060 4.609 4.057 4.840 . 0 0 "[ . 1 . 2]" 1
14 1 87 ILE HG12 1 88 HIS H 4.880 . 5.610 4.652 4.557 4.756 . 0 0 "[ . 1 . 2]" 1
15 1 87 ILE HB 1 88 HIS H 4.350 . 5.000 3.562 2.775 3.888 . 0 0 "[ . 1 . 2]" 1
16 1 45 VAL HB 1 46 ASP H 4.240 . 4.880 3.988 2.669 4.328 . 0 0 "[ . 1 . 2]" 1
17 1 46 ASP H 1 46 ASP HB2 4.130 . 4.750 2.687 2.352 3.502 . 0 0 "[ . 1 . 2]" 1
18 1 46 ASP H 1 55 PHE HD1 5.010 . 5.760 4.726 3.670 5.764 0.004 6 0 "[ . 1 . 2]" 1
19 1 46 ASP H 1 47 LYS H 5.030 . 5.780 4.399 4.258 4.557 . 0 0 "[ . 1 . 2]" 1
20 1 44 LEU HA 1 58 VAL H 4.250 . 4.890 3.620 3.213 3.913 . 0 0 "[ . 1 . 2]" 1
21 1 43 GLU HA 1 58 VAL H 4.800 . 5.520 4.896 4.608 5.123 . 0 0 "[ . 1 . 2]" 1
22 1 58 VAL H 1 58 VAL HB 3.830 . 4.400 2.555 2.516 2.601 . 0 0 "[ . 1 . 2]" 1
23 1 43 GLU HB3 1 58 VAL H 4.020 . 4.620 3.468 2.673 4.028 . 0 0 "[ . 1 . 2]" 1
24 1 57 ALA MB 1 58 VAL H 3.470 . 3.990 3.239 3.113 3.312 . 0 0 "[ . 1 . 2]" 1
25 1 43 GLU H 1 44 LEU H 4.570 . 5.260 4.299 4.064 4.522 . 0 0 "[ . 1 . 2]" 1
26 1 44 LEU H 1 57 ALA HA 4.910 . 5.650 4.888 4.533 5.118 . 0 0 "[ . 1 . 2]" 1
27 1 43 GLU HA 1 44 LEU H 3.020 . 3.470 2.160 2.121 2.219 . 0 0 "[ . 1 . 2]" 1
28 1 43 GLU HG2 1 44 LEU H 4.140 . 4.760 3.518 2.450 4.421 . 0 0 "[ . 1 . 2]" 1
29 1 44 LEU H 1 44 LEU HB2 3.460 . 3.980 2.422 2.290 2.613 . 0 0 "[ . 1 . 2]" 1
30 1 60 VAL MG2 1 95 HIS H 4.320 . 4.970 3.851 3.502 4.390 . 0 0 "[ . 1 . 2]" 1
31 1 60 VAL MG1 1 95 HIS H 5.230 . 6.010 4.748 4.431 5.403 . 0 0 "[ . 1 . 2]" 1
32 1 59 ILE MG 1 95 HIS H 3.690 . 4.240 3.375 2.802 4.258 0.018 15 0 "[ . 1 . 2]" 1
33 1 59 ILE MD 1 95 HIS H 3.950 . 4.540 3.118 2.363 3.471 . 0 0 "[ . 1 . 2]" 1
34 1 44 LEU HB2 1 45 VAL H 4.400 . 5.060 4.366 4.248 4.556 . 0 0 "[ . 1 . 2]" 1
35 1 45 VAL H 1 45 VAL HB 4.010 . 4.610 2.733 2.510 3.718 . 0 0 "[ . 1 . 2]" 1
36 1 93 LYS HA 1 95 HIS H 5.500 . 6.330 5.848 5.369 6.144 . 0 0 "[ . 1 . 2]" 1
37 1 94 CYS HA 1 95 HIS H 3.430 . 3.940 2.139 2.114 2.184 . 0 0 "[ . 1 . 2]" 1
38 1 60 VAL HA 1 95 HIS H 4.300 . 4.950 3.159 2.858 3.767 . 0 0 "[ . 1 . 2]" 1
39 1 59 ILE H 1 95 HIS H 4.140 . 4.760 3.875 3.339 4.118 . 0 0 "[ . 1 . 2]" 1
40 1 44 LEU MD2 1 45 VAL H 4.400 . 5.060 4.647 3.340 4.972 . 0 0 "[ . 1 . 2]" 1
41 1 45 VAL H 1 56 ASP HB2 4.740 . 5.450 5.032 4.465 5.445 . 0 0 "[ . 1 . 2]" 1
42 1 45 VAL H 1 55 PHE HB3 4.560 . 5.240 4.397 3.638 5.164 . 0 0 "[ . 1 . 2]" 1
43 1 45 VAL H 1 56 ASP HB3 4.750 . 5.460 3.721 2.868 4.047 . 0 0 "[ . 1 . 2]" 1
44 1 44 LEU HA 1 45 VAL H 3.420 . 3.930 2.128 2.092 2.161 . 0 0 "[ . 1 . 2]" 1
45 1 45 VAL H 1 57 ALA HA 4.190 . 4.820 3.128 2.642 3.539 . 0 0 "[ . 1 . 2]" 1
46 1 45 VAL H 1 55 PHE HD1 4.950 . 5.690 4.767 4.189 5.694 0.004 2 0 "[ . 1 . 2]" 1
47 1 66 ASP H 1 96 THR MG 4.900 . 5.640 4.591 4.351 5.072 . 0 0 "[ . 1 . 2]" 1
48 1 59 ILE MD 1 63 ASN H 4.670 . 5.370 4.664 4.225 5.371 0.001 1 0 "[ . 1 . 2]" 1
49 1 37 LEU HB3 1 63 ASN H 5.500 . 6.330 5.538 4.824 6.023 . 0 0 "[ . 1 . 2]" 1
50 1 63 ASN H 1 96 THR MG 4.920 . 5.660 5.212 4.626 5.668 0.008 2 0 "[ . 1 . 2]" 1
51 1 63 ASN H 1 63 ASN HB3 3.510 . 4.040 2.601 2.455 2.744 . 0 0 "[ . 1 . 2]" 1
52 1 63 ASN H 1 63 ASN HB2 3.510 . 4.040 2.566 2.356 3.650 . 0 0 "[ . 1 . 2]" 1
53 1 62 ASN HB2 1 63 ASN H 4.200 . 4.830 3.261 3.090 3.673 . 0 0 "[ . 1 . 2]" 1
54 1 62 ASN HB3 1 63 ASN H 4.050 . 4.660 3.823 3.181 4.053 . 0 0 "[ . 1 . 2]" 1
55 1 61 SER HA 1 63 ASN H 4.340 . 4.990 3.763 3.638 3.973 . 0 0 "[ . 1 . 2]" 1
56 1 62 ASN H 1 63 ASN H 4.020 . 4.620 2.571 2.513 2.681 . 0 0 "[ . 1 . 2]" 1
57 1 95 HIS H 1 96 THR H 4.880 . 5.610 4.399 4.340 4.481 . 0 0 "[ . 1 . 2]" 1
58 1 95 HIS HB2 1 96 THR H 4.570 . 5.260 3.865 3.655 4.194 . 0 0 "[ . 1 . 2]" 1
59 1 95 HIS HB3 1 96 THR H 4.570 . 5.260 2.669 2.173 3.906 . 0 0 "[ . 1 . 2]" 1
60 1 96 THR H 1 99 GLU HB3 4.230 . 4.860 3.935 2.231 4.866 0.006 11 0 "[ . 1 . 2]" 1
61 1 96 THR H 1 99 GLU HB2 4.100 . 4.720 3.161 1.840 4.363 . 0 0 "[ . 1 . 2]" 1
62 1 59 ILE MD 1 96 THR H 5.500 . 6.330 6.026 5.046 6.334 0.004 17 0 "[ . 1 . 2]" 1
63 1 87 ILE MG 1 90 PHE H 4.090 . 4.700 3.409 2.971 4.425 . 0 0 "[ . 1 . 2]" 1
64 1 87 ILE HG13 1 90 PHE H 5.160 . 5.930 5.937 5.932 5.942 0.012 7 0 "[ . 1 . 2]" 1
65 1 90 PHE H 1 90 PHE HB3 3.900 . 4.490 2.536 2.476 2.666 . 0 0 "[ . 1 . 2]" 1
66 1 90 PHE H 1 90 PHE HB2 3.900 . 4.490 2.834 2.561 3.183 . 0 0 "[ . 1 . 2]" 1
67 1 89 ALA HA 1 90 PHE H 3.000 . 3.450 2.203 2.128 2.572 . 0 0 "[ . 1 . 2]" 1
68 1 90 PHE H 1 90 PHE HD2 4.560 . 5.240 4.633 4.404 4.747 . 0 0 "[ . 1 . 2]" 1
69 1 55 PHE H 1 90 PHE H 5.160 . 5.930 4.904 4.575 5.106 . 0 0 "[ . 1 . 2]" 1
70 1 44 LEU HB3 1 56 ASP H 5.420 . 6.230 5.106 4.451 6.232 0.002 7 0 "[ . 1 . 2]" 1
71 1 56 ASP H 1 56 ASP HB2 3.900 . 4.490 2.827 2.437 3.091 . 0 0 "[ . 1 . 2]" 1
72 1 55 PHE HB3 1 56 ASP H 3.780 . 4.350 3.053 2.535 3.244 . 0 0 "[ . 1 . 2]" 1
73 1 55 PHE HB2 1 56 ASP H 4.150 . 4.770 4.077 3.680 4.199 . 0 0 "[ . 1 . 2]" 1
74 1 46 ASP HA 1 56 ASP H 4.410 . 5.070 3.844 3.386 4.638 . 0 0 "[ . 1 . 2]" 1
75 1 55 PHE HA 1 56 ASP H 3.540 . 4.070 2.176 2.088 2.321 . 0 0 "[ . 1 . 2]" 1
76 1 55 PHE HD1 1 56 ASP H 4.050 . 4.660 3.890 3.642 4.153 . 0 0 "[ . 1 . 2]" 1
77 1 55 PHE H 1 56 ASP H 4.650 . 5.350 4.390 4.317 4.469 . 0 0 "[ . 1 . 2]" 1
78 1 47 LYS H 1 56 ASP H 4.620 . 5.310 3.560 3.078 4.105 . 0 0 "[ . 1 . 2]" 1
79 1 45 VAL H 1 56 ASP H 4.090 . 4.700 3.273 2.882 3.784 . 0 0 "[ . 1 . 2]" 1
80 1 25 ILE MG 1 26 GLN H 4.180 . 4.810 2.160 1.881 2.291 . 0 0 "[ . 1 . 2]" 1
81 1 57 ALA H 1 58 VAL H 4.660 . 5.360 4.305 4.218 4.375 . 0 0 "[ . 1 . 2]" 1
82 1 58 VAL H 1 59 ILE H 5.030 . 5.780 4.366 4.318 4.408 . 0 0 "[ . 1 . 2]" 1
83 1 59 ILE H 1 93 LYS H 3.970 . 4.570 3.239 2.977 3.444 . 0 0 "[ . 1 . 2]" 1
84 1 57 ALA H 1 92 MET HB3 4.740 . 5.450 4.171 3.569 4.812 . 0 0 "[ . 1 . 2]" 1
85 1 57 ALA H 1 57 ALA MB 3.170 . 3.650 2.393 2.367 2.513 . 0 0 "[ . 1 . 2]" 1
86 1 96 THR MG 1 100 TYR H 5.500 . 6.330 5.725 5.213 6.118 . 0 0 "[ . 1 . 2]" 1
87 1 99 GLU HB2 1 100 TYR H 4.000 . 4.600 3.047 2.403 3.933 . 0 0 "[ . 1 . 2]" 1
88 1 99 GLU HB3 1 100 TYR H 3.850 . 4.430 3.268 2.358 3.864 . 0 0 "[ . 1 . 2]" 1
89 1 100 TYR H 1 100 TYR HB3 3.540 . 4.070 2.501 2.352 2.645 . 0 0 "[ . 1 . 2]" 1
90 1 100 TYR H 1 100 TYR HB2 3.870 . 4.450 2.591 2.447 2.790 . 0 0 "[ . 1 . 2]" 1
91 1 97 PRO HA 1 100 TYR H 4.130 . 4.750 3.372 3.028 3.891 . 0 0 "[ . 1 . 2]" 1
92 1 98 LEU HA 1 100 TYR H 4.990 . 5.740 4.516 4.283 4.822 . 0 0 "[ . 1 . 2]" 1
93 1 96 THR H 1 100 TYR H 4.530 . 5.210 4.295 3.548 4.818 . 0 0 "[ . 1 . 2]" 1
94 1 42 LEU HG 1 43 GLU H 5.060 . 5.820 4.078 2.940 5.126 . 0 0 "[ . 1 . 2]" 1
95 1 43 GLU H 1 43 GLU HB3 3.600 . 4.140 2.696 2.561 3.071 . 0 0 "[ . 1 . 2]" 1
96 1 43 GLU H 1 58 VAL HB 3.690 . 4.240 2.880 2.419 3.147 . 0 0 "[ . 1 . 2]" 1
97 1 42 LEU HA 1 43 GLU H 3.450 . 3.970 2.155 2.135 2.181 . 0 0 "[ . 1 . 2]" 1
98 1 43 GLU H 1 57 ALA HA 4.750 . 5.460 4.540 3.928 4.820 . 0 0 "[ . 1 . 2]" 1
99 1 41 PHE HD2 1 43 GLU H 4.640 . 5.340 4.271 3.784 4.644 . 0 0 "[ . 1 . 2]" 1
100 1 41 PHE HE2 1 43 GLU H 4.060 . 4.670 4.189 3.770 4.545 . 0 0 "[ . 1 . 2]" 1
101 1 43 GLU H 1 58 VAL H 4.060 . 4.670 3.252 3.022 3.636 . 0 0 "[ . 1 . 2]" 1
102 1 69 LEU H 1 69 LEU MD1 4.690 . 5.390 3.888 3.275 4.286 . 0 0 "[ . 1 . 2]" 1
103 1 69 LEU H 1 70 LEU MD1 4.870 . 5.600 3.073 2.879 3.364 . 0 0 "[ . 1 . 2]" 1
104 1 69 LEU H 1 69 LEU HB3 3.760 . 4.320 2.627 2.307 2.813 . 0 0 "[ . 1 . 2]" 1
105 1 68 LYS HB3 1 69 LEU H 4.480 . 5.150 3.842 3.285 4.050 . 0 0 "[ . 1 . 2]" 1
106 1 68 LYS HB2 1 69 LEU H 4.480 . 5.150 4.421 4.224 4.567 . 0 0 "[ . 1 . 2]" 1
107 1 15 GLU H 1 15 GLU HG2 3.260 . 3.750 2.296 1.810 3.181 . 0 0 "[ . 1 . 2]" 1
108 1 15 GLU H 1 15 GLU HG3 3.260 . 3.750 3.319 2.572 3.699 . 0 0 "[ . 1 . 2]" 1
109 1 15 GLU H 1 16 ASN HA 4.600 . 5.290 4.673 4.197 4.927 . 0 0 "[ . 1 . 2]" 1
110 1 15 GLU H 1 16 ASN H 3.050 . 3.510 2.581 1.990 3.206 . 0 0 "[ . 1 . 2]" 1
111 1 60 VAL MG2 1 61 SER H 4.520 . 5.200 4.215 4.157 4.296 . 0 0 "[ . 1 . 2]" 1
112 1 60 VAL MG1 1 61 SER H 3.860 . 4.440 3.176 3.003 3.350 . 0 0 "[ . 1 . 2]" 1
113 1 70 LEU H 1 70 LEU MD1 3.290 . 3.780 1.820 1.794 2.018 0.006 5 0 "[ . 1 . 2]" 1
114 1 60 VAL HB 1 61 SER H 4.480 . 5.150 4.400 4.293 4.475 . 0 0 "[ . 1 . 2]" 1
115 1 70 LEU H 1 70 LEU HB3 2.800 . 3.220 2.571 2.494 2.623 . 0 0 "[ . 1 . 2]" 1
116 1 70 LEU H 1 70 LEU HB2 3.590 . 4.130 3.635 3.601 3.656 . 0 0 "[ . 1 . 2]" 1
117 1 61 SER H 1 63 ASN H 5.160 . 5.930 4.777 4.637 4.985 . 0 0 "[ . 1 . 2]" 1
118 1 61 SER H 1 96 THR H 5.500 . 6.330 5.047 4.801 5.198 . 0 0 "[ . 1 . 2]" 1
119 1 61 SER H 1 95 HIS H 4.810 . 5.530 4.023 3.797 4.386 . 0 0 "[ . 1 . 2]" 1
120 1 61 SER H 1 62 ASN H 5.170 . 5.950 4.355 4.238 4.391 . 0 0 "[ . 1 . 2]" 1
121 1 61 SER H 1 62 ASN HA 4.930 . 5.670 4.936 4.740 5.052 . 0 0 "[ . 1 . 2]" 1
122 1 76 VAL MG2 1 77 ASN H 3.910 . 4.500 3.957 3.875 4.034 . 0 0 "[ . 1 . 2]" 1
123 1 76 VAL MG1 1 77 ASN H 3.910 . 4.500 3.153 2.237 3.367 . 0 0 "[ . 1 . 2]" 1
124 1 76 VAL HB 1 77 ASN H 3.930 . 4.520 2.713 2.573 3.894 . 0 0 "[ . 1 . 2]" 1
125 1 75 LEU HB2 1 77 ASN H 5.390 . 6.200 5.096 4.837 5.872 . 0 0 "[ . 1 . 2]" 1
126 1 77 ASN H 1 77 ASN HB2 3.480 . 4.000 2.339 2.229 2.501 . 0 0 "[ . 1 . 2]" 1
127 1 77 ASN H 1 77 ASN HB3 3.550 . 4.080 3.571 3.525 3.623 . 0 0 "[ . 1 . 2]" 1
128 1 77 ASN H 1 78 THR HA 5.440 . 6.260 5.259 5.166 5.337 . 0 0 "[ . 1 . 2]" 1
129 1 77 ASN H 1 78 THR HB 5.000 . 5.750 4.975 4.769 5.100 . 0 0 "[ . 1 . 2]" 1
130 1 77 ASN H 1 77 ASN HD22 4.250 . 4.890 3.881 3.639 4.060 . 0 0 "[ . 1 . 2]" 1
131 1 73 HIS HD2 1 77 ASN H 5.500 . 6.330 5.435 4.716 6.007 . 0 0 "[ . 1 . 2]" 1
132 1 77 ASN H 1 77 ASN HD21 4.250 . 4.890 2.594 2.069 3.302 . 0 0 "[ . 1 . 2]" 1
133 1 77 ASN H 1 78 THR H 3.600 . 4.140 2.678 2.566 2.784 . 0 0 "[ . 1 . 2]" 1
134 1 73 HIS HA 1 77 ASN H 3.920 . 4.510 4.088 3.775 4.377 . 0 0 "[ . 1 . 2]" 1
135 1 92 MET H 1 92 MET HB2 4.090 . 4.700 3.888 3.742 3.960 . 0 0 "[ . 1 . 2]" 1
136 1 92 MET H 1 92 MET HB3 3.850 . 4.430 3.151 2.871 3.284 . 0 0 "[ . 1 . 2]" 1
137 1 92 MET H 1 92 MET ME 3.240 . 3.730 3.075 2.701 3.333 . 0 0 "[ . 1 . 2]" 1
138 1 92 MET H 1 92 MET HG2 3.790 . 4.360 3.296 3.092 3.440 . 0 0 "[ . 1 . 2]" 1
139 1 91 SER HB2 1 92 MET H 4.150 . 4.770 3.671 2.383 4.018 . 0 0 "[ . 1 . 2]" 1
140 1 91 SER HA 1 92 MET H 2.920 . 3.360 2.347 2.159 2.496 . 0 0 "[ . 1 . 2]" 1
141 1 90 PHE HE2 1 92 MET H 4.720 . 5.430 5.087 4.354 5.430 . 0 0 "[ . 1 . 2]" 1
142 1 90 PHE HD2 1 92 MET H 5.420 . 6.230 5.082 4.583 5.478 . 0 0 "[ . 1 . 2]" 1
143 1 92 MET H 1 93 LYS H 4.580 . 5.270 4.347 4.255 4.459 . 0 0 "[ . 1 . 2]" 1
144 1 57 ALA H 1 92 MET H 4.780 . 5.500 4.509 4.268 4.846 . 0 0 "[ . 1 . 2]" 1
145 1 56 ASP HA 1 92 MET H 5.190 . 5.970 4.839 4.478 5.389 . 0 0 "[ . 1 . 2]" 1
146 1 33 LEU MD1 1 34 SER H 3.250 . 3.740 2.352 2.086 2.595 . 0 0 "[ . 1 . 2]" 1
147 1 33 LEU HB2 1 34 SER H 4.040 . 4.650 3.923 3.852 3.987 . 0 0 "[ . 1 . 2]" 1
148 1 34 SER H 1 36 ALA MB 4.780 . 5.500 4.828 4.634 5.041 . 0 0 "[ . 1 . 2]" 1
149 1 33 LEU HG 1 34 SER H 3.590 . 4.130 2.758 2.587 2.960 . 0 0 "[ . 1 . 2]" 1
150 1 30 GLU HA 1 34 SER H 4.710 . 5.420 4.187 3.870 4.462 . 0 0 "[ . 1 . 2]" 1
151 1 68 LYS HA 1 70 LEU H 4.220 . 4.850 3.857 3.522 4.295 . 0 0 "[ . 1 . 2]" 1
152 1 34 SER H 1 36 ALA H 4.440 . 5.110 3.931 3.838 4.118 . 0 0 "[ . 1 . 2]" 1
153 1 32 LYS H 1 34 SER H 4.600 . 5.290 3.840 3.585 3.994 . 0 0 "[ . 1 . 2]" 1
154 1 81 LYS HB3 1 82 GLU H 2.650 . 3.050 2.188 2.033 2.419 . 0 0 "[ . 1 . 2]" 1
155 1 81 LYS HB2 1 82 GLU H 3.890 . 4.470 3.657 3.538 3.802 . 0 0 "[ . 1 . 2]" 1
156 1 82 GLU H 1 85 GLN H 5.360 . 6.160 5.264 4.914 5.518 . 0 0 "[ . 1 . 2]" 1
157 1 80 LEU H 1 82 GLU H 5.360 . 6.160 4.968 4.621 5.207 . 0 0 "[ . 1 . 2]" 1
158 1 12 SER H 1 12 SER HB2 4.150 . 4.770 2.891 2.410 3.752 . 0 0 "[ . 1 . 2]" 1
159 1 12 SER H 1 12 SER HB3 4.150 . 4.770 3.430 2.558 4.032 . 0 0 "[ . 1 . 2]" 1
160 1 11 SER HA 1 12 SER H 3.370 . 3.880 2.686 2.121 3.575 . 0 0 "[ . 1 . 2]" 1
161 1 33 LEU H 1 80 LEU HG 5.500 . 6.330 5.968 5.320 6.340 0.010 16 0 "[ . 1 . 2]" 1
162 1 29 ILE MG 1 33 LEU H 3.960 . 4.550 4.000 3.662 4.239 . 0 0 "[ . 1 . 2]" 1
163 1 33 LEU H 1 33 LEU MD2 3.270 . 3.760 3.279 3.144 3.388 . 0 0 "[ . 1 . 2]" 1
164 1 33 LEU H 1 33 LEU HB2 3.980 . 4.580 3.623 3.595 3.648 . 0 0 "[ . 1 . 2]" 1
165 1 33 LEU H 1 36 ALA MB 4.500 . 5.180 4.861 4.506 5.192 0.012 17 0 "[ . 1 . 2]" 1
166 1 33 LEU H 1 33 LEU HG 3.560 . 4.090 1.981 1.838 2.123 . 0 0 "[ . 1 . 2]" 1
167 1 30 GLU HA 1 33 LEU H 4.640 . 5.340 4.109 3.914 4.419 . 0 0 "[ . 1 . 2]" 1
168 1 31 ASP HA 1 33 LEU H 4.850 . 5.580 4.803 4.574 5.105 . 0 0 "[ . 1 . 2]" 1
169 1 33 LEU H 1 36 ALA H 5.030 . 5.780 4.895 4.655 5.168 . 0 0 "[ . 1 . 2]" 1
170 1 32 LYS H 1 33 LEU H 4.070 . 4.680 2.798 2.671 2.884 . 0 0 "[ . 1 . 2]" 1
171 1 33 LEU H 1 34 SER H 3.770 . 4.340 2.547 2.477 2.633 . 0 0 "[ . 1 . 2]" 1
172 1 82 GLU H 1 83 GLU H 3.350 . 3.850 2.483 2.401 2.703 . 0 0 "[ . 1 . 2]" 1
173 1 25 ILE H 1 25 ILE HG12 5.040 . 5.800 4.651 4.412 4.693 . 0 0 "[ . 1 . 2]" 1
174 1 25 ILE H 1 25 ILE HB 3.710 . 4.270 2.524 2.452 2.656 . 0 0 "[ . 1 . 2]" 1
175 1 24 CYS H 1 25 ILE H 4.900 . 5.640 4.442 4.050 4.643 . 0 0 "[ . 1 . 2]" 1
176 1 25 ILE H 1 26 GLN H 4.700 . 5.400 2.760 2.648 2.963 . 0 0 "[ . 1 . 2]" 1
177 1 60 VAL H 1 60 VAL MG1 4.010 . 4.610 3.830 3.792 3.905 . 0 0 "[ . 1 . 2]" 1
178 1 59 ILE MD 1 60 VAL H 3.560 . 4.090 3.527 3.219 4.102 0.012 10 0 "[ . 1 . 2]" 1
179 1 39 PRO HG2 1 60 VAL H 4.940 . 5.680 4.956 4.561 5.456 . 0 0 "[ . 1 . 2]" 1
180 1 39 PRO HG3 1 60 VAL H 5.260 . 6.050 4.893 4.323 5.323 . 0 0 "[ . 1 . 2]" 1
181 1 60 VAL H 1 60 VAL HB 3.970 . 4.570 2.602 2.518 2.798 . 0 0 "[ . 1 . 2]" 1
182 1 42 LEU HA 1 60 VAL H 4.340 . 4.990 3.422 3.164 3.706 . 0 0 "[ . 1 . 2]" 1
183 1 41 PHE HD2 1 60 VAL H 4.500 . 5.180 4.021 3.684 4.627 . 0 0 "[ . 1 . 2]" 1
184 1 41 PHE H 1 60 VAL H 4.330 . 4.980 3.412 3.186 3.674 . 0 0 "[ . 1 . 2]" 1
185 1 59 ILE H 1 60 VAL H 5.080 . 5.840 4.283 4.106 4.508 . 0 0 "[ . 1 . 2]" 1
186 1 60 VAL H 1 61 SER H 5.280 . 6.070 4.133 3.852 4.306 . 0 0 "[ . 1 . 2]" 1
187 1 60 VAL H 1 95 HIS H 5.050 . 5.810 4.878 4.756 5.036 . 0 0 "[ . 1 . 2]" 1
188 1 41 PHE HB3 1 60 VAL H 4.330 . 4.980 3.743 3.513 4.250 . 0 0 "[ . 1 . 2]" 1
189 1 13 GLY H 1 14 ARG HD2 5.500 . 6.330 5.301 2.912 6.340 0.010 6 0 "[ . 1 . 2]" 1
190 1 13 GLY H 1 14 ARG HD3 5.500 . 6.330 5.039 2.366 6.333 0.003 14 0 "[ . 1 . 2]" 1
191 1 13 GLY H 1 14 ARG HA 4.670 . 5.370 4.632 4.182 5.173 . 0 0 "[ . 1 . 2]" 1
192 1 12 SER HA 1 13 GLY H 2.710 . 3.120 2.400 2.154 3.133 0.013 4 0 "[ . 1 . 2]" 1
193 1 13 GLY H 1 14 ARG H 3.230 . 3.710 2.404 1.796 3.187 0.004 19 0 "[ . 1 . 2]" 1
194 1 13 GLY H 1 15 GLU H 4.250 . 4.890 3.950 2.542 4.908 0.018 14 0 "[ . 1 . 2]" 1
195 1 47 LYS H 1 55 PHE HD1 4.930 . 5.670 4.370 3.320 5.242 . 0 0 "[ . 1 . 2]" 1
196 1 40 THR H 1 60 VAL MG2 5.500 . 6.330 5.434 5.064 5.751 . 0 0 "[ . 1 . 2]" 1
197 1 40 THR H 1 60 VAL MG1 4.930 . 5.670 3.790 3.493 4.195 . 0 0 "[ . 1 . 2]" 1
198 1 40 THR H 1 40 THR MG 3.410 . 3.920 2.593 2.384 3.206 . 0 0 "[ . 1 . 2]" 1
199 1 39 PRO HG2 1 40 THR H 4.640 . 5.340 4.906 4.331 5.345 0.005 17 0 "[ . 1 . 2]" 1
200 1 40 THR H 1 60 VAL HB 4.530 . 5.210 4.145 3.659 4.613 . 0 0 "[ . 1 . 2]" 1
201 1 40 THR H 1 41 PHE HA 5.300 . 6.100 5.000 4.712 5.216 . 0 0 "[ . 1 . 2]" 1
202 1 39 PRO HA 1 40 THR H 3.460 . 3.980 2.233 2.153 2.426 . 0 0 "[ . 1 . 2]" 1
203 1 40 THR H 1 61 SER HA 4.090 . 4.700 2.440 1.991 2.985 . 0 0 "[ . 1 . 2]" 1
204 1 40 THR H 1 61 SER H 4.760 . 5.470 4.639 4.446 5.124 . 0 0 "[ . 1 . 2]" 1
205 1 39 PRO HB3 1 40 THR H 4.580 . 5.270 3.782 3.409 4.098 . 0 0 "[ . 1 . 2]" 1
206 1 84 LEU H 1 84 LEU HG 3.330 . 3.830 2.292 2.117 2.500 . 0 0 "[ . 1 . 2]" 1
207 1 84 LEU H 1 84 LEU HB2 3.410 . 3.920 2.559 2.422 2.788 . 0 0 "[ . 1 . 2]" 1
208 1 80 LEU HB3 1 84 LEU H 3.910 . 4.500 3.491 3.132 4.152 . 0 0 "[ . 1 . 2]" 1
209 1 83 GLU HB3 1 84 LEU H 3.740 . 4.300 2.281 1.959 2.810 . 0 0 "[ . 1 . 2]" 1
210 1 83 GLU HG2 1 84 LEU H 3.590 . 4.130 4.091 3.705 4.199 0.069 8 0 "[ . 1 . 2]" 1
211 1 81 LYS HA 1 84 LEU H 4.430 . 5.090 4.190 3.478 4.505 . 0 0 "[ . 1 . 2]" 1
212 1 84 LEU H 1 85 GLN HA 5.430 . 6.240 5.407 5.285 5.513 . 0 0 "[ . 1 . 2]" 1
213 1 82 GLU H 1 84 LEU H 4.040 . 4.650 4.470 4.255 4.636 . 0 0 "[ . 1 . 2]" 1
214 1 32 LYS H 1 33 LEU MD2 4.760 . 5.470 5.047 4.886 5.159 . 0 0 "[ . 1 . 2]" 1
215 1 29 ILE MG 1 32 LYS H 4.540 . 5.220 4.705 4.352 4.930 . 0 0 "[ . 1 . 2]" 1
216 1 31 ASP HB3 1 32 LYS H 3.950 . 4.540 2.946 2.506 3.788 . 0 0 "[ . 1 . 2]" 1
217 1 31 ASP HB2 1 32 LYS H 3.950 . 4.540 3.773 2.955 4.044 . 0 0 "[ . 1 . 2]" 1
218 1 31 ASP H 1 32 LYS H 3.610 . 4.150 2.596 2.459 2.859 . 0 0 "[ . 1 . 2]" 1
219 1 28 VAL HA 1 32 LYS H 4.480 . 5.150 4.246 4.009 4.519 . 0 0 "[ . 1 . 2]" 1
220 1 60 VAL MG1 1 98 LEU H 4.610 . 5.300 4.430 4.247 4.645 . 0 0 "[ . 1 . 2]" 1
221 1 96 THR MG 1 98 LEU H 4.360 . 5.010 4.146 3.937 4.796 . 0 0 "[ . 1 . 2]" 1
222 1 98 LEU H 1 98 LEU HB2 3.550 . 4.080 2.301 2.081 2.463 . 0 0 "[ . 1 . 2]" 1
223 1 97 PRO HB2 1 98 LEU H 3.700 . 4.260 3.072 2.436 3.493 . 0 0 "[ . 1 . 2]" 1
224 1 98 LEU H 1 99 GLU HA 5.250 . 6.040 5.297 5.166 5.403 . 0 0 "[ . 1 . 2]" 1
225 1 96 THR HA 1 98 LEU H 4.430 . 5.090 4.171 3.891 4.830 . 0 0 "[ . 1 . 2]" 1
226 1 98 LEU H 1 99 GLU H 3.890 . 4.470 2.702 2.521 2.824 . 0 0 "[ . 1 . 2]" 1
227 1 96 THR H 1 98 LEU H 5.500 . 6.330 4.973 4.461 5.611 . 0 0 "[ . 1 . 2]" 1
228 1 98 LEU H 1 100 TYR H 4.540 . 5.220 3.962 3.700 4.284 . 0 0 "[ . 1 . 2]" 1
229 1 16 ASN H 1 16 ASN HA 2.860 . 3.290 2.854 2.769 2.931 . 0 0 "[ . 1 . 2]" 1
230 1 15 GLU HA 1 16 ASN H 3.280 . 3.770 3.065 2.476 3.408 . 0 0 "[ . 1 . 2]" 1
231 1 16 ASN H 1 16 ASN HD22 3.970 . 4.570 3.419 3.003 3.821 . 0 0 "[ . 1 . 2]" 1
232 1 16 ASN H 1 17 LEU H 3.160 . 3.630 2.588 2.192 2.867 . 0 0 "[ . 1 . 2]" 1
233 1 29 ILE MD 1 30 GLU H 4.480 . 5.150 4.136 3.928 4.577 . 0 0 "[ . 1 . 2]" 1
234 1 29 ILE MG 1 30 GLU H 3.600 . 4.140 2.906 2.603 3.435 . 0 0 "[ . 1 . 2]" 1
235 1 30 GLU H 1 33 LEU MD2 4.390 . 5.050 4.503 4.175 4.923 . 0 0 "[ . 1 . 2]" 1
236 1 29 ILE HB 1 30 GLU H 3.990 . 4.590 2.688 2.473 2.863 . 0 0 "[ . 1 . 2]" 1
237 1 30 GLU H 1 30 GLU HB3 3.910 . 4.500 2.940 2.440 3.607 . 0 0 "[ . 1 . 2]" 1
238 1 30 GLU H 1 30 GLU HG3 4.520 . 5.200 3.767 1.986 4.582 . 0 0 "[ . 1 . 2]" 1
239 1 30 GLU H 1 30 GLU HB2 3.910 . 4.500 2.437 2.166 2.616 . 0 0 "[ . 1 . 2]" 1
240 1 26 GLN HA 1 30 GLU H 4.760 . 5.470 4.138 3.751 4.620 . 0 0 "[ . 1 . 2]" 1
241 1 29 ILE H 1 30 GLU H 4.400 . 5.060 2.711 2.591 2.843 . 0 0 "[ . 1 . 2]" 1
242 1 30 GLU H 1 31 ASP H 4.060 . 4.670 2.842 2.684 2.928 . 0 0 "[ . 1 . 2]" 1
243 1 14 ARG H 1 15 GLU HG2 5.500 . 6.330 3.805 2.959 4.591 . 0 0 "[ . 1 . 2]" 1
244 1 14 ARG H 1 15 GLU HG3 5.500 . 6.330 4.934 3.931 5.486 . 0 0 "[ . 1 . 2]" 1
245 1 12 SER HA 1 14 ARG H 4.350 . 5.000 3.877 2.993 5.004 0.004 7 0 "[ . 1 . 2]" 1
246 1 14 ARG H 1 15 GLU H 3.040 . 3.500 2.126 1.788 2.725 0.012 12 0 "[ . 1 . 2]" 1
247 1 14 ARG H 1 16 ASN HD22 5.020 . 5.770 5.307 4.342 5.784 0.014 8 0 "[ . 1 . 2]" 1
248 1 14 ARG H 1 16 ASN HD21 4.920 . 5.660 4.345 3.536 5.662 0.002 20 0 "[ . 1 . 2]" 1
249 1 93 LYS HD3 1 94 CYS H 4.820 . 5.540 4.377 3.263 5.555 0.015 5 0 "[ . 1 . 2]" 1
250 1 93 LYS HD2 1 94 CYS H 4.820 . 5.540 4.608 2.195 5.138 . 0 0 "[ . 1 . 2]" 1
251 1 93 LYS HA 1 94 CYS H 2.950 . 3.390 2.160 2.111 2.230 . 0 0 "[ . 1 . 2]" 1
252 1 59 ILE H 1 94 CYS H 5.150 . 5.920 4.854 4.670 5.030 . 0 0 "[ . 1 . 2]" 1
253 1 94 CYS H 1 95 HIS H 4.470 . 5.140 4.440 4.234 4.550 . 0 0 "[ . 1 . 2]" 1
254 1 20 GLN H 1 20 GLN HB3 4.180 . 4.810 3.572 2.426 4.155 . 0 0 "[ . 1 . 2]" 1
255 1 20 GLN H 1 20 GLN HB2 4.180 . 4.810 3.177 2.298 3.911 . 0 0 "[ . 1 . 2]" 1
256 1 19 PHE HB2 1 20 GLN H 4.700 . 5.400 4.214 2.797 4.610 . 0 0 "[ . 1 . 2]" 1
257 1 19 PHE HA 1 20 GLN H 3.510 . 4.040 3.177 2.322 3.526 . 0 0 "[ . 1 . 2]" 1
258 1 18 TYR QD 1 20 GLN H 4.730 . 5.440 4.632 4.072 5.312 . 0 0 "[ . 1 . 2]" 1
259 1 19 PHE QD 1 20 GLN H 3.800 . 4.370 3.775 3.075 4.076 . 0 0 "[ . 1 . 2]" 1
260 1 19 PHE QE 1 20 GLN H 4.950 . 5.690 4.982 3.981 5.505 . 0 0 "[ . 1 . 2]" 1
261 1 20 GLN H 1 21 GLY H 3.860 . 4.440 3.028 2.074 4.367 . 0 0 "[ . 1 . 2]" 1
262 1 87 ILE MD 1 91 SER H 4.880 . 5.610 5.107 4.846 5.482 . 0 0 "[ . 1 . 2]" 1
263 1 87 ILE MG 1 91 SER H 5.140 . 5.910 4.801 4.524 5.893 . 0 0 "[ . 1 . 2]" 1
264 1 91 SER H 1 92 MET HB3 5.350 . 6.150 5.179 4.932 5.531 . 0 0 "[ . 1 . 2]" 1
265 1 91 SER H 1 92 MET ME 4.650 . 5.350 4.473 4.198 4.815 . 0 0 "[ . 1 . 2]" 1
266 1 90 PHE HB3 1 91 SER H 4.300 . 4.950 4.109 3.891 4.354 . 0 0 "[ . 1 . 2]" 1
267 1 90 PHE HB2 1 91 SER H 4.300 . 4.950 4.181 4.058 4.327 . 0 0 "[ . 1 . 2]" 1
268 1 90 PHE HA 1 91 SER H 3.090 . 3.550 2.165 2.107 2.224 . 0 0 "[ . 1 . 2]" 1
269 1 56 ASP HA 1 91 SER H 3.480 . 4.000 2.795 2.509 3.253 . 0 0 "[ . 1 . 2]" 1
270 1 54 SER HA 1 91 SER H 5.500 . 6.330 5.623 5.092 6.164 . 0 0 "[ . 1 . 2]" 1
271 1 90 PHE HE1 1 91 SER H 5.140 . 5.910 4.774 4.427 5.205 . 0 0 "[ . 1 . 2]" 1
272 1 90 PHE HE2 1 91 SER H 5.500 . 6.330 5.189 4.669 5.806 . 0 0 "[ . 1 . 2]" 1
273 1 90 PHE HD1 1 91 SER H 4.140 . 4.760 3.688 3.418 4.025 . 0 0 "[ . 1 . 2]" 1
274 1 90 PHE HD2 1 91 SER H 4.730 . 5.440 4.211 3.690 4.743 . 0 0 "[ . 1 . 2]" 1
275 1 56 ASP H 1 91 SER H 5.320 . 6.120 4.784 4.666 4.976 . 0 0 "[ . 1 . 2]" 1
276 1 90 PHE H 1 91 SER H 5.500 . 6.330 4.453 4.211 4.596 . 0 0 "[ . 1 . 2]" 1
277 1 91 SER H 1 92 MET H 4.470 . 5.140 4.438 4.362 4.508 . 0 0 "[ . 1 . 2]" 1
278 1 56 ASP HB2 1 91 SER H 5.500 . 6.330 4.614 4.065 5.400 . 0 0 "[ . 1 . 2]" 1
279 1 55 PHE H 1 87 ILE MG 4.210 . 4.840 3.090 2.542 3.851 . 0 0 "[ . 1 . 2]" 1
280 1 55 PHE H 1 55 PHE HD2 4.390 . 5.050 3.186 2.824 3.689 . 0 0 "[ . 1 . 2]" 1
281 1 55 PHE H 1 90 PHE HD1 4.600 . 5.290 3.647 2.535 4.394 . 0 0 "[ . 1 . 2]" 1
282 1 55 PHE H 1 89 ALA H 5.190 . 5.970 4.276 3.926 5.113 . 0 0 "[ . 1 . 2]" 1
283 1 106 LYS HG2 1 107 GLY H 3.790 . 4.360 2.575 1.804 4.356 . 0 0 "[ . 1 . 2]" 1
284 1 106 LYS HG3 1 107 GLY H 3.790 . 4.360 3.071 1.806 4.374 0.014 6 0 "[ . 1 . 2]" 1
285 1 107 GLY H 1 108 SER H 2.830 . 3.250 2.313 1.907 3.253 0.003 13 0 "[ . 1 . 2]" 1
286 1 70 LEU HB2 1 74 ARG H 5.500 . 6.330 4.853 4.674 5.039 . 0 0 "[ . 1 . 2]" 1
287 1 74 ARG H 1 74 ARG HG2 3.480 . 4.000 2.187 1.944 2.566 . 0 0 "[ . 1 . 2]" 1
288 1 74 ARG H 1 74 ARG HG3 3.770 . 4.340 3.541 3.175 3.940 . 0 0 "[ . 1 . 2]" 1
289 1 74 ARG H 1 74 ARG HB3 2.910 . 3.350 2.536 2.373 2.670 . 0 0 "[ . 1 . 2]" 1
290 1 74 ARG H 1 77 ASN HB2 4.910 . 5.650 5.058 4.679 5.328 . 0 0 "[ . 1 . 2]" 1
291 1 73 HIS HB3 1 74 ARG H 4.240 . 4.880 2.422 2.260 2.560 . 0 0 "[ . 1 . 2]" 1
292 1 73 HIS HB2 1 74 ARG H 4.240 . 4.880 3.781 3.670 3.908 . 0 0 "[ . 1 . 2]" 1
293 1 70 LEU HA 1 74 ARG H 4.250 . 4.890 3.967 3.736 4.335 . 0 0 "[ . 1 . 2]" 1
294 1 71 ASP HA 1 74 ARG H 4.050 . 4.660 3.374 3.174 3.670 . 0 0 "[ . 1 . 2]" 1
295 1 74 ARG H 1 76 VAL H 4.910 . 5.650 4.376 4.264 4.508 . 0 0 "[ . 1 . 2]" 1
296 1 73 HIS H 1 74 ARG H 3.680 . 4.230 2.743 2.616 2.887 . 0 0 "[ . 1 . 2]" 1
297 1 74 ARG H 1 77 ASN H 4.880 . 5.610 4.788 4.657 4.933 . 0 0 "[ . 1 . 2]" 1
298 1 20 GLN HA 1 22 HIS H 5.500 . 6.330 4.341 2.969 6.285 . 0 0 "[ . 1 . 2]" 1
299 1 29 ILE H 1 29 ILE MD 4.140 . 4.760 2.187 1.960 3.065 . 0 0 "[ . 1 . 2]" 1
300 1 29 ILE H 1 29 ILE MG 3.780 . 4.350 3.689 3.608 3.771 . 0 0 "[ . 1 . 2]" 1
301 1 28 VAL MG2 1 29 ILE H 4.150 . 4.770 3.713 3.377 3.851 . 0 0 "[ . 1 . 2]" 1
302 1 28 VAL MG1 1 29 ILE H 4.150 . 4.770 3.195 1.977 3.405 . 0 0 "[ . 1 . 2]" 1
303 1 29 ILE H 1 29 ILE HB 3.980 . 4.580 2.308 2.200 2.569 . 0 0 "[ . 1 . 2]" 1
304 1 28 VAL HB 1 29 ILE H 4.130 . 4.750 2.462 2.279 3.989 . 0 0 "[ . 1 . 2]" 1
305 1 25 ILE HA 1 29 ILE H 4.830 . 5.550 4.257 4.073 4.519 . 0 0 "[ . 1 . 2]" 1
306 1 28 VAL H 1 29 ILE H 4.390 . 5.050 2.773 2.656 2.919 . 0 0 "[ . 1 . 2]" 1
307 1 29 ILE H 1 31 ASP H 5.130 . 5.900 4.353 4.170 4.494 . 0 0 "[ . 1 . 2]" 1
308 1 57 ALA MB 1 93 LYS H 4.170 . 4.800 3.900 3.737 4.081 . 0 0 "[ . 1 . 2]" 1
309 1 58 VAL MG2 1 93 LYS H 4.810 . 5.530 4.046 3.693 4.370 . 0 0 "[ . 1 . 2]" 1
310 1 92 MET HB2 1 93 LYS H 3.530 . 4.060 2.986 2.736 3.250 . 0 0 "[ . 1 . 2]" 1
311 1 92 MET HG2 1 93 LYS H 4.130 . 4.750 3.977 3.735 4.232 . 0 0 "[ . 1 . 2]" 1
312 1 58 VAL HA 1 93 LYS H 4.120 . 4.740 2.744 2.463 3.034 . 0 0 "[ . 1 . 2]" 1
313 1 56 ASP HA 1 93 LYS H 5.500 . 6.330 5.386 4.920 5.938 . 0 0 "[ . 1 . 2]" 1
314 1 93 LYS H 1 94 CYS H 4.430 . 5.090 4.228 4.120 4.323 . 0 0 "[ . 1 . 2]" 1
315 1 57 ALA H 1 93 LYS H 4.450 . 5.120 3.816 3.545 4.090 . 0 0 "[ . 1 . 2]" 1
316 1 70 LEU MD1 1 72 ARG H 4.120 . 4.740 4.079 3.949 4.220 . 0 0 "[ . 1 . 2]" 1
317 1 72 ARG H 1 75 LEU HB2 4.810 . 5.530 5.106 4.810 5.390 . 0 0 "[ . 1 . 2]" 1
318 1 72 ARG H 1 73 HIS HB3 5.500 . 6.330 4.822 4.682 5.079 . 0 0 "[ . 1 . 2]" 1
319 1 72 ARG H 1 73 HIS HB2 5.500 . 6.330 4.940 4.636 5.170 . 0 0 "[ . 1 . 2]" 1
320 1 72 ARG H 1 74 ARG HD3 5.500 . 6.330 5.694 5.409 6.229 . 0 0 "[ . 1 . 2]" 1
321 1 69 LEU HA 1 72 ARG H 4.430 . 5.090 3.676 3.172 4.203 . 0 0 "[ . 1 . 2]" 1
322 1 101 ASP H 1 103 LEU HG 4.800 . 5.520 5.024 4.846 5.273 . 0 0 "[ . 1 . 2]" 1
323 1 60 VAL MG1 1 101 ASP H 4.890 . 5.620 4.785 4.345 5.248 . 0 0 "[ . 1 . 2]" 1
324 1 101 ASP H 1 102 LYS HB2 4.800 . 5.520 4.684 4.461 5.106 . 0 0 "[ . 1 . 2]" 1
325 1 101 ASP H 1 101 ASP HB3 2.900 . 3.340 2.544 2.419 2.657 . 0 0 "[ . 1 . 2]" 1
326 1 101 ASP H 1 101 ASP HB2 2.840 . 3.270 2.534 2.388 2.649 . 0 0 "[ . 1 . 2]" 1
327 1 100 TYR HB2 1 101 ASP H 4.090 . 4.700 3.983 3.920 4.134 . 0 0 "[ . 1 . 2]" 1
328 1 97 PRO HA 1 101 ASP H 4.370 . 5.030 3.898 3.488 4.464 . 0 0 "[ . 1 . 2]" 1
329 1 100 TYR HD2 1 101 ASP H 4.010 . 4.610 3.852 3.569 4.199 . 0 0 "[ . 1 . 2]" 1
330 1 99 GLU H 1 101 ASP H 4.340 . 4.990 4.126 3.816 4.348 . 0 0 "[ . 1 . 2]" 1
331 1 100 TYR H 1 101 ASP H 3.540 . 4.070 2.674 2.445 2.793 . 0 0 "[ . 1 . 2]" 1
332 1 98 LEU H 1 101 ASP H 4.760 . 5.470 4.672 4.479 5.051 . 0 0 "[ . 1 . 2]" 1
333 1 101 ASP H 1 101 ASP HA 2.940 . 3.380 2.796 2.758 2.827 . 0 0 "[ . 1 . 2]" 1
334 1 17 LEU H 1 17 LEU HB3 3.670 . 4.220 3.603 3.545 3.737 . 0 0 "[ . 1 . 2]" 1
335 1 17 LEU H 1 17 LEU HB2 2.560 . 2.940 2.423 2.276 2.618 . 0 0 "[ . 1 . 2]" 1
336 1 15 GLU HA 1 17 LEU H 3.390 . 3.900 3.139 2.849 3.468 . 0 0 "[ . 1 . 2]" 1
337 1 17 LEU H 1 18 TYR QD 4.610 . 5.300 3.565 2.830 4.512 . 0 0 "[ . 1 . 2]" 1
338 1 15 GLU H 1 17 LEU H 4.750 . 5.460 4.589 4.112 4.989 . 0 0 "[ . 1 . 2]" 1
339 1 19 PHE H 1 19 PHE HB2 3.940 . 4.530 3.560 2.755 3.773 . 0 0 "[ . 1 . 2]" 1
340 1 18 TYR HA 1 19 PHE H 2.720 . 3.130 2.275 2.101 2.612 . 0 0 "[ . 1 . 2]" 1
341 1 18 TYR QD 1 19 PHE H 4.240 . 4.880 4.128 3.166 4.717 . 0 0 "[ . 1 . 2]" 1
342 1 19 PHE H 1 19 PHE QD 4.080 . 4.690 2.201 1.794 4.253 0.006 13 0 "[ . 1 . 2]" 1
343 1 19 PHE H 1 20 GLN H 3.790 . 4.360 2.582 1.865 3.715 . 0 0 "[ . 1 . 2]" 1
344 1 83 GLU H 1 84 LEU HB2 4.580 . 5.270 4.933 4.774 5.010 . 0 0 "[ . 1 . 2]" 1
345 1 83 GLU H 1 83 GLU HB3 3.110 . 3.580 2.746 2.480 3.587 0.007 10 0 "[ . 1 . 2]" 1
346 1 83 GLU H 1 83 GLU HG2 3.950 . 4.540 4.416 3.462 4.550 0.010 19 0 "[ . 1 . 2]" 1
347 1 81 LYS HA 1 83 GLU H 4.760 . 5.470 4.522 4.153 4.657 . 0 0 "[ . 1 . 2]" 1
348 1 82 GLU HA 1 83 GLU H 3.550 . 4.080 3.504 3.465 3.550 . 0 0 "[ . 1 . 2]" 1
349 1 83 GLU H 1 85 GLN H 4.250 . 4.890 4.198 4.028 4.366 . 0 0 "[ . 1 . 2]" 1
350 1 83 GLU H 1 84 LEU H 3.540 . 4.070 2.863 2.776 2.950 . 0 0 "[ . 1 . 2]" 1
351 1 17 LEU HB3 1 18 TYR H 4.120 . 4.740 4.020 3.604 4.307 . 0 0 "[ . 1 . 2]" 1
352 1 17 LEU HB2 1 18 TYR H 3.210 . 3.690 3.242 2.875 3.693 0.003 7 0 "[ . 1 . 2]" 1
353 1 16 ASN HA 1 18 TYR H 3.870 . 4.450 3.524 3.208 3.889 . 0 0 "[ . 1 . 2]" 1
354 1 18 TYR H 1 18 TYR QE 4.600 . 5.290 4.656 4.213 5.074 . 0 0 "[ . 1 . 2]" 1
355 1 18 TYR H 1 18 TYR QD 3.150 . 3.620 2.715 1.874 3.336 . 0 0 "[ . 1 . 2]" 1
356 1 16 ASN H 1 18 TYR H 4.660 . 5.360 4.323 3.942 4.676 . 0 0 "[ . 1 . 2]" 1
357 1 18 TYR H 1 20 GLN HE21 5.500 . 6.330 5.566 4.090 6.336 0.006 4 0 "[ . 1 . 2]" 1
358 1 33 LEU MD1 1 35 SER H 4.630 . 5.320 4.473 4.337 4.588 . 0 0 "[ . 1 . 2]" 1
359 1 33 LEU HB2 1 35 SER H 5.500 . 6.330 5.707 5.610 5.914 . 0 0 "[ . 1 . 2]" 1
360 1 35 SER H 1 36 ALA MB 4.190 . 4.820 4.268 4.204 4.402 . 0 0 "[ . 1 . 2]" 1
361 1 33 LEU HG 1 35 SER H 4.920 . 5.660 5.224 5.063 5.373 . 0 0 "[ . 1 . 2]" 1
362 1 35 SER H 1 35 SER HB2 2.770 . 3.190 2.511 2.439 2.584 . 0 0 "[ . 1 . 2]" 1
363 1 31 ASP HA 1 35 SER H 3.560 . 4.090 3.913 3.434 4.098 0.008 15 0 "[ . 1 . 2]" 1
364 1 34 SER H 1 35 SER H 3.540 . 4.070 2.615 2.524 2.766 . 0 0 "[ . 1 . 2]" 1
365 1 78 THR H 1 79 ILE MD 4.250 . 4.890 4.087 3.575 4.896 0.006 7 0 "[ . 1 . 2]" 1
366 1 78 THR H 1 78 THR MG 3.790 . 4.360 3.770 3.760 3.782 . 0 0 "[ . 1 . 2]" 1
367 1 78 THR H 1 81 LYS HB2 4.990 . 5.740 5.098 4.906 5.360 . 0 0 "[ . 1 . 2]" 1
368 1 77 ASN HB2 1 78 THR H 3.910 . 4.500 2.869 2.601 3.083 . 0 0 "[ . 1 . 2]" 1
369 1 77 ASN HB3 1 78 THR H 3.960 . 4.550 3.567 3.347 3.919 . 0 0 "[ . 1 . 2]" 1
370 1 78 THR H 1 79 ILE HA 5.490 . 6.310 5.361 5.229 5.441 . 0 0 "[ . 1 . 2]" 1
371 1 75 LEU HA 1 78 THR H 3.920 . 4.510 3.544 3.341 4.002 . 0 0 "[ . 1 . 2]" 1
372 1 76 VAL H 1 78 THR H 4.660 . 5.360 4.199 4.018 4.394 . 0 0 "[ . 1 . 2]" 1
373 1 78 THR H 1 80 LEU H 4.290 . 4.930 4.204 4.012 4.394 . 0 0 "[ . 1 . 2]" 1
374 1 73 HIS H 1 74 ARG HG2 4.370 . 5.030 4.152 3.843 4.521 . 0 0 "[ . 1 . 2]" 1
375 1 73 HIS H 1 75 LEU HB2 5.040 . 5.800 5.182 4.885 5.739 . 0 0 "[ . 1 . 2]" 1
376 1 73 HIS H 1 73 HIS HB3 3.790 . 4.360 2.516 2.392 2.637 . 0 0 "[ . 1 . 2]" 1
377 1 73 HIS H 1 73 HIS HB2 3.790 . 4.360 2.512 2.375 2.642 . 0 0 "[ . 1 . 2]" 1
378 1 69 LEU HA 1 73 HIS H 4.720 . 5.430 4.190 3.754 4.842 . 0 0 "[ . 1 . 2]" 1
379 1 70 LEU HA 1 73 HIS H 4.190 . 4.820 3.395 3.200 3.620 . 0 0 "[ . 1 . 2]" 1
380 1 71 ASP HA 1 73 HIS H 4.790 . 5.510 4.199 4.006 4.373 . 0 0 "[ . 1 . 2]" 1
381 1 71 ASP H 1 73 HIS H 4.390 . 5.050 3.808 3.653 3.958 . 0 0 "[ . 1 . 2]" 1
382 1 72 ARG H 1 73 HIS H 3.980 . 4.580 2.613 2.459 2.811 . 0 0 "[ . 1 . 2]" 1
383 1 79 ILE H 1 79 ILE MD 3.260 . 3.750 2.372 1.839 3.420 . 0 0 "[ . 1 . 2]" 1
384 1 78 THR MG 1 79 ILE H 3.700 . 4.260 3.311 3.037 3.603 . 0 0 "[ . 1 . 2]" 1
385 1 79 ILE H 1 79 ILE HB 3.440 . 3.960 2.486 2.374 2.629 . 0 0 "[ . 1 . 2]" 1
386 1 76 VAL HA 1 79 ILE H 4.410 . 5.070 3.872 3.660 4.165 . 0 0 "[ . 1 . 2]" 1
387 1 78 THR HB 1 79 ILE H 3.910 . 4.500 2.457 2.272 2.683 . 0 0 "[ . 1 . 2]" 1
388 1 79 ILE H 1 81 LYS H 5.000 . 5.750 3.765 3.432 4.028 . 0 0 "[ . 1 . 2]" 1
389 1 79 ILE H 1 80 LEU H 4.060 . 4.670 2.493 2.379 2.597 . 0 0 "[ . 1 . 2]" 1
390 1 37 LEU H 1 37 LEU HG 3.600 . 4.140 2.606 2.363 3.940 . 0 0 "[ . 1 . 2]" 1
391 1 37 LEU H 1 37 LEU HB3 4.070 . 4.680 3.632 3.592 3.701 . 0 0 "[ . 1 . 2]" 1
392 1 36 ALA MB 1 37 LEU H 3.280 . 3.770 2.364 2.300 2.574 . 0 0 "[ . 1 . 2]" 1
393 1 37 LEU H 1 37 LEU HB2 3.820 . 4.390 2.481 2.385 2.548 . 0 0 "[ . 1 . 2]" 1
394 1 37 LEU H 1 38 LYS HA 4.750 . 5.460 4.512 4.332 4.726 . 0 0 "[ . 1 . 2]" 1
395 1 37 LEU H 1 38 LYS H 3.490 . 4.010 2.289 2.103 2.484 . 0 0 "[ . 1 . 2]" 1
396 1 35 SER H 1 37 LEU H 4.770 . 5.490 4.474 4.345 4.590 . 0 0 "[ . 1 . 2]" 1
397 1 20 GLN HB3 1 21 GLY H 4.600 . 5.290 4.076 2.788 4.585 . 0 0 "[ . 1 . 2]" 1
398 1 20 GLN HB2 1 21 GLY H 4.600 . 5.290 3.838 1.995 4.524 . 0 0 "[ . 1 . 2]" 1
399 1 19 PHE HA 1 21 GLY H 5.210 . 5.990 4.247 3.101 5.819 . 0 0 "[ . 1 . 2]" 1
400 1 21 GLY H 1 22 HIS H 4.340 . 4.990 3.035 1.881 4.286 . 0 0 "[ . 1 . 2]" 1
401 1 106 LYS HG2 1 108 SER H 4.090 . 4.700 3.082 2.002 4.697 . 0 0 "[ . 1 . 2]" 1
402 1 106 LYS HG3 1 108 SER H 4.090 . 4.700 3.182 1.994 4.614 . 0 0 "[ . 1 . 2]" 1
403 1 106 LYS HD2 1 108 SER H 4.830 . 5.550 4.203 2.290 5.552 0.002 9 0 "[ . 1 . 2]" 1
404 1 106 LYS HD3 1 108 SER H 4.830 . 5.550 4.036 1.812 5.138 . 0 0 "[ . 1 . 2]" 1
405 1 40 THR MG 1 62 ASN HD21 3.910 . 4.500 4.130 3.234 4.508 0.008 19 0 "[ . 1 . 2]" 1
406 1 62 ASN HD21 1 96 THR MG 4.680 . 5.380 4.854 3.946 5.395 0.015 17 0 "[ . 1 . 2]" 1
407 1 62 ASN HD21 1 97 PRO HG3 3.910 . 4.500 3.000 1.902 4.506 0.006 17 0 "[ . 1 . 2]" 1
408 1 62 ASN HD21 1 97 PRO HG2 3.910 . 4.500 2.688 1.882 3.654 . 0 0 "[ . 1 . 2]" 1
409 1 62 ASN HD21 1 65 GLU HG2 4.880 . 5.610 4.062 2.359 5.615 0.005 17 0 "[ . 1 . 2]" 1
410 1 62 ASN HB2 1 62 ASN HD21 3.410 . 3.920 2.985 2.165 3.524 . 0 0 "[ . 1 . 2]" 1
411 1 62 ASN HA 1 62 ASN HD21 3.780 . 4.350 2.430 1.795 4.257 0.005 9 0 "[ . 1 . 2]" 1
412 1 62 ASN HD21 1 98 LEU H 5.220 . 6.000 5.486 4.728 6.005 0.005 12 0 "[ . 1 . 2]" 1
413 1 62 ASN HD21 1 63 ASN H 4.830 . 5.550 4.834 4.299 5.559 0.009 19 0 "[ . 1 . 2]" 1
414 1 62 ASN H 1 62 ASN HD21 4.160 . 4.780 3.052 2.081 4.278 . 0 0 "[ . 1 . 2]" 1
415 1 80 LEU H 1 80 LEU HG 3.900 . 4.490 3.766 3.023 3.921 . 0 0 "[ . 1 . 2]" 1
416 1 80 LEU H 1 80 LEU MD1 3.460 . 3.980 2.242 2.008 3.703 . 0 0 "[ . 1 . 2]" 1
417 1 80 LEU H 1 81 LYS HB2 5.500 . 6.330 5.001 4.811 5.218 . 0 0 "[ . 1 . 2]" 1
418 1 80 LEU H 1 83 GLU HG2 5.500 . 6.330 5.492 4.368 6.342 0.012 17 0 "[ . 1 . 2]" 1
419 1 76 VAL HA 1 80 LEU H 4.710 . 5.420 3.541 3.268 3.832 . 0 0 "[ . 1 . 2]" 1
420 1 105 SER H 1 106 LYS H 3.060 . 3.520 2.654 2.373 2.986 . 0 0 "[ . 1 . 2]" 1
421 1 105 SER H 1 105 SER HA 2.870 . 3.300 2.833 2.777 2.894 . 0 0 "[ . 1 . 2]" 1
422 1 65 GLU HB2 1 67 LYS H 5.440 . 6.260 5.224 4.782 5.863 . 0 0 "[ . 1 . 2]" 1
423 1 65 GLU HG3 1 67 LYS H 4.810 . 5.530 4.897 4.476 5.479 . 0 0 "[ . 1 . 2]" 1
424 1 66 ASP HB3 1 67 LYS H 4.950 . 5.690 3.501 2.410 4.173 . 0 0 "[ . 1 . 2]" 1
425 1 65 GLU HA 1 67 LYS H 3.850 . 4.430 3.443 3.164 4.120 . 0 0 "[ . 1 . 2]" 1
426 1 64 PHE HA 1 67 LYS H 4.260 . 4.900 3.714 2.677 4.407 . 0 0 "[ . 1 . 2]" 1
427 1 65 GLU H 1 67 LYS H 4.710 . 5.420 3.995 3.597 4.365 . 0 0 "[ . 1 . 2]" 1
428 1 66 ASP H 1 67 LYS H 3.650 . 4.200 2.480 2.238 2.722 . 0 0 "[ . 1 . 2]" 1
429 1 67 LYS H 1 68 LYS H 4.170 . 4.800 2.678 2.551 3.047 . 0 0 "[ . 1 . 2]" 1
430 1 75 LEU H 1 75 LEU MD1 4.840 . 5.570 3.692 2.444 4.034 . 0 0 "[ . 1 . 2]" 1
431 1 75 LEU H 1 75 LEU MD2 4.840 . 5.570 3.177 2.452 4.252 . 0 0 "[ . 1 . 2]" 1
432 1 75 LEU H 1 75 LEU HG 3.920 . 4.510 3.280 2.315 4.513 0.003 4 0 "[ . 1 . 2]" 1
433 1 74 ARG HG3 1 75 LEU H 3.170 . 3.650 2.611 2.265 3.073 . 0 0 "[ . 1 . 2]" 1
434 1 75 LEU H 1 75 LEU HB2 3.340 . 3.840 2.313 2.135 2.489 . 0 0 "[ . 1 . 2]" 1
435 1 74 ARG HD2 1 75 LEU H 4.970 . 5.720 4.662 4.214 4.917 . 0 0 "[ . 1 . 2]" 1
436 1 74 ARG HD3 1 75 LEU H 5.230 . 6.010 4.409 4.224 4.574 . 0 0 "[ . 1 . 2]" 1
437 1 72 ARG HA 1 75 LEU H 4.030 . 4.630 3.692 3.425 4.185 . 0 0 "[ . 1 . 2]" 1
438 1 75 LEU H 1 78 THR HB 5.060 . 5.820 5.436 5.200 5.580 . 0 0 "[ . 1 . 2]" 1
439 1 71 ASP HA 1 75 LEU H 4.120 . 4.740 3.904 3.600 4.328 . 0 0 "[ . 1 . 2]" 1
440 1 75 LEU H 1 76 VAL H 3.710 . 4.270 2.728 2.671 2.817 . 0 0 "[ . 1 . 2]" 1
441 1 73 HIS H 1 75 LEU H 4.700 . 5.400 4.163 3.966 4.465 . 0 0 "[ . 1 . 2]" 1
442 1 75 LEU H 1 78 THR H 5.240 . 6.030 4.730 4.578 4.857 . 0 0 "[ . 1 . 2]" 1
443 1 74 ARG H 1 75 LEU H 3.670 . 4.220 2.683 2.568 2.760 . 0 0 "[ . 1 . 2]" 1
444 1 75 LEU H 1 77 ASN H 4.570 . 5.260 4.128 3.972 4.295 . 0 0 "[ . 1 . 2]" 1
445 1 73 HIS HD2 1 75 LEU H 5.500 . 6.330 5.927 5.698 6.235 . 0 0 "[ . 1 . 2]" 1
446 1 103 LEU HG 1 104 LYS H 3.880 . 4.460 4.179 3.996 4.323 . 0 0 "[ . 1 . 2]" 1
447 1 103 LEU HB2 1 104 LYS H 3.000 . 3.450 2.471 2.289 2.962 . 0 0 "[ . 1 . 2]" 1
448 1 100 TYR HB2 1 104 LYS H 5.500 . 6.330 5.989 5.554 6.332 0.002 4 0 "[ . 1 . 2]" 1
449 1 101 ASP HA 1 104 LYS H 3.870 . 4.450 3.593 3.325 3.984 . 0 0 "[ . 1 . 2]" 1
450 1 100 TYR HE1 1 104 LYS H 4.910 . 5.650 5.351 4.730 5.653 0.003 3 0 "[ . 1 . 2]" 1
451 1 100 TYR HD1 1 104 LYS H 4.710 . 5.420 4.979 4.418 5.399 . 0 0 "[ . 1 . 2]" 1
452 1 102 LYS H 1 104 LYS H 4.390 . 5.050 4.275 3.993 4.414 . 0 0 "[ . 1 . 2]" 1
453 1 101 ASP H 1 104 LYS H 5.020 . 5.770 4.907 4.820 5.036 . 0 0 "[ . 1 . 2]" 1
454 1 86 ASN H 1 87 ILE MD 4.680 . 5.380 4.535 4.186 4.804 . 0 0 "[ . 1 . 2]" 1
455 1 86 ASN H 1 87 ILE HG13 4.410 . 5.070 3.177 2.839 3.454 . 0 0 "[ . 1 . 2]" 1
456 1 84 LEU HB2 1 86 ASN H 5.070 . 5.830 5.007 4.912 5.091 . 0 0 "[ . 1 . 2]" 1
457 1 86 ASN H 1 87 ILE HG12 4.010 . 4.610 4.472 3.936 4.612 0.002 20 0 "[ . 1 . 2]" 1
458 1 85 GLN HB2 1 86 ASN H 3.410 . 3.920 3.062 2.896 3.313 . 0 0 "[ . 1 . 2]" 1
459 1 86 ASN H 1 86 ASN HB3 3.640 . 4.190 3.666 3.605 3.724 . 0 0 "[ . 1 . 2]" 1
460 1 85 GLN HA 1 86 ASN H 3.490 . 4.010 3.450 3.406 3.490 . 0 0 "[ . 1 . 2]" 1
461 1 86 ASN H 1 87 ILE HA 5.170 . 5.950 4.928 4.828 5.105 . 0 0 "[ . 1 . 2]" 1
462 1 86 ASN H 1 87 ILE H 3.150 . 3.620 2.336 2.113 2.436 . 0 0 "[ . 1 . 2]" 1
463 1 83 GLU H 1 86 ASN H 5.500 . 6.330 5.757 5.437 6.111 . 0 0 "[ . 1 . 2]" 1
464 1 84 LEU H 1 86 ASN H 4.630 . 5.320 4.461 4.311 4.601 . 0 0 "[ . 1 . 2]" 1
465 1 104 LYS H 1 104 LYS HG2 3.160 . 3.630 2.360 1.864 3.499 . 0 0 "[ . 1 . 2]" 1
466 1 104 LYS H 1 104 LYS HG3 3.260 . 3.750 2.382 1.791 3.125 0.009 3 0 "[ . 1 . 2]" 1
467 1 98 LEU HB2 1 99 GLU H 4.050 . 4.660 2.928 2.356 3.560 . 0 0 "[ . 1 . 2]" 1
468 1 99 GLU H 1 99 GLU HB2 3.630 . 4.170 2.433 2.205 2.601 . 0 0 "[ . 1 . 2]" 1
469 1 99 GLU H 1 99 GLU HB3 3.700 . 4.260 3.249 2.413 3.615 . 0 0 "[ . 1 . 2]" 1
470 1 99 GLU H 1 100 TYR HB3 5.010 . 5.760 4.806 4.580 5.080 . 0 0 "[ . 1 . 2]" 1
471 1 99 GLU H 1 100 TYR H 3.950 . 4.540 2.612 2.435 2.828 . 0 0 "[ . 1 . 2]" 1
472 1 96 THR H 1 99 GLU H 4.420 . 5.080 3.898 3.237 4.628 . 0 0 "[ . 1 . 2]" 1
473 1 16 ASN HA 1 16 ASN HD21 4.190 . 4.820 3.957 3.539 4.209 . 0 0 "[ . 1 . 2]" 1
474 1 16 ASN HD21 1 17 LEU H 4.070 . 4.680 3.555 2.308 4.563 . 0 0 "[ . 1 . 2]" 1
475 1 16 ASN H 1 16 ASN HD21 3.990 . 4.590 2.314 1.793 3.200 0.007 11 0 "[ . 1 . 2]" 1
476 1 15 GLU HA 1 16 ASN HD21 4.720 . 5.430 4.898 3.809 5.441 0.011 17 0 "[ . 1 . 2]" 1
477 1 103 LEU H 1 103 LEU HG 3.170 . 3.650 2.222 2.041 2.417 . 0 0 "[ . 1 . 2]" 1
478 1 103 LEU H 1 103 LEU MD2 3.180 . 3.660 3.149 2.937 3.359 . 0 0 "[ . 1 . 2]" 1
479 1 87 ILE MG 1 89 ALA H 3.570 . 4.110 2.181 1.816 3.354 . 0 0 "[ . 1 . 2]" 1
480 1 103 LEU H 1 103 LEU HB2 2.850 . 3.280 2.538 2.479 2.615 . 0 0 "[ . 1 . 2]" 1
481 1 102 LYS HB2 1 103 LEU H 3.160 . 3.630 2.999 2.611 3.430 . 0 0 "[ . 1 . 2]" 1
482 1 88 HIS HB2 1 89 ALA H 4.610 . 5.300 3.680 1.822 4.293 . 0 0 "[ . 1 . 2]" 1
483 1 88 HIS HB3 1 89 ALA H 4.610 . 5.300 2.591 2.174 4.205 . 0 0 "[ . 1 . 2]" 1
484 1 54 SER HB2 1 89 ALA H 5.500 . 6.330 4.756 3.173 6.239 . 0 0 "[ . 1 . 2]" 1
485 1 54 SER HB3 1 89 ALA H 5.500 . 6.330 3.953 2.312 5.354 . 0 0 "[ . 1 . 2]" 1
486 1 100 TYR HA 1 103 LEU H 3.520 . 4.050 3.238 3.005 3.446 . 0 0 "[ . 1 . 2]" 1
487 1 54 SER HA 1 89 ALA H 3.850 . 4.430 3.041 2.601 3.918 . 0 0 "[ . 1 . 2]" 1
488 1 100 TYR HD1 1 103 LEU H 5.050 . 5.810 5.219 4.929 5.572 . 0 0 "[ . 1 . 2]" 1
489 1 103 LEU H 1 104 LYS H 3.070 . 3.530 2.644 2.466 2.768 . 0 0 "[ . 1 . 2]" 1
490 1 89 ALA H 1 90 PHE H 4.010 . 4.610 3.757 3.348 4.046 . 0 0 "[ . 1 . 2]" 1
491 1 88 HIS H 1 89 ALA H 3.530 . 4.060 2.445 1.971 2.730 . 0 0 "[ . 1 . 2]" 1
492 1 28 VAL H 1 28 VAL HB 3.540 . 4.070 2.574 2.518 2.701 . 0 0 "[ . 1 . 2]" 1
493 1 27 LYS H 1 28 VAL H 3.990 . 4.590 2.591 2.477 2.728 . 0 0 "[ . 1 . 2]" 1
494 1 101 ASP H 1 103 LEU H 4.340 . 4.990 4.076 3.923 4.316 . 0 0 "[ . 1 . 2]" 1
495 1 28 VAL H 1 29 ILE MD 4.680 . 5.380 4.043 3.746 5.125 . 0 0 "[ . 1 . 2]" 1
496 1 76 VAL H 1 76 VAL MG2 3.910 . 4.500 2.329 2.129 3.754 . 0 0 "[ . 1 . 2]" 1
497 1 76 VAL H 1 76 VAL MG1 3.910 . 4.500 3.687 2.362 3.771 . 0 0 "[ . 1 . 2]" 1
498 1 75 LEU HB3 1 76 VAL H 3.600 . 4.140 3.154 2.431 3.446 . 0 0 "[ . 1 . 2]" 1
499 1 76 VAL H 1 76 VAL HB 3.330 . 3.830 2.442 2.383 2.501 . 0 0 "[ . 1 . 2]" 1
500 1 76 VAL H 1 77 ASN H 3.720 . 4.280 2.781 2.662 2.841 . 0 0 "[ . 1 . 2]" 1
501 1 35 SER H 1 36 ALA H 3.230 . 3.710 2.573 2.517 2.745 . 0 0 "[ . 1 . 2]" 1
502 1 36 ALA H 1 37 LEU H 3.420 . 3.930 2.541 2.394 2.714 . 0 0 "[ . 1 . 2]" 1
503 1 35 SER HB2 1 36 ALA H 3.020 . 3.470 2.942 2.511 3.022 . 0 0 "[ . 1 . 2]" 1
504 1 36 ALA H 1 36 ALA MB 2.840 . 3.270 2.274 2.246 2.314 . 0 0 "[ . 1 . 2]" 1
505 1 76 VAL H 1 77 ASN HB2 4.990 . 5.740 4.846 4.633 5.060 . 0 0 "[ . 1 . 2]" 1
506 1 75 LEU HB2 1 76 VAL H 3.810 . 4.380 2.627 2.345 3.742 . 0 0 "[ . 1 . 2]" 1
507 1 37 LEU HG 1 38 LYS H 4.730 . 5.440 4.419 4.212 5.117 . 0 0 "[ . 1 . 2]" 1
508 1 37 LEU HB3 1 38 LYS H 4.400 . 5.060 3.843 3.701 4.081 . 0 0 "[ . 1 . 2]" 1
509 1 36 ALA MB 1 38 LYS H 4.290 . 4.930 4.241 4.089 4.392 . 0 0 "[ . 1 . 2]" 1
510 1 38 LYS H 1 39 PRO HD2 3.770 . 4.340 3.707 3.303 4.138 . 0 0 "[ . 1 . 2]" 1
511 1 38 LYS H 1 39 PRO HD3 3.910 . 4.500 2.458 2.219 2.712 . 0 0 "[ . 1 . 2]" 1
512 1 35 SER H 1 38 LYS H 4.590 . 5.280 4.628 4.432 4.777 . 0 0 "[ . 1 . 2]" 1
513 1 34 SER H 1 38 LYS H 5.500 . 6.330 5.274 4.925 5.556 . 0 0 "[ . 1 . 2]" 1
514 1 84 LEU HB2 1 85 GLN HE21 3.430 . 3.940 2.547 2.289 3.955 0.015 11 0 "[ . 1 . 2]" 1
515 1 85 GLN HB2 1 85 GLN HE21 3.550 . 4.080 3.875 2.980 3.996 . 0 0 "[ . 1 . 2]" 1
516 1 85 GLN HE21 1 85 GLN HG2 3.120 . 3.590 2.169 2.152 2.242 . 0 0 "[ . 1 . 2]" 1
517 1 81 LYS HA 1 85 GLN HE21 4.730 . 5.440 4.170 3.726 5.038 . 0 0 "[ . 1 . 2]" 1
518 1 82 GLU HA 1 85 GLN HE21 3.280 . 3.770 3.166 1.794 3.360 0.006 11 0 "[ . 1 . 2]" 1
519 1 85 GLN HA 1 85 GLN HE21 3.970 . 4.570 3.289 3.128 4.156 . 0 0 "[ . 1 . 2]" 1
520 1 83 GLU H 1 85 GLN HE21 4.420 . 5.080 4.807 4.636 5.003 . 0 0 "[ . 1 . 2]" 1
521 1 82 GLU H 1 85 GLN HE21 4.620 . 5.310 4.825 4.384 5.030 . 0 0 "[ . 1 . 2]" 1
522 1 42 LEU H 1 60 VAL MG2 5.060 . 5.820 5.147 4.867 5.393 . 0 0 "[ . 1 . 2]" 1
523 1 42 LEU H 1 42 LEU MD1 5.150 . 5.920 4.339 4.157 4.693 . 0 0 "[ . 1 . 2]" 1
524 1 42 LEU H 1 42 LEU MD2 5.150 . 5.920 4.419 4.130 4.657 . 0 0 "[ . 1 . 2]" 1
525 1 42 LEU H 1 42 LEU HB3 4.020 . 4.620 2.875 2.724 3.099 . 0 0 "[ . 1 . 2]" 1
526 1 42 LEU H 1 42 LEU HG 5.030 . 5.780 4.767 4.488 5.070 . 0 0 "[ . 1 . 2]" 1
527 1 42 LEU H 1 42 LEU HB2 4.020 . 4.620 3.111 2.902 3.264 . 0 0 "[ . 1 . 2]" 1
528 1 41 PHE HB3 1 42 LEU H 4.210 . 4.840 4.116 3.981 4.230 . 0 0 "[ . 1 . 2]" 1
529 1 41 PHE HB2 1 42 LEU H 4.160 . 4.780 4.188 4.088 4.286 . 0 0 "[ . 1 . 2]" 1
530 1 41 PHE HA 1 42 LEU H 2.960 . 3.400 2.180 2.131 2.218 . 0 0 "[ . 1 . 2]" 1
531 1 41 PHE HD1 1 42 LEU H 4.220 . 4.850 3.655 3.333 4.109 . 0 0 "[ . 1 . 2]" 1
532 1 41 PHE HD2 1 42 LEU H 4.440 . 5.110 4.218 3.961 4.578 . 0 0 "[ . 1 . 2]" 1
533 1 41 PHE HE1 1 42 LEU H 5.080 . 5.840 4.724 4.450 5.179 . 0 0 "[ . 1 . 2]" 1
534 1 41 PHE HE2 1 42 LEU H 5.380 . 6.190 5.173 4.912 5.552 . 0 0 "[ . 1 . 2]" 1
535 1 42 LEU H 1 60 VAL H 5.370 . 6.180 5.039 4.873 5.282 . 0 0 "[ . 1 . 2]" 1
536 1 42 LEU H 1 43 GLU H 4.590 . 5.280 4.100 3.943 4.240 . 0 0 "[ . 1 . 2]" 1
537 1 59 ILE MD 1 65 GLU H 5.500 . 6.330 6.051 5.349 6.343 0.013 14 0 "[ . 1 . 2]" 1
538 1 65 GLU H 1 96 THR MG 3.540 . 4.070 3.166 2.638 3.768 . 0 0 "[ . 1 . 2]" 1
539 1 65 GLU H 1 65 GLU HB3 3.070 . 3.530 2.405 2.027 2.884 . 0 0 "[ . 1 . 2]" 1
540 1 65 GLU H 1 65 GLU HB2 3.640 . 4.190 3.446 3.074 3.683 . 0 0 "[ . 1 . 2]" 1
541 1 65 GLU H 1 65 GLU HG3 3.190 . 3.670 3.003 1.901 3.739 0.069 17 0 "[ . 1 . 2]" 1
542 1 62 ASN HB3 1 65 GLU H 4.790 . 5.510 4.531 4.174 4.935 . 0 0 "[ . 1 . 2]" 1
543 1 63 ASN HA 1 65 GLU H 4.660 . 5.360 3.965 3.688 4.233 . 0 0 "[ . 1 . 2]" 1
544 1 62 ASN HA 1 65 GLU H 3.800 . 4.370 3.225 2.976 3.611 . 0 0 "[ . 1 . 2]" 1
545 1 65 GLU H 1 66 ASP H 4.160 . 4.780 2.404 2.080 2.599 . 0 0 "[ . 1 . 2]" 1
546 1 63 ASN H 1 65 GLU H 4.180 . 4.810 4.084 3.780 4.384 . 0 0 "[ . 1 . 2]" 1
547 1 102 LYS H 1 103 LEU HG 4.080 . 4.690 4.031 3.779 4.234 . 0 0 "[ . 1 . 2]" 1
548 1 102 LYS H 1 103 LEU MD2 4.260 . 4.900 4.856 4.660 4.906 0.006 1 0 "[ . 1 . 2]" 1
549 1 102 LYS H 1 104 LYS HG3 4.710 . 5.420 4.794 4.331 5.433 0.013 8 0 "[ . 1 . 2]" 1
550 1 102 LYS H 1 102 LYS HB2 2.710 . 3.120 2.223 2.114 2.475 . 0 0 "[ . 1 . 2]" 1
551 1 101 ASP HB3 1 102 LYS H 3.140 . 3.610 2.748 2.519 2.855 . 0 0 "[ . 1 . 2]" 1
552 1 101 ASP HB2 1 102 LYS H 4.050 . 4.660 3.969 3.751 4.073 . 0 0 "[ . 1 . 2]" 1
553 1 102 LYS H 1 102 LYS HE2 4.590 . 5.280 2.883 1.879 5.283 0.003 1 0 "[ . 1 . 2]" 1
554 1 102 LYS H 1 102 LYS HE3 4.590 . 5.280 3.357 2.309 4.700 . 0 0 "[ . 1 . 2]" 1
555 1 99 GLU HA 1 102 LYS H 3.950 . 4.540 3.584 3.268 3.854 . 0 0 "[ . 1 . 2]" 1
556 1 100 TYR H 1 102 LYS H 4.370 . 5.030 4.233 4.087 4.423 . 0 0 "[ . 1 . 2]" 1
557 1 101 ASP H 1 102 LYS H 3.270 . 3.760 2.714 2.608 2.876 . 0 0 "[ . 1 . 2]" 1
558 1 25 ILE MD 1 86 ASN HD21 4.330 . 4.980 4.167 2.872 4.985 0.005 9 0 "[ . 1 . 2]" 1
559 1 83 GLU HB2 1 86 ASN HD21 4.990 . 5.740 5.350 4.799 5.743 0.003 3 0 "[ . 1 . 2]" 1
560 1 85 GLN HB2 1 86 ASN HD21 4.260 . 4.900 3.740 3.057 4.904 0.004 2 0 "[ . 1 . 2]" 1
561 1 83 GLU HA 1 86 ASN HD21 4.440 . 5.110 2.901 2.350 3.352 . 0 0 "[ . 1 . 2]" 1
562 1 86 ASN HA 1 86 ASN HD21 4.100 . 4.720 4.036 3.850 4.446 . 0 0 "[ . 1 . 2]" 1
563 1 86 ASN H 1 86 ASN HD21 3.890 . 4.470 2.605 2.264 3.718 . 0 0 "[ . 1 . 2]" 1
564 1 37 LEU HB2 1 63 ASN HD21 5.500 . 6.330 5.341 4.362 6.203 . 0 0 "[ . 1 . 2]" 1
565 1 25 ILE MD 1 27 LYS H 5.500 . 6.330 5.541 5.057 6.334 0.004 9 0 "[ . 1 . 2]" 1
566 1 27 LYS H 1 29 ILE HB 5.500 . 6.330 5.401 5.169 5.706 . 0 0 "[ . 1 . 2]" 1
567 1 27 LYS H 1 28 VAL HB 5.250 . 6.040 4.876 4.730 5.230 . 0 0 "[ . 1 . 2]" 1
568 1 24 CYS HB2 1 27 LYS H 5.300 . 6.100 3.690 2.480 4.620 . 0 0 "[ . 1 . 2]" 1
569 1 24 CYS HB3 1 27 LYS H 5.300 . 6.100 3.090 2.325 4.133 . 0 0 "[ . 1 . 2]" 1
570 1 27 LYS H 1 29 ILE H 4.810 . 5.530 4.386 4.185 4.550 . 0 0 "[ . 1 . 2]" 1
571 1 26 GLN H 1 27 LYS H 4.410 . 5.070 2.701 2.567 2.849 . 0 0 "[ . 1 . 2]" 1
572 1 87 ILE H 1 87 ILE MD 4.120 . 4.740 3.935 3.691 4.055 . 0 0 "[ . 1 . 2]" 1
573 1 87 ILE H 1 87 ILE MG 3.850 . 4.430 3.917 3.821 3.952 . 0 0 "[ . 1 . 2]" 1
574 1 87 ILE H 1 87 ILE HG13 3.740 . 4.300 2.416 2.034 2.645 . 0 0 "[ . 1 . 2]" 1
575 1 84 LEU HB2 1 87 ILE H 5.500 . 6.330 5.268 5.010 5.398 . 0 0 "[ . 1 . 2]" 1
576 1 87 ILE H 1 87 ILE HG12 3.580 . 4.120 3.452 3.038 3.723 . 0 0 "[ . 1 . 2]" 1
577 1 87 ILE H 1 87 ILE HB 3.730 . 4.290 2.891 2.769 3.174 . 0 0 "[ . 1 . 2]" 1
578 1 85 GLN HB2 1 87 ILE H 5.060 . 5.820 4.992 4.867 5.140 . 0 0 "[ . 1 . 2]" 1
579 1 86 ASN HB3 1 87 ILE H 4.330 . 4.980 4.251 3.897 4.412 . 0 0 "[ . 1 . 2]" 1
580 1 84 LEU HA 1 87 ILE H 3.740 . 4.300 3.314 2.809 3.520 . 0 0 "[ . 1 . 2]" 1
581 1 85 GLN HA 1 87 ILE H 4.030 . 4.630 3.893 3.665 4.511 . 0 0 "[ . 1 . 2]" 1
582 1 87 ILE H 1 88 HIS HA 4.910 . 5.650 4.909 4.680 5.139 . 0 0 "[ . 1 . 2]" 1
583 1 86 ASN HA 1 87 ILE H 3.380 . 3.890 3.297 3.173 3.477 . 0 0 "[ . 1 . 2]" 1
584 1 86 ASN HD21 1 87 ILE H 5.120 . 5.890 4.636 4.064 5.547 . 0 0 "[ . 1 . 2]" 1
585 1 84 LEU H 1 87 ILE H 5.500 . 6.330 5.352 4.732 5.562 . 0 0 "[ . 1 . 2]" 1
586 1 87 ILE H 1 88 HIS H 4.530 . 5.210 4.457 4.388 4.580 . 0 0 "[ . 1 . 2]" 1
587 1 41 PHE H 1 60 VAL MG2 4.000 . 4.600 4.123 4.003 4.405 . 0 0 "[ . 1 . 2]" 1
588 1 41 PHE H 1 60 VAL MG1 4.060 . 4.670 3.382 2.972 3.641 . 0 0 "[ . 1 . 2]" 1
589 1 40 THR MG 1 41 PHE H 3.760 . 4.320 4.074 3.890 4.291 . 0 0 "[ . 1 . 2]" 1
590 1 39 PRO HG2 1 41 PHE H 4.460 . 5.130 4.600 4.087 5.025 . 0 0 "[ . 1 . 2]" 1
591 1 41 PHE H 1 60 VAL HB 3.650 . 4.200 2.544 2.393 2.824 . 0 0 "[ . 1 . 2]" 1
592 1 41 PHE H 1 41 PHE HB2 3.980 . 4.580 3.259 3.116 3.324 . 0 0 "[ . 1 . 2]" 1
593 1 39 PRO HA 1 41 PHE H 4.610 . 5.300 3.790 3.582 4.134 . 0 0 "[ . 1 . 2]" 1
594 1 41 PHE H 1 61 SER HA 4.750 . 5.460 4.192 3.723 4.477 . 0 0 "[ . 1 . 2]" 1
595 1 41 PHE H 1 60 VAL HA 4.990 . 5.740 4.782 4.674 4.882 . 0 0 "[ . 1 . 2]" 1
596 1 41 PHE H 1 41 PHE HD2 4.410 . 5.070 4.709 4.618 4.808 . 0 0 "[ . 1 . 2]" 1
597 1 41 PHE H 1 42 LEU H 4.450 . 5.120 4.251 4.165 4.332 . 0 0 "[ . 1 . 2]" 1
598 1 40 THR H 1 41 PHE H 3.540 . 4.070 2.345 1.993 2.677 . 0 0 "[ . 1 . 2]" 1
599 1 41 PHE H 1 61 SER H 5.200 . 5.980 5.228 5.009 5.361 . 0 0 "[ . 1 . 2]" 1
600 1 62 ASN HD22 1 96 THR MG 5.110 . 5.880 5.625 4.741 5.886 0.006 4 0 "[ . 1 . 2]" 1
601 1 62 ASN HD22 1 97 PRO HG3 3.850 . 4.430 3.130 2.003 4.351 . 0 0 "[ . 1 . 2]" 1
602 1 62 ASN HD22 1 97 PRO HG2 3.850 . 4.430 2.571 1.926 3.376 . 0 0 "[ . 1 . 2]" 1
603 1 62 ASN HB2 1 62 ASN HD22 3.890 . 4.470 3.822 3.459 4.087 . 0 0 "[ . 1 . 2]" 1
604 1 62 ASN HD22 1 97 PRO HD3 4.730 . 5.440 4.375 3.926 5.339 . 0 0 "[ . 1 . 2]" 1
605 1 62 ASN HD22 1 97 PRO HD2 4.730 . 5.440 3.850 3.238 4.734 . 0 0 "[ . 1 . 2]" 1
606 1 62 ASN HA 1 62 ASN HD22 4.040 . 4.650 3.590 3.158 4.430 . 0 0 "[ . 1 . 2]" 1
607 1 62 ASN HD22 1 98 LEU H 4.980 . 5.730 5.320 4.029 5.728 . 0 0 "[ . 1 . 2]" 1
608 1 62 ASN H 1 62 ASN HD22 4.380 . 5.040 4.175 3.711 5.059 0.019 2 0 "[ . 1 . 2]" 1
609 1 70 LEU MD1 1 71 ASP H 3.640 . 4.190 1.798 1.789 1.826 0.011 10 0 "[ . 1 . 2]" 1
610 1 71 ASP H 1 71 ASP HB2 4.160 . 4.780 2.420 2.246 2.639 . 0 0 "[ . 1 . 2]" 1
611 1 71 ASP H 1 74 ARG HD2 5.160 . 5.930 4.668 3.999 5.327 . 0 0 "[ . 1 . 2]" 1
612 1 71 ASP H 1 74 ARG HD3 5.500 . 6.330 4.873 4.456 5.440 . 0 0 "[ . 1 . 2]" 1
613 1 69 LEU HA 1 71 ASP H 4.820 . 5.540 4.266 3.986 4.565 . 0 0 "[ . 1 . 2]" 1
614 1 68 LYS HA 1 71 ASP H 4.210 . 4.840 4.029 3.534 4.686 . 0 0 "[ . 1 . 2]" 1
615 1 71 ASP H 1 72 ARG H 3.630 . 4.170 2.569 2.444 2.706 . 0 0 "[ . 1 . 2]" 1
616 1 71 ASP H 1 74 ARG H 4.870 . 5.600 4.654 4.508 4.801 . 0 0 "[ . 1 . 2]" 1
617 1 70 LEU H 1 71 ASP H 3.550 . 4.080 2.620 2.549 2.734 . 0 0 "[ . 1 . 2]" 1
618 1 68 LYS H 1 71 ASP H 5.200 . 5.980 5.516 5.003 5.875 . 0 0 "[ . 1 . 2]" 1
619 1 85 GLN H 1 87 ILE HG13 5.120 . 5.890 4.876 4.429 5.103 . 0 0 "[ . 1 . 2]" 1
620 1 84 LEU HB2 1 85 GLN H 3.640 . 4.190 2.964 2.871 3.024 . 0 0 "[ . 1 . 2]" 1
621 1 84 LEU HB3 1 85 GLN H 3.860 . 4.440 3.836 3.679 3.940 . 0 0 "[ . 1 . 2]" 1
622 1 85 GLN H 1 85 GLN HB2 2.770 . 3.190 2.657 2.220 2.744 . 0 0 "[ . 1 . 2]" 1
623 1 85 GLN H 1 85 GLN HG2 3.130 . 3.600 2.312 2.090 3.609 0.009 11 0 "[ . 1 . 2]" 1
624 1 85 GLN H 1 86 ASN HB2 5.200 . 5.980 5.016 4.862 5.189 . 0 0 "[ . 1 . 2]" 1
625 1 83 GLU HA 1 85 GLN H 3.880 . 4.460 4.067 3.937 4.156 . 0 0 "[ . 1 . 2]" 1
626 1 85 GLN H 1 85 GLN HE22 4.650 . 5.350 3.670 3.241 3.857 . 0 0 "[ . 1 . 2]" 1
627 1 85 GLN H 1 87 ILE H 4.180 . 4.810 4.146 3.968 4.228 . 0 0 "[ . 1 . 2]" 1
628 1 85 GLN H 1 86 ASN H 3.200 . 3.680 2.727 2.612 2.817 . 0 0 "[ . 1 . 2]" 1
629 1 84 LEU H 1 85 GLN H 3.540 . 4.070 2.906 2.747 3.003 . 0 0 "[ . 1 . 2]" 1
630 1 82 GLU HA 1 85 GLN H 3.830 . 4.400 3.585 3.226 3.899 . 0 0 "[ . 1 . 2]" 1
631 1 76 VAL HB 1 77 ASN HD21 5.230 . 6.010 3.470 2.585 4.718 . 0 0 "[ . 1 . 2]" 1
632 1 77 ASN HD21 1 92 MET ME 5.500 . 6.330 5.522 4.414 6.336 0.006 6 0 "[ . 1 . 2]" 1
633 1 73 HIS HA 1 77 ASN HD21 4.630 . 5.320 4.355 3.265 5.329 0.009 7 0 "[ . 1 . 2]" 1
634 1 25 ILE MD 1 86 ASN HD22 4.730 . 5.440 4.348 2.858 5.443 0.003 14 0 "[ . 1 . 2]" 1
635 1 85 GLN HB2 1 86 ASN HD22 4.210 . 4.840 3.625 3.131 4.420 . 0 0 "[ . 1 . 2]" 1
636 1 86 ASN HA 1 86 ASN HD22 4.690 . 5.390 4.470 4.302 4.679 . 0 0 "[ . 1 . 2]" 1
637 1 59 ILE MD 1 64 PHE H 4.220 . 4.850 4.271 3.683 4.686 . 0 0 "[ . 1 . 2]" 1
638 1 64 PHE H 1 96 THR MG 3.600 . 4.140 3.671 3.184 4.145 0.005 17 0 "[ . 1 . 2]" 1
639 1 64 PHE H 1 65 GLU HB3 4.220 . 4.850 4.129 3.742 4.725 . 0 0 "[ . 1 . 2]" 1
640 1 63 ASN HB3 1 64 PHE H 4.340 . 4.990 3.146 2.546 4.199 . 0 0 "[ . 1 . 2]" 1
641 1 63 ASN HB2 1 64 PHE H 4.340 . 4.990 4.075 3.899 4.310 . 0 0 "[ . 1 . 2]" 1
642 1 64 PHE H 1 64 PHE HB3 3.920 . 4.510 2.796 2.443 3.743 . 0 0 "[ . 1 . 2]" 1
643 1 64 PHE H 1 64 PHE HB2 3.920 . 4.510 2.751 2.428 3.033 . 0 0 "[ . 1 . 2]" 1
644 1 64 PHE H 1 65 GLU HA 4.870 . 5.600 4.671 4.398 4.882 . 0 0 "[ . 1 . 2]" 1
645 1 62 ASN HA 1 64 PHE H 4.000 . 4.600 3.672 3.253 4.077 . 0 0 "[ . 1 . 2]" 1
646 1 64 PHE H 1 65 GLU H 3.380 . 3.890 2.317 2.069 2.640 . 0 0 "[ . 1 . 2]" 1
647 1 63 ASN H 1 64 PHE H 3.560 . 4.090 2.721 2.536 2.909 . 0 0 "[ . 1 . 2]" 1
648 1 62 ASN H 1 64 PHE H 4.680 . 5.380 4.441 4.153 4.706 . 0 0 "[ . 1 . 2]" 1
649 1 79 ILE MG 1 81 LYS H 4.480 . 5.150 4.584 4.415 4.766 . 0 0 "[ . 1 . 2]" 1
650 1 80 LEU HB2 1 81 LYS H 3.560 . 4.090 3.498 3.328 3.643 . 0 0 "[ . 1 . 2]" 1
651 1 80 LEU HB3 1 81 LYS H 4.110 . 4.730 4.059 3.869 4.164 . 0 0 "[ . 1 . 2]" 1
652 1 81 LYS H 1 81 LYS HB3 2.870 . 3.300 2.491 2.260 2.699 . 0 0 "[ . 1 . 2]" 1
653 1 81 LYS H 1 81 LYS HB2 2.950 . 3.390 2.597 2.463 2.798 . 0 0 "[ . 1 . 2]" 1
654 1 79 ILE HA 1 81 LYS H 4.320 . 4.970 3.933 3.708 4.230 . 0 0 "[ . 1 . 2]" 1
655 1 78 THR HA 1 81 LYS H 4.180 . 4.810 4.125 3.837 4.440 . 0 0 "[ . 1 . 2]" 1
656 1 80 LEU H 1 81 LYS H 3.590 . 4.130 2.608 2.569 2.684 . 0 0 "[ . 1 . 2]" 1
657 1 81 LYS H 1 83 GLU H 4.060 . 4.670 3.776 3.614 4.000 . 0 0 "[ . 1 . 2]" 1
658 1 81 LYS H 1 82 GLU H 3.490 . 4.010 3.003 2.764 3.133 . 0 0 "[ . 1 . 2]" 1
659 1 81 LYS H 1 84 LEU H 4.780 . 5.500 4.658 4.568 4.777 . 0 0 "[ . 1 . 2]" 1
660 1 84 LEU HB2 1 85 GLN HE22 3.580 . 4.120 3.127 2.962 3.354 . 0 0 "[ . 1 . 2]" 1
661 1 84 LEU HB3 1 85 GLN HE22 4.580 . 5.270 4.065 3.736 4.571 . 0 0 "[ . 1 . 2]" 1
662 1 85 GLN HE22 1 85 GLN HG2 3.640 . 4.190 3.442 3.426 3.479 . 0 0 "[ . 1 . 2]" 1
663 1 81 LYS HA 1 85 GLN HE22 4.690 . 5.390 4.645 4.143 4.920 . 0 0 "[ . 1 . 2]" 1
664 1 82 GLU HA 1 85 GLN HE22 3.960 . 4.550 4.487 2.997 4.571 0.021 20 0 "[ . 1 . 2]" 1
665 1 85 GLN HA 1 85 GLN HE22 3.780 . 4.350 3.536 3.402 4.175 . 0 0 "[ . 1 . 2]" 1
666 1 20 GLN H 1 20 GLN HE22 4.180 . 4.810 3.762 2.573 4.716 . 0 0 "[ . 1 . 2]" 1
667 1 20 GLN HB3 1 20 GLN HE21 4.370 . 5.030 3.909 3.218 4.260 . 0 0 "[ . 1 . 2]" 1
668 1 20 GLN HB2 1 20 GLN HE21 4.370 . 5.030 3.541 1.798 4.141 0.002 1 0 "[ . 1 . 2]" 1
669 1 20 GLN HA 1 20 GLN HE21 4.070 . 4.680 3.485 2.282 4.697 0.017 9 0 "[ . 1 . 2]" 1
670 1 20 GLN HE21 1 21 GLY H 5.190 . 5.970 4.503 1.978 5.623 . 0 0 "[ . 1 . 2]" 1
671 1 20 GLN H 1 20 GLN HE21 4.150 . 4.770 2.825 2.020 3.496 . 0 0 "[ . 1 . 2]" 1
672 1 16 ASN HD22 1 17 LEU HG 5.070 . 5.830 4.355 2.444 5.835 0.005 2 0 "[ . 1 . 2]" 1
673 1 15 GLU HA 1 16 ASN HD22 5.500 . 6.330 5.807 4.929 6.332 0.002 6 0 "[ . 1 . 2]" 1
674 1 16 ASN HD22 1 17 LEU HA 5.500 . 6.330 5.136 4.360 5.873 . 0 0 "[ . 1 . 2]" 1
675 1 16 ASN HD22 1 17 LEU H 4.140 . 4.760 4.157 3.551 4.762 0.002 4 0 "[ . 1 . 2]" 1
676 1 15 GLU H 1 16 ASN HD22 5.240 . 6.030 5.311 4.560 5.819 . 0 0 "[ . 1 . 2]" 1
677 1 37 LEU HB2 1 63 ASN HD22 5.500 . 6.330 5.975 3.769 6.334 0.004 5 0 "[ . 1 . 2]" 1
678 1 63 ASN HD22 1 75 LEU HB3 5.500 . 6.330 4.653 3.454 6.319 . 0 0 "[ . 1 . 2]" 1
679 1 76 VAL HB 1 77 ASN HD22 5.230 . 6.010 4.349 3.680 6.011 0.001 18 0 "[ . 1 . 2]" 1
680 1 77 ASN HD22 1 92 MET ME 5.500 . 6.330 5.677 4.542 6.333 0.003 3 0 "[ . 1 . 2]" 1
681 1 77 ASN HB2 1 77 ASN HD22 4.080 . 4.690 3.833 3.490 4.067 . 0 0 "[ . 1 . 2]" 1
682 1 73 HIS HA 1 77 ASN HD22 4.630 . 5.320 4.363 3.893 4.915 . 0 0 "[ . 1 . 2]" 1
683 1 60 VAL MG2 1 100 TYR HB3 4.630 . 5.320 3.745 2.888 4.460 . 0 0 "[ . 1 . 2]" 1
684 1 100 TYR HB3 1 101 ASP H 4.930 . 5.670 2.739 2.613 2.897 . 0 0 "[ . 1 . 2]" 1
685 1 60 VAL MG2 1 100 TYR HA 5.430 . 6.240 4.476 3.994 5.248 . 0 0 "[ . 1 . 2]" 1
686 1 59 ILE MD 1 63 ASN HB2 5.130 . 5.900 5.018 4.031 5.907 0.007 1 0 "[ . 1 . 2]" 1
687 1 59 ILE MD 1 63 ASN HB3 5.130 . 5.900 3.936 2.851 5.332 . 0 0 "[ . 1 . 2]" 1
688 1 59 ILE MD 1 64 PHE HA 5.300 . 6.100 5.295 4.567 6.027 . 0 0 "[ . 1 . 2]" 1
689 1 55 PHE HB2 1 87 ILE MD 5.500 . 6.330 3.597 3.033 4.363 . 0 0 "[ . 1 . 2]" 1
690 1 55 PHE HB3 1 90 PHE HD1 4.510 . 5.190 3.664 3.181 4.364 . 0 0 "[ . 1 . 2]" 1
691 1 55 PHE HB2 1 90 PHE HD1 4.810 . 5.530 2.334 1.802 2.955 . 0 0 "[ . 1 . 2]" 1
692 1 41 PHE HB2 1 60 VAL MG1 4.910 . 5.650 3.570 3.130 3.985 . 0 0 "[ . 1 . 2]" 1
693 1 41 PHE HB2 1 60 VAL MG2 4.070 . 4.680 3.806 3.443 4.067 . 0 0 "[ . 1 . 2]" 1
694 1 41 PHE HB3 1 60 VAL MG2 4.130 . 4.750 2.482 2.221 2.752 . 0 0 "[ . 1 . 2]" 1
695 1 41 PHE HA 1 41 PHE HD1 3.810 . 4.380 2.736 2.598 2.957 . 0 0 "[ . 1 . 2]" 1
696 1 41 PHE HA 1 60 VAL MG2 4.850 . 5.580 4.878 4.651 5.123 . 0 0 "[ . 1 . 2]" 1
697 1 54 SER HA 1 90 PHE HD1 5.500 . 6.330 5.434 4.183 6.333 0.003 14 0 "[ . 1 . 2]" 1
698 1 19 PHE H 1 19 PHE HB3 3.940 . 4.530 2.813 2.463 3.641 . 0 0 "[ . 1 . 2]" 1
699 1 19 PHE HB3 1 20 GLN H 4.700 . 5.400 4.360 3.912 4.653 . 0 0 "[ . 1 . 2]" 1
700 1 44 LEU HB3 1 45 VAL H 4.600 . 5.290 3.501 3.322 3.977 . 0 0 "[ . 1 . 2]" 1
701 1 44 LEU HB3 1 55 PHE HD1 5.380 . 6.190 3.659 2.249 5.033 . 0 0 "[ . 1 . 2]" 1
702 1 44 LEU HA 1 57 ALA HA 3.630 . 4.170 2.482 2.026 2.789 . 0 0 "[ . 1 . 2]" 1
703 1 44 LEU H 1 44 LEU HG 5.010 . 5.760 4.109 2.763 4.663 . 0 0 "[ . 1 . 2]" 1
704 1 44 LEU HG 1 45 VAL H 5.340 . 6.140 4.996 4.043 5.516 . 0 0 "[ . 1 . 2]" 1
705 1 44 LEU HG 1 57 ALA HA 4.990 . 5.740 4.796 2.632 5.746 0.006 10 0 "[ . 1 . 2]" 1
706 1 44 LEU HA 1 44 LEU HG 4.110 . 4.730 3.294 2.398 3.758 . 0 0 "[ . 1 . 2]" 1
707 1 25 ILE HB 1 26 GLN H 5.000 . 5.750 3.992 3.934 4.078 . 0 0 "[ . 1 . 2]" 1
708 1 24 CYS HA 1 25 ILE HB 4.850 . 5.580 4.624 4.476 4.843 . 0 0 "[ . 1 . 2]" 1
709 1 25 ILE H 1 25 ILE HG13 5.040 . 5.800 4.500 4.464 4.630 . 0 0 "[ . 1 . 2]" 1
710 1 26 GLN HA 1 29 ILE HB 4.210 . 4.840 3.156 2.712 3.553 . 0 0 "[ . 1 . 2]" 1
711 1 26 GLN HA 1 29 ILE MG 4.360 . 5.010 4.296 3.951 4.599 . 0 0 "[ . 1 . 2]" 1
712 1 26 GLN HA 1 29 ILE MD 4.370 . 5.030 3.635 2.896 4.753 . 0 0 "[ . 1 . 2]" 1
713 1 26 GLN HG2 1 44 LEU HB2 5.500 . 6.330 4.852 3.463 5.928 . 0 0 "[ . 1 . 2]" 1
714 1 26 GLN HG3 1 44 LEU HB2 5.500 . 6.330 4.800 2.863 6.335 0.005 2 0 "[ . 1 . 2]" 1
715 1 25 ILE HA 1 28 VAL HB 4.060 . 4.670 2.902 2.329 4.390 . 0 0 "[ . 1 . 2]" 1
716 1 28 VAL HA 1 31 ASP H 4.560 . 5.240 3.796 3.558 4.134 . 0 0 "[ . 1 . 2]" 1
717 1 28 VAL HA 1 31 ASP HB2 4.360 . 5.010 4.053 2.834 4.855 . 0 0 "[ . 1 . 2]" 1
718 1 28 VAL HA 1 31 ASP HB3 4.360 . 5.010 3.638 2.999 4.847 . 0 0 "[ . 1 . 2]" 1
719 1 28 VAL HA 1 28 VAL MG1 3.370 . 3.880 2.448 2.368 3.214 . 0 0 "[ . 1 . 2]" 1
720 1 28 VAL HA 1 28 VAL MG2 3.370 . 3.880 2.388 2.340 2.423 . 0 0 "[ . 1 . 2]" 1
721 1 29 ILE HA 1 32 LYS H 4.500 . 5.180 3.627 3.203 3.939 . 0 0 "[ . 1 . 2]" 1
722 1 29 ILE HA 1 29 ILE MG 3.190 . 3.670 2.635 2.396 2.759 . 0 0 "[ . 1 . 2]" 1
723 1 29 ILE HA 1 33 LEU MD2 4.270 . 4.910 4.166 3.857 4.718 . 0 0 "[ . 1 . 2]" 1
724 1 30 GLU HB2 1 31 ASP H 4.300 . 4.950 3.291 2.351 3.922 . 0 0 "[ . 1 . 2]" 1
725 1 30 GLU HB3 1 31 ASP H 4.300 . 4.950 2.765 2.354 3.545 . 0 0 "[ . 1 . 2]" 1
726 1 30 GLU H 1 30 GLU HG2 4.520 . 5.200 4.011 2.464 4.504 . 0 0 "[ . 1 . 2]" 1
727 1 30 GLU HG3 1 31 ASP H 5.020 . 5.770 4.666 4.085 5.196 . 0 0 "[ . 1 . 2]" 1
728 1 30 GLU HA 1 30 GLU HG2 3.990 . 4.590 2.625 2.220 3.082 . 0 0 "[ . 1 . 2]" 1
729 1 30 GLU HG2 1 31 ASP H 5.020 . 5.770 4.340 3.541 4.967 . 0 0 "[ . 1 . 2]" 1
730 1 30 GLU HA 1 30 GLU HG3 3.990 . 4.590 3.132 2.542 3.679 . 0 0 "[ . 1 . 2]" 1
731 1 30 GLU HA 1 33 LEU MD1 3.520 . 4.050 2.824 2.412 3.326 . 0 0 "[ . 1 . 2]" 1
732 1 30 GLU HA 1 33 LEU MD2 3.670 . 4.220 3.014 2.638 3.440 . 0 0 "[ . 1 . 2]" 1
733 1 30 GLU HA 1 33 LEU HB2 5.500 . 6.330 5.598 5.238 6.020 . 0 0 "[ . 1 . 2]" 1
734 1 31 ASP H 1 31 ASP HB2 3.800 . 4.370 2.462 2.126 2.679 . 0 0 "[ . 1 . 2]" 1
735 1 31 ASP H 1 31 ASP HB3 3.800 . 4.370 2.766 2.418 3.568 . 0 0 "[ . 1 . 2]" 1
736 1 31 ASP HA 1 33 LEU HG 5.050 . 5.810 5.217 4.806 5.770 . 0 0 "[ . 1 . 2]" 1
737 1 31 ASP HA 1 33 LEU MD1 5.230 . 6.010 4.894 4.478 5.183 . 0 0 "[ . 1 . 2]" 1
738 1 32 LYS HA 1 32 LYS HG2 4.250 . 4.890 3.062 2.286 3.871 . 0 0 "[ . 1 . 2]" 1
739 1 32 LYS HA 1 32 LYS HG3 4.250 . 4.890 3.027 2.387 3.796 . 0 0 "[ . 1 . 2]" 1
740 1 32 LYS H 1 32 LYS HG2 5.180 . 5.960 3.917 2.238 4.635 . 0 0 "[ . 1 . 2]" 1
741 1 32 LYS H 1 32 LYS HG3 5.180 . 5.960 3.826 2.472 4.466 . 0 0 "[ . 1 . 2]" 1
742 1 33 LEU HG 1 80 LEU HG 5.500 . 6.330 5.781 5.156 6.132 . 0 0 "[ . 1 . 2]" 1
743 1 29 ILE MG 1 33 LEU HG 3.920 . 4.510 3.308 2.906 3.640 . 0 0 "[ . 1 . 2]" 1
744 1 33 LEU HA 1 33 LEU MD1 4.110 . 4.730 3.672 3.641 3.704 . 0 0 "[ . 1 . 2]" 1
745 1 33 LEU HA 1 33 LEU MD2 4.510 . 5.190 4.055 4.033 4.084 . 0 0 "[ . 1 . 2]" 1
746 1 33 LEU HB3 1 33 LEU MD2 3.370 . 3.880 2.181 2.164 2.192 . 0 0 "[ . 1 . 2]" 1
747 1 33 LEU MD1 1 34 SER HA 4.540 . 5.220 2.663 2.504 2.848 . 0 0 "[ . 1 . 2]" 1
748 1 35 SER HB3 1 36 ALA H 3.980 . 4.580 3.947 3.619 4.043 . 0 0 "[ . 1 . 2]" 1
749 1 35 SER H 1 35 SER HB3 3.640 . 4.190 3.590 3.568 3.602 . 0 0 "[ . 1 . 2]" 1
750 1 35 SER HB3 1 36 ALA MB 5.180 . 5.960 4.774 4.520 4.964 . 0 0 "[ . 1 . 2]" 1
751 1 35 SER HB2 1 36 ALA MB 4.480 . 5.150 3.899 3.665 4.070 . 0 0 "[ . 1 . 2]" 1
752 1 35 SER HB3 1 36 ALA HA 4.730 . 5.440 4.544 4.332 4.689 . 0 0 "[ . 1 . 2]" 1
753 1 31 ASP HA 1 35 SER HB2 4.960 . 5.700 5.582 5.068 5.704 0.004 2 0 "[ . 1 . 2]" 1
754 1 35 SER HA 1 38 LYS H 4.650 . 5.350 4.264 3.792 4.513 . 0 0 "[ . 1 . 2]" 1
755 1 36 ALA HA 1 79 ILE MD 4.150 . 4.770 4.271 3.547 4.603 . 0 0 "[ . 1 . 2]" 1
756 1 35 SER HB2 1 36 ALA HA 4.570 . 5.260 4.342 4.188 4.529 . 0 0 "[ . 1 . 2]" 1
757 1 33 LEU HA 1 36 ALA MB 3.540 . 4.070 2.606 2.308 2.898 . 0 0 "[ . 1 . 2]" 1
758 1 36 ALA MB 1 79 ILE MD 2.690 . 3.090 2.256 1.818 2.579 . 0 0 "[ . 1 . 2]" 1
759 1 36 ALA MB 1 37 LEU HA 3.960 . 4.550 3.820 3.740 3.906 . 0 0 "[ . 1 . 2]" 1
760 1 37 LEU HA 1 37 LEU HG 3.970 . 4.570 3.066 2.451 3.204 . 0 0 "[ . 1 . 2]" 1
761 1 37 LEU HB2 1 39 PRO HD3 4.620 . 5.310 3.182 2.606 3.628 . 0 0 "[ . 1 . 2]" 1
762 1 37 LEU HB2 1 39 PRO HG3 4.130 . 4.750 3.804 2.820 4.687 . 0 0 "[ . 1 . 2]" 1
763 1 36 ALA MB 1 37 LEU HB3 5.080 . 5.840 4.949 4.843 5.062 . 0 0 "[ . 1 . 2]" 1
764 1 37 LEU HA 1 37 LEU MD1 4.500 . 5.180 3.773 2.899 3.891 . 0 0 "[ . 1 . 2]" 1
765 1 37 LEU HA 1 37 LEU MD2 4.500 . 5.180 2.203 1.984 3.726 . 0 0 "[ . 1 . 2]" 1
766 1 37 LEU MD1 1 76 VAL HA 5.310 . 6.110 3.703 2.799 4.498 . 0 0 "[ . 1 . 2]" 1
767 1 37 LEU MD2 1 76 VAL HA 5.310 . 6.110 3.730 2.758 4.875 . 0 0 "[ . 1 . 2]" 1
768 1 37 LEU HG 1 76 VAL HA 5.270 . 6.060 5.104 4.303 6.065 0.005 17 0 "[ . 1 . 2]" 1
769 1 38 LYS HB2 1 39 PRO HD2 5.500 . 6.330 5.128 4.750 5.350 . 0 0 "[ . 1 . 2]" 1
770 1 38 LYS HB3 1 39 PRO HD2 5.500 . 6.330 4.783 4.389 5.331 . 0 0 "[ . 1 . 2]" 1
771 1 38 LYS HA 1 39 PRO HD2 3.480 . 4.000 2.472 2.142 2.723 . 0 0 "[ . 1 . 2]" 1
772 1 39 PRO HA 1 61 SER HA 4.600 . 5.290 2.694 2.333 3.601 . 0 0 "[ . 1 . 2]" 1
773 1 39 PRO HB2 1 41 PHE H 4.490 . 5.160 2.734 2.346 2.988 . 0 0 "[ . 1 . 2]" 1
774 1 39 PRO HB3 1 41 PHE H 4.490 . 5.160 4.073 3.603 4.309 . 0 0 "[ . 1 . 2]" 1
775 1 39 PRO HB3 1 60 VAL H 4.940 . 5.680 3.365 2.964 3.754 . 0 0 "[ . 1 . 2]" 1
776 1 39 PRO HB2 1 40 THR H 4.580 . 5.270 3.193 2.522 3.619 . 0 0 "[ . 1 . 2]" 1
777 1 39 PRO HB2 1 60 VAL H 4.940 . 5.680 3.078 2.751 3.409 . 0 0 "[ . 1 . 2]" 1
778 1 37 LEU HB3 1 39 PRO HD3 4.630 . 5.320 4.328 3.738 4.741 . 0 0 "[ . 1 . 2]" 1
779 1 37 LEU H 1 39 PRO HD3 4.540 . 5.220 4.012 3.717 4.319 . 0 0 "[ . 1 . 2]" 1
780 1 40 THR MG 1 62 ASN HD22 4.970 . 5.720 4.065 3.400 5.361 . 0 0 "[ . 1 . 2]" 1
781 1 40 THR MG 1 61 SER HA 4.300 . 4.950 3.354 2.948 4.089 . 0 0 "[ . 1 . 2]" 1
782 1 40 THR HA 1 40 THR MG 2.720 . 3.130 2.274 2.153 2.325 . 0 0 "[ . 1 . 2]" 1
783 1 40 THR MG 1 60 VAL MG1 4.030 . 4.630 4.156 3.876 4.528 . 0 0 "[ . 1 . 2]" 1
784 1 39 PRO HA 1 40 THR MG 3.930 . 4.520 3.949 3.723 4.526 0.006 16 0 "[ . 1 . 2]" 1
785 1 14 ARG HA 1 14 ARG HD2 5.500 . 6.330 4.450 2.050 5.534 . 0 0 "[ . 1 . 2]" 1
786 1 14 ARG HA 1 14 ARG HD3 5.500 . 6.330 4.742 3.689 5.544 . 0 0 "[ . 1 . 2]" 1
787 1 16 ASN H 1 16 ASN HB2 4.130 . 4.750 3.616 3.468 3.714 . 0 0 "[ . 1 . 2]" 1
788 1 16 ASN H 1 16 ASN HB3 4.130 . 4.750 2.592 2.304 3.032 . 0 0 "[ . 1 . 2]" 1
789 1 16 ASN HB3 1 17 LEU H 4.410 . 5.070 4.286 4.031 4.467 . 0 0 "[ . 1 . 2]" 1
790 1 16 ASN HB2 1 17 LEU H 4.410 . 5.070 4.288 3.846 4.500 . 0 0 "[ . 1 . 2]" 1
791 1 17 LEU HA 1 17 LEU MD1 4.070 . 4.680 2.982 1.880 3.903 . 0 0 "[ . 1 . 2]" 1
792 1 17 LEU HA 1 17 LEU HG 3.960 . 4.550 2.953 2.403 3.715 . 0 0 "[ . 1 . 2]" 1
793 1 17 LEU H 1 17 LEU HG 3.950 . 4.540 3.379 2.175 4.162 . 0 0 "[ . 1 . 2]" 1
794 1 17 LEU HA 1 17 LEU MD2 4.070 . 4.680 3.079 2.019 3.784 . 0 0 "[ . 1 . 2]" 1
795 1 42 LEU MD1 1 58 VAL H 5.500 . 6.330 4.023 3.083 5.884 . 0 0 "[ . 1 . 2]" 1
796 1 42 LEU MD2 1 58 VAL H 5.500 . 6.330 5.081 3.298 6.332 0.002 11 0 "[ . 1 . 2]" 1
797 1 42 LEU HA 1 42 LEU MD1 4.420 . 5.080 2.482 2.029 3.813 . 0 0 "[ . 1 . 2]" 1
798 1 42 LEU HA 1 42 LEU MD2 4.420 . 5.080 2.925 1.883 3.907 . 0 0 "[ . 1 . 2]" 1
799 1 43 GLU HB3 1 44 LEU H 4.650 . 5.350 4.176 3.848 4.441 . 0 0 "[ . 1 . 2]" 1
800 1 43 GLU HB2 1 44 LEU H 4.690 . 5.390 4.246 4.038 4.473 . 0 0 "[ . 1 . 2]" 1
801 1 41 PHE HE2 1 43 GLU HB3 4.000 . 4.600 3.184 2.845 3.871 . 0 0 "[ . 1 . 2]" 1
802 1 41 PHE HE2 1 43 GLU HB2 4.060 . 4.670 2.751 1.799 3.661 0.001 10 0 "[ . 1 . 2]" 1
803 1 43 GLU HB3 1 58 VAL HB 3.390 . 3.900 2.339 1.796 2.975 0.004 10 0 "[ . 1 . 2]" 1
804 1 43 GLU HB3 1 58 VAL MG1 4.890 . 5.620 3.726 3.335 4.361 . 0 0 "[ . 1 . 2]" 1
805 1 43 GLU HB3 1 58 VAL MG2 4.890 . 5.620 3.098 2.445 3.616 . 0 0 "[ . 1 . 2]" 1
806 1 43 GLU HB2 1 58 VAL MG1 5.500 . 6.330 4.564 3.870 5.265 . 0 0 "[ . 1 . 2]" 1
807 1 43 GLU HB2 1 58 VAL MG2 5.500 . 6.330 4.470 3.728 5.079 . 0 0 "[ . 1 . 2]" 1
808 1 43 GLU HG3 1 44 LEU H 4.140 . 4.760 3.144 2.588 4.739 . 0 0 "[ . 1 . 2]" 1
809 1 43 GLU H 1 43 GLU HG3 5.160 . 5.930 4.661 4.446 4.913 . 0 0 "[ . 1 . 2]" 1
810 1 43 GLU H 1 43 GLU HG2 5.160 . 5.930 4.525 4.253 5.053 . 0 0 "[ . 1 . 2]" 1
811 1 41 PHE HE2 1 43 GLU HG2 4.980 . 5.730 4.837 3.828 5.427 . 0 0 "[ . 1 . 2]" 1
812 1 41 PHE HE2 1 43 GLU HG3 4.980 . 5.730 4.915 3.582 5.731 0.001 16 0 "[ . 1 . 2]" 1
813 1 43 GLU HA 1 43 GLU HG3 3.870 . 4.450 2.697 2.480 3.624 . 0 0 "[ . 1 . 2]" 1
814 1 43 GLU HA 1 43 GLU HG2 3.870 . 4.450 3.271 2.417 3.769 . 0 0 "[ . 1 . 2]" 1
815 1 44 LEU MD1 1 45 VAL H 4.400 . 5.060 3.865 2.386 5.030 . 0 0 "[ . 1 . 2]" 1
816 1 44 LEU MD1 1 57 ALA HA 4.220 . 4.850 3.077 2.323 4.861 0.011 2 0 "[ . 1 . 2]" 1
817 1 44 LEU HA 1 44 LEU MD1 3.840 . 4.420 2.324 1.892 3.805 . 0 0 "[ . 1 . 2]" 1
818 1 30 GLU HG2 1 44 LEU MD1 4.260 . 4.900 3.578 1.870 4.905 0.005 16 0 "[ . 1 . 2]" 1
819 1 30 GLU HG3 1 44 LEU MD1 4.260 . 4.900 3.382 2.221 4.791 . 0 0 "[ . 1 . 2]" 1
820 1 30 GLU HA 1 44 LEU MD1 4.690 . 5.390 3.798 2.428 5.226 . 0 0 "[ . 1 . 2]" 1
821 1 45 VAL HA 1 46 ASP H 3.280 . 3.770 2.171 2.126 2.261 . 0 0 "[ . 1 . 2]" 1
822 1 45 VAL HB 1 56 ASP H 4.750 . 5.460 3.758 3.149 4.863 . 0 0 "[ . 1 . 2]" 1
823 1 44 LEU HA 1 45 VAL HB 5.500 . 6.330 4.768 4.530 5.743 . 0 0 "[ . 1 . 2]" 1
824 1 45 VAL HB 1 56 ASP HB2 4.510 . 5.190 4.164 2.741 5.202 0.012 5 0 "[ . 1 . 2]" 1
825 1 45 VAL HA 1 45 VAL MG1 3.480 . 4.000 2.363 2.270 2.425 . 0 0 "[ . 1 . 2]" 1
826 1 45 VAL HA 1 45 VAL MG2 3.480 . 4.000 2.510 2.376 3.200 . 0 0 "[ . 1 . 2]" 1
827 1 45 VAL HA 1 46 ASP HB3 4.720 . 5.430 4.604 4.130 4.950 . 0 0 "[ . 1 . 2]" 1
828 1 45 VAL HA 1 46 ASP HB2 4.720 . 5.430 4.659 4.191 5.459 0.029 13 0 "[ . 1 . 2]" 1
829 1 46 ASP H 1 46 ASP HB3 4.130 . 4.750 2.472 2.245 2.692 . 0 0 "[ . 1 . 2]" 1
830 1 25 ILE MD 1 86 ASN HB2 4.360 . 5.010 3.211 2.410 3.994 . 0 0 "[ . 1 . 2]" 1
831 1 54 SER HB2 1 89 ALA MB 4.160 . 4.780 3.239 2.528 4.117 . 0 0 "[ . 1 . 2]" 1
832 1 54 SER HB3 1 89 ALA MB 4.160 . 4.780 2.487 1.821 4.055 . 0 0 "[ . 1 . 2]" 1
833 1 46 ASP HA 1 55 PHE HA 4.240 . 4.880 3.185 2.366 4.329 . 0 0 "[ . 1 . 2]" 1
834 1 55 PHE HA 1 55 PHE HD1 4.360 . 5.010 2.736 2.300 2.947 . 0 0 "[ . 1 . 2]" 1
835 1 47 LYS H 1 55 PHE HA 4.280 . 4.920 2.925 2.244 4.046 . 0 0 "[ . 1 . 2]" 1
836 1 56 ASP HA 1 57 ALA H 3.300 . 3.800 2.171 2.143 2.257 . 0 0 "[ . 1 . 2]" 1
837 1 56 ASP HA 1 91 SER HB2 4.310 . 4.960 3.295 2.405 4.407 . 0 0 "[ . 1 . 2]" 1
838 1 56 ASP HA 1 57 ALA MB 4.440 . 5.110 3.962 3.909 4.059 . 0 0 "[ . 1 . 2]" 1
839 1 56 ASP H 1 56 ASP HB3 4.090 . 4.700 2.733 2.542 3.187 . 0 0 "[ . 1 . 2]" 1
840 1 55 PHE HA 1 56 ASP HB2 4.930 . 5.670 4.368 4.152 4.605 . 0 0 "[ . 1 . 2]" 1
841 1 45 VAL HB 1 56 ASP HB3 4.650 . 5.350 2.703 1.798 4.268 0.002 6 0 "[ . 1 . 2]" 1
842 1 45 VAL MG1 1 56 ASP HB3 4.560 . 5.240 3.697 3.092 4.314 . 0 0 "[ . 1 . 2]" 1
843 1 45 VAL MG2 1 56 ASP HB3 4.560 . 5.240 3.660 1.794 4.309 0.006 5 0 "[ . 1 . 2]" 1
844 1 57 ALA HA 1 58 VAL H 3.430 . 3.940 2.117 2.101 2.144 . 0 0 "[ . 1 . 2]" 1
845 1 44 LEU HB2 1 57 ALA HA 5.480 . 6.300 5.341 4.758 5.695 . 0 0 "[ . 1 . 2]" 1
846 1 57 ALA MB 1 90 PHE HE1 3.980 . 4.580 2.507 2.057 3.037 . 0 0 "[ . 1 . 2]" 1
847 1 44 LEU HA 1 57 ALA MB 4.000 . 4.600 3.334 2.746 3.851 . 0 0 "[ . 1 . 2]" 1
848 1 101 ASP HB2 1 104 LYS HG2 5.310 . 6.110 4.832 4.332 6.112 0.002 3 0 "[ . 1 . 2]" 1
849 1 101 ASP HB2 1 104 LYS HG3 5.500 . 6.330 4.924 4.536 6.030 . 0 0 "[ . 1 . 2]" 1
850 1 104 LYS HB3 1 104 LYS HG2 2.670 . 3.070 2.308 2.215 2.421 . 0 0 "[ . 1 . 2]" 1
851 1 41 PHE HE2 1 58 VAL HB 4.050 . 4.660 3.586 2.752 4.258 . 0 0 "[ . 1 . 2]" 1
852 1 59 ILE H 1 60 VAL MG2 4.470 . 5.140 4.191 3.979 4.400 . 0 0 "[ . 1 . 2]" 1
853 1 60 VAL H 1 60 VAL MG2 3.700 . 4.260 2.659 2.447 2.915 . 0 0 "[ . 1 . 2]" 1
854 1 41 PHE HE2 1 60 VAL MG2 4.610 . 5.300 3.797 3.542 4.210 . 0 0 "[ . 1 . 2]" 1
855 1 41 PHE HD2 1 60 VAL MG2 3.400 . 3.910 2.123 1.911 2.490 . 0 0 "[ . 1 . 2]" 1
856 1 60 VAL MG2 1 100 TYR HD1 4.190 . 4.820 3.306 2.779 4.405 . 0 0 "[ . 1 . 2]" 1
857 1 60 VAL MG2 1 100 TYR HD2 4.680 . 5.380 4.388 3.092 5.249 . 0 0 "[ . 1 . 2]" 1
858 1 60 VAL MG2 1 95 HIS HB2 4.000 . 4.600 2.565 1.828 3.261 . 0 0 "[ . 1 . 2]" 1
859 1 60 VAL MG2 1 100 TYR HB2 4.020 . 4.620 2.722 2.206 3.319 . 0 0 "[ . 1 . 2]" 1
860 1 60 VAL MG2 1 95 HIS HB3 4.000 . 4.600 2.767 1.805 3.384 . 0 0 "[ . 1 . 2]" 1
861 1 58 VAL MG1 1 93 LYS H 4.810 . 5.530 4.473 4.169 4.799 . 0 0 "[ . 1 . 2]" 1
862 1 41 PHE HB2 1 60 VAL HB 4.580 . 5.270 3.269 3.017 3.494 . 0 0 "[ . 1 . 2]" 1
863 1 42 LEU HA 1 59 ILE HA 4.310 . 4.960 2.937 2.674 3.206 . 0 0 "[ . 1 . 2]" 1
864 1 39 PRO HG3 1 59 ILE HA 4.190 . 4.820 4.530 3.834 4.824 0.004 13 0 "[ . 1 . 2]" 1
865 1 59 ILE HA 1 59 ILE MG 3.320 . 3.820 3.008 2.477 3.226 . 0 0 "[ . 1 . 2]" 1
866 1 59 ILE MD 1 60 VAL HA 4.880 . 5.610 3.247 2.781 4.342 . 0 0 "[ . 1 . 2]" 1
867 1 59 ILE MD 1 94 CYS HA 4.640 . 5.340 3.078 2.463 3.511 . 0 0 "[ . 1 . 2]" 1
868 1 59 ILE HA 1 59 ILE MD 4.040 . 4.650 3.545 3.377 4.066 . 0 0 "[ . 1 . 2]" 1
869 1 59 ILE HB 1 59 ILE MD 3.220 . 3.700 2.921 2.235 3.215 . 0 0 "[ . 1 . 2]" 1
870 1 59 ILE H 1 59 ILE MG 4.160 . 4.780 2.036 1.852 2.262 . 0 0 "[ . 1 . 2]" 1
871 1 59 ILE MG 1 60 VAL H 4.100 . 4.720 4.188 4.048 4.268 . 0 0 "[ . 1 . 2]" 1
872 1 59 ILE MG 1 60 VAL HA 5.500 . 6.330 4.631 4.209 5.478 . 0 0 "[ . 1 . 2]" 1
873 1 59 ILE MG 1 94 CYS HA 4.120 . 4.740 2.378 1.796 3.624 0.004 5 0 "[ . 1 . 2]" 1
874 1 59 ILE MG 1 60 VAL MG2 5.040 . 5.800 4.709 4.508 5.076 . 0 0 "[ . 1 . 2]" 1
875 1 60 VAL MG1 1 96 THR HA 4.680 . 5.380 3.114 2.751 3.630 . 0 0 "[ . 1 . 2]" 1
876 1 60 VAL MG1 1 100 TYR H 3.840 . 4.420 3.682 3.367 4.100 . 0 0 "[ . 1 . 2]" 1
877 1 60 VAL MG1 1 100 TYR HD2 4.160 . 4.780 3.435 2.724 3.997 . 0 0 "[ . 1 . 2]" 1
878 1 60 VAL MG1 1 97 PRO HA 3.260 . 3.750 2.155 1.955 2.472 . 0 0 "[ . 1 . 2]" 1
879 1 60 VAL MG1 1 95 HIS HB2 4.470 . 5.140 4.090 3.324 4.839 . 0 0 "[ . 1 . 2]" 1
880 1 60 VAL MG1 1 100 TYR HB2 3.810 . 4.380 2.538 2.068 3.104 . 0 0 "[ . 1 . 2]" 1
881 1 60 VAL MG1 1 95 HIS HB3 4.470 . 5.140 3.590 2.964 4.178 . 0 0 "[ . 1 . 2]" 1
882 1 60 VAL MG1 1 100 TYR HB3 4.240 . 4.880 2.672 2.421 3.093 . 0 0 "[ . 1 . 2]" 1
883 1 60 VAL MG1 1 97 PRO HB2 4.300 . 4.950 4.046 3.799 4.358 . 0 0 "[ . 1 . 2]" 1
884 1 73 HIS HA 1 77 ASN HB2 4.840 . 5.570 5.184 4.829 5.577 0.007 7 0 "[ . 1 . 2]" 1
885 1 74 ARG HB2 1 77 ASN HB2 5.500 . 6.330 4.784 4.294 5.295 . 0 0 "[ . 1 . 2]" 1
886 1 76 VAL HB 1 77 ASN HB2 5.500 . 6.330 4.856 4.606 6.037 . 0 0 "[ . 1 . 2]" 1
887 1 65 GLU HB3 1 66 ASP H 4.310 . 4.960 3.831 3.061 4.403 . 0 0 "[ . 1 . 2]" 1
888 1 65 GLU HB2 1 66 ASP H 4.500 . 5.180 4.259 4.084 4.424 . 0 0 "[ . 1 . 2]" 1
889 1 64 PHE H 1 65 GLU HB2 5.500 . 6.330 5.343 4.616 5.947 . 0 0 "[ . 1 . 2]" 1
890 1 65 GLU HB3 1 96 THR MG 3.920 . 4.510 2.622 1.799 3.590 0.001 1 0 "[ . 1 . 2]" 1
891 1 62 ASN HB3 1 65 GLU HB3 4.360 . 5.010 4.150 3.066 5.012 0.002 10 0 "[ . 1 . 2]" 1
892 1 62 ASN HB3 1 65 GLU HB2 5.290 . 6.080 5.302 4.226 6.089 0.009 14 0 "[ . 1 . 2]" 1
893 1 62 ASN HA 1 65 GLU HB2 4.810 . 5.530 3.801 2.575 4.766 . 0 0 "[ . 1 . 2]" 1
894 1 62 ASN HA 1 65 GLU HB3 4.690 . 5.390 2.508 1.795 3.260 0.005 9 0 "[ . 1 . 2]" 1
895 1 65 GLU HG3 1 66 ASP H 3.720 . 4.280 3.092 2.620 3.519 . 0 0 "[ . 1 . 2]" 1
896 1 65 GLU H 1 65 GLU HG2 3.790 . 4.360 3.594 2.262 4.283 . 0 0 "[ . 1 . 2]" 1
897 1 64 PHE H 1 65 GLU HG2 5.500 . 6.330 5.411 4.011 6.331 0.001 2 0 "[ . 1 . 2]" 1
898 1 64 PHE H 1 65 GLU HG3 5.500 . 6.330 5.097 3.341 6.253 . 0 0 "[ . 1 . 2]" 1
899 1 62 ASN HA 1 65 GLU HG2 3.700 . 4.260 3.064 2.331 3.739 . 0 0 "[ . 1 . 2]" 1
900 1 65 GLU HB2 1 65 GLU HG2 2.810 . 3.230 2.626 2.441 3.006 . 0 0 "[ . 1 . 2]" 1
901 1 65 GLU HB3 1 65 GLU HG2 2.850 . 3.280 2.310 2.234 2.420 . 0 0 "[ . 1 . 2]" 1
902 1 65 GLU HG2 1 96 THR MG 4.050 . 4.660 4.172 3.589 4.667 0.007 18 0 "[ . 1 . 2]" 1
903 1 65 GLU HG3 1 96 THR MG 4.470 . 5.140 4.264 3.363 4.709 . 0 0 "[ . 1 . 2]" 1
904 1 65 GLU HA 1 66 ASP H 3.440 . 3.960 3.391 3.259 3.498 . 0 0 "[ . 1 . 2]" 1
905 1 65 GLU HA 1 65 GLU HG3 3.800 . 4.370 3.557 3.226 3.738 . 0 0 "[ . 1 . 2]" 1
906 1 66 ASP HB2 1 67 LYS H 4.950 . 5.690 3.992 3.101 4.455 . 0 0 "[ . 1 . 2]" 1
907 1 68 LYS HE2 1 70 LEU MD1 4.300 . 4.950 3.553 1.811 4.962 0.012 20 0 "[ . 1 . 2]" 1
908 1 68 LYS HE3 1 70 LEU MD1 4.300 . 4.950 3.095 1.803 4.096 . 0 0 "[ . 1 . 2]" 1
909 1 68 LYS HE2 1 71 ASP H 5.450 . 6.270 5.018 3.660 6.280 0.010 6 0 "[ . 1 . 2]" 1
910 1 68 LYS HE3 1 71 ASP H 5.450 . 6.270 4.933 3.333 5.983 . 0 0 "[ . 1 . 2]" 1
911 1 70 LEU HB2 1 71 ASP H 4.300 . 4.950 4.047 3.975 4.151 . 0 0 "[ . 1 . 2]" 1
912 1 70 LEU HB3 1 71 ASP H 4.430 . 5.090 4.093 4.069 4.124 . 0 0 "[ . 1 . 2]" 1
913 1 70 LEU HB2 1 70 LEU MD1 3.320 . 3.820 3.221 3.212 3.234 . 0 0 "[ . 1 . 2]" 1
914 1 69 LEU H 1 69 LEU HB2 3.760 . 4.320 2.986 2.317 3.652 . 0 0 "[ . 1 . 2]" 1
915 1 70 LEU HA 1 73 HIS HB3 4.410 . 5.070 2.507 2.107 2.946 . 0 0 "[ . 1 . 2]" 1
916 1 70 LEU HA 1 73 HIS HB2 4.410 . 5.070 3.161 2.969 3.736 . 0 0 "[ . 1 . 2]" 1
917 1 99 GLU HA 1 102 LYS HB2 3.760 . 4.320 3.162 2.689 3.906 . 0 0 "[ . 1 . 2]" 1
918 1 70 LEU H 1 70 LEU HG 4.100 . 4.720 3.702 3.663 3.810 . 0 0 "[ . 1 . 2]" 1
919 1 70 LEU HG 1 71 ASP H 5.010 . 5.760 4.310 4.221 4.393 . 0 0 "[ . 1 . 2]" 1
920 1 70 LEU H 1 70 LEU MD2 4.010 . 4.610 3.658 3.605 3.818 . 0 0 "[ . 1 . 2]" 1
921 1 70 LEU MD2 1 74 ARG H 4.980 . 5.730 4.335 4.091 4.477 . 0 0 "[ . 1 . 2]" 1
922 1 70 LEU MD2 1 73 HIS H 5.230 . 6.010 4.910 4.753 5.031 . 0 0 "[ . 1 . 2]" 1
923 1 70 LEU MD2 1 71 ASP H 4.750 . 5.460 2.523 2.330 2.748 . 0 0 "[ . 1 . 2]" 1
924 1 70 LEU HA 1 70 LEU MD2 3.480 . 4.000 3.597 3.550 3.614 . 0 0 "[ . 1 . 2]" 1
925 1 70 LEU MD2 1 74 ARG HD2 4.080 . 4.690 2.559 2.201 3.079 . 0 0 "[ . 1 . 2]" 1
926 1 68 LYS HE2 1 70 LEU MD2 5.500 . 6.330 4.465 3.113 5.991 . 0 0 "[ . 1 . 2]" 1
927 1 68 LYS HE3 1 70 LEU MD2 5.500 . 6.330 4.138 3.140 5.158 . 0 0 "[ . 1 . 2]" 1
928 1 70 LEU HB2 1 70 LEU MD2 3.020 . 3.470 2.287 2.273 2.297 . 0 0 "[ . 1 . 2]" 1
929 1 69 LEU MD1 1 70 LEU H 4.170 . 4.800 3.237 2.135 4.530 . 0 0 "[ . 1 . 2]" 1
930 1 69 LEU H 1 69 LEU MD2 4.690 . 5.390 3.682 2.935 4.245 . 0 0 "[ . 1 . 2]" 1
931 1 69 LEU MD2 1 70 LEU H 4.170 . 4.800 3.889 2.961 4.436 . 0 0 "[ . 1 . 2]" 1
932 1 69 LEU HA 1 69 LEU MD1 4.260 . 4.900 3.344 2.185 3.743 . 0 0 "[ . 1 . 2]" 1
933 1 69 LEU HA 1 69 LEU MD2 4.260 . 4.900 3.403 1.879 4.054 . 0 0 "[ . 1 . 2]" 1
934 1 70 LEU HA 1 70 LEU MD1 3.610 . 4.150 3.510 3.495 3.556 . 0 0 "[ . 1 . 2]" 1
935 1 70 LEU MD1 1 74 ARG HD2 5.130 . 5.900 4.827 4.363 5.455 . 0 0 "[ . 1 . 2]" 1
936 1 70 LEU HB3 1 70 LEU MD1 2.400 . 2.760 2.530 2.504 2.554 . 0 0 "[ . 1 . 2]" 1
937 1 71 ASP H 1 71 ASP HB3 4.160 . 4.780 3.070 2.468 3.608 . 0 0 "[ . 1 . 2]" 1
938 1 72 ARG HA 1 75 LEU HB2 4.040 . 4.650 2.902 2.526 3.563 . 0 0 "[ . 1 . 2]" 1
939 1 76 VAL HA 1 78 THR H 4.590 . 5.280 4.378 4.124 4.663 . 0 0 "[ . 1 . 2]" 1
940 1 75 LEU HB3 1 76 VAL HA 4.240 . 4.880 4.091 3.828 4.341 . 0 0 "[ . 1 . 2]" 1
941 1 76 VAL HA 1 76 VAL MG2 3.330 . 3.830 2.290 2.255 2.342 . 0 0 "[ . 1 . 2]" 1
942 1 74 ARG HA 1 77 ASN H 4.390 . 5.050 3.613 3.355 3.841 . 0 0 "[ . 1 . 2]" 1
943 1 74 ARG HA 1 78 THR H 4.780 . 5.500 4.112 3.830 4.321 . 0 0 "[ . 1 . 2]" 1
944 1 74 ARG HA 1 77 ASN HB3 4.260 . 4.900 4.304 3.828 4.716 . 0 0 "[ . 1 . 2]" 1
945 1 74 ARG HA 1 77 ASN HB2 3.930 . 4.520 2.739 2.296 3.121 . 0 0 "[ . 1 . 2]" 1
946 1 74 ARG HB3 1 75 LEU H 4.230 . 4.860 3.947 3.823 4.042 . 0 0 "[ . 1 . 2]" 1
947 1 74 ARG HB2 1 75 LEU H 4.580 . 5.270 3.819 3.642 3.988 . 0 0 "[ . 1 . 2]" 1
948 1 74 ARG HB2 1 78 THR H 5.220 . 6.000 5.159 4.940 5.349 . 0 0 "[ . 1 . 2]" 1
949 1 71 ASP HA 1 74 ARG HG2 4.550 . 5.230 2.083 1.793 2.567 0.007 12 0 "[ . 1 . 2]" 1
950 1 71 ASP HA 1 74 ARG HG3 4.320 . 4.970 3.347 2.899 3.766 . 0 0 "[ . 1 . 2]" 1
951 1 74 ARG HA 1 74 ARG HG3 3.860 . 4.440 3.824 3.766 3.889 . 0 0 "[ . 1 . 2]" 1
952 1 74 ARG HA 1 74 ARG HG2 3.810 . 4.380 3.693 3.640 3.760 . 0 0 "[ . 1 . 2]" 1
953 1 74 ARG HG3 1 75 LEU MD1 5.340 . 6.140 4.027 1.913 4.644 . 0 0 "[ . 1 . 2]" 1
954 1 74 ARG HG3 1 75 LEU MD2 5.340 . 6.140 2.923 1.898 5.014 . 0 0 "[ . 1 . 2]" 1
955 1 74 ARG HG2 1 75 LEU MD1 5.500 . 6.330 4.512 2.318 5.440 . 0 0 "[ . 1 . 2]" 1
956 1 74 ARG HG2 1 75 LEU MD2 5.500 . 6.330 3.727 2.311 5.694 . 0 0 "[ . 1 . 2]" 1
957 1 74 ARG H 1 74 ARG HD2 4.500 . 5.180 3.670 3.270 3.976 . 0 0 "[ . 1 . 2]" 1
958 1 74 ARG H 1 74 ARG HD3 5.140 . 5.910 4.386 4.178 4.662 . 0 0 "[ . 1 . 2]" 1
959 1 71 ASP HA 1 74 ARG HD3 3.920 . 4.510 2.226 1.921 2.718 . 0 0 "[ . 1 . 2]" 1
960 1 74 ARG HA 1 74 ARG HD2 4.880 . 5.610 4.725 4.627 4.875 . 0 0 "[ . 1 . 2]" 1
961 1 70 LEU HA 1 74 ARG HD2 4.740 . 5.450 5.143 4.612 5.460 0.010 11 0 "[ . 1 . 2]" 1
962 1 74 ARG HB3 1 74 ARG HD2 3.140 . 3.610 2.401 2.323 2.550 . 0 0 "[ . 1 . 2]" 1
963 1 70 LEU MD1 1 74 ARG HD3 5.500 . 6.330 5.178 4.687 5.572 . 0 0 "[ . 1 . 2]" 1
964 1 75 LEU HA 1 78 THR MG 4.360 . 5.010 4.259 3.885 4.661 . 0 0 "[ . 1 . 2]" 1
965 1 63 ASN HD21 1 75 LEU HB3 5.500 . 6.330 5.460 3.976 6.200 . 0 0 "[ . 1 . 2]" 1
966 1 75 LEU H 1 75 LEU HB3 3.900 . 4.490 3.482 2.574 3.605 . 0 0 "[ . 1 . 2]" 1
967 1 72 ARG HA 1 75 LEU HB3 4.800 . 5.520 4.256 2.699 5.102 . 0 0 "[ . 1 . 2]" 1
968 1 76 VAL MG1 1 78 THR H 5.500 . 6.330 4.825 4.311 4.986 . 0 0 "[ . 1 . 2]" 1
969 1 76 VAL HA 1 76 VAL MG1 3.330 . 3.830 2.548 2.461 3.224 . 0 0 "[ . 1 . 2]" 1
970 1 76 VAL MG2 1 78 THR H 5.500 . 6.330 5.447 5.184 5.643 . 0 0 "[ . 1 . 2]" 1
971 1 77 ASN HA 1 84 LEU MD1 5.280 . 6.070 4.635 4.229 5.087 . 0 0 "[ . 1 . 2]" 1
972 1 78 THR HA 1 81 LYS HB2 3.850 . 4.430 3.583 3.165 4.221 . 0 0 "[ . 1 . 2]" 1
973 1 78 THR H 1 78 THR HB 3.420 . 3.930 2.547 2.487 2.598 . 0 0 "[ . 1 . 2]" 1
974 1 75 LEU HB3 1 78 THR HB 5.320 . 6.120 4.981 4.417 5.586 . 0 0 "[ . 1 . 2]" 1
975 1 78 THR HB 1 79 ILE HB 5.500 . 6.330 4.574 4.403 4.820 . 0 0 "[ . 1 . 2]" 1
976 1 78 THR MG 1 80 LEU H 5.040 . 5.800 5.169 4.903 5.438 . 0 0 "[ . 1 . 2]" 1
977 1 78 THR MG 1 81 LYS H 4.940 . 5.680 5.053 4.841 5.266 . 0 0 "[ . 1 . 2]" 1
978 1 78 THR HA 1 78 THR MG 2.960 . 3.400 2.402 2.367 2.457 . 0 0 "[ . 1 . 2]" 1
979 1 78 THR MG 1 79 ILE HA 3.920 . 4.510 3.358 3.148 3.540 . 0 0 "[ . 1 . 2]" 1
980 1 78 THR MG 1 79 ILE HB 4.660 . 5.360 4.856 4.515 5.193 . 0 0 "[ . 1 . 2]" 1
981 1 78 THR MG 1 81 LYS HB3 5.130 . 5.900 4.732 4.200 5.245 . 0 0 "[ . 1 . 2]" 1
982 1 36 ALA MB 1 79 ILE HA 5.050 . 5.810 5.119 4.686 5.813 0.003 11 0 "[ . 1 . 2]" 1
983 1 79 ILE HA 1 79 ILE MG 3.200 . 3.680 2.447 2.308 2.565 . 0 0 "[ . 1 . 2]" 1
984 1 79 ILE HB 1 80 LEU H 4.330 . 4.980 2.534 2.311 2.729 . 0 0 "[ . 1 . 2]" 1
985 1 76 VAL HA 1 79 ILE HB 4.210 . 4.840 3.736 3.207 4.251 . 0 0 "[ . 1 . 2]" 1
986 1 33 LEU MD2 1 80 LEU HG 3.130 . 3.600 3.498 3.006 3.607 0.007 12 0 "[ . 1 . 2]" 1
987 1 33 LEU HB3 1 80 LEU HG 4.010 . 4.610 3.789 2.881 4.262 . 0 0 "[ . 1 . 2]" 1
988 1 80 LEU HG 1 83 GLU HB3 4.500 . 5.180 2.831 2.360 4.308 . 0 0 "[ . 1 . 2]" 1
989 1 80 LEU HG 1 90 PHE HZ 5.150 . 5.920 5.653 5.031 5.924 0.004 14 0 "[ . 1 . 2]" 1
990 1 81 LYS HA 1 84 LEU HG 3.770 . 4.340 3.827 2.422 4.345 0.005 5 0 "[ . 1 . 2]" 1
991 1 78 THR HA 1 81 LYS HB3 3.930 . 4.520 3.895 3.480 4.290 . 0 0 "[ . 1 . 2]" 1
992 1 81 LYS H 1 81 LYS HD2 5.500 . 6.330 4.851 4.503 5.846 . 0 0 "[ . 1 . 2]" 1
993 1 81 LYS H 1 81 LYS HD3 5.500 . 6.330 4.839 4.550 5.124 . 0 0 "[ . 1 . 2]" 1
994 1 81 LYS HB2 1 81 LYS HD2 3.860 . 4.440 3.129 2.720 3.738 . 0 0 "[ . 1 . 2]" 1
995 1 81 LYS HB2 1 81 LYS HD3 3.860 . 4.440 2.702 2.388 3.441 . 0 0 "[ . 1 . 2]" 1
996 1 81 LYS HE2 1 82 GLU H 5.500 . 6.330 5.725 5.070 6.339 0.009 14 0 "[ . 1 . 2]" 1
997 1 81 LYS HE3 1 82 GLU H 5.500 . 6.330 5.691 4.542 6.345 0.015 10 0 "[ . 1 . 2]" 1
998 1 83 GLU HA 1 83 GLU HG2 3.870 . 4.450 3.598 3.114 3.772 . 0 0 "[ . 1 . 2]" 1
999 1 83 GLU H 1 83 GLU HG3 4.890 . 5.620 4.372 3.972 4.456 . 0 0 "[ . 1 . 2]" 1
1000 1 80 LEU HB3 1 83 GLU HG2 3.990 . 4.590 4.161 3.265 4.594 0.004 13 0 "[ . 1 . 2]" 1
1001 1 80 LEU HG 1 83 GLU HG3 4.870 . 5.600 3.952 3.376 5.607 0.007 14 0 "[ . 1 . 2]" 1
1002 1 82 GLU HA 1 85 GLN HB2 4.130 . 4.750 3.925 3.546 4.402 . 0 0 "[ . 1 . 2]" 1
1003 1 84 LEU HA 1 87 ILE MD 3.880 . 4.460 2.862 2.408 3.651 . 0 0 "[ . 1 . 2]" 1
1004 1 84 LEU HA 1 84 LEU HG 4.100 . 4.720 3.146 3.014 3.350 . 0 0 "[ . 1 . 2]" 1
1005 1 77 ASN HA 1 84 LEU MD2 5.280 . 6.070 5.984 5.678 6.086 0.016 14 0 "[ . 1 . 2]" 1
1006 1 84 LEU HG 1 85 GLN HE22 4.690 . 5.390 5.381 5.124 5.399 0.009 18 0 "[ . 1 . 2]" 1
1007 1 44 LEU MD2 1 57 ALA HA 4.220 . 4.850 4.203 2.015 4.770 . 0 0 "[ . 1 . 2]" 1
1008 1 44 LEU HA 1 44 LEU MD2 3.840 . 4.420 3.073 1.898 3.758 . 0 0 "[ . 1 . 2]" 1
1009 1 30 GLU HA 1 44 LEU MD2 4.690 . 5.390 3.782 2.721 4.787 . 0 0 "[ . 1 . 2]" 1
1010 1 30 GLU HG2 1 44 LEU MD2 4.260 . 4.900 3.129 2.103 4.610 . 0 0 "[ . 1 . 2]" 1
1011 1 30 GLU HG3 1 44 LEU MD2 4.260 . 4.900 2.804 1.865 4.180 . 0 0 "[ . 1 . 2]" 1
1012 1 85 GLN H 1 85 GLN HB3 3.610 . 4.150 3.618 3.511 3.639 . 0 0 "[ . 1 . 2]" 1
1013 1 85 GLN HB3 1 86 ASN H 4.520 . 5.200 4.041 3.794 4.188 . 0 0 "[ . 1 . 2]" 1
1014 1 84 LEU HB2 1 85 GLN HG2 5.410 . 6.220 4.384 4.087 5.576 . 0 0 "[ . 1 . 2]" 1
1015 1 85 GLN HA 1 85 GLN HG2 3.700 . 4.260 3.444 3.352 3.632 . 0 0 "[ . 1 . 2]" 1
1016 1 85 GLN HA 1 85 GLN HG3 3.610 . 4.150 3.672 2.763 3.803 . 0 0 "[ . 1 . 2]" 1
1017 1 82 GLU HA 1 85 GLN HG2 4.090 . 4.700 2.131 1.788 3.514 0.012 8 0 "[ . 1 . 2]" 1
1018 1 82 GLU HA 1 85 GLN HG3 4.740 . 5.450 3.210 2.706 5.057 . 0 0 "[ . 1 . 2]" 1
1019 1 85 GLN H 1 85 GLN HG3 4.220 . 4.850 3.740 3.635 4.076 . 0 0 "[ . 1 . 2]" 1
1020 1 86 ASN H 1 86 ASN HB2 4.040 . 4.650 2.514 2.421 2.600 . 0 0 "[ . 1 . 2]" 1
1021 1 86 ASN HB2 1 87 ILE H 4.790 . 5.510 3.478 2.892 3.759 . 0 0 "[ . 1 . 2]" 1
1022 1 87 ILE HA 1 89 ALA H 4.700 . 5.400 4.323 3.894 5.029 . 0 0 "[ . 1 . 2]" 1
1023 1 84 LEU HA 1 87 ILE HB 4.390 . 5.050 2.991 2.592 3.783 . 0 0 "[ . 1 . 2]" 1
1024 1 86 ASN H 1 87 ILE HB 5.500 . 6.330 4.737 4.507 5.152 . 0 0 "[ . 1 . 2]" 1
1025 1 87 ILE HG13 1 87 ILE MG 3.500 . 4.030 3.199 3.193 3.204 . 0 0 "[ . 1 . 2]" 1
1026 1 83 GLU HG3 1 87 ILE HG13 4.310 . 4.960 4.113 3.401 4.963 0.003 10 0 "[ . 1 . 2]" 1
1027 1 87 ILE HA 1 87 ILE MD 4.260 . 4.900 3.912 3.861 4.028 . 0 0 "[ . 1 . 2]" 1
1028 1 87 ILE MD 1 90 PHE HB3 4.320 . 4.970 3.017 2.673 3.308 . 0 0 "[ . 1 . 2]" 1
1029 1 87 ILE MD 1 90 PHE HB2 4.320 . 4.970 1.992 1.815 2.332 . 0 0 "[ . 1 . 2]" 1
1030 1 83 GLU HG2 1 87 ILE MD 4.060 . 4.670 3.488 2.222 4.330 . 0 0 "[ . 1 . 2]" 1
1031 1 87 ILE MD 1 87 ILE MG 2.870 . 3.300 1.909 1.856 1.960 . 0 0 "[ . 1 . 2]" 1
1032 1 87 ILE HG12 1 87 ILE MG 3.500 . 4.030 2.420 2.362 2.476 . 0 0 "[ . 1 . 2]" 1
1033 1 87 ILE MG 1 90 PHE HB3 3.690 . 4.240 3.691 3.325 4.245 0.005 11 0 "[ . 1 . 2]" 1
1034 1 87 ILE MG 1 90 PHE HB2 3.690 . 4.240 2.175 1.806 2.851 . 0 0 "[ . 1 . 2]" 1
1035 1 87 ILE HA 1 87 ILE MG 3.550 . 4.080 2.250 2.171 2.293 . 0 0 "[ . 1 . 2]" 1
1036 1 87 ILE MG 1 90 PHE HA 4.530 . 5.210 3.017 2.720 4.049 . 0 0 "[ . 1 . 2]" 1
1037 1 54 SER HA 1 87 ILE MG 4.140 . 4.760 3.048 2.188 4.120 . 0 0 "[ . 1 . 2]" 1
1038 1 55 PHE HD2 1 87 ILE MG 3.770 . 4.340 2.427 2.033 3.086 . 0 0 "[ . 1 . 2]" 1
1039 1 87 ILE MG 1 90 PHE HD1 3.630 . 4.170 2.856 2.133 3.806 . 0 0 "[ . 1 . 2]" 1
1040 1 89 ALA MB 1 90 PHE H 3.730 . 4.290 3.459 3.250 3.716 . 0 0 "[ . 1 . 2]" 1
1041 1 55 PHE H 1 89 ALA MB 4.510 . 5.190 4.276 3.616 5.188 . 0 0 "[ . 1 . 2]" 1
1042 1 88 HIS HD2 1 89 ALA MB 4.270 . 4.910 2.827 2.155 4.926 0.016 12 0 "[ . 1 . 2]" 1
1043 1 54 SER HA 1 89 ALA MB 4.060 . 4.670 3.275 2.134 4.476 . 0 0 "[ . 1 . 2]" 1
1044 1 55 PHE H 1 90 PHE HA 3.660 . 4.210 2.729 2.501 2.985 . 0 0 "[ . 1 . 2]" 1
1045 1 91 SER HB3 1 92 MET H 4.150 . 4.770 3.251 2.513 4.069 . 0 0 "[ . 1 . 2]" 1
1046 1 56 ASP HA 1 91 SER HB3 4.310 . 4.960 3.685 2.136 4.740 . 0 0 "[ . 1 . 2]" 1
1047 1 57 ALA H 1 92 MET HA 3.870 . 4.450 2.440 2.093 2.838 . 0 0 "[ . 1 . 2]" 1
1048 1 92 MET HA 1 93 LYS H 3.420 . 3.930 2.186 2.140 2.265 . 0 0 "[ . 1 . 2]" 1
1049 1 57 ALA MB 1 92 MET HA 3.770 . 4.340 2.980 2.801 3.199 . 0 0 "[ . 1 . 2]" 1
1050 1 90 PHE HE2 1 92 MET HB2 4.890 . 5.620 3.922 3.436 4.319 . 0 0 "[ . 1 . 2]" 1
1051 1 92 MET HB3 1 92 MET ME 4.490 . 5.160 2.023 1.993 2.084 . 0 0 "[ . 1 . 2]" 1
1052 1 59 ILE MG 1 92 MET HG2 4.510 . 5.190 3.920 3.053 4.701 . 0 0 "[ . 1 . 2]" 1
1053 1 59 ILE MG 1 92 MET HG3 4.490 . 5.160 3.783 2.869 4.523 . 0 0 "[ . 1 . 2]" 1
1054 1 90 PHE HE2 1 92 MET HG3 4.970 . 5.720 4.240 3.901 4.652 . 0 0 "[ . 1 . 2]" 1
1055 1 90 PHE HE2 1 92 MET HG2 5.500 . 6.330 5.355 4.959 5.777 . 0 0 "[ . 1 . 2]" 1
1056 1 92 MET H 1 92 MET HG3 4.500 . 5.180 4.108 3.859 4.261 . 0 0 "[ . 1 . 2]" 1
1057 1 58 VAL MG1 1 93 LYS HB2 4.910 . 5.650 3.131 2.022 4.942 . 0 0 "[ . 1 . 2]" 1
1058 1 58 VAL MG2 1 93 LYS HB2 4.910 . 5.650 2.699 2.047 4.322 . 0 0 "[ . 1 . 2]" 1
1059 1 58 VAL MG1 1 93 LYS HB3 4.910 . 5.650 3.335 2.572 3.880 . 0 0 "[ . 1 . 2]" 1
1060 1 58 VAL MG2 1 93 LYS HB3 4.910 . 5.650 3.419 2.210 4.044 . 0 0 "[ . 1 . 2]" 1
1061 1 93 LYS HA 1 93 LYS HG3 3.800 . 4.370 3.373 2.493 3.897 . 0 0 "[ . 1 . 2]" 1
1062 1 93 LYS HA 1 93 LYS HG2 3.800 . 4.370 3.290 2.351 3.730 . 0 0 "[ . 1 . 2]" 1
1063 1 93 LYS HA 1 93 LYS HD2 4.050 . 4.660 3.041 1.888 4.266 . 0 0 "[ . 1 . 2]" 1
1064 1 93 LYS HA 1 93 LYS HD3 4.050 . 4.660 2.537 1.864 4.666 0.006 2 0 "[ . 1 . 2]" 1
1065 1 95 HIS HA 1 99 GLU HB3 5.500 . 6.330 5.296 3.900 6.335 0.005 11 0 "[ . 1 . 2]" 1
1066 1 95 HIS HA 1 96 THR MG 4.480 . 5.150 3.819 3.221 4.300 . 0 0 "[ . 1 . 2]" 1
1067 1 92 MET HG2 1 94 CYS HA 5.100 . 5.870 5.038 4.231 5.678 . 0 0 "[ . 1 . 2]" 1
1068 1 61 SER H 1 96 THR HA 4.460 . 5.130 2.854 2.367 3.123 . 0 0 "[ . 1 . 2]" 1
1069 1 96 THR HA 1 97 PRO HD2 3.830 . 4.400 2.642 2.289 3.028 . 0 0 "[ . 1 . 2]" 1
1070 1 96 THR HA 1 97 PRO HD3 3.830 . 4.400 2.233 1.903 2.686 . 0 0 "[ . 1 . 2]" 1
1071 1 65 GLU HA 1 96 THR MG 3.290 . 3.780 2.130 1.789 2.779 0.011 18 0 "[ . 1 . 2]" 1
1072 1 96 THR MG 1 97 PRO HD2 4.020 . 4.620 2.869 2.294 3.369 . 0 0 "[ . 1 . 2]" 1
1073 1 62 ASN HA 1 96 THR MG 3.970 . 4.570 3.476 2.286 4.222 . 0 0 "[ . 1 . 2]" 1
1074 1 96 THR HA 1 96 THR MG 3.500 . 4.030 2.252 2.149 2.459 . 0 0 "[ . 1 . 2]" 1
1075 1 96 THR MG 1 99 GLU H 4.610 . 5.300 4.534 3.854 5.084 . 0 0 "[ . 1 . 2]" 1
1076 1 96 THR H 1 96 THR MG 3.670 . 4.220 2.952 2.481 3.427 . 0 0 "[ . 1 . 2]" 1
1077 1 96 THR MG 1 97 PRO HD3 4.020 . 4.620 3.351 2.406 4.240 . 0 0 "[ . 1 . 2]" 1
1078 1 64 PHE HB2 1 96 THR MG 4.370 . 5.030 4.025 3.091 4.653 . 0 0 "[ . 1 . 2]" 1
1079 1 64 PHE HB3 1 96 THR MG 4.370 . 5.030 3.016 2.216 4.945 . 0 0 "[ . 1 . 2]" 1
1080 1 65 GLU HB2 1 96 THR MG 3.650 . 4.200 2.722 1.785 3.454 0.015 17 0 "[ . 1 . 2]" 1
1081 1 96 THR MG 1 99 GLU HB2 5.300 . 6.100 4.805 3.528 5.859 . 0 0 "[ . 1 . 2]" 1
1082 1 59 ILE MD 1 96 THR MG 4.610 . 5.300 4.916 4.158 5.305 0.005 9 0 "[ . 1 . 2]" 1
1083 1 40 THR MG 1 97 PRO HB2 4.650 . 5.350 4.528 3.823 5.348 . 0 0 "[ . 1 . 2]" 1
1084 1 97 PRO HB3 1 98 LEU H 4.470 . 5.140 4.147 3.847 4.316 . 0 0 "[ . 1 . 2]" 1
1085 1 60 VAL MG1 1 97 PRO HB3 4.460 . 5.130 3.000 2.590 3.358 . 0 0 "[ . 1 . 2]" 1
1086 1 60 VAL MG2 1 97 PRO HA 4.650 . 5.350 4.184 3.853 4.578 . 0 0 "[ . 1 . 2]" 1
1087 1 97 PRO HA 1 100 TYR HB3 4.310 . 4.960 2.371 1.885 2.999 . 0 0 "[ . 1 . 2]" 1
1088 1 97 PRO HA 1 100 TYR HB2 4.250 . 4.890 3.379 2.681 4.254 . 0 0 "[ . 1 . 2]" 1
1089 1 40 THR MG 1 97 PRO HG2 4.650 . 5.350 4.217 3.156 5.349 . 0 0 "[ . 1 . 2]" 1
1090 1 60 VAL MG1 1 97 PRO HG2 4.810 . 5.530 4.167 3.594 4.618 . 0 0 "[ . 1 . 2]" 1
1091 1 40 THR MG 1 97 PRO HG3 4.650 . 5.350 3.384 2.661 3.935 . 0 0 "[ . 1 . 2]" 1
1092 1 60 VAL MG1 1 97 PRO HG3 4.810 . 5.530 3.153 2.072 4.204 . 0 0 "[ . 1 . 2]" 1
1093 1 62 ASN HA 1 97 PRO HD2 4.590 . 5.280 3.301 2.934 3.572 . 0 0 "[ . 1 . 2]" 1
1094 1 62 ASN HA 1 97 PRO HD3 4.590 . 5.280 3.518 3.046 3.876 . 0 0 "[ . 1 . 2]" 1
1095 1 98 LEU HA 1 101 ASP H 4.120 . 4.740 3.683 3.314 3.968 . 0 0 "[ . 1 . 2]" 1
1096 1 98 LEU HA 1 101 ASP HB2 3.610 . 4.150 3.630 2.722 4.152 0.002 13 0 "[ . 1 . 2]" 1
1097 1 98 LEU HA 1 101 ASP HB3 4.030 . 4.630 3.250 2.776 4.291 . 0 0 "[ . 1 . 2]" 1
1098 1 98 LEU HA 1 98 LEU MD1 3.590 . 4.130 2.226 1.883 2.865 . 0 0 "[ . 1 . 2]" 1
1099 1 98 LEU HA 1 98 LEU MD2 3.590 . 4.130 2.464 1.826 3.179 . 0 0 "[ . 1 . 2]" 1
1100 1 98 LEU H 1 98 LEU HB3 3.550 . 4.080 3.261 2.718 3.608 . 0 0 "[ . 1 . 2]" 1
1101 1 98 LEU HB3 1 99 GLU H 4.050 . 4.660 2.949 2.296 3.738 . 0 0 "[ . 1 . 2]" 1
1102 1 98 LEU MD1 1 101 ASP H 5.500 . 6.330 4.856 4.287 5.203 . 0 0 "[ . 1 . 2]" 1
1103 1 98 LEU MD2 1 101 ASP H 5.500 . 6.330 5.258 4.803 5.685 . 0 0 "[ . 1 . 2]" 1
1104 1 99 GLU H 1 99 GLU HG2 4.570 . 5.260 3.884 2.170 4.636 . 0 0 "[ . 1 . 2]" 1
1105 1 99 GLU H 1 99 GLU HG3 4.570 . 5.260 3.699 2.120 4.496 . 0 0 "[ . 1 . 2]" 1
1106 1 98 LEU MD1 1 101 ASP HB2 5.500 . 6.330 4.557 3.758 5.133 . 0 0 "[ . 1 . 2]" 1
1107 1 98 LEU MD2 1 101 ASP HB2 5.500 . 6.330 4.984 3.602 5.982 . 0 0 "[ . 1 . 2]" 1
1108 1 101 ASP HB3 1 102 LYS HB2 4.680 . 5.380 4.625 4.405 5.014 . 0 0 "[ . 1 . 2]" 1
1109 1 102 LYS HB3 1 103 LEU HA 4.290 . 4.930 4.104 3.909 4.344 . 0 0 "[ . 1 . 2]" 1
1110 1 103 LEU H 1 103 LEU HB3 3.660 . 4.210 3.597 3.578 3.617 . 0 0 "[ . 1 . 2]" 1
1111 1 103 LEU HB3 1 104 LYS H 4.090 . 4.700 3.590 3.390 3.995 . 0 0 "[ . 1 . 2]" 1
1112 1 100 TYR HA 1 103 LEU HB3 4.450 . 5.120 4.253 3.860 4.693 . 0 0 "[ . 1 . 2]" 1
1113 1 102 LYS HB2 1 103 LEU HG 4.090 . 4.700 3.818 3.190 4.363 . 0 0 "[ . 1 . 2]" 1
1114 1 100 TYR HB2 1 103 LEU HG 4.530 . 5.210 4.991 4.711 5.213 0.003 1 0 "[ . 1 . 2]" 1
1115 1 100 TYR HB3 1 103 LEU HG 5.180 . 5.960 5.545 5.287 5.791 . 0 0 "[ . 1 . 2]" 1
1116 1 99 GLU HB3 1 103 LEU HG 4.800 . 5.520 4.285 3.191 5.471 . 0 0 "[ . 1 . 2]" 1
1117 1 100 TYR HA 1 103 LEU HG 3.370 . 3.880 2.647 2.413 2.875 . 0 0 "[ . 1 . 2]" 1
1118 1 103 LEU HA 1 103 LEU HG 3.580 . 4.120 3.202 3.147 3.288 . 0 0 "[ . 1 . 2]" 1
1119 1 100 TYR HD1 1 103 LEU HG 4.110 . 4.730 4.508 4.166 4.734 0.004 19 0 "[ . 1 . 2]" 1
1120 1 100 TYR H 1 103 LEU HG 4.770 . 5.490 4.581 4.158 4.927 . 0 0 "[ . 1 . 2]" 1
1121 1 103 LEU MD1 1 104 LYS H 4.750 . 5.460 4.406 4.220 4.775 . 0 0 "[ . 1 . 2]" 1
1122 1 103 LEU MD2 1 104 LYS H 5.100 . 5.870 4.570 4.511 4.632 . 0 0 "[ . 1 . 2]" 1
1123 1 100 TYR HD1 1 103 LEU MD1 4.170 . 4.800 2.545 2.136 2.932 . 0 0 "[ . 1 . 2]" 1
1124 1 100 TYR HE1 1 103 LEU MD1 4.440 . 5.110 4.089 3.493 4.699 . 0 0 "[ . 1 . 2]" 1
1125 1 103 LEU HA 1 103 LEU MD2 2.740 . 3.150 2.045 1.982 2.108 . 0 0 "[ . 1 . 2]" 1
1126 1 99 GLU HA 1 103 LEU MD2 4.660 . 5.360 5.031 4.495 5.365 0.005 15 0 "[ . 1 . 2]" 1
1127 1 100 TYR HB2 1 103 LEU MD1 4.600 . 5.290 3.687 3.190 4.146 . 0 0 "[ . 1 . 2]" 1
1128 1 103 LEU HB2 1 104 LYS HA 4.150 . 4.770 4.232 4.083 4.371 . 0 0 "[ . 1 . 2]" 1
1129 1 104 LYS HA 1 104 LYS HG3 3.730 . 4.290 3.635 3.461 3.743 . 0 0 "[ . 1 . 2]" 1
1130 1 104 LYS H 1 104 LYS HB3 3.370 . 3.880 2.851 2.504 3.573 . 0 0 "[ . 1 . 2]" 1
1131 1 100 TYR HE2 1 104 LYS HG2 4.490 . 5.160 3.865 2.573 5.067 . 0 0 "[ . 1 . 2]" 1
1132 1 101 ASP HA 1 104 LYS HG2 4.310 . 4.960 2.491 1.970 3.816 . 0 0 "[ . 1 . 2]" 1
1133 1 101 ASP HA 1 104 LYS HG3 4.530 . 5.210 2.568 2.098 3.622 . 0 0 "[ . 1 . 2]" 1
1134 1 104 LYS H 1 104 LYS HD2 5.440 . 6.260 4.394 3.496 4.778 . 0 0 "[ . 1 . 2]" 1
1135 1 104 LYS H 1 104 LYS HD3 5.440 . 6.260 4.306 4.080 4.572 . 0 0 "[ . 1 . 2]" 1
1136 1 100 TYR HE2 1 104 LYS HE3 5.500 . 6.330 5.622 4.540 6.332 0.002 18 0 "[ . 1 . 2]" 1
1137 1 100 TYR HE2 1 104 LYS HE2 5.500 . 6.330 5.590 3.835 6.335 0.005 14 0 "[ . 1 . 2]" 1
1138 1 104 LYS HB2 1 105 SER HA 5.100 . 5.870 4.403 3.674 4.673 . 0 0 "[ . 1 . 2]" 1
1139 1 106 LYS H 1 106 LYS HB2 3.910 . 4.500 3.757 3.518 4.009 . 0 0 "[ . 1 . 2]" 1
1140 1 106 LYS H 1 106 LYS HB3 3.910 . 4.500 3.279 2.611 3.653 . 0 0 "[ . 1 . 2]" 1
1141 1 79 ILE MD 1 80 LEU H 4.440 . 5.110 3.925 3.601 4.217 . 0 0 "[ . 1 . 2]" 1
1142 1 76 VAL H 1 79 ILE MD 4.780 . 5.500 4.701 4.236 4.957 . 0 0 "[ . 1 . 2]" 1
1143 1 33 LEU HA 1 79 ILE MD 4.180 . 4.810 4.402 3.168 4.820 0.010 12 0 "[ . 1 . 2]" 1
1144 1 79 ILE HA 1 79 ILE MD 3.920 . 4.510 3.342 2.835 3.930 . 0 0 "[ . 1 . 2]" 1
1145 1 76 VAL HA 1 79 ILE MD 3.550 . 4.080 3.764 3.159 4.087 0.007 14 0 "[ . 1 . 2]" 1
1146 1 79 ILE HB 1 79 ILE MD 2.960 . 3.400 2.320 2.258 2.366 . 0 0 "[ . 1 . 2]" 1
1147 1 33 LEU H 1 79 ILE MG 4.740 . 5.450 4.154 3.533 4.884 . 0 0 "[ . 1 . 2]" 1
1148 1 32 LYS H 1 79 ILE MG 5.470 . 6.290 5.682 4.859 6.298 0.008 19 0 "[ . 1 . 2]" 1
1149 1 79 ILE H 1 79 ILE MG 3.830 . 4.400 3.775 3.730 3.815 . 0 0 "[ . 1 . 2]" 1
1150 1 79 ILE MG 1 80 LEU H 4.100 . 4.720 3.285 3.066 3.492 . 0 0 "[ . 1 . 2]" 1
1151 1 36 ALA HA 1 79 ILE MG 5.000 . 5.750 5.299 4.678 5.625 . 0 0 "[ . 1 . 2]" 1
1152 1 33 LEU HA 1 79 ILE MG 3.560 . 4.090 2.783 2.019 3.701 . 0 0 "[ . 1 . 2]" 1
1153 1 76 VAL HA 1 79 ILE MG 5.080 . 5.840 4.956 4.566 5.421 . 0 0 "[ . 1 . 2]" 1
1154 1 33 LEU HB3 1 79 ILE MG 3.990 . 4.590 3.451 2.639 4.166 . 0 0 "[ . 1 . 2]" 1
1155 1 36 ALA MB 1 79 ILE MG 2.800 . 3.220 2.835 2.445 3.226 0.006 18 0 "[ . 1 . 2]" 1
1156 1 32 LYS HG2 1 79 ILE MG 5.470 . 6.290 3.821 2.367 5.404 . 0 0 "[ . 1 . 2]" 1
1157 1 32 LYS HG3 1 79 ILE MG 5.470 . 6.290 3.935 2.229 5.576 . 0 0 "[ . 1 . 2]" 1
1158 1 79 ILE MG 1 80 LEU HG 4.290 . 4.930 3.825 3.210 4.485 . 0 0 "[ . 1 . 2]" 1
1159 1 29 ILE MD 1 32 LYS H 5.230 . 6.010 5.323 4.831 5.668 . 0 0 "[ . 1 . 2]" 1
1160 1 25 ILE HA 1 29 ILE MD 4.850 . 5.580 3.695 3.311 4.635 . 0 0 "[ . 1 . 2]" 1
1161 1 29 ILE MD 1 29 ILE MG 3.420 . 3.930 3.191 2.029 3.264 . 0 0 "[ . 1 . 2]" 1
1162 1 25 ILE H 1 25 ILE MD 4.450 . 5.120 4.096 3.989 4.449 . 0 0 "[ . 1 . 2]" 1
1163 1 25 ILE MD 1 29 ILE H 4.550 . 5.230 4.030 3.849 5.234 0.004 9 0 "[ . 1 . 2]" 1
1164 1 25 ILE HA 1 25 ILE MD 3.360 . 3.860 2.173 1.932 3.802 . 0 0 "[ . 1 . 2]" 1
1165 1 25 ILE MD 1 86 ASN HB3 3.970 . 4.570 2.313 1.800 3.414 0.000 5 0 "[ . 1 . 2]" 1
1166 1 25 ILE MD 1 29 ILE MD 3.690 . 4.240 2.373 2.028 2.798 . 0 0 "[ . 1 . 2]" 1
1167 1 29 ILE MG 1 30 GLU HA 4.550 . 5.230 2.972 2.775 3.529 . 0 0 "[ . 1 . 2]" 1
1168 1 29 ILE MG 1 90 PHE HZ 4.560 . 5.240 4.116 3.080 4.814 . 0 0 "[ . 1 . 2]" 1
1169 1 29 ILE MG 1 90 PHE HE1 4.210 . 4.840 3.340 2.444 4.301 . 0 0 "[ . 1 . 2]" 1
1170 1 25 ILE H 1 25 ILE MG 3.630 . 4.170 2.096 1.973 2.270 . 0 0 "[ . 1 . 2]" 1
1171 1 24 CYS HA 1 25 ILE MG 4.640 . 5.340 3.990 3.713 4.220 . 0 0 "[ . 1 . 2]" 1
1172 1 25 ILE HA 1 25 ILE MG 3.450 . 3.970 3.218 3.212 3.223 . 0 0 "[ . 1 . 2]" 1
1173 1 25 ILE MG 1 26 GLN HA 4.280 . 4.920 3.290 3.126 3.410 . 0 0 "[ . 1 . 2]" 1
1174 1 25 ILE MG 1 29 ILE MD 4.250 . 4.890 3.947 3.245 4.895 0.005 19 0 "[ . 1 . 2]" 1
1175 1 90 PHE HD2 1 92 MET ME 3.230 . 3.710 2.356 1.983 2.635 . 0 0 "[ . 1 . 2]" 1
1176 1 90 PHE HE2 1 92 MET ME 3.180 . 3.660 2.359 1.995 2.588 . 0 0 "[ . 1 . 2]" 1
1177 1 92 MET HA 1 92 MET ME 4.760 . 5.470 3.918 3.852 4.060 . 0 0 "[ . 1 . 2]" 1
1178 1 76 VAL MG1 1 92 MET ME 3.600 . 4.140 2.405 2.016 2.805 . 0 0 "[ . 1 . 2]" 1
1179 1 76 VAL MG2 1 92 MET ME 3.600 . 4.140 3.414 2.231 4.143 0.003 11 0 "[ . 1 . 2]" 1
1180 1 100 TYR H 1 100 TYR HD1 5.400 . 6.210 4.704 4.531 4.917 . 0 0 "[ . 1 . 2]" 1
1181 1 100 TYR H 1 100 TYR HD2 5.500 . 6.330 4.736 4.499 4.890 . 0 0 "[ . 1 . 2]" 1
1182 1 100 TYR HA 1 100 TYR HD1 3.290 . 3.780 2.593 2.382 2.831 . 0 0 "[ . 1 . 2]" 1
1183 1 100 TYR HB2 1 100 TYR HD1 3.510 . 4.040 2.624 2.491 2.719 . 0 0 "[ . 1 . 2]" 1
1184 1 100 TYR HB3 1 100 TYR HD2 3.480 . 4.000 2.325 2.299 2.390 . 0 0 "[ . 1 . 2]" 1
1185 1 100 TYR HD1 1 103 LEU HB3 4.830 . 5.550 4.553 3.942 5.080 . 0 0 "[ . 1 . 2]" 1
1186 1 100 TYR HD1 1 103 LEU HB2 4.490 . 5.160 3.454 2.951 3.899 . 0 0 "[ . 1 . 2]" 1
1187 1 18 TYR HA 1 18 TYR QD 3.420 . 3.930 2.847 2.168 3.187 . 0 0 "[ . 1 . 2]" 1
1188 1 15 GLU HA 1 18 TYR QD 4.380 . 5.040 2.876 1.925 4.811 . 0 0 "[ . 1 . 2]" 1
1189 1 17 LEU HB2 1 18 TYR QD 4.440 . 5.110 3.422 2.548 4.281 . 0 0 "[ . 1 . 2]" 1
1190 1 46 ASP HA 1 55 PHE HD1 3.820 . 4.390 3.149 2.262 4.043 . 0 0 "[ . 1 . 2]" 1
1191 1 41 PHE HB3 1 41 PHE HD2 3.690 . 4.240 2.340 2.311 2.410 . 0 0 "[ . 1 . 2]" 1
1192 1 55 PHE HD2 1 87 ILE MD 4.210 . 4.840 3.285 2.093 4.313 . 0 0 "[ . 1 . 2]" 1
1193 1 90 PHE HA 1 90 PHE HD1 3.990 . 4.590 2.748 2.564 2.920 . 0 0 "[ . 1 . 2]" 1
1194 1 90 PHE HD2 1 92 MET HB3 4.730 . 5.440 3.953 3.517 4.318 . 0 0 "[ . 1 . 2]" 1
1195 1 87 ILE MD 1 90 PHE HD1 3.680 . 4.230 2.349 2.062 2.985 . 0 0 "[ . 1 . 2]" 1
1196 1 100 TYR HA 1 100 TYR HE1 5.020 . 5.770 4.763 4.619 4.916 . 0 0 "[ . 1 . 2]" 1
1197 1 100 TYR HB2 1 100 TYR HE1 4.840 . 5.570 4.784 4.713 4.831 . 0 0 "[ . 1 . 2]" 1
1198 1 100 TYR HB3 1 100 TYR HE2 4.840 . 5.570 4.627 4.610 4.665 . 0 0 "[ . 1 . 2]" 1
1199 1 41 PHE HB3 1 100 TYR HE2 5.500 . 6.330 5.058 4.380 5.623 . 0 0 "[ . 1 . 2]" 1
1200 1 100 TYR HE1 1 103 LEU HB3 5.170 . 5.950 5.080 4.574 5.775 . 0 0 "[ . 1 . 2]" 1
1201 1 100 TYR HE2 1 104 LYS HD2 4.840 . 5.570 3.712 2.615 5.579 0.009 19 0 "[ . 1 . 2]" 1
1202 1 100 TYR HE2 1 104 LYS HD3 4.840 . 5.570 3.780 2.447 4.701 . 0 0 "[ . 1 . 2]" 1
1203 1 60 VAL MG2 1 100 TYR HE1 4.910 . 5.650 4.317 3.404 5.253 . 0 0 "[ . 1 . 2]" 1
1204 1 60 VAL MG2 1 100 TYR HE2 5.400 . 6.210 5.176 3.559 6.210 . 0 0 "[ . 1 . 2]" 1
1205 1 17 LEU H 1 18 TYR QE 5.250 . 6.040 4.803 4.009 5.660 . 0 0 "[ . 1 . 2]" 1
1206 1 18 TYR HA 1 18 TYR QE 5.500 . 6.330 4.626 4.263 4.790 . 0 0 "[ . 1 . 2]" 1
1207 1 17 LEU HB2 1 18 TYR QE 4.500 . 5.180 3.726 2.910 4.786 . 0 0 "[ . 1 . 2]" 1
1208 1 55 PHE HB3 1 90 PHE HE1 5.150 . 5.920 3.603 2.912 4.479 . 0 0 "[ . 1 . 2]" 1
1209 1 90 PHE HE2 1 92 MET HB3 4.050 . 4.660 2.544 2.090 2.934 . 0 0 "[ . 1 . 2]" 1
1210 1 33 LEU MD2 1 90 PHE HE1 3.990 . 4.590 3.534 3.039 4.415 . 0 0 "[ . 1 . 2]" 1
1211 1 33 LEU MD2 1 90 PHE HE2 4.590 . 5.280 3.477 3.087 3.981 . 0 0 "[ . 1 . 2]" 1
1212 1 80 LEU MD2 1 90 PHE HE2 3.580 . 4.120 2.319 2.058 2.524 . 0 0 "[ . 1 . 2]" 1
1213 1 80 LEU HG 1 90 PHE HE2 4.420 . 5.080 4.584 3.974 5.079 . 0 0 "[ . 1 . 2]" 1
1214 1 57 ALA MB 1 90 PHE HZ 3.650 . 4.200 2.171 1.953 2.478 . 0 0 "[ . 1 . 2]" 1
1215 1 33 LEU MD2 1 90 PHE HZ 3.640 . 4.190 2.611 2.131 3.200 . 0 0 "[ . 1 . 2]" 1
1216 1 80 LEU MD2 1 90 PHE HZ 3.800 . 4.370 3.786 3.243 4.257 . 0 0 "[ . 1 . 2]" 1
1217 1 73 HIS H 1 73 HIS HD2 4.990 . 5.740 5.112 4.995 5.195 . 0 0 "[ . 1 . 2]" 1
1218 1 70 LEU HA 1 73 HIS HD2 4.620 . 5.310 4.637 3.826 5.289 . 0 0 "[ . 1 . 2]" 1
1219 1 88 HIS HA 1 88 HIS HD2 4.690 . 5.390 4.172 3.058 4.684 . 0 0 "[ . 1 . 2]" 1
1220 1 87 ILE MG 1 88 HIS HD2 5.500 . 6.330 5.433 3.339 5.818 . 0 0 "[ . 1 . 2]" 1
1221 1 41 PHE HD2 1 60 VAL MG1 4.430 . 5.090 4.011 3.603 4.362 . 0 0 "[ . 1 . 2]" 1
1222 1 12 SER H 1 12 SER QB 3.580 . 4.120 2.655 2.239 3.395 . 0 0 "[ . 1 . 2]" 1
1223 1 13 GLY H 1 14 ARG QB 4.700 . 5.400 4.326 3.547 5.012 . 0 0 "[ . 1 . 2]" 1
1224 1 13 GLY H 1 14 ARG QG 4.710 . 5.420 3.561 2.390 5.028 . 0 0 "[ . 1 . 2]" 1
1225 1 13 GLY QA 1 15 GLU H 4.550 . 5.230 3.844 3.373 4.264 . 0 0 "[ . 1 . 2]" 1
1226 1 14 ARG H 1 14 ARG QB 3.080 . 3.540 2.719 2.411 3.171 . 0 0 "[ . 1 . 2]" 1
1227 1 14 ARG H 1 14 ARG QG 3.030 . 3.480 2.380 1.905 3.330 . 0 0 "[ . 1 . 2]" 1
1228 1 14 ARG H 1 15 GLU QG 4.660 . 5.360 3.673 2.911 4.153 . 0 0 "[ . 1 . 2]" 1
1229 1 14 ARG HA 1 14 ARG QD 4.730 . 5.440 3.960 2.040 4.550 . 0 0 "[ . 1 . 2]" 1
1230 1 14 ARG QB 1 14 ARG QG 2.300 . 2.640 2.062 1.992 2.088 . 0 0 "[ . 1 . 2]" 1
1231 1 14 ARG QB 1 14 ARG QD 3.190 . 3.670 2.366 2.127 2.788 . 0 0 "[ . 1 . 2]" 1
1232 1 14 ARG QB 1 15 GLU H 3.430 . 3.940 3.148 2.278 3.794 . 0 0 "[ . 1 . 2]" 1
1233 1 14 ARG QG 1 15 GLU H 3.430 . 3.940 2.999 2.015 3.945 0.005 18 0 "[ . 1 . 2]" 1
1234 1 15 GLU H 1 15 GLU QG 2.710 . 3.120 2.249 1.797 3.006 0.003 18 0 "[ . 1 . 2]" 1
1235 1 15 GLU HA 1 15 GLU QG 3.490 . 4.010 3.409 3.307 3.542 . 0 0 "[ . 1 . 2]" 1
1236 1 15 GLU HA 1 17 LEU QD 3.720 . 4.280 3.750 2.903 4.281 0.001 10 0 "[ . 1 . 2]" 1
1237 1 15 GLU QB 1 17 LEU QD 4.850 . 5.580 4.903 4.127 5.415 . 0 0 "[ . 1 . 2]" 1
1238 1 15 GLU QB 1 18 TYR QD 4.390 . 5.050 3.101 2.215 4.587 . 0 0 "[ . 1 . 2]" 1
1239 1 15 GLU QG 1 16 ASN H 3.670 . 4.220 3.465 2.724 4.223 0.003 4 0 "[ . 1 . 2]" 1
1240 1 15 GLU QG 1 16 ASN HD21 5.290 . 6.080 5.195 4.542 6.090 0.010 17 0 "[ . 1 . 2]" 1
1241 1 15 GLU QG 1 17 LEU H 5.000 . 5.750 4.851 4.677 5.303 . 0 0 "[ . 1 . 2]" 1
1242 1 15 GLU QG 1 17 LEU QD 5.280 . 6.070 5.447 4.815 6.078 0.008 10 0 "[ . 1 . 2]" 1
1243 1 15 GLU QG 1 18 TYR H 4.920 . 5.660 4.986 4.268 5.581 . 0 0 "[ . 1 . 2]" 1
1244 1 16 ASN H 1 17 LEU QD 4.170 . 4.800 3.357 2.538 4.310 . 0 0 "[ . 1 . 2]" 1
1245 1 16 ASN QB 1 16 ASN HD21 2.880 . 3.310 2.388 2.164 2.822 . 0 0 "[ . 1 . 2]" 1
1246 1 16 ASN QB 1 16 ASN HD22 3.330 . 3.830 3.351 3.276 3.496 . 0 0 "[ . 1 . 2]" 1
1247 1 16 ASN QB 1 17 LEU H 3.840 . 4.420 3.812 3.630 3.959 . 0 0 "[ . 1 . 2]" 1
1248 1 16 ASN HD21 1 17 LEU QD 4.720 . 5.430 3.081 1.798 4.797 0.002 20 0 "[ . 1 . 2]" 1
1249 1 17 LEU H 1 17 LEU QD 3.180 . 3.660 2.343 1.801 3.100 . 0 0 "[ . 1 . 2]" 1
1250 1 17 LEU HA 1 17 LEU QD 3.570 . 4.110 2.413 1.841 3.025 . 0 0 "[ . 1 . 2]" 1
1251 1 17 LEU QD 1 18 TYR H 3.920 . 4.510 3.982 3.658 4.304 . 0 0 "[ . 1 . 2]" 1
1252 1 18 TYR H 1 18 TYR QB 2.780 . 3.200 2.490 2.312 2.693 . 0 0 "[ . 1 . 2]" 1
1253 1 18 TYR QB 1 18 TYR QD 2.980 . 3.430 2.138 2.133 2.164 . 0 0 "[ . 1 . 2]" 1
1254 1 18 TYR QB 1 19 PHE H 3.220 . 3.700 3.035 1.874 3.716 0.016 17 0 "[ . 1 . 2]" 1
1255 1 18 TYR QB 1 20 GLN HE21 4.600 . 5.290 2.974 1.830 4.312 . 0 0 "[ . 1 . 2]" 1
1256 1 19 PHE H 1 19 PHE QB 3.380 . 3.890 2.680 2.417 2.903 . 0 0 "[ . 1 . 2]" 1
1257 1 19 PHE QB 1 20 GLN H 4.000 . 4.600 3.801 2.748 4.036 . 0 0 "[ . 1 . 2]" 1
1258 1 19 PHE QB 1 20 GLN HE21 5.340 . 6.140 5.634 4.595 6.154 0.014 1 0 "[ . 1 . 2]" 1
1259 1 20 GLN H 1 20 GLN QB 3.460 . 3.980 2.833 2.271 3.392 . 0 0 "[ . 1 . 2]" 1
1260 1 20 GLN H 1 20 GLN QG 3.790 . 4.360 2.905 1.796 3.792 0.004 11 0 "[ . 1 . 2]" 1
1261 1 20 GLN HA 1 20 GLN QG 3.530 . 4.060 2.854 2.310 3.513 . 0 0 "[ . 1 . 2]" 1
1262 1 20 GLN QB 1 20 GLN HE21 3.600 . 4.140 3.209 1.789 3.632 0.011 1 0 "[ . 1 . 2]" 1
1263 1 20 GLN QB 1 20 GLN HE22 4.050 . 4.660 3.967 3.179 4.229 . 0 0 "[ . 1 . 2]" 1
1264 1 20 GLN QB 1 21 GLY H 4.040 . 4.650 3.470 1.954 3.983 . 0 0 "[ . 1 . 2]" 1
1265 1 20 GLN HE21 1 20 GLN QG 2.790 . 3.210 2.284 2.172 2.752 . 0 0 "[ . 1 . 2]" 1
1266 1 20 GLN HE22 1 20 GLN QG 3.450 . 3.970 3.316 3.276 3.469 . 0 0 "[ . 1 . 2]" 1
1267 1 20 GLN QG 1 21 GLY H 4.780 . 5.500 4.335 3.303 4.977 . 0 0 "[ . 1 . 2]" 1
1268 1 24 CYS H 1 24 CYS QB 3.380 . 3.890 2.548 2.239 2.939 . 0 0 "[ . 1 . 2]" 1
1269 1 24 CYS QB 1 25 ILE H 3.960 . 4.550 3.240 2.288 3.822 . 0 0 "[ . 1 . 2]" 1
1270 1 24 CYS QB 1 25 ILE MG 4.750 . 5.460 4.006 3.144 4.758 . 0 0 "[ . 1 . 2]" 1
1271 1 24 CYS QB 1 26 GLN H 4.860 . 5.590 3.236 2.643 3.854 . 0 0 "[ . 1 . 2]" 1
1272 1 24 CYS QB 1 26 GLN QB 4.420 . 5.080 3.256 2.738 4.007 . 0 0 "[ . 1 . 2]" 1
1273 1 24 CYS QB 1 27 LYS H 4.580 . 5.270 2.678 2.312 2.979 . 0 0 "[ . 1 . 2]" 1
1274 1 25 ILE HA 1 25 ILE QG 3.700 . 4.260 2.840 2.353 2.954 . 0 0 "[ . 1 . 2]" 1
1275 1 25 ILE QG 1 29 ILE H 4.320 . 4.970 4.179 3.733 4.525 . 0 0 "[ . 1 . 2]" 1
1276 1 25 ILE QG 1 29 ILE MD 3.940 . 4.530 2.323 1.889 3.253 . 0 0 "[ . 1 . 2]" 1
1277 1 26 GLN H 1 26 GLN QB 3.450 . 3.970 2.241 2.215 2.300 . 0 0 "[ . 1 . 2]" 1
1278 1 26 GLN H 1 26 GLN QG 4.740 . 5.450 3.977 3.950 4.051 . 0 0 "[ . 1 . 2]" 1
1279 1 26 GLN HA 1 26 GLN QG 3.440 . 3.960 2.544 2.415 3.049 . 0 0 "[ . 1 . 2]" 1
1280 1 26 GLN HA 1 44 LEU QD 5.440 . 6.260 4.691 3.184 6.016 . 0 0 "[ . 1 . 2]" 1
1281 1 26 GLN QB 1 27 LYS H 3.280 . 3.770 2.532 2.311 2.701 . 0 0 "[ . 1 . 2]" 1
1282 1 26 GLN QG 1 29 ILE MG 5.340 . 6.140 4.567 3.848 5.158 . 0 0 "[ . 1 . 2]" 1
1283 1 26 GLN QG 1 44 LEU QD 5.280 . 6.070 3.044 1.937 4.160 . 0 0 "[ . 1 . 2]" 1
1284 1 26 GLN QE 1 30 GLU QG 5.180 . 5.960 4.326 2.471 5.962 0.002 20 0 "[ . 1 . 2]" 1
1285 1 26 GLN QE 1 44 LEU H 5.340 . 6.140 4.745 3.152 6.046 . 0 0 "[ . 1 . 2]" 1
1286 1 26 GLN QE 1 44 LEU HB2 4.200 . 4.830 2.936 1.798 3.975 0.002 3 0 "[ . 1 . 2]" 1
1287 1 26 GLN QE 1 44 LEU HB3 4.560 . 5.240 2.964 1.930 3.780 . 0 0 "[ . 1 . 2]" 1
1288 1 26 GLN QE 1 44 LEU QD 4.040 . 4.650 2.763 1.818 3.741 . 0 0 "[ . 1 . 2]" 1
1289 1 26 GLN QE 1 45 VAL H 5.340 . 6.140 5.770 4.789 6.149 0.009 9 0 "[ . 1 . 2]" 1
1290 1 27 LYS H 1 28 VAL QG 4.190 . 4.820 3.850 3.687 4.008 . 0 0 "[ . 1 . 2]" 1
1291 1 28 VAL H 1 28 VAL QG 3.060 . 3.520 2.040 1.935 2.175 . 0 0 "[ . 1 . 2]" 1
1292 1 28 VAL HA 1 28 VAL QG 2.930 . 3.370 2.145 2.127 2.355 . 0 0 "[ . 1 . 2]" 1
1293 1 28 VAL HA 1 31 ASP QB 3.800 . 4.370 3.234 2.803 3.891 . 0 0 "[ . 1 . 2]" 1
1294 1 28 VAL QG 1 29 ILE H 3.630 . 4.170 3.009 1.964 3.169 . 0 0 "[ . 1 . 2]" 1
1295 1 28 VAL QG 1 31 ASP QB 5.280 . 6.070 4.047 3.590 4.577 . 0 0 "[ . 1 . 2]" 1
1296 1 29 ILE HA 1 32 LYS QB 4.500 . 5.180 2.791 2.173 3.348 . 0 0 "[ . 1 . 2]" 1
1297 1 29 ILE MG 1 30 GLU QG 4.460 . 5.130 4.174 3.068 4.874 . 0 0 "[ . 1 . 2]" 1
1298 1 30 GLU H 1 30 GLU QB 3.360 . 3.860 2.283 2.103 2.557 . 0 0 "[ . 1 . 2]" 1
1299 1 30 GLU H 1 30 GLU QG 3.840 . 4.420 3.357 1.970 4.011 . 0 0 "[ . 1 . 2]" 1
1300 1 30 GLU H 1 44 LEU QD 5.440 . 6.260 4.224 2.841 5.065 . 0 0 "[ . 1 . 2]" 1
1301 1 30 GLU HA 1 30 GLU QG 3.430 . 3.940 2.442 2.195 2.675 . 0 0 "[ . 1 . 2]" 1
1302 1 30 GLU HA 1 44 LEU QD 3.960 . 4.550 3.303 2.268 4.317 . 0 0 "[ . 1 . 2]" 1
1303 1 30 GLU QB 1 31 ASP H 3.650 . 4.200 2.404 2.309 2.640 . 0 0 "[ . 1 . 2]" 1
1304 1 30 GLU QB 1 44 LEU QD 4.030 . 4.630 3.006 2.112 4.136 . 0 0 "[ . 1 . 2]" 1
1305 1 30 GLU QG 1 31 ASP H 4.420 . 5.080 3.915 3.435 4.446 . 0 0 "[ . 1 . 2]" 1
1306 1 30 GLU QG 1 33 LEU MD2 4.340 . 4.990 4.340 3.693 4.994 0.004 12 0 "[ . 1 . 2]" 1
1307 1 30 GLU QG 1 44 LEU HB2 5.280 . 6.070 4.673 2.544 5.706 . 0 0 "[ . 1 . 2]" 1
1308 1 30 GLU QG 1 44 LEU HB3 5.260 . 6.050 5.292 3.790 6.055 0.005 6 0 "[ . 1 . 2]" 1
1309 1 30 GLU QG 1 44 LEU QD 2.930 . 3.370 2.111 1.796 2.757 0.004 15 0 "[ . 1 . 2]" 1
1310 1 31 ASP HA 1 34 SER QB 3.750 . 4.310 2.514 1.787 3.807 0.013 17 0 "[ . 1 . 2]" 1
1311 1 31 ASP QB 1 32 LYS H 3.390 . 3.900 2.772 2.478 3.185 . 0 0 "[ . 1 . 2]" 1
1312 1 31 ASP QB 1 35 SER H 5.340 . 6.140 5.054 4.080 5.349 . 0 0 "[ . 1 . 2]" 1
1313 1 32 LYS H 1 32 LYS QB 3.220 . 3.700 2.277 2.037 2.508 . 0 0 "[ . 1 . 2]" 1
1314 1 32 LYS H 1 32 LYS QG 4.390 . 5.050 3.339 2.220 4.046 . 0 0 "[ . 1 . 2]" 1
1315 1 32 LYS HA 1 32 LYS QG 3.650 . 4.200 2.581 2.227 3.063 . 0 0 "[ . 1 . 2]" 1
1316 1 32 LYS QB 1 33 LEU H 3.920 . 4.510 2.390 2.254 2.666 . 0 0 "[ . 1 . 2]" 1
1317 1 32 LYS QB 1 34 SER H 5.270 . 6.060 4.430 4.259 4.611 . 0 0 "[ . 1 . 2]" 1
1318 1 32 LYS QB 1 79 ILE MG 4.190 . 4.820 3.410 1.985 4.585 . 0 0 "[ . 1 . 2]" 1
1319 1 32 LYS QG 1 79 ILE MG 4.680 . 5.380 3.306 2.197 4.792 . 0 0 "[ . 1 . 2]" 1
1320 1 33 LEU MD1 1 34 SER QB 4.760 . 5.470 2.982 2.632 3.540 . 0 0 "[ . 1 . 2]" 1
1321 1 34 SER HA 1 34 SER QB 2.620 . 3.010 2.368 2.182 2.447 . 0 0 "[ . 1 . 2]" 1
1322 1 34 SER QB 1 42 LEU QD 4.600 . 5.290 3.364 2.209 4.586 . 0 0 "[ . 1 . 2]" 1
1323 1 36 ALA H 1 37 LEU QD 4.760 . 5.470 4.663 3.509 4.943 . 0 0 "[ . 1 . 2]" 1
1324 1 36 ALA MB 1 37 LEU QD 2.970 . 3.420 3.019 1.843 3.393 . 0 0 "[ . 1 . 2]" 1
1325 1 37 LEU H 1 37 LEU QD 3.820 . 4.390 3.082 2.214 3.296 . 0 0 "[ . 1 . 2]" 1
1326 1 37 LEU HA 1 37 LEU QD 3.780 . 4.350 2.109 1.978 2.870 . 0 0 "[ . 1 . 2]" 1
1327 1 37 LEU QD 1 38 LYS H 4.310 . 4.960 4.122 3.809 4.238 . 0 0 "[ . 1 . 2]" 1
1328 1 37 LEU QD 1 63 ASN H 5.440 . 6.260 5.572 5.061 5.946 . 0 0 "[ . 1 . 2]" 1
1329 1 37 LEU QD 1 63 ASN HA 5.440 . 6.260 5.672 4.975 6.106 . 0 0 "[ . 1 . 2]" 1
1330 1 37 LEU QD 1 63 ASN QB 3.320 . 3.820 3.531 3.002 3.824 0.004 7 0 "[ . 1 . 2]" 1
1331 1 37 LEU QD 1 63 ASN QD 3.190 . 3.670 2.490 1.917 3.332 . 0 0 "[ . 1 . 2]" 1
1332 1 37 LEU QD 1 64 PHE H 5.440 . 6.260 5.720 4.813 6.256 . 0 0 "[ . 1 . 2]" 1
1333 1 37 LEU QD 1 76 VAL H 5.440 . 6.260 3.769 3.302 4.324 . 0 0 "[ . 1 . 2]" 1
1334 1 37 LEU QD 1 76 VAL HA 4.470 . 5.140 3.255 2.601 3.838 . 0 0 "[ . 1 . 2]" 1
1335 1 37 LEU QD 1 79 ILE MD 3.640 . 4.190 3.267 2.374 4.159 . 0 0 "[ . 1 . 2]" 1
1336 1 38 LYS H 1 38 LYS QB 3.260 . 3.750 3.115 2.888 3.420 . 0 0 "[ . 1 . 2]" 1
1337 1 39 PRO QB 1 40 THR H 3.740 . 4.300 3.024 2.466 3.381 . 0 0 "[ . 1 . 2]" 1
1338 1 39 PRO QB 1 60 VAL H 4.070 . 4.680 2.839 2.551 3.100 . 0 0 "[ . 1 . 2]" 1
1339 1 40 THR MG 1 97 PRO QG 4.040 . 4.650 3.218 2.633 3.840 . 0 0 "[ . 1 . 2]" 1
1340 1 41 PHE H 1 42 LEU QB 5.040 . 5.800 4.423 4.229 4.632 . 0 0 "[ . 1 . 2]" 1
1341 1 41 PHE H 1 42 LEU QD 5.140 . 5.910 4.962 4.427 5.339 . 0 0 "[ . 1 . 2]" 1
1342 1 41 PHE HA 1 42 LEU QB 4.680 . 5.380 3.973 3.904 4.018 . 0 0 "[ . 1 . 2]" 1
1343 1 41 PHE HE2 1 43 GLU QG 4.280 . 4.920 4.287 3.466 4.921 0.001 16 0 "[ . 1 . 2]" 1
1344 1 41 PHE HE2 1 58 VAL QG 4.000 . 4.600 3.212 2.585 3.913 . 0 0 "[ . 1 . 2]" 1
1345 1 42 LEU H 1 42 LEU QB 3.410 . 3.920 2.639 2.579 2.672 . 0 0 "[ . 1 . 2]" 1
1346 1 42 LEU H 1 42 LEU QD 4.510 . 5.190 3.894 3.747 4.014 . 0 0 "[ . 1 . 2]" 1
1347 1 42 LEU HA 1 42 LEU QD 3.830 . 4.400 1.997 1.855 2.341 . 0 0 "[ . 1 . 2]" 1
1348 1 42 LEU QB 1 43 GLU H 3.850 . 4.430 3.825 3.727 3.897 . 0 0 "[ . 1 . 2]" 1
1349 1 42 LEU QB 1 60 VAL H 4.710 . 5.420 4.297 4.041 4.619 . 0 0 "[ . 1 . 2]" 1
1350 1 42 LEU QD 1 43 GLU H 3.950 . 4.540 2.467 2.186 2.796 . 0 0 "[ . 1 . 2]" 1
1351 1 43 GLU H 1 43 GLU QG 4.460 . 5.130 4.076 3.943 4.232 . 0 0 "[ . 1 . 2]" 1
1352 1 43 GLU H 1 44 LEU QD 4.470 . 5.140 3.807 3.455 4.794 . 0 0 "[ . 1 . 2]" 1
1353 1 43 GLU HA 1 43 GLU QG 3.280 . 3.770 2.537 2.383 2.972 . 0 0 "[ . 1 . 2]" 1
1354 1 43 GLU HB2 1 45 VAL QG 5.440 . 6.260 4.635 4.357 4.981 . 0 0 "[ . 1 . 2]" 1
1355 1 43 GLU HB3 1 45 VAL QG 4.770 . 5.490 3.608 3.039 4.049 . 0 0 "[ . 1 . 2]" 1
1356 1 43 GLU HB3 1 58 VAL QG 4.280 . 4.920 2.946 2.389 3.414 . 0 0 "[ . 1 . 2]" 1
1357 1 43 GLU QG 1 44 LEU H 3.320 . 3.820 2.857 2.374 3.670 . 0 0 "[ . 1 . 2]" 1
1358 1 43 GLU QG 1 45 VAL QG 3.440 . 3.960 2.456 2.039 3.857 . 0 0 "[ . 1 . 2]" 1
1359 1 43 GLU QG 1 58 VAL QG 4.220 . 4.850 3.619 3.063 4.078 . 0 0 "[ . 1 . 2]" 1
1360 1 44 LEU H 1 44 LEU QD 4.130 . 4.750 2.446 1.931 3.519 . 0 0 "[ . 1 . 2]" 1
1361 1 44 LEU H 1 45 VAL QG 4.310 . 4.960 4.205 3.759 4.534 . 0 0 "[ . 1 . 2]" 1
1362 1 44 LEU HA 1 44 LEU QD 3.340 . 3.840 2.162 1.858 2.998 . 0 0 "[ . 1 . 2]" 1
1363 1 44 LEU HA 1 45 VAL QG 4.040 . 4.650 3.525 3.328 3.661 . 0 0 "[ . 1 . 2]" 1
1364 1 44 LEU QD 1 45 VAL H 3.770 . 4.340 3.596 2.349 4.342 0.002 1 0 "[ . 1 . 2]" 1
1365 1 44 LEU QD 1 55 PHE HB2 3.870 . 4.450 3.880 3.029 4.453 0.003 14 0 "[ . 1 . 2]" 1
1366 1 44 LEU QD 1 55 PHE HB3 4.140 . 4.760 2.992 1.811 3.618 . 0 0 "[ . 1 . 2]" 1
1367 1 44 LEU QD 1 57 ALA H 4.920 . 5.660 4.447 3.911 5.444 . 0 0 "[ . 1 . 2]" 1
1368 1 44 LEU QD 1 57 ALA HA 3.690 . 4.240 2.831 2.013 4.033 . 0 0 "[ . 1 . 2]" 1
1369 1 44 LEU QD 1 58 VAL H 4.390 . 5.050 3.928 3.511 4.625 . 0 0 "[ . 1 . 2]" 1
1370 1 45 VAL H 1 45 VAL QG 3.290 . 3.780 2.433 1.895 2.688 . 0 0 "[ . 1 . 2]" 1
1371 1 45 VAL HA 1 45 VAL QG 3.000 . 3.450 2.148 2.132 2.226 . 0 0 "[ . 1 . 2]" 1
1372 1 45 VAL QG 1 46 ASP H 3.270 . 3.760 2.706 2.255 3.283 . 0 0 "[ . 1 . 2]" 1
1373 1 45 VAL QG 1 46 ASP QB 4.790 . 5.510 3.809 3.365 4.407 . 0 0 "[ . 1 . 2]" 1
1374 1 45 VAL QG 1 47 LYS H 4.880 . 5.610 4.224 3.689 4.703 . 0 0 "[ . 1 . 2]" 1
1375 1 45 VAL QG 1 56 ASP H 4.980 . 5.730 3.931 2.816 4.325 . 0 0 "[ . 1 . 2]" 1
1376 1 45 VAL QG 1 56 ASP HB2 4.850 . 5.580 4.149 2.794 4.686 . 0 0 "[ . 1 . 2]" 1
1377 1 45 VAL QG 1 56 ASP HB3 3.980 . 4.580 3.162 1.793 3.708 0.007 5 0 "[ . 1 . 2]" 1
1378 1 45 VAL QG 1 57 ALA HA 4.620 . 5.310 3.921 3.356 4.503 . 0 0 "[ . 1 . 2]" 1
1379 1 46 ASP H 1 46 ASP QB 3.360 . 3.860 2.253 2.162 2.325 . 0 0 "[ . 1 . 2]" 1
1380 1 54 SER QB 1 55 PHE H 4.130 . 4.750 3.045 2.640 3.858 . 0 0 "[ . 1 . 2]" 1
1381 1 54 SER QB 1 89 ALA MB 3.650 . 4.200 2.350 1.801 2.969 . 0 0 "[ . 1 . 2]" 1
1382 1 55 PHE H 1 90 PHE QB 5.320 . 6.120 4.189 3.719 4.769 . 0 0 "[ . 1 . 2]" 1
1383 1 56 ASP HA 1 91 SER QB 3.650 . 4.200 2.730 2.126 3.969 . 0 0 "[ . 1 . 2]" 1
1384 1 57 ALA HA 1 58 VAL QG 4.170 . 4.800 3.631 3.556 3.691 . 0 0 "[ . 1 . 2]" 1
1385 1 58 VAL H 1 58 VAL QG 3.460 . 3.980 2.198 2.075 2.321 . 0 0 "[ . 1 . 2]" 1
1386 1 58 VAL HA 1 58 VAL QG 3.100 . 3.570 2.139 2.132 2.143 . 0 0 "[ . 1 . 2]" 1
1387 1 58 VAL HA 1 93 LYS QB 3.900 . 4.490 2.196 1.828 2.930 . 0 0 "[ . 1 . 2]" 1
1388 1 58 VAL QG 1 59 ILE H 3.870 . 4.450 2.941 2.799 2.986 . 0 0 "[ . 1 . 2]" 1
1389 1 58 VAL QG 1 93 LYS H 3.760 . 4.320 3.761 3.469 4.053 . 0 0 "[ . 1 . 2]" 1
1390 1 58 VAL QG 1 93 LYS QB 3.710 . 4.270 2.281 1.929 2.786 . 0 0 "[ . 1 . 2]" 1
1391 1 59 ILE H 1 93 LYS QB 4.830 . 5.550 3.407 2.946 4.033 . 0 0 "[ . 1 . 2]" 1
1392 1 59 ILE MD 1 63 ASN QB 4.470 . 5.140 3.785 2.795 4.746 . 0 0 "[ . 1 . 2]" 1
1393 1 59 ILE MD 1 63 ASN QD 4.160 . 4.780 4.169 2.509 4.784 0.004 9 0 "[ . 1 . 2]" 1
1394 1 60 VAL HA 1 95 HIS QB 4.750 . 5.460 3.186 2.739 3.712 . 0 0 "[ . 1 . 2]" 1
1395 1 60 VAL MG1 1 95 HIS QB 3.790 . 4.360 3.324 2.913 3.891 . 0 0 "[ . 1 . 2]" 1
1396 1 60 VAL MG1 1 97 PRO QG 4.070 . 4.680 3.021 2.059 3.898 . 0 0 "[ . 1 . 2]" 1
1397 1 60 VAL MG1 1 97 PRO QD 4.240 . 4.880 2.749 2.512 3.120 . 0 0 "[ . 1 . 2]" 1
1398 1 60 VAL MG2 1 95 HIS QB 3.230 . 3.710 2.217 1.796 2.835 0.004 17 0 "[ . 1 . 2]" 1
1399 1 61 SER H 1 95 HIS QB 5.340 . 6.140 4.704 4.457 4.992 . 0 0 "[ . 1 . 2]" 1
1400 1 61 SER H 1 97 PRO QD 4.620 . 5.310 3.030 2.780 3.343 . 0 0 "[ . 1 . 2]" 1
1401 1 61 SER QB 1 63 ASN H 4.540 . 5.220 2.900 2.284 3.229 . 0 0 "[ . 1 . 2]" 1
1402 1 62 ASN HA 1 97 PRO QD 4.040 . 4.650 3.018 2.660 3.270 . 0 0 "[ . 1 . 2]" 1
1403 1 62 ASN HD21 1 97 PRO QD 3.960 . 4.550 3.114 2.738 4.009 . 0 0 "[ . 1 . 2]" 1
1404 1 62 ASN HD22 1 97 PRO QD 3.970 . 4.570 3.585 3.141 4.432 . 0 0 "[ . 1 . 2]" 1
1405 1 62 ASN HD22 1 98 LEU QD 5.070 . 5.830 4.526 2.164 5.836 0.006 7 0 "[ . 1 . 2]" 1
1406 1 63 ASN H 1 63 ASN QD 5.110 . 5.880 4.429 3.572 4.585 . 0 0 "[ . 1 . 2]" 1
1407 1 63 ASN HA 1 63 ASN QD 3.980 . 4.580 3.809 2.877 4.306 . 0 0 "[ . 1 . 2]" 1
1408 1 63 ASN QD 1 64 PHE H 4.620 . 5.310 4.276 3.531 4.934 . 0 0 "[ . 1 . 2]" 1
1409 1 63 ASN QD 1 64 PHE QB 4.500 . 5.180 4.179 3.128 5.189 0.009 9 0 "[ . 1 . 2]" 1
1410 1 63 ASN QD 1 72 ARG HA 4.160 . 4.780 3.692 2.505 4.789 0.009 7 0 "[ . 1 . 2]" 1
1411 1 63 ASN QD 1 75 LEU HB2 5.310 . 6.110 4.082 2.820 5.199 . 0 0 "[ . 1 . 2]" 1
1412 1 63 ASN QD 1 75 LEU HG 5.340 . 6.140 4.374 2.501 6.104 . 0 0 "[ . 1 . 2]" 1
1413 1 63 ASN QD 1 75 LEU QD 5.270 . 6.060 2.886 1.802 4.436 . 0 0 "[ . 1 . 2]" 1
1414 1 64 PHE H 1 64 PHE QB 3.350 . 3.850 2.395 2.292 2.535 . 0 0 "[ . 1 . 2]" 1
1415 1 64 PHE HA 1 66 ASP QB 4.820 . 5.540 4.429 3.741 5.152 . 0 0 "[ . 1 . 2]" 1
1416 1 64 PHE QB 1 96 THR MG 3.700 . 4.260 2.804 2.199 3.938 . 0 0 "[ . 1 . 2]" 1
1417 1 65 GLU HG2 1 97 PRO QD 5.350 . 6.150 4.580 3.826 5.421 . 0 0 "[ . 1 . 2]" 1
1418 1 65 GLU HG3 1 66 ASP QB 4.080 . 4.690 4.030 3.096 4.466 . 0 0 "[ . 1 . 2]" 1
1419 1 66 ASP QB 1 67 LYS H 4.070 . 4.680 3.228 2.384 3.734 . 0 0 "[ . 1 . 2]" 1
1420 1 68 LYS H 1 68 LYS QB 3.180 . 3.660 2.431 2.199 2.607 . 0 0 "[ . 1 . 2]" 1
1421 1 68 LYS H 1 68 LYS QG 2.990 . 3.440 2.401 2.079 2.873 . 0 0 "[ . 1 . 2]" 1
1422 1 68 LYS H 1 68 LYS QD 3.810 . 4.380 3.698 3.080 4.394 0.014 10 0 "[ . 1 . 2]" 1
1423 1 68 LYS H 1 71 ASP QB 4.930 . 5.670 4.519 3.703 5.018 . 0 0 "[ . 1 . 2]" 1
1424 1 68 LYS HA 1 68 LYS QG 3.300 . 3.800 2.837 2.312 3.100 . 0 0 "[ . 1 . 2]" 1
1425 1 68 LYS HA 1 68 LYS QD 3.710 . 4.270 2.311 1.815 3.882 . 0 0 "[ . 1 . 2]" 1
1426 1 68 LYS HA 1 69 LEU QD 5.060 . 5.820 4.817 4.249 5.330 . 0 0 "[ . 1 . 2]" 1
1427 1 68 LYS QB 1 69 LEU H 3.880 . 4.460 3.614 3.177 3.758 . 0 0 "[ . 1 . 2]" 1
1428 1 68 LYS QB 1 70 LEU H 3.850 . 4.430 3.956 3.173 4.437 0.007 12 0 "[ . 1 . 2]" 1
1429 1 68 LYS QB 1 71 ASP H 3.880 . 4.460 2.680 2.252 2.954 . 0 0 "[ . 1 . 2]" 1
1430 1 68 LYS QG 1 69 LEU H 5.120 . 5.890 4.703 4.035 4.891 . 0 0 "[ . 1 . 2]" 1
1431 1 68 LYS QG 1 71 ASP H 5.150 . 5.920 4.692 4.196 5.117 . 0 0 "[ . 1 . 2]" 1
1432 1 68 LYS QD 1 68 LYS QE 2.340 . 2.690 2.045 1.983 2.092 . 0 0 "[ . 1 . 2]" 1
1433 1 68 LYS QD 1 69 LEU H 4.390 . 5.050 4.143 3.566 5.064 0.014 2 0 "[ . 1 . 2]" 1
1434 1 68 LYS QD 1 71 ASP H 5.340 . 6.140 4.515 3.038 5.716 . 0 0 "[ . 1 . 2]" 1
1435 1 68 LYS QE 1 70 LEU H 5.340 . 6.140 5.087 3.847 6.159 0.019 13 0 "[ . 1 . 2]" 1
1436 1 68 LYS QE 1 70 LEU MD1 3.750 . 4.310 2.737 1.796 3.890 0.004 17 0 "[ . 1 . 2]" 1
1437 1 68 LYS QE 1 71 ASP H 4.720 . 5.430 4.187 3.277 5.356 . 0 0 "[ . 1 . 2]" 1
1438 1 69 LEU H 1 69 LEU QB 3.250 . 3.740 2.409 2.192 2.718 . 0 0 "[ . 1 . 2]" 1
1439 1 69 LEU H 1 69 LEU QD 3.670 . 4.220 3.350 2.835 3.773 . 0 0 "[ . 1 . 2]" 1
1440 1 69 LEU HA 1 69 LEU QD 3.370 . 3.880 2.836 1.859 3.433 . 0 0 "[ . 1 . 2]" 1
1441 1 69 LEU QB 1 69 LEU QD 2.750 . 3.160 1.933 1.868 2.067 . 0 0 "[ . 1 . 2]" 1
1442 1 69 LEU QD 1 70 LEU H 3.490 . 4.010 2.828 2.128 3.517 . 0 0 "[ . 1 . 2]" 1
1443 1 69 LEU QD 1 70 LEU HA 3.310 . 3.810 2.880 2.407 3.814 0.004 4 0 "[ . 1 . 2]" 1
1444 1 69 LEU QD 1 70 LEU HB3 3.290 . 3.780 3.185 2.467 3.788 0.008 20 0 "[ . 1 . 2]" 1
1445 1 69 LEU QD 1 71 ASP H 4.780 . 5.500 4.510 4.238 5.071 . 0 0 "[ . 1 . 2]" 1
1446 1 69 LEU QD 1 72 ARG H 5.010 . 5.760 4.883 4.221 5.284 . 0 0 "[ . 1 . 2]" 1
1447 1 69 LEU QD 1 73 HIS H 4.220 . 4.850 4.239 3.324 4.844 . 0 0 "[ . 1 . 2]" 1
1448 1 70 LEU H 1 71 ASP QB 5.340 . 6.140 4.484 4.285 4.680 . 0 0 "[ . 1 . 2]" 1
1449 1 70 LEU H 1 73 HIS QB 5.340 . 6.140 4.597 4.346 5.107 . 0 0 "[ . 1 . 2]" 1
1450 1 70 LEU HA 1 73 HIS QB 3.790 . 4.360 2.409 2.077 2.842 . 0 0 "[ . 1 . 2]" 1
1451 1 70 LEU MD2 1 73 HIS QB 5.340 . 6.140 4.570 4.355 4.865 . 0 0 "[ . 1 . 2]" 1
1452 1 71 ASP H 1 71 ASP QB 3.310 . 3.810 2.287 2.222 2.351 . 0 0 "[ . 1 . 2]" 1
1453 1 71 ASP H 1 73 HIS QB 5.340 . 6.140 4.545 4.360 4.810 . 0 0 "[ . 1 . 2]" 1
1454 1 71 ASP QB 1 72 ARG H 3.860 . 4.440 2.574 2.349 2.777 . 0 0 "[ . 1 . 2]" 1
1455 1 72 ARG H 1 73 HIS QB 4.620 . 5.310 4.343 4.205 4.546 . 0 0 "[ . 1 . 2]" 1
1456 1 73 HIS H 1 76 VAL QG 4.960 . 5.700 4.648 4.090 4.836 . 0 0 "[ . 1 . 2]" 1
1457 1 73 HIS HA 1 77 ASN QD 3.940 . 4.530 3.833 3.120 4.423 . 0 0 "[ . 1 . 2]" 1
1458 1 73 HIS QB 1 74 ARG H 3.460 . 3.980 2.395 2.241 2.527 . 0 0 "[ . 1 . 2]" 1
1459 1 73 HIS QB 1 77 ASN QD 5.180 . 5.960 4.759 4.051 5.327 . 0 0 "[ . 1 . 2]" 1
1460 1 74 ARG HA 1 77 ASN QD 5.230 . 6.010 4.566 3.431 5.308 . 0 0 "[ . 1 . 2]" 1
1461 1 74 ARG HG3 1 75 LEU QD 4.600 . 5.290 2.574 1.895 3.999 . 0 0 "[ . 1 . 2]" 1
1462 1 74 ARG HD3 1 75 LEU QD 5.440 . 6.260 3.622 2.811 5.250 . 0 0 "[ . 1 . 2]" 1
1463 1 75 LEU H 1 75 LEU QD 4.110 . 4.730 2.863 2.424 3.674 . 0 0 "[ . 1 . 2]" 1
1464 1 75 LEU H 1 76 VAL QG 4.510 . 5.190 4.266 4.025 4.357 . 0 0 "[ . 1 . 2]" 1
1465 1 75 LEU HB2 1 76 VAL QG 4.660 . 5.360 3.584 3.130 4.780 . 0 0 "[ . 1 . 2]" 1
1466 1 76 VAL H 1 76 VAL QG 3.130 . 3.600 2.241 2.118 2.339 . 0 0 "[ . 1 . 2]" 1
1467 1 76 VAL HB 1 77 ASN QD 4.390 . 5.050 3.307 2.537 4.555 . 0 0 "[ . 1 . 2]" 1
1468 1 76 VAL QG 1 77 ASN H 3.350 . 3.850 3.029 2.224 3.176 . 0 0 "[ . 1 . 2]" 1
1469 1 76 VAL QG 1 77 ASN HA 4.360 . 5.010 3.126 3.013 3.318 . 0 0 "[ . 1 . 2]" 1
1470 1 76 VAL QG 1 78 THR H 4.660 . 5.360 4.517 4.111 4.658 . 0 0 "[ . 1 . 2]" 1
1471 1 76 VAL QG 1 80 LEU H 3.690 . 4.240 3.747 3.629 3.990 . 0 0 "[ . 1 . 2]" 1
1472 1 76 VAL QG 1 80 LEU HB3 3.760 . 4.320 3.500 3.115 3.821 . 0 0 "[ . 1 . 2]" 1
1473 1 76 VAL QG 1 80 LEU HG 3.860 . 4.440 3.894 3.568 4.135 . 0 0 "[ . 1 . 2]" 1
1474 1 76 VAL QG 1 90 PHE HZ 5.080 . 5.840 5.545 4.854 5.843 0.003 14 0 "[ . 1 . 2]" 1
1475 1 76 VAL QG 1 90 PHE HE2 3.810 . 4.380 3.989 3.473 4.347 . 0 0 "[ . 1 . 2]" 1
1476 1 76 VAL QG 1 90 PHE HD2 5.190 . 5.970 4.421 3.973 5.100 . 0 0 "[ . 1 . 2]" 1
1477 1 76 VAL QG 1 92 MET ME 2.740 . 3.150 2.327 2.000 2.669 . 0 0 "[ . 1 . 2]" 1
1478 1 77 ASN HA 1 84 LEU QD 4.280 . 4.920 4.484 4.125 4.845 . 0 0 "[ . 1 . 2]" 1
1479 1 80 LEU HB2 1 84 LEU QD 4.820 . 5.540 3.714 3.313 4.153 . 0 0 "[ . 1 . 2]" 1
1480 1 80 LEU HB3 1 84 LEU QD 2.990 . 3.440 2.692 2.319 3.283 . 0 0 "[ . 1 . 2]" 1
1481 1 81 LYS H 1 81 LYS QG 4.380 . 5.040 4.018 3.906 4.078 . 0 0 "[ . 1 . 2]" 1
1482 1 81 LYS H 1 81 LYS QD 4.690 . 5.390 4.276 4.096 4.482 . 0 0 "[ . 1 . 2]" 1
1483 1 81 LYS HA 1 81 LYS QG 3.330 . 3.830 3.021 2.411 3.265 . 0 0 "[ . 1 . 2]" 1
1484 1 81 LYS HA 1 81 LYS QD 3.900 . 4.490 2.352 2.008 4.097 . 0 0 "[ . 1 . 2]" 1
1485 1 81 LYS HA 1 84 LEU QD 4.770 . 5.490 3.278 2.513 3.705 . 0 0 "[ . 1 . 2]" 1
1486 1 81 LYS HB2 1 81 LYS QD 3.310 . 3.810 2.518 2.307 2.945 . 0 0 "[ . 1 . 2]" 1
1487 1 81 LYS QD 1 81 LYS QG 2.350 . 2.700 2.078 2.006 2.092 . 0 0 "[ . 1 . 2]" 1
1488 1 81 LYS QE 1 81 LYS QG 3.130 . 3.600 2.207 2.108 2.339 . 0 0 "[ . 1 . 2]" 1
1489 1 81 LYS QG 1 82 GLU H 3.160 . 3.630 2.952 2.389 3.577 . 0 0 "[ . 1 . 2]" 1
1490 1 81 LYS QG 1 82 GLU HA 3.750 . 4.310 3.391 3.154 3.929 . 0 0 "[ . 1 . 2]" 1
1491 1 81 LYS QD 1 82 GLU H 4.500 . 5.180 4.154 3.065 4.446 . 0 0 "[ . 1 . 2]" 1
1492 1 81 LYS QD 1 85 GLN HE21 4.110 . 4.730 4.075 2.860 4.736 0.006 14 0 "[ . 1 . 2]" 1
1493 1 81 LYS QD 1 85 GLN HE22 4.190 . 4.820 3.991 2.664 4.831 0.011 11 0 "[ . 1 . 2]" 1
1494 1 83 GLU HB3 1 84 LEU QD 4.360 . 5.010 3.536 3.079 4.008 . 0 0 "[ . 1 . 2]" 1
1495 1 84 LEU H 1 84 LEU QD 3.360 . 3.860 2.938 2.635 3.158 . 0 0 "[ . 1 . 2]" 1
1496 1 84 LEU HA 1 84 LEU QD 3.040 . 3.500 1.935 1.862 2.107 . 0 0 "[ . 1 . 2]" 1
1497 1 84 LEU QD 1 85 GLN H 4.420 . 5.080 4.246 4.159 4.280 . 0 0 "[ . 1 . 2]" 1
1498 1 84 LEU QD 1 85 GLN HE22 5.240 . 6.030 4.057 3.880 4.163 . 0 0 "[ . 1 . 2]" 1
1499 1 84 LEU QD 1 86 ASN H 4.680 . 5.380 4.918 4.834 5.033 . 0 0 "[ . 1 . 2]" 1
1500 1 84 LEU QD 1 87 ILE H 4.470 . 5.140 4.448 4.151 4.643 . 0 0 "[ . 1 . 2]" 1
1501 1 84 LEU QD 1 87 ILE HB 3.970 . 4.570 3.228 2.969 3.560 . 0 0 "[ . 1 . 2]" 1
1502 1 84 LEU QD 1 87 ILE HG12 4.320 . 4.970 4.842 4.598 4.981 0.011 8 0 "[ . 1 . 2]" 1
1503 1 84 LEU QD 1 87 ILE HG13 4.540 . 5.220 3.772 3.457 3.992 . 0 0 "[ . 1 . 2]" 1
1504 1 84 LEU QD 1 87 ILE MD 2.970 . 3.420 2.576 2.192 3.145 . 0 0 "[ . 1 . 2]" 1
1505 1 84 LEU QD 1 90 PHE H 4.750 . 5.460 3.053 2.700 3.490 . 0 0 "[ . 1 . 2]" 1
1506 1 84 LEU QD 1 90 PHE QB 3.450 . 3.970 2.154 1.864 2.388 . 0 0 "[ . 1 . 2]" 1
1507 1 84 LEU QD 1 90 PHE HZ 5.440 . 6.260 5.841 5.264 6.265 0.005 8 0 "[ . 1 . 2]" 1
1508 1 84 LEU QD 1 90 PHE HE2 4.590 . 5.280 4.595 3.880 5.135 . 0 0 "[ . 1 . 2]" 1
1509 1 84 LEU QD 1 90 PHE HD2 3.760 . 4.320 2.945 2.231 3.377 . 0 0 "[ . 1 . 2]" 1
1510 1 84 LEU QD 1 92 MET ME 4.180 . 4.810 3.609 3.037 4.070 . 0 0 "[ . 1 . 2]" 1
1511 1 87 ILE HA 1 88 HIS QB 4.680 . 5.380 4.197 4.098 4.686 . 0 0 "[ . 1 . 2]" 1
1512 1 87 ILE MG 1 88 HIS QB 5.190 . 5.970 3.628 3.341 4.211 . 0 0 "[ . 1 . 2]" 1
1513 1 87 ILE MG 1 90 PHE QB 3.220 . 3.700 2.159 1.798 2.810 0.002 7 0 "[ . 1 . 2]" 1
1514 1 87 ILE MD 1 90 PHE QB 3.690 . 4.240 1.964 1.797 2.251 0.003 11 0 "[ . 1 . 2]" 1
1515 1 88 HIS QB 1 89 ALA H 3.940 . 4.530 2.472 1.812 3.784 . 0 0 "[ . 1 . 2]" 1
1516 1 88 HIS QB 1 89 ALA MB 4.480 . 5.150 3.437 3.016 3.917 . 0 0 "[ . 1 . 2]" 1
1517 1 89 ALA H 1 90 PHE QB 4.560 . 5.240 4.535 4.024 4.956 . 0 0 "[ . 1 . 2]" 1
1518 1 90 PHE H 1 90 PHE QB 3.400 . 3.910 2.363 2.273 2.537 . 0 0 "[ . 1 . 2]" 1
1519 1 90 PHE QB 1 90 PHE HD1 3.210 . 3.690 2.484 2.412 2.556 . 0 0 "[ . 1 . 2]" 1
1520 1 90 PHE QB 1 91 SER H 3.670 . 4.220 3.691 3.536 3.834 . 0 0 "[ . 1 . 2]" 1
1521 1 91 SER H 1 91 SER QB 3.090 . 3.550 2.680 2.394 3.055 . 0 0 "[ . 1 . 2]" 1
1522 1 91 SER QB 1 92 MET H 3.520 . 4.050 2.935 2.357 3.568 . 0 0 "[ . 1 . 2]" 1
1523 1 93 LYS H 1 93 LYS QB 3.350 . 3.850 2.505 2.349 2.684 . 0 0 "[ . 1 . 2]" 1
1524 1 93 LYS H 1 93 LYS QD 4.590 . 5.280 3.739 2.676 4.959 . 0 0 "[ . 1 . 2]" 1
1525 1 93 LYS HA 1 93 LYS QD 3.510 . 4.040 2.231 1.844 3.951 . 0 0 "[ . 1 . 2]" 1
1526 1 93 LYS QB 1 94 CYS H 4.320 . 4.970 3.524 3.292 3.903 . 0 0 "[ . 1 . 2]" 1
1527 1 93 LYS QE 1 93 LYS QG 3.270 . 3.760 2.283 2.122 2.844 . 0 0 "[ . 1 . 2]" 1
1528 1 93 LYS QG 1 94 CYS H 4.520 . 5.200 4.351 3.093 4.920 . 0 0 "[ . 1 . 2]" 1
1529 1 93 LYS QD 1 94 CYS H 4.030 . 4.630 3.870 2.184 4.582 . 0 0 "[ . 1 . 2]" 1
1530 1 94 CYS H 1 94 CYS QB 3.650 . 4.200 2.697 2.291 2.921 . 0 0 "[ . 1 . 2]" 1
1531 1 95 HIS QB 1 96 THR H 3.950 . 4.540 2.609 2.158 3.591 . 0 0 "[ . 1 . 2]" 1
1532 1 96 THR HA 1 97 PRO QG 4.690 . 5.390 3.931 3.738 4.162 . 0 0 "[ . 1 . 2]" 1
1533 1 96 THR HA 1 97 PRO QD 3.360 . 3.860 2.049 1.878 2.274 . 0 0 "[ . 1 . 2]" 1
1534 1 96 THR MG 1 97 PRO QG 4.830 . 5.550 4.274 3.836 4.720 . 0 0 "[ . 1 . 2]" 1
1535 1 96 THR MG 1 97 PRO QD 3.350 . 3.850 2.670 2.197 3.129 . 0 0 "[ . 1 . 2]" 1
1536 1 97 PRO HB2 1 98 LEU QD 4.850 . 5.580 3.493 2.116 4.788 . 0 0 "[ . 1 . 2]" 1
1537 1 97 PRO QG 1 98 LEU H 3.370 . 3.880 3.179 2.250 3.896 0.016 11 0 "[ . 1 . 2]" 1
1538 1 97 PRO QD 1 98 LEU H 3.540 . 4.070 2.735 2.494 3.137 . 0 0 "[ . 1 . 2]" 1
1539 1 98 LEU H 1 98 LEU QB 2.960 . 3.400 2.251 2.049 2.424 . 0 0 "[ . 1 . 2]" 1
1540 1 98 LEU H 1 98 LEU QD 3.760 . 4.320 2.579 1.796 3.562 0.004 13 0 "[ . 1 . 2]" 1
1541 1 98 LEU HA 1 98 LEU QD 3.120 . 3.590 1.867 1.806 1.956 . 0 0 "[ . 1 . 2]" 1
1542 1 98 LEU QB 1 99 GLU H 3.540 . 4.070 2.412 2.266 2.736 . 0 0 "[ . 1 . 2]" 1
1543 1 98 LEU QB 1 100 TYR H 4.890 . 5.620 4.559 4.340 4.897 . 0 0 "[ . 1 . 2]" 1
1544 1 98 LEU QD 1 99 GLU H 4.410 . 5.070 3.590 3.327 3.773 . 0 0 "[ . 1 . 2]" 1
1545 1 98 LEU QD 1 100 TYR H 5.440 . 6.260 4.851 4.603 5.028 . 0 0 "[ . 1 . 2]" 1
1546 1 98 LEU QD 1 101 ASP HB3 4.140 . 4.760 3.719 2.714 4.486 . 0 0 "[ . 1 . 2]" 1
1547 1 98 LEU QD 1 102 LYS H 5.280 . 6.070 4.963 3.788 5.845 . 0 0 "[ . 1 . 2]" 1
1548 1 99 GLU HA 1 99 GLU QG 3.460 . 3.980 2.562 2.248 3.014 . 0 0 "[ . 1 . 2]" 1
1549 1 99 GLU HA 1 102 LYS QD 3.560 . 4.090 3.189 1.792 4.092 0.008 1 0 "[ . 1 . 2]" 1
1550 1 99 GLU QG 1 100 TYR H 5.040 . 5.800 4.159 3.310 4.714 . 0 0 "[ . 1 . 2]" 1
1551 1 100 TYR HE2 1 104 LYS QD 4.240 . 4.880 3.232 2.405 4.465 . 0 0 "[ . 1 . 2]" 1
1552 1 100 TYR HD2 1 104 LYS QD 4.570 . 5.260 3.608 2.754 5.098 . 0 0 "[ . 1 . 2]" 1
1553 1 100 TYR HD2 1 104 LYS QE 5.340 . 6.140 5.163 3.844 5.877 . 0 0 "[ . 1 . 2]" 1
1554 1 101 ASP H 1 102 LYS QD 4.330 . 4.980 4.622 3.590 4.981 0.001 3 0 "[ . 1 . 2]" 1
1555 1 101 ASP HA 1 104 LYS QD 3.990 . 4.590 2.428 1.796 3.666 0.004 20 0 "[ . 1 . 2]" 1
1556 1 101 ASP HA 1 104 LYS QE 3.070 . 3.530 2.875 1.796 3.535 0.005 9 0 "[ . 1 . 2]" 1
1557 1 101 ASP HB3 1 102 LYS QD 3.980 . 4.580 3.589 2.469 4.581 0.001 1 0 "[ . 1 . 2]" 1
1558 1 102 LYS H 1 102 LYS QD 3.770 . 4.340 2.833 1.980 3.221 . 0 0 "[ . 1 . 2]" 1
1559 1 102 LYS H 1 102 LYS QE 3.810 . 4.380 2.420 1.869 4.127 . 0 0 "[ . 1 . 2]" 1
1560 1 102 LYS HA 1 102 LYS QD 3.460 . 3.980 3.422 2.391 3.994 0.014 1 0 "[ . 1 . 2]" 1
1561 1 102 LYS HB2 1 102 LYS QE 4.320 . 4.970 2.732 1.826 3.811 . 0 0 "[ . 1 . 2]" 1
1562 1 102 LYS QD 1 103 LEU H 4.640 . 5.340 4.704 3.791 5.131 . 0 0 "[ . 1 . 2]" 1
1563 1 102 LYS QE 1 103 LEU H 5.050 . 5.810 4.300 3.880 5.733 . 0 0 "[ . 1 . 2]" 1
1564 1 104 LYS H 1 104 LYS QD 4.640 . 5.340 3.847 3.384 4.083 . 0 0 "[ . 1 . 2]" 1
1565 1 104 LYS H 1 104 LYS QE 4.280 . 4.920 4.215 3.653 4.718 . 0 0 "[ . 1 . 2]" 1
1566 1 104 LYS HB2 1 104 LYS QE 4.690 . 5.390 2.737 1.868 3.967 . 0 0 "[ . 1 . 2]" 1
1567 1 104 LYS QE 1 104 LYS HG2 3.680 . 4.230 3.072 2.420 3.355 . 0 0 "[ . 1 . 2]" 1
1568 1 104 LYS QE 1 104 LYS HG3 3.300 . 3.800 2.292 2.143 2.502 . 0 0 "[ . 1 . 2]" 1
1569 1 104 LYS HG3 1 105 SER QB 4.640 . 5.340 3.882 2.861 5.348 0.008 3 0 "[ . 1 . 2]" 1
1570 1 104 LYS QE 1 105 SER H 3.870 . 4.450 3.749 2.435 4.452 0.002 5 0 "[ . 1 . 2]" 1
1571 1 104 LYS QE 1 106 LYS H 5.340 . 6.140 5.817 4.739 6.155 0.015 16 0 "[ . 1 . 2]" 1
1572 1 105 SER H 1 105 SER QB 2.740 . 3.150 2.329 2.184 2.514 . 0 0 "[ . 1 . 2]" 1
1573 1 105 SER HA 1 105 SER QB 2.540 . 2.920 2.365 2.333 2.447 . 0 0 "[ . 1 . 2]" 1
1574 1 105 SER QB 1 106 LYS H 2.680 . 3.080 2.532 1.951 3.075 . 0 0 "[ . 1 . 2]" 1
1575 1 105 SER QB 1 106 LYS QB 5.010 . 5.760 3.927 3.465 4.208 . 0 0 "[ . 1 . 2]" 1
1576 1 105 SER QB 1 106 LYS QD 4.720 . 5.430 3.244 1.801 5.428 . 0 0 "[ . 1 . 2]" 1
1577 1 106 LYS H 1 106 LYS QB 3.350 . 3.850 3.078 2.554 3.380 . 0 0 "[ . 1 . 2]" 1
1578 1 106 LYS H 1 106 LYS QG 2.560 . 2.940 2.312 1.833 2.938 . 0 0 "[ . 1 . 2]" 1
1579 1 106 LYS H 1 106 LYS QD 3.340 . 3.840 2.905 1.871 3.859 0.019 4 0 "[ . 1 . 2]" 1
1580 1 106 LYS HA 1 106 LYS QG 3.440 . 3.960 3.410 3.265 3.495 . 0 0 "[ . 1 . 2]" 1
1581 1 106 LYS QB 1 107 GLY H 2.850 . 3.280 2.984 1.833 3.300 0.020 2 0 "[ . 1 . 2]" 1
1582 1 106 LYS QB 1 108 SER H 4.050 . 4.660 3.462 2.184 4.598 . 0 0 "[ . 1 . 2]" 1
1583 1 106 LYS QG 1 107 GLY H 3.310 . 3.810 2.144 1.780 3.830 0.020 16 0 "[ . 1 . 2]" 1
1584 1 106 LYS QG 1 108 SER H 3.430 . 3.940 2.522 1.969 3.958 0.018 16 0 "[ . 1 . 2]" 1
1585 1 106 LYS QD 1 107 GLY H 3.320 . 3.820 3.413 2.716 3.850 0.030 19 0 "[ . 1 . 2]" 1
1586 1 106 LYS QD 1 108 SER H 4.140 . 4.760 3.514 1.801 4.671 . 0 0 "[ . 1 . 2]" 1
1587 1 106 LYS QE 1 107 GLY H 4.330 . 4.980 4.388 3.621 4.981 0.001 14 0 "[ . 1 . 2]" 1
1588 1 108 SER H 1 108 SER QB 2.810 . 3.230 2.713 2.259 3.240 0.010 15 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 60
_Distance_constraint_stats_list.Viol_count 213
_Distance_constraint_stats_list.Viol_total 30.823
_Distance_constraint_stats_list.Viol_max 0.037
_Distance_constraint_stats_list.Viol_rms 0.0037
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0013
_Distance_constraint_stats_list.Viol_average_violations_only 0.0072
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 24 CYS 0.025 0.015 9 0 "[ . 1 . 2]"
1 25 ILE 0.044 0.013 5 0 "[ . 1 . 2]"
1 26 GLN 0.008 0.004 15 0 "[ . 1 . 2]"
1 27 LYS 0.022 0.009 18 0 "[ . 1 . 2]"
1 28 VAL 0.085 0.016 6 0 "[ . 1 . 2]"
1 29 ILE 0.047 0.013 5 0 "[ . 1 . 2]"
1 30 GLU 0.018 0.006 12 0 "[ . 1 . 2]"
1 31 ASP 0.022 0.009 18 0 "[ . 1 . 2]"
1 32 LYS 0.060 0.016 6 0 "[ . 1 . 2]"
1 33 LEU 0.014 0.006 10 0 "[ . 1 . 2]"
1 34 SER 0.010 0.006 12 0 "[ . 1 . 2]"
1 37 LEU 0.011 0.006 10 0 "[ . 1 . 2]"
1 41 PHE 0.051 0.011 6 0 "[ . 1 . 2]"
1 43 GLU 0.055 0.014 17 0 "[ . 1 . 2]"
1 45 VAL 0.110 0.017 2 0 "[ . 1 . 2]"
1 55 PHE 0.058 0.017 20 0 "[ . 1 . 2]"
1 56 ASP 0.110 0.017 2 0 "[ . 1 . 2]"
1 57 ALA 0.117 0.013 15 0 "[ . 1 . 2]"
1 58 VAL 0.055 0.014 17 0 "[ . 1 . 2]"
1 59 ILE 0.071 0.013 2 0 "[ . 1 . 2]"
1 60 VAL 0.051 0.011 6 0 "[ . 1 . 2]"
1 61 SER 0.102 0.018 7 0 "[ . 1 . 2]"
1 71 ASP 0.004 0.004 20 0 "[ . 1 . 2]"
1 72 ARG 0.005 0.004 17 0 "[ . 1 . 2]"
1 73 HIS 0.010 0.010 2 0 "[ . 1 . 2]"
1 74 ARG 0.001 0.001 16 0 "[ . 1 . 2]"
1 75 LEU 0.088 0.021 20 0 "[ . 1 . 2]"
1 76 VAL 0.076 0.015 20 0 "[ . 1 . 2]"
1 77 ASN 0.146 0.013 15 0 "[ . 1 . 2]"
1 78 THR 0.001 0.001 16 0 "[ . 1 . 2]"
1 79 ILE 0.441 0.037 10 0 "[ . 1 . 2]"
1 80 LEU 0.160 0.015 20 0 "[ . 1 . 2]"
1 81 LYS 0.136 0.013 15 0 "[ . 1 . 2]"
1 83 GLU 0.357 0.037 10 0 "[ . 1 . 2]"
1 84 LEU 0.089 0.011 13 0 "[ . 1 . 2]"
1 91 SER 0.092 0.017 20 0 "[ . 1 . 2]"
1 93 LYS 0.133 0.013 15 0 "[ . 1 . 2]"
1 95 HIS 0.123 0.018 7 0 "[ . 1 . 2]"
1 96 THR 0.038 0.019 4 0 "[ . 1 . 2]"
1 100 TYR 0.038 0.019 4 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 41 PHE O 1 60 VAL H 1.800 . 2.300 1.973 1.851 2.231 . 0 0 "[ . 1 . 2]" 2
2 1 41 PHE O 1 60 VAL N 2.800 2.800 3.300 2.877 2.793 2.992 0.007 17 0 "[ . 1 . 2]" 2
3 1 41 PHE H 1 60 VAL O 1.800 . 2.300 2.179 1.902 2.311 0.011 6 0 "[ . 1 . 2]" 2
4 1 41 PHE N 1 60 VAL O 2.800 2.800 3.300 3.145 2.860 3.286 . 0 0 "[ . 1 . 2]" 2
5 1 43 GLU O 1 58 VAL H 1.800 . 2.300 1.944 1.837 2.152 . 0 0 "[ . 1 . 2]" 2
6 1 43 GLU O 1 58 VAL N 2.800 2.800 3.300 2.851 2.792 3.019 0.008 19 0 "[ . 1 . 2]" 2
7 1 43 GLU H 1 58 VAL O 1.800 . 2.300 2.150 1.922 2.314 0.014 17 0 "[ . 1 . 2]" 2
8 1 43 GLU N 1 58 VAL O 2.800 2.800 3.300 3.100 2.902 3.252 . 0 0 "[ . 1 . 2]" 2
9 1 45 VAL O 1 56 ASP H 1.800 . 2.300 1.971 1.804 2.310 0.010 16 0 "[ . 1 . 2]" 2
10 1 45 VAL O 1 56 ASP N 2.800 2.800 3.300 2.928 2.788 3.287 0.012 18 0 "[ . 1 . 2]" 2
11 1 45 VAL H 1 56 ASP O 1.800 . 2.300 1.920 1.806 2.300 . 0 0 "[ . 1 . 2]" 2
12 1 45 VAL N 1 56 ASP O 2.800 2.800 3.300 2.856 2.783 3.227 0.017 2 0 "[ . 1 . 2]" 2
13 1 59 ILE H 1 93 LYS O 1.800 . 2.300 1.903 1.821 2.100 . 0 0 "[ . 1 . 2]" 2
14 1 59 ILE N 1 93 LYS O 2.800 2.800 3.300 2.847 2.787 3.038 0.013 2 0 "[ . 1 . 2]" 2
15 1 57 ALA O 1 93 LYS H 1.800 . 2.300 1.844 1.804 1.971 . 0 0 "[ . 1 . 2]" 2
16 1 57 ALA O 1 93 LYS N 2.800 2.800 3.300 2.806 2.787 2.944 0.013 15 0 "[ . 1 . 2]" 2
17 1 59 ILE O 1 95 HIS H 1.800 . 2.300 1.993 1.839 2.300 . 10 0 "[ . 1 . 2]" 2
18 1 59 ILE O 1 95 HIS N 2.800 2.800 3.300 2.883 2.790 3.025 0.010 6 0 "[ . 1 . 2]" 2
19 1 61 SER H 1 95 HIS O 1.800 . 2.300 2.272 2.077 2.318 0.018 7 0 "[ . 1 . 2]" 2
20 1 61 SER N 1 95 HIS O 2.800 2.800 3.300 3.165 2.981 3.254 . 0 0 "[ . 1 . 2]" 2
21 1 57 ALA H 1 91 SER O 1.800 . 2.300 1.872 1.814 1.986 . 0 0 "[ . 1 . 2]" 2
22 1 57 ALA N 1 91 SER O 2.800 2.800 3.300 2.828 2.794 2.950 0.006 17 0 "[ . 1 . 2]" 2
23 1 55 PHE O 1 91 SER H 1.800 . 2.300 1.902 1.802 2.196 . 0 0 "[ . 1 . 2]" 2
24 1 55 PHE O 1 91 SER N 2.800 2.800 3.300 2.858 2.783 3.101 0.017 20 0 "[ . 1 . 2]" 2
25 1 33 LEU O 1 37 LEU H 1.800 . 2.300 1.928 1.829 2.131 . 0 0 "[ . 1 . 2]" 2
26 1 33 LEU O 1 37 LEU N 2.800 2.800 3.300 2.888 2.794 3.107 0.006 10 0 "[ . 1 . 2]" 2
27 1 24 CYS O 1 28 VAL H 1.800 . 2.300 2.150 1.879 2.315 0.015 9 0 "[ . 1 . 2]" 2
28 1 24 CYS O 1 28 VAL N 2.800 2.800 3.300 3.049 2.796 3.264 0.004 5 0 "[ . 1 . 2]" 2
29 1 25 ILE O 1 29 ILE H 1.800 . 2.300 2.221 1.965 2.313 0.013 5 0 "[ . 1 . 2]" 2
30 1 25 ILE O 1 29 ILE N 2.800 2.800 3.300 3.186 2.938 3.295 . 0 0 "[ . 1 . 2]" 2
31 1 26 GLN O 1 30 GLU H 1.800 . 2.300 1.994 1.836 2.304 0.004 15 0 "[ . 1 . 2]" 2
32 1 26 GLN O 1 30 GLU N 2.800 2.800 3.300 2.942 2.796 3.270 0.004 9 0 "[ . 1 . 2]" 2
33 1 27 LYS O 1 31 ASP H 1.800 . 2.300 1.946 1.834 2.303 0.003 15 0 "[ . 1 . 2]" 2
34 1 27 LYS O 1 31 ASP N 2.800 2.800 3.300 2.891 2.791 3.219 0.009 18 0 "[ . 1 . 2]" 2
35 1 28 VAL O 1 32 LYS H 1.800 . 2.300 2.192 1.986 2.316 0.016 6 0 "[ . 1 . 2]" 2
36 1 28 VAL O 1 32 LYS N 2.800 2.800 3.300 3.064 2.830 3.285 . 0 0 "[ . 1 . 2]" 2
37 1 29 ILE O 1 33 LEU H 1.800 . 2.300 2.165 1.886 2.302 0.002 3 0 "[ . 1 . 2]" 2
38 1 29 ILE O 1 33 LEU N 2.800 2.800 3.300 3.144 2.870 3.286 . 0 0 "[ . 1 . 2]" 2
39 1 30 GLU O 1 34 SER H 1.800 . 2.300 2.114 1.934 2.306 0.006 12 0 "[ . 1 . 2]" 2
40 1 30 GLU O 1 34 SER N 2.800 2.800 3.300 2.967 2.817 3.161 . 0 0 "[ . 1 . 2]" 2
41 1 80 LEU O 1 84 LEU H 1.800 . 2.300 1.856 1.805 1.972 . 0 0 "[ . 1 . 2]" 2
42 1 80 LEU O 1 84 LEU N 2.800 2.800 3.300 2.808 2.789 2.911 0.011 13 0 "[ . 1 . 2]" 2
43 1 79 ILE O 1 83 GLU H 1.800 . 2.300 2.315 2.244 2.337 0.037 10 0 "[ . 1 . 2]" 2
44 1 79 ILE O 1 83 GLU N 2.800 2.800 3.300 3.257 3.126 3.309 0.009 8 0 "[ . 1 . 2]" 2
45 1 77 ASN O 1 81 LYS H 1.800 . 2.300 2.307 2.301 2.313 0.013 15 0 "[ . 1 . 2]" 2
46 1 77 ASN O 1 81 LYS N 2.800 2.800 3.300 2.956 2.848 3.096 . 0 0 "[ . 1 . 2]" 2
47 1 76 VAL O 1 80 LEU H 1.800 . 2.300 1.959 1.848 2.163 . 0 0 "[ . 1 . 2]" 2
48 1 76 VAL O 1 80 LEU N 2.800 2.800 3.300 2.814 2.785 2.949 0.015 20 0 "[ . 1 . 2]" 2
49 1 75 LEU O 1 79 ILE H 1.800 . 2.300 2.228 1.952 2.321 0.021 20 0 "[ . 1 . 2]" 2
50 1 75 LEU O 1 79 ILE N 2.800 2.800 3.300 3.195 2.932 3.284 . 0 0 "[ . 1 . 2]" 2
51 1 74 ARG O 1 78 THR H 1.800 . 2.300 2.126 1.923 2.265 . 0 0 "[ . 1 . 2]" 2
52 1 74 ARG O 1 78 THR N 2.800 2.800 3.300 2.986 2.799 3.187 0.001 16 0 "[ . 1 . 2]" 2
53 1 73 HIS O 1 77 ASN H 1.800 . 2.300 2.030 1.870 2.310 0.010 2 0 "[ . 1 . 2]" 2
54 1 73 HIS O 1 77 ASN N 2.800 2.800 3.300 2.971 2.816 3.262 . 0 0 "[ . 1 . 2]" 2
55 1 72 ARG O 1 76 VAL H 1.800 . 2.300 2.084 1.852 2.304 0.004 17 0 "[ . 1 . 2]" 2
56 1 72 ARG O 1 76 VAL N 2.800 2.800 3.300 3.034 2.816 3.255 . 0 0 "[ . 1 . 2]" 2
57 1 71 ASP O 1 75 LEU H 1.800 . 2.300 2.038 1.864 2.304 0.004 20 0 "[ . 1 . 2]" 2
58 1 71 ASP O 1 75 LEU N 2.800 2.800 3.300 2.984 2.820 3.244 . 0 0 "[ . 1 . 2]" 2
59 1 96 THR O 1 100 TYR H 1.800 . 2.300 2.054 1.870 2.319 0.019 4 0 "[ . 1 . 2]" 2
60 1 96 THR O 1 100 TYR N 2.800 2.800 3.300 2.992 2.794 3.296 0.006 6 0 "[ . 1 . 2]" 2
stop_
save_
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