NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
555693 |
4asv   |
18456 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_4asv
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 2536
_Distance_constraint_stats_list.Viol_count 1136
_Distance_constraint_stats_list.Viol_total 2380.045
_Distance_constraint_stats_list.Viol_max 0.642
_Distance_constraint_stats_list.Viol_rms 0.0241
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0023
_Distance_constraint_stats_list.Viol_average_violations_only 0.1048
_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 15 MET 9.618 0.641 15 5 "[ - ** 1 + * 2]"
1 16 SER 3.969 0.320 8 0 "[ . 1 . 2]"
1 17 ALA 1.223 0.176 9 0 "[ . 1 . 2]"
1 18 SER 3.024 0.641 15 3 "[ - . 1 + * 2]"
1 19 LYS 1.047 0.189 17 0 "[ . 1 . 2]"
1 20 GLU 0.609 0.123 19 0 "[ . 1 . 2]"
1 21 GLU 1.490 0.112 10 0 "[ . 1 . 2]"
1 22 ILE 0.716 0.123 19 0 "[ . 1 . 2]"
1 23 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ALA 0.189 0.051 12 0 "[ . 1 . 2]"
1 25 LEU 0.506 0.080 5 0 "[ . 1 . 2]"
1 26 ILE 0.034 0.019 16 0 "[ . 1 . 2]"
1 27 VAL 0.055 0.055 12 0 "[ . 1 . 2]"
1 28 ASN 0.026 0.023 19 0 "[ . 1 . 2]"
1 29 TYR 0.105 0.024 6 0 "[ . 1 . 2]"
1 30 PHE 4.039 0.268 12 0 "[ . 1 . 2]"
1 31 SER 0.027 0.025 17 0 "[ . 1 . 2]"
1 32 SER 2.803 0.641 15 3 "[ - . 1 + * 2]"
1 33 ILE 0.997 0.102 2 0 "[ . 1 . 2]"
1 34 VAL 0.002 0.002 4 0 "[ . 1 . 2]"
1 35 GLU 0.002 0.002 4 0 "[ . 1 . 2]"
1 36 LYS 2.803 0.641 15 3 "[ - . 1 + * 2]"
1 37 LYS 0.024 0.012 10 0 "[ . 1 . 2]"
1 38 GLU 6.105 0.540 9 4 "[ * +1*- . 2]"
1 39 ILE 3.944 0.146 2 0 "[ . 1 . 2]"
1 40 SER 0.579 0.167 11 0 "[ . 1 . 2]"
1 41 GLU 0.084 0.084 12 0 "[ . 1 . 2]"
1 42 ASP 3.707 0.371 13 0 "[ . 1 . 2]"
1 43 GLY 0.015 0.015 18 0 "[ . 1 . 2]"
1 44 ALA 0.249 0.065 11 0 "[ . 1 . 2]"
1 45 ASP 3.516 0.464 10 0 "[ . 1 . 2]"
1 46 SER 5.513 0.475 7 0 "[ . 1 . 2]"
1 47 LEU 1.829 0.268 12 0 "[ . 1 . 2]"
1 48 ASN 1.449 0.093 13 0 "[ . 1 . 2]"
1 49 VAL 0.110 0.036 1 0 "[ . 1 . 2]"
1 50 ALA 0.150 0.028 15 0 "[ . 1 . 2]"
1 51 MET 6.000 0.247 10 0 "[ . 1 . 2]"
1 52 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 CYS 0.395 0.301 18 0 "[ . 1 . 2]"
1 54 ILE 3.206 0.301 18 0 "[ . 1 . 2]"
1 55 SER 1.172 0.323 19 0 "[ . 1 . 2]"
1 56 GLU 1.172 0.323 19 0 "[ . 1 . 2]"
1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 PHE 3.120 0.189 17 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 PHE 2.426 0.112 10 0 "[ . 1 . 2]"
1 61 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ARG 0.019 0.012 6 0 "[ . 1 . 2]"
1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ALA 0.071 0.031 4 0 "[ . 1 . 2]"
1 65 VAL 0.081 0.043 6 0 "[ . 1 . 2]"
1 66 SER 0.019 0.012 6 0 "[ . 1 . 2]"
1 67 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ILE 0.061 0.051 12 0 "[ . 1 . 2]"
1 69 LEU 3.413 0.641 15 3 "[ - . 1 + * 2]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LYS 0.308 0.133 10 0 "[ . 1 . 2]"
1 72 SER 3.549 0.641 15 3 "[ - . 1 + * 2]"
1 73 GLU 4.537 0.346 4 0 "[ . 1 . 2]"
1 74 PHE 1.093 0.227 20 0 "[ . 1 . 2]"
1 75 LYS 5.021 0.641 15 3 "[ - . 1 + * 2]"
1 76 GLY 0.011 0.011 7 0 "[ . 1 . 2]"
1 77 GLN 2.343 0.463 12 0 "[ . 1 . 2]"
1 78 HIS 0.763 0.463 12 0 "[ . 1 . 2]"
1 79 LEU 1.479 0.184 8 0 "[ . 1 . 2]"
1 80 ALA 0.902 0.184 8 0 "[ . 1 . 2]"
1 81 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 ILE 0.541 0.175 9 0 "[ . 1 . 2]"
1 83 LEU 1.084 0.066 12 0 "[ . 1 . 2]"
1 84 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 SER 0.059 0.059 17 0 "[ . 1 . 2]"
1 88 ARG 1.907 0.602 13 1 "[ . 1 + . 2]"
1 89 VAL 0.284 0.164 2 0 "[ . 1 . 2]"
1 90 PRO 0.138 0.057 3 0 "[ . 1 . 2]"
1 91 GLU 0.713 0.175 19 0 "[ . 1 . 2]"
1 92 SER 0.575 0.175 19 0 "[ . 1 . 2]"
2 15 MET 9.644 0.642 15 5 "[ - ** 1 + * 2]"
2 16 SER 3.939 0.317 8 0 "[ . 1 . 2]"
2 17 ALA 1.225 0.176 9 0 "[ . 1 . 2]"
2 18 SER 3.016 0.642 15 3 "[ - . 1 + * 2]"
2 19 LYS 1.065 0.188 17 0 "[ . 1 . 2]"
2 20 GLU 0.610 0.125 19 0 "[ . 1 . 2]"
2 21 GLU 1.481 0.113 10 0 "[ . 1 . 2]"
2 22 ILE 0.715 0.125 19 0 "[ . 1 . 2]"
2 23 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 24 ALA 0.183 0.051 12 0 "[ . 1 . 2]"
2 25 LEU 0.504 0.082 5 0 "[ . 1 . 2]"
2 26 ILE 0.034 0.018 16 0 "[ . 1 . 2]"
2 27 VAL 0.056 0.056 12 0 "[ . 1 . 2]"
2 28 ASN 0.021 0.019 19 0 "[ . 1 . 2]"
2 29 TYR 0.104 0.025 6 0 "[ . 1 . 2]"
2 30 PHE 4.051 0.268 12 0 "[ . 1 . 2]"
2 31 SER 0.029 0.025 17 0 "[ . 1 . 2]"
2 32 SER 2.803 0.642 15 3 "[ - . 1 + * 2]"
2 33 ILE 0.997 0.102 2 0 "[ . 1 . 2]"
2 34 VAL 0.004 0.004 4 0 "[ . 1 . 2]"
2 35 GLU 0.004 0.004 4 0 "[ . 1 . 2]"
2 36 LYS 2.803 0.642 15 3 "[ - . 1 + * 2]"
2 37 LYS 0.016 0.012 10 0 "[ . 1 . 2]"
2 38 GLU 6.089 0.542 9 4 "[ * +1-* . 2]"
2 39 ILE 3.934 0.147 16 0 "[ . 1 . 2]"
2 40 SER 0.577 0.168 11 0 "[ . 1 . 2]"
2 41 GLU 0.084 0.084 12 0 "[ . 1 . 2]"
2 42 ASP 3.702 0.371 13 0 "[ . 1 . 2]"
2 43 GLY 0.014 0.014 18 0 "[ . 1 . 2]"
2 44 ALA 0.248 0.066 11 0 "[ . 1 . 2]"
2 45 ASP 3.521 0.465 10 0 "[ . 1 . 2]"
2 46 SER 5.500 0.477 7 0 "[ . 1 . 2]"
2 47 LEU 1.830 0.268 12 0 "[ . 1 . 2]"
2 48 ASN 1.444 0.093 13 0 "[ . 1 . 2]"
2 49 VAL 0.100 0.034 1 0 "[ . 1 . 2]"
2 50 ALA 0.168 0.028 15 0 "[ . 1 . 2]"
2 51 MET 6.000 0.247 10 0 "[ . 1 . 2]"
2 52 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 53 CYS 0.377 0.302 18 0 "[ . 1 . 2]"
2 54 ILE 3.207 0.302 18 0 "[ . 1 . 2]"
2 55 SER 1.179 0.324 19 0 "[ . 1 . 2]"
2 56 GLU 1.179 0.324 19 0 "[ . 1 . 2]"
2 57 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 58 PHE 3.115 0.188 17 0 "[ . 1 . 2]"
2 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 60 PHE 2.420 0.113 10 0 "[ . 1 . 2]"
2 61 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 62 ARG 0.015 0.011 6 0 "[ . 1 . 2]"
2 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 64 ALA 0.070 0.033 4 0 "[ . 1 . 2]"
2 65 VAL 0.080 0.042 6 0 "[ . 1 . 2]"
2 66 SER 0.015 0.011 6 0 "[ . 1 . 2]"
2 67 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 68 ILE 0.061 0.051 12 0 "[ . 1 . 2]"
2 69 LEU 3.406 0.642 15 3 "[ - . 1 + * 2]"
2 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 71 LYS 0.305 0.137 10 0 "[ . 1 . 2]"
2 72 SER 3.549 0.642 15 3 "[ - . 1 + * 2]"
2 73 GLU 4.524 0.351 4 0 "[ . 1 . 2]"
2 74 PHE 1.130 0.227 20 0 "[ . 1 . 2]"
2 75 LYS 5.033 0.642 15 3 "[ - . 1 + * 2]"
2 76 GLY 0.011 0.011 7 0 "[ . 1 . 2]"
2 77 GLN 2.326 0.463 12 0 "[ . 1 . 2]"
2 78 HIS 0.754 0.463 12 0 "[ . 1 . 2]"
2 79 LEU 1.462 0.181 8 0 "[ . 1 . 2]"
2 80 ALA 0.879 0.181 8 0 "[ . 1 . 2]"
2 81 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 82 ILE 0.543 0.175 9 0 "[ . 1 . 2]"
2 83 LEU 1.083 0.065 12 0 "[ . 1 . 2]"
2 84 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 85 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 86 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 87 SER 0.062 0.062 17 0 "[ . 1 . 2]"
2 88 ARG 1.883 0.600 13 1 "[ . 1 + . 2]"
2 89 VAL 0.283 0.163 2 0 "[ . 1 . 2]"
2 90 PRO 0.154 0.061 3 0 "[ . 1 . 2]"
2 91 GLU 0.724 0.171 19 0 "[ . 1 . 2]"
2 92 SER 0.571 0.171 19 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 82 ILE HB 1 83 LEU MD1 2.777 . 3.741 2.720 2.285 2.856 . 0 0 "[ . 1 . 2]" 1
2 2 82 ILE HB 2 83 LEU MD1 2.777 . 3.741 2.721 2.285 2.857 . 0 0 "[ . 1 . 2]" 1
3 1 65 VAL HA 1 68 ILE HB 2.856 . 3.876 2.753 2.462 3.044 . 0 0 "[ . 1 . 2]" 1
4 2 65 VAL HA 2 68 ILE HB 2.856 . 3.876 2.754 2.462 3.045 . 0 0 "[ . 1 . 2]" 1
5 1 24 ALA MB 1 68 ILE HB 2.761 . 3.714 2.500 2.241 2.745 . 0 0 "[ . 1 . 2]" 1
6 2 24 ALA MB 2 68 ILE HB 2.761 . 3.714 2.500 2.240 2.746 . 0 0 "[ . 1 . 2]" 1
7 1 68 ILE HB 1 68 ILE MD 2.512 . 3.301 2.427 2.413 2.441 . 0 0 "[ . 1 . 2]" 1
8 2 68 ILE HB 2 68 ILE MD 2.512 . 3.301 2.428 2.415 2.439 . 0 0 "[ . 1 . 2]" 1
9 1 26 ILE HB 1 26 ILE MD 2.559 . 3.378 2.437 2.422 2.453 . 0 0 "[ . 1 . 2]" 1
10 2 26 ILE HB 2 26 ILE MD 2.559 . 3.378 2.437 2.423 2.453 . 0 0 "[ . 1 . 2]" 1
11 1 20 GLU HB2 1 20 GLU HG2 2.672 . 3.564 2.988 2.589 3.012 . 0 0 "[ . 1 . 2]" 1
12 2 20 GLU HB2 2 20 GLU HG2 2.672 . 3.564 2.987 2.590 3.011 . 0 0 "[ . 1 . 2]" 1
13 1 20 GLU HA 1 20 GLU HG3 3.341 . 4.737 3.807 3.732 4.248 . 0 0 "[ . 1 . 2]" 1
14 2 20 GLU HA 2 20 GLU HG3 3.341 . 4.737 3.807 3.732 4.248 . 0 0 "[ . 1 . 2]" 1
15 1 30 PHE QD 1 33 ILE HB 4.516 . 7.066 4.208 3.718 4.542 . 0 0 "[ . 1 . 2]" 1
16 2 30 PHE QD 2 33 ILE HB 4.516 . 7.066 4.208 3.719 4.543 . 0 0 "[ . 1 . 2]" 1
17 1 19 LYS HA 1 22 ILE HB 3.014 . 4.150 3.099 2.704 3.423 . 0 0 "[ . 1 . 2]" 1
18 2 19 LYS HA 2 22 ILE HB 3.014 . 4.150 3.098 2.702 3.424 . 0 0 "[ . 1 . 2]" 1
19 1 20 GLU HB3 1 20 GLU HG2 2.940 . 4.021 2.492 2.399 2.988 . 0 0 "[ . 1 . 2]" 1
20 2 20 GLU HB3 2 20 GLU HG2 2.940 . 4.021 2.492 2.400 2.990 . 0 0 "[ . 1 . 2]" 1
21 1 20 GLU HB3 1 20 GLU HG3 2.663 . 3.549 2.987 2.582 3.011 . 0 0 "[ . 1 . 2]" 1
22 2 20 GLU HB3 2 20 GLU HG3 2.663 . 3.549 2.987 2.581 3.011 . 0 0 "[ . 1 . 2]" 1
23 1 63 GLU HA 1 63 GLU HG2 3.390 . 4.826 3.237 2.493 4.224 . 0 0 "[ . 1 . 2]" 1
24 2 63 GLU HA 2 63 GLU HG2 3.390 . 4.826 3.237 2.490 4.225 . 0 0 "[ . 1 . 2]" 1
25 1 56 GLU HA 1 56 GLU QG 3.040 . 4.196 2.694 2.425 3.084 . 0 0 "[ . 1 . 2]" 1
26 2 56 GLU HA 2 56 GLU QG 3.040 . 4.196 2.694 2.427 3.086 . 0 0 "[ . 1 . 2]" 1
27 1 73 GLU HA 1 73 GLU HG2 3.588 . 5.197 3.152 2.434 4.121 . 0 0 "[ . 1 . 2]" 1
28 2 73 GLU HA 2 73 GLU HG2 3.588 . 5.197 3.152 2.436 4.122 . 0 0 "[ . 1 . 2]" 1
29 1 77 GLN HA 1 77 GLN QG 3.443 . 4.252 2.772 2.221 3.464 . 0 0 "[ . 1 . 2]" 1
30 2 77 GLN HA 2 77 GLN QG 3.443 . 4.252 2.772 2.217 3.464 . 0 0 "[ . 1 . 2]" 1
31 1 71 LYS HA 1 71 LYS HB2 2.829 . 3.829 2.660 2.414 3.027 . 0 0 "[ . 1 . 2]" 1
32 2 71 LYS HA 2 71 LYS HB2 2.829 . 3.829 2.660 2.412 3.026 . 0 0 "[ . 1 . 2]" 1
33 1 71 LYS HA 1 71 LYS HB3 2.911 . 3.970 2.800 2.407 3.027 . 0 0 "[ . 1 . 2]" 1
34 2 71 LYS HA 2 71 LYS HB3 2.911 . 3.970 2.800 2.403 3.027 . 0 0 "[ . 1 . 2]" 1
35 1 15 MET HA 1 15 MET HG2 3.333 . 4.722 2.715 2.423 3.712 . 0 0 "[ . 1 . 2]" 1
36 2 15 MET HA 2 15 MET HG2 3.333 . 4.722 2.716 2.421 3.714 . 0 0 "[ . 1 . 2]" 1
37 1 65 VAL HA 1 65 VAL HB 2.848 . 3.862 2.423 2.377 2.489 . 0 0 "[ . 1 . 2]" 1
38 2 65 VAL HA 2 65 VAL HB 2.848 . 3.862 2.423 2.378 2.487 . 0 0 "[ . 1 . 2]" 1
39 1 19 LYS HA 1 19 LYS HB2 2.944 . 4.028 2.916 2.486 3.026 . 0 0 "[ . 1 . 2]" 1
40 2 19 LYS HA 2 19 LYS HB2 2.944 . 4.028 2.917 2.487 3.027 . 0 0 "[ . 1 . 2]" 1
41 1 89 VAL HB 1 90 PRO HD2 4.535 . 7.105 4.868 3.718 5.316 . 0 0 "[ . 1 . 2]" 1
42 2 89 VAL HB 2 90 PRO HD2 4.535 . 7.105 4.869 3.720 5.317 . 0 0 "[ . 1 . 2]" 1
43 1 75 LYS HA 1 75 LYS HB2 2.558 . 3.376 2.758 2.460 3.026 . 0 0 "[ . 1 . 2]" 1
44 2 75 LYS HA 2 75 LYS HB2 2.558 . 3.376 2.757 2.461 3.026 . 0 0 "[ . 1 . 2]" 1
45 1 75 LYS HA 1 75 LYS HB3 2.753 . 3.701 2.422 2.358 2.490 . 0 0 "[ . 1 . 2]" 1
46 2 75 LYS HA 2 75 LYS HB3 2.753 . 3.701 2.422 2.357 2.490 . 0 0 "[ . 1 . 2]" 1
47 1 49 VAL HA 1 49 VAL HB 2.750 . 3.695 2.447 2.409 2.496 . 0 0 "[ . 1 . 2]" 1
48 2 49 VAL HA 2 49 VAL HB 2.750 . 3.695 2.447 2.407 2.498 . 0 0 "[ . 1 . 2]" 1
49 1 77 GLN HB2 1 82 ILE MD 3.337 . 4.729 3.411 2.395 4.579 . 0 0 "[ . 1 . 2]" 1
50 2 77 GLN HB2 2 82 ILE MD 3.337 . 4.729 3.412 2.396 4.580 . 0 0 "[ . 1 . 2]" 1
51 1 88 ARG HB2 1 88 ARG QD 4.162 . 6.328 2.829 2.367 3.490 . 0 0 "[ . 1 . 2]" 1
52 2 88 ARG HB2 2 88 ARG QD 4.162 . 6.328 2.829 2.364 3.489 . 0 0 "[ . 1 . 2]" 1
53 1 61 GLU HA 1 61 GLU HB3 2.637 . 3.506 2.480 2.447 2.550 . 0 0 "[ . 1 . 2]" 1
54 2 61 GLU HA 2 61 GLU HB3 2.637 . 3.506 2.480 2.446 2.551 . 0 0 "[ . 1 . 2]" 1
55 1 38 GLU HA 1 38 GLU HB2 2.789 . 3.762 2.675 2.399 3.022 . 0 0 "[ . 1 . 2]" 1
56 2 38 GLU HA 2 38 GLU HB2 2.789 . 3.762 2.675 2.399 3.025 . 0 0 "[ . 1 . 2]" 1
57 1 33 ILE HA 1 38 GLU HB2 4.885 . 7.868 3.412 2.170 4.683 . 0 0 "[ . 1 . 2]" 1
58 2 33 ILE HA 2 38 GLU HB2 4.885 . 7.868 3.412 2.172 4.681 . 0 0 "[ . 1 . 2]" 1
59 1 35 GLU HA 1 35 GLU HB2 2.670 . 3.561 2.479 2.392 2.543 . 0 0 "[ . 1 . 2]" 1
60 2 35 GLU HA 2 35 GLU HB2 2.670 . 3.561 2.480 2.392 2.542 . 0 0 "[ . 1 . 2]" 1
61 1 21 GLU HB2 1 22 ILE HA 3.340 . 4.735 4.244 4.067 4.388 . 0 0 "[ . 1 . 2]" 1
62 2 21 GLU HB2 2 22 ILE HA 3.340 . 4.735 4.244 4.065 4.386 . 0 0 "[ . 1 . 2]" 1
63 1 20 GLU HA 1 20 GLU HB3 2.992 . 4.111 2.421 2.387 2.465 . 0 0 "[ . 1 . 2]" 1
64 2 20 GLU HA 2 20 GLU HB3 2.992 . 4.111 2.421 2.389 2.466 . 0 0 "[ . 1 . 2]" 1
65 1 63 GLU HA 1 63 GLU HB2 2.749 . 3.693 2.828 2.432 3.024 . 0 0 "[ . 1 . 2]" 1
66 2 63 GLU HA 2 63 GLU HB2 2.749 . 3.693 2.828 2.435 3.025 . 0 0 "[ . 1 . 2]" 1
67 1 37 LYS HB2 1 37 LYS HD3 2.889 . 3.933 2.881 2.422 3.713 . 0 0 "[ . 1 . 2]" 1
68 2 37 LYS HB2 2 37 LYS HD3 2.889 . 3.933 2.880 2.422 3.714 . 0 0 "[ . 1 . 2]" 1
69 1 73 GLU HA 1 75 LYS QD 3.179 . 4.442 3.688 2.731 4.392 . 0 0 "[ . 1 . 2]" 1
70 2 73 GLU HA 2 75 LYS QD 3.179 . 4.442 3.688 2.730 4.390 . 0 0 "[ . 1 . 2]" 1
71 1 37 LYS HB2 1 37 LYS HD2 3.627 . 5.271 2.882 2.397 3.729 . 0 0 "[ . 1 . 2]" 1
72 2 37 LYS HB2 2 37 LYS HD2 3.627 . 5.271 2.882 2.399 3.727 . 0 0 "[ . 1 . 2]" 1
73 1 71 LYS HA 1 71 LYS QD 3.492 . 5.016 3.401 2.010 4.527 . 0 0 "[ . 1 . 2]" 1
74 2 71 LYS HA 2 71 LYS QD 3.492 . 5.016 3.401 2.010 4.526 . 0 0 "[ . 1 . 2]" 1
75 1 73 GLU HA 1 73 GLU HB2 2.837 . 3.843 2.893 2.432 3.029 . 0 0 "[ . 1 . 2]" 1
76 2 73 GLU HA 2 73 GLU HB2 2.837 . 3.843 2.892 2.425 3.030 . 0 0 "[ . 1 . 2]" 1
77 1 90 PRO HD3 1 90 PRO HG3 2.766 . 3.722 2.306 2.261 2.323 . 0 0 "[ . 1 . 2]" 1
78 2 90 PRO HD3 2 90 PRO HG3 2.766 . 3.722 2.306 2.259 2.324 . 0 0 "[ . 1 . 2]" 1
79 1 62 ARG HA 1 62 ARG HG2 3.100 . 4.301 2.948 2.449 3.769 . 0 0 "[ . 1 . 2]" 1
80 2 62 ARG HA 2 62 ARG HG2 3.100 . 4.301 2.948 2.461 3.767 . 0 0 "[ . 1 . 2]" 1
81 1 90 PRO HD2 1 90 PRO HG2 2.974 . 4.080 2.308 2.257 2.327 . 0 0 "[ . 1 . 2]" 1
82 2 90 PRO HD2 2 90 PRO HG2 2.974 . 4.080 2.308 2.258 2.330 . 0 0 "[ . 1 . 2]" 1
83 1 62 ARG HA 1 62 ARG HG3 3.564 . 5.152 2.839 2.476 3.688 . 0 0 "[ . 1 . 2]" 1
84 2 62 ARG HA 2 62 ARG HG3 3.564 . 5.152 2.839 2.478 3.690 . 0 0 "[ . 1 . 2]" 1
85 1 88 ARG HA 1 88 ARG HG2 3.500 . 5.032 2.889 2.271 3.832 . 0 0 "[ . 1 . 2]" 1
86 2 88 ARG HA 2 88 ARG HG2 3.500 . 5.032 2.889 2.266 3.832 . 0 0 "[ . 1 . 2]" 1
87 1 69 LEU HA 1 69 LEU HG 3.213 . 4.504 3.073 2.973 3.141 . 0 0 "[ . 1 . 2]" 1
88 2 69 LEU HA 2 69 LEU HG 3.213 . 4.504 3.072 2.972 3.140 . 0 0 "[ . 1 . 2]" 1
89 1 79 LEU HB2 1 79 LEU HG 2.654 . 3.534 3.019 3.013 3.022 . 0 0 "[ . 1 . 2]" 1
90 2 79 LEU HB2 2 79 LEU HG 2.654 . 3.534 3.019 3.013 3.023 . 0 0 "[ . 1 . 2]" 1
91 1 79 LEU MD1 1 79 LEU HG 2.115 . 2.674 2.125 2.122 2.126 . 0 0 "[ . 1 . 2]" 1
92 2 79 LEU MD1 2 79 LEU HG 2.115 . 2.674 2.124 2.122 2.125 . 0 0 "[ . 1 . 2]" 1
93 1 83 LEU HA 1 83 LEU MD1 3.094 . 4.291 2.394 2.115 2.676 . 0 0 "[ . 1 . 2]" 1
94 2 83 LEU HA 2 83 LEU MD1 3.094 . 4.291 2.394 2.115 2.679 . 0 0 "[ . 1 . 2]" 1
95 1 80 ALA HA 1 83 LEU MD1 3.171 . 4.428 3.351 2.895 3.848 . 0 0 "[ . 1 . 2]" 1
96 2 80 ALA HA 2 83 LEU MD1 3.171 . 4.428 3.352 2.897 3.847 . 0 0 "[ . 1 . 2]" 1
97 1 83 LEU HB2 1 83 LEU MD1 2.545 . 3.355 2.432 2.370 2.519 . 0 0 "[ . 1 . 2]" 1
98 2 83 LEU HB2 2 83 LEU MD1 2.545 . 3.355 2.432 2.371 2.521 . 0 0 "[ . 1 . 2]" 1
99 1 83 LEU HB3 1 83 LEU MD1 3.128 . 4.351 3.209 3.194 3.219 . 0 0 "[ . 1 . 2]" 1
100 2 83 LEU HB3 2 83 LEU MD1 3.128 . 4.351 3.209 3.195 3.218 . 0 0 "[ . 1 . 2]" 1
101 1 79 LEU HG 1 83 LEU MD1 2.366 . 3.066 2.254 2.092 2.361 . 0 0 "[ . 1 . 2]" 1
102 2 79 LEU HG 2 83 LEU MD1 2.366 . 3.066 2.254 2.092 2.360 . 0 0 "[ . 1 . 2]" 1
103 1 79 LEU MD2 1 83 LEU MD1 2.538 . 3.343 3.367 3.221 3.403 0.060 19 0 "[ . 1 . 2]" 1
104 2 79 LEU MD2 2 83 LEU MD1 2.538 . 3.343 3.367 3.223 3.403 0.060 19 0 "[ . 1 . 2]" 1
105 1 19 LYS HA 1 19 LYS HG2 3.619 . 5.256 2.897 2.488 3.729 . 0 0 "[ . 1 . 2]" 1
106 2 19 LYS HA 2 19 LYS HG2 3.619 . 5.256 2.898 2.490 3.732 . 0 0 "[ . 1 . 2]" 1
107 1 29 TYR HB3 1 79 LEU MD2 3.461 . 4.958 2.913 2.563 3.252 . 0 0 "[ . 1 . 2]" 1
108 2 29 TYR HB3 2 79 LEU MD2 3.461 . 4.958 2.912 2.562 3.251 . 0 0 "[ . 1 . 2]" 1
109 1 79 LEU MD2 1 79 LEU HG 2.072 . 2.609 2.125 2.123 2.127 . 0 0 "[ . 1 . 2]" 1
110 2 79 LEU MD2 2 79 LEU HG 2.072 . 2.609 2.125 2.123 2.128 . 0 0 "[ . 1 . 2]" 1
111 1 26 ILE HA 1 79 LEU MD2 2.552 . 3.366 2.138 1.867 2.515 . 0 0 "[ . 1 . 2]" 1
112 2 26 ILE HA 2 79 LEU MD2 2.552 . 3.366 2.138 1.866 2.513 . 0 0 "[ . 1 . 2]" 1
113 1 79 LEU HB2 1 79 LEU MD2 2.424 . 3.159 2.430 2.399 2.467 . 0 0 "[ . 1 . 2]" 1
114 2 79 LEU HB2 2 79 LEU MD2 2.424 . 3.159 2.430 2.399 2.467 . 0 0 "[ . 1 . 2]" 1
115 1 79 LEU HB3 1 79 LEU MD2 2.568 . 3.392 2.289 2.262 2.314 . 0 0 "[ . 1 . 2]" 1
116 2 79 LEU HB3 2 79 LEU MD2 2.568 . 3.392 2.289 2.263 2.315 . 0 0 "[ . 1 . 2]" 1
117 1 25 LEU HB3 1 25 LEU MD1 2.588 . 3.425 2.368 2.302 2.446 . 0 0 "[ . 1 . 2]" 1
118 2 25 LEU HB3 2 25 LEU MD1 2.588 . 3.425 2.368 2.303 2.443 . 0 0 "[ . 1 . 2]" 1
119 1 25 LEU MD1 1 25 LEU HG 2.112 . 2.669 2.125 2.122 2.127 . 0 0 "[ . 1 . 2]" 1
120 2 25 LEU MD1 2 25 LEU HG 2.112 . 2.669 2.125 2.122 2.127 . 0 0 "[ . 1 . 2]" 1
121 1 28 ASN HB2 1 69 LEU MD1 2.328 . 3.005 2.419 2.122 2.819 . 0 0 "[ . 1 . 2]" 1
122 2 28 ASN HB2 2 69 LEU MD1 2.328 . 3.005 2.419 2.121 2.819 . 0 0 "[ . 1 . 2]" 1
123 1 69 LEU HB2 1 69 LEU MD1 2.376 . 3.081 2.337 2.280 2.378 . 0 0 "[ . 1 . 2]" 1
124 2 69 LEU HB2 2 69 LEU MD1 2.376 . 3.081 2.337 2.280 2.378 . 0 0 "[ . 1 . 2]" 1
125 1 69 LEU MD1 1 69 LEU HG 1.850 . 2.278 2.124 2.120 2.126 . 0 0 "[ . 1 . 2]" 1
126 2 69 LEU MD1 2 69 LEU HG 1.850 . 2.278 2.124 2.120 2.126 . 0 0 "[ . 1 . 2]" 1
127 1 69 LEU HB3 1 69 LEU MD1 2.449 . 3.199 2.384 2.328 2.451 . 0 0 "[ . 1 . 2]" 1
128 2 69 LEU HB3 2 69 LEU MD1 2.449 . 3.199 2.384 2.327 2.449 . 0 0 "[ . 1 . 2]" 1
129 1 24 ALA MB 1 69 LEU MD1 2.419 . 3.151 3.061 2.773 3.186 0.035 7 0 "[ . 1 . 2]" 1
130 2 24 ALA MB 2 69 LEU MD1 2.419 . 3.151 3.061 2.773 3.186 0.035 7 0 "[ . 1 . 2]" 1
131 1 25 LEU MD2 1 69 LEU MD1 2.172 . 2.762 2.755 2.324 2.842 0.080 5 0 "[ . 1 . 2]" 1
132 2 25 LEU MD2 2 69 LEU MD1 2.172 . 2.762 2.755 2.325 2.844 0.082 5 0 "[ . 1 . 2]" 1
133 1 30 PHE HA 1 47 LEU MD1 3.335 . 4.725 2.843 2.613 3.135 . 0 0 "[ . 1 . 2]" 1
134 2 30 PHE HA 2 47 LEU MD1 3.335 . 4.725 2.843 2.612 3.136 . 0 0 "[ . 1 . 2]" 1
135 1 47 LEU MD1 1 47 LEU HG 1.844 . 2.269 2.127 2.124 2.130 . 0 0 "[ . 1 . 2]" 1
136 2 47 LEU MD1 2 47 LEU HG 1.844 . 2.269 2.127 2.124 2.129 . 0 0 "[ . 1 . 2]" 1
137 1 47 LEU MD1 1 47 LEU MD2 1.749 . 2.132 2.083 2.080 2.085 . 0 0 "[ . 1 . 2]" 1
138 2 47 LEU MD1 2 47 LEU MD2 1.749 . 2.132 2.083 2.080 2.085 . 0 0 "[ . 1 . 2]" 1
139 1 71 LYS HA 1 71 LYS HG3 3.527 . 5.082 3.048 2.535 3.799 . 0 0 "[ . 1 . 2]" 1
140 2 71 LYS HA 2 71 LYS HG3 3.527 . 5.082 3.048 2.536 3.803 . 0 0 "[ . 1 . 2]" 1
141 1 71 LYS QE 1 71 LYS HG3 3.373 . 4.795 2.794 2.367 3.519 . 0 0 "[ . 1 . 2]" 1
142 2 71 LYS QE 2 71 LYS HG3 3.373 . 4.795 2.794 2.368 3.517 . 0 0 "[ . 1 . 2]" 1
143 1 71 LYS HB2 1 71 LYS HG3 2.827 . 3.826 2.540 2.365 3.011 . 0 0 "[ . 1 . 2]" 1
144 2 71 LYS HB2 2 71 LYS HG3 2.827 . 3.826 2.540 2.366 3.012 . 0 0 "[ . 1 . 2]" 1
145 1 71 LYS HA 1 71 LYS HG2 3.232 . 4.538 3.153 2.545 3.804 . 0 0 "[ . 1 . 2]" 1
146 2 71 LYS HA 2 71 LYS HG2 3.232 . 4.538 3.154 2.544 3.805 . 0 0 "[ . 1 . 2]" 1
147 1 75 LYS HA 1 75 LYS HG2 3.241 . 4.554 3.232 2.417 3.720 . 0 0 "[ . 1 . 2]" 1
148 2 75 LYS HA 2 75 LYS HG2 3.241 . 4.554 3.231 2.415 3.718 . 0 0 "[ . 1 . 2]" 1
149 1 75 LYS HA 1 75 LYS HG3 3.725 . 5.459 3.606 2.801 4.260 . 0 0 "[ . 1 . 2]" 1
150 2 75 LYS HA 2 75 LYS HG3 3.725 . 5.459 3.605 2.799 4.261 . 0 0 "[ . 1 . 2]" 1
151 1 75 LYS QE 1 75 LYS HG3 3.155 . 4.399 2.781 2.341 3.528 . 0 0 "[ . 1 . 2]" 1
152 2 75 LYS QE 2 75 LYS HG3 3.155 . 4.399 2.781 2.344 3.528 . 0 0 "[ . 1 . 2]" 1
153 1 75 LYS QD 1 75 LYS HG3 3.028 . 4.174 2.298 2.167 2.388 . 0 0 "[ . 1 . 2]" 1
154 2 75 LYS QD 2 75 LYS HG3 3.028 . 4.174 2.298 2.166 2.389 . 0 0 "[ . 1 . 2]" 1
155 1 25 LEU MD2 1 74 PHE QD 4.218 . 6.442 3.736 3.369 4.513 . 0 0 "[ . 1 . 2]" 1
156 2 25 LEU MD2 2 74 PHE QD 4.218 . 6.442 3.736 3.371 4.512 . 0 0 "[ . 1 . 2]" 1
157 1 25 LEU MD2 1 78 HIS HA 3.269 . 4.604 3.364 2.527 4.632 0.028 9 0 "[ . 1 . 2]" 1
158 2 25 LEU MD2 2 78 HIS HA 3.269 . 4.604 3.364 2.529 4.633 0.029 9 0 "[ . 1 . 2]" 1
159 1 25 LEU MD2 1 74 PHE HB2 3.467 . 4.970 3.045 2.229 4.412 . 0 0 "[ . 1 . 2]" 1
160 2 25 LEU MD2 2 74 PHE HB2 3.467 . 4.970 3.045 2.230 4.412 . 0 0 "[ . 1 . 2]" 1
161 1 25 LEU MD2 1 25 LEU HG 1.943 . 2.415 2.131 2.129 2.133 . 0 0 "[ . 1 . 2]" 1
162 2 25 LEU MD2 2 25 LEU HG 1.943 . 2.415 2.131 2.129 2.133 . 0 0 "[ . 1 . 2]" 1
163 1 25 LEU MD1 1 25 LEU MD2 1.725 . 2.097 2.081 2.076 2.089 . 0 0 "[ . 1 . 2]" 1
164 2 25 LEU MD1 2 25 LEU MD2 1.725 . 2.097 2.081 2.076 2.090 . 0 0 "[ . 1 . 2]" 1
165 1 79 LEU HA 1 79 LEU MD1 2.210 . 2.820 2.094 2.038 2.173 . 0 0 "[ . 1 . 2]" 1
166 2 79 LEU HA 2 79 LEU MD1 2.210 . 2.820 2.094 2.039 2.171 . 0 0 "[ . 1 . 2]" 1
167 1 25 LEU HG 1 79 LEU MD1 3.215 . 4.507 4.274 3.995 4.474 . 0 0 "[ . 1 . 2]" 1
168 2 25 LEU HG 2 79 LEU MD1 3.215 . 4.507 4.274 3.994 4.474 . 0 0 "[ . 1 . 2]" 1
169 1 69 LEU MD2 1 74 PHE QD 3.619 . 5.256 3.627 2.177 4.698 . 0 0 "[ . 1 . 2]" 1
170 2 69 LEU MD2 2 74 PHE QD 3.619 . 5.256 3.628 2.177 4.697 . 0 0 "[ . 1 . 2]" 1
171 1 69 LEU HA 1 69 LEU MD2 2.133 . 2.702 1.992 1.921 2.060 . 0 0 "[ . 1 . 2]" 1
172 2 69 LEU HA 2 69 LEU MD2 2.133 . 2.702 1.992 1.920 2.058 . 0 0 "[ . 1 . 2]" 1
173 1 25 LEU HA 1 69 LEU MD2 2.608 . 3.458 2.965 2.564 3.468 0.010 2 0 "[ . 1 . 2]" 1
174 2 25 LEU HA 2 69 LEU MD2 2.608 . 3.458 2.964 2.561 3.467 0.009 2 0 "[ . 1 . 2]" 1
175 1 69 LEU MD2 1 74 PHE HB2 2.716 . 3.638 2.810 2.012 3.647 0.009 12 0 "[ . 1 . 2]" 1
176 2 69 LEU MD2 2 74 PHE HB2 2.716 . 3.638 2.811 2.014 3.648 0.010 12 0 "[ . 1 . 2]" 1
177 1 69 LEU HB2 1 69 LEU MD2 2.849 . 3.863 3.198 3.195 3.203 . 0 0 "[ . 1 . 2]" 1
178 2 69 LEU HB2 2 69 LEU MD2 2.849 . 3.863 3.198 3.195 3.202 . 0 0 "[ . 1 . 2]" 1
179 1 25 LEU MD1 1 69 LEU MD2 2.959 . 4.054 3.522 3.238 3.837 . 0 0 "[ . 1 . 2]" 1
180 2 25 LEU MD1 2 69 LEU MD2 2.959 . 4.054 3.522 3.239 3.838 . 0 0 "[ . 1 . 2]" 1
181 1 83 LEU HA 1 83 LEU MD2 2.883 . 3.922 3.793 3.767 3.812 . 0 0 "[ . 1 . 2]" 1
182 2 83 LEU HA 2 83 LEU MD2 2.883 . 3.922 3.793 3.768 3.813 . 0 0 "[ . 1 . 2]" 1
183 1 47 LEU HB2 1 47 LEU MD2 3.180 . 4.444 3.197 3.192 3.204 . 0 0 "[ . 1 . 2]" 1
184 2 47 LEU HB2 2 47 LEU MD2 3.180 . 4.444 3.197 3.193 3.203 . 0 0 "[ . 1 . 2]" 1
185 1 60 PHE QD 1 64 ALA MB 4.337 . 6.689 2.873 2.344 3.379 . 0 0 "[ . 1 . 2]" 1
186 2 60 PHE QD 2 64 ALA MB 4.337 . 6.689 2.874 2.346 3.379 . 0 0 "[ . 1 . 2]" 1
187 1 60 PHE HB2 1 64 ALA MB 2.432 . 3.171 2.850 1.969 3.202 0.031 4 0 "[ . 1 . 2]" 1
188 2 60 PHE HB2 2 64 ALA MB 2.432 . 3.171 2.850 1.973 3.204 0.033 4 0 "[ . 1 . 2]" 1
189 1 60 PHE HB3 1 64 ALA MB 4.084 . 6.169 4.324 3.393 4.710 . 0 0 "[ . 1 . 2]" 1
190 2 60 PHE HB3 2 64 ALA MB 4.084 . 6.169 4.325 3.396 4.711 . 0 0 "[ . 1 . 2]" 1
191 1 61 GLU HB2 1 64 ALA MB 3.090 . 4.283 2.611 1.975 3.179 . 0 0 "[ . 1 . 2]" 1
192 2 61 GLU HB2 2 64 ALA MB 3.090 . 4.283 2.611 1.976 3.180 . 0 0 "[ . 1 . 2]" 1
193 1 17 ALA MB 1 74 PHE QE 3.802 . 5.609 3.314 1.964 3.925 0.031 18 0 "[ . 1 . 2]" 1
194 2 17 ALA MB 2 74 PHE QE 3.802 . 5.609 3.313 1.962 3.925 0.033 18 0 "[ . 1 . 2]" 1
195 1 17 ALA MB 1 74 PHE HZ 2.681 . 3.579 2.609 1.935 3.440 . 0 0 "[ . 1 . 2]" 1
196 2 17 ALA MB 2 74 PHE HZ 2.681 . 3.579 2.609 1.933 3.439 . 0 0 "[ . 1 . 2]" 1
197 1 17 ALA HA 1 17 ALA MB 1.906 . 2.360 2.128 2.121 2.134 . 0 0 "[ . 1 . 2]" 1
198 2 17 ALA HA 2 17 ALA MB 1.906 . 2.360 2.128 2.120 2.135 . 0 0 "[ . 1 . 2]" 1
199 1 17 ALA MB 1 21 GLU HB3 3.960 . 5.920 4.802 3.433 5.803 . 0 0 "[ . 1 . 2]" 1
200 2 17 ALA MB 2 21 GLU HB3 3.960 . 5.920 4.802 3.434 5.805 . 0 0 "[ . 1 . 2]" 1
201 1 86 ALA HA 1 86 ALA MB 1.840 . 2.263 2.128 2.118 2.132 . 0 0 "[ . 1 . 2]" 1
202 2 86 ALA HA 2 86 ALA MB 1.840 . 2.263 2.128 2.119 2.133 . 0 0 "[ . 1 . 2]" 1
203 1 83 LEU HA 1 86 ALA MB 2.678 . 3.575 2.687 2.021 3.292 . 0 0 "[ . 1 . 2]" 1
204 2 83 LEU HA 2 86 ALA MB 2.678 . 3.575 2.687 2.019 3.295 . 0 0 "[ . 1 . 2]" 1
205 1 41 GLU HA 1 44 ALA MB 2.542 . 3.350 2.609 2.118 2.909 . 0 0 "[ . 1 . 2]" 1
206 2 41 GLU HA 2 44 ALA MB 2.542 . 3.350 2.609 2.116 2.907 . 0 0 "[ . 1 . 2]" 1
207 1 34 VAL HA 1 44 ALA MB 3.099 . 4.300 3.696 3.167 4.074 . 0 0 "[ . 1 . 2]" 1
208 2 34 VAL HA 2 44 ALA MB 3.099 . 4.300 3.696 3.168 4.074 . 0 0 "[ . 1 . 2]" 1
209 1 34 VAL HB 1 44 ALA MB 2.935 . 4.012 3.145 2.668 3.645 . 0 0 "[ . 1 . 2]" 1
210 2 34 VAL HB 2 44 ALA MB 2.935 . 4.012 3.144 2.667 3.643 . 0 0 "[ . 1 . 2]" 1
211 1 31 SER HA 1 51 MET ME 3.370 . 4.790 3.498 2.927 4.094 . 0 0 "[ . 1 . 2]" 1
212 2 31 SER HA 2 51 MET ME 3.370 . 4.790 3.499 2.926 4.096 . 0 0 "[ . 1 . 2]" 1
213 1 30 PHE HB2 1 51 MET ME 2.580 . 3.412 1.931 1.841 2.090 . 0 0 "[ . 1 . 2]" 1
214 2 30 PHE HB2 2 51 MET ME 2.580 . 3.412 1.932 1.840 2.091 . 0 0 "[ . 1 . 2]" 1
215 1 51 MET HB2 1 51 MET ME 2.188 . 2.786 1.910 1.800 2.002 . 0 0 "[ . 1 . 2]" 1
216 2 51 MET HB2 2 51 MET ME 2.188 . 2.786 1.909 1.799 2.001 . 0 0 "[ . 1 . 2]" 1
217 1 47 LEU HB2 1 51 MET ME 3.693 . 5.398 4.058 3.845 4.230 . 0 0 "[ . 1 . 2]" 1
218 2 47 LEU HB2 2 51 MET ME 3.693 . 5.398 4.058 3.845 4.233 . 0 0 "[ . 1 . 2]" 1
219 1 47 LEU MD1 1 51 MET ME 3.082 . 4.269 3.749 3.504 3.930 . 0 0 "[ . 1 . 2]" 1
220 2 47 LEU MD1 2 51 MET ME 3.082 . 4.269 3.749 3.504 3.930 . 0 0 "[ . 1 . 2]" 1
221 1 47 LEU MD2 1 51 MET ME 2.633 . 3.500 3.549 3.365 3.595 0.095 7 0 "[ . 1 . 2]" 1
222 2 47 LEU MD2 2 51 MET ME 2.633 . 3.500 3.549 3.365 3.595 0.095 7 0 "[ . 1 . 2]" 1
223 1 50 ALA MB 1 54 ILE MD 2.805 . 3.788 2.936 2.210 3.259 . 0 0 "[ . 1 . 2]" 1
224 2 50 ALA MB 2 54 ILE MD 2.805 . 3.788 2.936 2.210 3.258 . 0 0 "[ . 1 . 2]" 1
225 1 47 LEU MD2 1 50 ALA MB 2.352 . 3.044 2.955 2.617 3.072 0.028 15 0 "[ . 1 . 2]" 1
226 2 47 LEU MD2 2 50 ALA MB 2.352 . 3.044 2.955 2.617 3.072 0.028 15 0 "[ . 1 . 2]" 1
227 1 41 GLU QG 1 44 ALA MB 4.166 . 6.336 4.429 3.625 5.207 . 0 0 "[ . 1 . 2]" 1
228 2 41 GLU QG 2 44 ALA MB 4.166 . 6.336 4.429 3.626 5.206 . 0 0 "[ . 1 . 2]" 1
229 1 39 ILE MD 1 44 ALA MB 3.047 . 4.208 3.803 3.086 3.984 . 0 0 "[ . 1 . 2]" 1
230 2 39 ILE MD 2 44 ALA MB 3.047 . 4.208 3.803 3.087 3.981 . 0 0 "[ . 1 . 2]" 1
231 1 24 ALA MB 1 60 PHE HZ 3.656 . 5.327 4.626 4.119 5.019 . 0 0 "[ . 1 . 2]" 1
232 2 24 ALA MB 2 60 PHE HZ 3.656 . 5.327 4.625 4.119 5.018 . 0 0 "[ . 1 . 2]" 1
233 1 24 ALA MB 1 69 LEU HA 3.521 . 5.070 3.875 3.524 4.148 . 0 0 "[ . 1 . 2]" 1
234 2 24 ALA MB 2 69 LEU HA 3.521 . 5.070 3.874 3.524 4.148 . 0 0 "[ . 1 . 2]" 1
235 1 24 ALA HA 1 24 ALA MB 2.060 . 2.590 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
236 2 24 ALA HA 2 24 ALA MB 2.060 . 2.590 2.129 2.126 2.132 . 0 0 "[ . 1 . 2]" 1
237 1 21 GLU HA 1 24 ALA MB 2.198 . 2.802 2.634 2.374 2.811 0.009 6 0 "[ . 1 . 2]" 1
238 2 21 GLU HA 2 24 ALA MB 2.198 . 2.802 2.633 2.377 2.809 0.007 6 0 "[ . 1 . 2]" 1
239 1 24 ALA MB 1 65 VAL HA 2.904 . 3.958 3.188 2.871 3.581 . 0 0 "[ . 1 . 2]" 1
240 2 24 ALA MB 2 65 VAL HA 2.904 . 3.958 3.187 2.872 3.581 . 0 0 "[ . 1 . 2]" 1
241 1 24 ALA MB 1 65 VAL HB 3.530 . 5.087 4.045 3.702 4.266 . 0 0 "[ . 1 . 2]" 1
242 2 24 ALA MB 2 65 VAL HB 3.530 . 5.087 4.045 3.701 4.265 . 0 0 "[ . 1 . 2]" 1
243 1 24 ALA MB 1 68 ILE MD 2.146 . 2.722 2.541 2.292 2.773 0.051 12 0 "[ . 1 . 2]" 1
244 2 24 ALA MB 2 68 ILE MD 2.146 . 2.722 2.541 2.293 2.773 0.051 12 0 "[ . 1 . 2]" 1
245 1 23 ALA HA 1 26 ILE MD 2.366 . 3.066 2.125 2.011 2.393 . 0 0 "[ . 1 . 2]" 1
246 2 23 ALA HA 2 26 ILE MD 2.366 . 3.066 2.125 2.011 2.390 . 0 0 "[ . 1 . 2]" 1
247 1 51 MET HA 1 54 ILE MD 2.555 . 3.371 2.292 1.882 3.114 . 0 0 "[ . 1 . 2]" 1
248 2 51 MET HA 2 54 ILE MD 2.555 . 3.371 2.292 1.881 3.114 . 0 0 "[ . 1 . 2]" 1
249 1 54 ILE HA 1 54 ILE MD 3.770 . 5.546 3.900 3.858 3.920 . 0 0 "[ . 1 . 2]" 1
250 2 54 ILE HA 2 54 ILE MD 3.770 . 5.546 3.900 3.859 3.918 . 0 0 "[ . 1 . 2]" 1
251 1 51 MET ME 1 54 ILE MD 2.271 . 2.916 3.061 2.975 3.163 0.247 10 0 "[ . 1 . 2]" 1
252 2 51 MET ME 2 54 ILE MD 2.271 . 2.916 3.061 2.975 3.163 0.247 10 0 "[ . 1 . 2]" 1
253 1 54 ILE HB 1 54 ILE MD 2.302 . 2.964 2.389 2.361 2.413 . 0 0 "[ . 1 . 2]" 1
254 2 54 ILE HB 2 54 ILE MD 2.302 . 2.964 2.390 2.361 2.412 . 0 0 "[ . 1 . 2]" 1
255 1 74 PHE QD 1 82 ILE MD 3.453 . 4.943 2.527 1.956 4.705 0.007 20 0 "[ . 1 . 2]" 1
256 2 74 PHE QD 2 82 ILE MD 3.453 . 4.943 2.527 1.955 4.703 0.008 11 0 "[ . 1 . 2]" 1
257 1 79 LEU HA 1 82 ILE MD 2.571 . 3.397 2.419 2.181 2.852 . 0 0 "[ . 1 . 2]" 1
258 2 79 LEU HA 2 82 ILE MD 2.571 . 3.397 2.419 2.181 2.853 . 0 0 "[ . 1 . 2]" 1
259 1 79 LEU MD1 1 82 ILE MD 2.534 . 3.336 2.933 2.221 3.295 . 0 0 "[ . 1 . 2]" 1
260 2 79 LEU MD1 2 82 ILE MD 2.534 . 3.336 2.933 2.222 3.294 . 0 0 "[ . 1 . 2]" 1
261 1 82 ILE MD 1 83 LEU MD1 2.873 . 3.905 3.852 3.443 3.956 0.051 9 0 "[ . 1 . 2]" 1
262 2 82 ILE MD 2 83 LEU MD1 2.873 . 3.905 3.852 3.444 3.956 0.051 9 0 "[ . 1 . 2]" 1
263 1 25 LEU MD1 1 82 ILE MD 1.897 . 2.347 2.029 1.942 2.305 . 0 0 "[ . 1 . 2]" 1
264 2 25 LEU MD1 2 82 ILE MD 1.897 . 2.347 2.029 1.942 2.305 . 0 0 "[ . 1 . 2]" 1
265 1 39 ILE MD 1 44 ALA HA 2.454 . 3.207 3.099 2.168 3.272 0.065 11 0 "[ . 1 . 2]" 1
266 2 39 ILE MD 2 44 ALA HA 2.454 . 3.207 3.099 2.169 3.273 0.066 11 0 "[ . 1 . 2]" 1
267 1 60 PHE HB2 1 68 ILE MD 2.709 . 3.627 2.566 2.180 3.302 . 0 0 "[ . 1 . 2]" 1
268 2 60 PHE HB2 2 68 ILE MD 2.709 . 3.627 2.566 2.182 3.303 . 0 0 "[ . 1 . 2]" 1
269 1 64 ALA MB 1 68 ILE MD 2.808 . 3.793 3.194 2.727 3.537 . 0 0 "[ . 1 . 2]" 1
270 2 64 ALA MB 2 68 ILE MD 2.808 . 3.793 3.194 2.726 3.535 . 0 0 "[ . 1 . 2]" 1
271 1 22 ILE HA 1 22 ILE MD 3.897 . 5.795 3.866 3.821 3.896 . 0 0 "[ . 1 . 2]" 1
272 2 22 ILE HA 2 22 ILE MD 3.897 . 5.795 3.866 3.821 3.896 . 0 0 "[ . 1 . 2]" 1
273 1 22 ILE HB 1 22 ILE MD 2.301 . 2.963 2.360 2.321 2.394 . 0 0 "[ . 1 . 2]" 1
274 2 22 ILE HB 2 22 ILE MD 2.301 . 2.963 2.361 2.322 2.397 . 0 0 "[ . 1 . 2]" 1
275 1 17 ALA MB 1 22 ILE MD 2.187 . 2.785 2.381 2.000 2.800 0.015 19 0 "[ . 1 . 2]" 1
276 2 17 ALA MB 2 22 ILE MD 2.187 . 2.785 2.381 2.002 2.801 0.016 19 0 "[ . 1 . 2]" 1
277 1 29 TYR QE 1 33 ILE MD 3.328 . 4.713 2.508 2.268 2.724 . 0 0 "[ . 1 . 2]" 1
278 2 29 TYR QE 2 33 ILE MD 3.328 . 4.713 2.507 2.269 2.725 . 0 0 "[ . 1 . 2]" 1
279 1 30 PHE HA 1 33 ILE MD 2.571 . 3.397 2.186 2.063 2.503 . 0 0 "[ . 1 . 2]" 1
280 2 30 PHE HA 2 33 ILE MD 2.571 . 3.397 2.186 2.064 2.501 . 0 0 "[ . 1 . 2]" 1
281 1 33 ILE HA 1 33 ILE MD 3.446 . 4.930 3.838 3.770 3.918 . 0 0 "[ . 1 . 2]" 1
282 2 33 ILE HA 2 33 ILE MD 3.446 . 4.930 3.839 3.772 3.920 . 0 0 "[ . 1 . 2]" 1
283 1 33 ILE MD 1 47 LEU MD1 2.253 . 2.888 2.586 2.327 2.917 0.029 20 0 "[ . 1 . 2]" 1
284 2 33 ILE MD 2 47 LEU MD1 2.253 . 2.888 2.586 2.328 2.915 0.027 20 0 "[ . 1 . 2]" 1
285 1 33 ILE MD 1 39 ILE MD 2.371 . 3.074 3.122 3.059 3.176 0.102 2 0 "[ . 1 . 2]" 1
286 2 33 ILE MD 2 39 ILE MD 2.371 . 3.074 3.122 3.060 3.176 0.102 2 0 "[ . 1 . 2]" 1
287 1 25 LEU HB2 1 25 LEU HG 2.678 . 3.574 2.473 2.422 2.533 . 0 0 "[ . 1 . 2]" 1
288 2 25 LEU HB2 2 25 LEU HG 2.678 . 3.574 2.474 2.420 2.535 . 0 0 "[ . 1 . 2]" 1
289 1 25 LEU HB2 1 25 LEU MD1 2.874 . 3.906 2.310 2.260 2.358 . 0 0 "[ . 1 . 2]" 1
290 2 25 LEU HB2 2 25 LEU MD1 2.874 . 3.906 2.309 2.259 2.358 . 0 0 "[ . 1 . 2]" 1
291 1 69 LEU HB2 1 69 LEU HG 2.884 . 3.924 2.463 2.425 2.501 . 0 0 "[ . 1 . 2]" 1
292 2 69 LEU HB2 2 69 LEU HG 2.884 . 3.924 2.463 2.426 2.500 . 0 0 "[ . 1 . 2]" 1
293 1 47 LEU HB2 1 47 LEU MD1 2.640 . 3.511 2.351 2.326 2.395 . 0 0 "[ . 1 . 2]" 1
294 2 47 LEU HB2 2 47 LEU MD1 2.640 . 3.511 2.351 2.323 2.394 . 0 0 "[ . 1 . 2]" 1
295 1 39 ILE HB 1 39 ILE MD 2.299 . 2.960 2.355 2.318 2.416 . 0 0 "[ . 1 . 2]" 1
296 2 39 ILE HB 2 39 ILE MD 2.299 . 2.960 2.355 2.316 2.418 . 0 0 "[ . 1 . 2]" 1
297 1 47 LEU HB3 1 47 LEU MD1 2.760 . 3.712 2.354 2.294 2.391 . 0 0 "[ . 1 . 2]" 1
298 2 47 LEU HB3 2 47 LEU MD1 2.760 . 3.712 2.354 2.296 2.389 . 0 0 "[ . 1 . 2]" 1
299 1 47 LEU HA 1 47 LEU HB3 2.980 . 4.090 2.532 2.505 2.567 . 0 0 "[ . 1 . 2]" 1
300 2 47 LEU HA 2 47 LEU HB3 2.980 . 4.090 2.532 2.504 2.567 . 0 0 "[ . 1 . 2]" 1
301 1 28 ASN HA 1 28 ASN HB2 2.190 . 2.790 2.452 2.366 2.526 . 0 0 "[ . 1 . 2]" 1
302 2 28 ASN HA 2 28 ASN HB2 2.190 . 2.790 2.452 2.365 2.525 . 0 0 "[ . 1 . 2]" 1
303 1 83 LEU HB3 1 83 LEU HG 2.611 . 3.463 2.439 2.372 2.490 . 0 0 "[ . 1 . 2]" 1
304 2 83 LEU HB3 2 83 LEU HG 2.611 . 3.463 2.439 2.372 2.490 . 0 0 "[ . 1 . 2]" 1
305 1 83 LEU HB3 1 83 LEU MD2 2.661 . 3.546 2.349 2.290 2.437 . 0 0 "[ . 1 . 2]" 1
306 2 83 LEU HB3 2 83 LEU MD2 2.661 . 3.546 2.349 2.289 2.439 . 0 0 "[ . 1 . 2]" 1
307 1 47 LEU HB3 1 47 LEU MD2 2.776 . 3.739 2.374 2.329 2.441 . 0 0 "[ . 1 . 2]" 1
308 2 47 LEU HB3 2 47 LEU MD2 2.776 . 3.739 2.374 2.332 2.439 . 0 0 "[ . 1 . 2]" 1
309 1 72 SER HA 1 72 SER HB2 2.986 . 4.100 2.760 2.434 3.031 . 0 0 "[ . 1 . 2]" 1
310 2 72 SER HA 2 72 SER HB2 2.986 . 4.100 2.760 2.434 3.032 . 0 0 "[ . 1 . 2]" 1
311 1 18 SER HA 1 18 SER HB2 2.670 . 3.561 2.809 2.472 3.029 . 0 0 "[ . 1 . 2]" 1
312 2 18 SER HA 2 18 SER HB2 2.670 . 3.561 2.810 2.475 3.028 . 0 0 "[ . 1 . 2]" 1
313 1 53 CYS HA 1 53 CYS HB2 2.790 . 3.763 2.931 2.328 3.026 . 0 0 "[ . 1 . 2]" 1
314 2 53 CYS HA 2 53 CYS HB2 2.790 . 3.763 2.931 2.329 3.025 . 0 0 "[ . 1 . 2]" 1
315 1 53 CYS HA 1 56 GLU QG 4.597 . 7.238 4.427 3.837 4.986 . 0 0 "[ . 1 . 2]" 1
316 2 53 CYS HA 2 56 GLU QG 4.597 . 7.238 4.427 3.836 4.986 . 0 0 "[ . 1 . 2]" 1
317 1 53 CYS HA 1 56 GLU HB3 2.951 . 4.040 2.775 2.216 3.414 . 0 0 "[ . 1 . 2]" 1
318 2 53 CYS HA 2 56 GLU HB3 2.951 . 4.040 2.776 2.217 3.416 . 0 0 "[ . 1 . 2]" 1
319 1 53 CYS HA 1 56 GLU HB2 3.807 . 5.618 3.741 3.132 4.488 . 0 0 "[ . 1 . 2]" 1
320 2 53 CYS HA 2 56 GLU HB2 3.807 . 5.618 3.741 3.131 4.487 . 0 0 "[ . 1 . 2]" 1
321 1 60 PHE HB2 1 60 PHE QD 3.278 . 4.621 2.348 2.254 2.443 . 0 0 "[ . 1 . 2]" 1
322 2 60 PHE HB2 2 60 PHE QD 3.278 . 4.621 2.348 2.256 2.443 . 0 0 "[ . 1 . 2]" 1
323 1 60 PHE HB3 1 60 PHE QD 3.259 . 4.586 2.443 2.340 2.605 . 0 0 "[ . 1 . 2]" 1
324 2 60 PHE HB3 2 60 PHE QD 3.259 . 4.586 2.443 2.341 2.603 . 0 0 "[ . 1 . 2]" 1
325 1 58 PHE HB2 1 60 PHE QD 3.815 . 5.635 2.287 2.064 2.894 . 0 0 "[ . 1 . 2]" 1
326 2 58 PHE HB2 2 60 PHE QD 3.815 . 5.635 2.288 2.063 2.895 . 0 0 "[ . 1 . 2]" 1
327 1 60 PHE QD 1 68 ILE MD 3.327 . 4.710 2.807 2.402 2.998 . 0 0 "[ . 1 . 2]" 1
328 2 60 PHE QD 2 68 ILE MD 3.327 . 4.710 2.807 2.400 2.997 . 0 0 "[ . 1 . 2]" 1
329 1 29 TYR HB3 1 29 TYR QD 3.789 . 5.583 2.283 2.272 2.292 . 0 0 "[ . 1 . 2]" 1
330 2 29 TYR HB3 2 29 TYR QD 3.789 . 5.583 2.284 2.274 2.291 . 0 0 "[ . 1 . 2]" 1
331 1 29 TYR HB2 1 29 TYR QD 3.815 . 5.634 2.630 2.565 2.684 . 0 0 "[ . 1 . 2]" 1
332 2 29 TYR HB2 2 29 TYR QD 3.815 . 5.634 2.630 2.565 2.683 . 0 0 "[ . 1 . 2]" 1
333 1 90 PRO HA 1 90 PRO HB3 2.979 . 4.089 2.280 2.260 2.318 . 0 0 "[ . 1 . 2]" 1
334 2 90 PRO HA 2 90 PRO HB3 2.979 . 4.089 2.281 2.259 2.320 . 0 0 "[ . 1 . 2]" 1
335 1 58 PHE HB3 1 58 PHE QD 3.530 . 5.088 2.298 2.273 2.337 . 0 0 "[ . 1 . 2]" 1
336 2 58 PHE HB3 2 58 PHE QD 3.530 . 5.088 2.299 2.272 2.338 . 0 0 "[ . 1 . 2]" 1
337 1 54 ILE HA 1 58 PHE QD 4.308 . 6.628 3.255 2.625 3.773 . 0 0 "[ . 1 . 2]" 1
338 2 54 ILE HA 2 58 PHE QD 4.308 . 6.628 3.254 2.624 3.773 . 0 0 "[ . 1 . 2]" 1
339 1 58 PHE HB2 1 58 PHE QD 3.458 . 4.952 2.497 2.442 2.553 . 0 0 "[ . 1 . 2]" 1
340 2 58 PHE HB2 2 58 PHE QD 3.458 . 4.952 2.496 2.443 2.552 . 0 0 "[ . 1 . 2]" 1
341 1 46 SER HA 1 49 VAL HB 3.311 . 4.681 4.528 4.191 4.717 0.036 1 0 "[ . 1 . 2]" 1
342 2 46 SER HA 2 49 VAL HB 3.311 . 4.681 4.528 4.193 4.715 0.034 1 0 "[ . 1 . 2]" 1
343 1 28 ASN HA 1 31 SER QB 3.512 . 5.054 2.790 2.290 3.906 . 0 0 "[ . 1 . 2]" 1
344 2 28 ASN HA 2 31 SER QB 3.512 . 5.054 2.791 2.290 3.909 . 0 0 "[ . 1 . 2]" 1
345 1 31 SER QB 1 51 MET ME 3.304 . 4.669 3.549 2.758 4.694 0.025 17 0 "[ . 1 . 2]" 1
346 2 31 SER QB 2 51 MET ME 3.304 . 4.669 3.549 2.754 4.694 0.025 17 0 "[ . 1 . 2]" 1
347 1 58 PHE HB3 1 60 PHE QE 4.450 . 6.925 3.228 2.564 3.850 . 0 0 "[ . 1 . 2]" 1
348 2 58 PHE HB3 2 60 PHE QE 4.450 . 6.925 3.227 2.567 3.852 . 0 0 "[ . 1 . 2]" 1
349 1 58 PHE HB2 1 60 PHE QE 3.675 . 5.364 2.152 2.044 2.303 . 0 0 "[ . 1 . 2]" 1
350 2 58 PHE HB2 2 60 PHE QE 3.675 . 5.364 2.151 2.044 2.302 . 0 0 "[ . 1 . 2]" 1
351 1 74 PHE HA 1 74 PHE QD 3.681 . 5.374 2.550 2.211 3.126 . 0 0 "[ . 1 . 2]" 1
352 2 74 PHE HA 2 74 PHE QD 3.681 . 5.374 2.550 2.211 3.127 . 0 0 "[ . 1 . 2]" 1
353 1 74 PHE HB2 1 74 PHE QD 3.737 . 5.483 2.328 2.265 2.713 . 0 0 "[ . 1 . 2]" 1
354 2 74 PHE HB2 2 74 PHE QD 3.737 . 5.483 2.328 2.268 2.712 . 0 0 "[ . 1 . 2]" 1
355 1 29 TYR HA 1 29 TYR QD 3.632 . 5.281 2.420 2.306 2.642 . 0 0 "[ . 1 . 2]" 1
356 2 29 TYR HA 2 29 TYR QD 3.632 . 5.281 2.420 2.308 2.644 . 0 0 "[ . 1 . 2]" 1
357 1 29 TYR HA 1 29 TYR HB2 2.984 . 4.097 2.412 2.382 2.428 . 0 0 "[ . 1 . 2]" 1
358 2 29 TYR HA 2 29 TYR HB2 2.984 . 4.097 2.412 2.380 2.428 . 0 0 "[ . 1 . 2]" 1
359 1 89 VAL HA 1 90 PRO HD3 2.160 . 2.743 2.147 1.836 2.603 . 0 0 "[ . 1 . 2]" 1
360 2 89 VAL HA 2 90 PRO HD3 2.160 . 2.743 2.147 1.838 2.604 . 0 0 "[ . 1 . 2]" 1
361 1 89 VAL HA 1 90 PRO HD2 2.495 . 3.273 2.495 2.035 2.699 . 0 0 "[ . 1 . 2]" 1
362 2 89 VAL HA 2 90 PRO HD2 2.495 . 3.273 2.496 2.033 2.699 . 0 0 "[ . 1 . 2]" 1
363 1 19 LYS HA 1 22 ILE MD 2.733 . 3.667 2.469 2.077 2.808 . 0 0 "[ . 1 . 2]" 1
364 2 19 LYS HA 2 22 ILE MD 2.733 . 3.667 2.469 2.076 2.809 . 0 0 "[ . 1 . 2]" 1
365 1 39 ILE HA 1 39 ILE HB 2.321 . 2.994 2.525 2.459 2.562 . 0 0 "[ . 1 . 2]" 1
366 2 39 ILE HA 2 39 ILE HB 2.321 . 2.994 2.525 2.459 2.562 . 0 0 "[ . 1 . 2]" 1
367 1 39 ILE HA 1 39 ILE MD 3.813 . 5.630 3.717 3.662 3.785 . 0 0 "[ . 1 . 2]" 1
368 2 39 ILE HA 2 39 ILE MD 3.813 . 5.630 3.717 3.661 3.785 . 0 0 "[ . 1 . 2]" 1
369 1 58 PHE HA 1 58 PHE QD 3.819 . 5.642 3.087 3.038 3.122 . 0 0 "[ . 1 . 2]" 1
370 2 58 PHE HA 2 58 PHE QD 3.819 . 5.642 3.087 3.036 3.123 . 0 0 "[ . 1 . 2]" 1
371 1 58 PHE HA 1 58 PHE HB3 2.985 . 4.099 2.544 2.490 2.583 . 0 0 "[ . 1 . 2]" 1
372 2 58 PHE HA 2 58 PHE HB3 2.985 . 4.099 2.544 2.489 2.584 . 0 0 "[ . 1 . 2]" 1
373 1 30 PHE HA 1 30 PHE QD 3.426 . 4.893 1.985 1.934 2.115 0.025 3 0 "[ . 1 . 2]" 1
374 2 30 PHE HA 2 30 PHE QD 3.426 . 4.893 1.985 1.933 2.114 0.026 3 0 "[ . 1 . 2]" 1
375 1 63 GLU HA 1 63 GLU HG3 3.253 . 4.576 3.219 2.458 3.757 . 0 0 "[ . 1 . 2]" 1
376 2 63 GLU HA 2 63 GLU HG3 3.253 . 4.576 3.219 2.454 3.757 . 0 0 "[ . 1 . 2]" 1
377 1 23 ALA MB 1 58 PHE HZ 3.099 . 4.299 3.367 3.068 3.579 . 0 0 "[ . 1 . 2]" 1
378 2 23 ALA MB 2 58 PHE HZ 3.099 . 4.299 3.367 3.069 3.579 . 0 0 "[ . 1 . 2]" 1
379 1 26 ILE MD 1 58 PHE HZ 2.977 . 4.085 3.751 3.499 4.055 . 0 0 "[ . 1 . 2]" 1
380 2 26 ILE MD 2 58 PHE HZ 2.977 . 4.085 3.751 3.498 4.055 . 0 0 "[ . 1 . 2]" 1
381 1 72 SER HA 1 72 SER HB3 2.723 . 3.650 2.499 2.376 3.030 . 0 0 "[ . 1 . 2]" 1
382 2 72 SER HA 2 72 SER HB3 2.723 . 3.650 2.499 2.376 3.031 . 0 0 "[ . 1 . 2]" 1
383 1 16 SER QB 1 18 SER HA 3.406 . 4.856 4.633 3.954 4.949 0.093 18 0 "[ . 1 . 2]" 1
384 2 16 SER QB 2 18 SER HA 3.406 . 4.856 4.633 3.959 4.946 0.090 18 0 "[ . 1 . 2]" 1
385 1 16 SER HA 1 16 SER QB 2.439 . 3.183 2.330 2.189 2.421 . 0 0 "[ . 1 . 2]" 1
386 2 16 SER HA 2 16 SER QB 2.439 . 3.183 2.330 2.189 2.417 . 0 0 "[ . 1 . 2]" 1
387 1 40 SER HA 1 40 SER HB2 2.717 . 3.640 2.765 2.478 3.030 . 0 0 "[ . 1 . 2]" 1
388 2 40 SER HA 2 40 SER HB2 2.717 . 3.640 2.765 2.480 3.029 . 0 0 "[ . 1 . 2]" 1
389 1 48 ASN HA 1 51 MET ME 2.618 . 3.475 3.547 3.512 3.568 0.093 13 0 "[ . 1 . 2]" 1
390 2 48 ASN HA 2 51 MET ME 2.618 . 3.475 3.547 3.512 3.568 0.093 13 0 "[ . 1 . 2]" 1
391 1 73 GLU HA 1 73 GLU HG3 2.680 . 3.578 3.661 2.955 3.879 0.301 13 0 "[ . 1 . 2]" 1
392 2 73 GLU HA 2 73 GLU HG3 2.680 . 3.578 3.660 2.957 3.877 0.299 13 0 "[ . 1 . 2]" 1
393 1 23 ALA MB 1 60 PHE HZ 2.370 . 3.072 2.628 2.220 2.900 . 0 0 "[ . 1 . 2]" 1
394 2 23 ALA MB 2 60 PHE HZ 2.370 . 3.072 2.628 2.221 2.901 . 0 0 "[ . 1 . 2]" 1
395 1 42 ASP HA 1 42 ASP HB2 2.619 . 3.476 2.728 2.420 3.026 . 0 0 "[ . 1 . 2]" 1
396 2 42 ASP HA 2 42 ASP HB2 2.619 . 3.476 2.728 2.421 3.028 . 0 0 "[ . 1 . 2]" 1
397 1 36 LYS HA 1 36 LYS HB2 2.662 . 3.548 2.480 2.426 2.573 . 0 0 "[ . 1 . 2]" 1
398 2 36 LYS HA 2 36 LYS HB2 2.662 . 3.548 2.480 2.426 2.571 . 0 0 "[ . 1 . 2]" 1
399 1 36 LYS HA 1 36 LYS HG2 3.248 . 4.567 3.724 3.648 3.809 . 0 0 "[ . 1 . 2]" 1
400 2 36 LYS HA 2 36 LYS HG2 3.248 . 4.567 3.724 3.645 3.811 . 0 0 "[ . 1 . 2]" 1
401 1 69 LEU HA 1 69 LEU HB3 2.892 . 3.937 2.491 2.459 2.521 . 0 0 "[ . 1 . 2]" 1
402 2 69 LEU HA 2 69 LEU HB3 2.892 . 3.937 2.491 2.459 2.522 . 0 0 "[ . 1 . 2]" 1
403 1 38 GLU HA 1 38 GLU HB3 2.877 . 3.912 2.875 2.519 3.031 . 0 0 "[ . 1 . 2]" 1
404 2 38 GLU HA 2 38 GLU HB3 2.877 . 3.912 2.875 2.520 3.032 . 0 0 "[ . 1 . 2]" 1
405 1 36 LYS HG3 1 38 GLU HA 4.385 . 6.789 4.026 3.309 4.610 . 0 0 "[ . 1 . 2]" 1
406 2 36 LYS HG3 2 38 GLU HA 4.385 . 6.789 4.026 3.310 4.613 . 0 0 "[ . 1 . 2]" 1
407 1 88 ARG HA 1 88 ARG QD 3.318 . 4.694 3.599 1.968 4.549 . 0 0 "[ . 1 . 2]" 1
408 2 88 ARG HA 2 88 ARG QD 3.318 . 4.694 3.599 1.968 4.550 . 0 0 "[ . 1 . 2]" 1
409 1 88 ARG HA 1 88 ARG HB3 2.474 . 3.239 2.508 2.452 2.631 . 0 0 "[ . 1 . 2]" 1
410 2 88 ARG HA 2 88 ARG HB3 2.474 . 3.239 2.507 2.452 2.630 . 0 0 "[ . 1 . 2]" 1
411 1 15 MET HA 1 15 MET HG3 3.312 . 4.683 3.300 2.857 4.255 . 0 0 "[ . 1 . 2]" 1
412 2 15 MET HA 2 15 MET HG3 3.312 . 4.683 3.300 2.861 4.256 . 0 0 "[ . 1 . 2]" 1
413 1 78 HIS HA 1 78 HIS HB3 2.864 . 3.889 2.544 2.404 3.034 . 0 0 "[ . 1 . 2]" 1
414 2 78 HIS HA 2 78 HIS HB3 2.864 . 3.889 2.545 2.403 3.035 . 0 0 "[ . 1 . 2]" 1
415 1 77 GLN HA 1 78 HIS HB3 5.455 . 9.175 5.624 4.510 6.297 . 0 0 "[ . 1 . 2]" 1
416 2 77 GLN HA 2 78 HIS HB3 5.455 . 9.175 5.625 4.511 6.299 . 0 0 "[ . 1 . 2]" 1
417 1 60 PHE HA 1 60 PHE QD 4.492 . 7.014 3.741 3.717 3.754 . 0 0 "[ . 1 . 2]" 1
418 2 60 PHE HA 2 60 PHE QD 4.492 . 7.014 3.741 3.717 3.755 . 0 0 "[ . 1 . 2]" 1
419 1 60 PHE HA 1 60 PHE HB2 2.581 . 3.413 2.400 2.371 2.459 . 0 0 "[ . 1 . 2]" 1
420 2 60 PHE HA 2 60 PHE HB2 2.581 . 3.413 2.400 2.372 2.460 . 0 0 "[ . 1 . 2]" 1
421 1 60 PHE HA 1 60 PHE HB3 2.705 . 3.619 2.511 2.443 2.548 . 0 0 "[ . 1 . 2]" 1
422 2 60 PHE HA 2 60 PHE HB3 2.705 . 3.619 2.512 2.445 2.549 . 0 0 "[ . 1 . 2]" 1
423 1 60 PHE HA 1 68 ILE MD 4.398 . 6.816 4.565 4.190 5.309 . 0 0 "[ . 1 . 2]" 1
424 2 60 PHE HA 2 68 ILE MD 4.398 . 6.816 4.565 4.190 5.311 . 0 0 "[ . 1 . 2]" 1
425 1 64 ALA HA 1 64 ALA MB 2.141 . 2.714 2.126 2.124 2.128 . 0 0 "[ . 1 . 2]" 1
426 2 64 ALA HA 2 64 ALA MB 2.141 . 2.714 2.126 2.125 2.128 . 0 0 "[ . 1 . 2]" 1
427 1 29 TYR HA 1 29 TYR QE 4.476 . 6.981 4.550 4.473 4.698 . 0 0 "[ . 1 . 2]" 1
428 2 29 TYR HA 2 29 TYR QE 4.476 . 6.981 4.550 4.472 4.698 . 0 0 "[ . 1 . 2]" 1
429 1 29 TYR QE 1 30 PHE QE 4.649 . 7.351 3.263 2.704 3.953 . 0 0 "[ . 1 . 2]" 1
430 2 29 TYR QE 2 30 PHE QE 4.649 . 7.351 3.263 2.704 3.952 . 0 0 "[ . 1 . 2]" 1
431 1 29 TYR QE 1 80 ALA MB 3.190 . 4.462 2.619 2.217 3.582 . 0 0 "[ . 1 . 2]" 1
432 2 29 TYR QE 2 80 ALA MB 3.190 . 4.462 2.618 2.216 3.582 . 0 0 "[ . 1 . 2]" 1
433 1 29 TYR QE 1 47 LEU MD1 3.732 . 5.473 5.403 5.169 5.497 0.024 6 0 "[ . 1 . 2]" 1
434 2 29 TYR QE 2 47 LEU MD1 3.732 . 5.473 5.403 5.169 5.498 0.025 6 0 "[ . 1 . 2]" 1
435 1 78 HIS HD2 1 80 ALA MB 4.974 . 8.066 6.174 5.280 6.924 . 0 0 "[ . 1 . 2]" 1
436 2 78 HIS HD2 2 80 ALA MB 4.974 . 8.066 6.173 5.281 6.923 . 0 0 "[ . 1 . 2]" 1
437 1 78 HIS HA 1 78 HIS HD2 3.988 . 5.976 2.880 2.187 3.426 . 0 0 "[ . 1 . 2]" 1
438 2 78 HIS HA 2 78 HIS HD2 3.988 . 5.976 2.880 2.188 3.424 . 0 0 "[ . 1 . 2]" 1
439 1 29 TYR HA 1 78 HIS HD2 3.935 . 5.870 4.795 3.808 5.846 . 0 0 "[ . 1 . 2]" 1
440 2 29 TYR HA 2 78 HIS HD2 3.935 . 5.870 4.795 3.808 5.843 . 0 0 "[ . 1 . 2]" 1
441 1 29 TYR QE 1 80 ALA HA 5.000 . 8.125 4.950 4.419 5.996 . 0 0 "[ . 1 . 2]" 1
442 2 29 TYR QE 2 80 ALA HA 5.000 . 8.125 4.949 4.419 5.996 . 0 0 "[ . 1 . 2]" 1
443 1 29 TYR QE 1 30 PHE HA 5.145 . 8.454 4.760 4.450 4.947 . 0 0 "[ . 1 . 2]" 1
444 2 29 TYR QE 2 30 PHE HA 5.145 . 8.454 4.759 4.448 4.945 . 0 0 "[ . 1 . 2]" 1
445 1 32 SER HB2 1 78 HIS HD2 5.063 . 8.268 4.340 2.552 6.467 . 0 0 "[ . 1 . 2]" 1
446 2 32 SER HB2 2 78 HIS HD2 5.063 . 8.268 4.340 2.548 6.471 . 0 0 "[ . 1 . 2]" 1
447 1 77 GLN HA 1 78 HIS HD2 5.205 . 8.592 5.775 4.697 6.709 . 0 0 "[ . 1 . 2]" 1
448 2 77 GLN HA 2 78 HIS HD2 5.205 . 8.592 5.775 4.695 6.712 . 0 0 "[ . 1 . 2]" 1
449 1 58 PHE HB2 1 60 PHE HZ 4.635 . 7.321 4.440 3.850 4.717 . 0 0 "[ . 1 . 2]" 1
450 2 58 PHE HB2 2 60 PHE HZ 4.635 . 7.321 4.440 3.854 4.715 . 0 0 "[ . 1 . 2]" 1
451 1 27 VAL HB 1 60 PHE HZ 4.186 . 6.376 4.572 4.138 5.487 . 0 0 "[ . 1 . 2]" 1
452 2 27 VAL HB 2 60 PHE HZ 4.186 . 6.376 4.572 4.137 5.485 . 0 0 "[ . 1 . 2]" 1
453 1 58 PHE HB3 1 60 PHE HZ 5.688 . 9.733 5.573 4.910 5.945 . 0 0 "[ . 1 . 2]" 1
454 2 58 PHE HB3 2 60 PHE HZ 5.688 . 9.733 5.573 4.914 5.942 . 0 0 "[ . 1 . 2]" 1
455 1 60 PHE HZ 1 68 ILE MD 4.350 . 6.715 4.498 3.874 4.945 . 0 0 "[ . 1 . 2]" 1
456 2 60 PHE HZ 2 68 ILE MD 4.350 . 6.715 4.498 3.874 4.945 . 0 0 "[ . 1 . 2]" 1
457 1 58 PHE QD 1 60 PHE HZ 5.699 . 9.758 4.949 4.304 5.313 . 0 0 "[ . 1 . 2]" 1
458 2 58 PHE QD 2 60 PHE HZ 5.699 . 9.758 4.949 4.305 5.315 . 0 0 "[ . 1 . 2]" 1
459 1 23 ALA HA 1 58 PHE HZ 4.410 . 6.841 4.639 4.419 4.895 . 0 0 "[ . 1 . 2]" 1
460 2 23 ALA HA 2 58 PHE HZ 4.410 . 6.841 4.639 4.419 4.895 . 0 0 "[ . 1 . 2]" 1
461 1 22 ILE HB 1 58 PHE HZ 4.837 . 7.762 4.882 4.526 5.176 . 0 0 "[ . 1 . 2]" 1
462 2 22 ILE HB 2 58 PHE HZ 4.837 . 7.762 4.881 4.528 5.176 . 0 0 "[ . 1 . 2]" 1
463 1 19 LYS HB2 1 58 PHE HZ 4.282 . 6.573 5.805 4.054 6.466 . 0 0 "[ . 1 . 2]" 1
464 2 19 LYS HB2 2 58 PHE HZ 4.282 . 6.573 5.805 4.055 6.467 . 0 0 "[ . 1 . 2]" 1
465 1 22 ILE HA 1 74 PHE HZ 4.439 . 6.902 5.429 3.735 6.956 0.054 18 0 "[ . 1 . 2]" 1
466 2 22 ILE HA 2 74 PHE HZ 4.439 . 6.902 5.430 3.735 6.956 0.054 18 0 "[ . 1 . 2]" 1
467 1 17 ALA HA 1 74 PHE HZ 3.953 . 5.906 3.066 1.978 5.715 0.022 9 0 "[ . 1 . 2]" 1
468 2 17 ALA HA 2 74 PHE HZ 3.953 . 5.906 3.067 1.979 5.716 0.021 9 0 "[ . 1 . 2]" 1
469 1 25 LEU MD1 1 74 PHE HZ 4.561 . 7.162 4.359 3.549 5.600 . 0 0 "[ . 1 . 2]" 1
470 2 25 LEU MD1 2 74 PHE HZ 4.561 . 7.162 4.359 3.548 5.600 . 0 0 "[ . 1 . 2]" 1
471 1 72 SER HB2 1 74 PHE QD 5.165 . 8.499 3.229 1.992 4.676 . 0 0 "[ . 1 . 2]" 1
472 2 72 SER HB2 2 74 PHE QD 5.165 . 8.499 3.229 1.991 4.676 . 0 0 "[ . 1 . 2]" 1
473 1 21 GLU HA 1 74 PHE QD 6.047 . 10.617 4.398 3.729 5.964 . 0 0 "[ . 1 . 2]" 1
474 2 21 GLU HA 2 74 PHE QD 6.047 . 10.617 4.398 3.730 5.962 . 0 0 "[ . 1 . 2]" 1
475 1 21 GLU HB3 1 74 PHE QD 5.220 . 8.626 2.802 1.997 4.350 . 0 0 "[ . 1 . 2]" 1
476 2 21 GLU HB3 2 74 PHE QD 5.220 . 8.626 2.801 1.995 4.349 . 0 0 "[ . 1 . 2]" 1
477 1 17 ALA HA 1 74 PHE QE 6.657 . 12.196 2.824 1.955 4.028 . 0 0 "[ . 1 . 2]" 1
478 2 17 ALA HA 2 74 PHE QE 6.657 . 12.196 2.824 1.954 4.029 . 0 0 "[ . 1 . 2]" 1
479 1 74 PHE HA 1 74 PHE QE 5.075 . 8.295 4.539 4.343 4.746 . 0 0 "[ . 1 . 2]" 1
480 2 74 PHE HA 2 74 PHE QE 5.075 . 8.295 4.540 4.344 4.747 . 0 0 "[ . 1 . 2]" 1
481 1 72 SER HB2 1 74 PHE QE 5.918 . 10.295 4.500 2.851 6.717 . 0 0 "[ . 1 . 2]" 1
482 2 72 SER HB2 2 74 PHE QE 5.918 . 10.295 4.500 2.847 6.717 . 0 0 "[ . 1 . 2]" 1
483 1 21 GLU HA 1 74 PHE QE 6.583 . 12.000 4.866 3.561 6.937 . 0 0 "[ . 1 . 2]" 1
484 2 21 GLU HA 2 74 PHE QE 6.583 . 12.000 4.866 3.564 6.935 . 0 0 "[ . 1 . 2]" 1
485 1 25 LEU MD1 1 74 PHE QE 4.983 . 8.087 3.416 3.029 3.889 . 0 0 "[ . 1 . 2]" 1
486 2 25 LEU MD1 2 74 PHE QE 4.983 . 8.087 3.416 3.029 3.888 . 0 0 "[ . 1 . 2]" 1
487 1 19 LYS HA 1 58 PHE QE 4.607 . 7.260 2.893 2.594 3.408 . 0 0 "[ . 1 . 2]" 1
488 2 19 LYS HA 2 58 PHE QE 4.607 . 7.260 2.892 2.597 3.407 . 0 0 "[ . 1 . 2]" 1
489 1 20 GLU HB3 1 60 PHE QE 5.059 . 8.258 5.461 4.602 6.300 . 0 0 "[ . 1 . 2]" 1
490 2 20 GLU HB3 2 60 PHE QE 5.059 . 8.258 5.461 4.601 6.301 . 0 0 "[ . 1 . 2]" 1
491 1 30 PHE QE 1 54 ILE HB 4.696 . 7.452 5.524 5.153 5.720 . 0 0 "[ . 1 . 2]" 1
492 2 30 PHE QE 2 54 ILE HB 4.696 . 7.452 5.524 5.152 5.719 . 0 0 "[ . 1 . 2]" 1
493 1 26 ILE HB 1 30 PHE QE 5.391 . 9.024 4.839 4.564 5.280 . 0 0 "[ . 1 . 2]" 1
494 2 26 ILE HB 2 30 PHE QE 5.391 . 9.024 4.839 4.563 5.279 . 0 0 "[ . 1 . 2]" 1
495 1 30 PHE QE 1 51 MET ME 5.249 . 8.693 4.418 4.050 4.690 . 0 0 "[ . 1 . 2]" 1
496 2 30 PHE QE 2 51 MET ME 5.249 . 8.693 4.417 4.052 4.691 . 0 0 "[ . 1 . 2]" 1
497 1 26 ILE HA 1 30 PHE QE 4.906 . 7.915 4.936 4.841 5.039 . 0 0 "[ . 1 . 2]" 1
498 2 26 ILE HA 2 30 PHE QE 4.906 . 7.915 4.936 4.842 5.038 . 0 0 "[ . 1 . 2]" 1
499 1 30 PHE HA 1 30 PHE QE 4.966 . 8.048 4.298 4.257 4.345 . 0 0 "[ . 1 . 2]" 1
500 2 30 PHE HA 2 30 PHE QE 4.966 . 8.048 4.297 4.258 4.346 . 0 0 "[ . 1 . 2]" 1
501 1 19 LYS HA 1 58 PHE QD 6.344 . 11.374 3.869 3.518 4.278 . 0 0 "[ . 1 . 2]" 1
502 2 19 LYS HA 2 58 PHE QD 6.344 . 11.374 3.868 3.515 4.277 . 0 0 "[ . 1 . 2]" 1
503 1 19 LYS HG3 1 58 PHE QD 5.058 . 8.256 4.383 2.684 5.132 . 0 0 "[ . 1 . 2]" 1
504 2 19 LYS HG3 2 58 PHE QD 5.058 . 8.256 4.384 2.687 5.130 . 0 0 "[ . 1 . 2]" 1
505 1 19 LYS HG2 1 58 PHE QD 4.991 . 8.104 4.521 4.178 4.956 . 0 0 "[ . 1 . 2]" 1
506 2 19 LYS HG2 2 58 PHE QD 4.991 . 8.104 4.522 4.180 4.956 . 0 0 "[ . 1 . 2]" 1
507 1 20 GLU HB3 1 58 PHE QD 6.234 . 11.091 4.247 3.671 4.982 . 0 0 "[ . 1 . 2]" 1
508 2 20 GLU HB3 2 58 PHE QD 6.234 . 11.091 4.247 3.669 4.980 . 0 0 "[ . 1 . 2]" 1
509 1 20 GLU HG3 1 58 PHE QD 5.113 . 8.380 6.238 5.807 6.655 . 0 0 "[ . 1 . 2]" 1
510 2 20 GLU HG3 2 58 PHE QD 5.113 . 8.380 6.238 5.805 6.654 . 0 0 "[ . 1 . 2]" 1
511 1 58 PHE QD 1 60 PHE QD 6.855 . 12.729 4.210 4.056 4.630 . 0 0 "[ . 1 . 2]" 1
512 2 58 PHE QD 2 60 PHE QD 6.855 . 12.729 4.210 4.057 4.631 . 0 0 "[ . 1 . 2]" 1
513 1 29 TYR QD 1 30 PHE QE 5.700 . 9.761 3.163 2.746 3.697 . 0 0 "[ . 1 . 2]" 1
514 2 29 TYR QD 2 30 PHE QE 5.700 . 9.761 3.162 2.746 3.695 . 0 0 "[ . 1 . 2]" 1
515 1 29 TYR QD 1 78 HIS HE1 5.212 . 8.608 7.276 2.842 8.555 . 0 0 "[ . 1 . 2]" 1
516 2 29 TYR QD 2 78 HIS HE1 5.212 . 8.608 7.276 2.844 8.553 . 0 0 "[ . 1 . 2]" 1
517 1 29 TYR QD 1 79 LEU MD2 4.713 . 7.489 3.204 2.886 3.452 . 0 0 "[ . 1 . 2]" 1
518 2 29 TYR QD 2 79 LEU MD2 4.713 . 7.489 3.204 2.886 3.453 . 0 0 "[ . 1 . 2]" 1
519 1 29 TYR QD 1 79 LEU HG 5.840 . 10.103 5.036 4.831 5.391 . 0 0 "[ . 1 . 2]" 1
520 2 29 TYR QD 2 79 LEU HG 5.840 . 10.103 5.036 4.831 5.391 . 0 0 "[ . 1 . 2]" 1
521 1 29 TYR QD 1 80 ALA MB 4.138 . 6.278 3.072 2.450 4.020 . 0 0 "[ . 1 . 2]" 1
522 2 29 TYR QD 2 80 ALA MB 4.138 . 6.278 3.071 2.451 4.018 . 0 0 "[ . 1 . 2]" 1
523 1 29 TYR QD 1 32 SER HB2 6.332 . 11.344 4.461 3.317 5.348 . 0 0 "[ . 1 . 2]" 1
524 2 29 TYR QD 2 32 SER HB2 6.332 . 11.344 4.462 3.321 5.354 . 0 0 "[ . 1 . 2]" 1
525 1 29 TYR QD 1 30 PHE HA 5.521 . 9.332 3.917 3.675 4.141 . 0 0 "[ . 1 . 2]" 1
526 2 29 TYR QD 2 30 PHE HA 5.521 . 9.332 3.917 3.674 4.140 . 0 0 "[ . 1 . 2]" 1
527 1 60 PHE QD 1 61 GLU HA 5.173 . 8.518 4.095 3.560 4.767 . 0 0 "[ . 1 . 2]" 1
528 2 60 PHE QD 2 61 GLU HA 5.173 . 8.518 4.095 3.561 4.767 . 0 0 "[ . 1 . 2]" 1
529 1 30 PHE QE 1 79 LEU MD2 5.752 . 9.887 5.013 4.349 5.403 . 0 0 "[ . 1 . 2]" 1
530 2 30 PHE QE 2 79 LEU MD2 5.752 . 9.887 5.013 4.349 5.402 . 0 0 "[ . 1 . 2]" 1
531 1 50 ALA MB 1 53 CYS HA 5.083 . 8.312 6.199 5.923 6.578 . 0 0 "[ . 1 . 2]" 1
532 2 50 ALA MB 2 53 CYS HA 5.083 . 8.312 6.199 5.922 6.578 . 0 0 "[ . 1 . 2]" 1
533 1 69 LEU MD2 1 72 SER HB2 4.138 . 6.278 4.104 2.439 5.750 . 0 0 "[ . 1 . 2]" 1
534 2 69 LEU MD2 2 72 SER HB2 4.138 . 6.278 4.105 2.440 5.753 . 0 0 "[ . 1 . 2]" 1
535 1 39 ILE MD 1 43 GLY HA2 3.802 . 5.609 3.367 2.933 4.120 . 0 0 "[ . 1 . 2]" 1
536 2 39 ILE MD 2 43 GLY HA2 3.802 . 5.609 3.367 2.932 4.120 . 0 0 "[ . 1 . 2]" 1
537 1 44 ALA HA 1 47 LEU MD1 3.126 . 4.348 2.663 2.444 3.216 . 0 0 "[ . 1 . 2]" 1
538 2 44 ALA HA 2 47 LEU MD1 3.126 . 4.348 2.663 2.444 3.213 . 0 0 "[ . 1 . 2]" 1
539 1 25 LEU MD1 1 79 LEU HA 3.088 . 4.280 2.919 2.368 3.378 . 0 0 "[ . 1 . 2]" 1
540 2 25 LEU MD1 2 79 LEU HA 3.088 . 4.280 2.919 2.369 3.379 . 0 0 "[ . 1 . 2]" 1
541 1 79 LEU HA 1 79 LEU HG 3.488 . 5.009 3.077 2.953 3.215 . 0 0 "[ . 1 . 2]" 1
542 2 79 LEU HA 2 79 LEU HG 3.488 . 5.009 3.077 2.954 3.215 . 0 0 "[ . 1 . 2]" 1
543 1 79 LEU HA 1 79 LEU HB3 2.927 . 3.998 3.017 3.010 3.022 . 0 0 "[ . 1 . 2]" 1
544 2 79 LEU HA 2 79 LEU HB3 2.927 . 3.998 3.017 3.010 3.021 . 0 0 "[ . 1 . 2]" 1
545 1 79 LEU HA 1 82 ILE HB 2.869 . 3.898 2.789 2.439 3.315 . 0 0 "[ . 1 . 2]" 1
546 2 79 LEU HA 2 82 ILE HB 2.869 . 3.898 2.789 2.439 3.315 . 0 0 "[ . 1 . 2]" 1
547 1 21 GLU HA 1 69 LEU MD2 3.847 . 5.697 3.875 3.391 4.432 . 0 0 "[ . 1 . 2]" 1
548 2 21 GLU HA 2 69 LEU MD2 3.847 . 5.697 3.874 3.391 4.428 . 0 0 "[ . 1 . 2]" 1
549 1 21 GLU HA 1 68 ILE MD 4.119 . 6.240 4.052 3.207 4.610 . 0 0 "[ . 1 . 2]" 1
550 2 21 GLU HA 2 68 ILE MD 4.119 . 6.240 4.052 3.206 4.607 . 0 0 "[ . 1 . 2]" 1
551 1 21 GLU HA 1 21 GLU HG3 3.086 . 4.276 3.150 2.894 3.868 . 0 0 "[ . 1 . 2]" 1
552 2 21 GLU HA 2 21 GLU HG3 3.086 . 4.276 3.150 2.892 3.869 . 0 0 "[ . 1 . 2]" 1
553 1 21 GLU HA 1 21 GLU HG2 2.784 . 3.753 2.600 2.510 3.173 . 0 0 "[ . 1 . 2]" 1
554 2 21 GLU HA 2 21 GLU HG2 2.784 . 3.753 2.601 2.512 3.172 . 0 0 "[ . 1 . 2]" 1
555 1 21 GLU HA 1 21 GLU HB3 2.858 . 3.879 2.461 2.401 2.501 . 0 0 "[ . 1 . 2]" 1
556 2 21 GLU HA 2 21 GLU HB3 2.858 . 3.879 2.462 2.400 2.503 . 0 0 "[ . 1 . 2]" 1
557 1 51 MET HA 1 54 ILE HB 3.024 . 4.167 2.970 2.511 3.367 . 0 0 "[ . 1 . 2]" 1
558 2 51 MET HA 2 54 ILE HB 3.024 . 4.167 2.970 2.510 3.368 . 0 0 "[ . 1 . 2]" 1
559 1 41 GLU HA 1 41 GLU QG 3.335 . 4.725 2.618 2.375 3.315 . 0 0 "[ . 1 . 2]" 1
560 2 41 GLU HA 2 41 GLU QG 3.335 . 4.725 2.618 2.379 3.317 . 0 0 "[ . 1 . 2]" 1
561 1 51 MET HA 1 51 MET HG3 3.719 . 5.448 2.625 2.270 2.969 . 0 0 "[ . 1 . 2]" 1
562 2 51 MET HA 2 51 MET HG3 3.719 . 5.448 2.625 2.270 2.970 . 0 0 "[ . 1 . 2]" 1
563 1 51 MET HA 1 51 MET HG2 2.959 . 4.053 3.485 3.143 3.718 . 0 0 "[ . 1 . 2]" 1
564 2 51 MET HA 2 51 MET HG2 2.959 . 4.053 3.485 3.145 3.715 . 0 0 "[ . 1 . 2]" 1
565 1 82 ILE HA 1 83 LEU MD1 4.582 . 7.206 4.498 4.292 4.608 . 0 0 "[ . 1 . 2]" 1
566 2 82 ILE HA 2 83 LEU MD1 4.582 . 7.206 4.499 4.292 4.611 . 0 0 "[ . 1 . 2]" 1
567 1 82 ILE HA 1 82 ILE MD 4.427 . 6.877 3.792 3.765 3.835 . 0 0 "[ . 1 . 2]" 1
568 2 82 ILE HA 2 82 ILE MD 4.427 . 6.877 3.792 3.763 3.833 . 0 0 "[ . 1 . 2]" 1
569 1 33 ILE HA 1 38 GLU HB3 3.582 . 5.186 3.493 2.378 4.637 . 0 0 "[ . 1 . 2]" 1
570 2 33 ILE HA 2 38 GLU HB3 3.582 . 5.186 3.492 2.381 4.635 . 0 0 "[ . 1 . 2]" 1
571 1 68 ILE HA 1 68 ILE MD 4.647 . 7.347 3.840 3.828 3.853 . 0 0 "[ . 1 . 2]" 1
572 2 68 ILE HA 2 68 ILE MD 4.647 . 7.347 3.839 3.827 3.854 . 0 0 "[ . 1 . 2]" 1
573 1 34 VAL HA 1 34 VAL HB 2.834 . 3.838 2.448 2.420 2.474 . 0 0 "[ . 1 . 2]" 1
574 2 34 VAL HA 2 34 VAL HB 2.834 . 3.838 2.448 2.421 2.476 . 0 0 "[ . 1 . 2]" 1
575 1 34 VAL HA 1 37 LYS HA 3.449 . 4.936 2.854 2.403 3.209 . 0 0 "[ . 1 . 2]" 1
576 2 34 VAL HA 2 37 LYS HA 3.449 . 4.936 2.853 2.404 3.207 . 0 0 "[ . 1 . 2]" 1
577 1 27 VAL HA 1 51 MET ME 3.959 . 5.918 2.843 2.470 3.404 . 0 0 "[ . 1 . 2]" 1
578 2 27 VAL HA 2 51 MET ME 3.959 . 5.918 2.843 2.472 3.406 . 0 0 "[ . 1 . 2]" 1
579 1 27 VAL HA 1 51 MET HG3 4.408 . 6.837 4.666 3.214 6.140 . 0 0 "[ . 1 . 2]" 1
580 2 27 VAL HA 2 51 MET HG3 4.408 . 6.837 4.666 3.213 6.142 . 0 0 "[ . 1 . 2]" 1
581 1 27 VAL HA 1 30 PHE HB3 3.600 . 5.220 4.373 4.162 4.538 . 0 0 "[ . 1 . 2]" 1
582 2 27 VAL HA 2 30 PHE HB3 3.600 . 5.220 4.373 4.161 4.537 . 0 0 "[ . 1 . 2]" 1
583 1 27 VAL HA 1 30 PHE QD 4.311 . 6.634 2.582 2.108 3.194 . 0 0 "[ . 1 . 2]" 1
584 2 27 VAL HA 2 30 PHE QD 4.311 . 6.634 2.582 2.106 3.194 . 0 0 "[ . 1 . 2]" 1
585 1 78 HIS HB3 1 78 HIS HD2 3.870 . 5.742 3.165 2.810 3.979 . 0 0 "[ . 1 . 2]" 1
586 2 78 HIS HB3 2 78 HIS HD2 3.870 . 5.742 3.166 2.812 3.976 . 0 0 "[ . 1 . 2]" 1
587 1 30 PHE QD 1 51 MET HG3 5.515 . 9.316 5.276 3.713 6.460 . 0 0 "[ . 1 . 2]" 1
588 2 30 PHE QD 2 51 MET HG3 5.515 . 9.316 5.276 3.714 6.460 . 0 0 "[ . 1 . 2]" 1
589 1 51 MET HB3 1 51 MET HG3 2.959 . 4.054 2.693 2.407 2.998 . 0 0 "[ . 1 . 2]" 1
590 2 51 MET HB3 2 51 MET HG3 2.959 . 4.054 2.693 2.407 2.997 . 0 0 "[ . 1 . 2]" 1
591 1 48 ASN HA 1 51 MET HB2 3.458 . 4.952 2.988 2.482 3.551 . 0 0 "[ . 1 . 2]" 1
592 2 48 ASN HA 2 51 MET HB2 3.458 . 4.952 2.988 2.484 3.553 . 0 0 "[ . 1 . 2]" 1
593 1 30 PHE HB2 1 30 PHE QD 4.236 . 6.478 2.336 2.272 2.561 . 0 0 "[ . 1 . 2]" 1
594 2 30 PHE HB2 2 30 PHE QD 4.236 . 6.478 2.335 2.274 2.562 . 0 0 "[ . 1 . 2]" 1
595 1 25 LEU HA 1 28 ASN HB3 3.100 . 4.302 2.313 1.895 2.777 0.003 13 0 "[ . 1 . 2]" 1
596 2 25 LEU HA 2 28 ASN HB3 3.100 . 4.302 2.314 1.896 2.776 0.002 13 0 "[ . 1 . 2]" 1
597 1 24 ALA MB 1 69 LEU HB2 4.859 . 7.810 4.418 4.180 4.687 . 0 0 "[ . 1 . 2]" 1
598 2 24 ALA MB 2 69 LEU HB2 4.859 . 7.810 4.418 4.178 4.687 . 0 0 "[ . 1 . 2]" 1
599 1 34 VAL HA 1 39 ILE HB 4.118 . 6.238 4.819 4.490 5.292 . 0 0 "[ . 1 . 2]" 1
600 2 34 VAL HA 2 39 ILE HB 4.118 . 6.238 4.819 4.491 5.290 . 0 0 "[ . 1 . 2]" 1
601 1 79 LEU MD2 1 80 ALA MB 4.523 . 7.080 4.403 4.206 4.792 . 0 0 "[ . 1 . 2]" 1
602 2 79 LEU MD2 2 80 ALA MB 4.523 . 7.080 4.403 4.202 4.792 . 0 0 "[ . 1 . 2]" 1
603 1 78 HIS HE1 1 80 ALA MB 4.643 . 7.338 6.603 2.813 7.367 0.029 10 0 "[ . 1 . 2]" 1
604 2 78 HIS HE1 2 80 ALA MB 4.643 . 7.338 6.602 2.813 7.368 0.030 15 0 "[ . 1 . 2]" 1
605 1 30 PHE QE 1 50 ALA MB 4.175 . 6.353 4.215 3.324 4.997 . 0 0 "[ . 1 . 2]" 1
606 2 30 PHE QE 2 50 ALA MB 4.175 . 6.353 4.215 3.323 4.998 . 0 0 "[ . 1 . 2]" 1
607 1 60 PHE HA 1 64 ALA MB 4.251 . 6.510 4.041 3.294 4.390 . 0 0 "[ . 1 . 2]" 1
608 2 60 PHE HA 2 64 ALA MB 4.251 . 6.510 4.041 3.296 4.390 . 0 0 "[ . 1 . 2]" 1
609 1 63 GLU HA 1 64 ALA MB 5.561 . 9.426 4.884 4.792 4.946 . 0 0 "[ . 1 . 2]" 1
610 2 63 GLU HA 2 64 ALA MB 5.561 . 9.426 4.885 4.791 4.944 . 0 0 "[ . 1 . 2]" 1
611 1 62 ARG HA 1 64 ALA MB 5.088 . 8.325 4.774 4.495 4.926 . 0 0 "[ . 1 . 2]" 1
612 2 62 ARG HA 2 64 ALA MB 5.088 . 8.325 4.774 4.496 4.926 . 0 0 "[ . 1 . 2]" 1
613 1 64 ALA MB 1 68 ILE HA 5.630 . 9.592 5.565 5.287 5.985 . 0 0 "[ . 1 . 2]" 1
614 2 64 ALA MB 2 68 ILE HA 5.630 . 9.592 5.565 5.286 5.983 . 0 0 "[ . 1 . 2]" 1
615 1 64 ALA MB 1 65 VAL HA 3.800 . 5.605 3.988 3.884 4.069 . 0 0 "[ . 1 . 2]" 1
616 2 64 ALA MB 2 65 VAL HA 3.800 . 5.605 3.989 3.882 4.071 . 0 0 "[ . 1 . 2]" 1
617 1 49 VAL HB 1 50 ALA MB 4.559 . 7.157 5.436 5.376 5.486 . 0 0 "[ . 1 . 2]" 1
618 2 49 VAL HB 2 50 ALA MB 4.559 . 7.157 5.436 5.376 5.484 . 0 0 "[ . 1 . 2]" 1
619 1 19 LYS HG2 1 58 PHE QE 5.350 . 8.928 4.030 3.121 5.085 . 0 0 "[ . 1 . 2]" 1
620 2 19 LYS HG2 2 58 PHE QE 5.350 . 8.928 4.030 3.121 5.084 . 0 0 "[ . 1 . 2]" 1
621 1 19 LYS HG3 1 58 PHE QE 5.355 . 8.939 4.551 3.978 5.289 . 0 0 "[ . 1 . 2]" 1
622 2 19 LYS HG3 2 58 PHE QE 5.355 . 8.939 4.551 3.979 5.288 . 0 0 "[ . 1 . 2]" 1
623 1 19 LYS HG3 1 20 GLU HA 5.303 . 8.818 5.824 3.524 6.512 . 0 0 "[ . 1 . 2]" 1
624 2 19 LYS HG3 2 20 GLU HA 5.303 . 8.818 5.823 3.527 6.508 . 0 0 "[ . 1 . 2]" 1
625 1 30 PHE QD 1 47 LEU HG 5.043 . 8.223 5.057 4.775 5.252 . 0 0 "[ . 1 . 2]" 1
626 2 30 PHE QD 2 47 LEU HG 5.043 . 8.223 5.057 4.778 5.251 . 0 0 "[ . 1 . 2]" 1
627 1 74 PHE QE 1 83 LEU HG 5.466 . 9.201 9.063 8.786 9.267 0.066 12 0 "[ . 1 . 2]" 1
628 2 74 PHE QE 2 83 LEU HG 5.466 . 9.201 9.063 8.786 9.266 0.065 12 0 "[ . 1 . 2]" 1
629 1 19 LYS HB2 1 58 PHE QE 4.108 . 6.218 3.415 1.879 4.017 0.119 10 0 "[ . 1 . 2]" 1
630 2 19 LYS HB2 2 58 PHE QE 4.108 . 6.218 3.414 1.878 4.017 0.120 10 0 "[ . 1 . 2]" 1
631 1 19 LYS HB3 1 58 PHE QE 5.305 . 8.823 2.386 1.931 3.475 . 0 0 "[ . 1 . 2]" 1
632 2 19 LYS HB3 2 58 PHE QE 5.305 . 8.823 2.385 1.934 3.471 . 0 0 "[ . 1 . 2]" 1
633 1 19 LYS HB3 1 58 PHE QD 5.408 . 9.064 2.491 1.964 4.175 . 0 0 "[ . 1 . 2]" 1
634 2 19 LYS HB3 2 58 PHE QD 5.408 . 9.064 2.491 1.968 4.174 . 0 0 "[ . 1 . 2]" 1
635 1 74 PHE QD 1 77 GLN QG 5.203 . 8.587 5.642 2.991 8.102 . 0 0 "[ . 1 . 2]" 1
636 2 74 PHE QD 2 77 GLN QG 5.203 . 8.587 5.641 2.991 8.099 . 0 0 "[ . 1 . 2]" 1
637 1 20 GLU HA 1 20 GLU HG2 4.741 . 7.551 3.715 3.672 3.775 . 0 0 "[ . 1 . 2]" 1
638 2 20 GLU HA 2 20 GLU HG2 4.741 . 7.551 3.715 3.671 3.774 . 0 0 "[ . 1 . 2]" 1
639 1 21 GLU HB3 1 74 PHE HB2 2.571 . 6.000 4.596 2.613 5.880 . 0 0 "[ . 1 . 2]" 1
640 2 21 GLU HB3 2 74 PHE HB2 2.571 . 6.000 4.595 2.615 5.879 . 0 0 "[ . 1 . 2]" 1
641 1 21 GLU HB3 1 74 PHE QE 5.013 . 8.154 2.643 1.874 5.048 . 0 0 "[ . 1 . 2]" 1
642 2 21 GLU HB3 2 74 PHE QE 5.013 . 8.154 2.642 1.872 5.046 0.000 3 0 "[ . 1 . 2]" 1
643 1 20 GLU HB3 1 68 ILE MD 3.970 . 5.940 3.899 3.518 4.471 . 0 0 "[ . 1 . 2]" 1
644 2 20 GLU HB3 2 68 ILE MD 3.970 . 5.940 3.900 3.516 4.471 . 0 0 "[ . 1 . 2]" 1
645 1 77 GLN QG 1 82 ILE MD 4.956 . 8.026 4.207 2.612 5.392 . 0 0 "[ . 1 . 2]" 1
646 2 77 GLN QG 2 82 ILE MD 4.956 . 8.026 4.206 2.612 5.388 . 0 0 "[ . 1 . 2]" 1
647 1 20 GLU HG2 1 68 ILE MD 4.658 . 7.370 4.799 4.160 5.425 . 0 0 "[ . 1 . 2]" 1
648 2 20 GLU HG2 2 68 ILE MD 4.658 . 7.370 4.799 4.160 5.425 . 0 0 "[ . 1 . 2]" 1
649 1 44 ALA HA 1 47 LEU HG 3.692 . 5.396 3.482 3.226 3.770 . 0 0 "[ . 1 . 2]" 1
650 2 44 ALA HA 2 47 LEU HG 3.692 . 5.396 3.482 3.228 3.769 . 0 0 "[ . 1 . 2]" 1
651 1 30 PHE HB2 1 33 ILE MD 4.846 . 7.781 4.728 4.567 5.070 . 0 0 "[ . 1 . 2]" 1
652 2 30 PHE HB2 2 33 ILE MD 4.846 . 7.781 4.729 4.568 5.069 . 0 0 "[ . 1 . 2]" 1
653 1 30 PHE QE 1 33 ILE MD 4.247 . 6.502 3.465 3.285 3.822 . 0 0 "[ . 1 . 2]" 1
654 2 30 PHE QE 2 33 ILE MD 4.247 . 6.502 3.465 3.285 3.823 . 0 0 "[ . 1 . 2]" 1
655 1 20 GLU HG3 1 68 ILE MD 4.529 . 7.093 3.737 2.825 4.530 . 0 0 "[ . 1 . 2]" 1
656 2 20 GLU HG3 2 68 ILE MD 4.529 . 7.093 3.737 2.824 4.531 . 0 0 "[ . 1 . 2]" 1
657 1 65 VAL HB 1 68 ILE MD 4.129 . 6.260 3.968 3.589 4.292 . 0 0 "[ . 1 . 2]" 1
658 2 65 VAL HB 2 68 ILE MD 4.129 . 6.260 3.968 3.590 4.290 . 0 0 "[ . 1 . 2]" 1
659 1 20 GLU HB2 1 68 ILE MD 3.045 . 4.204 2.451 2.037 2.975 . 0 0 "[ . 1 . 2]" 1
660 2 20 GLU HB2 2 68 ILE MD 3.045 . 4.204 2.451 2.036 2.975 . 0 0 "[ . 1 . 2]" 1
661 1 21 GLU HB3 1 22 ILE MD 6.664 . 12.215 5.635 5.438 5.941 . 0 0 "[ . 1 . 2]" 1
662 2 21 GLU HB3 2 22 ILE MD 6.664 . 12.215 5.635 5.437 5.944 . 0 0 "[ . 1 . 2]" 1
663 1 18 SER HA 1 22 ILE MD 4.711 . 7.486 4.026 3.643 4.518 . 0 0 "[ . 1 . 2]" 1
664 2 18 SER HA 2 22 ILE MD 4.711 . 7.486 4.025 3.639 4.519 . 0 0 "[ . 1 . 2]" 1
665 1 74 PHE HB2 1 82 ILE MD 4.881 . 7.860 4.430 3.439 5.641 . 0 0 "[ . 1 . 2]" 1
666 2 74 PHE HB2 2 82 ILE MD 4.881 . 7.860 4.430 3.438 5.642 . 0 0 "[ . 1 . 2]" 1
667 1 74 PHE HB3 1 82 ILE MD 3.056 . 4.224 3.078 2.222 4.228 0.004 12 0 "[ . 1 . 2]" 1
668 2 74 PHE HB3 2 82 ILE MD 3.056 . 4.224 3.078 2.221 4.229 0.005 12 0 "[ . 1 . 2]" 1
669 1 74 PHE HA 1 82 ILE MD 3.625 . 5.268 3.688 2.596 5.220 . 0 0 "[ . 1 . 2]" 1
670 2 74 PHE HA 2 82 ILE MD 3.625 . 5.268 3.688 2.595 5.219 . 0 0 "[ . 1 . 2]" 1
671 1 78 HIS HA 1 82 ILE MD 4.743 . 7.555 4.584 4.034 5.275 . 0 0 "[ . 1 . 2]" 1
672 2 78 HIS HA 2 82 ILE MD 4.743 . 7.555 4.584 4.031 5.275 . 0 0 "[ . 1 . 2]" 1
673 1 54 ILE MD 1 58 PHE QD 4.693 . 7.446 5.570 4.953 5.895 . 0 0 "[ . 1 . 2]" 1
674 2 54 ILE MD 2 58 PHE QD 4.693 . 7.446 5.571 4.952 5.897 . 0 0 "[ . 1 . 2]" 1
675 1 51 MET HG3 1 54 ILE MD 4.700 . 7.461 3.964 2.447 5.234 . 0 0 "[ . 1 . 2]" 1
676 2 51 MET HG3 2 54 ILE MD 4.700 . 7.461 3.964 2.446 5.233 . 0 0 "[ . 1 . 2]" 1
677 1 26 ILE HB 1 54 ILE MD 3.301 . 4.663 3.774 3.111 4.421 . 0 0 "[ . 1 . 2]" 1
678 2 26 ILE HB 2 54 ILE MD 3.301 . 4.663 3.774 3.110 4.421 . 0 0 "[ . 1 . 2]" 1
679 1 69 LEU MD2 1 74 PHE HA 4.879 . 7.855 4.979 4.339 5.862 . 0 0 "[ . 1 . 2]" 1
680 2 69 LEU MD2 2 74 PHE HA 4.879 . 7.855 4.979 4.340 5.861 . 0 0 "[ . 1 . 2]" 1
681 1 30 PHE HB2 1 47 LEU MD2 3.076 . 4.259 3.886 3.519 4.527 0.268 12 0 "[ . 1 . 2]" 1
682 2 30 PHE HB2 2 47 LEU MD2 3.076 . 4.259 3.886 3.519 4.527 0.268 12 0 "[ . 1 . 2]" 1
683 1 25 LEU MD2 1 69 LEU HA 4.776 . 7.627 4.713 4.195 4.991 . 0 0 "[ . 1 . 2]" 1
684 2 25 LEU MD2 2 69 LEU HA 4.776 . 7.627 4.713 4.196 4.993 . 0 0 "[ . 1 . 2]" 1
685 1 69 LEU MD1 1 74 PHE QD 5.373 . 8.981 5.850 4.671 6.632 . 0 0 "[ . 1 . 2]" 1
686 2 69 LEU MD1 2 74 PHE QD 5.373 . 8.981 5.850 4.672 6.633 . 0 0 "[ . 1 . 2]" 1
687 1 28 ASN HA 1 69 LEU MD1 4.416 . 6.854 4.393 4.097 4.903 . 0 0 "[ . 1 . 2]" 1
688 2 28 ASN HA 2 69 LEU MD1 4.416 . 6.854 4.393 4.098 4.903 . 0 0 "[ . 1 . 2]" 1
689 1 65 VAL HA 1 69 LEU MD1 3.906 . 5.813 4.568 4.429 4.696 . 0 0 "[ . 1 . 2]" 1
690 2 65 VAL HA 2 69 LEU MD1 3.906 . 5.813 4.568 4.429 4.696 . 0 0 "[ . 1 . 2]" 1
691 1 65 VAL HB 1 69 LEU MD1 3.791 . 5.588 4.738 4.646 4.809 . 0 0 "[ . 1 . 2]" 1
692 2 65 VAL HB 2 69 LEU MD1 3.791 . 5.588 4.738 4.644 4.812 . 0 0 "[ . 1 . 2]" 1
693 1 26 ILE HB 1 79 LEU MD2 4.709 . 7.481 4.481 4.209 4.902 . 0 0 "[ . 1 . 2]" 1
694 2 26 ILE HB 2 79 LEU MD2 4.709 . 7.481 4.481 4.209 4.902 . 0 0 "[ . 1 . 2]" 1
695 1 25 LEU MD1 1 74 PHE HB2 4.545 . 7.127 3.109 2.021 3.673 . 0 0 "[ . 1 . 2]" 1
696 2 25 LEU MD1 2 74 PHE HB2 4.545 . 7.127 3.110 2.021 3.674 . 0 0 "[ . 1 . 2]" 1
697 1 29 TYR HA 1 79 LEU MD2 5.407 . 9.062 4.772 4.366 5.228 . 0 0 "[ . 1 . 2]" 1
698 2 29 TYR HA 2 79 LEU MD2 5.407 . 9.062 4.772 4.367 5.226 . 0 0 "[ . 1 . 2]" 1
699 1 25 LEU MD1 1 74 PHE HA 5.054 . 8.247 4.019 2.611 4.515 . 0 0 "[ . 1 . 2]" 1
700 2 25 LEU MD1 2 74 PHE HA 5.054 . 8.247 4.019 2.608 4.516 . 0 0 "[ . 1 . 2]" 1
701 1 74 PHE QE 1 83 LEU MD1 4.834 . 7.755 6.204 5.812 6.509 . 0 0 "[ . 1 . 2]" 1
702 2 74 PHE QE 2 83 LEU MD1 4.834 . 7.755 6.204 5.813 6.508 . 0 0 "[ . 1 . 2]" 1
703 1 25 LEU MD1 1 69 LEU MD1 3.541 . 5.108 4.914 4.495 5.085 . 0 0 "[ . 1 . 2]" 1
704 2 25 LEU MD1 2 69 LEU MD1 3.541 . 5.108 4.914 4.495 5.086 . 0 0 "[ . 1 . 2]" 1
705 1 79 LEU MD2 1 83 LEU HG 3.808 . 5.621 5.442 5.103 5.630 0.009 18 0 "[ . 1 . 2]" 1
706 2 79 LEU MD2 2 83 LEU HG 3.808 . 5.621 5.442 5.101 5.629 0.008 18 0 "[ . 1 . 2]" 1
707 1 47 LEU MD2 1 47 LEU HG 2.431 . 3.169 2.128 2.127 2.130 . 0 0 "[ . 1 . 2]" 1
708 2 47 LEU MD2 2 47 LEU HG 2.431 . 3.169 2.128 2.127 2.130 . 0 0 "[ . 1 . 2]" 1
709 1 17 ALA MB 1 22 ILE HA 4.000 . 6.000 4.517 3.369 5.381 . 0 0 "[ . 1 . 2]" 1
710 2 17 ALA MB 2 22 ILE HA 4.000 . 6.000 4.517 3.370 5.381 . 0 0 "[ . 1 . 2]" 1
711 1 17 ALA MB 1 21 GLU HA 5.427 . 9.109 6.402 4.993 7.306 . 0 0 "[ . 1 . 2]" 1
712 2 17 ALA MB 2 21 GLU HA 5.427 . 9.109 6.403 4.994 7.305 . 0 0 "[ . 1 . 2]" 1
713 1 16 SER QB 1 17 ALA MB 4.774 . 7.623 4.329 4.088 4.914 . 0 0 "[ . 1 . 2]" 1
714 2 16 SER QB 2 17 ALA MB 4.774 . 7.623 4.329 4.083 4.914 . 0 0 "[ . 1 . 2]" 1
715 1 17 ALA MB 1 19 LYS HA 4.953 . 8.020 5.448 5.035 5.902 . 0 0 "[ . 1 . 2]" 1
716 2 17 ALA MB 2 19 LYS HA 4.953 . 8.020 5.448 5.035 5.905 . 0 0 "[ . 1 . 2]" 1
717 1 23 ALA MB 1 26 ILE HB 3.976 . 5.952 3.638 3.424 3.842 . 0 0 "[ . 1 . 2]" 1
718 2 23 ALA MB 2 26 ILE HB 3.976 . 5.952 3.638 3.425 3.840 . 0 0 "[ . 1 . 2]" 1
719 1 17 ALA MB 1 18 SER HA 4.747 . 7.564 4.392 4.322 4.444 . 0 0 "[ . 1 . 2]" 1
720 2 17 ALA MB 2 18 SER HA 4.747 . 7.564 4.391 4.320 4.443 . 0 0 "[ . 1 . 2]" 1
721 1 24 ALA MB 1 25 LEU MD1 5.085 . 8.318 4.483 4.331 4.689 . 0 0 "[ . 1 . 2]" 1
722 2 24 ALA MB 2 25 LEU MD1 5.085 . 8.318 4.484 4.330 4.690 . 0 0 "[ . 1 . 2]" 1
723 1 47 LEU HB3 1 51 MET ME 3.051 . 4.215 2.849 2.664 3.009 . 0 0 "[ . 1 . 2]" 1
724 2 47 LEU HB3 2 51 MET ME 3.051 . 4.215 2.849 2.664 3.012 . 0 0 "[ . 1 . 2]" 1
725 1 29 TYR QD 1 79 LEU HB2 4.510 . 7.052 4.683 4.080 5.083 . 0 0 "[ . 1 . 2]" 1
726 2 29 TYR QD 2 79 LEU HB2 4.510 . 7.052 4.682 4.080 5.083 . 0 0 "[ . 1 . 2]" 1
727 1 25 LEU HB2 1 74 PHE QD 4.625 . 7.298 5.228 3.505 5.783 . 0 0 "[ . 1 . 2]" 1
728 2 25 LEU HB2 2 74 PHE QD 4.625 . 7.298 5.228 3.502 5.780 . 0 0 "[ . 1 . 2]" 1
729 1 25 LEU HB2 1 74 PHE QE 4.722 . 7.510 5.811 4.436 6.617 . 0 0 "[ . 1 . 2]" 1
730 2 25 LEU HB2 2 74 PHE QE 4.722 . 7.510 5.810 4.432 6.616 . 0 0 "[ . 1 . 2]" 1
731 1 30 PHE QE 1 47 LEU MD2 4.142 . 6.287 3.209 3.088 3.445 . 0 0 "[ . 1 . 2]" 1
732 2 30 PHE QE 2 47 LEU MD2 4.142 . 6.287 3.209 3.088 3.447 . 0 0 "[ . 1 . 2]" 1
733 1 25 LEU MD2 1 74 PHE QE 4.997 . 8.119 5.186 4.653 6.243 . 0 0 "[ . 1 . 2]" 1
734 2 25 LEU MD2 2 74 PHE QE 4.997 . 8.119 5.186 4.652 6.243 . 0 0 "[ . 1 . 2]" 1
735 1 25 LEU MD1 1 74 PHE QD 4.395 . 6.809 2.501 1.953 2.777 0.028 9 0 "[ . 1 . 2]" 1
736 2 25 LEU MD1 2 74 PHE QD 4.395 . 6.809 2.500 1.951 2.778 0.030 9 0 "[ . 1 . 2]" 1
737 1 69 LEU MD2 1 74 PHE QE 4.421 . 6.864 5.280 3.888 6.372 . 0 0 "[ . 1 . 2]" 1
738 2 69 LEU MD2 2 74 PHE QE 4.421 . 6.864 5.280 3.888 6.371 . 0 0 "[ . 1 . 2]" 1
739 1 39 ILE MD 1 40 SER HB2 5.472 . 9.215 5.290 4.508 6.036 . 0 0 "[ . 1 . 2]" 1
740 2 39 ILE MD 2 40 SER HB2 5.472 . 9.215 5.288 4.501 6.032 . 0 0 "[ . 1 . 2]" 1
741 1 39 ILE MD 1 43 GLY HA3 2.701 . 3.613 2.412 1.980 2.960 . 0 0 "[ . 1 . 2]" 1
742 2 39 ILE MD 2 43 GLY HA3 2.701 . 3.613 2.412 1.980 2.961 . 0 0 "[ . 1 . 2]" 1
743 1 30 PHE QE 1 39 ILE MD 5.157 . 8.482 5.410 4.997 6.001 . 0 0 "[ . 1 . 2]" 1
744 2 30 PHE QE 2 39 ILE MD 5.157 . 8.482 5.410 4.997 6.002 . 0 0 "[ . 1 . 2]" 1
745 1 27 VAL HA 1 54 ILE MD 3.328 . 4.713 3.302 3.022 3.646 . 0 0 "[ . 1 . 2]" 1
746 2 27 VAL HA 2 54 ILE MD 3.328 . 4.713 3.302 3.024 3.646 . 0 0 "[ . 1 . 2]" 1
747 1 26 ILE MD 1 58 PHE QD 5.767 . 9.924 5.288 5.076 5.506 . 0 0 "[ . 1 . 2]" 1
748 2 26 ILE MD 2 58 PHE QD 5.767 . 9.924 5.288 5.075 5.506 . 0 0 "[ . 1 . 2]" 1
749 1 17 ALA MB 1 25 LEU MD1 4.253 . 6.513 4.960 3.749 6.348 . 0 0 "[ . 1 . 2]" 1
750 2 17 ALA MB 2 25 LEU MD1 4.253 . 6.513 4.960 3.749 6.349 . 0 0 "[ . 1 . 2]" 1
751 1 21 GLU HG2 1 69 LEU MD2 4.250 . 6.508 5.089 4.484 6.561 0.053 6 0 "[ . 1 . 2]" 1
752 2 21 GLU HG2 2 69 LEU MD2 4.250 . 6.508 5.089 4.485 6.560 0.052 6 0 "[ . 1 . 2]" 1
753 1 31 SER HA 1 47 LEU MD2 4.946 . 8.004 6.362 5.977 6.978 . 0 0 "[ . 1 . 2]" 1
754 2 31 SER HA 2 47 LEU MD2 4.946 . 8.004 6.363 5.975 6.977 . 0 0 "[ . 1 . 2]" 1
755 1 19 LYS HB2 1 58 PHE QD 5.117 . 8.390 2.754 2.168 3.195 . 0 0 "[ . 1 . 2]" 1
756 2 19 LYS HB2 2 58 PHE QD 5.117 . 8.390 2.753 2.167 3.194 . 0 0 "[ . 1 . 2]" 1
757 1 88 ARG HB3 2 69 LEU MD1 8.208 . 16.630 10.081 8.813 13.072 . 0 0 "[ . 1 . 2]" 1
758 1 69 LEU MD1 2 88 ARG HB3 8.208 . 16.630 10.080 8.804 13.057 . 0 0 "[ . 1 . 2]" 1
759 1 56 GLU HB2 2 46 SER HB2 6.882 . 12.803 5.967 5.207 6.854 . 0 0 "[ . 1 . 2]" 1
760 1 46 SER HB2 2 56 GLU HB2 6.882 . 12.803 5.966 5.204 6.795 . 0 0 "[ . 1 . 2]" 1
761 1 56 GLU HB3 2 46 SER HB2 4.999 . 8.123 4.365 3.621 5.266 . 0 0 "[ . 1 . 2]" 1
762 1 46 SER HB2 2 56 GLU HB3 4.999 . 8.123 4.364 3.623 5.267 . 0 0 "[ . 1 . 2]" 1
763 1 79 LEU MD2 2 79 LEU MD2 3.554 . 5.133 2.787 1.972 3.705 0.003 18 0 "[ . 1 . 2]" 1
764 1 25 LEU MD1 2 83 LEU MD2 3.093 . 3.721 1.981 1.895 2.222 0.002 18 0 "[ . 1 . 2]" 1
765 1 83 LEU MD2 2 25 LEU MD1 3.093 . 3.721 1.979 1.896 2.230 0.001 18 0 "[ . 1 . 2]" 1
766 1 47 LEU MD2 2 57 ALA MB 2.739 . 3.677 2.571 2.280 2.933 . 0 0 "[ . 1 . 2]" 1
767 1 57 ALA MB 2 47 LEU MD2 2.739 . 3.677 2.571 2.288 2.964 . 0 0 "[ . 1 . 2]" 1
768 1 47 LEU MD2 2 54 ILE HA 3.494 . 5.020 2.835 2.372 3.536 . 0 0 "[ . 1 . 2]" 1
769 1 54 ILE HA 2 47 LEU MD2 3.494 . 5.020 2.837 2.348 3.539 . 0 0 "[ . 1 . 2]" 1
770 1 47 LEU MD2 2 58 PHE QD 5.293 . 8.795 3.726 3.185 4.394 . 0 0 "[ . 1 . 2]" 1
771 1 58 PHE QD 2 47 LEU MD2 5.293 . 8.795 3.728 3.198 4.385 . 0 0 "[ . 1 . 2]" 1
772 1 47 LEU MD2 2 26 ILE MD 4.697 . 7.455 4.950 4.772 5.343 . 0 0 "[ . 1 . 2]" 1
773 1 26 ILE MD 2 47 LEU MD2 4.697 . 7.455 4.951 4.757 5.357 . 0 0 "[ . 1 . 2]" 1
774 1 83 LEU MD2 2 79 LEU HA 5.114 . 8.383 4.499 4.008 5.227 . 0 0 "[ . 1 . 2]" 1
775 1 79 LEU HA 2 83 LEU MD2 5.114 . 8.383 4.501 4.006 5.235 . 0 0 "[ . 1 . 2]" 1
776 1 83 LEU MD2 2 22 ILE HA 4.299 . 6.609 2.378 2.167 2.748 . 0 0 "[ . 1 . 2]" 1
777 1 22 ILE HA 2 83 LEU MD2 4.299 . 6.609 2.378 2.171 2.783 . 0 0 "[ . 1 . 2]" 1
778 1 83 LEU MD2 2 17 ALA MB 4.941 . 7.993 3.441 2.363 5.176 . 0 0 "[ . 1 . 2]" 1
779 1 17 ALA MB 2 83 LEU MD2 4.941 . 7.993 3.441 2.351 5.194 . 0 0 "[ . 1 . 2]" 1
780 1 83 LEU MD2 2 79 LEU MD1 2.321 . 2.994 2.267 1.869 2.624 . 0 0 "[ . 1 . 2]" 1
781 1 79 LEU MD1 2 83 LEU MD2 2.321 . 2.994 2.267 1.856 2.629 . 0 0 "[ . 1 . 2]" 1
782 1 83 LEU MD2 2 82 ILE MD 3.655 . 5.325 3.648 2.921 4.178 . 0 0 "[ . 1 . 2]" 1
783 1 82 ILE MD 2 83 LEU MD2 3.655 . 5.325 3.650 2.910 4.191 . 0 0 "[ . 1 . 2]" 1
784 1 79 LEU MD1 2 79 LEU MD2 2.861 . 3.885 2.853 2.354 3.532 . 0 0 "[ . 1 . 2]" 1
785 1 79 LEU MD2 2 79 LEU MD1 2.861 . 3.885 2.852 2.352 3.546 . 0 0 "[ . 1 . 2]" 1
786 1 47 LEU MD1 2 57 ALA MB 3.254 . 3.476 3.056 2.657 3.410 . 0 0 "[ . 1 . 2]" 1
787 1 57 ALA MB 2 47 LEU MD1 3.254 . 3.476 3.058 2.626 3.459 . 0 0 "[ . 1 . 2]" 1
788 1 79 LEU MD1 2 83 LEU HB3 4.978 . 8.076 4.947 4.575 5.210 . 0 0 "[ . 1 . 2]" 1
789 1 83 LEU HB3 2 79 LEU MD1 4.978 . 8.076 4.947 4.592 5.197 . 0 0 "[ . 1 . 2]" 1
790 1 79 LEU MD1 2 83 LEU HG 3.089 . 4.282 3.172 2.838 3.422 . 0 0 "[ . 1 . 2]" 1
791 1 83 LEU HG 2 79 LEU MD1 3.089 . 4.282 3.172 2.858 3.413 . 0 0 "[ . 1 . 2]" 1
792 1 83 LEU MD2 2 74 PHE QE 5.504 . 9.290 3.336 2.279 3.775 . 0 0 "[ . 1 . 2]" 1
793 1 74 PHE QE 2 83 LEU MD2 5.504 . 9.290 3.337 2.295 3.790 . 0 0 "[ . 1 . 2]" 1
794 1 47 LEU MD2 2 58 PHE QE 3.529 . 5.086 2.455 2.044 3.224 . 0 0 "[ . 1 . 2]" 1
795 1 58 PHE QE 2 47 LEU MD2 3.529 . 5.086 2.456 2.064 3.228 . 0 0 "[ . 1 . 2]" 1
796 1 57 ALA MB 2 39 ILE MD 2.371 . 3.074 1.914 1.796 2.175 . 0 0 "[ . 1 . 2]" 1
797 1 39 ILE MD 2 57 ALA MB 2.371 . 3.074 1.912 1.784 2.169 . 0 0 "[ . 1 . 2]" 1
798 1 57 ALA MB 2 47 LEU HG 2.439 . 3.183 2.516 2.216 3.042 . 0 0 "[ . 1 . 2]" 1
799 1 47 LEU HG 2 57 ALA MB 2.439 . 3.183 2.515 2.228 3.034 . 0 0 "[ . 1 . 2]" 1
800 1 57 ALA MB 2 43 GLY HA2 4.825 . 7.735 2.749 2.249 3.389 . 0 0 "[ . 1 . 2]" 1
801 1 43 GLY HA2 2 57 ALA MB 4.825 . 7.735 2.747 2.253 3.419 . 0 0 "[ . 1 . 2]" 1
802 1 57 ALA MB 2 46 SER HB3 3.868 . 5.738 3.288 2.077 4.928 . 0 0 "[ . 1 . 2]" 1
803 1 46 SER HB3 2 57 ALA MB 3.868 . 5.738 3.287 2.055 4.912 . 0 0 "[ . 1 . 2]" 1
804 1 57 ALA MB 2 46 SER HA 6.508 . 11.802 5.069 4.625 5.967 . 0 0 "[ . 1 . 2]" 1
805 1 46 SER HA 2 57 ALA MB 6.508 . 11.802 5.067 4.567 5.960 . 0 0 "[ . 1 . 2]" 1
806 1 50 ALA MB 2 54 ILE MD 3.977 . 5.926 3.538 3.056 3.852 . 0 0 "[ . 1 . 2]" 1
807 1 54 ILE MD 2 50 ALA MB 3.977 . 5.926 3.539 3.045 3.833 . 0 0 "[ . 1 . 2]" 1
808 1 50 ALA MB 2 53 CYS HB3 3.803 . 5.611 2.702 2.297 4.129 . 0 0 "[ . 1 . 2]" 1
809 1 53 CYS HB3 2 50 ALA MB 3.803 . 5.611 2.702 2.284 4.141 . 0 0 "[ . 1 . 2]" 1
810 1 50 ALA MB 2 54 ILE HA 4.880 . 7.857 4.255 3.669 5.174 . 0 0 "[ . 1 . 2]" 1
811 1 54 ILE HA 2 50 ALA MB 4.880 . 7.857 4.255 3.659 5.163 . 0 0 "[ . 1 . 2]" 1
812 1 50 ALA MB 2 50 ALA HA 3.386 . 4.819 2.624 2.375 3.347 . 0 0 "[ . 1 . 2]" 1
813 1 50 ALA HA 2 50 ALA MB 3.386 . 4.819 2.624 2.362 3.336 . 0 0 "[ . 1 . 2]" 1
814 1 51 MET ME 2 50 ALA MB 4.247 . 6.502 6.059 5.480 6.466 . 0 0 "[ . 1 . 2]" 1
815 1 50 ALA MB 2 51 MET ME 4.247 . 6.502 6.059 5.475 6.469 . 0 0 "[ . 1 . 2]" 1
816 1 23 ALA MB 2 29 TYR QD 6.751 . 12.449 5.124 4.743 5.563 . 0 0 "[ . 1 . 2]" 1
817 1 29 TYR QD 2 23 ALA MB 6.751 . 12.449 5.123 4.769 5.578 . 0 0 "[ . 1 . 2]" 1
818 1 17 ALA MB 2 84 ASN HA 5.176 . 8.525 2.922 2.063 4.473 . 0 0 "[ . 1 . 2]" 1
819 1 84 ASN HA 2 17 ALA MB 5.176 . 8.525 2.921 2.040 4.491 . 0 0 "[ . 1 . 2]" 1
820 1 17 ALA MB 2 81 ASP HA 5.341 . 8.906 4.733 4.136 6.601 . 0 0 "[ . 1 . 2]" 1
821 1 81 ASP HA 2 17 ALA MB 5.341 . 8.906 4.731 4.145 6.604 . 0 0 "[ . 1 . 2]" 1
822 1 17 ALA MB 2 83 LEU HA 5.966 . 10.416 4.729 3.961 6.547 . 0 0 "[ . 1 . 2]" 1
823 1 83 LEU HA 2 17 ALA MB 5.966 . 10.416 4.729 3.953 6.546 . 0 0 "[ . 1 . 2]" 1
824 1 54 ILE MD 2 47 LEU MD2 4.983 . 8.087 4.408 3.959 4.697 . 0 0 "[ . 1 . 2]" 1
825 1 47 LEU MD2 2 54 ILE MD 4.983 . 8.087 4.407 3.962 4.689 . 0 0 "[ . 1 . 2]" 1
826 1 54 ILE MD 2 54 ILE MD 2.835 . 3.840 3.192 2.326 3.586 . 0 0 "[ . 1 . 2]" 1
827 1 54 ILE MD 2 30 PHE QD 5.317 . 8.851 4.908 4.688 5.271 . 0 0 "[ . 1 . 2]" 1
828 1 30 PHE QD 2 54 ILE MD 5.317 . 8.851 4.907 4.687 5.271 . 0 0 "[ . 1 . 2]" 1
829 1 26 ILE MD 2 79 LEU MD2 2.914 . 3.976 2.323 2.112 2.584 . 0 0 "[ . 1 . 2]" 1
830 1 79 LEU MD2 2 26 ILE MD 2.914 . 3.976 2.324 2.156 2.611 . 0 0 "[ . 1 . 2]" 1
831 1 26 ILE MD 2 26 ILE HA 4.431 . 6.885 3.325 3.138 3.703 . 0 0 "[ . 1 . 2]" 1
832 1 26 ILE HA 2 26 ILE MD 4.431 . 6.885 3.325 3.128 3.716 . 0 0 "[ . 1 . 2]" 1
833 1 26 ILE MD 2 30 PHE HZ 3.892 . 5.786 2.503 2.268 3.025 . 0 0 "[ . 1 . 2]" 1
834 1 30 PHE HZ 2 26 ILE MD 3.892 . 5.786 2.502 2.285 3.006 . 0 0 "[ . 1 . 2]" 1
835 1 26 ILE MD 2 30 PHE QE 5.166 . 8.502 2.658 2.174 3.066 . 0 0 "[ . 1 . 2]" 1
836 1 30 PHE QE 2 26 ILE MD 5.166 . 8.502 2.657 2.150 3.053 . 0 0 "[ . 1 . 2]" 1
837 1 39 ILE MD 2 54 ILE HA 5.209 . 8.600 5.331 5.053 5.587 . 0 0 "[ . 1 . 2]" 1
838 1 54 ILE HA 2 39 ILE MD 5.209 . 8.600 5.333 5.051 5.588 . 0 0 "[ . 1 . 2]" 1
839 1 39 ILE MD 2 57 ALA HA 4.590 . 7.224 3.100 2.456 3.661 . 0 0 "[ . 1 . 2]" 1
840 1 57 ALA HA 2 39 ILE MD 4.590 . 7.224 3.102 2.471 3.692 . 0 0 "[ . 1 . 2]" 1
841 1 39 ILE MD 2 58 PHE HA 5.142 . 8.447 3.702 3.145 5.134 . 0 0 "[ . 1 . 2]" 1
842 1 58 PHE HA 2 39 ILE MD 5.142 . 8.447 3.705 3.136 5.102 . 0 0 "[ . 1 . 2]" 1
843 1 39 ILE MD 2 58 PHE QD 5.773 . 9.394 4.007 3.504 4.782 . 0 0 "[ . 1 . 2]" 1
844 1 58 PHE QD 2 39 ILE MD 5.773 . 9.394 4.010 3.519 4.758 . 0 0 "[ . 1 . 2]" 1
845 1 82 ILE MD 2 86 ALA MB 4.097 . 5.167 3.167 2.586 4.020 . 0 0 "[ . 1 . 2]" 1
846 1 86 ALA MB 2 82 ILE MD 4.097 . 5.167 3.168 2.563 4.012 . 0 0 "[ . 1 . 2]" 1
847 1 82 ILE MD 2 83 LEU HA 4.930 . 7.968 3.663 2.958 4.425 . 0 0 "[ . 1 . 2]" 1
848 1 83 LEU HA 2 82 ILE MD 4.930 . 7.968 3.662 2.949 4.425 . 0 0 "[ . 1 . 2]" 1
849 1 22 ILE MD 2 79 LEU MD2 4.991 . 8.104 4.159 3.588 4.733 . 0 0 "[ . 1 . 2]" 1
850 1 79 LEU MD2 2 22 ILE MD 4.991 . 8.104 4.158 3.593 4.736 . 0 0 "[ . 1 . 2]" 1
851 1 22 ILE MD 2 80 ALA MB 2.534 . 3.337 1.894 1.796 1.994 . 0 0 "[ . 1 . 2]" 1
852 1 80 ALA MB 2 22 ILE MD 2.534 . 3.337 1.891 1.784 2.024 . 0 0 "[ . 1 . 2]" 1
853 1 22 ILE MD 2 80 ALA HA 3.717 . 5.444 2.740 2.271 3.197 . 0 0 "[ . 1 . 2]" 1
854 1 80 ALA HA 2 22 ILE MD 3.717 . 5.444 2.740 2.286 3.163 . 0 0 "[ . 1 . 2]" 1
855 1 22 ILE MD 2 29 TYR QE 6.284 . 11.221 2.764 2.348 3.011 . 0 0 "[ . 1 . 2]" 1
856 1 29 TYR QE 2 22 ILE MD 6.284 . 11.221 2.762 2.355 3.021 . 0 0 "[ . 1 . 2]" 1
857 1 33 ILE MD 2 58 PHE HZ 3.510 . 5.050 2.280 2.083 2.447 . 0 0 "[ . 1 . 2]" 1
858 1 58 PHE HZ 2 33 ILE MD 3.510 . 5.050 2.281 2.098 2.458 . 0 0 "[ . 1 . 2]" 1
859 1 33 ILE MD 2 58 PHE QD 6.589 . 12.016 4.309 3.958 4.451 . 0 0 "[ . 1 . 2]" 1
860 1 58 PHE QD 2 33 ILE MD 6.589 . 12.016 4.311 3.926 4.468 . 0 0 "[ . 1 . 2]" 1
861 1 33 ILE MD 2 19 LYS HA 6.109 . 10.774 4.627 4.247 5.356 . 0 0 "[ . 1 . 2]" 1
862 1 19 LYS HA 2 33 ILE MD 6.109 . 10.774 4.631 4.238 5.382 . 0 0 "[ . 1 . 2]" 1
863 1 58 PHE QE 2 29 TYR QE 8.067 . 16.202 2.699 2.151 3.218 . 0 0 "[ . 1 . 2]" 1
864 1 29 TYR QE 2 58 PHE QE 8.067 . 16.202 2.700 2.141 3.230 . 0 0 "[ . 1 . 2]" 1
865 1 74 PHE QE 2 83 LEU HA 7.208 . 13.702 3.281 2.800 4.628 . 0 0 "[ . 1 . 2]" 1
866 1 83 LEU HA 2 74 PHE QE 7.208 . 13.702 3.279 2.798 4.639 . 0 0 "[ . 1 . 2]" 1
867 1 74 PHE QE 2 83 LEU HB3 6.192 . 10.985 2.607 1.809 3.258 . 0 0 "[ . 1 . 2]" 1
868 1 83 LEU HB3 2 74 PHE QE 6.192 . 10.985 2.607 1.798 3.259 . 0 0 "[ . 1 . 2]" 1
869 1 30 PHE HZ 2 54 ILE HB 6.179 . 10.951 4.946 4.699 5.464 . 0 0 "[ . 1 . 2]" 1
870 1 54 ILE HB 2 30 PHE HZ 6.179 . 10.951 4.946 4.730 5.470 . 0 0 "[ . 1 . 2]" 1
871 1 29 TYR QD 2 26 ILE MD 5.491 . 9.260 2.422 2.098 2.904 . 0 0 "[ . 1 . 2]" 1
872 1 26 ILE MD 2 29 TYR QD 5.491 . 9.260 2.423 2.093 2.909 . 0 0 "[ . 1 . 2]" 1
873 1 29 TYR QD 2 58 PHE HZ 7.567 . 14.724 3.536 3.018 3.907 . 0 0 "[ . 1 . 2]" 1
874 1 58 PHE HZ 2 29 TYR QD 7.567 . 14.724 3.535 3.039 3.896 . 0 0 "[ . 1 . 2]" 1
875 1 58 PHE QD 2 47 LEU MD1 5.864 . 10.162 4.679 4.108 5.047 . 0 0 "[ . 1 . 2]" 1
876 1 47 LEU MD1 2 58 PHE QD 5.864 . 10.162 4.677 4.095 5.025 . 0 0 "[ . 1 . 2]" 1
877 1 58 PHE QD 2 30 PHE QE 8.361 . 17.099 4.335 4.135 4.874 . 0 0 "[ . 1 . 2]" 1
878 1 30 PHE QE 2 58 PHE QD 8.361 . 17.099 4.334 4.129 4.902 . 0 0 "[ . 1 . 2]" 1
879 1 74 PHE QD 2 83 LEU HB3 6.284 . 11.220 4.232 2.212 5.020 . 0 0 "[ . 1 . 2]" 1
880 1 83 LEU HB3 2 74 PHE QD 6.284 . 11.220 4.231 2.213 5.018 . 0 0 "[ . 1 . 2]" 1
881 1 86 ALA MB 2 74 PHE QD 4.741 . 7.550 3.937 2.626 5.479 . 0 0 "[ . 1 . 2]" 1
882 1 74 PHE QD 2 86 ALA MB 4.741 . 7.550 3.937 2.633 5.482 . 0 0 "[ . 1 . 2]" 1
883 1 86 ALA MB 2 74 PHE QE 5.027 . 8.186 3.220 1.981 5.652 . 0 0 "[ . 1 . 2]" 1
884 1 74 PHE QE 2 86 ALA MB 5.027 . 8.186 3.221 1.974 5.658 . 0 0 "[ . 1 . 2]" 1
885 1 86 ALA MB 2 86 ALA HA 4.891 . 7.881 5.794 3.833 7.391 . 0 0 "[ . 1 . 2]" 1
886 1 86 ALA HA 2 86 ALA MB 4.891 . 7.881 5.794 3.827 7.383 . 0 0 "[ . 1 . 2]" 1
887 1 86 ALA MB 2 82 ILE HA 3.997 . 5.994 3.864 3.006 4.939 . 0 0 "[ . 1 . 2]" 1
888 1 82 ILE HA 2 86 ALA MB 3.997 . 5.994 3.865 3.011 4.942 . 0 0 "[ . 1 . 2]" 1
889 1 86 ALA MB 2 79 LEU MD1 4.507 . 7.047 5.513 4.833 5.811 . 0 0 "[ . 1 . 2]" 1
890 1 79 LEU MD1 2 86 ALA MB 4.507 . 7.047 5.513 4.815 5.823 . 0 0 "[ . 1 . 2]" 1
891 1 50 ALA MB 2 53 CYS HB2 3.683 . 5.378 2.288 1.963 3.554 0.025 9 0 "[ . 1 . 2]" 1
892 1 53 CYS HB2 2 50 ALA MB 3.683 . 5.378 2.288 1.961 3.555 0.027 10 0 "[ . 1 . 2]" 1
893 1 62 ARG H 1 63 GLU H 2.646 . 3.521 2.698 2.523 2.919 . 0 0 "[ . 1 . 2]" 1
894 2 62 ARG H 2 63 GLU H 2.646 . 3.521 2.698 2.511 2.919 . 0 0 "[ . 1 . 2]" 1
895 1 73 GLU H 1 74 PHE H 3.001 . 4.127 2.888 2.398 4.141 0.015 6 0 "[ . 1 . 2]" 1
896 2 73 GLU H 2 74 PHE H 3.001 . 4.127 2.888 2.400 4.142 0.015 6 0 "[ . 1 . 2]" 1
897 1 31 SER H 1 32 SER H 2.688 . 3.591 2.632 2.548 2.729 . 0 0 "[ . 1 . 2]" 1
898 2 31 SER H 2 32 SER H 2.688 . 3.591 2.631 2.550 2.728 . 0 0 "[ . 1 . 2]" 1
899 1 63 GLU H 1 64 ALA H 2.332 . 3.012 2.497 2.307 2.779 . 0 0 "[ . 1 . 2]" 1
900 2 63 GLU H 2 64 ALA H 2.332 . 3.012 2.498 2.309 2.775 . 0 0 "[ . 1 . 2]" 1
901 1 63 GLU H 1 65 VAL H 4.610 . 7.267 4.221 4.035 4.421 . 0 0 "[ . 1 . 2]" 1
902 2 63 GLU H 2 65 VAL H 4.610 . 7.267 4.222 4.048 4.418 . 0 0 "[ . 1 . 2]" 1
903 1 20 GLU H 1 21 GLU H 2.755 . 3.704 2.672 2.542 2.823 . 0 0 "[ . 1 . 2]" 1
904 2 20 GLU H 2 21 GLU H 2.755 . 3.704 2.672 2.544 2.821 . 0 0 "[ . 1 . 2]" 1
905 1 50 ALA H 1 51 MET H 2.780 . 3.746 2.614 2.539 2.724 . 0 0 "[ . 1 . 2]" 1
906 2 50 ALA H 2 51 MET H 2.780 . 3.746 2.613 2.541 2.724 . 0 0 "[ . 1 . 2]" 1
907 1 51 MET H 1 52 ASP H 2.732 . 3.665 2.733 2.584 2.882 . 0 0 "[ . 1 . 2]" 1
908 2 51 MET H 2 52 ASP H 2.732 . 3.665 2.732 2.580 2.882 . 0 0 "[ . 1 . 2]" 1
909 1 40 SER H 1 41 GLU H 4.787 . 7.651 4.598 4.482 4.652 . 0 0 "[ . 1 . 2]" 1
910 2 40 SER H 2 41 GLU H 4.787 . 7.651 4.598 4.487 4.651 . 0 0 "[ . 1 . 2]" 1
911 1 18 SER H 1 21 GLU H 4.324 . 6.662 4.041 3.775 4.424 . 0 0 "[ . 1 . 2]" 1
912 2 18 SER H 2 21 GLU H 4.324 . 6.662 4.041 3.777 4.421 . 0 0 "[ . 1 . 2]" 1
913 1 76 GLY H 1 77 GLN H 3.188 . 4.458 2.924 1.907 4.414 0.011 7 0 "[ . 1 . 2]" 1
914 2 76 GLY H 2 77 GLN H 3.188 . 4.458 2.924 1.907 4.414 0.011 7 0 "[ . 1 . 2]" 1
915 1 54 ILE H 1 56 GLU H 4.061 . 6.123 4.232 4.045 4.447 . 0 0 "[ . 1 . 2]" 1
916 2 54 ILE H 2 56 GLU H 4.061 . 6.123 4.231 4.048 4.447 . 0 0 "[ . 1 . 2]" 1
917 1 53 CYS H 1 54 ILE H 2.727 . 3.657 2.712 2.580 2.943 . 0 0 "[ . 1 . 2]" 1
918 2 53 CYS H 2 54 ILE H 2.727 . 3.657 2.713 2.581 2.939 . 0 0 "[ . 1 . 2]" 1
919 1 54 ILE H 1 55 SER H 2.572 . 3.399 2.750 2.670 2.882 . 0 0 "[ . 1 . 2]" 1
920 2 54 ILE H 2 55 SER H 2.572 . 3.399 2.748 2.670 2.879 . 0 0 "[ . 1 . 2]" 1
921 1 33 ILE H 1 35 GLU H 3.537 . 5.101 3.818 3.642 3.978 . 0 0 "[ . 1 . 2]" 1
922 2 33 ILE H 2 35 GLU H 3.537 . 5.101 3.819 3.639 3.979 . 0 0 "[ . 1 . 2]" 1
923 1 42 ASP H 1 44 ALA H 4.205 . 6.416 4.091 3.730 4.253 . 0 0 "[ . 1 . 2]" 1
924 2 42 ASP H 2 44 ALA H 4.205 . 6.416 4.091 3.736 4.247 . 0 0 "[ . 1 . 2]" 1
925 1 44 ALA H 1 45 ASP H 2.537 . 3.342 2.688 2.508 2.814 . 0 0 "[ . 1 . 2]" 1
926 2 44 ALA H 2 45 ASP H 2.537 . 3.342 2.689 2.511 2.814 . 0 0 "[ . 1 . 2]" 1
927 1 40 SER H 1 44 ALA H 4.422 . 6.867 4.567 4.328 4.915 . 0 0 "[ . 1 . 2]" 1
928 2 40 SER H 2 44 ALA H 4.422 . 6.867 4.569 4.326 4.919 . 0 0 "[ . 1 . 2]" 1
929 1 66 SER H 1 67 GLY H 2.717 . 3.639 2.630 2.529 2.755 . 0 0 "[ . 1 . 2]" 1
930 2 66 SER H 2 67 GLY H 2.717 . 3.639 2.632 2.526 2.750 . 0 0 "[ . 1 . 2]" 1
931 1 80 ALA H 1 82 ILE H 3.766 . 5.539 4.134 3.935 4.261 . 0 0 "[ . 1 . 2]" 1
932 2 80 ALA H 2 82 ILE H 3.766 . 5.539 4.135 3.933 4.261 . 0 0 "[ . 1 . 2]" 1
933 1 80 ALA H 1 81 ASP H 2.822 . 3.818 2.671 2.580 2.773 . 0 0 "[ . 1 . 2]" 1
934 2 80 ALA H 2 81 ASP H 2.822 . 3.818 2.672 2.585 2.773 . 0 0 "[ . 1 . 2]" 1
935 1 48 ASN H 1 49 VAL H 2.696 . 3.604 2.763 2.624 2.907 . 0 0 "[ . 1 . 2]" 1
936 2 48 ASN H 2 49 VAL H 2.696 . 3.604 2.765 2.632 2.909 . 0 0 "[ . 1 . 2]" 1
937 1 46 SER H 1 47 LEU H 2.440 . 3.184 2.641 2.546 2.742 . 0 0 "[ . 1 . 2]" 1
938 2 46 SER H 2 47 LEU H 2.440 . 3.184 2.640 2.546 2.742 . 0 0 "[ . 1 . 2]" 1
939 1 51 MET H 1 53 CYS H 3.967 . 5.934 3.987 3.770 4.416 . 0 0 "[ . 1 . 2]" 1
940 2 51 MET H 2 53 CYS H 3.967 . 5.934 3.987 3.767 4.417 . 0 0 "[ . 1 . 2]" 1
941 1 52 ASP H 1 53 CYS H 2.666 . 3.555 2.619 2.523 2.751 . 0 0 "[ . 1 . 2]" 1
942 2 52 ASP H 2 53 CYS H 2.666 . 3.555 2.621 2.527 2.750 . 0 0 "[ . 1 . 2]" 1
943 1 30 PHE H 1 31 SER H 2.758 . 3.708 2.709 2.649 2.764 . 0 0 "[ . 1 . 2]" 1
944 2 30 PHE H 2 31 SER H 2.758 . 3.708 2.709 2.650 2.763 . 0 0 "[ . 1 . 2]" 1
945 1 41 GLU H 1 42 ASP H 2.768 . 3.726 2.864 2.643 3.026 . 0 0 "[ . 1 . 2]" 1
946 2 41 GLU H 2 42 ASP H 2.768 . 3.726 2.863 2.646 3.022 . 0 0 "[ . 1 . 2]" 1
947 1 23 ALA H 1 24 ALA H 2.709 . 3.626 2.684 2.631 2.740 . 0 0 "[ . 1 . 2]" 1
948 2 23 ALA H 2 24 ALA H 2.709 . 3.626 2.684 2.632 2.739 . 0 0 "[ . 1 . 2]" 1
949 1 24 ALA H 1 25 LEU H 2.616 . 3.471 2.802 2.716 2.902 . 0 0 "[ . 1 . 2]" 1
950 2 24 ALA H 2 25 LEU H 2.616 . 3.471 2.801 2.715 2.904 . 0 0 "[ . 1 . 2]" 1
951 1 60 PHE H 1 61 GLU H 4.498 . 7.027 4.397 4.362 4.428 . 0 0 "[ . 1 . 2]" 1
952 2 60 PHE H 2 61 GLU H 4.498 . 7.027 4.396 4.362 4.429 . 0 0 "[ . 1 . 2]" 1
953 1 68 ILE H 1 69 LEU H 2.618 . 3.475 2.716 2.611 2.814 . 0 0 "[ . 1 . 2]" 1
954 2 68 ILE H 2 69 LEU H 2.618 . 3.475 2.716 2.613 2.816 . 0 0 "[ . 1 . 2]" 1
955 1 70 GLY H 1 72 SER H 4.513 . 7.059 3.982 3.449 4.619 . 0 0 "[ . 1 . 2]" 1
956 2 70 GLY H 2 72 SER H 4.513 . 7.059 3.980 3.444 4.623 . 0 0 "[ . 1 . 2]" 1
957 1 70 GLY H 1 71 LYS H 2.723 . 3.650 2.426 2.106 2.703 . 0 0 "[ . 1 . 2]" 1
958 2 70 GLY H 2 71 LYS H 2.723 . 3.650 2.424 2.108 2.702 . 0 0 "[ . 1 . 2]" 1
959 1 49 VAL H 1 50 ALA H 2.475 . 3.241 2.601 2.479 2.652 . 0 0 "[ . 1 . 2]" 1
960 2 49 VAL H 2 50 ALA H 2.475 . 3.241 2.602 2.481 2.654 . 0 0 "[ . 1 . 2]" 1
961 1 20 GLU H 1 23 ALA H 3.766 . 5.539 4.825 4.671 4.952 . 0 0 "[ . 1 . 2]" 1
962 2 20 GLU H 2 23 ALA H 3.766 . 5.539 4.826 4.670 4.955 . 0 0 "[ . 1 . 2]" 1
963 1 64 ALA H 1 65 VAL H 2.128 . 2.694 2.312 2.114 2.589 . 0 0 "[ . 1 . 2]" 1
964 2 64 ALA H 2 65 VAL H 2.128 . 2.694 2.312 2.113 2.586 . 0 0 "[ . 1 . 2]" 1
965 1 16 SER H 1 17 ALA H 3.035 . 4.186 3.466 2.242 4.362 0.176 9 0 "[ . 1 . 2]" 1
966 2 16 SER H 2 17 ALA H 3.035 . 4.186 3.465 2.244 4.362 0.176 9 0 "[ . 1 . 2]" 1
967 1 56 GLU H 1 57 ALA H 2.508 . 3.294 2.621 2.529 2.707 . 0 0 "[ . 1 . 2]" 1
968 2 56 GLU H 2 57 ALA H 2.508 . 3.294 2.620 2.535 2.711 . 0 0 "[ . 1 . 2]" 1
969 1 57 ALA H 1 59 GLY H 3.821 . 5.646 3.858 3.743 3.970 . 0 0 "[ . 1 . 2]" 1
970 2 57 ALA H 2 59 GLY H 3.821 . 5.646 3.858 3.740 3.975 . 0 0 "[ . 1 . 2]" 1
971 1 57 ALA H 1 58 PHE H 2.670 . 3.561 2.701 2.614 2.789 . 0 0 "[ . 1 . 2]" 1
972 2 57 ALA H 2 58 PHE H 2.670 . 3.561 2.701 2.610 2.790 . 0 0 "[ . 1 . 2]" 1
973 1 38 GLU H 1 39 ILE H 1.679 . 2.031 2.139 2.092 2.177 0.146 2 0 "[ . 1 . 2]" 1
974 2 38 GLU H 2 39 ILE H 1.679 . 2.031 2.139 2.097 2.178 0.147 16 0 "[ . 1 . 2]" 1
975 1 15 MET H 1 16 SER H 3.203 . 4.485 3.379 2.184 4.581 0.096 13 0 "[ . 1 . 2]" 1
976 2 15 MET H 2 16 SER H 3.203 . 4.485 3.378 2.182 4.580 0.095 13 0 "[ . 1 . 2]" 1
977 1 22 ILE H 1 23 ALA H 2.786 . 3.756 2.671 2.613 2.787 . 0 0 "[ . 1 . 2]" 1
978 2 22 ILE H 2 23 ALA H 2.786 . 3.756 2.672 2.613 2.786 . 0 0 "[ . 1 . 2]" 1
979 1 21 GLU H 1 22 ILE H 2.469 . 3.231 2.556 2.446 2.660 . 0 0 "[ . 1 . 2]" 1
980 2 21 GLU H 2 22 ILE H 2.469 . 3.231 2.556 2.447 2.659 . 0 0 "[ . 1 . 2]" 1
981 1 28 ASN H 1 29 TYR H 2.714 . 3.635 2.654 2.532 2.778 . 0 0 "[ . 1 . 2]" 1
982 2 28 ASN H 2 29 TYR H 2.714 . 3.635 2.654 2.530 2.778 . 0 0 "[ . 1 . 2]" 1
983 1 29 TYR H 1 30 PHE H 2.765 . 3.721 2.756 2.589 2.848 . 0 0 "[ . 1 . 2]" 1
984 2 29 TYR H 2 30 PHE H 2.765 . 3.721 2.756 2.592 2.848 . 0 0 "[ . 1 . 2]" 1
985 1 72 SER H 1 74 PHE H 4.495 . 7.021 4.897 4.026 7.045 0.024 20 0 "[ . 1 . 2]" 1
986 2 72 SER H 2 74 PHE H 4.495 . 7.021 4.897 4.027 7.043 0.022 20 0 "[ . 1 . 2]" 1
987 1 43 GLY H 1 44 ALA H 2.545 . 3.355 2.626 2.400 2.733 . 0 0 "[ . 1 . 2]" 1
988 2 43 GLY H 2 44 ALA H 2.545 . 3.355 2.628 2.408 2.736 . 0 0 "[ . 1 . 2]" 1
989 1 42 ASP H 1 43 GLY H 2.480 . 3.249 2.710 2.533 2.845 . 0 0 "[ . 1 . 2]" 1
990 2 42 ASP H 2 43 GLY H 2.480 . 3.249 2.710 2.539 2.848 . 0 0 "[ . 1 . 2]" 1
991 1 77 GLN H 1 78 HIS H 4.733 . 7.533 4.453 3.913 4.634 . 0 0 "[ . 1 . 2]" 1
992 2 77 GLN H 2 78 HIS H 4.733 . 7.533 4.453 3.918 4.635 . 0 0 "[ . 1 . 2]" 1
993 1 83 LEU H 1 84 ASN H 3.137 . 4.367 2.622 2.521 2.718 . 0 0 "[ . 1 . 2]" 1
994 2 83 LEU H 2 84 ASN H 3.137 . 4.367 2.621 2.520 2.716 . 0 0 "[ . 1 . 2]" 1
995 1 84 ASN H 1 85 SER H 2.603 . 3.450 2.600 2.466 2.776 . 0 0 "[ . 1 . 2]" 1
996 2 84 ASN H 2 85 SER H 2.603 . 3.450 2.601 2.459 2.776 . 0 0 "[ . 1 . 2]" 1
997 1 35 GLU H 1 37 LYS H 3.755 . 5.517 3.657 3.402 4.016 . 0 0 "[ . 1 . 2]" 1
998 2 35 GLU H 2 37 LYS H 3.755 . 5.517 3.657 3.399 4.012 . 0 0 "[ . 1 . 2]" 1
999 1 37 LYS H 1 38 GLU H 2.764 . 3.719 2.948 2.830 3.198 . 0 0 "[ . 1 . 2]" 1
1000 2 37 LYS H 2 38 GLU H 2.764 . 3.719 2.948 2.825 3.193 . 0 0 "[ . 1 . 2]" 1
1001 1 32 SER H 1 33 ILE H 2.524 . 3.320 2.574 2.433 2.680 . 0 0 "[ . 1 . 2]" 1
1002 2 32 SER H 2 33 ILE H 2.524 . 3.320 2.574 2.431 2.680 . 0 0 "[ . 1 . 2]" 1
1003 1 37 LYS H 1 39 ILE H 4.451 . 6.927 4.577 4.339 4.789 . 0 0 "[ . 1 . 2]" 1
1004 2 37 LYS H 2 39 ILE H 4.451 . 6.927 4.577 4.341 4.785 . 0 0 "[ . 1 . 2]" 1
1005 1 91 GLU H 1 92 SER H 3.948 . 5.897 4.039 2.576 4.615 . 0 0 "[ . 1 . 2]" 1
1006 2 91 GLU H 2 92 SER H 3.948 . 5.897 4.041 2.590 4.620 . 0 0 "[ . 1 . 2]" 1
1007 1 82 ILE H 1 83 LEU H 2.718 . 3.641 2.754 2.626 2.816 . 0 0 "[ . 1 . 2]" 1
1008 2 82 ILE H 2 83 LEU H 2.718 . 3.641 2.755 2.629 2.817 . 0 0 "[ . 1 . 2]" 1
1009 1 45 ASP H 1 46 SER H 2.525 . 3.322 2.637 2.515 2.820 . 0 0 "[ . 1 . 2]" 1
1010 2 45 ASP H 2 46 SER H 2.525 . 3.322 2.637 2.517 2.824 . 0 0 "[ . 1 . 2]" 1
1011 1 67 GLY H 1 68 ILE H 2.466 . 3.226 2.609 2.406 2.732 . 0 0 "[ . 1 . 2]" 1
1012 2 67 GLY H 2 68 ILE H 2.466 . 3.226 2.608 2.414 2.722 . 0 0 "[ . 1 . 2]" 1
1013 1 43 GLY H 1 45 ASP H 4.245 . 6.497 4.213 3.862 4.451 . 0 0 "[ . 1 . 2]" 1
1014 2 43 GLY H 2 45 ASP H 4.245 . 6.497 4.215 3.869 4.448 . 0 0 "[ . 1 . 2]" 1
1015 1 35 GLU H 1 36 LYS H 2.414 . 3.142 2.736 2.619 2.913 . 0 0 "[ . 1 . 2]" 1
1016 2 35 GLU H 2 36 LYS H 2.414 . 3.142 2.736 2.617 2.908 . 0 0 "[ . 1 . 2]" 1
1017 1 36 LYS H 1 37 LYS H 2.392 . 3.107 2.414 2.212 2.643 . 0 0 "[ . 1 . 2]" 1
1018 2 36 LYS H 2 37 LYS H 2.392 . 3.107 2.415 2.211 2.638 . 0 0 "[ . 1 . 2]" 1
1019 1 36 LYS H 1 38 GLU H 4.267 . 6.543 4.068 3.723 4.500 . 0 0 "[ . 1 . 2]" 1
1020 2 36 LYS H 2 38 GLU H 4.267 . 6.543 4.068 3.726 4.495 . 0 0 "[ . 1 . 2]" 1
1021 1 86 ALA H 1 87 SER H 4.319 . 6.650 3.859 2.656 4.620 . 0 0 "[ . 1 . 2]" 1
1022 2 86 ALA H 2 87 SER H 4.319 . 6.650 3.857 2.658 4.616 . 0 0 "[ . 1 . 2]" 1
1023 1 21 GLU H 1 23 ALA H 3.968 . 5.936 4.124 3.984 4.235 . 0 0 "[ . 1 . 2]" 1
1024 2 21 GLU H 2 23 ALA H 3.968 . 5.936 4.125 3.985 4.235 . 0 0 "[ . 1 . 2]" 1
1025 1 59 GLY H 1 60 PHE H 2.590 . 3.429 2.378 2.133 2.613 . 0 0 "[ . 1 . 2]" 1
1026 2 59 GLY H 2 60 PHE H 2.590 . 3.429 2.377 2.136 2.611 . 0 0 "[ . 1 . 2]" 1
1027 1 34 VAL H 1 35 GLU H 2.465 . 3.225 2.446 2.369 2.514 . 0 0 "[ . 1 . 2]" 1
1028 2 34 VAL H 2 35 GLU H 2.465 . 3.225 2.446 2.370 2.508 . 0 0 "[ . 1 . 2]" 1
1029 1 44 ALA H 1 46 SER H 4.004 . 6.008 4.054 3.863 4.266 . 0 0 "[ . 1 . 2]" 1
1030 2 44 ALA H 2 46 SER H 4.004 . 6.008 4.055 3.863 4.266 . 0 0 "[ . 1 . 2]" 1
1031 1 46 SER H 1 48 ASN H 4.015 . 6.030 3.925 3.832 4.059 . 0 0 "[ . 1 . 2]" 1
1032 2 46 SER H 2 48 ASN H 4.015 . 6.030 3.925 3.838 4.058 . 0 0 "[ . 1 . 2]" 1
1033 1 33 ILE H 1 34 VAL H 2.503 . 3.286 2.726 2.595 2.852 . 0 0 "[ . 1 . 2]" 1
1034 2 33 ILE H 2 34 VAL H 2.503 . 3.286 2.727 2.596 2.853 . 0 0 "[ . 1 . 2]" 1
1035 1 55 SER H 1 58 PHE H 4.074 . 6.149 4.987 4.849 5.186 . 0 0 "[ . 1 . 2]" 1
1036 2 55 SER H 2 58 PHE H 4.074 . 6.149 4.987 4.849 5.187 . 0 0 "[ . 1 . 2]" 1
1037 1 55 SER H 1 56 GLU H 2.803 . 3.785 2.734 2.636 2.870 . 0 0 "[ . 1 . 2]" 1
1038 2 55 SER H 2 56 GLU H 2.803 . 3.785 2.735 2.634 2.869 . 0 0 "[ . 1 . 2]" 1
1039 1 48 ASN H 1 48 ASN HD22 4.711 . 7.485 4.132 3.894 4.343 . 0 0 "[ . 1 . 2]" 1
1040 2 48 ASN H 2 48 ASN HD22 4.711 . 7.485 4.132 3.886 4.337 . 0 0 "[ . 1 . 2]" 1
1041 1 46 SER H 1 48 ASN HD22 4.895 . 7.890 6.979 6.654 7.428 . 0 0 "[ . 1 . 2]" 1
1042 2 46 SER H 2 48 ASN HD22 4.895 . 7.890 6.979 6.659 7.422 . 0 0 "[ . 1 . 2]" 1
1043 1 58 PHE H 1 60 PHE H 4.596 . 7.237 4.022 3.724 4.273 . 0 0 "[ . 1 . 2]" 1
1044 2 58 PHE H 2 60 PHE H 4.596 . 7.237 4.024 3.733 4.275 . 0 0 "[ . 1 . 2]" 1
1045 1 58 PHE H 1 59 GLY H 2.362 . 3.059 2.314 2.123 2.453 . 0 0 "[ . 1 . 2]" 1
1046 2 58 PHE H 2 59 GLY H 2.362 . 3.059 2.316 2.126 2.452 . 0 0 "[ . 1 . 2]" 1
1047 1 65 VAL H 1 66 SER H 2.722 . 3.648 2.691 2.602 2.815 . 0 0 "[ . 1 . 2]" 1
1048 2 65 VAL H 2 66 SER H 2.722 . 3.648 2.691 2.601 2.811 . 0 0 "[ . 1 . 2]" 1
1049 1 30 PHE H 1 33 ILE H 3.978 . 5.956 4.766 4.637 4.996 . 0 0 "[ . 1 . 2]" 1
1050 2 30 PHE H 2 33 ILE H 3.978 . 5.956 4.766 4.636 4.996 . 0 0 "[ . 1 . 2]" 1
1051 1 39 ILE H 1 40 SER H 4.008 . 6.016 4.515 4.408 4.595 . 0 0 "[ . 1 . 2]" 1
1052 2 39 ILE H 2 40 SER H 4.008 . 6.016 4.514 4.408 4.596 . 0 0 "[ . 1 . 2]" 1
1053 1 74 PHE H 1 75 LYS H 2.632 . 3.498 2.636 1.949 3.593 0.095 18 0 "[ . 1 . 2]" 1
1054 2 74 PHE H 2 75 LYS H 2.632 . 3.498 2.637 1.946 3.597 0.099 18 0 "[ . 1 . 2]" 1
1055 1 60 PHE H 1 60 PHE QD 3.961 . 5.922 2.738 2.146 3.211 . 0 0 "[ . 1 . 2]" 1
1056 2 60 PHE H 2 60 PHE QD 3.961 . 5.922 2.738 2.141 3.210 . 0 0 "[ . 1 . 2]" 1
1057 1 58 PHE H 1 60 PHE QD 5.009 . 8.145 4.050 3.349 4.642 . 0 0 "[ . 1 . 2]" 1
1058 2 58 PHE H 2 60 PHE QD 5.009 . 8.145 4.051 3.352 4.643 . 0 0 "[ . 1 . 2]" 1
1059 1 81 ASP H 1 82 ILE H 2.646 . 3.521 2.601 2.504 2.694 . 0 0 "[ . 1 . 2]" 1
1060 2 81 ASP H 2 82 ILE H 2.646 . 3.521 2.601 2.500 2.696 . 0 0 "[ . 1 . 2]" 1
1061 1 71 LYS H 1 72 SER H 2.362 . 3.059 2.350 1.927 2.732 . 0 0 "[ . 1 . 2]" 1
1062 2 71 LYS H 2 72 SER H 2.362 . 3.059 2.351 1.931 2.742 . 0 0 "[ . 1 . 2]" 1
1063 1 48 ASN H 1 48 ASN HD21 3.183 . 4.450 3.445 2.317 3.708 . 0 0 "[ . 1 . 2]" 1
1064 2 48 ASN H 2 48 ASN HD21 3.183 . 4.450 3.445 2.307 3.709 . 0 0 "[ . 1 . 2]" 1
1065 1 29 TYR QD 1 30 PHE H 4.610 . 7.267 3.499 3.138 3.723 . 0 0 "[ . 1 . 2]" 1
1066 2 29 TYR QD 2 30 PHE H 4.610 . 7.267 3.499 3.138 3.726 . 0 0 "[ . 1 . 2]" 1
1067 1 60 PHE HA 1 61 GLU H 2.295 . 2.953 2.441 2.286 2.647 . 0 0 "[ . 1 . 2]" 1
1068 2 60 PHE HA 2 61 GLU H 2.295 . 2.953 2.441 2.286 2.648 . 0 0 "[ . 1 . 2]" 1
1069 1 60 PHE H 1 60 PHE HA 2.791 . 3.765 2.921 2.897 2.935 . 0 0 "[ . 1 . 2]" 1
1070 2 60 PHE H 2 60 PHE HA 2.791 . 3.765 2.920 2.898 2.937 . 0 0 "[ . 1 . 2]" 1
1071 1 78 HIS HA 1 79 LEU H 3.173 . 4.432 2.361 2.096 2.676 . 0 0 "[ . 1 . 2]" 1
1072 2 78 HIS HA 2 79 LEU H 3.173 . 4.432 2.362 2.101 2.673 . 0 0 "[ . 1 . 2]" 1
1073 1 78 HIS H 1 78 HIS HA 2.964 . 4.062 2.881 2.248 2.947 . 0 0 "[ . 1 . 2]" 1
1074 2 78 HIS H 2 78 HIS HA 2.964 . 4.062 2.881 2.249 2.949 . 0 0 "[ . 1 . 2]" 1
1075 1 72 SER HA 1 73 GLU H 3.001 . 4.127 2.549 2.194 3.556 . 0 0 "[ . 1 . 2]" 1
1076 2 72 SER HA 2 73 GLU H 3.001 . 4.127 2.549 2.197 3.555 . 0 0 "[ . 1 . 2]" 1
1077 1 61 GLU HA 1 62 ARG H 2.377 . 3.083 2.312 2.193 2.536 . 0 0 "[ . 1 . 2]" 1
1078 2 61 GLU HA 2 62 ARG H 2.377 . 3.083 2.312 2.192 2.535 . 0 0 "[ . 1 . 2]" 1
1079 1 61 GLU H 1 61 GLU HA 2.631 . 3.496 2.928 2.888 2.949 . 0 0 "[ . 1 . 2]" 1
1080 2 61 GLU H 2 61 GLU HA 2.631 . 3.496 2.928 2.890 2.950 . 0 0 "[ . 1 . 2]" 1
1081 1 77 GLN H 1 77 GLN HA 2.631 . 3.496 2.754 2.260 2.947 . 0 0 "[ . 1 . 2]" 1
1082 2 77 GLN H 2 77 GLN HA 2.631 . 3.496 2.754 2.258 2.946 . 0 0 "[ . 1 . 2]" 1
1083 1 71 LYS H 1 71 LYS HA 2.927 . 3.998 2.901 2.835 2.944 . 0 0 "[ . 1 . 2]" 1
1084 2 71 LYS H 2 71 LYS HA 2.927 . 3.998 2.901 2.831 2.948 . 0 0 "[ . 1 . 2]" 1
1085 1 77 GLN HA 1 78 HIS H 2.300 . 2.961 2.388 2.142 3.424 0.463 12 0 "[ . 1 . 2]" 1
1086 2 77 GLN HA 2 78 HIS H 2.300 . 2.961 2.388 2.143 3.424 0.463 12 0 "[ . 1 . 2]" 1
1087 1 64 ALA HA 1 65 VAL H 3.220 . 4.516 3.301 3.175 3.443 . 0 0 "[ . 1 . 2]" 1
1088 2 64 ALA HA 2 65 VAL H 3.220 . 4.516 3.302 3.178 3.443 . 0 0 "[ . 1 . 2]" 1
1089 1 64 ALA HA 1 67 GLY H 3.362 . 4.775 3.238 3.004 3.416 . 0 0 "[ . 1 . 2]" 1
1090 2 64 ALA HA 2 67 GLY H 3.362 . 4.775 3.237 3.004 3.419 . 0 0 "[ . 1 . 2]" 1
1091 1 64 ALA H 1 64 ALA HA 2.684 . 3.585 2.919 2.833 2.944 . 0 0 "[ . 1 . 2]" 1
1092 2 64 ALA H 2 64 ALA HA 2.684 . 3.585 2.919 2.835 2.944 . 0 0 "[ . 1 . 2]" 1
1093 1 28 ASN HA 1 29 TYR H 3.673 . 5.360 3.535 3.491 3.563 . 0 0 "[ . 1 . 2]" 1
1094 2 28 ASN HA 2 29 TYR H 3.673 . 5.360 3.535 3.492 3.563 . 0 0 "[ . 1 . 2]" 1
1095 1 52 ASP HA 1 56 GLU H 4.309 . 6.630 3.889 3.701 4.079 . 0 0 "[ . 1 . 2]" 1
1096 2 52 ASP HA 2 56 GLU H 4.309 . 6.630 3.891 3.708 4.082 . 0 0 "[ . 1 . 2]" 1
1097 1 28 ASN HA 1 31 SER H 3.843 . 5.689 3.527 3.326 3.728 . 0 0 "[ . 1 . 2]" 1
1098 2 28 ASN HA 2 31 SER H 3.843 . 5.689 3.527 3.324 3.730 . 0 0 "[ . 1 . 2]" 1
1099 1 28 ASN H 1 28 ASN HA 2.898 . 3.948 2.819 2.797 2.848 . 0 0 "[ . 1 . 2]" 1
1100 2 28 ASN H 2 28 ASN HA 2.898 . 3.948 2.819 2.797 2.848 . 0 0 "[ . 1 . 2]" 1
1101 1 52 ASP HA 1 53 CYS H 3.602 . 5.224 3.508 3.474 3.566 . 0 0 "[ . 1 . 2]" 1
1102 2 52 ASP HA 2 53 CYS H 3.602 . 5.224 3.508 3.475 3.568 . 0 0 "[ . 1 . 2]" 1
1103 1 52 ASP H 1 52 ASP HA 2.891 . 3.936 2.817 2.800 2.839 . 0 0 "[ . 1 . 2]" 1
1104 2 52 ASP H 2 52 ASP HA 2.891 . 3.936 2.818 2.799 2.840 . 0 0 "[ . 1 . 2]" 1
1105 1 28 ASN HA 1 32 SER H 4.316 . 6.645 4.116 3.899 4.457 . 0 0 "[ . 1 . 2]" 1
1106 2 28 ASN HA 2 32 SER H 4.316 . 6.645 4.116 3.898 4.450 . 0 0 "[ . 1 . 2]" 1
1107 1 28 ASN HA 1 28 ASN HD22 3.517 . 5.063 4.207 3.585 4.717 . 0 0 "[ . 1 . 2]" 1
1108 2 28 ASN HA 2 28 ASN HD22 3.517 . 5.063 4.207 3.587 4.717 . 0 0 "[ . 1 . 2]" 1
1109 1 52 ASP HA 1 55 SER H 3.823 . 5.650 3.636 3.228 3.940 . 0 0 "[ . 1 . 2]" 1
1110 2 52 ASP HA 2 55 SER H 3.823 . 5.650 3.637 3.230 3.939 . 0 0 "[ . 1 . 2]" 1
1111 1 28 ASN HA 1 28 ASN HD21 4.212 . 6.429 3.441 1.972 4.483 0.023 19 0 "[ . 1 . 2]" 1
1112 2 28 ASN HA 2 28 ASN HD21 4.212 . 6.429 3.440 1.976 4.483 0.019 19 0 "[ . 1 . 2]" 1
1113 1 48 ASN HA 1 51 MET H 3.310 . 4.679 3.423 3.211 3.575 . 0 0 "[ . 1 . 2]" 1
1114 2 48 ASN HA 2 51 MET H 3.310 . 4.679 3.422 3.215 3.576 . 0 0 "[ . 1 . 2]" 1
1115 1 58 PHE HA 1 59 GLY H 3.315 . 4.689 3.422 3.291 3.491 . 0 0 "[ . 1 . 2]" 1
1116 2 58 PHE HA 2 59 GLY H 3.315 . 4.689 3.423 3.290 3.492 . 0 0 "[ . 1 . 2]" 1
1117 1 58 PHE H 1 58 PHE HA 2.930 . 4.003 2.903 2.867 2.935 . 0 0 "[ . 1 . 2]" 1
1118 2 58 PHE H 2 58 PHE HA 2.930 . 4.003 2.903 2.870 2.935 . 0 0 "[ . 1 . 2]" 1
1119 1 15 MET H 1 15 MET HA 2.617 . 3.473 2.600 2.245 2.943 . 0 0 "[ . 1 . 2]" 1
1120 2 15 MET H 2 15 MET HA 2.617 . 3.473 2.601 2.246 2.944 . 0 0 "[ . 1 . 2]" 1
1121 1 48 ASN HA 1 49 VAL H 3.557 . 5.139 3.584 3.573 3.596 . 0 0 "[ . 1 . 2]" 1
1122 2 48 ASN HA 2 49 VAL H 3.557 . 5.139 3.584 3.574 3.599 . 0 0 "[ . 1 . 2]" 1
1123 1 30 PHE HA 1 31 SER H 3.677 . 5.367 3.535 3.517 3.553 . 0 0 "[ . 1 . 2]" 1
1124 2 30 PHE HA 2 31 SER H 3.677 . 5.367 3.534 3.516 3.553 . 0 0 "[ . 1 . 2]" 1
1125 1 81 ASP HA 1 82 ILE H 3.497 . 5.026 3.503 3.487 3.520 . 0 0 "[ . 1 . 2]" 1
1126 2 81 ASP HA 2 82 ILE H 3.497 . 5.026 3.504 3.490 3.521 . 0 0 "[ . 1 . 2]" 1
1127 1 39 ILE H 1 39 ILE HA 2.334 . 3.015 2.929 2.895 2.948 . 0 0 "[ . 1 . 2]" 1
1128 2 39 ILE H 2 39 ILE HA 2.334 . 3.015 2.929 2.894 2.949 . 0 0 "[ . 1 . 2]" 1
1129 1 48 ASN HA 1 48 ASN HD21 2.486 . 3.258 1.795 1.730 2.293 . 0 0 "[ . 1 . 2]" 1
1130 2 48 ASN HA 2 48 ASN HD21 2.486 . 3.258 1.795 1.730 2.296 . 0 0 "[ . 1 . 2]" 1
1131 1 17 ALA HA 1 18 SER H 2.223 . 2.841 2.342 2.144 2.596 . 0 0 "[ . 1 . 2]" 1
1132 2 17 ALA HA 2 18 SER H 2.223 . 2.841 2.340 2.141 2.593 . 0 0 "[ . 1 . 2]" 1
1133 1 39 ILE HA 1 40 SER H 2.163 . 2.748 2.349 2.268 2.488 . 0 0 "[ . 1 . 2]" 1
1134 2 39 ILE HA 2 40 SER H 2.163 . 2.748 2.348 2.262 2.489 . 0 0 "[ . 1 . 2]" 1
1135 1 81 ASP HA 1 84 ASN H 4.005 . 6.010 3.453 3.213 3.833 . 0 0 "[ . 1 . 2]" 1
1136 2 81 ASP HA 2 84 ASN H 4.005 . 6.010 3.453 3.213 3.830 . 0 0 "[ . 1 . 2]" 1
1137 1 30 PHE HA 1 33 ILE H 3.361 . 4.773 3.326 3.234 3.500 . 0 0 "[ . 1 . 2]" 1
1138 2 30 PHE HA 2 33 ILE H 3.361 . 4.773 3.327 3.235 3.503 . 0 0 "[ . 1 . 2]" 1
1139 1 81 ASP H 1 81 ASP HA 2.952 . 4.041 2.819 2.798 2.845 . 0 0 "[ . 1 . 2]" 1
1140 2 81 ASP H 2 81 ASP HA 2.952 . 4.041 2.819 2.797 2.846 . 0 0 "[ . 1 . 2]" 1
1141 1 45 ASP H 1 45 ASP HA 2.660 . 3.544 2.822 2.780 2.847 . 0 0 "[ . 1 . 2]" 1
1142 2 45 ASP H 2 45 ASP HA 2.660 . 3.544 2.822 2.779 2.847 . 0 0 "[ . 1 . 2]" 1
1143 1 30 PHE HA 1 34 VAL H 4.159 . 6.322 4.408 4.162 4.643 . 0 0 "[ . 1 . 2]" 1
1144 2 30 PHE HA 2 34 VAL H 4.159 . 6.322 4.409 4.162 4.646 . 0 0 "[ . 1 . 2]" 1
1145 1 90 PRO HA 1 91 GLU H 1.958 . 2.437 2.297 2.142 2.494 0.057 3 0 "[ . 1 . 2]" 1
1146 2 90 PRO HA 2 91 GLU H 1.958 . 2.437 2.298 2.143 2.498 0.061 3 0 "[ . 1 . 2]" 1
1147 1 42 ASP H 1 42 ASP HA 2.656 . 3.538 2.806 2.778 2.851 . 0 0 "[ . 1 . 2]" 1
1148 2 42 ASP H 2 42 ASP HA 2.656 . 3.538 2.806 2.779 2.850 . 0 0 "[ . 1 . 2]" 1
1149 1 42 ASP HA 1 43 GLY H 3.626 . 5.270 3.532 3.490 3.555 . 0 0 "[ . 1 . 2]" 1
1150 2 42 ASP HA 2 43 GLY H 3.626 . 5.270 3.533 3.488 3.557 . 0 0 "[ . 1 . 2]" 1
1151 1 87 SER HA 1 88 ARG H 2.075 . 2.613 2.239 2.145 2.672 0.059 17 0 "[ . 1 . 2]" 1
1152 2 87 SER HA 2 88 ARG H 2.075 . 2.613 2.239 2.142 2.675 0.062 17 0 "[ . 1 . 2]" 1
1153 1 87 SER H 1 87 SER HA 2.744 . 3.685 2.842 2.273 2.912 . 0 0 "[ . 1 . 2]" 1
1154 2 87 SER H 2 87 SER HA 2.744 . 3.685 2.842 2.273 2.911 . 0 0 "[ . 1 . 2]" 1
1155 1 88 ARG HA 1 89 VAL H 1.930 . 2.396 2.225 2.101 2.425 0.029 14 0 "[ . 1 . 2]" 1
1156 2 88 ARG HA 2 89 VAL H 1.930 . 2.396 2.226 2.106 2.420 0.024 14 0 "[ . 1 . 2]" 1
1157 1 85 SER H 1 85 SER HA 2.790 . 3.763 2.876 2.841 2.905 . 0 0 "[ . 1 . 2]" 1
1158 2 85 SER H 2 85 SER HA 2.790 . 3.763 2.877 2.840 2.909 . 0 0 "[ . 1 . 2]" 1
1159 1 29 TYR HA 1 30 PHE H 4.063 . 6.126 3.562 3.551 3.571 . 0 0 "[ . 1 . 2]" 1
1160 2 29 TYR HA 2 30 PHE H 4.063 . 6.126 3.562 3.551 3.570 . 0 0 "[ . 1 . 2]" 1
1161 1 38 GLU H 1 38 GLU HA 2.688 . 3.591 2.925 2.899 2.946 . 0 0 "[ . 1 . 2]" 1
1162 2 38 GLU H 2 38 GLU HA 2.688 . 3.591 2.925 2.900 2.946 . 0 0 "[ . 1 . 2]" 1
1163 1 38 GLU HA 1 39 ILE H 2.835 . 3.839 3.338 3.158 3.484 . 0 0 "[ . 1 . 2]" 1
1164 2 38 GLU HA 2 39 ILE H 2.835 . 3.839 3.339 3.161 3.481 . 0 0 "[ . 1 . 2]" 1
1165 1 40 SER HB3 1 42 ASP H 3.323 . 4.704 3.676 3.032 4.789 0.085 12 0 "[ . 1 . 2]" 1
1166 2 40 SER HB3 2 42 ASP H 3.323 . 4.704 3.674 3.038 4.788 0.084 12 0 "[ . 1 . 2]" 1
1167 1 86 ALA HA 1 87 SER H 2.384 . 3.095 2.531 2.179 3.007 . 0 0 "[ . 1 . 2]" 1
1168 2 86 ALA HA 2 87 SER H 2.384 . 3.095 2.531 2.178 3.003 . 0 0 "[ . 1 . 2]" 1
1169 1 86 ALA H 1 86 ALA HA 2.615 . 3.469 2.906 2.808 2.947 . 0 0 "[ . 1 . 2]" 1
1170 2 86 ALA H 2 86 ALA HA 2.615 . 3.469 2.908 2.807 2.948 . 0 0 "[ . 1 . 2]" 1
1171 1 32 SER HA 1 34 VAL H 4.197 . 6.399 4.533 4.339 4.628 . 0 0 "[ . 1 . 2]" 1
1172 2 32 SER HA 2 34 VAL H 4.197 . 6.399 4.533 4.341 4.628 . 0 0 "[ . 1 . 2]" 1
1173 1 32 SER HA 1 33 ILE H 3.526 . 5.080 3.513 3.456 3.541 . 0 0 "[ . 1 . 2]" 1
1174 2 32 SER HA 2 33 ILE H 3.526 . 5.080 3.513 3.458 3.542 . 0 0 "[ . 1 . 2]" 1
1175 1 32 SER HA 1 35 GLU H 3.383 . 4.814 3.349 3.099 3.613 . 0 0 "[ . 1 . 2]" 1
1176 2 32 SER HA 2 35 GLU H 3.383 . 4.814 3.350 3.098 3.612 . 0 0 "[ . 1 . 2]" 1
1177 1 40 SER HB3 1 43 GLY H 3.589 . 5.199 3.676 2.770 4.312 . 0 0 "[ . 1 . 2]" 1
1178 2 40 SER HB3 2 43 GLY H 3.589 . 5.199 3.674 2.767 4.318 . 0 0 "[ . 1 . 2]" 1
1179 1 91 GLU H 1 91 GLU HA 2.681 . 3.580 2.822 2.264 2.943 . 0 0 "[ . 1 . 2]" 1
1180 2 91 GLU H 2 91 GLU HA 2.681 . 3.580 2.822 2.265 2.940 . 0 0 "[ . 1 . 2]" 1
1181 1 91 GLU HA 1 92 SER H 2.259 . 2.897 2.351 2.114 2.959 0.062 15 0 "[ . 1 . 2]" 1
1182 2 91 GLU HA 2 92 SER H 2.259 . 2.897 2.352 2.111 2.960 0.063 15 0 "[ . 1 . 2]" 1
1183 1 63 GLU H 1 63 GLU HA 2.789 . 3.761 2.877 2.810 2.923 . 0 0 "[ . 1 . 2]" 1
1184 2 63 GLU H 2 63 GLU HA 2.789 . 3.761 2.877 2.812 2.923 . 0 0 "[ . 1 . 2]" 1
1185 1 63 GLU HA 1 64 ALA H 3.187 . 4.456 3.320 3.177 3.408 . 0 0 "[ . 1 . 2]" 1
1186 2 63 GLU HA 2 64 ALA H 3.187 . 4.456 3.320 3.177 3.406 . 0 0 "[ . 1 . 2]" 1
1187 1 63 GLU HA 1 65 VAL H 3.813 . 5.631 3.687 3.555 3.815 . 0 0 "[ . 1 . 2]" 1
1188 2 63 GLU HA 2 65 VAL H 3.813 . 5.631 3.687 3.553 3.818 . 0 0 "[ . 1 . 2]" 1
1189 1 46 SER HA 1 47 LEU H 3.791 . 5.587 3.532 3.502 3.558 . 0 0 "[ . 1 . 2]" 1
1190 2 46 SER HA 2 47 LEU H 3.791 . 5.587 3.532 3.501 3.559 . 0 0 "[ . 1 . 2]" 1
1191 1 46 SER H 1 46 SER HA 2.701 . 3.613 2.816 2.788 2.844 . 0 0 "[ . 1 . 2]" 1
1192 2 46 SER H 2 46 SER HA 2.701 . 3.613 2.816 2.789 2.842 . 0 0 "[ . 1 . 2]" 1
1193 1 46 SER HA 1 49 VAL H 3.149 . 4.388 3.635 3.347 3.808 . 0 0 "[ . 1 . 2]" 1
1194 2 46 SER HA 2 49 VAL H 3.149 . 4.388 3.635 3.349 3.804 . 0 0 "[ . 1 . 2]" 1
1195 1 36 LYS HA 1 37 LYS H 3.263 . 4.594 3.169 2.919 3.350 . 0 0 "[ . 1 . 2]" 1
1196 2 36 LYS HA 2 37 LYS H 3.263 . 4.594 3.169 2.920 3.352 . 0 0 "[ . 1 . 2]" 1
1197 1 36 LYS H 1 36 LYS HA 2.730 . 3.662 2.912 2.867 2.938 . 0 0 "[ . 1 . 2]" 1
1198 2 36 LYS H 2 36 LYS HA 2.730 . 3.662 2.913 2.869 2.937 . 0 0 "[ . 1 . 2]" 1
1199 1 31 SER H 1 31 SER HA 2.805 . 3.789 2.817 2.799 2.835 . 0 0 "[ . 1 . 2]" 1
1200 2 31 SER H 2 31 SER HA 2.805 . 3.789 2.817 2.799 2.836 . 0 0 "[ . 1 . 2]" 1
1201 1 31 SER HA 1 32 SER H 3.453 . 4.943 3.514 3.448 3.552 . 0 0 "[ . 1 . 2]" 1
1202 2 31 SER HA 2 32 SER H 3.453 . 4.943 3.514 3.448 3.553 . 0 0 "[ . 1 . 2]" 1
1203 1 73 GLU HA 1 75 LYS H 3.687 . 5.386 3.701 2.540 5.001 . 0 0 "[ . 1 . 2]" 1
1204 2 73 GLU HA 2 75 LYS H 3.687 . 5.386 3.700 2.540 5.001 . 0 0 "[ . 1 . 2]" 1
1205 1 53 CYS HA 1 56 GLU H 3.261 . 4.590 3.573 3.268 3.887 . 0 0 "[ . 1 . 2]" 1
1206 2 53 CYS HA 2 56 GLU H 3.261 . 4.590 3.573 3.264 3.887 . 0 0 "[ . 1 . 2]" 1
1207 1 53 CYS H 1 53 CYS HA 2.944 . 4.028 2.818 2.772 2.847 . 0 0 "[ . 1 . 2]" 1
1208 2 53 CYS H 2 53 CYS HA 2.944 . 4.028 2.818 2.769 2.846 . 0 0 "[ . 1 . 2]" 1
1209 1 62 ARG HA 1 63 GLU H 3.410 . 4.863 3.477 3.402 3.579 . 0 0 "[ . 1 . 2]" 1
1210 2 62 ARG HA 2 63 GLU H 3.410 . 4.863 3.478 3.398 3.579 . 0 0 "[ . 1 . 2]" 1
1211 1 19 LYS HA 1 22 ILE H 3.833 . 5.669 3.658 3.410 3.836 . 0 0 "[ . 1 . 2]" 1
1212 2 19 LYS HA 2 22 ILE H 3.833 . 5.669 3.658 3.409 3.839 . 0 0 "[ . 1 . 2]" 1
1213 1 72 SER H 1 72 SER HB2 2.834 . 3.838 2.956 2.433 3.725 . 0 0 "[ . 1 . 2]" 1
1214 2 72 SER H 2 72 SER HB2 2.834 . 3.838 2.956 2.431 3.726 . 0 0 "[ . 1 . 2]" 1
1215 1 62 ARG HA 1 65 VAL H 3.280 . 4.625 3.811 3.595 3.959 . 0 0 "[ . 1 . 2]" 1
1216 2 62 ARG HA 2 65 VAL H 3.280 . 4.625 3.810 3.591 3.958 . 0 0 "[ . 1 . 2]" 1
1217 1 62 ARG HA 1 64 ALA H 2.972 . 4.076 3.669 3.462 3.889 . 0 0 "[ . 1 . 2]" 1
1218 2 62 ARG HA 2 64 ALA H 2.972 . 4.076 3.668 3.466 3.886 . 0 0 "[ . 1 . 2]" 1
1219 1 59 GLY H 1 59 GLY HA2 2.578 . 3.409 2.350 2.308 2.415 . 0 0 "[ . 1 . 2]" 1
1220 2 59 GLY H 2 59 GLY HA2 2.578 . 3.409 2.350 2.309 2.410 . 0 0 "[ . 1 . 2]" 1
1221 1 31 SER H 1 31 SER QB 2.753 . 3.700 2.382 2.230 2.664 . 0 0 "[ . 1 . 2]" 1
1222 2 31 SER H 2 31 SER QB 2.753 . 3.700 2.382 2.232 2.664 . 0 0 "[ . 1 . 2]" 1
1223 1 59 GLY HA2 1 60 PHE H 3.148 . 4.387 2.832 2.675 2.950 . 0 0 "[ . 1 . 2]" 1
1224 2 59 GLY HA2 2 60 PHE H 3.148 . 4.387 2.832 2.676 2.946 . 0 0 "[ . 1 . 2]" 1
1225 1 40 SER HB2 1 42 ASP H 3.866 . 5.734 4.037 2.974 5.183 . 0 0 "[ . 1 . 2]" 1
1226 2 40 SER HB2 2 42 ASP H 3.866 . 5.734 4.038 2.976 5.178 . 0 0 "[ . 1 . 2]" 1
1227 1 40 SER H 1 40 SER HB2 2.573 . 3.401 2.723 2.499 3.568 0.167 11 0 "[ . 1 . 2]" 1
1228 2 40 SER H 2 40 SER HB2 2.573 . 3.401 2.721 2.499 3.569 0.168 11 0 "[ . 1 . 2]" 1
1229 1 58 PHE H 1 59 GLY HA2 5.309 . 8.832 4.615 4.429 4.767 . 0 0 "[ . 1 . 2]" 1
1230 2 58 PHE H 2 59 GLY HA2 5.309 . 8.832 4.616 4.433 4.765 . 0 0 "[ . 1 . 2]" 1
1231 1 76 GLY HA2 1 77 GLN H 3.746 . 5.501 3.165 2.143 3.555 . 0 0 "[ . 1 . 2]" 1
1232 2 76 GLY HA2 2 77 GLN H 3.746 . 5.501 3.165 2.142 3.553 . 0 0 "[ . 1 . 2]" 1
1233 1 18 SER H 1 18 SER HB3 2.956 . 4.048 3.184 2.479 3.617 . 0 0 "[ . 1 . 2]" 1
1234 2 18 SER H 2 18 SER HB3 2.956 . 4.048 3.184 2.480 3.617 . 0 0 "[ . 1 . 2]" 1
1235 1 76 GLY H 1 76 GLY HA2 2.964 . 4.062 2.513 2.292 2.958 . 0 0 "[ . 1 . 2]" 1
1236 2 76 GLY H 2 76 GLY HA2 2.964 . 4.062 2.512 2.292 2.958 . 0 0 "[ . 1 . 2]" 1
1237 1 35 GLU H 1 35 GLU HA 2.644 . 3.518 2.809 2.757 2.847 . 0 0 "[ . 1 . 2]" 1
1238 2 35 GLU H 2 35 GLU HA 2.644 . 3.518 2.809 2.757 2.847 . 0 0 "[ . 1 . 2]" 1
1239 1 70 GLY H 1 70 GLY HA2 2.622 . 3.482 2.878 2.808 2.955 . 0 0 "[ . 1 . 2]" 1
1240 2 70 GLY H 2 70 GLY HA2 2.622 . 3.482 2.878 2.809 2.954 . 0 0 "[ . 1 . 2]" 1
1241 1 35 GLU HA 1 36 LYS H 3.424 . 4.889 3.556 3.529 3.576 . 0 0 "[ . 1 . 2]" 1
1242 2 35 GLU HA 2 36 LYS H 3.424 . 4.889 3.556 3.529 3.578 . 0 0 "[ . 1 . 2]" 1
1243 1 70 GLY HA2 1 71 LYS H 3.240 . 4.552 3.432 2.957 3.535 . 0 0 "[ . 1 . 2]" 1
1244 2 70 GLY HA2 2 71 LYS H 3.240 . 4.552 3.432 2.956 3.534 . 0 0 "[ . 1 . 2]" 1
1245 1 51 MET H 1 51 MET HA 2.983 . 4.095 2.801 2.748 2.841 . 0 0 "[ . 1 . 2]" 1
1246 2 51 MET H 2 51 MET HA 2.983 . 4.095 2.802 2.747 2.842 . 0 0 "[ . 1 . 2]" 1
1247 1 41 GLU H 1 41 GLU HA 2.656 . 3.538 2.771 2.743 2.812 . 0 0 "[ . 1 . 2]" 1
1248 2 41 GLU H 2 41 GLU HA 2.656 . 3.538 2.772 2.740 2.816 . 0 0 "[ . 1 . 2]" 1
1249 1 41 GLU HA 1 42 ASP H 3.648 . 5.312 3.548 3.483 3.582 . 0 0 "[ . 1 . 2]" 1
1250 2 41 GLU HA 2 42 ASP H 3.648 . 5.312 3.548 3.483 3.582 . 0 0 "[ . 1 . 2]" 1
1251 1 51 MET HA 1 52 ASP H 3.749 . 5.506 3.543 3.520 3.557 . 0 0 "[ . 1 . 2]" 1
1252 2 51 MET HA 2 52 ASP H 3.749 . 5.506 3.543 3.522 3.556 . 0 0 "[ . 1 . 2]" 1
1253 1 51 MET HA 1 54 ILE H 3.469 . 4.973 3.430 3.009 3.976 . 0 0 "[ . 1 . 2]" 1
1254 2 51 MET HA 2 54 ILE H 3.469 . 4.973 3.430 3.010 3.978 . 0 0 "[ . 1 . 2]" 1
1255 1 41 GLU HA 1 44 ALA H 3.180 . 4.444 3.462 3.078 3.621 . 0 0 "[ . 1 . 2]" 1
1256 2 41 GLU HA 2 44 ALA H 3.180 . 4.444 3.463 3.075 3.624 . 0 0 "[ . 1 . 2]" 1
1257 1 41 GLU HA 1 45 ASP H 3.965 . 5.930 4.145 3.844 4.661 . 0 0 "[ . 1 . 2]" 1
1258 2 41 GLU HA 2 45 ASP H 3.965 . 5.930 4.145 3.845 4.660 . 0 0 "[ . 1 . 2]" 1
1259 1 37 LYS HA 1 38 GLU H 2.182 . 2.777 2.546 2.318 2.702 . 0 0 "[ . 1 . 2]" 1
1260 2 37 LYS HA 2 38 GLU H 2.182 . 2.777 2.546 2.321 2.704 . 0 0 "[ . 1 . 2]" 1
1261 1 37 LYS H 1 37 LYS HA 2.107 . 2.662 2.259 2.247 2.273 . 0 0 "[ . 1 . 2]" 1
1262 2 37 LYS H 2 37 LYS HA 2.107 . 2.662 2.258 2.246 2.272 . 0 0 "[ . 1 . 2]" 1
1263 1 37 LYS HA 1 39 ILE H 3.287 . 4.637 3.148 2.817 3.589 . 0 0 "[ . 1 . 2]" 1
1264 2 37 LYS HA 2 39 ILE H 3.287 . 4.637 3.148 2.822 3.584 . 0 0 "[ . 1 . 2]" 1
1265 1 72 SER HB3 1 73 GLU H 2.999 . 4.123 3.080 1.813 3.918 0.062 17 0 "[ . 1 . 2]" 1
1266 2 72 SER HB3 2 73 GLU H 2.999 . 4.123 3.080 1.814 3.919 0.061 17 0 "[ . 1 . 2]" 1
1267 1 72 SER H 1 72 SER HB3 3.315 . 4.688 3.165 2.459 3.769 . 0 0 "[ . 1 . 2]" 1
1268 2 72 SER H 2 72 SER HB3 3.315 . 4.688 3.164 2.459 3.772 . 0 0 "[ . 1 . 2]" 1
1269 1 67 GLY H 1 67 GLY QA 2.165 . 2.751 2.206 2.196 2.235 . 0 0 "[ . 1 . 2]" 1
1270 2 67 GLY H 2 67 GLY QA 2.165 . 2.751 2.206 2.197 2.235 . 0 0 "[ . 1 . 2]" 1
1271 1 59 GLY HA3 1 60 PHE H 2.798 . 3.776 3.546 3.504 3.566 . 0 0 "[ . 1 . 2]" 1
1272 2 59 GLY HA3 2 60 PHE H 2.798 . 3.776 3.546 3.502 3.569 . 0 0 "[ . 1 . 2]" 1
1273 1 67 GLY QA 1 68 ILE H 2.978 . 4.087 2.689 2.627 2.728 . 0 0 "[ . 1 . 2]" 1
1274 2 67 GLY QA 2 68 ILE H 2.978 . 4.087 2.689 2.630 2.731 . 0 0 "[ . 1 . 2]" 1
1275 1 46 SER H 1 46 SER HB3 2.395 . 3.112 3.139 2.641 3.587 0.475 7 0 "[ . 1 . 2]" 1
1276 2 46 SER H 2 46 SER HB3 2.395 . 3.112 3.138 2.633 3.589 0.477 7 0 "[ . 1 . 2]" 1
1277 1 55 SER H 1 55 SER HA 2.934 . 4.010 2.800 2.782 2.813 . 0 0 "[ . 1 . 2]" 1
1278 2 55 SER H 2 55 SER HA 2.934 . 4.010 2.801 2.782 2.815 . 0 0 "[ . 1 . 2]" 1
1279 1 75 LYS HA 1 76 GLY H 2.885 . 3.925 2.560 2.123 3.577 . 0 0 "[ . 1 . 2]" 1
1280 2 75 LYS HA 2 76 GLY H 2.885 . 3.925 2.560 2.121 3.574 . 0 0 "[ . 1 . 2]" 1
1281 1 75 LYS HA 1 77 GLN H 3.339 . 6.000 4.268 3.214 6.037 0.037 16 0 "[ . 1 . 2]" 1
1282 2 75 LYS HA 2 77 GLN H 3.339 . 6.000 4.268 3.216 6.038 0.038 16 0 "[ . 1 . 2]" 1
1283 1 75 LYS H 1 75 LYS HA 2.844 . 3.855 2.716 2.251 2.942 . 0 0 "[ . 1 . 2]" 1
1284 2 75 LYS H 2 75 LYS HA 2.844 . 3.855 2.715 2.249 2.942 . 0 0 "[ . 1 . 2]" 1
1285 1 70 GLY H 1 70 GLY HA3 2.975 . 4.081 2.342 2.292 2.511 . 0 0 "[ . 1 . 2]" 1
1286 2 70 GLY H 2 70 GLY HA3 2.975 . 4.081 2.342 2.292 2.510 . 0 0 "[ . 1 . 2]" 1
1287 1 70 GLY HA3 1 71 LYS H 3.822 . 5.648 2.989 2.770 3.441 . 0 0 "[ . 1 . 2]" 1
1288 2 70 GLY HA3 2 71 LYS H 3.822 . 5.648 2.988 2.770 3.442 . 0 0 "[ . 1 . 2]" 1
1289 1 23 ALA H 1 23 ALA HA 2.501 . 3.283 2.794 2.778 2.803 . 0 0 "[ . 1 . 2]" 1
1290 2 23 ALA H 2 23 ALA HA 2.501 . 3.283 2.794 2.778 2.801 . 0 0 "[ . 1 . 2]" 1
1291 1 83 LEU HA 1 84 ASN H 3.286 . 4.636 3.506 3.460 3.535 . 0 0 "[ . 1 . 2]" 1
1292 2 83 LEU HA 2 84 ASN H 3.286 . 4.636 3.506 3.459 3.535 . 0 0 "[ . 1 . 2]" 1
1293 1 83 LEU H 1 83 LEU HA 2.922 . 3.989 2.824 2.800 2.848 . 0 0 "[ . 1 . 2]" 1
1294 2 83 LEU H 2 83 LEU HA 2.922 . 3.989 2.824 2.800 2.848 . 0 0 "[ . 1 . 2]" 1
1295 1 83 LEU HA 1 86 ALA H 3.328 . 4.713 3.354 3.054 4.062 . 0 0 "[ . 1 . 2]" 1
1296 2 83 LEU HA 2 86 ALA H 3.328 . 4.713 3.358 3.052 4.071 . 0 0 "[ . 1 . 2]" 1
1297 1 25 LEU HA 1 28 ASN H 3.278 . 4.621 3.429 3.272 3.628 . 0 0 "[ . 1 . 2]" 1
1298 2 25 LEU HA 2 28 ASN H 3.278 . 4.621 3.429 3.271 3.627 . 0 0 "[ . 1 . 2]" 1
1299 1 47 LEU H 1 47 LEU HA 2.735 . 3.670 2.833 2.805 2.857 . 0 0 "[ . 1 . 2]" 1
1300 2 47 LEU H 2 47 LEU HA 2.735 . 3.670 2.832 2.803 2.856 . 0 0 "[ . 1 . 2]" 1
1301 1 20 GLU HA 1 21 GLU H 3.668 . 5.350 3.508 3.485 3.537 . 0 0 "[ . 1 . 2]" 1
1302 2 20 GLU HA 2 21 GLU H 3.668 . 5.350 3.508 3.485 3.538 . 0 0 "[ . 1 . 2]" 1
1303 1 92 SER H 1 92 SER QB 3.265 . 4.597 2.785 2.478 3.391 . 0 0 "[ . 1 . 2]" 1
1304 2 92 SER H 2 92 SER QB 3.265 . 4.597 2.786 2.480 3.391 . 0 0 "[ . 1 . 2]" 1
1305 1 49 VAL H 1 49 VAL HA 2.740 . 3.679 2.830 2.812 2.855 . 0 0 "[ . 1 . 2]" 1
1306 2 49 VAL H 2 49 VAL HA 2.740 . 3.679 2.830 2.813 2.856 . 0 0 "[ . 1 . 2]" 1
1307 1 47 LEU HA 1 48 ASN H 3.347 . 4.748 3.464 3.412 3.494 . 0 0 "[ . 1 . 2]" 1
1308 2 47 LEU HA 2 48 ASN H 3.347 . 4.748 3.464 3.413 3.494 . 0 0 "[ . 1 . 2]" 1
1309 1 50 ALA HA 1 53 CYS H 3.167 . 4.420 3.413 3.225 3.579 . 0 0 "[ . 1 . 2]" 1
1310 2 50 ALA HA 2 53 CYS H 3.167 . 4.420 3.413 3.226 3.576 . 0 0 "[ . 1 . 2]" 1
1311 1 43 GLY H 2 57 ALA HA 5.138 . 8.437 4.357 3.986 4.936 . 0 0 "[ . 1 . 2]" 1
1312 1 57 ALA HA 2 43 GLY H 5.138 . 8.437 4.361 3.975 4.931 . 0 0 "[ . 1 . 2]" 1
1313 1 16 SER QB 1 17 ALA H 3.863 . 5.729 3.166 2.158 3.856 . 0 0 "[ . 1 . 2]" 1
1314 2 16 SER QB 2 17 ALA H 3.863 . 5.729 3.166 2.154 3.858 . 0 0 "[ . 1 . 2]" 1
1315 1 16 SER H 1 16 SER QB 2.536 . 3.340 2.905 2.451 3.408 0.068 6 0 "[ . 1 . 2]" 1
1316 2 16 SER H 2 16 SER QB 2.536 . 3.340 2.905 2.453 3.411 0.071 6 0 "[ . 1 . 2]" 1
1317 1 33 ILE H 1 33 ILE HA 2.594 . 3.435 2.816 2.780 2.843 . 0 0 "[ . 1 . 2]" 1
1318 2 33 ILE H 2 33 ILE HA 2.594 . 3.435 2.816 2.781 2.843 . 0 0 "[ . 1 . 2]" 1
1319 1 55 SER HB2 1 56 GLU H 3.081 . 4.267 2.675 2.358 3.747 . 0 0 "[ . 1 . 2]" 1
1320 2 55 SER HB2 2 56 GLU H 3.081 . 4.267 2.676 2.361 3.749 . 0 0 "[ . 1 . 2]" 1
1321 1 33 ILE HA 1 34 VAL H 3.309 . 4.678 3.557 3.536 3.574 . 0 0 "[ . 1 . 2]" 1
1322 2 33 ILE HA 2 34 VAL H 3.309 . 4.678 3.558 3.537 3.577 . 0 0 "[ . 1 . 2]" 1
1323 1 55 SER H 1 55 SER HB2 3.298 . 4.658 2.716 2.328 3.572 . 0 0 "[ . 1 . 2]" 1
1324 2 55 SER H 2 55 SER HB2 3.298 . 4.658 2.715 2.328 3.572 . 0 0 "[ . 1 . 2]" 1
1325 1 76 GLY HA3 1 77 GLN H 2.798 . 3.776 3.053 2.275 3.561 . 0 0 "[ . 1 . 2]" 1
1326 2 76 GLY HA3 2 77 GLN H 2.798 . 3.776 3.054 2.277 3.556 . 0 0 "[ . 1 . 2]" 1
1327 1 55 SER HB2 1 60 PHE H 3.971 . 5.942 4.740 3.549 5.615 . 0 0 "[ . 1 . 2]" 1
1328 2 55 SER HB2 2 60 PHE H 3.971 . 5.942 4.740 3.550 5.615 . 0 0 "[ . 1 . 2]" 1
1329 1 44 ALA H 1 44 ALA HA 2.615 . 3.470 2.811 2.794 2.845 . 0 0 "[ . 1 . 2]" 1
1330 2 44 ALA H 2 44 ALA HA 2.615 . 3.470 2.811 2.794 2.847 . 0 0 "[ . 1 . 2]" 1
1331 1 44 ALA HA 1 48 ASN H 3.835 . 5.674 4.566 4.322 4.774 . 0 0 "[ . 1 . 2]" 1
1332 2 44 ALA HA 2 48 ASN H 3.835 . 5.674 4.565 4.321 4.766 . 0 0 "[ . 1 . 2]" 1
1333 1 44 ALA HA 1 47 LEU H 3.158 . 4.405 3.438 3.317 3.582 . 0 0 "[ . 1 . 2]" 1
1334 2 44 ALA HA 2 47 LEU H 3.158 . 4.405 3.439 3.318 3.581 . 0 0 "[ . 1 . 2]" 1
1335 1 44 ALA HA 1 45 ASP H 3.216 . 4.509 3.538 3.488 3.572 . 0 0 "[ . 1 . 2]" 1
1336 2 44 ALA HA 2 45 ASP H 3.216 . 4.509 3.537 3.487 3.573 . 0 0 "[ . 1 . 2]" 1
1337 1 80 ALA H 1 80 ALA HA 2.923 . 3.991 2.817 2.790 2.841 . 0 0 "[ . 1 . 2]" 1
1338 2 80 ALA H 2 80 ALA HA 2.923 . 3.991 2.817 2.785 2.841 . 0 0 "[ . 1 . 2]" 1
1339 1 80 ALA HA 1 81 ASP H 3.550 . 5.125 3.531 3.495 3.562 . 0 0 "[ . 1 . 2]" 1
1340 2 80 ALA HA 2 81 ASP H 3.550 . 5.125 3.531 3.496 3.562 . 0 0 "[ . 1 . 2]" 1
1341 1 82 ILE HA 1 83 LEU H 3.436 . 4.912 3.552 3.531 3.566 . 0 0 "[ . 1 . 2]" 1
1342 2 82 ILE HA 2 83 LEU H 3.436 . 4.912 3.553 3.529 3.567 . 0 0 "[ . 1 . 2]" 1
1343 1 21 GLU HA 1 22 ILE H 3.565 . 5.154 3.519 3.494 3.536 . 0 0 "[ . 1 . 2]" 1
1344 2 21 GLU HA 2 22 ILE H 3.565 . 5.154 3.519 3.491 3.536 . 0 0 "[ . 1 . 2]" 1
1345 1 43 GLY HA2 1 46 SER H 3.498 . 5.028 3.361 3.155 3.671 . 0 0 "[ . 1 . 2]" 1
1346 2 43 GLY HA2 2 46 SER H 3.498 . 5.028 3.361 3.157 3.670 . 0 0 "[ . 1 . 2]" 1
1347 1 42 ASP H 1 43 GLY HA2 4.859 . 7.811 5.317 5.193 5.416 . 0 0 "[ . 1 . 2]" 1
1348 2 42 ASP H 2 43 GLY HA2 4.859 . 7.811 5.316 5.197 5.417 . 0 0 "[ . 1 . 2]" 1
1349 1 21 GLU HA 1 24 ALA H 3.206 . 4.490 3.563 3.341 3.765 . 0 0 "[ . 1 . 2]" 1
1350 2 21 GLU HA 2 24 ALA H 3.206 . 4.490 3.563 3.343 3.763 . 0 0 "[ . 1 . 2]" 1
1351 1 43 GLY H 1 43 GLY HA2 2.884 . 3.924 2.829 2.804 2.877 . 0 0 "[ . 1 . 2]" 1
1352 2 43 GLY H 2 43 GLY HA2 2.884 . 3.924 2.829 2.806 2.877 . 0 0 "[ . 1 . 2]" 1
1353 1 82 ILE HA 1 85 SER H 3.650 . 5.315 3.627 3.450 3.905 . 0 0 "[ . 1 . 2]" 1
1354 2 82 ILE HA 2 85 SER H 3.650 . 5.315 3.625 3.450 3.898 . 0 0 "[ . 1 . 2]" 1
1355 1 21 GLU H 1 21 GLU HA 2.706 . 3.621 2.838 2.816 2.865 . 0 0 "[ . 1 . 2]" 1
1356 2 21 GLU H 2 21 GLU HA 2.706 . 3.621 2.838 2.814 2.866 . 0 0 "[ . 1 . 2]" 1
1357 1 82 ILE H 1 82 ILE HA 2.802 . 3.784 2.800 2.779 2.830 . 0 0 "[ . 1 . 2]" 1
1358 2 82 ILE H 2 82 ILE HA 2.802 . 3.784 2.800 2.778 2.829 . 0 0 "[ . 1 . 2]" 1
1359 1 27 VAL H 1 27 VAL HA 2.987 . 4.102 2.844 2.829 2.858 . 0 0 "[ . 1 . 2]" 1
1360 2 27 VAL H 2 27 VAL HA 2.987 . 4.102 2.845 2.830 2.856 . 0 0 "[ . 1 . 2]" 1
1361 1 27 VAL HA 1 28 ASN H 3.482 . 4.997 3.496 3.457 3.524 . 0 0 "[ . 1 . 2]" 1
1362 2 27 VAL HA 2 28 ASN H 3.482 . 4.997 3.496 3.456 3.526 . 0 0 "[ . 1 . 2]" 1
1363 1 34 VAL HA 1 35 GLU H 3.155 . 4.399 3.448 3.405 3.489 . 0 0 "[ . 1 . 2]" 1
1364 2 34 VAL HA 2 35 GLU H 3.155 . 4.399 3.448 3.406 3.489 . 0 0 "[ . 1 . 2]" 1
1365 1 34 VAL HA 1 38 GLU H 3.683 . 5.378 3.519 3.207 3.844 . 0 0 "[ . 1 . 2]" 1
1366 2 34 VAL HA 2 38 GLU H 3.683 . 5.378 3.519 3.208 3.843 . 0 0 "[ . 1 . 2]" 1
1367 1 34 VAL HA 1 37 LYS H 3.355 . 4.762 3.235 2.892 3.506 . 0 0 "[ . 1 . 2]" 1
1368 2 34 VAL HA 2 37 LYS H 3.355 . 4.762 3.235 2.895 3.509 . 0 0 "[ . 1 . 2]" 1
1369 1 34 VAL H 1 34 VAL HA 2.649 . 3.526 2.868 2.847 2.889 . 0 0 "[ . 1 . 2]" 1
1370 2 34 VAL H 2 34 VAL HA 2.649 . 3.526 2.868 2.847 2.887 . 0 0 "[ . 1 . 2]" 1
1371 1 30 PHE HB2 1 31 SER H 3.677 . 5.367 2.643 2.559 2.719 . 0 0 "[ . 1 . 2]" 1
1372 2 30 PHE HB2 2 31 SER H 3.677 . 5.367 2.643 2.560 2.719 . 0 0 "[ . 1 . 2]" 1
1373 1 30 PHE H 1 30 PHE HB2 3.660 . 5.335 2.459 2.395 2.511 . 0 0 "[ . 1 . 2]" 1
1374 2 30 PHE H 2 30 PHE HB2 3.660 . 5.335 2.459 2.400 2.506 . 0 0 "[ . 1 . 2]" 1
1375 1 68 ILE H 1 68 ILE HA 2.885 . 3.926 2.814 2.795 2.848 . 0 0 "[ . 1 . 2]" 1
1376 2 68 ILE H 2 68 ILE HA 2.885 . 3.926 2.814 2.797 2.848 . 0 0 "[ . 1 . 2]" 1
1377 1 34 VAL HA 1 39 ILE H 3.659 . 5.332 3.767 3.498 4.274 . 0 0 "[ . 1 . 2]" 1
1378 2 34 VAL HA 2 39 ILE H 3.659 . 5.332 3.767 3.497 4.272 . 0 0 "[ . 1 . 2]" 1
1379 1 68 ILE HA 1 69 LEU H 3.727 . 5.464 3.552 3.532 3.570 . 0 0 "[ . 1 . 2]" 1
1380 2 68 ILE HA 2 69 LEU H 3.727 . 5.464 3.553 3.531 3.570 . 0 0 "[ . 1 . 2]" 1
1381 1 43 GLY HA3 1 44 ALA H 2.920 . 3.986 2.843 2.762 2.936 . 0 0 "[ . 1 . 2]" 1
1382 2 43 GLY HA3 2 44 ALA H 2.920 . 3.986 2.843 2.763 2.936 . 0 0 "[ . 1 . 2]" 1
1383 1 42 ASP H 1 43 GLY HA3 4.872 . 7.839 4.981 4.836 5.099 . 0 0 "[ . 1 . 2]" 1
1384 2 42 ASP H 2 43 GLY HA3 4.872 . 7.839 4.980 4.842 5.103 . 0 0 "[ . 1 . 2]" 1
1385 1 43 GLY H 1 43 GLY HA3 2.342 . 3.028 2.296 2.288 2.312 . 0 0 "[ . 1 . 2]" 1
1386 2 43 GLY H 2 43 GLY HA3 2.342 . 3.028 2.296 2.289 2.312 . 0 0 "[ . 1 . 2]" 1
1387 1 43 GLY HA3 1 46 SER H 4.406 . 6.832 4.575 4.457 4.856 . 0 0 "[ . 1 . 2]" 1
1388 2 43 GLY HA3 2 46 SER H 4.406 . 6.832 4.574 4.459 4.856 . 0 0 "[ . 1 . 2]" 1
1389 1 58 PHE H 1 58 PHE HB3 3.805 . 5.615 3.609 3.571 3.682 . 0 0 "[ . 1 . 2]" 1
1390 2 58 PHE H 2 58 PHE HB3 3.805 . 5.615 3.609 3.570 3.680 . 0 0 "[ . 1 . 2]" 1
1391 1 40 SER H 1 43 GLY HA3 4.008 . 6.016 3.996 3.441 4.732 . 0 0 "[ . 1 . 2]" 1
1392 2 40 SER H 2 43 GLY HA3 4.008 . 6.016 3.998 3.439 4.740 . 0 0 "[ . 1 . 2]" 1
1393 1 58 PHE HB3 1 59 GLY H 4.493 . 7.016 3.921 3.683 4.177 . 0 0 "[ . 1 . 2]" 1
1394 2 58 PHE HB3 2 59 GLY H 4.493 . 7.016 3.921 3.677 4.176 . 0 0 "[ . 1 . 2]" 1
1395 1 78 HIS HB3 1 80 ALA H 3.429 . 4.899 3.350 2.763 4.405 . 0 0 "[ . 1 . 2]" 1
1396 2 78 HIS HB3 2 80 ALA H 3.429 . 4.899 3.349 2.765 4.409 . 0 0 "[ . 1 . 2]" 1
1397 1 78 HIS H 1 78 HIS HB3 3.643 . 5.302 3.578 2.639 4.061 . 0 0 "[ . 1 . 2]" 1
1398 2 78 HIS H 2 78 HIS HB3 3.643 . 5.302 3.578 2.635 4.059 . 0 0 "[ . 1 . 2]" 1
1399 1 78 HIS HB3 1 81 ASP H 3.842 . 5.687 3.564 2.519 4.320 . 0 0 "[ . 1 . 2]" 1
1400 2 78 HIS HB3 2 81 ASP H 3.842 . 5.687 3.563 2.517 4.318 . 0 0 "[ . 1 . 2]" 1
1401 1 74 PHE H 1 74 PHE HB3 3.901 . 5.804 3.725 3.575 4.085 . 0 0 "[ . 1 . 2]" 1
1402 2 74 PHE H 2 74 PHE HB3 3.901 . 5.804 3.726 3.577 4.087 . 0 0 "[ . 1 . 2]" 1
1403 1 54 ILE HA 1 55 SER H 3.454 . 4.945 3.542 3.525 3.555 . 0 0 "[ . 1 . 2]" 1
1404 2 54 ILE HA 2 55 SER H 3.454 . 4.945 3.542 3.527 3.555 . 0 0 "[ . 1 . 2]" 1
1405 1 54 ILE H 1 54 ILE HA 2.850 . 3.865 2.804 2.771 2.823 . 0 0 "[ . 1 . 2]" 1
1406 2 54 ILE H 2 54 ILE HA 2.850 . 3.865 2.804 2.772 2.823 . 0 0 "[ . 1 . 2]" 1
1407 1 65 VAL HA 1 68 ILE H 3.244 . 4.559 3.322 3.122 3.471 . 0 0 "[ . 1 . 2]" 1
1408 2 65 VAL HA 2 68 ILE H 3.244 . 4.559 3.322 3.121 3.468 . 0 0 "[ . 1 . 2]" 1
1409 1 65 VAL H 1 65 VAL HA 2.650 . 3.528 2.808 2.778 2.830 . 0 0 "[ . 1 . 2]" 1
1410 2 65 VAL H 2 65 VAL HA 2.650 . 3.528 2.807 2.779 2.827 . 0 0 "[ . 1 . 2]" 1
1411 1 26 ILE HA 1 29 TYR H 3.133 . 4.360 3.575 3.445 3.737 . 0 0 "[ . 1 . 2]" 1
1412 2 26 ILE HA 2 29 TYR H 3.133 . 4.360 3.575 3.446 3.739 . 0 0 "[ . 1 . 2]" 1
1413 1 22 ILE HA 1 25 LEU H 2.951 . 4.040 3.540 3.423 3.746 . 0 0 "[ . 1 . 2]" 1
1414 2 22 ILE HA 2 25 LEU H 2.951 . 4.040 3.538 3.422 3.736 . 0 0 "[ . 1 . 2]" 1
1415 1 22 ILE HA 1 23 ALA H 3.707 . 5.425 3.552 3.543 3.565 . 0 0 "[ . 1 . 2]" 1
1416 2 22 ILE HA 2 23 ALA H 3.707 . 5.425 3.552 3.543 3.566 . 0 0 "[ . 1 . 2]" 1
1417 1 22 ILE H 1 22 ILE HA 2.978 . 4.086 2.826 2.799 2.837 . 0 0 "[ . 1 . 2]" 1
1418 2 22 ILE H 2 22 ILE HA 2.978 . 4.086 2.826 2.801 2.838 . 0 0 "[ . 1 . 2]" 1
1419 1 30 PHE H 1 30 PHE HB3 2.606 . 3.455 3.599 3.581 3.606 0.151 11 0 "[ . 1 . 2]" 1
1420 2 30 PHE H 2 30 PHE HB3 2.606 . 3.455 3.600 3.583 3.605 0.150 1 0 "[ . 1 . 2]" 1
1421 1 30 PHE HB3 1 31 SER H 2.900 . 3.951 3.594 3.499 3.673 . 0 0 "[ . 1 . 2]" 1
1422 2 30 PHE HB3 2 31 SER H 2.900 . 3.951 3.594 3.500 3.673 . 0 0 "[ . 1 . 2]" 1
1423 1 51 MET H 1 51 MET HG2 4.093 . 6.187 4.554 4.524 4.651 . 0 0 "[ . 1 . 2]" 1
1424 2 51 MET H 2 51 MET HG2 4.093 . 6.187 4.554 4.523 4.652 . 0 0 "[ . 1 . 2]" 1
1425 1 60 PHE HB2 1 61 GLU H 2.340 . 3.024 2.449 2.134 2.843 . 0 0 "[ . 1 . 2]" 1
1426 2 60 PHE HB2 2 61 GLU H 2.340 . 3.024 2.449 2.136 2.840 . 0 0 "[ . 1 . 2]" 1
1427 1 60 PHE H 1 60 PHE HB2 3.932 . 5.865 3.931 3.880 3.983 . 0 0 "[ . 1 . 2]" 1
1428 2 60 PHE H 2 60 PHE HB2 3.932 . 5.865 3.931 3.883 3.985 . 0 0 "[ . 1 . 2]" 1
1429 1 29 TYR HB3 1 30 PHE H 2.644 . 3.518 2.472 2.391 2.565 . 0 0 "[ . 1 . 2]" 1
1430 2 29 TYR HB3 2 30 PHE H 2.644 . 3.518 2.471 2.388 2.567 . 0 0 "[ . 1 . 2]" 1
1431 1 29 TYR H 1 29 TYR HB3 2.669 . 3.559 2.449 2.349 2.506 . 0 0 "[ . 1 . 2]" 1
1432 2 29 TYR H 2 29 TYR HB3 2.669 . 3.559 2.448 2.350 2.507 . 0 0 "[ . 1 . 2]" 1
1433 1 78 HIS H 1 78 HIS HB2 2.458 . 3.213 2.657 2.348 3.344 0.131 9 0 "[ . 1 . 2]" 1
1434 2 78 HIS H 2 78 HIS HB2 2.458 . 3.213 2.657 2.349 3.343 0.130 9 0 "[ . 1 . 2]" 1
1435 1 78 HIS HB2 1 81 ASP H 3.343 . 4.740 3.150 2.597 4.735 . 0 0 "[ . 1 . 2]" 1
1436 2 78 HIS HB2 2 81 ASP H 3.343 . 4.740 3.149 2.596 4.738 . 0 0 "[ . 1 . 2]" 1
1437 1 53 CYS HB2 1 54 ILE H 3.034 . 4.184 2.717 2.373 3.804 . 0 0 "[ . 1 . 2]" 1
1438 2 53 CYS HB2 2 54 ILE H 3.034 . 4.184 2.718 2.371 3.807 . 0 0 "[ . 1 . 2]" 1
1439 1 52 ASP H 1 52 ASP HB2 2.598 . 3.442 2.459 2.271 2.628 . 0 0 "[ . 1 . 2]" 1
1440 2 52 ASP H 2 52 ASP HB2 2.598 . 3.442 2.461 2.272 2.633 . 0 0 "[ . 1 . 2]" 1
1441 1 60 PHE HB3 1 61 GLU H 3.840 . 5.683 3.835 3.618 4.065 . 0 0 "[ . 1 . 2]" 1
1442 2 60 PHE HB3 2 61 GLU H 3.840 . 5.683 3.835 3.617 4.062 . 0 0 "[ . 1 . 2]" 1
1443 1 29 TYR H 1 29 TYR HB2 2.879 . 3.915 2.645 2.583 2.720 . 0 0 "[ . 1 . 2]" 1
1444 2 29 TYR H 2 29 TYR HB2 2.879 . 3.915 2.645 2.583 2.720 . 0 0 "[ . 1 . 2]" 1
1445 1 60 PHE H 1 60 PHE HB3 2.663 . 3.549 3.224 3.132 3.414 . 0 0 "[ . 1 . 2]" 1
1446 2 60 PHE H 2 60 PHE HB3 2.663 . 3.549 3.224 3.134 3.412 . 0 0 "[ . 1 . 2]" 1
1447 1 53 CYS H 1 53 CYS HB3 2.921 . 3.987 3.416 2.271 3.596 . 0 0 "[ . 1 . 2]" 1
1448 2 53 CYS H 2 53 CYS HB3 2.921 . 3.987 3.416 2.272 3.594 . 0 0 "[ . 1 . 2]" 1
1449 1 55 SER HB3 1 56 GLU H 2.722 . 3.648 3.630 2.602 3.971 0.323 19 0 "[ . 1 . 2]" 1
1450 2 55 SER HB3 2 56 GLU H 2.722 . 3.648 3.631 2.607 3.972 0.324 19 0 "[ . 1 . 2]" 1
1451 1 55 SER H 1 55 SER HB3 2.760 . 3.712 3.387 2.641 3.588 . 0 0 "[ . 1 . 2]" 1
1452 2 55 SER H 2 55 SER HB3 2.760 . 3.712 3.388 2.642 3.591 . 0 0 "[ . 1 . 2]" 1
1453 1 53 CYS HB3 1 54 ILE H 2.844 . 3.855 3.508 2.335 4.156 0.301 18 0 "[ . 1 . 2]" 1
1454 2 53 CYS HB3 2 54 ILE H 2.844 . 3.855 3.508 2.336 4.157 0.302 18 0 "[ . 1 . 2]" 1
1455 1 78 HIS H 1 81 ASP QB 3.661 . 5.336 2.814 2.013 5.162 . 0 0 "[ . 1 . 2]" 1
1456 2 78 HIS H 2 81 ASP QB 3.661 . 5.336 2.813 2.011 5.163 . 0 0 "[ . 1 . 2]" 1
1457 1 81 ASP QB 1 82 ILE H 3.058 . 4.227 2.517 2.382 2.652 . 0 0 "[ . 1 . 2]" 1
1458 2 81 ASP QB 2 82 ILE H 3.058 . 4.227 2.516 2.384 2.647 . 0 0 "[ . 1 . 2]" 1
1459 1 81 ASP H 1 81 ASP QB 2.872 . 3.903 2.359 2.230 2.482 . 0 0 "[ . 1 . 2]" 1
1460 2 81 ASP H 2 81 ASP QB 2.872 . 3.903 2.358 2.229 2.481 . 0 0 "[ . 1 . 2]" 1
1461 1 44 ALA H 1 45 ASP HB3 4.821 . 7.727 5.168 4.574 6.315 . 0 0 "[ . 1 . 2]" 1
1462 2 44 ALA H 2 45 ASP HB3 4.821 . 7.727 5.169 4.576 6.318 . 0 0 "[ . 1 . 2]" 1
1463 1 45 ASP H 1 45 ASP HB3 2.411 . 3.138 2.753 2.390 3.602 0.464 10 0 "[ . 1 . 2]" 1
1464 2 45 ASP H 2 45 ASP HB3 2.411 . 3.138 2.753 2.392 3.603 0.465 10 0 "[ . 1 . 2]" 1
1465 1 45 ASP HB3 1 46 SER H 2.559 . 3.378 2.870 2.517 3.729 0.351 3 0 "[ . 1 . 2]" 1
1466 2 45 ASP HB3 2 46 SER H 2.559 . 3.378 2.871 2.526 3.726 0.348 3 0 "[ . 1 . 2]" 1
1467 1 52 ASP HB3 1 53 CYS H 3.321 . 4.700 3.196 2.529 3.732 . 0 0 "[ . 1 . 2]" 1
1468 2 52 ASP HB3 2 53 CYS H 3.321 . 4.700 3.196 2.527 3.732 . 0 0 "[ . 1 . 2]" 1
1469 1 52 ASP H 1 52 ASP HB3 2.847 . 3.860 3.163 2.447 3.617 . 0 0 "[ . 1 . 2]" 1
1470 2 52 ASP H 2 52 ASP HB3 2.847 . 3.860 3.164 2.443 3.618 . 0 0 "[ . 1 . 2]" 1
1471 1 45 ASP H 1 45 ASP HB2 2.774 . 3.736 2.541 2.349 2.674 . 0 0 "[ . 1 . 2]" 1
1472 2 45 ASP H 2 45 ASP HB2 2.774 . 3.736 2.540 2.347 2.668 . 0 0 "[ . 1 . 2]" 1
1473 1 45 ASP HB2 1 46 SER H 3.620 . 5.258 3.636 2.723 3.967 . 0 0 "[ . 1 . 2]" 1
1474 2 45 ASP HB2 2 46 SER H 3.620 . 5.258 3.637 2.724 3.967 . 0 0 "[ . 1 . 2]" 1
1475 1 28 ASN HB3 1 29 TYR H 2.946 . 4.031 2.607 2.457 2.841 . 0 0 "[ . 1 . 2]" 1
1476 2 28 ASN HB3 2 29 TYR H 2.946 . 4.031 2.607 2.457 2.838 . 0 0 "[ . 1 . 2]" 1
1477 1 20 GLU H 1 20 GLU HG2 2.934 . 4.010 2.065 1.857 2.818 0.001 10 0 "[ . 1 . 2]" 1
1478 2 20 GLU H 2 20 GLU HG2 2.934 . 4.010 2.065 1.855 2.819 0.003 10 0 "[ . 1 . 2]" 1
1479 1 58 PHE HB2 1 59 GLY H 3.289 . 4.641 3.158 2.933 3.506 . 0 0 "[ . 1 . 2]" 1
1480 2 58 PHE HB2 2 59 GLY H 3.289 . 4.641 3.158 2.926 3.505 . 0 0 "[ . 1 . 2]" 1
1481 1 58 PHE H 1 58 PHE HB2 2.498 . 3.278 2.368 2.298 2.491 . 0 0 "[ . 1 . 2]" 1
1482 2 58 PHE H 2 58 PHE HB2 2.498 . 3.278 2.368 2.297 2.488 . 0 0 "[ . 1 . 2]" 1
1483 1 42 ASP H 1 42 ASP HB2 2.851 . 3.867 2.627 2.356 3.630 . 0 0 "[ . 1 . 2]" 1
1484 2 42 ASP H 2 42 ASP HB2 2.851 . 3.867 2.626 2.359 3.625 . 0 0 "[ . 1 . 2]" 1
1485 1 42 ASP HB2 1 43 GLY H 4.108 . 6.217 3.222 2.360 4.003 . 0 0 "[ . 1 . 2]" 1
1486 2 42 ASP HB2 2 43 GLY H 4.108 . 6.217 3.222 2.358 4.004 . 0 0 "[ . 1 . 2]" 1
1487 1 20 GLU HG2 1 21 GLU H 3.125 . 4.345 2.640 2.218 2.881 . 0 0 "[ . 1 . 2]" 1
1488 2 20 GLU HG2 2 21 GLU H 3.125 . 4.345 2.641 2.214 2.885 . 0 0 "[ . 1 . 2]" 1
1489 1 51 MET H 1 51 MET HB2 2.352 . 3.043 2.315 2.181 2.444 . 0 0 "[ . 1 . 2]" 1
1490 2 51 MET H 2 51 MET HB2 2.352 . 3.043 2.316 2.183 2.446 . 0 0 "[ . 1 . 2]" 1
1491 1 51 MET HB2 1 53 CYS H 4.165 . 6.333 5.554 5.345 5.855 . 0 0 "[ . 1 . 2]" 1
1492 2 51 MET HB2 2 53 CYS H 4.165 . 6.333 5.555 5.352 5.855 . 0 0 "[ . 1 . 2]" 1
1493 1 51 MET HB2 1 52 ASP H 3.244 . 4.560 3.648 3.316 3.837 . 0 0 "[ . 1 . 2]" 1
1494 2 51 MET HB2 2 52 ASP H 3.244 . 4.560 3.647 3.317 3.835 . 0 0 "[ . 1 . 2]" 1
1495 1 74 PHE H 1 74 PHE HB2 2.748 . 3.692 2.708 2.345 3.664 . 0 0 "[ . 1 . 2]" 1
1496 2 74 PHE H 2 74 PHE HB2 2.748 . 3.692 2.708 2.345 3.662 . 0 0 "[ . 1 . 2]" 1
1497 1 15 MET H 1 15 MET HG2 3.169 . 4.424 3.303 2.300 4.404 . 0 0 "[ . 1 . 2]" 1
1498 2 15 MET H 2 15 MET HG2 3.169 . 4.424 3.305 2.298 4.408 . 0 0 "[ . 1 . 2]" 1
1499 1 15 MET HG2 1 16 SER H 4.441 . 6.906 4.514 2.011 5.236 . 0 0 "[ . 1 . 2]" 1
1500 2 15 MET HG2 2 16 SER H 4.441 . 6.906 4.514 2.016 5.235 . 0 0 "[ . 1 . 2]" 1
1501 1 21 GLU HB3 1 22 ILE H 3.838 . 5.680 3.634 3.544 3.775 . 0 0 "[ . 1 . 2]" 1
1502 2 21 GLU HB3 2 22 ILE H 3.838 . 5.680 3.633 3.546 3.775 . 0 0 "[ . 1 . 2]" 1
1503 1 18 SER H 1 21 GLU HB3 3.986 . 5.972 3.956 3.619 4.460 . 0 0 "[ . 1 . 2]" 1
1504 2 18 SER H 2 21 GLU HB3 3.986 . 5.972 3.956 3.623 4.456 . 0 0 "[ . 1 . 2]" 1
1505 1 42 ASP H 1 42 ASP HB3 2.479 . 3.247 3.058 2.459 3.618 0.371 13 0 "[ . 1 . 2]" 1
1506 2 42 ASP H 2 42 ASP HB3 2.479 . 3.247 3.058 2.462 3.618 0.371 13 0 "[ . 1 . 2]" 1
1507 1 15 MET H 1 15 MET HG3 2.582 . 3.415 3.257 2.223 3.986 0.571 5 2 "[ +- 1 . 2]" 1
1508 2 15 MET H 2 15 MET HG3 2.582 . 3.415 3.258 2.228 3.982 0.567 5 2 "[ +- 1 . 2]" 1
1509 1 42 ASP HB3 1 43 GLY H 2.879 . 3.915 3.177 2.480 3.930 0.015 18 0 "[ . 1 . 2]" 1
1510 2 42 ASP HB3 2 43 GLY H 2.879 . 3.915 3.176 2.481 3.929 0.014 18 0 "[ . 1 . 2]" 1
1511 1 20 GLU H 1 20 GLU HG3 2.950 . 4.038 3.279 3.010 3.718 . 0 0 "[ . 1 . 2]" 1
1512 2 20 GLU H 2 20 GLU HG3 2.950 . 4.038 3.279 3.007 3.718 . 0 0 "[ . 1 . 2]" 1
1513 1 27 VAL H 1 27 VAL HB 2.873 . 3.904 3.657 3.644 3.663 . 0 0 "[ . 1 . 2]" 1
1514 2 27 VAL H 2 27 VAL HB 2.873 . 3.904 3.658 3.644 3.665 . 0 0 "[ . 1 . 2]" 1
1515 1 27 VAL HB 1 28 ASN H 2.945 . 4.029 3.900 3.811 3.959 . 0 0 "[ . 1 . 2]" 1
1516 2 27 VAL HB 2 28 ASN H 2.945 . 4.029 3.901 3.812 3.962 . 0 0 "[ . 1 . 2]" 1
1517 1 48 ASN H 1 49 VAL HB 4.730 . 7.527 5.327 5.130 5.458 . 0 0 "[ . 1 . 2]" 1
1518 2 48 ASN H 2 49 VAL HB 4.730 . 7.527 5.329 5.135 5.458 . 0 0 "[ . 1 . 2]" 1
1519 1 49 VAL HB 1 50 ALA H 3.007 . 4.137 3.998 3.973 4.045 . 0 0 "[ . 1 . 2]" 1
1520 2 49 VAL HB 2 50 ALA H 3.007 . 4.137 3.999 3.973 4.042 . 0 0 "[ . 1 . 2]" 1
1521 1 49 VAL H 1 49 VAL HB 2.298 . 2.958 2.636 2.586 2.706 . 0 0 "[ . 1 . 2]" 1
1522 2 49 VAL H 2 49 VAL HB 2.298 . 2.958 2.637 2.588 2.702 . 0 0 "[ . 1 . 2]" 1
1523 1 35 GLU H 1 35 GLU HG2 4.273 . 6.556 4.512 4.362 4.608 . 0 0 "[ . 1 . 2]" 1
1524 2 35 GLU H 2 35 GLU HG2 4.273 . 6.556 4.512 4.360 4.609 . 0 0 "[ . 1 . 2]" 1
1525 1 35 GLU HG2 1 36 LYS H 4.065 . 6.130 4.023 3.210 4.720 . 0 0 "[ . 1 . 2]" 1
1526 2 35 GLU HG2 2 36 LYS H 4.065 . 6.130 4.024 3.212 4.720 . 0 0 "[ . 1 . 2]" 1
1527 1 41 GLU H 1 41 GLU QG 2.593 . 3.433 2.193 1.836 2.959 . 0 0 "[ . 1 . 2]" 1
1528 2 41 GLU H 2 41 GLU QG 2.593 . 3.433 2.193 1.841 2.963 . 0 0 "[ . 1 . 2]" 1
1529 1 61 GLU HB3 1 62 ARG H 2.660 . 3.545 2.655 2.251 2.929 . 0 0 "[ . 1 . 2]" 1
1530 2 61 GLU HB3 2 62 ARG H 2.660 . 3.545 2.656 2.249 2.932 . 0 0 "[ . 1 . 2]" 1
1531 1 41 GLU QG 1 42 ASP H 5.053 . 8.245 3.937 1.874 4.573 . 0 0 "[ . 1 . 2]" 1
1532 2 41 GLU QG 2 42 ASP H 5.053 . 8.245 3.936 1.874 4.569 . 0 0 "[ . 1 . 2]" 1
1533 1 56 GLU QG 1 57 ALA H 3.934 . 5.868 3.779 3.481 4.211 . 0 0 "[ . 1 . 2]" 1
1534 2 56 GLU QG 2 57 ALA H 3.934 . 5.868 3.779 3.480 4.215 . 0 0 "[ . 1 . 2]" 1
1535 1 20 GLU H 1 20 GLU HB3 3.165 . 4.418 2.594 2.537 2.719 . 0 0 "[ . 1 . 2]" 1
1536 2 20 GLU H 2 20 GLU HB3 3.165 . 4.418 2.595 2.542 2.718 . 0 0 "[ . 1 . 2]" 1
1537 1 91 GLU QG 1 92 SER H 4.574 . 7.190 3.929 2.614 4.873 . 0 0 "[ . 1 . 2]" 1
1538 2 91 GLU QG 2 92 SER H 4.574 . 7.190 3.931 2.621 4.873 . 0 0 "[ . 1 . 2]" 1
1539 1 56 GLU H 1 56 GLU QG 4.028 . 6.056 3.994 3.941 4.055 . 0 0 "[ . 1 . 2]" 1
1540 2 56 GLU H 2 56 GLU QG 4.028 . 6.056 3.994 3.943 4.058 . 0 0 "[ . 1 . 2]" 1
1541 1 77 GLN QG 1 78 HIS H 5.605 . 9.533 4.119 3.050 4.633 . 0 0 "[ . 1 . 2]" 1
1542 2 77 GLN QG 2 78 HIS H 5.605 . 9.533 4.119 3.047 4.633 . 0 0 "[ . 1 . 2]" 1
1543 1 77 GLN H 1 77 GLN QG 2.620 . 3.478 2.821 2.248 3.418 . 0 0 "[ . 1 . 2]" 1
1544 2 77 GLN H 2 77 GLN QG 2.620 . 3.478 2.821 2.250 3.414 . 0 0 "[ . 1 . 2]" 1
1545 1 77 GLN HE21 1 77 GLN QG 3.163 . 4.414 2.257 2.152 2.775 . 0 0 "[ . 1 . 2]" 1
1546 2 77 GLN HE21 2 77 GLN QG 3.163 . 4.414 2.257 2.150 2.778 . 0 0 "[ . 1 . 2]" 1
1547 1 77 GLN HE22 1 77 GLN QG 3.571 . 5.165 3.284 3.213 3.477 . 0 0 "[ . 1 . 2]" 1
1548 2 77 GLN HE22 2 77 GLN QG 3.571 . 5.165 3.284 3.214 3.477 . 0 0 "[ . 1 . 2]" 1
1549 1 65 VAL HB 1 66 SER H 3.222 . 4.519 4.029 3.950 4.067 . 0 0 "[ . 1 . 2]" 1
1550 2 65 VAL HB 2 66 SER H 3.222 . 4.519 4.028 3.943 4.072 . 0 0 "[ . 1 . 2]" 1
1551 1 34 VAL H 1 34 VAL HB 2.743 . 3.683 3.653 3.634 3.677 . 0 0 "[ . 1 . 2]" 1
1552 2 34 VAL H 2 34 VAL HB 2.743 . 3.683 3.653 3.634 3.677 . 0 0 "[ . 1 . 2]" 1
1553 1 65 VAL H 1 65 VAL HB 2.104 . 2.657 2.627 2.531 2.700 0.043 6 0 "[ . 1 . 2]" 1
1554 2 65 VAL H 2 65 VAL HB 2.104 . 2.657 2.627 2.531 2.699 0.042 6 0 "[ . 1 . 2]" 1
1555 1 35 GLU H 1 35 GLU HB2 2.297 . 2.956 2.470 2.381 2.562 . 0 0 "[ . 1 . 2]" 1
1556 2 35 GLU H 2 35 GLU HB2 2.297 . 2.956 2.470 2.381 2.564 . 0 0 "[ . 1 . 2]" 1
1557 1 35 GLU HB2 1 36 LYS H 3.192 . 4.466 3.751 3.630 3.892 . 0 0 "[ . 1 . 2]" 1
1558 2 35 GLU HB2 2 36 LYS H 3.192 . 4.466 3.751 3.628 3.895 . 0 0 "[ . 1 . 2]" 1
1559 1 26 ILE HB 1 27 VAL H 2.669 . 3.559 2.445 2.393 2.492 . 0 0 "[ . 1 . 2]" 1
1560 2 26 ILE HB 2 27 VAL H 2.669 . 3.559 2.445 2.392 2.492 . 0 0 "[ . 1 . 2]" 1
1561 1 25 LEU H 1 26 ILE HB 3.429 . 4.899 4.745 4.637 4.899 . 0 0 "[ . 1 . 2]" 1
1562 2 25 LEU H 2 26 ILE HB 3.429 . 4.899 4.748 4.637 4.900 0.001 1 0 "[ . 1 . 2]" 1
1563 1 91 GLU H 1 91 GLU HB2 3.140 . 4.372 2.933 2.340 3.731 . 0 0 "[ . 1 . 2]" 1
1564 2 91 GLU H 2 91 GLU HB2 3.140 . 4.372 2.931 2.342 3.731 . 0 0 "[ . 1 . 2]" 1
1565 1 91 GLU HB2 1 92 SER H 3.167 . 4.421 3.958 2.224 4.596 0.175 19 0 "[ . 1 . 2]" 1
1566 2 91 GLU HB2 2 92 SER H 3.167 . 4.421 3.959 2.226 4.592 0.171 19 0 "[ . 1 . 2]" 1
1567 1 33 ILE HB 1 34 VAL H 2.356 . 3.050 2.468 2.329 2.652 . 0 0 "[ . 1 . 2]" 1
1568 2 33 ILE HB 2 34 VAL H 2.356 . 3.050 2.469 2.330 2.652 . 0 0 "[ . 1 . 2]" 1
1569 1 33 ILE H 1 33 ILE HB 2.312 . 2.980 2.606 2.488 2.773 . 0 0 "[ . 1 . 2]" 1
1570 2 33 ILE H 2 33 ILE HB 2.312 . 2.980 2.606 2.489 2.776 . 0 0 "[ . 1 . 2]" 1
1571 1 56 GLU H 1 56 GLU HB2 2.354 . 3.046 2.470 2.332 2.598 . 0 0 "[ . 1 . 2]" 1
1572 2 56 GLU H 2 56 GLU HB2 2.354 . 3.046 2.470 2.328 2.601 . 0 0 "[ . 1 . 2]" 1
1573 1 31 SER H 1 51 MET ME 3.947 . 5.894 3.114 2.482 3.745 . 0 0 "[ . 1 . 2]" 1
1574 2 31 SER H 2 51 MET ME 3.947 . 5.894 3.114 2.482 3.745 . 0 0 "[ . 1 . 2]" 1
1575 1 89 VAL H 1 89 VAL HB 2.375 . 3.080 2.699 2.512 2.907 . 0 0 "[ . 1 . 2]" 1
1576 2 89 VAL H 2 89 VAL HB 2.375 . 3.080 2.698 2.509 2.900 . 0 0 "[ . 1 . 2]" 1
1577 1 35 GLU HB3 1 36 LYS H 2.534 . 3.336 2.420 2.197 2.674 . 0 0 "[ . 1 . 2]" 1
1578 2 35 GLU HB3 2 36 LYS H 2.534 . 3.336 2.420 2.196 2.677 . 0 0 "[ . 1 . 2]" 1
1579 1 48 ASN H 1 51 MET ME 3.716 . 5.442 4.773 4.596 4.872 . 0 0 "[ . 1 . 2]" 1
1580 2 48 ASN H 2 51 MET ME 3.716 . 5.442 4.772 4.591 4.872 . 0 0 "[ . 1 . 2]" 1
1581 1 37 LYS H 1 37 LYS HB3 3.130 . 4.354 3.596 2.971 3.736 . 0 0 "[ . 1 . 2]" 1
1582 2 37 LYS H 2 37 LYS HB3 3.130 . 4.354 3.596 2.971 3.733 . 0 0 "[ . 1 . 2]" 1
1583 1 50 ALA H 1 51 MET ME 3.972 . 5.944 5.123 4.477 5.491 . 0 0 "[ . 1 . 2]" 1
1584 2 50 ALA H 2 51 MET ME 3.972 . 5.944 5.122 4.475 5.486 . 0 0 "[ . 1 . 2]" 1
1585 1 75 LYS H 1 75 LYS HB2 3.406 . 4.856 3.350 2.428 3.830 . 0 0 "[ . 1 . 2]" 1
1586 2 75 LYS H 2 75 LYS HB2 3.406 . 4.856 3.350 2.429 3.830 . 0 0 "[ . 1 . 2]" 1
1587 1 20 GLU HB2 1 21 GLU H 3.346 . 4.746 3.787 3.541 3.961 . 0 0 "[ . 1 . 2]" 1
1588 2 20 GLU HB2 2 21 GLU H 3.346 . 4.746 3.788 3.542 3.963 . 0 0 "[ . 1 . 2]" 1
1589 1 55 SER H 1 56 GLU HB3 4.913 . 7.930 4.949 4.714 5.245 . 0 0 "[ . 1 . 2]" 1
1590 2 55 SER H 2 56 GLU HB3 4.913 . 7.930 4.950 4.711 5.247 . 0 0 "[ . 1 . 2]" 1
1591 1 56 GLU HB3 1 57 ALA H 2.669 . 3.560 2.704 2.476 3.024 . 0 0 "[ . 1 . 2]" 1
1592 2 56 GLU HB3 2 57 ALA H 2.669 . 3.560 2.703 2.475 3.028 . 0 0 "[ . 1 . 2]" 1
1593 1 71 LYS HB2 1 72 SER H 2.989 . 4.106 3.549 2.449 4.042 . 0 0 "[ . 1 . 2]" 1
1594 2 71 LYS HB2 2 72 SER H 2.989 . 4.106 3.549 2.452 4.042 . 0 0 "[ . 1 . 2]" 1
1595 1 71 LYS H 1 71 LYS HB2 2.906 . 3.961 2.704 2.436 3.622 . 0 0 "[ . 1 . 2]" 1
1596 2 71 LYS H 2 71 LYS HB2 2.906 . 3.961 2.703 2.429 3.622 . 0 0 "[ . 1 . 2]" 1
1597 1 61 GLU H 1 61 GLU HB2 2.401 . 3.122 2.509 2.395 2.611 . 0 0 "[ . 1 . 2]" 1
1598 2 61 GLU H 2 61 GLU HB2 2.401 . 3.122 2.509 2.392 2.612 . 0 0 "[ . 1 . 2]" 1
1599 1 56 GLU H 1 56 GLU HB3 2.475 . 3.241 2.528 2.407 2.710 . 0 0 "[ . 1 . 2]" 1
1600 2 56 GLU H 2 56 GLU HB3 2.475 . 3.241 2.529 2.409 2.711 . 0 0 "[ . 1 . 2]" 1
1601 1 91 GLU HB3 1 92 SER H 4.030 . 6.061 3.914 2.560 4.527 . 0 0 "[ . 1 . 2]" 1
1602 2 91 GLU HB3 2 92 SER H 4.030 . 6.061 3.915 2.554 4.532 . 0 0 "[ . 1 . 2]" 1
1603 1 51 MET H 1 51 MET HB3 3.577 . 5.176 2.716 2.624 2.966 . 0 0 "[ . 1 . 2]" 1
1604 2 51 MET H 2 51 MET HB3 3.577 . 5.176 2.716 2.621 2.969 . 0 0 "[ . 1 . 2]" 1
1605 1 51 MET HB3 1 52 ASP H 2.948 . 4.035 2.458 2.273 2.667 . 0 0 "[ . 1 . 2]" 1
1606 2 51 MET HB3 2 52 ASP H 2.948 . 4.035 2.456 2.271 2.666 . 0 0 "[ . 1 . 2]" 1
1607 1 62 ARG H 1 62 ARG HG2 4.390 . 6.799 3.976 2.270 4.523 . 0 0 "[ . 1 . 2]" 1
1608 2 62 ARG H 2 62 ARG HG2 4.390 . 6.799 3.977 2.269 4.523 . 0 0 "[ . 1 . 2]" 1
1609 1 38 GLU H 1 38 GLU HB3 2.380 . 3.088 2.894 2.314 3.628 0.540 9 4 "[ * +1*- . 2]" 1
1610 2 38 GLU H 2 38 GLU HB3 2.380 . 3.088 2.894 2.309 3.630 0.542 9 4 "[ * +1-* . 2]" 1
1611 1 38 GLU HB3 1 39 ILE H 2.941 . 4.022 3.395 2.781 4.155 0.133 11 0 "[ . 1 . 2]" 1
1612 2 38 GLU HB3 2 39 ILE H 2.941 . 4.022 3.395 2.781 4.153 0.131 11 0 "[ . 1 . 2]" 1
1613 1 21 GLU HB2 1 22 ILE H 2.623 . 3.483 2.526 2.379 2.649 . 0 0 "[ . 1 . 2]" 1
1614 2 21 GLU HB2 2 22 ILE H 2.623 . 3.483 2.525 2.380 2.648 . 0 0 "[ . 1 . 2]" 1
1615 1 21 GLU H 1 21 GLU HB2 2.576 . 3.405 2.498 2.422 2.633 . 0 0 "[ . 1 . 2]" 1
1616 2 21 GLU H 2 21 GLU HB2 2.576 . 3.405 2.497 2.422 2.634 . 0 0 "[ . 1 . 2]" 1
1617 1 18 SER H 1 21 GLU HB2 2.699 . 3.610 2.693 2.333 3.144 . 0 0 "[ . 1 . 2]" 1
1618 2 18 SER H 2 21 GLU HB2 2.699 . 3.610 2.694 2.337 3.139 . 0 0 "[ . 1 . 2]" 1
1619 1 88 ARG HB3 1 89 VAL H 2.909 . 3.967 3.332 2.342 4.131 0.164 2 0 "[ . 1 . 2]" 1
1620 2 88 ARG HB3 2 89 VAL H 2.909 . 3.967 3.333 2.347 4.130 0.163 2 0 "[ . 1 . 2]" 1
1621 1 88 ARG H 1 88 ARG HB3 3.684 . 5.381 3.560 2.538 3.855 . 0 0 "[ . 1 . 2]" 1
1622 2 88 ARG H 2 88 ARG HB3 3.684 . 5.381 3.560 2.543 3.854 . 0 0 "[ . 1 . 2]" 1
1623 1 71 LYS HB3 1 72 SER H 3.112 . 4.322 3.122 2.045 4.363 0.041 12 0 "[ . 1 . 2]" 1
1624 2 71 LYS HB3 2 72 SER H 3.112 . 4.322 3.122 2.046 4.362 0.040 12 0 "[ . 1 . 2]" 1
1625 1 71 LYS H 1 71 LYS HB3 2.697 . 3.606 2.919 2.368 3.739 0.133 10 0 "[ . 1 . 2]" 1
1626 2 71 LYS H 2 71 LYS HB3 2.697 . 3.606 2.920 2.371 3.743 0.137 10 0 "[ . 1 . 2]" 1
1627 1 19 LYS H 1 19 LYS HG2 2.579 . 3.410 2.755 1.902 3.477 0.067 7 0 "[ . 1 . 2]" 1
1628 2 19 LYS H 2 19 LYS HG2 2.579 . 3.410 2.756 1.903 3.477 0.067 7 0 "[ . 1 . 2]" 1
1629 1 15 MET H 1 73 GLU HG3 3.404 . 4.853 3.544 1.733 5.199 0.346 4 0 "[ . 1 . 2]" 1
1630 2 15 MET H 2 73 GLU HG3 3.404 . 4.853 3.546 1.730 5.204 0.351 4 0 "[ . 1 . 2]" 1
1631 1 73 GLU H 1 73 GLU HG3 2.768 . 3.726 3.255 1.757 4.027 0.301 12 0 "[ . 1 . 2]" 1
1632 2 73 GLU H 2 73 GLU HG3 2.768 . 3.726 3.255 1.760 4.023 0.297 12 0 "[ . 1 . 2]" 1
1633 1 69 LEU HB2 1 70 GLY H 3.636 . 5.288 3.114 2.608 3.628 . 0 0 "[ . 1 . 2]" 1
1634 2 69 LEU HB2 2 70 GLY H 3.636 . 5.288 3.115 2.612 3.632 . 0 0 "[ . 1 . 2]" 1
1635 1 69 LEU H 1 69 LEU HB2 2.857 . 3.878 2.446 2.393 2.499 . 0 0 "[ . 1 . 2]" 1
1636 2 69 LEU H 2 69 LEU HB2 2.857 . 3.878 2.446 2.394 2.497 . 0 0 "[ . 1 . 2]" 1
1637 1 36 LYS H 1 36 LYS HB3 2.460 . 3.217 2.865 2.617 3.102 . 0 0 "[ . 1 . 2]" 1
1638 2 36 LYS H 2 36 LYS HB3 2.460 . 3.217 2.866 2.620 3.107 . 0 0 "[ . 1 . 2]" 1
1639 1 54 ILE H 1 54 ILE HB 2.557 . 3.374 2.645 2.546 2.732 . 0 0 "[ . 1 . 2]" 1
1640 2 54 ILE H 2 54 ILE HB 2.557 . 3.374 2.644 2.547 2.732 . 0 0 "[ . 1 . 2]" 1
1641 1 54 ILE HB 1 55 SER H 2.608 . 3.458 2.397 2.290 2.701 . 0 0 "[ . 1 . 2]" 1
1642 2 54 ILE HB 2 55 SER H 2.608 . 3.458 2.397 2.290 2.701 . 0 0 "[ . 1 . 2]" 1
1643 1 35 GLU H 1 36 LYS HB3 4.862 . 7.817 5.463 5.253 5.814 . 0 0 "[ . 1 . 2]" 1
1644 2 35 GLU H 2 36 LYS HB3 4.862 . 7.817 5.464 5.251 5.812 . 0 0 "[ . 1 . 2]" 1
1645 1 88 ARG HB2 1 89 VAL H 4.053 . 6.106 3.858 2.453 4.517 . 0 0 "[ . 1 . 2]" 1
1646 2 88 ARG HB2 2 89 VAL H 4.053 . 6.106 3.859 2.461 4.521 . 0 0 "[ . 1 . 2]" 1
1647 1 88 ARG H 1 88 ARG HB2 2.585 . 3.420 2.836 2.340 4.022 0.602 13 1 "[ . 1 + . 2]" 1
1648 2 88 ARG H 2 88 ARG HB2 2.585 . 3.420 2.836 2.339 4.020 0.600 13 1 "[ . 1 + . 2]" 1
1649 1 22 ILE H 1 22 ILE HB 2.455 . 3.208 2.535 2.451 2.621 . 0 0 "[ . 1 . 2]" 1
1650 2 22 ILE H 2 22 ILE HB 2.455 . 3.208 2.535 2.452 2.621 . 0 0 "[ . 1 . 2]" 1
1651 1 19 LYS H 1 19 LYS HG3 2.917 . 3.981 2.471 1.790 3.486 0.063 19 0 "[ . 1 . 2]" 1
1652 2 19 LYS H 2 19 LYS HG3 2.917 . 3.981 2.472 1.790 3.489 0.063 19 0 "[ . 1 . 2]" 1
1653 1 61 GLU H 1 64 ALA MB 2.391 . 3.105 2.441 2.056 2.913 . 0 0 "[ . 1 . 2]" 1
1654 2 61 GLU H 2 64 ALA MB 2.391 . 3.105 2.440 2.056 2.913 . 0 0 "[ . 1 . 2]" 1
1655 1 22 ILE HB 1 23 ALA H 2.467 . 3.228 2.389 2.312 2.487 . 0 0 "[ . 1 . 2]" 1
1656 2 22 ILE HB 2 23 ALA H 2.467 . 3.228 2.388 2.312 2.488 . 0 0 "[ . 1 . 2]" 1
1657 1 64 ALA H 1 64 ALA MB 2.133 . 2.701 2.335 2.249 2.412 . 0 0 "[ . 1 . 2]" 1
1658 2 64 ALA H 2 64 ALA MB 2.133 . 2.701 2.335 2.247 2.410 . 0 0 "[ . 1 . 2]" 1
1659 1 64 ALA MB 1 65 VAL H 3.111 . 4.321 3.242 3.006 3.425 . 0 0 "[ . 1 . 2]" 1
1660 2 64 ALA MB 2 65 VAL H 3.111 . 4.321 3.243 3.008 3.427 . 0 0 "[ . 1 . 2]" 1
1661 1 71 LYS H 1 71 LYS QD 5.069 . 8.280 4.323 3.444 5.028 . 0 0 "[ . 1 . 2]" 1
1662 2 71 LYS H 2 71 LYS QD 5.069 . 8.280 4.322 3.443 5.028 . 0 0 "[ . 1 . 2]" 1
1663 1 25 LEU H 1 25 LEU HB3 2.918 . 3.982 3.573 3.548 3.599 . 0 0 "[ . 1 . 2]" 1
1664 2 25 LEU H 2 25 LEU HB3 2.918 . 3.982 3.575 3.550 3.602 . 0 0 "[ . 1 . 2]" 1
1665 1 15 MET H 1 73 GLU HB2 3.975 . 5.950 4.320 2.718 5.574 . 0 0 "[ . 1 . 2]" 1
1666 2 15 MET H 2 73 GLU HB2 3.975 . 5.950 4.320 2.717 5.589 . 0 0 "[ . 1 . 2]" 1
1667 1 36 LYS HG3 1 38 GLU H 3.600 . 5.220 3.001 2.278 3.837 . 0 0 "[ . 1 . 2]" 1
1668 2 36 LYS HG3 2 38 GLU H 3.600 . 5.220 3.002 2.286 3.832 . 0 0 "[ . 1 . 2]" 1
1669 1 36 LYS H 1 36 LYS HG3 3.120 . 4.337 3.020 2.629 3.312 . 0 0 "[ . 1 . 2]" 1
1670 2 36 LYS H 2 36 LYS HG3 3.120 . 4.337 3.020 2.631 3.315 . 0 0 "[ . 1 . 2]" 1
1671 1 69 LEU H 1 69 LEU HG 2.468 . 3.229 2.355 2.178 2.502 . 0 0 "[ . 1 . 2]" 1
1672 2 69 LEU H 2 69 LEU HG 2.468 . 3.229 2.354 2.178 2.503 . 0 0 "[ . 1 . 2]" 1
1673 1 83 LEU H 1 83 LEU HB2 2.419 . 3.151 2.216 2.146 2.284 . 0 0 "[ . 1 . 2]" 1
1674 2 83 LEU H 2 83 LEU HB2 2.419 . 3.151 2.215 2.149 2.283 . 0 0 "[ . 1 . 2]" 1
1675 1 73 GLU H 1 73 GLU HB2 3.019 . 4.158 2.787 2.348 3.971 . 0 0 "[ . 1 . 2]" 1
1676 2 73 GLU H 2 73 GLU HB2 3.019 . 4.158 2.786 2.345 3.969 . 0 0 "[ . 1 . 2]" 1
1677 1 47 LEU HB2 1 48 ASN H 2.865 . 3.891 3.015 2.884 3.255 . 0 0 "[ . 1 . 2]" 1
1678 2 47 LEU HB2 2 48 ASN H 2.865 . 3.891 3.013 2.883 3.250 . 0 0 "[ . 1 . 2]" 1
1679 1 47 LEU H 1 47 LEU HB2 2.319 . 2.991 2.395 2.351 2.459 . 0 0 "[ . 1 . 2]" 1
1680 2 47 LEU H 2 47 LEU HB2 2.319 . 2.991 2.395 2.354 2.460 . 0 0 "[ . 1 . 2]" 1
1681 1 82 ILE H 1 82 ILE HB 2.290 . 2.945 2.356 2.296 2.442 . 0 0 "[ . 1 . 2]" 1
1682 2 82 ILE H 2 82 ILE HB 2.290 . 2.945 2.355 2.297 2.445 . 0 0 "[ . 1 . 2]" 1
1683 1 39 ILE HB 1 40 SER H 3.422 . 4.885 3.990 3.898 4.090 . 0 0 "[ . 1 . 2]" 1
1684 2 39 ILE HB 2 40 SER H 3.422 . 4.885 3.991 3.896 4.095 . 0 0 "[ . 1 . 2]" 1
1685 1 39 ILE H 1 39 ILE HB 2.307 . 2.972 2.805 2.568 3.041 0.069 14 0 "[ . 1 . 2]" 1
1686 2 39 ILE H 2 39 ILE HB 2.307 . 2.972 2.804 2.568 3.043 0.071 14 0 "[ . 1 . 2]" 1
1687 1 68 ILE H 1 68 ILE HB 2.450 . 3.200 2.569 2.517 2.631 . 0 0 "[ . 1 . 2]" 1
1688 2 68 ILE H 2 68 ILE HB 2.450 . 3.200 2.569 2.513 2.629 . 0 0 "[ . 1 . 2]" 1
1689 1 82 ILE HB 1 83 LEU H 2.352 . 3.044 2.480 2.336 2.639 . 0 0 "[ . 1 . 2]" 1
1690 2 82 ILE HB 2 83 LEU H 2.352 . 3.044 2.480 2.339 2.640 . 0 0 "[ . 1 . 2]" 1
1691 1 68 ILE HB 1 69 LEU H 2.738 . 3.675 2.468 2.332 2.623 . 0 0 "[ . 1 . 2]" 1
1692 2 68 ILE HB 2 69 LEU H 2.738 . 3.675 2.468 2.330 2.623 . 0 0 "[ . 1 . 2]" 1
1693 1 50 ALA MB 1 51 MET H 2.710 . 3.628 2.621 2.429 2.799 . 0 0 "[ . 1 . 2]" 1
1694 2 50 ALA MB 2 51 MET H 2.710 . 3.628 2.621 2.426 2.801 . 0 0 "[ . 1 . 2]" 1
1695 1 50 ALA H 1 50 ALA MB 2.225 . 2.844 2.235 2.223 2.243 . 0 0 "[ . 1 . 2]" 1
1696 2 50 ALA H 2 50 ALA MB 2.225 . 2.844 2.235 2.224 2.243 . 0 0 "[ . 1 . 2]" 1
1697 1 80 ALA MB 1 81 ASP H 2.577 . 3.407 2.623 2.394 2.845 . 0 0 "[ . 1 . 2]" 1
1698 2 80 ALA MB 2 81 ASP H 2.577 . 3.407 2.623 2.399 2.845 . 0 0 "[ . 1 . 2]" 1
1699 1 80 ALA H 1 80 ALA MB 2.258 . 2.895 2.227 2.213 2.258 . 0 0 "[ . 1 . 2]" 1
1700 2 80 ALA H 2 80 ALA MB 2.258 . 2.895 2.227 2.212 2.258 . 0 0 "[ . 1 . 2]" 1
1701 1 49 VAL H 1 50 ALA MB 4.322 . 6.657 4.276 4.173 4.324 . 0 0 "[ . 1 . 2]" 1
1702 2 49 VAL H 2 50 ALA MB 4.322 . 6.657 4.277 4.175 4.324 . 0 0 "[ . 1 . 2]" 1
1703 1 47 LEU H 1 47 LEU HG 2.378 . 3.085 2.520 2.370 2.741 . 0 0 "[ . 1 . 2]" 1
1704 2 47 LEU H 2 47 LEU HG 2.378 . 3.085 2.520 2.369 2.738 . 0 0 "[ . 1 . 2]" 1
1705 1 44 ALA MB 1 45 ASP H 2.381 . 3.089 2.462 2.340 2.665 . 0 0 "[ . 1 . 2]" 1
1706 2 44 ALA MB 2 45 ASP H 2.381 . 3.089 2.461 2.346 2.661 . 0 0 "[ . 1 . 2]" 1
1707 1 44 ALA H 1 44 ALA MB 2.139 . 2.711 2.234 2.228 2.241 . 0 0 "[ . 1 . 2]" 1
1708 2 44 ALA H 2 44 ALA MB 2.139 . 2.711 2.234 2.227 2.240 . 0 0 "[ . 1 . 2]" 1
1709 1 42 ASP H 1 44 ALA MB 4.634 . 7.319 4.752 4.400 4.954 . 0 0 "[ . 1 . 2]" 1
1710 2 42 ASP H 2 44 ALA MB 4.634 . 7.319 4.752 4.404 4.953 . 0 0 "[ . 1 . 2]" 1
1711 1 75 LYS H 1 75 LYS HG2 3.294 . 4.650 2.642 1.842 3.732 0.096 15 0 "[ . 1 . 2]" 1
1712 2 75 LYS H 2 75 LYS HG2 3.294 . 4.650 2.642 1.840 3.732 0.098 15 0 "[ . 1 . 2]" 1
1713 1 86 ALA MB 1 87 SER H 3.304 . 4.669 3.132 1.951 3.718 . 0 0 "[ . 1 . 2]" 1
1714 2 86 ALA MB 2 87 SER H 3.304 . 4.669 3.131 1.951 3.719 . 0 0 "[ . 1 . 2]" 1
1715 1 36 LYS H 1 36 LYS HG2 2.148 . 2.725 2.001 1.915 2.139 . 0 0 "[ . 1 . 2]" 1
1716 2 36 LYS H 2 36 LYS HG2 2.148 . 2.725 2.001 1.913 2.141 . 0 0 "[ . 1 . 2]" 1
1717 1 86 ALA H 1 86 ALA MB 2.211 . 2.822 2.318 2.225 2.478 . 0 0 "[ . 1 . 2]" 1
1718 2 86 ALA H 2 86 ALA MB 2.211 . 2.822 2.320 2.229 2.484 . 0 0 "[ . 1 . 2]" 1
1719 1 35 GLU H 1 36 LYS HG2 4.109 . 6.219 4.142 3.938 4.355 . 0 0 "[ . 1 . 2]" 1
1720 2 35 GLU H 2 36 LYS HG2 4.109 . 6.219 4.143 3.937 4.355 . 0 0 "[ . 1 . 2]" 1
1721 1 69 LEU H 1 69 LEU HB3 3.328 . 4.713 3.589 3.574 3.611 . 0 0 "[ . 1 . 2]" 1
1722 2 69 LEU H 2 69 LEU HB3 3.328 . 4.713 3.589 3.572 3.611 . 0 0 "[ . 1 . 2]" 1
1723 1 69 LEU HB3 1 70 GLY H 3.873 . 5.748 3.955 3.559 4.275 . 0 0 "[ . 1 . 2]" 1
1724 2 69 LEU HB3 2 70 GLY H 3.873 . 5.748 3.955 3.562 4.279 . 0 0 "[ . 1 . 2]" 1
1725 1 25 LEU H 1 25 LEU HB2 2.171 . 2.760 2.364 2.285 2.470 . 0 0 "[ . 1 . 2]" 1
1726 2 25 LEU H 2 25 LEU HB2 2.171 . 2.760 2.366 2.289 2.472 . 0 0 "[ . 1 . 2]" 1
1727 1 83 LEU H 1 83 LEU HB3 3.935 . 5.871 3.508 3.459 3.547 . 0 0 "[ . 1 . 2]" 1
1728 2 83 LEU H 2 83 LEU HB3 3.935 . 5.871 3.508 3.460 3.547 . 0 0 "[ . 1 . 2]" 1
1729 1 79 LEU HB2 1 80 ALA H 2.825 . 3.822 3.826 3.682 4.006 0.184 8 0 "[ . 1 . 2]" 1
1730 2 79 LEU HB2 2 80 ALA H 2.825 . 3.822 3.826 3.676 4.003 0.181 8 0 "[ . 1 . 2]" 1
1731 1 79 LEU H 1 79 LEU HB2 3.118 . 4.334 2.454 2.399 2.520 . 0 0 "[ . 1 . 2]" 1
1732 2 79 LEU H 2 79 LEU HB2 3.118 . 4.334 2.454 2.399 2.520 . 0 0 "[ . 1 . 2]" 1
1733 1 17 ALA MB 1 21 GLU H 4.813 . 7.708 5.707 4.691 6.201 . 0 0 "[ . 1 . 2]" 1
1734 2 17 ALA MB 2 21 GLU H 4.813 . 7.708 5.707 4.691 6.201 . 0 0 "[ . 1 . 2]" 1
1735 1 75 LYS H 1 75 LYS HG3 2.912 . 3.972 3.106 1.833 4.453 0.481 7 0 "[ . 1 . 2]" 1
1736 2 75 LYS H 2 75 LYS HG3 2.912 . 3.972 3.106 1.833 4.457 0.485 7 0 "[ . 1 . 2]" 1
1737 1 17 ALA MB 1 18 SER H 3.473 . 4.981 3.606 3.122 3.719 . 0 0 "[ . 1 . 2]" 1
1738 2 17 ALA MB 2 18 SER H 3.473 . 4.981 3.605 3.120 3.716 . 0 0 "[ . 1 . 2]" 1
1739 1 17 ALA H 1 17 ALA MB 2.323 . 2.998 2.621 2.198 2.901 . 0 0 "[ . 1 . 2]" 1
1740 2 17 ALA H 2 17 ALA MB 2.323 . 2.998 2.621 2.200 2.901 . 0 0 "[ . 1 . 2]" 1
1741 1 51 MET H 1 54 ILE MD 3.636 . 5.288 4.087 3.866 4.627 . 0 0 "[ . 1 . 2]" 1
1742 2 51 MET H 2 54 ILE MD 3.636 . 5.288 4.087 3.864 4.626 . 0 0 "[ . 1 . 2]" 1
1743 1 24 ALA H 1 24 ALA MB 2.224 . 2.842 2.219 2.210 2.228 . 0 0 "[ . 1 . 2]" 1
1744 2 24 ALA H 2 24 ALA MB 2.224 . 2.842 2.219 2.210 2.229 . 0 0 "[ . 1 . 2]" 1
1745 1 24 ALA MB 1 25 LEU H 2.428 . 3.165 2.416 2.273 2.540 . 0 0 "[ . 1 . 2]" 1
1746 2 24 ALA MB 2 25 LEU H 2.428 . 3.165 2.413 2.274 2.540 . 0 0 "[ . 1 . 2]" 1
1747 1 24 ALA MB 1 69 LEU H 3.515 . 5.059 3.538 3.253 3.889 . 0 0 "[ . 1 . 2]" 1
1748 2 24 ALA MB 2 69 LEU H 3.515 . 5.059 3.538 3.250 3.891 . 0 0 "[ . 1 . 2]" 1
1749 1 79 LEU HB3 1 80 ALA H 4.360 . 6.736 2.516 2.293 2.805 . 0 0 "[ . 1 . 2]" 1
1750 2 79 LEU HB3 2 80 ALA H 4.360 . 6.736 2.515 2.286 2.804 . 0 0 "[ . 1 . 2]" 1
1751 1 23 ALA MB 1 24 ALA H 2.641 . 3.513 2.626 2.528 2.747 . 0 0 "[ . 1 . 2]" 1
1752 2 23 ALA MB 2 24 ALA H 2.641 . 3.513 2.626 2.528 2.743 . 0 0 "[ . 1 . 2]" 1
1753 1 23 ALA H 1 23 ALA MB 2.051 . 2.577 2.229 2.225 2.234 . 0 0 "[ . 1 . 2]" 1
1754 2 23 ALA H 2 23 ALA MB 2.051 . 2.577 2.229 2.224 2.236 . 0 0 "[ . 1 . 2]" 1
1755 1 57 ALA H 1 57 ALA MB 2.135 . 2.705 2.227 2.210 2.246 . 0 0 "[ . 1 . 2]" 1
1756 2 57 ALA H 2 57 ALA MB 2.135 . 2.705 2.227 2.209 2.247 . 0 0 "[ . 1 . 2]" 1
1757 1 57 ALA MB 1 58 PHE H 2.382 . 3.091 2.530 2.344 2.741 . 0 0 "[ . 1 . 2]" 1
1758 2 57 ALA MB 2 58 PHE H 2.382 . 3.091 2.529 2.344 2.743 . 0 0 "[ . 1 . 2]" 1
1759 1 57 ALA MB 1 59 GLY H 4.405 . 6.831 4.311 4.136 4.429 . 0 0 "[ . 1 . 2]" 1
1760 2 57 ALA MB 2 59 GLY H 4.405 . 6.831 4.311 4.137 4.434 . 0 0 "[ . 1 . 2]" 1
1761 1 25 LEU H 1 69 LEU MD2 2.677 . 3.572 3.142 2.753 3.577 0.005 2 0 "[ . 1 . 2]" 1
1762 2 25 LEU H 2 69 LEU MD2 2.677 . 3.572 3.140 2.753 3.577 0.005 2 0 "[ . 1 . 2]" 1
1763 1 28 ASN HD22 1 69 LEU MD1 3.188 . 4.458 3.456 2.956 4.004 . 0 0 "[ . 1 . 2]" 1
1764 2 28 ASN HD22 2 69 LEU MD1 3.188 . 4.458 3.455 2.961 3.996 . 0 0 "[ . 1 . 2]" 1
1765 1 28 ASN HD21 1 69 LEU MD1 3.247 . 4.565 2.929 1.942 3.950 . 0 0 "[ . 1 . 2]" 1
1766 2 28 ASN HD21 2 69 LEU MD1 3.247 . 4.565 2.929 1.944 3.948 . 0 0 "[ . 1 . 2]" 1
1767 1 22 ILE MD 1 23 ALA H 4.432 . 6.888 4.279 4.174 4.434 . 0 0 "[ . 1 . 2]" 1
1768 2 22 ILE MD 2 23 ALA H 4.432 . 6.888 4.279 4.170 4.436 . 0 0 "[ . 1 . 2]" 1
1769 1 22 ILE H 1 22 ILE MD 3.574 . 5.171 3.384 3.235 3.504 . 0 0 "[ . 1 . 2]" 1
1770 2 22 ILE H 2 22 ILE MD 3.574 . 5.171 3.385 3.237 3.507 . 0 0 "[ . 1 . 2]" 1
1771 1 82 ILE H 1 82 ILE MD 3.829 . 5.661 3.572 3.456 3.657 . 0 0 "[ . 1 . 2]" 1
1772 2 82 ILE H 2 82 ILE MD 3.829 . 5.661 3.572 3.454 3.656 . 0 0 "[ . 1 . 2]" 1
1773 1 78 HIS H 1 82 ILE MD 4.349 . 6.713 4.667 3.730 5.456 . 0 0 "[ . 1 . 2]" 1
1774 2 78 HIS H 2 82 ILE MD 4.349 . 6.713 4.667 3.728 5.458 . 0 0 "[ . 1 . 2]" 1
1775 1 47 LEU H 1 47 LEU MD1 3.582 . 5.185 3.738 3.659 3.912 . 0 0 "[ . 1 . 2]" 1
1776 2 47 LEU H 2 47 LEU MD1 3.582 . 5.185 3.739 3.659 3.911 . 0 0 "[ . 1 . 2]" 1
1777 1 33 ILE H 1 47 LEU MD1 3.789 . 5.583 4.630 4.250 5.062 . 0 0 "[ . 1 . 2]" 1
1778 2 33 ILE H 2 47 LEU MD1 3.789 . 5.583 4.631 4.246 5.063 . 0 0 "[ . 1 . 2]" 1
1779 1 83 LEU H 1 83 LEU MD1 2.448 . 3.197 2.268 2.145 2.368 . 0 0 "[ . 1 . 2]" 1
1780 2 83 LEU H 2 83 LEU MD1 2.448 . 3.197 2.269 2.149 2.371 . 0 0 "[ . 1 . 2]" 1
1781 1 39 ILE MD 1 47 LEU H 3.800 . 5.605 4.302 3.870 4.610 . 0 0 "[ . 1 . 2]" 1
1782 2 39 ILE MD 2 47 LEU H 3.800 . 5.605 4.302 3.869 4.610 . 0 0 "[ . 1 . 2]" 1
1783 1 39 ILE MD 1 40 SER H 4.152 . 6.307 3.774 3.576 3.942 . 0 0 "[ . 1 . 2]" 1
1784 2 39 ILE MD 2 40 SER H 4.152 . 6.307 3.775 3.576 3.943 . 0 0 "[ . 1 . 2]" 1
1785 1 39 ILE H 1 39 ILE MD 3.821 . 5.646 4.560 4.423 4.745 . 0 0 "[ . 1 . 2]" 1
1786 2 39 ILE H 2 39 ILE MD 3.821 . 5.646 4.559 4.422 4.746 . 0 0 "[ . 1 . 2]" 1
1787 1 39 ILE MD 1 44 ALA H 3.558 . 5.141 3.523 3.166 3.646 . 0 0 "[ . 1 . 2]" 1
1788 2 39 ILE MD 2 44 ALA H 3.558 . 5.141 3.521 3.161 3.647 . 0 0 "[ . 1 . 2]" 1
1789 1 68 ILE H 1 68 ILE MD 3.730 . 5.469 3.565 3.514 3.595 . 0 0 "[ . 1 . 2]" 1
1790 2 68 ILE H 2 68 ILE MD 3.730 . 5.469 3.565 3.515 3.595 . 0 0 "[ . 1 . 2]" 1
1791 1 47 LEU MD2 1 48 ASN H 4.571 . 7.183 4.702 4.665 4.739 . 0 0 "[ . 1 . 2]" 1
1792 2 47 LEU MD2 2 48 ASN H 4.571 . 7.183 4.702 4.666 4.740 . 0 0 "[ . 1 . 2]" 1
1793 1 47 LEU H 1 47 LEU MD2 3.591 . 5.202 3.453 3.331 3.559 . 0 0 "[ . 1 . 2]" 1
1794 2 47 LEU H 2 47 LEU MD2 3.591 . 5.202 3.453 3.328 3.564 . 0 0 "[ . 1 . 2]" 1
1795 1 79 LEU MD2 1 80 ALA H 4.431 . 6.885 4.167 3.949 4.460 . 0 0 "[ . 1 . 2]" 1
1796 2 79 LEU MD2 2 80 ALA H 4.431 . 6.885 4.166 3.943 4.461 . 0 0 "[ . 1 . 2]" 1
1797 1 25 LEU H 1 25 LEU MD1 3.530 . 5.088 3.677 3.531 3.842 . 0 0 "[ . 1 . 2]" 1
1798 2 25 LEU H 2 25 LEU MD1 3.530 . 5.088 3.676 3.532 3.845 . 0 0 "[ . 1 . 2]" 1
1799 1 61 GLU H 1 62 ARG H 4.738 . 7.544 4.528 4.462 4.598 . 0 0 "[ . 1 . 2]" 1
1800 2 61 GLU H 2 62 ARG H 4.738 . 7.544 4.528 4.455 4.594 . 0 0 "[ . 1 . 2]" 1
1801 1 74 PHE HB2 1 75 LYS H 3.617 . 5.252 3.735 2.118 4.448 . 0 0 "[ . 1 . 2]" 1
1802 2 74 PHE HB2 2 75 LYS H 3.617 . 5.252 3.735 2.120 4.446 . 0 0 "[ . 1 . 2]" 1
1803 1 74 PHE HB3 1 75 LYS H 4.467 . 6.962 4.218 2.827 4.514 . 0 0 "[ . 1 . 2]" 1
1804 2 74 PHE HB3 2 75 LYS H 4.467 . 6.962 4.218 2.821 4.512 . 0 0 "[ . 1 . 2]" 1
1805 1 56 GLU H 1 58 PHE H 4.617 . 7.281 4.331 4.205 4.535 . 0 0 "[ . 1 . 2]" 1
1806 2 56 GLU H 2 58 PHE H 4.617 . 7.281 4.332 4.204 4.532 . 0 0 "[ . 1 . 2]" 1
1807 1 17 ALA MB 1 22 ILE H 4.172 . 6.347 4.482 3.459 5.116 . 0 0 "[ . 1 . 2]" 1
1808 2 17 ALA MB 2 22 ILE H 4.172 . 6.347 4.481 3.459 5.116 . 0 0 "[ . 1 . 2]" 1
1809 1 29 TYR QE 1 80 ALA H 4.474 . 6.976 4.383 3.727 5.043 . 0 0 "[ . 1 . 2]" 1
1810 2 29 TYR QE 2 80 ALA H 4.474 . 6.976 4.383 3.728 5.042 . 0 0 "[ . 1 . 2]" 1
1811 1 74 PHE H 1 74 PHE HA 2.735 . 3.670 2.814 2.256 2.945 . 0 0 "[ . 1 . 2]" 1
1812 2 74 PHE H 2 74 PHE HA 2.735 . 3.670 2.815 2.259 2.944 . 0 0 "[ . 1 . 2]" 1
1813 1 74 PHE H 1 74 PHE QE 4.579 . 7.199 4.651 4.188 5.119 . 0 0 "[ . 1 . 2]" 1
1814 2 74 PHE H 2 74 PHE QE 4.579 . 7.199 4.651 4.182 5.116 . 0 0 "[ . 1 . 2]" 1
1815 1 46 SER H 1 47 LEU HB2 4.657 . 7.368 4.747 4.624 4.843 . 0 0 "[ . 1 . 2]" 1
1816 2 46 SER H 2 47 LEU HB2 4.657 . 7.368 4.746 4.623 4.841 . 0 0 "[ . 1 . 2]" 1
1817 1 65 VAL HA 1 66 SER H 3.637 . 5.291 3.521 3.478 3.563 . 0 0 "[ . 1 . 2]" 1
1818 2 65 VAL HA 2 66 SER H 3.637 . 5.291 3.520 3.473 3.563 . 0 0 "[ . 1 . 2]" 1
1819 1 48 ASN HD21 1 51 MET ME 4.142 . 6.286 3.875 3.715 4.178 . 0 0 "[ . 1 . 2]" 1
1820 2 48 ASN HD21 2 51 MET ME 4.142 . 6.286 3.876 3.713 4.179 . 0 0 "[ . 1 . 2]" 1
1821 1 77 GLN HA 1 77 GLN HE21 3.898 . 5.797 3.840 2.353 5.166 . 0 0 "[ . 1 . 2]" 1
1822 2 77 GLN HA 2 77 GLN HE21 3.898 . 5.797 3.839 2.347 5.167 . 0 0 "[ . 1 . 2]" 1
1823 1 77 GLN HA 1 77 GLN HE22 3.751 . 5.510 4.423 3.174 5.925 0.415 8 0 "[ . 1 . 2]" 1
1824 2 77 GLN HA 2 77 GLN HE22 3.751 . 5.510 4.421 3.171 5.929 0.419 8 0 "[ . 1 . 2]" 1
1825 1 79 LEU MD1 1 80 ALA H 4.458 . 6.943 4.495 4.329 4.645 . 0 0 "[ . 1 . 2]" 1
1826 2 79 LEU MD1 2 80 ALA H 4.458 . 6.943 4.495 4.330 4.646 . 0 0 "[ . 1 . 2]" 1
1827 1 40 SER HB3 1 44 ALA H 4.671 . 7.399 5.221 4.513 5.752 . 0 0 "[ . 1 . 2]" 1
1828 2 40 SER HB3 2 44 ALA H 4.671 . 7.399 5.221 4.512 5.750 . 0 0 "[ . 1 . 2]" 1
1829 1 79 LEU HA 1 82 ILE HB 2.769 . 3.727 2.556 2.340 2.801 . 0 0 "[ . 1 . 2]" 1
1830 2 79 LEU HA 2 82 ILE HB 2.769 . 3.727 2.556 2.340 2.800 . 0 0 "[ . 1 . 2]" 1
1831 1 38 GLU HA 1 38 GLU QG 3.089 . 4.282 2.648 2.313 3.143 . 0 0 "[ . 1 . 2]" 1
1832 2 38 GLU HA 2 38 GLU QG 3.089 . 4.282 2.648 2.312 3.145 . 0 0 "[ . 1 . 2]" 1
1833 1 35 GLU HA 1 35 GLU HG2 2.932 . 4.006 2.513 2.300 2.962 . 0 0 "[ . 1 . 2]" 1
1834 2 35 GLU HA 2 35 GLU HG2 2.932 . 4.006 2.514 2.302 2.962 . 0 0 "[ . 1 . 2]" 1
1835 1 41 GLU QB 1 41 GLU QG 2.368 . 3.069 2.046 1.979 2.088 . 0 0 "[ . 1 . 2]" 1
1836 2 41 GLU QB 2 41 GLU QG 2.368 . 3.069 2.046 1.979 2.086 . 0 0 "[ . 1 . 2]" 1
1837 1 61 GLU HA 1 61 GLU QG 2.708 . 3.625 2.607 2.399 3.027 . 0 0 "[ . 1 . 2]" 1
1838 2 61 GLU HA 2 61 GLU QG 2.708 . 3.625 2.608 2.403 3.024 . 0 0 "[ . 1 . 2]" 1
1839 1 63 GLU QB 1 63 GLU HG3 2.483 . 3.254 2.314 2.158 2.456 . 0 0 "[ . 1 . 2]" 1
1840 2 63 GLU QB 2 63 GLU HG3 2.483 . 3.254 2.314 2.159 2.453 . 0 0 "[ . 1 . 2]" 1
1841 1 15 MET HB2 1 18 SER HB3 3.536 . 5.099 4.844 3.341 5.740 0.641 15 3 "[ - . 1 + * 2]" 1
1842 2 15 MET HB2 2 18 SER HB3 3.536 . 5.099 4.844 3.338 5.741 0.642 15 3 "[ - . 1 + * 2]" 1
1843 1 15 MET QB 1 15 MET HG2 2.652 . 3.531 2.350 2.312 2.408 . 0 0 "[ . 1 . 2]" 1
1844 2 15 MET QB 2 15 MET HG2 2.652 . 3.531 2.350 2.313 2.408 . 0 0 "[ . 1 . 2]" 1
1845 1 31 SER QB 1 34 VAL HB 3.328 . 4.712 4.562 4.379 4.714 0.002 4 0 "[ . 1 . 2]" 1
1846 2 31 SER QB 2 34 VAL HB 3.328 . 4.712 4.562 4.379 4.716 0.004 4 0 "[ . 1 . 2]" 1
1847 1 25 LEU HB2 1 77 GLN QB 4.379 . 6.775 5.847 4.956 6.590 . 0 0 "[ . 1 . 2]" 1
1848 2 25 LEU HB2 2 77 GLN QB 4.379 . 6.775 5.847 4.957 6.592 . 0 0 "[ . 1 . 2]" 1
1849 1 19 LYS HB3 1 20 GLU HA 3.777 . 5.560 3.585 2.890 3.958 . 0 0 "[ . 1 . 2]" 1
1850 2 19 LYS HB3 2 20 GLU HA 3.777 . 5.560 3.585 2.888 3.957 . 0 0 "[ . 1 . 2]" 1
1851 1 88 ARG HB3 1 88 ARG QG 2.516 . 3.307 2.363 2.293 2.465 . 0 0 "[ . 1 . 2]" 1
1852 2 88 ARG HB3 2 88 ARG QG 2.516 . 3.307 2.363 2.292 2.464 . 0 0 "[ . 1 . 2]" 1
1853 1 88 ARG HB2 1 88 ARG QG 2.158 . 2.740 2.272 2.159 2.394 . 0 0 "[ . 1 . 2]" 1
1854 2 88 ARG HB2 2 88 ARG QG 2.158 . 2.740 2.272 2.159 2.394 . 0 0 "[ . 1 . 2]" 1
1855 1 35 GLU HB3 1 35 GLU HG3 2.275 . 2.922 1.988 1.915 2.062 . 0 0 "[ . 1 . 2]" 1
1856 2 35 GLU HB3 2 35 GLU HG3 2.275 . 2.922 1.988 1.915 2.060 . 0 0 "[ . 1 . 2]" 1
1857 1 19 LYS QD 1 19 LYS HG3 2.432 . 3.171 2.265 2.125 2.332 . 0 0 "[ . 1 . 2]" 1
1858 2 19 LYS QD 2 19 LYS HG3 2.432 . 3.171 2.265 2.123 2.331 . 0 0 "[ . 1 . 2]" 1
1859 1 35 GLU HB2 1 35 GLU HG2 2.567 . 3.391 2.357 2.164 2.680 . 0 0 "[ . 1 . 2]" 1
1860 2 35 GLU HB2 2 35 GLU HG2 2.567 . 3.391 2.357 2.163 2.681 . 0 0 "[ . 1 . 2]" 1
1861 1 19 LYS QD 1 58 PHE QE 4.386 . 6.790 3.589 2.616 4.290 . 0 0 "[ . 1 . 2]" 1
1862 2 19 LYS QD 2 58 PHE QE 4.386 . 6.790 3.589 2.617 4.288 . 0 0 "[ . 1 . 2]" 1
1863 1 21 GLU HB2 1 58 PHE QE 4.348 . 6.712 6.783 6.747 6.824 0.112 10 0 "[ . 1 . 2]" 1
1864 2 21 GLU HB2 2 58 PHE QE 4.348 . 6.712 6.783 6.746 6.825 0.113 10 0 "[ . 1 . 2]" 1
1865 1 37 LYS HD2 1 37 LYS QG 2.535 . 3.338 2.315 2.166 2.459 . 0 0 "[ . 1 . 2]" 1
1866 2 37 LYS HD2 2 37 LYS QG 2.535 . 3.338 2.315 2.169 2.458 . 0 0 "[ . 1 . 2]" 1
1867 1 32 SER HA 1 36 LYS HD3 4.614 . 7.275 5.232 4.496 5.817 . 0 0 "[ . 1 . 2]" 1
1868 2 32 SER HA 2 36 LYS HD3 4.614 . 7.275 5.232 4.494 5.820 . 0 0 "[ . 1 . 2]" 1
1869 1 71 LYS HB3 1 71 LYS QD 2.274 . 2.920 2.100 1.987 2.279 . 0 0 "[ . 1 . 2]" 1
1870 2 71 LYS HB3 2 71 LYS QD 2.274 . 2.920 2.100 1.986 2.274 . 0 0 "[ . 1 . 2]" 1
1871 1 62 ARG QB 1 62 ARG HG2 2.592 . 3.432 2.349 2.292 2.454 . 0 0 "[ . 1 . 2]" 1
1872 2 62 ARG QB 2 62 ARG HG2 2.592 . 3.432 2.349 2.293 2.453 . 0 0 "[ . 1 . 2]" 1
1873 1 62 ARG QD 1 62 ARG HG3 2.638 . 3.508 2.294 2.170 2.443 . 0 0 "[ . 1 . 2]" 1
1874 2 62 ARG QD 2 62 ARG HG3 2.638 . 3.508 2.294 2.169 2.442 . 0 0 "[ . 1 . 2]" 1
1875 1 88 ARG QD 1 88 ARG QG 2.764 . 3.719 2.030 1.993 2.090 . 0 0 "[ . 1 . 2]" 1
1876 2 88 ARG QD 2 88 ARG QG 2.764 . 3.719 2.030 1.994 2.090 . 0 0 "[ . 1 . 2]" 1
1877 1 69 LEU QD 1 69 LEU HG 1.952 . 2.428 1.893 1.891 1.895 . 0 0 "[ . 1 . 2]" 1
1878 2 69 LEU QD 2 69 LEU HG 1.952 . 2.428 1.894 1.892 1.895 . 0 0 "[ . 1 . 2]" 1
1879 1 82 ILE HB 1 83 LEU MD1 1.988 . 2.482 2.051 1.956 2.070 . 0 0 "[ . 1 . 2]" 1
1880 2 82 ILE HB 2 83 LEU MD1 1.988 . 2.482 2.051 1.955 2.070 . 0 0 "[ . 1 . 2]" 1
1881 1 36 LYS QE 1 36 LYS HG3 3.394 . 4.834 2.809 2.328 3.518 . 0 0 "[ . 1 . 2]" 1
1882 2 36 LYS QE 2 36 LYS HG3 3.394 . 4.834 2.809 2.328 3.516 . 0 0 "[ . 1 . 2]" 1
1883 1 83 LEU QD 1 83 LEU HG 1.822 . 2.237 1.893 1.890 1.895 . 0 0 "[ . 1 . 2]" 1
1884 2 83 LEU QD 2 83 LEU HG 1.822 . 2.237 1.893 1.890 1.895 . 0 0 "[ . 1 . 2]" 1
1885 1 19 LYS QE 1 19 LYS HG2 3.196 . 4.473 2.850 2.352 3.511 . 0 0 "[ . 1 . 2]" 1
1886 2 19 LYS QE 2 19 LYS HG2 3.196 . 4.473 2.851 2.352 3.512 . 0 0 "[ . 1 . 2]" 1
1887 1 36 LYS QE 1 36 LYS HG2 3.496 . 5.023 2.799 2.296 3.489 . 0 0 "[ . 1 . 2]" 1
1888 2 36 LYS QE 2 36 LYS HG2 3.496 . 5.023 2.799 2.296 3.488 . 0 0 "[ . 1 . 2]" 1
1889 1 29 TYR QR 1 79 LEU MD2 3.836 . 5.676 3.127 2.825 3.359 . 0 0 "[ . 1 . 2]" 1
1890 2 29 TYR QR 2 79 LEU MD2 3.836 . 5.676 3.127 2.825 3.360 . 0 0 "[ . 1 . 2]" 1
1891 1 25 LEU MD1 1 79 LEU HA 3.160 . 4.408 2.828 2.349 3.185 . 0 0 "[ . 1 . 2]" 1
1892 2 25 LEU MD1 2 79 LEU HA 3.160 . 4.408 2.828 2.350 3.187 . 0 0 "[ . 1 . 2]" 1
1893 1 25 LEU MD1 1 25 LEU MD2 1.700 . 2.061 1.855 1.852 1.859 . 0 0 "[ . 1 . 2]" 1
1894 2 25 LEU MD1 2 25 LEU MD2 1.700 . 2.061 1.855 1.853 1.859 . 0 0 "[ . 1 . 2]" 1
1895 1 25 LEU HA 1 25 LEU MD1 3.346 . 4.745 3.667 3.560 3.732 . 0 0 "[ . 1 . 2]" 1
1896 2 25 LEU HA 2 25 LEU MD1 3.346 . 4.745 3.667 3.560 3.731 . 0 0 "[ . 1 . 2]" 1
1897 1 37 LYS QE 1 37 LYS HG2 3.041 . 4.197 2.583 2.178 2.884 . 0 0 "[ . 1 . 2]" 1
1898 2 37 LYS QE 2 37 LYS HG2 3.041 . 4.197 2.583 2.176 2.886 . 0 0 "[ . 1 . 2]" 1
1899 1 37 LYS HA 1 37 LYS QG 2.572 . 3.399 2.523 2.306 3.360 . 0 0 "[ . 1 . 2]" 1
1900 2 37 LYS HA 2 37 LYS QG 2.572 . 3.399 2.524 2.307 3.360 . 0 0 "[ . 1 . 2]" 1
1901 1 33 ILE HB 1 47 LEU MD1 2.523 . 3.319 2.822 2.463 3.130 . 0 0 "[ . 1 . 2]" 1
1902 2 33 ILE HB 2 47 LEU MD1 2.523 . 3.319 2.822 2.464 3.131 . 0 0 "[ . 1 . 2]" 1
1903 1 25 LEU HB3 1 25 LEU MD2 2.397 . 3.115 2.092 2.067 2.127 . 0 0 "[ . 1 . 2]" 1
1904 2 25 LEU HB3 2 25 LEU MD2 2.397 . 3.115 2.092 2.066 2.127 . 0 0 "[ . 1 . 2]" 1
1905 1 71 LYS QE 1 71 LYS HG2 2.890 . 3.934 2.447 2.124 3.021 . 0 0 "[ . 1 . 2]" 1
1906 2 71 LYS QE 2 71 LYS HG2 2.890 . 3.934 2.447 2.122 3.022 . 0 0 "[ . 1 . 2]" 1
1907 1 25 LEU MD2 1 28 ASN QB 3.565 . 5.154 3.148 2.769 3.593 . 0 0 "[ . 1 . 2]" 1
1908 2 25 LEU MD2 2 28 ASN QB 3.565 . 5.154 3.148 2.770 3.593 . 0 0 "[ . 1 . 2]" 1
1909 1 30 PHE HA 1 47 LEU MD2 3.839 . 5.681 3.858 3.547 4.462 . 0 0 "[ . 1 . 2]" 1
1910 2 30 PHE HA 2 47 LEU MD2 3.839 . 5.681 3.858 3.546 4.462 . 0 0 "[ . 1 . 2]" 1
1911 1 44 ALA MB 1 45 ASP HA 3.543 . 5.112 3.440 3.374 3.478 . 0 0 "[ . 1 . 2]" 1
1912 2 44 ALA MB 2 45 ASP HA 3.543 . 5.112 3.440 3.375 3.477 . 0 0 "[ . 1 . 2]" 1
1913 1 33 ILE HB 1 44 ALA MB 3.602 . 5.224 3.961 3.467 4.186 . 0 0 "[ . 1 . 2]" 1
1914 2 33 ILE HB 2 44 ALA MB 3.602 . 5.224 3.961 3.465 4.184 . 0 0 "[ . 1 . 2]" 1
1915 1 31 SER QB 1 50 ALA MB 4.420 . 6.862 5.465 4.891 5.743 . 0 0 "[ . 1 . 2]" 1
1916 2 31 SER QB 2 50 ALA MB 4.420 . 6.862 5.465 4.891 5.744 . 0 0 "[ . 1 . 2]" 1
1917 1 47 LEU HA 1 50 ALA MB 1.812 . 2.222 1.934 1.850 1.977 . 0 0 "[ . 1 . 2]" 1
1918 2 47 LEU HA 2 50 ALA MB 1.812 . 2.222 1.934 1.850 1.977 . 0 0 "[ . 1 . 2]" 1
1919 1 26 ILE HA 1 80 ALA MB 4.044 . 6.088 5.531 5.245 5.723 . 0 0 "[ . 1 . 2]" 1
1920 2 26 ILE HA 2 80 ALA MB 4.044 . 6.088 5.531 5.246 5.722 . 0 0 "[ . 1 . 2]" 1
1921 1 50 ALA MB 1 53 CYS HB2 3.133 . 4.360 3.472 3.083 4.328 . 0 0 "[ . 1 . 2]" 1
1922 2 50 ALA MB 2 53 CYS HB2 3.133 . 4.360 3.472 3.083 4.329 . 0 0 "[ . 1 . 2]" 1
1923 1 50 ALA MB 1 53 CYS HB3 3.203 . 4.485 3.803 3.187 4.137 . 0 0 "[ . 1 . 2]" 1
1924 2 50 ALA MB 2 53 CYS HB3 3.203 . 4.485 3.802 3.187 4.136 . 0 0 "[ . 1 . 2]" 1
1925 1 47 LEU MD1 1 50 ALA MB 3.538 . 5.103 4.491 4.312 4.584 . 0 0 "[ . 1 . 2]" 1
1926 2 47 LEU MD1 2 50 ALA MB 3.538 . 5.103 4.491 4.312 4.585 . 0 0 "[ . 1 . 2]" 1
1927 1 44 ALA HA 1 44 ALA MB 1.819 . 2.233 1.892 1.890 1.894 . 0 0 "[ . 1 . 2]" 1
1928 2 44 ALA HA 2 44 ALA MB 1.819 . 2.233 1.892 1.890 1.893 . 0 0 "[ . 1 . 2]" 1
1929 1 24 ALA MB 1 60 PHE QR 4.128 . 6.258 3.975 3.634 4.283 . 0 0 "[ . 1 . 2]" 1
1930 2 24 ALA MB 2 60 PHE QR 4.128 . 6.258 3.975 3.634 4.284 . 0 0 "[ . 1 . 2]" 1
1931 1 20 GLU HG3 1 24 ALA MB 3.756 . 5.519 4.648 4.273 5.125 . 0 0 "[ . 1 . 2]" 1
1932 2 20 GLU HG3 2 24 ALA MB 3.756 . 5.519 4.648 4.273 5.127 . 0 0 "[ . 1 . 2]" 1
1933 1 21 GLU HB2 1 24 ALA MB 4.072 . 6.144 4.116 3.963 4.228 . 0 0 "[ . 1 . 2]" 1
1934 2 21 GLU HB2 2 24 ALA MB 4.072 . 6.144 4.116 3.963 4.227 . 0 0 "[ . 1 . 2]" 1
1935 1 24 ALA MB 1 25 LEU HB2 3.805 . 5.615 3.985 3.906 4.057 . 0 0 "[ . 1 . 2]" 1
1936 2 24 ALA MB 2 25 LEU HB2 3.805 . 5.615 3.986 3.906 4.057 . 0 0 "[ . 1 . 2]" 1
1937 1 77 GLN QB 1 82 ILE MD 2.938 . 4.017 3.103 2.212 4.192 0.175 9 0 "[ . 1 . 2]" 1
1938 2 77 GLN QB 2 82 ILE MD 2.938 . 4.017 3.103 2.211 4.192 0.175 9 0 "[ . 1 . 2]" 1
1939 1 16 SER QB 1 22 ILE MD 3.698 . 5.408 5.420 5.256 5.531 0.123 19 0 "[ . 1 . 2]" 1
1940 2 16 SER QB 2 22 ILE MD 3.698 . 5.408 5.419 5.256 5.533 0.125 19 0 "[ . 1 . 2]" 1
1941 1 33 ILE MD 1 34 VAL HB 4.243 . 6.494 4.595 3.782 5.413 . 0 0 "[ . 1 . 2]" 1
1942 2 33 ILE MD 2 34 VAL HB 4.243 . 6.494 4.595 3.786 5.413 . 0 0 "[ . 1 . 2]" 1
1943 1 25 LEU HB2 1 25 LEU MD2 3.066 . 4.241 2.456 2.271 2.604 . 0 0 "[ . 1 . 2]" 1
1944 2 25 LEU HB2 2 25 LEU MD2 3.066 . 4.241 2.455 2.268 2.602 . 0 0 "[ . 1 . 2]" 1
1945 1 47 LEU HA 1 47 LEU HB2 3.233 . 4.540 2.668 2.660 2.677 . 0 0 "[ . 1 . 2]" 1
1946 2 47 LEU HA 2 47 LEU HB2 3.233 . 4.540 2.668 2.660 2.677 . 0 0 "[ . 1 . 2]" 1
1947 1 69 LEU HB3 1 69 LEU QD 2.571 . 3.397 2.116 2.104 2.131 . 0 0 "[ . 1 . 2]" 1
1948 2 69 LEU HB3 2 69 LEU QD 2.571 . 3.397 2.116 2.104 2.129 . 0 0 "[ . 1 . 2]" 1
1949 1 25 LEU HA 1 25 LEU HB2 3.065 . 4.239 2.482 2.444 2.509 . 0 0 "[ . 1 . 2]" 1
1950 2 25 LEU HA 2 25 LEU HB2 3.065 . 4.239 2.482 2.445 2.508 . 0 0 "[ . 1 . 2]" 1
1951 1 83 LEU HB2 1 83 LEU QD 2.445 . 3.192 2.120 2.110 2.127 . 0 0 "[ . 1 . 2]" 1
1952 2 83 LEU HB2 2 83 LEU QD 2.445 . 3.192 2.120 2.112 2.126 . 0 0 "[ . 1 . 2]" 1
1953 1 44 ALA HA 1 47 LEU HB2 2.834 . 3.838 2.311 2.179 2.515 . 0 0 "[ . 1 . 2]" 1
1954 2 44 ALA HA 2 47 LEU HB2 2.834 . 3.838 2.311 2.179 2.518 . 0 0 "[ . 1 . 2]" 1
1955 1 47 LEU HB3 1 47 LEU HG 3.342 . 4.738 2.933 2.903 2.949 . 0 0 "[ . 1 . 2]" 1
1956 2 47 LEU HB3 2 47 LEU HG 3.342 . 4.738 2.932 2.902 2.950 . 0 0 "[ . 1 . 2]" 1
1957 1 50 ALA HA 1 53 CYS HA 4.075 . 6.151 4.846 4.596 5.029 . 0 0 "[ . 1 . 2]" 1
1958 2 50 ALA HA 2 53 CYS HA 4.075 . 6.151 4.846 4.596 5.030 . 0 0 "[ . 1 . 2]" 1
1959 1 20 GLU HA 1 60 PHE QD 4.203 . 6.411 3.078 2.678 3.336 . 0 0 "[ . 1 . 2]" 1
1960 2 20 GLU HA 2 60 PHE QD 4.203 . 6.411 3.078 2.676 3.336 . 0 0 "[ . 1 . 2]" 1
1961 1 20 GLU HB2 1 60 PHE QD 4.524 . 7.083 3.873 3.091 4.306 . 0 0 "[ . 1 . 2]" 1
1962 2 20 GLU HB2 2 60 PHE QD 4.524 . 7.083 3.873 3.089 4.304 . 0 0 "[ . 1 . 2]" 1
1963 1 19 LYS HB3 1 58 PHE QD 4.432 . 6.887 2.435 1.963 3.883 0.014 16 0 "[ . 1 . 2]" 1
1964 2 19 LYS HB3 2 58 PHE QD 4.432 . 6.887 2.436 1.967 3.881 0.010 16 0 "[ . 1 . 2]" 1
1965 1 28 ASN HA 1 31 SER HA 4.538 . 7.112 4.987 4.778 5.180 . 0 0 "[ . 1 . 2]" 1
1966 2 28 ASN HA 2 31 SER HA 4.538 . 7.112 4.988 4.778 5.181 . 0 0 "[ . 1 . 2]" 1
1967 1 31 SER HA 1 33 ILE HB 3.742 . 5.492 3.423 2.907 3.931 . 0 0 "[ . 1 . 2]" 1
1968 2 31 SER HA 2 33 ILE HB 3.742 . 5.492 3.424 2.907 3.933 . 0 0 "[ . 1 . 2]" 1
1969 1 29 TYR HA 1 32 SER HB3 2.450 . 3.200 2.267 2.132 2.361 . 0 0 "[ . 1 . 2]" 1
1970 2 29 TYR HA 2 32 SER HB3 2.450 . 3.200 2.267 2.131 2.362 . 0 0 "[ . 1 . 2]" 1
1971 1 32 SER HA 1 35 GLU QB 2.734 . 3.669 2.281 1.844 2.706 . 0 0 "[ . 1 . 2]" 1
1972 2 32 SER HA 2 35 GLU QB 2.734 . 3.669 2.281 1.843 2.701 . 0 0 "[ . 1 . 2]" 1
1973 1 55 SER HB3 1 60 PHE QE 4.249 . 6.506 3.703 2.922 4.124 . 0 0 "[ . 1 . 2]" 1
1974 2 55 SER HB3 2 60 PHE QE 4.249 . 6.506 3.702 2.921 4.124 . 0 0 "[ . 1 . 2]" 1
1975 1 20 GLU HG3 1 60 PHE QE 4.407 . 6.835 4.457 4.197 4.807 . 0 0 "[ . 1 . 2]" 1
1976 2 20 GLU HG3 2 60 PHE QE 4.407 . 6.835 4.457 4.197 4.807 . 0 0 "[ . 1 . 2]" 1
1977 1 29 TYR QR 1 30 PHE QE 4.888 . 7.874 2.839 2.531 3.395 . 0 0 "[ . 1 . 2]" 1
1978 2 29 TYR QR 2 30 PHE QE 4.888 . 7.874 2.838 2.530 3.393 . 0 0 "[ . 1 . 2]" 1
1979 1 27 VAL HA 1 30 PHE QD 3.833 . 5.669 2.160 1.942 2.463 0.055 12 0 "[ . 1 . 2]" 1
1980 2 27 VAL HA 2 30 PHE QD 3.833 . 5.669 2.160 1.941 2.463 0.056 12 0 "[ . 1 . 2]" 1
1981 1 19 LYS HB2 1 58 PHE QE 3.771 . 5.548 2.404 1.805 2.837 0.189 17 0 "[ . 1 . 2]" 1
1982 2 19 LYS HB2 2 58 PHE QE 3.771 . 5.548 2.404 1.806 2.838 0.188 17 0 "[ . 1 . 2]" 1
1983 1 19 LYS HG3 1 58 PHE QE 4.343 . 6.701 3.669 3.427 3.869 . 0 0 "[ . 1 . 2]" 1
1984 2 19 LYS HG3 2 58 PHE QE 4.343 . 6.701 3.669 3.428 3.869 . 0 0 "[ . 1 . 2]" 1
1985 1 85 SER HA 1 85 SER QB 2.492 . 3.269 2.320 2.161 2.392 . 0 0 "[ . 1 . 2]" 1
1986 2 85 SER HA 2 85 SER QB 2.492 . 3.269 2.321 2.164 2.391 . 0 0 "[ . 1 . 2]" 1
1987 1 19 LYS HA 1 58 PHE QE 3.988 . 5.976 2.803 2.551 3.209 . 0 0 "[ . 1 . 2]" 1
1988 2 19 LYS HA 2 58 PHE QE 3.988 . 5.976 2.803 2.554 3.209 . 0 0 "[ . 1 . 2]" 1
1989 1 19 LYS HA 1 19 LYS HE2 4.526 . 7.087 3.958 3.729 4.185 . 0 0 "[ . 1 . 2]" 1
1990 2 19 LYS HA 2 19 LYS HE2 4.526 . 7.087 3.958 3.730 4.187 . 0 0 "[ . 1 . 2]" 1
1991 1 62 ARG HA 1 62 ARG QB 2.616 . 3.471 2.351 2.189 2.437 . 0 0 "[ . 1 . 2]" 1
1992 2 62 ARG HA 2 62 ARG QB 2.616 . 3.471 2.351 2.188 2.438 . 0 0 "[ . 1 . 2]" 1
1993 1 19 LYS HA 1 19 LYS HB3 2.693 . 3.599 2.307 2.179 2.442 . 0 0 "[ . 1 . 2]" 1
1994 2 19 LYS HA 2 19 LYS HB3 2.693 . 3.599 2.307 2.181 2.442 . 0 0 "[ . 1 . 2]" 1
1995 1 19 LYS HA 1 19 LYS HG3 2.723 . 3.650 2.496 2.312 2.876 . 0 0 "[ . 1 . 2]" 1
1996 2 19 LYS HA 2 19 LYS HG3 2.723 . 3.650 2.496 2.310 2.875 . 0 0 "[ . 1 . 2]" 1
1997 1 63 GLU HA 1 63 GLU QB 2.561 . 3.381 2.344 2.175 2.478 . 0 0 "[ . 1 . 2]" 1
1998 2 63 GLU HA 2 63 GLU QB 2.561 . 3.381 2.344 2.177 2.477 . 0 0 "[ . 1 . 2]" 1
1999 1 81 ASP HA 1 81 ASP QB 2.565 . 3.388 2.181 2.073 2.313 . 0 0 "[ . 1 . 2]" 1
2000 2 81 ASP HA 2 81 ASP QB 2.565 . 3.388 2.181 2.074 2.314 . 0 0 "[ . 1 . 2]" 1
2001 1 23 ALA HA 1 60 PHE HZ 3.111 . 4.320 2.996 2.753 3.311 . 0 0 "[ . 1 . 2]" 1
2002 2 23 ALA HA 2 60 PHE HZ 3.111 . 4.320 2.996 2.752 3.311 . 0 0 "[ . 1 . 2]" 1
2003 1 38 GLU HA 1 38 GLU HB2 2.486 . 3.259 2.430 2.181 2.633 . 0 0 "[ . 1 . 2]" 1
2004 2 38 GLU HA 2 38 GLU HB2 2.486 . 3.259 2.430 2.180 2.635 . 0 0 "[ . 1 . 2]" 1
2005 1 36 LYS HA 1 36 LYS HD3 2.873 . 3.905 3.650 3.593 3.771 . 0 0 "[ . 1 . 2]" 1
2006 2 36 LYS HA 2 36 LYS HD3 2.873 . 3.905 3.650 3.593 3.773 . 0 0 "[ . 1 . 2]" 1
2007 1 37 LYS QG 1 38 GLU HA 3.303 . 4.667 4.495 4.106 4.679 0.012 10 0 "[ . 1 . 2]" 1
2008 2 37 LYS QG 2 38 GLU HA 3.303 . 4.667 4.495 4.109 4.679 0.012 10 0 "[ . 1 . 2]" 1
2009 1 88 ARG HA 1 88 ARG QG 3.178 . 4.440 2.720 2.230 3.352 . 0 0 "[ . 1 . 2]" 1
2010 2 88 ARG HA 2 88 ARG QG 3.178 . 4.440 2.719 2.226 3.352 . 0 0 "[ . 1 . 2]" 1
2011 1 84 ASN HA 1 84 ASN QB 2.612 . 3.465 2.377 2.336 2.479 . 0 0 "[ . 1 . 2]" 1
2012 2 84 ASN HA 2 84 ASN QB 2.612 . 3.465 2.377 2.337 2.477 . 0 0 "[ . 1 . 2]" 1
2013 1 29 TYR QE 1 30 PHE QD 3.602 . 5.224 3.697 3.276 4.165 . 0 0 "[ . 1 . 2]" 1
2014 2 29 TYR QE 2 30 PHE QD 3.602 . 5.224 3.697 3.274 4.164 . 0 0 "[ . 1 . 2]" 1
2015 1 29 TYR QE 1 39 ILE MD 2.912 . 6.000 5.116 4.919 5.496 . 0 0 "[ . 1 . 2]" 1
2016 2 29 TYR QE 2 39 ILE MD 2.912 . 6.000 5.116 4.919 5.496 . 0 0 "[ . 1 . 2]" 1
2017 1 55 SER HB3 1 60 PHE HZ 4.676 . 7.409 4.595 3.924 5.114 . 0 0 "[ . 1 . 2]" 1
2018 2 55 SER HB3 2 60 PHE HZ 4.676 . 7.409 4.594 3.923 5.113 . 0 0 "[ . 1 . 2]" 1
2019 1 54 ILE HA 1 60 PHE HZ 5.277 . 8.758 5.175 4.962 5.330 . 0 0 "[ . 1 . 2]" 1
2020 2 54 ILE HA 2 60 PHE HZ 5.277 . 8.758 5.174 4.964 5.329 . 0 0 "[ . 1 . 2]" 1
2021 1 54 ILE HB 1 60 PHE HZ 4.955 . 8.023 4.269 3.643 5.063 . 0 0 "[ . 1 . 2]" 1
2022 2 54 ILE HB 2 60 PHE HZ 4.955 . 8.023 4.269 3.643 5.065 . 0 0 "[ . 1 . 2]" 1
2023 1 20 GLU HB2 1 60 PHE HZ 5.777 . 9.949 5.629 5.234 6.007 . 0 0 "[ . 1 . 2]" 1
2024 2 20 GLU HB2 2 60 PHE HZ 5.777 . 9.949 5.629 5.233 6.008 . 0 0 "[ . 1 . 2]" 1
2025 1 19 LYS HA 1 60 PHE HZ 5.137 . 8.436 5.166 4.744 5.793 . 0 0 "[ . 1 . 2]" 1
2026 2 19 LYS HA 2 60 PHE HZ 5.137 . 8.436 5.166 4.745 5.792 . 0 0 "[ . 1 . 2]" 1
2027 1 19 LYS HE2 1 58 PHE HZ 4.820 . 7.724 5.501 5.089 5.811 . 0 0 "[ . 1 . 2]" 1
2028 2 19 LYS HE2 2 58 PHE HZ 4.820 . 7.724 5.501 5.087 5.811 . 0 0 "[ . 1 . 2]" 1
2029 1 19 LYS HB3 1 58 PHE HZ 4.603 . 7.252 4.551 4.214 5.489 . 0 0 "[ . 1 . 2]" 1
2030 2 19 LYS HB3 2 58 PHE HZ 4.603 . 7.252 4.550 4.215 5.487 . 0 0 "[ . 1 . 2]" 1
2031 1 20 GLU HA 1 74 PHE HZ 5.247 . 8.689 7.624 6.624 8.320 . 0 0 "[ . 1 . 2]" 1
2032 2 20 GLU HA 2 74 PHE HZ 5.247 . 8.689 7.624 6.623 8.320 . 0 0 "[ . 1 . 2]" 1
2033 1 25 LEU HB3 1 74 PHE HZ 4.460 . 6.947 5.413 3.769 6.948 0.001 2 0 "[ . 1 . 2]" 1
2034 2 25 LEU HB3 2 74 PHE HZ 4.460 . 6.947 5.414 3.771 6.949 0.002 2 0 "[ . 1 . 2]" 1
2035 1 18 SER HA 1 74 PHE HZ 6.515 . 11.821 5.743 5.269 6.136 . 0 0 "[ . 1 . 2]" 1
2036 2 18 SER HA 2 74 PHE HZ 6.515 . 11.821 5.743 5.269 6.136 . 0 0 "[ . 1 . 2]" 1
2037 1 20 GLU HB3 1 74 PHE QD 6.170 . 10.928 5.527 2.990 7.662 . 0 0 "[ . 1 . 2]" 1
2038 2 20 GLU HB3 2 74 PHE QD 6.170 . 10.928 5.526 2.990 7.660 . 0 0 "[ . 1 . 2]" 1
2039 1 15 MET QB 1 74 PHE QD 5.373 . 8.982 5.783 3.955 6.941 . 0 0 "[ . 1 . 2]" 1
2040 2 15 MET QB 2 74 PHE QD 5.373 . 8.982 5.783 3.954 6.940 . 0 0 "[ . 1 . 2]" 1
2041 1 25 LEU HB3 1 74 PHE QD 5.305 . 8.822 4.131 3.002 5.220 . 0 0 "[ . 1 . 2]" 1
2042 2 25 LEU HB3 2 74 PHE QD 5.305 . 8.822 4.131 3.003 5.221 . 0 0 "[ . 1 . 2]" 1
2043 1 15 MET QB 1 74 PHE QE 5.546 . 9.390 5.640 2.940 7.701 . 0 0 "[ . 1 . 2]" 1
2044 2 15 MET QB 2 74 PHE QE 5.546 . 9.390 5.640 2.940 7.699 . 0 0 "[ . 1 . 2]" 1
2045 1 25 LEU HB3 1 74 PHE QE 4.714 . 7.491 4.453 3.196 5.857 . 0 0 "[ . 1 . 2]" 1
2046 2 25 LEU HB3 2 74 PHE QE 4.714 . 7.491 4.453 3.197 5.858 . 0 0 "[ . 1 . 2]" 1
2047 1 23 ALA HA 1 30 PHE QE 5.072 . 8.287 5.096 4.492 5.401 . 0 0 "[ . 1 . 2]" 1
2048 2 23 ALA HA 2 30 PHE QE 5.072 . 8.287 5.096 4.492 5.400 . 0 0 "[ . 1 . 2]" 1
2049 1 55 SER HB3 1 58 PHE QD 5.925 . 10.314 5.543 5.341 5.718 . 0 0 "[ . 1 . 2]" 1
2050 2 55 SER HB3 2 58 PHE QD 5.925 . 10.314 5.543 5.343 5.717 . 0 0 "[ . 1 . 2]" 1
2051 1 29 TYR QD 1 30 PHE QD 5.022 . 8.174 3.086 2.551 3.531 . 0 0 "[ . 1 . 2]" 1
2052 2 29 TYR QD 2 30 PHE QD 5.022 . 8.174 3.086 2.549 3.530 . 0 0 "[ . 1 . 2]" 1
2053 1 29 TYR QD 1 33 ILE HB 6.677 . 12.250 5.303 5.131 5.503 . 0 0 "[ . 1 . 2]" 1
2054 2 29 TYR QD 2 33 ILE HB 6.677 . 12.250 5.303 5.132 5.504 . 0 0 "[ . 1 . 2]" 1
2055 1 26 ILE HA 1 29 TYR QD 5.260 . 8.718 4.108 3.686 4.546 . 0 0 "[ . 1 . 2]" 1
2056 2 26 ILE HA 2 29 TYR QD 5.260 . 8.718 4.109 3.686 4.546 . 0 0 "[ . 1 . 2]" 1
2057 1 27 VAL HA 1 29 TYR QD 6.878 . 12.792 4.648 4.323 4.875 . 0 0 "[ . 1 . 2]" 1
2058 2 27 VAL HA 2 29 TYR QD 6.878 . 12.792 4.648 4.323 4.875 . 0 0 "[ . 1 . 2]" 1
2059 1 59 GLY HA2 1 60 PHE QD 4.980 . 8.080 3.692 3.441 3.985 . 0 0 "[ . 1 . 2]" 1
2060 2 59 GLY HA2 2 60 PHE QD 4.980 . 8.080 3.692 3.444 3.987 . 0 0 "[ . 1 . 2]" 1
2061 1 29 TYR HA 1 78 HIS HE1 6.150 . 10.877 6.513 2.723 8.348 . 0 0 "[ . 1 . 2]" 1
2062 2 29 TYR HA 2 78 HIS HE1 6.150 . 10.877 6.513 2.720 8.345 . 0 0 "[ . 1 . 2]" 1
2063 1 32 SER QB 1 78 HIS HE1 6.133 . 10.835 5.483 2.021 6.986 . 0 0 "[ . 1 . 2]" 1
2064 2 32 SER QB 2 78 HIS HE1 6.133 . 10.835 5.484 2.023 6.985 . 0 0 "[ . 1 . 2]" 1
2065 1 33 ILE HA 1 78 HIS HE1 6.296 . 11.252 7.279 5.410 8.741 . 0 0 "[ . 1 . 2]" 1
2066 2 33 ILE HA 2 78 HIS HE1 6.296 . 11.252 7.279 5.411 8.741 . 0 0 "[ . 1 . 2]" 1
2067 1 71 LYS HB3 1 72 SER HA 4.695 . 7.450 4.123 3.357 4.830 . 0 0 "[ . 1 . 2]" 1
2068 2 71 LYS HB3 2 72 SER HA 4.695 . 7.450 4.124 3.360 4.828 . 0 0 "[ . 1 . 2]" 1
2069 1 18 SER HA 1 19 LYS HA 4.545 . 7.127 3.798 3.756 3.838 . 0 0 "[ . 1 . 2]" 1
2070 2 18 SER HA 2 19 LYS HA 4.545 . 7.127 3.798 3.756 3.837 . 0 0 "[ . 1 . 2]" 1
2071 1 25 LEU HB3 1 29 TYR HA 4.879 . 7.855 5.144 4.691 5.486 . 0 0 "[ . 1 . 2]" 1
2072 2 25 LEU HB3 2 29 TYR HA 4.879 . 7.855 5.144 4.692 5.487 . 0 0 "[ . 1 . 2]" 1
2073 1 29 TYR QR 1 80 ALA HA 5.009 . 8.146 4.454 3.975 5.363 . 0 0 "[ . 1 . 2]" 1
2074 2 29 TYR QR 2 80 ALA HA 5.009 . 8.146 4.454 3.974 5.363 . 0 0 "[ . 1 . 2]" 1
2075 1 21 GLU HA 1 25 LEU HB3 4.594 . 7.232 5.314 4.947 5.536 . 0 0 "[ . 1 . 2]" 1
2076 2 21 GLU HA 2 25 LEU HB3 4.594 . 7.232 5.313 4.948 5.534 . 0 0 "[ . 1 . 2]" 1
2077 1 41 GLU HA 1 44 ALA MB 2.838 . 3.845 2.560 2.107 2.826 . 0 0 "[ . 1 . 2]" 1
2078 2 41 GLU HA 2 44 ALA MB 2.838 . 3.845 2.560 2.106 2.825 . 0 0 "[ . 1 . 2]" 1
2079 1 41 GLU HA 1 41 GLU QB 3.387 . 4.821 2.190 1.986 2.327 . 0 0 "[ . 1 . 2]" 1
2080 2 41 GLU HA 2 41 GLU QB 3.387 . 4.821 2.190 1.987 2.326 . 0 0 "[ . 1 . 2]" 1
2081 1 82 ILE HA 1 85 SER QB 3.762 . 5.531 3.291 2.657 4.389 . 0 0 "[ . 1 . 2]" 1
2082 2 82 ILE HA 2 85 SER QB 3.762 . 5.531 3.292 2.656 4.395 . 0 0 "[ . 1 . 2]" 1
2083 1 33 ILE HA 1 34 VAL HB 4.672 . 7.400 3.251 2.123 4.442 . 0 0 "[ . 1 . 2]" 1
2084 2 33 ILE HA 2 34 VAL HB 4.672 . 7.400 3.250 2.124 4.440 . 0 0 "[ . 1 . 2]" 1
2085 1 33 ILE HB 1 34 VAL HA 4.383 . 6.784 4.119 3.932 4.256 . 0 0 "[ . 1 . 2]" 1
2086 2 33 ILE HB 2 34 VAL HA 4.383 . 6.784 4.120 3.934 4.256 . 0 0 "[ . 1 . 2]" 1
2087 1 58 PHE HB2 1 60 PHE QR 4.130 . 6.262 1.953 1.900 2.026 0.098 3 0 "[ . 1 . 2]" 1
2088 2 58 PHE HB2 2 60 PHE QR 4.130 . 6.262 1.953 1.900 2.029 0.098 3 0 "[ . 1 . 2]" 1
2089 1 42 ASP HA 1 45 ASP HB3 2.995 . 4.116 2.594 2.136 2.850 . 0 0 "[ . 1 . 2]" 1
2090 2 42 ASP HA 2 45 ASP HB3 2.995 . 4.116 2.595 2.140 2.847 . 0 0 "[ . 1 . 2]" 1
2091 1 66 SER HA 1 69 LEU HB2 3.875 . 5.752 2.851 2.492 3.313 . 0 0 "[ . 1 . 2]" 1
2092 2 66 SER HA 2 69 LEU HB2 3.875 . 5.752 2.851 2.494 3.315 . 0 0 "[ . 1 . 2]" 1
2093 1 25 LEU HB3 1 69 LEU QD 4.105 . 6.211 4.172 3.842 4.450 . 0 0 "[ . 1 . 2]" 1
2094 2 25 LEU HB3 2 69 LEU QD 4.105 . 6.211 4.172 3.841 4.449 . 0 0 "[ . 1 . 2]" 1
2095 1 38 GLU HB2 1 39 ILE HB 5.031 . 8.194 4.612 3.919 5.423 . 0 0 "[ . 1 . 2]" 1
2096 2 38 GLU HB2 2 39 ILE HB 5.031 . 8.194 4.612 3.923 5.421 . 0 0 "[ . 1 . 2]" 1
2097 1 24 ALA HA 1 64 ALA MB 5.244 . 8.682 3.968 3.558 4.225 . 0 0 "[ . 1 . 2]" 1
2098 2 24 ALA HA 2 64 ALA MB 5.244 . 8.682 3.968 3.554 4.224 . 0 0 "[ . 1 . 2]" 1
2099 1 63 GLU QB 1 64 ALA MB 4.897 . 7.895 4.067 3.744 4.595 . 0 0 "[ . 1 . 2]" 1
2100 2 63 GLU QB 2 64 ALA MB 4.897 . 7.895 4.067 3.744 4.596 . 0 0 "[ . 1 . 2]" 1
2101 1 48 ASN QB 1 51 MET ME 6.230 . 11.082 4.930 4.798 5.011 . 0 0 "[ . 1 . 2]" 1
2102 2 48 ASN QB 2 51 MET ME 6.230 . 11.082 4.929 4.796 5.010 . 0 0 "[ . 1 . 2]" 1
2103 1 18 SER HB2 1 19 LYS HG3 6.596 . 12.035 5.105 3.999 5.689 . 0 0 "[ . 1 . 2]" 1
2104 2 18 SER HB2 2 19 LYS HG3 6.596 . 12.035 5.106 4.001 5.687 . 0 0 "[ . 1 . 2]" 1
2105 1 27 VAL HB 1 30 PHE QD 5.285 . 8.777 4.015 3.770 4.234 . 0 0 "[ . 1 . 2]" 1
2106 2 27 VAL HB 2 30 PHE QD 5.285 . 8.777 4.015 3.769 4.232 . 0 0 "[ . 1 . 2]" 1
2107 1 73 GLU HG2 1 74 PHE QR 6.745 . 12.431 4.866 3.011 6.368 . 0 0 "[ . 1 . 2]" 1
2108 2 73 GLU HG2 2 74 PHE QR 6.745 . 12.431 4.868 3.012 6.371 . 0 0 "[ . 1 . 2]" 1
2109 1 60 PHE HA 1 61 GLU QG 4.388 . 6.794 3.651 3.375 4.354 . 0 0 "[ . 1 . 2]" 1
2110 2 60 PHE HA 2 61 GLU QG 4.388 . 6.794 3.651 3.367 4.351 . 0 0 "[ . 1 . 2]" 1
2111 1 30 PHE QD 1 54 ILE HB 4.316 . 6.644 4.716 4.567 4.865 . 0 0 "[ . 1 . 2]" 1
2112 2 30 PHE QD 2 54 ILE HB 4.316 . 6.644 4.716 4.566 4.865 . 0 0 "[ . 1 . 2]" 1
2113 1 20 GLU HB3 1 60 PHE QR 4.824 . 7.732 4.220 3.358 5.059 . 0 0 "[ . 1 . 2]" 1
2114 2 20 GLU HB3 2 60 PHE QR 4.824 . 7.732 4.220 3.359 5.058 . 0 0 "[ . 1 . 2]" 1
2115 1 19 LYS QD 1 58 PHE QD 5.946 . 10.366 3.725 3.015 4.576 . 0 0 "[ . 1 . 2]" 1
2116 2 19 LYS QD 2 58 PHE QD 5.946 . 10.366 3.724 3.016 4.572 . 0 0 "[ . 1 . 2]" 1
2117 1 17 ALA HA 1 21 GLU HB2 4.477 . 6.982 2.995 2.516 3.553 . 0 0 "[ . 1 . 2]" 1
2118 2 17 ALA HA 2 21 GLU HB2 4.477 . 6.982 2.994 2.515 3.552 . 0 0 "[ . 1 . 2]" 1
2119 1 71 LYS HA 1 75 LYS QD 5.755 . 9.894 4.562 3.472 6.239 . 0 0 "[ . 1 . 2]" 1
2120 2 71 LYS HA 2 75 LYS QD 5.755 . 9.894 4.563 3.472 6.242 . 0 0 "[ . 1 . 2]" 1
2121 1 37 LYS HB3 1 37 LYS QE 4.045 . 6.091 3.593 1.991 4.494 0.008 13 0 "[ . 1 . 2]" 1
2122 2 37 LYS HB3 2 37 LYS QE 4.045 . 6.091 3.594 1.997 4.492 0.002 13 0 "[ . 1 . 2]" 1
2123 1 37 LYS HB2 1 37 LYS QE 5.236 . 8.663 3.612 1.955 4.184 . 0 0 "[ . 1 . 2]" 1
2124 2 37 LYS HB2 2 37 LYS QE 5.236 . 8.663 3.612 1.956 4.185 . 0 0 "[ . 1 . 2]" 1
2125 1 18 SER HA 1 19 LYS QD 6.651 . 12.181 5.407 3.493 5.871 . 0 0 "[ . 1 . 2]" 1
2126 2 18 SER HA 2 19 LYS QD 6.651 . 12.181 5.407 3.498 5.872 . 0 0 "[ . 1 . 2]" 1
2127 1 41 GLU HB2 1 42 ASP HA 4.957 . 8.028 3.499 3.369 3.581 . 0 0 "[ . 1 . 2]" 1
2128 2 41 GLU HB2 2 42 ASP HA 4.957 . 8.028 3.499 3.368 3.581 . 0 0 "[ . 1 . 2]" 1
2129 1 33 ILE HA 1 36 LYS HG2 3.010 . 4.142 2.678 2.250 2.938 . 0 0 "[ . 1 . 2]" 1
2130 2 33 ILE HA 2 36 LYS HG2 3.010 . 4.142 2.678 2.249 2.940 . 0 0 "[ . 1 . 2]" 1
2131 1 80 ALA MB 1 84 ASN HA 4.212 . 6.429 4.661 4.232 5.137 . 0 0 "[ . 1 . 2]" 1
2132 2 80 ALA MB 2 84 ASN HA 4.212 . 6.429 4.661 4.231 5.139 . 0 0 "[ . 1 . 2]" 1
2133 1 29 TYR HB2 1 33 ILE MD 5.596 . 9.511 4.868 4.328 5.255 . 0 0 "[ . 1 . 2]" 1
2134 2 29 TYR HB2 2 33 ILE MD 5.596 . 9.511 4.868 4.328 5.255 . 0 0 "[ . 1 . 2]" 1
2135 1 20 GLU HG2 1 68 ILE MD 4.399 . 6.818 4.462 4.107 4.918 . 0 0 "[ . 1 . 2]" 1
2136 2 20 GLU HG2 2 68 ILE MD 4.399 . 6.818 4.462 4.108 4.918 . 0 0 "[ . 1 . 2]" 1
2137 1 29 TYR HA 1 33 ILE MD 4.956 . 8.026 4.776 4.637 4.923 . 0 0 "[ . 1 . 2]" 1
2138 2 29 TYR HA 2 33 ILE MD 4.956 . 8.026 4.776 4.636 4.923 . 0 0 "[ . 1 . 2]" 1
2139 1 29 TYR HB2 1 82 ILE MD 5.648 . 9.636 4.497 4.345 4.649 . 0 0 "[ . 1 . 2]" 1
2140 2 29 TYR HB2 2 82 ILE MD 5.648 . 9.636 4.497 4.346 4.651 . 0 0 "[ . 1 . 2]" 1
2141 1 18 SER HB2 1 82 ILE MD 7.029 . 13.205 8.148 7.848 8.465 . 0 0 "[ . 1 . 2]" 1
2142 2 18 SER HB2 2 82 ILE MD 7.029 . 13.205 8.149 7.848 8.467 . 0 0 "[ . 1 . 2]" 1
2143 1 30 PHE HA 1 54 ILE MD 4.663 . 7.381 5.639 5.500 5.938 . 0 0 "[ . 1 . 2]" 1
2144 2 30 PHE HA 2 54 ILE MD 4.663 . 7.381 5.639 5.500 5.938 . 0 0 "[ . 1 . 2]" 1
2145 1 29 TYR QR 1 54 ILE MD 4.346 . 6.707 6.020 5.651 6.335 . 0 0 "[ . 1 . 2]" 1
2146 2 29 TYR QR 2 54 ILE MD 4.346 . 6.707 6.020 5.650 6.335 . 0 0 "[ . 1 . 2]" 1
2147 1 30 PHE HB3 1 54 ILE MD 3.957 . 5.915 4.310 3.677 4.865 . 0 0 "[ . 1 . 2]" 1
2148 2 30 PHE HB3 2 54 ILE MD 3.957 . 5.915 4.310 3.676 4.864 . 0 0 "[ . 1 . 2]" 1
2149 1 53 CYS HB3 1 54 ILE MD 5.201 . 8.582 5.379 4.387 5.737 . 0 0 "[ . 1 . 2]" 1
2150 2 53 CYS HB3 2 54 ILE MD 5.201 . 8.582 5.379 4.389 5.739 . 0 0 "[ . 1 . 2]" 1
2151 1 69 LEU MD2 1 72 SER HA 5.150 . 8.466 5.123 4.522 6.146 . 0 0 "[ . 1 . 2]" 1
2152 2 69 LEU MD2 2 72 SER HA 5.150 . 8.466 5.123 4.523 6.145 . 0 0 "[ . 1 . 2]" 1
2153 1 25 LEU MD2 1 74 PHE HA 4.479 . 6.986 3.976 2.315 4.293 . 0 0 "[ . 1 . 2]" 1
2154 2 25 LEU MD2 2 74 PHE HA 4.479 . 6.986 3.976 2.313 4.295 . 0 0 "[ . 1 . 2]" 1
2155 1 29 TYR QR 1 79 LEU MD1 5.433 . 9.123 5.122 4.819 5.308 . 0 0 "[ . 1 . 2]" 1
2156 2 29 TYR QR 2 79 LEU MD1 5.433 . 9.123 5.122 4.819 5.308 . 0 0 "[ . 1 . 2]" 1
2157 1 21 GLU HA 1 69 LEU MD1 4.776 . 7.627 5.859 5.456 6.115 . 0 0 "[ . 1 . 2]" 1
2158 2 21 GLU HA 2 69 LEU MD1 4.776 . 7.627 5.859 5.456 6.115 . 0 0 "[ . 1 . 2]" 1
2159 1 25 LEU MD1 1 78 HIS HA 5.031 . 8.195 4.849 4.224 5.451 . 0 0 "[ . 1 . 2]" 1
2160 2 25 LEU MD1 2 78 HIS HA 5.031 . 8.195 4.849 4.225 5.449 . 0 0 "[ . 1 . 2]" 1
2161 1 30 PHE QD 1 79 LEU MD2 5.119 . 8.395 4.861 4.507 5.192 . 0 0 "[ . 1 . 2]" 1
2162 2 30 PHE QD 2 79 LEU MD2 5.119 . 8.395 4.860 4.507 5.191 . 0 0 "[ . 1 . 2]" 1
2163 1 74 PHE QD 1 83 LEU MD1 4.437 . 6.898 6.048 5.755 6.315 . 0 0 "[ . 1 . 2]" 1
2164 2 74 PHE QD 2 83 LEU MD1 4.437 . 6.898 6.047 5.755 6.314 . 0 0 "[ . 1 . 2]" 1
2165 1 29 TYR QR 1 79 LEU HG 5.583 . 9.479 4.772 4.581 5.080 . 0 0 "[ . 1 . 2]" 1
2166 2 29 TYR QR 2 79 LEU HG 5.583 . 9.479 4.772 4.581 5.080 . 0 0 "[ . 1 . 2]" 1
2167 1 22 ILE HA 1 83 LEU MD1 3.714 . 6.000 5.822 5.507 6.019 0.019 16 0 "[ . 1 . 2]" 1
2168 2 22 ILE HA 2 83 LEU MD1 3.714 . 6.000 5.822 5.505 6.018 0.018 16 0 "[ . 1 . 2]" 1
2169 1 79 LEU HA 1 83 LEU MD2 4.264 . 6.537 4.980 4.626 5.391 . 0 0 "[ . 1 . 2]" 1
2170 2 79 LEU HA 2 83 LEU MD2 4.264 . 6.537 4.980 4.626 5.391 . 0 0 "[ . 1 . 2]" 1
2171 1 24 ALA MB 1 28 ASN QB 4.192 . 6.389 4.090 3.982 4.403 . 0 0 "[ . 1 . 2]" 1
2172 2 24 ALA MB 2 28 ASN QB 4.192 . 6.389 4.090 3.984 4.405 . 0 0 "[ . 1 . 2]" 1
2173 1 20 GLU HB3 1 23 ALA MB 4.671 . 7.398 4.062 3.781 4.326 . 0 0 "[ . 1 . 2]" 1
2174 2 20 GLU HB3 2 23 ALA MB 4.671 . 7.398 4.062 3.780 4.326 . 0 0 "[ . 1 . 2]" 1
2175 1 17 ALA HA 1 24 ALA MB 6.030 . 10.576 5.566 5.349 5.751 . 0 0 "[ . 1 . 2]" 1
2176 2 17 ALA HA 2 24 ALA MB 6.030 . 10.576 5.566 5.349 5.752 . 0 0 "[ . 1 . 2]" 1
2177 1 26 ILE MD 1 30 PHE QE 3.894 . 5.790 3.868 3.334 4.149 . 0 0 "[ . 1 . 2]" 1
2178 2 26 ILE MD 2 30 PHE QE 3.894 . 5.790 3.869 3.334 4.150 . 0 0 "[ . 1 . 2]" 1
2179 1 39 ILE MD 1 40 SER HA 6.133 . 10.834 5.040 4.590 5.330 . 0 0 "[ . 1 . 2]" 1
2180 2 39 ILE MD 2 40 SER HA 6.133 . 10.834 5.040 4.594 5.330 . 0 0 "[ . 1 . 2]" 1
2181 1 76 GLY HA2 1 82 ILE MD 5.060 . 8.260 5.884 2.277 6.929 . 0 0 "[ . 1 . 2]" 1
2182 2 76 GLY HA2 2 82 ILE MD 5.060 . 8.260 5.885 2.278 6.930 . 0 0 "[ . 1 . 2]" 1
2183 1 29 TYR QR 1 47 LEU MD2 4.702 . 7.466 4.883 4.701 5.416 . 0 0 "[ . 1 . 2]" 1
2184 2 29 TYR QR 2 47 LEU MD2 4.702 . 7.466 4.883 4.702 5.416 . 0 0 "[ . 1 . 2]" 1
2185 1 29 TYR HB3 1 47 LEU MD2 5.118 . 8.392 5.640 5.542 5.818 . 0 0 "[ . 1 . 2]" 1
2186 2 29 TYR HB3 2 47 LEU MD2 5.118 . 8.392 5.640 5.542 5.817 . 0 0 "[ . 1 . 2]" 1
2187 1 73 GLU HB2 2 83 LEU HB3 5.204 . 8.589 5.856 4.041 7.568 . 0 0 "[ . 1 . 2]" 1
2188 1 83 LEU HB3 2 73 GLU HB2 5.204 . 8.589 5.858 4.042 7.571 . 0 0 "[ . 1 . 2]" 1
2189 1 79 LEU MD2 2 17 ALA MB 5.423 . 9.099 5.050 4.501 5.825 . 0 0 "[ . 1 . 2]" 1
2190 1 17 ALA MB 2 79 LEU MD2 5.423 . 9.099 5.050 4.499 5.822 . 0 0 "[ . 1 . 2]" 1
2191 1 79 LEU MD2 2 22 ILE HB 5.163 . 8.495 4.486 4.153 4.827 . 0 0 "[ . 1 . 2]" 1
2192 1 22 ILE HB 2 79 LEU MD2 5.163 . 8.495 4.487 4.160 4.819 . 0 0 "[ . 1 . 2]" 1
2193 1 79 LEU MD2 2 22 ILE HA 5.403 . 9.052 4.093 3.869 4.275 . 0 0 "[ . 1 . 2]" 1
2194 1 22 ILE HA 2 79 LEU MD2 5.403 . 9.052 4.093 3.874 4.277 . 0 0 "[ . 1 . 2]" 1
2195 1 25 LEU MD1 2 83 LEU HA 5.864 . 10.162 4.218 3.879 4.685 . 0 0 "[ . 1 . 2]" 1
2196 1 23 ALA HA 2 79 LEU MD2 5.864 . 10.162 4.217 3.882 4.694 . 0 0 "[ . 1 . 2]" 1
2197 1 79 LEU MD2 2 26 ILE MD 2.849 . 3.864 2.210 1.995 2.472 . 0 0 "[ . 1 . 2]" 1
2198 1 26 ILE MD 2 79 LEU MD2 2.849 . 3.864 2.210 1.979 2.458 . 0 0 "[ . 1 . 2]" 1
2199 1 47 LEU MD2 2 51 MET HB3 6.373 . 11.450 6.170 5.446 6.725 . 0 0 "[ . 1 . 2]" 1
2200 1 51 MET HB3 2 47 LEU MD2 6.373 . 11.450 6.170 5.420 6.678 . 0 0 "[ . 1 . 2]" 1
2201 1 47 LEU MD2 2 50 ALA HA 4.894 . 7.888 4.746 4.489 5.084 . 0 0 "[ . 1 . 2]" 1
2202 1 50 ALA HA 2 47 LEU MD2 4.894 . 7.888 4.746 4.501 5.112 . 0 0 "[ . 1 . 2]" 1
2203 1 83 LEU MD2 2 23 ALA HA 5.772 . 9.937 4.795 4.396 5.130 . 0 0 "[ . 1 . 2]" 1
2204 1 23 ALA HA 2 83 LEU MD2 5.772 . 9.937 4.795 4.381 5.148 . 0 0 "[ . 1 . 2]" 1
2205 1 69 LEU MD2 2 83 LEU HB3 5.284 . 8.774 6.568 5.950 7.493 . 0 0 "[ . 1 . 2]" 1
2206 1 83 LEU HB3 2 69 LEU MD2 5.284 . 8.774 6.568 5.944 7.498 . 0 0 "[ . 1 . 2]" 1
2207 1 79 LEU MD1 2 83 LEU QD 2.271 . 2.915 1.892 1.707 2.177 . 0 0 "[ . 1 . 2]" 1
2208 1 83 LEU QD 2 79 LEU MD1 2.271 . 2.915 1.892 1.728 2.166 . 0 0 "[ . 1 . 2]" 1
2209 1 47 LEU MD1 2 54 ILE HA 4.886 . 7.870 4.687 4.075 4.966 . 0 0 "[ . 1 . 2]" 1
2210 1 26 ILE HA 2 79 LEU MD1 4.886 . 7.870 4.687 4.050 4.951 . 0 0 "[ . 1 . 2]" 1
2211 1 47 LEU MD1 2 57 ALA HA 4.999 . 8.122 4.498 4.263 4.738 . 0 0 "[ . 1 . 2]" 1
2212 1 57 ALA HA 2 47 LEU MD1 4.999 . 8.122 4.499 4.258 4.733 . 0 0 "[ . 1 . 2]" 1
2213 1 47 LEU MD1 2 58 PHE QE 4.623 . 7.294 3.296 2.742 3.632 . 0 0 "[ . 1 . 2]" 1
2214 1 58 PHE QE 2 47 LEU MD1 4.623 . 7.294 3.298 2.756 3.637 . 0 0 "[ . 1 . 2]" 1
2215 1 50 ALA MB 2 53 CYS HA 5.901 . 10.254 4.273 4.022 4.634 . 0 0 "[ . 1 . 2]" 1
2216 1 19 LYS HA 2 80 ALA MB 5.901 . 10.254 4.273 3.985 4.652 . 0 0 "[ . 1 . 2]" 1
2217 1 51 MET ME 2 23 ALA MB 4.785 . 7.647 6.038 5.700 6.304 . 0 0 "[ . 1 . 2]" 1
2218 1 23 ALA MB 2 51 MET ME 4.785 . 7.647 6.039 5.705 6.331 . 0 0 "[ . 1 . 2]" 1
2219 1 24 ALA MB 2 25 LEU HB3 5.575 . 9.460 8.325 7.858 8.965 . 0 0 "[ . 1 . 2]" 1
2220 1 25 LEU HB3 2 24 ALA MB 5.575 . 9.460 8.325 7.862 9.014 . 0 0 "[ . 1 . 2]" 1
2221 1 80 ALA MB 2 16 SER HA 5.732 . 9.840 5.023 3.996 5.874 . 0 0 "[ . 1 . 2]" 1
2222 1 16 SER HA 2 80 ALA MB 5.732 . 9.840 5.025 4.019 5.890 . 0 0 "[ . 1 . 2]" 1
2223 1 50 ALA MB 2 30 PHE QD 5.250 . 8.695 4.833 4.548 5.000 . 0 0 "[ . 1 . 2]" 1
2224 1 30 PHE QD 2 50 ALA MB 5.250 . 8.695 4.833 4.564 4.996 . 0 0 "[ . 1 . 2]" 1
2225 1 51 MET ME 2 30 PHE HZ 5.781 . 9.959 5.602 5.127 5.803 . 0 0 "[ . 1 . 2]" 1
2226 1 30 PHE HZ 2 51 MET ME 5.781 . 9.959 5.603 5.138 5.794 . 0 0 "[ . 1 . 2]" 1
2227 1 23 ALA MB 2 30 PHE QD 5.583 . 9.479 3.948 3.746 4.164 . 0 0 "[ . 1 . 2]" 1
2228 1 30 PHE QD 2 23 ALA MB 5.583 . 9.479 3.948 3.739 4.160 . 0 0 "[ . 1 . 2]" 1
2229 1 17 ALA MB 2 83 LEU QD 3.950 . 5.901 3.333 2.332 4.840 . 0 0 "[ . 1 . 2]" 1
2230 1 83 LEU QD 2 17 ALA MB 3.950 . 5.901 3.334 2.342 4.828 . 0 0 "[ . 1 . 2]" 1
2231 1 57 ALA MB 2 30 PHE HA 6.369 . 11.439 5.230 4.670 5.350 . 0 0 "[ . 1 . 2]" 1
2232 1 30 PHE HA 2 57 ALA MB 6.369 . 11.439 5.229 4.692 5.354 . 0 0 "[ . 1 . 2]" 1
2233 1 54 ILE MD 2 26 ILE MD 5.176 . 8.525 4.632 4.456 4.909 . 0 0 "[ . 1 . 2]" 1
2234 1 26 ILE MD 2 54 ILE MD 5.176 . 8.525 4.633 4.467 4.906 . 0 0 "[ . 1 . 2]" 1
2235 1 54 ILE MD 2 47 LEU HA 6.191 . 10.983 5.028 4.473 5.305 . 0 0 "[ . 1 . 2]" 1
2236 1 47 LEU HA 2 54 ILE MD 6.191 . 10.983 5.027 4.484 5.323 . 0 0 "[ . 1 . 2]" 1
2237 1 26 ILE MD 2 79 LEU MD1 4.968 . 8.053 3.791 3.495 4.092 . 0 0 "[ . 1 . 2]" 1
2238 1 79 LEU MD1 2 26 ILE MD 4.968 . 8.053 3.792 3.493 4.065 . 0 0 "[ . 1 . 2]" 1
2239 1 26 ILE MD 2 29 TYR QR 5.542 . 9.381 2.337 2.038 2.797 . 0 0 "[ . 1 . 2]" 1
2240 1 29 TYR QR 2 26 ILE MD 5.542 . 9.381 2.337 2.042 2.793 . 0 0 "[ . 1 . 2]" 1
2241 1 39 ILE MD 2 58 PHE QE 4.262 . 6.533 3.721 3.317 4.141 . 0 0 "[ . 1 . 2]" 1
2242 1 58 PHE QE 2 39 ILE MD 4.262 . 6.533 3.722 3.325 4.126 . 0 0 "[ . 1 . 2]" 1
2243 1 82 ILE MD 2 83 LEU QD 3.276 . 4.618 3.173 2.501 3.640 . 0 0 "[ . 1 . 2]" 1
2244 1 83 LEU QD 2 82 ILE MD 3.276 . 4.618 3.172 2.509 3.632 . 0 0 "[ . 1 . 2]" 1
2245 1 22 ILE MD 2 83 LEU QD 4.368 . 6.753 3.359 2.944 4.024 . 0 0 "[ . 1 . 2]" 1
2246 1 83 LEU QD 2 22 ILE MD 4.368 . 6.753 3.360 2.948 4.020 . 0 0 "[ . 1 . 2]" 1
2247 1 33 ILE MD 2 19 LYS HB3 4.833 . 7.753 3.482 2.533 4.003 . 0 0 "[ . 1 . 2]" 1
2248 1 19 LYS HB3 2 33 ILE MD 4.833 . 7.753 3.485 2.558 4.006 . 0 0 "[ . 1 . 2]" 1
2249 1 33 ILE MD 2 19 LYS HE2 4.713 . 7.489 5.145 3.366 5.917 . 0 0 "[ . 1 . 2]" 1
2250 1 19 LYS HE2 2 33 ILE MD 4.713 . 7.489 5.143 3.376 5.925 . 0 0 "[ . 1 . 2]" 1
2251 1 30 PHE HZ 2 26 ILE MD 3.726 . 5.461 2.438 2.258 2.816 . 0 0 "[ . 1 . 2]" 1
2252 1 26 ILE MD 2 30 PHE HZ 3.726 . 5.461 2.439 2.242 2.831 . 0 0 "[ . 1 . 2]" 1
2253 1 30 PHE QD 2 54 ILE HA 6.428 . 11.592 4.331 4.112 4.581 . 0 0 "[ . 1 . 2]" 1
2254 1 26 ILE HA 2 30 PHE HZ 6.428 . 11.592 4.332 4.125 4.588 . 0 0 "[ . 1 . 2]" 1
2255 1 30 PHE QD 2 23 ALA HA 5.340 . 8.904 4.024 3.554 4.586 . 0 0 "[ . 1 . 2]" 1
2256 1 23 ALA HA 2 30 PHE QD 5.340 . 8.904 4.025 3.598 4.594 . 0 0 "[ . 1 . 2]" 1
2257 1 58 PHE QD 2 33 ILE HA 7.105 . 13.415 6.606 6.275 7.138 . 0 0 "[ . 1 . 2]" 1
2258 1 33 ILE HA 2 58 PHE QD 7.105 . 13.415 6.605 6.257 7.158 . 0 0 "[ . 1 . 2]" 1
2259 1 58 PHE QD 2 30 PHE QD 6.050 . 10.626 4.841 4.726 5.100 . 0 0 "[ . 1 . 2]" 1
2260 1 30 PHE QD 2 58 PHE QD 6.050 . 10.626 4.841 4.721 5.118 . 0 0 "[ . 1 . 2]" 1
2261 1 58 PHE QD 2 30 PHE HA 7.662 . 14.999 6.249 5.873 6.505 . 0 0 "[ . 1 . 2]" 1
2262 1 30 PHE HA 2 58 PHE QD 7.662 . 14.999 6.248 5.879 6.484 . 0 0 "[ . 1 . 2]" 1
2263 1 39 ILE MD 2 53 CYS HB2 7.166 . 13.584 7.174 6.782 7.474 . 0 0 "[ . 1 . 2]" 1
2264 1 53 CYS HB2 2 39 ILE MD 7.166 . 13.584 7.175 6.787 7.468 . 0 0 "[ . 1 . 2]" 1
2265 1 23 ALA MB 2 30 PHE QE 6.152 . 10.882 3.517 3.271 3.907 . 0 0 "[ . 1 . 2]" 1
2266 1 30 PHE QE 2 23 ALA MB 6.152 . 10.882 3.516 3.260 3.899 . 0 0 "[ . 1 . 2]" 1
2267 1 57 ALA MB 2 33 ILE HB 6.305 . 11.274 5.534 5.167 6.034 . 0 0 "[ . 1 . 2]" 1
2268 1 33 ILE HB 2 57 ALA MB 6.305 . 11.274 5.533 5.172 6.018 . 0 0 "[ . 1 . 2]" 1
2269 1 69 LEU MD2 2 22 ILE HA 8.262 . 16.794 7.751 6.736 10.580 . 0 0 "[ . 1 . 2]" 1
2270 1 22 ILE HA 2 69 LEU MD2 8.262 . 16.794 7.751 6.751 10.587 . 0 0 "[ . 1 . 2]" 1
2271 1 79 LEU MD1 2 29 TYR QR 5.998 . 10.496 5.979 5.557 6.493 . 0 0 "[ . 1 . 2]" 1
2272 1 29 TYR QR 2 79 LEU MD1 5.998 . 10.496 5.978 5.537 6.506 . 0 0 "[ . 1 . 2]" 1
2273 1 56 GLU HB2 2 40 SER HB3 9.294 . 20.091 7.351 6.465 8.684 . 0 0 "[ . 1 . 2]" 1
2274 1 40 SER HB3 2 56 GLU HB2 9.294 . 20.091 7.349 6.453 8.679 . 0 0 "[ . 1 . 2]" 1
2275 1 86 ALA MB 2 85 SER QB 4.816 . 7.715 4.502 3.105 6.060 . 0 0 "[ . 1 . 2]" 1
2276 1 85 SER QB 2 86 ALA MB 4.816 . 7.715 4.502 3.114 6.057 . 0 0 "[ . 1 . 2]" 1
2277 1 86 ALA MB 2 75 LYS HA 4.765 . 7.603 5.520 4.431 6.520 . 0 0 "[ . 1 . 2]" 1
2278 1 75 LYS HA 2 86 ALA MB 4.765 . 7.603 5.521 4.438 6.525 . 0 0 "[ . 1 . 2]" 1
2279 1 86 ALA MB 2 15 MET HB3 5.208 . 8.598 5.722 4.400 7.174 . 0 0 "[ . 1 . 2]" 1
2280 1 15 MET HB3 2 86 ALA MB 5.208 . 8.598 5.721 4.398 7.172 . 0 0 "[ . 1 . 2]" 1
2281 1 25 LEU H 1 27 VAL H 3.303 . 4.666 4.025 3.931 4.079 . 0 0 "[ . 1 . 2]" 1
2282 2 25 LEU H 2 27 VAL H 3.303 . 4.666 4.028 3.932 4.094 . 0 0 "[ . 1 . 2]" 1
2283 1 45 ASP H 1 47 LEU H 4.003 . 6.006 3.854 3.745 3.972 . 0 0 "[ . 1 . 2]" 1
2284 2 45 ASP H 2 47 LEU H 4.003 . 6.006 3.853 3.748 3.976 . 0 0 "[ . 1 . 2]" 1
2285 1 15 MET H 1 16 SER H 2.539 . 3.345 2.698 2.103 3.503 0.158 2 0 "[ . 1 . 2]" 1
2286 2 15 MET H 2 16 SER H 2.539 . 3.345 2.697 2.103 3.508 0.163 2 0 "[ . 1 . 2]" 1
2287 1 19 LYS H 1 23 ALA H 3.876 . 5.754 4.652 4.527 4.776 . 0 0 "[ . 1 . 2]" 1
2288 2 19 LYS H 2 23 ALA H 3.876 . 5.754 4.653 4.525 4.777 . 0 0 "[ . 1 . 2]" 1
2289 1 25 LEU H 1 27 VAL H 3.486 . 5.005 3.815 3.711 3.891 . 0 0 "[ . 1 . 2]" 1
2290 2 25 LEU H 2 27 VAL H 3.486 . 5.005 3.816 3.711 3.898 . 0 0 "[ . 1 . 2]" 1
2291 1 29 TYR H 1 30 PHE H 2.675 . 3.569 2.387 2.329 2.475 . 0 0 "[ . 1 . 2]" 1
2292 2 29 TYR H 2 30 PHE H 2.675 . 3.569 2.388 2.332 2.474 . 0 0 "[ . 1 . 2]" 1
2293 1 40 SER H 1 41 GLU H 3.831 . 5.665 3.937 3.791 4.031 . 0 0 "[ . 1 . 2]" 1
2294 2 40 SER H 2 41 GLU H 3.831 . 5.665 3.937 3.786 4.033 . 0 0 "[ . 1 . 2]" 1
2295 1 15 MET H 1 74 PHE H 4.126 . 6.254 5.403 3.545 6.368 0.114 7 0 "[ . 1 . 2]" 1
2296 1 88 ARG H 2 15 MET H 4.126 . 6.254 5.404 3.538 6.400 0.146 7 0 "[ . 1 . 2]" 1
2297 1 83 LEU H 1 86 ALA H 4.048 . 6.096 3.678 2.642 4.302 . 0 0 "[ . 1 . 2]" 1
2298 2 83 LEU H 2 86 ALA H 4.048 . 6.096 3.676 2.645 4.302 . 0 0 "[ . 1 . 2]" 1
2299 1 58 PHE H 1 58 PHE QD 2.455 . 3.208 2.038 1.982 2.112 . 0 0 "[ . 1 . 2]" 1
2300 2 58 PHE H 2 58 PHE QD 2.455 . 3.208 2.038 1.982 2.112 . 0 0 "[ . 1 . 2]" 1
2301 1 34 VAL H 1 37 LYS H 4.062 . 6.124 3.807 3.704 3.919 . 0 0 "[ . 1 . 2]" 1
2302 2 34 VAL H 2 37 LYS H 4.062 . 6.124 3.808 3.703 3.918 . 0 0 "[ . 1 . 2]" 1
2303 1 45 ASP HA 1 48 ASN H 2.667 . 3.556 2.674 2.624 2.724 . 0 0 "[ . 1 . 2]" 1
2304 2 45 ASP HA 2 48 ASN H 2.667 . 3.556 2.674 2.623 2.723 . 0 0 "[ . 1 . 2]" 1
2305 1 45 ASP HA 1 48 ASN HD22 4.545 . 7.127 3.291 3.253 3.333 . 0 0 "[ . 1 . 2]" 1
2306 2 45 ASP HA 2 48 ASN HD22 4.545 . 7.127 3.292 3.249 3.335 . 0 0 "[ . 1 . 2]" 1
2307 1 15 MET HA 1 16 SER H 2.115 . 2.674 2.460 1.993 2.786 0.112 9 0 "[ . 1 . 2]" 1
2308 2 15 MET HA 2 16 SER H 2.115 . 2.674 2.461 1.992 2.786 0.112 9 0 "[ . 1 . 2]" 1
2309 1 45 ASP HA 1 47 LEU H 4.249 . 6.506 4.097 3.991 4.221 . 0 0 "[ . 1 . 2]" 1
2310 2 45 ASP HA 2 47 LEU H 4.249 . 6.506 4.096 3.991 4.220 . 0 0 "[ . 1 . 2]" 1
2311 1 18 SER HB2 1 19 LYS H 2.853 . 3.871 3.270 2.124 3.864 . 0 0 "[ . 1 . 2]" 1
2312 2 18 SER HB2 2 19 LYS H 2.853 . 3.871 3.271 2.122 3.870 . 0 0 "[ . 1 . 2]" 1
2313 1 42 ASP HA 1 44 ALA H 4.125 . 6.252 4.192 4.084 4.345 . 0 0 "[ . 1 . 2]" 1
2314 2 42 ASP HA 2 44 ALA H 4.125 . 6.252 4.193 4.083 4.344 . 0 0 "[ . 1 . 2]" 1
2315 1 16 SER HA 1 17 ALA H 2.209 . 2.819 2.221 2.058 2.352 . 0 0 "[ . 1 . 2]" 1
2316 2 16 SER HA 2 17 ALA H 2.209 . 2.819 2.221 2.061 2.348 . 0 0 "[ . 1 . 2]" 1
2317 1 42 ASP HA 1 46 SER H 3.268 . 4.603 3.355 3.287 3.438 . 0 0 "[ . 1 . 2]" 1
2318 2 42 ASP HA 2 46 SER H 3.268 . 4.603 3.355 3.288 3.436 . 0 0 "[ . 1 . 2]" 1
2319 1 81 ASP HA 1 84 ASN HD22 3.751 . 5.510 3.504 2.308 4.699 . 0 0 "[ . 1 . 2]" 1
2320 1 16 SER HA 2 84 ASN HD22 3.751 . 5.510 3.505 2.337 4.673 . 0 0 "[ . 1 . 2]" 1
2321 1 40 SER HA 1 41 GLU H 2.059 . 2.589 2.296 2.128 2.485 . 0 0 "[ . 1 . 2]" 1
2322 2 40 SER HA 2 41 GLU H 2.059 . 2.589 2.295 2.124 2.482 . 0 0 "[ . 1 . 2]" 1
2323 1 40 SER H 1 40 SER HA 2.672 . 3.564 2.567 2.363 2.762 . 0 0 "[ . 1 . 2]" 1
2324 2 40 SER H 2 40 SER HA 2.672 . 3.564 2.568 2.371 2.762 . 0 0 "[ . 1 . 2]" 1
2325 1 29 TYR HA 1 32 SER H 2.779 . 3.744 2.701 2.645 2.752 . 0 0 "[ . 1 . 2]" 1
2326 2 29 TYR HA 2 32 SER H 2.779 . 3.744 2.701 2.644 2.752 . 0 0 "[ . 1 . 2]" 1
2327 1 72 SER HB2 1 74 PHE H 3.243 . 4.558 2.744 2.290 3.308 . 0 0 "[ . 1 . 2]" 1
2328 2 72 SER HB2 2 74 PHE H 3.243 . 4.558 2.744 2.290 3.308 . 0 0 "[ . 1 . 2]" 1
2329 1 72 SER HB2 1 73 GLU H 3.111 . 4.321 2.424 1.831 2.855 0.070 13 0 "[ . 1 . 2]" 1
2330 2 72 SER HB2 2 73 GLU H 3.111 . 4.321 2.425 1.833 2.853 0.068 13 0 "[ . 1 . 2]" 1
2331 1 62 ARG HA 1 66 SER H 3.451 . 6.000 5.899 5.686 6.012 0.012 6 0 "[ . 1 . 2]" 1
2332 2 62 ARG HA 2 66 SER H 3.451 . 6.000 5.898 5.683 6.011 0.011 6 0 "[ . 1 . 2]" 1
2333 1 18 SER HB3 1 19 LYS H 3.038 . 4.192 2.445 2.153 2.633 . 0 0 "[ . 1 . 2]" 1
2334 2 18 SER HB3 2 19 LYS H 3.038 . 4.192 2.444 2.153 2.633 . 0 0 "[ . 1 . 2]" 1
2335 1 32 SER H 1 32 SER QB 2.458 . 3.213 2.340 2.222 2.757 . 0 0 "[ . 1 . 2]" 1
2336 2 32 SER H 2 32 SER QB 2.458 . 3.213 2.339 2.226 2.755 . 0 0 "[ . 1 . 2]" 1
2337 1 32 SER QB 1 33 ILE H 2.988 . 4.104 2.741 2.517 3.609 . 0 0 "[ . 1 . 2]" 1
2338 2 32 SER QB 2 33 ILE H 2.988 . 4.104 2.739 2.520 3.607 . 0 0 "[ . 1 . 2]" 1
2339 1 32 SER HB3 1 34 VAL H 3.995 . 5.990 4.644 4.504 4.854 . 0 0 "[ . 1 . 2]" 1
2340 2 32 SER HB3 2 34 VAL H 3.995 . 5.990 4.643 4.503 4.855 . 0 0 "[ . 1 . 2]" 1
2341 1 85 SER H 1 85 SER QB 2.510 . 3.298 2.461 2.255 2.853 . 0 0 "[ . 1 . 2]" 1
2342 2 85 SER H 2 85 SER QB 2.510 . 3.298 2.461 2.258 2.852 . 0 0 "[ . 1 . 2]" 1
2343 1 85 SER QB 1 86 ALA H 3.198 . 4.477 3.219 2.542 3.842 . 0 0 "[ . 1 . 2]" 1
2344 2 85 SER QB 2 86 ALA H 3.198 . 4.477 3.223 2.536 3.853 . 0 0 "[ . 1 . 2]" 1
2345 1 51 MET HA 1 53 CYS H 4.428 . 6.878 4.208 3.907 4.404 . 0 0 "[ . 1 . 2]" 1
2346 1 46 SER HB2 2 53 CYS H 4.428 . 6.878 4.208 3.903 4.412 . 0 0 "[ . 1 . 2]" 1
2347 1 66 SER H 1 66 SER HA 2.584 . 3.419 2.304 2.157 2.442 . 0 0 "[ . 1 . 2]" 1
2348 2 66 SER H 2 66 SER HA 2.584 . 3.419 2.304 2.156 2.442 . 0 0 "[ . 1 . 2]" 1
2349 1 65 VAL H 1 66 SER HA 4.660 . 7.374 4.254 4.055 4.386 . 0 0 "[ . 1 . 2]" 1
2350 2 65 VAL H 2 66 SER HA 4.660 . 7.374 4.254 4.056 4.386 . 0 0 "[ . 1 . 2]" 1
2351 1 72 SER HB3 1 74 PHE H 3.257 . 4.583 3.522 2.529 4.810 0.227 20 0 "[ . 1 . 2]" 1
2352 2 72 SER HB3 2 74 PHE H 3.257 . 4.583 3.522 2.526 4.810 0.227 20 0 "[ . 1 . 2]" 1
2353 1 55 SER HA 1 56 GLU H 2.554 . 3.369 2.718 2.696 2.745 . 0 0 "[ . 1 . 2]" 1
2354 2 55 SER HA 2 56 GLU H 2.554 . 3.369 2.718 2.696 2.745 . 0 0 "[ . 1 . 2]" 1
2355 1 56 GLU HA 1 59 GLY H 2.463 . 3.222 2.764 2.716 2.821 . 0 0 "[ . 1 . 2]" 1
2356 2 56 GLU HA 2 59 GLY H 2.463 . 3.222 2.764 2.716 2.821 . 0 0 "[ . 1 . 2]" 1
2357 1 55 SER HA 1 58 PHE H 3.847 . 5.697 3.517 3.376 3.666 . 0 0 "[ . 1 . 2]" 1
2358 2 55 SER HA 2 58 PHE H 3.847 . 5.697 3.518 3.378 3.670 . 0 0 "[ . 1 . 2]" 1
2359 1 66 SER QB 1 69 LEU H 4.580 . 7.202 3.828 3.728 3.918 . 0 0 "[ . 1 . 2]" 1
2360 2 66 SER QB 2 69 LEU H 4.580 . 7.202 3.829 3.729 3.918 . 0 0 "[ . 1 . 2]" 1
2361 1 23 ALA HA 1 24 ALA H 2.718 . 3.641 2.682 2.667 2.702 . 0 0 "[ . 1 . 2]" 1
2362 2 23 ALA HA 2 24 ALA H 2.718 . 3.641 2.682 2.666 2.702 . 0 0 "[ . 1 . 2]" 1
2363 1 87 SER QB 1 88 ARG H 3.368 . 4.786 3.332 2.624 3.892 . 0 0 "[ . 1 . 2]" 1
2364 2 87 SER QB 2 88 ARG H 3.368 . 4.786 3.332 2.622 3.894 . 0 0 "[ . 1 . 2]" 1
2365 1 87 SER H 1 87 SER QB 2.753 . 3.701 2.761 2.240 3.326 . 0 0 "[ . 1 . 2]" 1
2366 2 87 SER H 2 87 SER QB 2.753 . 3.701 2.761 2.238 3.322 . 0 0 "[ . 1 . 2]" 1
2367 1 25 LEU H 1 25 LEU HA 2.321 . 2.994 2.519 2.502 2.532 . 0 0 "[ . 1 . 2]" 1
2368 2 25 LEU H 2 25 LEU HA 2.321 . 2.994 2.519 2.503 2.531 . 0 0 "[ . 1 . 2]" 1
2369 1 49 VAL HA 1 52 ASP H 3.319 . 4.696 3.168 2.942 3.400 . 0 0 "[ . 1 . 2]" 1
2370 2 49 VAL HA 2 52 ASP H 3.319 . 4.696 3.169 2.940 3.399 . 0 0 "[ . 1 . 2]" 1
2371 1 47 LEU HA 1 51 MET H 3.244 . 4.560 3.152 3.111 3.179 . 0 0 "[ . 1 . 2]" 1
2372 2 47 LEU HA 2 51 MET H 3.244 . 4.560 3.152 3.110 3.179 . 0 0 "[ . 1 . 2]" 1
2373 1 47 LEU HA 1 50 ALA H 2.458 . 3.213 2.693 2.661 2.710 . 0 0 "[ . 1 . 2]" 1
2374 2 47 LEU HA 2 50 ALA H 2.458 . 3.213 2.693 2.660 2.710 . 0 0 "[ . 1 . 2]" 1
2375 1 50 ALA HA 1 54 ILE H 4.039 . 6.078 3.912 3.674 4.095 . 0 0 "[ . 1 . 2]" 1
2376 1 47 LEU HA 2 54 ILE H 4.039 . 6.078 3.913 3.677 4.096 . 0 0 "[ . 1 . 2]" 1
2377 1 33 ILE HA 1 39 ILE H 4.010 . 6.021 4.620 4.364 4.963 . 0 0 "[ . 1 . 2]" 1
2378 2 33 ILE HA 2 39 ILE H 4.010 . 6.021 4.619 4.362 4.957 . 0 0 "[ . 1 . 2]" 1
2379 1 80 ALA HA 1 84 ASN H 3.767 . 5.541 3.659 3.472 3.779 . 0 0 "[ . 1 . 2]" 1
2380 2 80 ALA HA 2 84 ASN H 3.767 . 5.541 3.659 3.472 3.781 . 0 0 "[ . 1 . 2]" 1
2381 1 21 GLU HA 1 25 LEU H 3.933 . 5.867 3.679 3.529 3.824 . 0 0 "[ . 1 . 2]" 1
2382 1 43 GLY HA2 2 57 ALA H 3.933 . 5.867 3.678 3.524 3.826 . 0 0 "[ . 1 . 2]" 1
2383 1 62 ARG QD 1 62 ARG HE 3.560 . 5.144 2.470 2.379 2.495 . 0 0 "[ . 1 . 2]" 1
2384 2 62 ARG QD 2 62 ARG HE 3.560 . 5.144 2.470 2.380 2.495 . 0 0 "[ . 1 . 2]" 1
2385 1 48 ASN HB2 1 50 ALA H 3.898 . 5.797 3.936 3.627 4.373 . 0 0 "[ . 1 . 2]" 1
2386 1 53 CYS HB2 2 50 ALA H 3.898 . 5.797 3.936 3.637 4.374 . 0 0 "[ . 1 . 2]" 1
2387 1 29 TYR HB3 1 30 PHE H 2.486 . 3.258 2.225 2.182 2.384 . 0 0 "[ . 1 . 2]" 1
2388 2 29 TYR HB3 2 30 PHE H 2.486 . 3.258 2.225 2.181 2.383 . 0 0 "[ . 1 . 2]" 1
2389 1 48 ASN H 1 48 ASN QB 2.383 . 3.093 2.375 2.257 2.426 . 0 0 "[ . 1 . 2]" 1
2390 2 48 ASN H 2 48 ASN QB 2.383 . 3.093 2.374 2.261 2.425 . 0 0 "[ . 1 . 2]" 1
2391 1 47 LEU H 1 48 ASN QB 4.550 . 7.138 4.101 3.810 4.663 . 0 0 "[ . 1 . 2]" 1
2392 1 53 CYS HB3 2 47 LEU H 4.550 . 7.138 4.101 3.795 4.660 . 0 0 "[ . 1 . 2]" 1
2393 1 48 ASN QB 1 49 VAL H 2.686 . 3.588 2.384 2.232 2.570 . 0 0 "[ . 1 . 2]" 1
2394 2 48 ASN QB 2 49 VAL H 2.686 . 3.588 2.383 2.230 2.570 . 0 0 "[ . 1 . 2]" 1
2395 1 48 ASN QB 1 48 ASN HD21 3.226 . 4.527 2.768 2.737 2.796 . 0 0 "[ . 1 . 2]" 1
2396 2 48 ASN QB 2 48 ASN HD21 3.226 . 4.527 2.768 2.738 2.800 . 0 0 "[ . 1 . 2]" 1
2397 1 48 ASN HB3 1 50 ALA H 3.927 . 5.855 3.870 3.342 4.766 . 0 0 "[ . 1 . 2]" 1
2398 1 53 CYS HB3 2 50 ALA H 3.927 . 5.855 3.871 3.331 4.763 . 0 0 "[ . 1 . 2]" 1
2399 1 53 CYS HB3 1 57 ALA H 4.522 . 7.079 4.724 4.512 5.131 . 0 0 "[ . 1 . 2]" 1
2400 2 53 CYS HB3 2 57 ALA H 4.522 . 7.079 4.725 4.510 5.134 . 0 0 "[ . 1 . 2]" 1
2401 1 55 SER HB3 1 58 PHE H 4.761 . 7.595 5.274 5.048 5.484 . 0 0 "[ . 1 . 2]" 1
2402 2 55 SER HB3 2 58 PHE H 4.761 . 7.595 5.275 5.050 5.482 . 0 0 "[ . 1 . 2]" 1
2403 1 84 ASN H 1 84 ASN QB 2.436 . 3.177 2.260 2.219 2.388 . 0 0 "[ . 1 . 2]" 1
2404 2 84 ASN H 2 84 ASN QB 2.436 . 3.177 2.260 2.220 2.388 . 0 0 "[ . 1 . 2]" 1
2405 1 84 ASN QB 1 85 SER H 2.725 . 3.653 2.774 2.437 3.142 . 0 0 "[ . 1 . 2]" 1
2406 2 84 ASN QB 2 85 SER H 2.725 . 3.653 2.775 2.428 3.128 . 0 0 "[ . 1 . 2]" 1
2407 1 84 ASN QB 1 84 ASN HD22 3.035 . 4.187 3.300 3.202 3.478 . 0 0 "[ . 1 . 2]" 1
2408 2 84 ASN QB 2 84 ASN HD22 3.035 . 4.187 3.300 3.202 3.477 . 0 0 "[ . 1 . 2]" 1
2409 1 84 ASN QB 1 84 ASN HD21 3.055 . 4.221 2.298 2.141 2.778 . 0 0 "[ . 1 . 2]" 1
2410 2 84 ASN QB 2 84 ASN HD21 3.055 . 4.221 2.298 2.144 2.777 . 0 0 "[ . 1 . 2]" 1
2411 1 28 ASN H 1 28 ASN QB 2.303 . 2.966 2.252 2.184 2.290 . 0 0 "[ . 1 . 2]" 1
2412 2 28 ASN H 2 28 ASN QB 2.303 . 2.966 2.252 2.183 2.289 . 0 0 "[ . 1 . 2]" 1
2413 1 28 ASN QB 1 28 ASN HD22 3.068 . 4.244 3.281 3.211 3.461 . 0 0 "[ . 1 . 2]" 1
2414 2 28 ASN QB 2 28 ASN HD22 3.068 . 4.244 3.280 3.212 3.461 . 0 0 "[ . 1 . 2]" 1
2415 1 28 ASN QB 1 28 ASN HD21 3.327 . 4.711 2.235 2.152 2.731 . 0 0 "[ . 1 . 2]" 1
2416 2 28 ASN QB 2 28 ASN HD21 3.327 . 4.711 2.234 2.151 2.735 . 0 0 "[ . 1 . 2]" 1
2417 1 20 GLU HG2 1 23 ALA H 2.732 . 6.000 5.341 5.117 5.505 . 0 0 "[ . 1 . 2]" 1
2418 2 20 GLU HG2 2 23 ALA H 2.732 . 6.000 5.342 5.120 5.506 . 0 0 "[ . 1 . 2]" 1
2419 1 20 GLU HG3 1 21 GLU H 2.598 . 3.442 2.418 1.908 3.331 . 0 0 "[ . 1 . 2]" 1
2420 2 20 GLU HG3 2 21 GLU H 2.598 . 3.442 2.418 1.905 3.330 . 0 0 "[ . 1 . 2]" 1
2421 1 61 GLU H 1 61 GLU HB3 2.653 . 3.533 2.654 2.407 3.175 . 0 0 "[ . 1 . 2]" 1
2422 2 61 GLU H 2 61 GLU HB3 2.653 . 3.533 2.654 2.407 3.173 . 0 0 "[ . 1 . 2]" 1
2423 1 61 GLU HB3 1 63 GLU H 2.542 . 3.350 2.531 1.860 3.337 . 0 0 "[ . 1 . 2]" 1
2424 2 61 GLU HB3 2 63 GLU H 2.542 . 3.350 2.531 1.863 3.339 . 0 0 "[ . 1 . 2]" 1
2425 1 61 GLU HB3 1 64 ALA H 3.569 . 5.162 3.554 2.934 4.083 . 0 0 "[ . 1 . 2]" 1
2426 2 61 GLU HB3 2 64 ALA H 3.569 . 5.162 3.555 2.930 4.081 . 0 0 "[ . 1 . 2]" 1
2427 1 20 GLU HB3 1 21 GLU H 2.892 . 3.938 3.145 1.908 3.374 . 0 0 "[ . 1 . 2]" 1
2428 2 20 GLU HB3 2 21 GLU H 2.892 . 3.938 3.145 1.903 3.375 . 0 0 "[ . 1 . 2]" 1
2429 1 90 PRO HB2 1 91 GLU H 2.866 . 3.893 2.726 1.952 3.750 . 0 0 "[ . 1 . 2]" 1
2430 2 90 PRO HB2 2 91 GLU H 2.866 . 3.893 2.727 1.949 3.751 . 0 0 "[ . 1 . 2]" 1
2431 1 38 GLU H 1 38 GLU HB2 2.711 . 3.630 2.553 2.268 2.836 . 0 0 "[ . 1 . 2]" 1
2432 2 38 GLU H 2 38 GLU HB2 2.711 . 3.630 2.553 2.270 2.833 . 0 0 "[ . 1 . 2]" 1
2433 1 38 GLU HB2 1 39 ILE H 3.543 . 5.112 3.534 3.141 3.738 . 0 0 "[ . 1 . 2]" 1
2434 2 38 GLU HB2 2 39 ILE H 3.543 . 5.112 3.534 3.146 3.739 . 0 0 "[ . 1 . 2]" 1
2435 1 33 ILE H 1 34 VAL HB 4.068 . 6.137 4.988 4.758 5.243 . 0 0 "[ . 1 . 2]" 1
2436 2 33 ILE H 2 34 VAL HB 4.068 . 6.137 4.989 4.758 5.246 . 0 0 "[ . 1 . 2]" 1
2437 1 34 VAL HB 1 37 LYS H 4.539 . 7.115 4.504 4.362 4.714 . 0 0 "[ . 1 . 2]" 1
2438 2 34 VAL HB 2 37 LYS H 4.539 . 7.115 4.505 4.362 4.718 . 0 0 "[ . 1 . 2]" 1
2439 1 63 GLU HB2 1 64 ALA H 3.759 . 5.525 3.515 3.188 3.972 . 0 0 "[ . 1 . 2]" 1
2440 2 63 GLU HB2 2 64 ALA H 3.759 . 5.525 3.515 3.187 3.973 . 0 0 "[ . 1 . 2]" 1
2441 1 63 GLU H 1 63 GLU QB 2.625 . 3.486 2.432 2.197 2.709 . 0 0 "[ . 1 . 2]" 1
2442 2 63 GLU H 2 63 GLU QB 2.625 . 3.486 2.432 2.194 2.708 . 0 0 "[ . 1 . 2]" 1
2443 1 19 LYS H 1 19 LYS HB2 3.322 . 4.702 2.423 2.142 3.294 . 0 0 "[ . 1 . 2]" 1
2444 2 19 LYS H 2 19 LYS HB2 3.322 . 4.702 2.424 2.144 3.293 . 0 0 "[ . 1 . 2]" 1
2445 1 33 ILE HB 1 39 ILE H 4.593 . 7.230 4.552 4.051 4.787 . 0 0 "[ . 1 . 2]" 1
2446 2 33 ILE HB 2 39 ILE H 4.593 . 7.230 4.551 4.054 4.788 . 0 0 "[ . 1 . 2]" 1
2447 1 32 SER H 1 33 ILE HB 4.295 . 6.601 4.406 4.150 4.586 . 0 0 "[ . 1 . 2]" 1
2448 2 32 SER H 2 33 ILE HB 4.295 . 6.601 4.406 4.148 4.583 . 0 0 "[ . 1 . 2]" 1
2449 1 41 GLU H 1 41 GLU QB 2.408 . 3.133 2.525 2.441 2.620 . 0 0 "[ . 1 . 2]" 1
2450 2 41 GLU H 2 41 GLU QB 2.408 . 3.133 2.525 2.437 2.620 . 0 0 "[ . 1 . 2]" 1
2451 1 41 GLU QB 1 42 ASP H 2.371 . 3.074 2.493 2.232 3.158 0.084 12 0 "[ . 1 . 2]" 1
2452 2 41 GLU QB 2 42 ASP H 2.371 . 3.074 2.493 2.237 3.158 0.084 12 0 "[ . 1 . 2]" 1
2453 1 15 MET QB 1 16 SER H 2.486 . 3.259 2.699 1.828 3.579 0.320 8 0 "[ . 1 . 2]" 1
2454 2 15 MET QB 2 16 SER H 2.486 . 3.259 2.697 1.828 3.576 0.317 8 0 "[ . 1 . 2]" 1
2455 1 15 MET H 1 15 MET QB 2.466 . 3.226 2.863 2.313 3.360 0.134 10 0 "[ . 1 . 2]" 1
2456 2 15 MET H 2 15 MET QB 2.466 . 3.226 2.863 2.313 3.359 0.133 10 0 "[ . 1 . 2]" 1
2457 1 62 ARG H 1 62 ARG QB 2.639 . 3.510 2.327 2.198 2.663 . 0 0 "[ . 1 . 2]" 1
2458 2 62 ARG H 2 62 ARG QB 2.639 . 3.510 2.326 2.196 2.665 . 0 0 "[ . 1 . 2]" 1
2459 1 61 GLU HB2 1 63 GLU H 2.537 . 3.341 2.856 2.347 3.280 . 0 0 "[ . 1 . 2]" 1
2460 2 61 GLU HB2 2 63 GLU H 2.537 . 3.341 2.856 2.340 3.285 . 0 0 "[ . 1 . 2]" 1
2461 1 19 LYS H 1 19 LYS HD2 3.526 . 5.080 3.415 3.272 3.506 . 0 0 "[ . 1 . 2]" 1
2462 2 19 LYS H 2 19 LYS HD2 3.526 . 5.080 3.416 3.273 3.507 . 0 0 "[ . 1 . 2]" 1
2463 1 36 LYS HB2 1 39 ILE H 4.893 . 7.885 4.939 4.608 5.219 . 0 0 "[ . 1 . 2]" 1
2464 1 19 LYS HD3 2 39 ILE H 4.893 . 7.885 4.941 4.604 5.220 . 0 0 "[ . 1 . 2]" 1
2465 1 77 GLN QB 1 78 HIS H 2.477 . 3.244 2.562 1.718 3.264 0.020 2 0 "[ . 1 . 2]" 1
2466 2 77 GLN QB 2 78 HIS H 2.477 . 3.244 2.562 1.717 3.266 0.022 2 0 "[ . 1 . 2]" 1
2467 1 77 GLN H 1 77 GLN QB 2.932 . 4.006 2.702 2.051 3.417 . 0 0 "[ . 1 . 2]" 1
2468 2 77 GLN H 2 77 GLN QB 2.932 . 4.006 2.702 2.049 3.417 . 0 0 "[ . 1 . 2]" 1
2469 1 19 LYS H 1 19 LYS HB3 2.943 . 4.026 2.887 2.513 3.036 . 0 0 "[ . 1 . 2]" 1
2470 2 19 LYS H 2 19 LYS HB3 2.943 . 4.026 2.887 2.512 3.036 . 0 0 "[ . 1 . 2]" 1
2471 1 90 PRO HB3 1 91 GLU H 2.657 . 3.540 3.019 2.487 3.485 . 0 0 "[ . 1 . 2]" 1
2472 2 90 PRO HB3 2 91 GLU H 2.657 . 3.540 3.019 2.486 3.486 . 0 0 "[ . 1 . 2]" 1
2473 1 19 LYS H 1 19 LYS HB3 2.657 . 3.540 3.058 2.566 3.271 . 0 0 "[ . 1 . 2]" 1
2474 2 19 LYS H 2 19 LYS HB3 2.657 . 3.540 3.059 2.565 3.271 . 0 0 "[ . 1 . 2]" 1
2475 1 75 LYS H 1 75 LYS HB3 3.108 . 4.316 2.903 1.599 3.830 0.301 18 0 "[ . 1 . 2]" 1
2476 2 75 LYS H 2 75 LYS HB3 3.108 . 4.316 2.903 1.599 3.828 0.301 18 0 "[ . 1 . 2]" 1
2477 1 73 GLU QG 1 74 PHE H 4.755 . 7.582 3.702 2.385 4.246 . 0 0 "[ . 1 . 2]" 1
2478 2 73 GLU QG 2 74 PHE H 4.755 . 7.582 3.702 2.380 4.248 . 0 0 "[ . 1 . 2]" 1
2479 1 36 LYS HB3 1 38 GLU H 3.682 . 5.377 4.910 3.810 5.306 . 0 0 "[ . 1 . 2]" 1
2480 2 36 LYS HB3 2 38 GLU H 3.682 . 5.377 4.910 3.810 5.307 . 0 0 "[ . 1 . 2]" 1
2481 1 36 LYS HB3 1 37 LYS H 3.993 . 5.986 4.162 3.675 4.391 . 0 0 "[ . 1 . 2]" 1
2482 2 36 LYS HB3 2 37 LYS H 3.993 . 5.986 4.162 3.676 4.391 . 0 0 "[ . 1 . 2]" 1
2483 1 36 LYS HB3 1 39 ILE H 4.789 . 7.656 5.527 3.628 6.247 . 0 0 "[ . 1 . 2]" 1
2484 2 36 LYS HB3 2 39 ILE H 4.789 . 7.656 5.528 3.627 6.244 . 0 0 "[ . 1 . 2]" 1
2485 1 62 ARG HG3 1 63 GLU H 3.925 . 5.851 3.767 2.789 4.007 . 0 0 "[ . 1 . 2]" 1
2486 2 62 ARG HG3 2 63 GLU H 3.925 . 5.851 3.767 2.795 4.005 . 0 0 "[ . 1 . 2]" 1
2487 1 19 LYS HG3 1 21 GLU H 4.672 . 7.401 4.530 4.149 4.766 . 0 0 "[ . 1 . 2]" 1
2488 2 19 LYS HG3 2 21 GLU H 4.672 . 7.401 4.530 4.153 4.767 . 0 0 "[ . 1 . 2]" 1
2489 1 64 ALA MB 1 68 ILE H 4.085 . 6.171 3.800 3.601 4.001 . 0 0 "[ . 1 . 2]" 1
2490 2 64 ALA MB 2 68 ILE H 4.085 . 6.171 3.800 3.599 3.999 . 0 0 "[ . 1 . 2]" 1
2491 1 36 LYS HG3 1 37 LYS H 3.252 . 4.574 2.781 2.668 2.938 . 0 0 "[ . 1 . 2]" 1
2492 2 36 LYS HG3 2 37 LYS H 3.252 . 4.574 2.781 2.668 2.942 . 0 0 "[ . 1 . 2]" 1
2493 1 88 ARG H 1 88 ARG QG 2.812 . 3.800 2.801 2.113 3.467 . 0 0 "[ . 1 . 2]" 1
2494 2 88 ARG H 2 88 ARG QG 2.812 . 3.800 2.800 2.115 3.465 . 0 0 "[ . 1 . 2]" 1
2495 1 88 ARG QG 1 89 VAL H 3.354 . 4.760 4.101 3.459 4.739 . 0 0 "[ . 1 . 2]" 1
2496 2 88 ARG QG 2 89 VAL H 3.354 . 4.760 4.102 3.461 4.744 . 0 0 "[ . 1 . 2]" 1
2497 1 80 ALA MB 1 84 ASN H 4.286 . 6.582 3.940 3.843 4.073 . 0 0 "[ . 1 . 2]" 1
2498 2 80 ALA MB 2 84 ASN H 4.286 . 6.582 3.941 3.843 4.077 . 0 0 "[ . 1 . 2]" 1
2499 1 50 ALA MB 1 52 ASP H 4.353 . 6.722 4.507 4.332 4.709 . 0 0 "[ . 1 . 2]" 1
2500 1 50 ALA MB 2 52 ASP H 4.353 . 6.722 4.507 4.336 4.708 . 0 0 "[ . 1 . 2]" 1
2501 1 71 LYS H 1 71 LYS QG 3.071 . 4.250 3.381 1.943 4.130 . 0 0 "[ . 1 . 2]" 1
2502 2 71 LYS H 2 71 LYS QG 3.071 . 4.250 3.381 1.944 4.129 . 0 0 "[ . 1 . 2]" 1
2503 1 50 ALA MB 1 54 ILE H 3.594 . 5.209 3.448 3.238 3.822 . 0 0 "[ . 1 . 2]" 1
2504 1 50 ALA MB 2 54 ILE H 3.594 . 5.209 3.449 3.233 3.820 . 0 0 "[ . 1 . 2]" 1
2505 1 50 ALA MB 1 53 CYS H 3.850 . 5.703 3.905 3.770 4.237 . 0 0 "[ . 1 . 2]" 1
2506 1 50 ALA MB 2 53 CYS H 3.850 . 5.703 3.905 3.767 4.242 . 0 0 "[ . 1 . 2]" 1
2507 1 44 ALA MB 1 48 ASN H 3.791 . 5.587 3.853 3.796 3.910 . 0 0 "[ . 1 . 2]" 1
2508 2 44 ALA MB 2 48 ASN H 3.791 . 5.587 3.853 3.796 3.909 . 0 0 "[ . 1 . 2]" 1
2509 1 44 ALA MB 1 46 SER H 3.836 . 5.675 4.050 3.941 4.180 . 0 0 "[ . 1 . 2]" 1
2510 2 44 ALA MB 2 46 SER H 3.836 . 5.675 4.050 3.943 4.180 . 0 0 "[ . 1 . 2]" 1
2511 1 36 LYS HG2 1 38 GLU H 3.785 . 5.575 3.533 3.128 3.955 . 0 0 "[ . 1 . 2]" 1
2512 2 36 LYS HG2 2 38 GLU H 3.785 . 5.575 3.533 3.126 3.957 . 0 0 "[ . 1 . 2]" 1
2513 1 36 LYS HG2 1 37 LYS H 3.048 . 4.209 3.455 2.914 3.895 . 0 0 "[ . 1 . 2]" 1
2514 2 36 LYS HG2 2 37 LYS H 3.048 . 4.209 3.456 2.916 3.892 . 0 0 "[ . 1 . 2]" 1
2515 1 69 LEU H 1 69 LEU QD 3.676 . 5.365 3.100 3.034 3.187 . 0 0 "[ . 1 . 2]" 1
2516 2 69 LEU H 2 69 LEU QD 3.676 . 5.365 3.100 3.033 3.188 . 0 0 "[ . 1 . 2]" 1
2517 1 69 LEU QD 1 70 GLY H 4.754 . 7.579 4.241 4.073 4.388 . 0 0 "[ . 1 . 2]" 1
2518 2 69 LEU QD 2 70 GLY H 4.754 . 7.579 4.242 4.074 4.391 . 0 0 "[ . 1 . 2]" 1
2519 1 25 LEU H 1 25 LEU MD2 3.272 . 4.610 3.460 3.274 3.617 . 0 0 "[ . 1 . 2]" 1
2520 2 25 LEU H 2 25 LEU MD2 3.272 . 4.610 3.459 3.275 3.617 . 0 0 "[ . 1 . 2]" 1
2521 1 82 ILE H 1 83 LEU MD1 4.129 . 6.260 3.971 3.815 4.132 . 0 0 "[ . 1 . 2]" 1
2522 1 83 LEU MD1 2 82 ILE H 4.129 . 6.260 3.972 3.817 4.132 . 0 0 "[ . 1 . 2]" 1
2523 1 83 LEU QD 1 84 ASN H 4.053 . 6.107 3.941 3.878 4.004 . 0 0 "[ . 1 . 2]" 1
2524 2 83 LEU QD 2 84 ASN H 4.053 . 6.107 3.941 3.877 4.003 . 0 0 "[ . 1 . 2]" 1
2525 1 57 ALA H 2 39 ILE MD 4.040 . 6.081 4.347 4.199 4.491 . 0 0 "[ . 1 . 2]" 1
2526 1 39 ILE MD 2 57 ALA H 4.040 . 6.081 4.347 4.202 4.482 . 0 0 "[ . 1 . 2]" 1
2527 1 41 GLU QB 1 44 ALA H 4.668 . 7.392 4.807 4.614 4.973 . 0 0 "[ . 1 . 2]" 1
2528 2 41 GLU QB 2 44 ALA H 4.668 . 7.392 4.807 4.612 4.979 . 0 0 "[ . 1 . 2]" 1
2529 1 83 LEU QD 1 86 ALA H 4.443 . 6.910 4.836 4.520 5.234 . 0 0 "[ . 1 . 2]" 1
2530 1 83 LEU MD1 2 86 ALA H 4.443 . 6.910 4.839 4.523 5.242 . 0 0 "[ . 1 . 2]" 1
2531 1 82 ILE HA 1 86 ALA H 4.423 . 6.869 4.805 4.090 5.238 . 0 0 "[ . 1 . 2]" 1
2532 1 82 ILE HA 2 86 ALA H 4.423 . 6.869 4.811 4.090 5.247 . 0 0 "[ . 1 . 2]" 1
2533 1 85 SER H 1 86 ALA MB 4.531 . 7.098 4.015 3.891 4.167 . 0 0 "[ . 1 . 2]" 1
2534 1 86 ALA MB 2 85 SER H 4.531 . 7.098 4.014 3.883 4.166 . 0 0 "[ . 1 . 2]" 1
2535 1 62 ARG HA 1 67 GLY H 4.502 . 7.035 6.514 6.294 6.653 . 0 0 "[ . 1 . 2]" 1
2536 2 62 ARG HA 2 67 GLY H 4.502 . 7.035 6.513 6.294 6.651 . 0 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 124
_Distance_constraint_stats_list.Viol_count 135
_Distance_constraint_stats_list.Viol_total 102.415
_Distance_constraint_stats_list.Viol_max 0.175
_Distance_constraint_stats_list.Viol_rms 0.0117
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0021
_Distance_constraint_stats_list.Viol_average_violations_only 0.0379
_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 20 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 GLU 0.843 0.175 12 0 "[ . 1 . 2]"
1 22 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ALA 0.026 0.016 6 0 "[ . 1 . 2]"
1 24 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 LEU 0.843 0.175 12 0 "[ . 1 . 2]"
1 26 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 VAL 0.026 0.016 6 0 "[ . 1 . 2]"
1 28 ASN 0.086 0.086 13 0 "[ . 1 . 2]"
1 29 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 SER 0.086 0.086 13 0 "[ . 1 . 2]"
1 33 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLU 0.007 0.005 4 0 "[ . 1 . 2]"
1 42 ASP 0.061 0.061 2 0 "[ . 1 . 2]"
1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 ALA 0.217 0.078 14 0 "[ . 1 . 2]"
1 45 ASP 0.326 0.094 11 0 "[ . 1 . 2]"
1 46 SER 0.061 0.061 2 0 "[ . 1 . 2]"
1 47 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ASN 0.718 0.110 2 0 "[ . 1 . 2]"
1 49 VAL 0.372 0.094 11 0 "[ . 1 . 2]"
1 50 ALA 0.291 0.049 6 0 "[ . 1 . 2]"
1 51 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ASP 0.516 0.110 2 0 "[ . 1 . 2]"
1 53 CYS 0.052 0.036 18 0 "[ . 1 . 2]"
1 54 ILE 0.291 0.049 6 0 "[ . 1 . 2]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLU 0.014 0.014 2 0 "[ . 1 . 2]"
1 64 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 HIS 0.053 0.031 18 0 "[ . 1 . 2]"
1 79 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ALA 0.053 0.050 14 0 "[ . 1 . 2]"
1 81 ASP 0.272 0.114 8 0 "[ . 1 . 2]"
1 82 ILE 0.053 0.031 18 0 "[ . 1 . 2]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ASN 0.053 0.050 14 0 "[ . 1 . 2]"
1 85 SER 0.272 0.114 8 0 "[ . 1 . 2]"
2 20 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 21 GLU 0.592 0.132 12 0 "[ . 1 . 2]"
2 22 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 23 ALA 0.021 0.015 6 0 "[ . 1 . 2]"
2 24 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 25 LEU 0.592 0.132 12 0 "[ . 1 . 2]"
2 26 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 27 VAL 0.021 0.015 6 0 "[ . 1 . 2]"
2 28 ASN 0.064 0.064 13 0 "[ . 1 . 2]"
2 29 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
2 30 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
2 31 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 32 SER 0.300 0.066 12 0 "[ . 1 . 2]"
2 33 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 34 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 35 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 36 LYS 0.236 0.066 12 0 "[ . 1 . 2]"
2 41 GLU 0.006 0.003 4 0 "[ . 1 . 2]"
2 42 ASP 0.046 0.046 2 0 "[ . 1 . 2]"
2 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 44 ALA 0.139 0.054 14 0 "[ . 1 . 2]"
2 45 ASP 0.248 0.079 11 0 "[ . 1 . 2]"
2 46 SER 0.046 0.046 2 0 "[ . 1 . 2]"
2 47 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 48 ASN 0.495 0.084 2 0 "[ . 1 . 2]"
2 49 VAL 0.275 0.079 11 0 "[ . 1 . 2]"
2 50 ALA 0.241 0.042 20 0 "[ . 1 . 2]"
2 51 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 52 ASP 0.364 0.084 2 0 "[ . 1 . 2]"
2 53 CYS 0.101 0.038 4 0 "[ . 1 . 2]"
2 54 ILE 0.242 0.042 20 0 "[ . 1 . 2]"
2 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 56 GLU 0.009 0.009 2 0 "[ . 1 . 2]"
2 57 ALA 0.068 0.038 4 0 "[ . 1 . 2]"
2 58 PHE 0.001 0.001 2 0 "[ . 1 . 2]"
2 64 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
2 65 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
2 68 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
2 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 78 HIS 0.044 0.025 18 0 "[ . 1 . 2]"
2 79 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 80 ALA 0.046 0.035 14 0 "[ . 1 . 2]"
2 81 ASP 0.180 0.078 8 0 "[ . 1 . 2]"
2 82 ILE 0.044 0.025 18 0 "[ . 1 . 2]"
2 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 84 ASN 0.046 0.035 14 0 "[ . 1 . 2]"
2 85 SER 0.180 0.078 8 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 2 20 GLU O 2 24 ALA H 2.300 . 2.500 2.071 1.948 2.230 . 0 0 "[ . 1 . 2]" 2
2 2 20 GLU O 2 24 ALA N 3.300 2.500 3.500 2.924 2.791 3.079 . 0 0 "[ . 1 . 2]" 2
3 2 21 GLU O 2 25 LEU H 2.300 . 2.500 2.400 1.934 2.632 0.132 12 0 "[ . 1 . 2]" 2
4 2 21 GLU O 2 25 LEU N 3.300 2.500 3.500 3.317 2.871 3.566 0.066 9 0 "[ . 1 . 2]" 2
5 2 22 ILE O 2 26 ILE H 2.300 . 2.500 2.017 1.856 2.202 . 0 0 "[ . 1 . 2]" 2
6 2 22 ILE O 2 26 ILE N 3.300 2.500 3.500 2.932 2.772 3.103 . 0 0 "[ . 1 . 2]" 2
7 2 23 ALA O 2 27 VAL H 2.300 . 2.500 1.853 1.785 1.952 0.015 6 0 "[ . 1 . 2]" 2
8 2 23 ALA O 2 27 VAL N 3.300 2.500 3.500 2.834 2.768 2.930 . 0 0 "[ . 1 . 2]" 2
9 2 24 ALA O 2 28 ASN H 2.300 . 2.500 2.116 1.967 2.439 . 0 0 "[ . 1 . 2]" 2
10 2 24 ALA O 2 28 ASN N 3.300 2.500 3.500 2.974 2.853 3.245 . 0 0 "[ . 1 . 2]" 2
11 2 25 LEU O 2 29 TYR H 2.300 . 2.500 1.956 1.833 2.257 . 0 0 "[ . 1 . 2]" 2
12 2 25 LEU O 2 29 TYR N 3.300 2.500 3.500 2.852 2.737 3.143 . 0 0 "[ . 1 . 2]" 2
13 2 26 ILE O 2 30 PHE H 2.300 . 2.500 2.181 1.966 2.426 . 0 0 "[ . 1 . 2]" 2
14 2 26 ILE O 2 30 PHE N 3.300 2.500 3.500 3.151 2.933 3.391 . 0 0 "[ . 1 . 2]" 2
15 2 27 VAL O 2 31 SER H 2.300 . 2.500 1.935 1.836 2.015 . 0 0 "[ . 1 . 2]" 2
16 2 27 VAL O 2 31 SER N 3.300 2.500 3.500 2.858 2.743 2.945 . 0 0 "[ . 1 . 2]" 2
17 2 28 ASN O 2 32 SER H 2.300 . 2.500 2.046 1.826 2.564 0.064 13 0 "[ . 1 . 2]" 2
18 2 28 ASN O 2 32 SER N 3.300 2.500 3.500 2.887 2.742 3.413 . 0 0 "[ . 1 . 2]" 2
19 2 29 TYR O 2 33 ILE H 2.300 . 2.500 2.122 1.923 2.362 . 0 0 "[ . 1 . 2]" 2
20 2 29 TYR O 2 33 ILE N 3.300 2.500 3.500 2.982 2.837 3.242 . 0 0 "[ . 1 . 2]" 2
21 2 30 PHE O 2 34 VAL H 2.300 . 2.500 2.272 2.075 2.497 . 0 0 "[ . 1 . 2]" 2
22 2 30 PHE O 2 34 VAL N 3.300 2.500 3.500 3.220 3.028 3.445 . 0 0 "[ . 1 . 2]" 2
23 2 31 SER O 2 35 GLU H 2.300 . 2.500 2.110 1.925 2.430 . 0 0 "[ . 1 . 2]" 2
24 2 31 SER O 2 35 GLU N 3.300 2.500 3.500 2.891 2.750 3.169 . 0 0 "[ . 1 . 2]" 2
25 2 32 SER O 2 36 LYS H 2.300 . 2.500 2.256 1.869 2.566 0.066 12 0 "[ . 1 . 2]" 2
26 2 32 SER O 2 36 LYS N 3.300 2.500 3.500 3.202 2.849 3.536 0.036 9 0 "[ . 1 . 2]" 2
27 2 41 GLU O 2 45 ASP H 2.300 . 2.500 2.062 1.797 2.503 0.003 4 0 "[ . 1 . 2]" 2
28 2 41 GLU O 2 45 ASP N 3.300 2.500 3.500 2.999 2.719 3.430 . 0 0 "[ . 1 . 2]" 2
29 2 42 ASP O 2 46 SER H 2.300 . 2.500 2.104 1.876 2.546 0.046 2 0 "[ . 1 . 2]" 2
30 2 42 ASP O 2 46 SER N 3.300 2.500 3.500 3.010 2.760 3.459 . 0 0 "[ . 1 . 2]" 2
31 2 43 GLY O 2 47 LEU H 2.300 . 2.500 2.028 1.896 2.257 . 0 0 "[ . 1 . 2]" 2
32 2 43 GLY O 2 47 LEU N 3.300 2.500 3.500 2.919 2.818 3.166 . 0 0 "[ . 1 . 2]" 2
33 2 44 ALA O 2 48 ASN H 2.300 . 2.500 2.351 2.123 2.554 0.054 14 0 "[ . 1 . 2]" 2
34 2 44 ALA O 2 48 ASN N 3.300 2.500 3.500 3.089 2.864 3.283 . 0 0 "[ . 1 . 2]" 2
35 2 45 ASP O 2 49 VAL H 2.300 . 2.500 2.401 2.074 2.579 0.079 11 0 "[ . 1 . 2]" 2
36 2 45 ASP O 2 49 VAL N 3.300 2.500 3.500 3.345 3.035 3.517 0.017 11 0 "[ . 1 . 2]" 2
37 2 46 SER O 2 50 ALA H 2.300 . 2.500 2.150 2.005 2.317 . 0 0 "[ . 1 . 2]" 2
38 2 46 SER O 2 50 ALA N 3.300 2.500 3.500 3.070 2.924 3.256 . 0 0 "[ . 1 . 2]" 2
39 2 47 LEU O 2 51 MET H 2.300 . 2.500 1.998 1.907 2.093 . 0 0 "[ . 1 . 2]" 2
40 2 47 LEU O 2 51 MET N 3.300 2.500 3.500 2.782 2.715 2.890 . 0 0 "[ . 1 . 2]" 2
41 2 48 ASN O 2 52 ASP H 2.300 . 2.500 2.374 2.103 2.584 0.084 2 0 "[ . 1 . 2]" 2
42 2 48 ASN O 2 52 ASP N 3.300 2.500 3.500 3.312 3.034 3.513 0.013 17 0 "[ . 1 . 2]" 2
43 2 49 VAL O 2 53 CYS H 2.300 . 2.500 2.302 1.963 2.522 0.022 18 0 "[ . 1 . 2]" 2
44 2 49 VAL O 2 53 CYS N 3.300 2.500 3.500 3.210 2.863 3.482 . 0 0 "[ . 1 . 2]" 2
45 2 50 ALA O 2 54 ILE H 2.300 . 2.500 1.806 1.758 1.922 0.042 20 0 "[ . 1 . 2]" 2
46 2 50 ALA O 2 54 ILE N 3.300 2.500 3.500 2.756 2.706 2.850 . 0 0 "[ . 1 . 2]" 2
47 2 51 MET O 2 55 SER H 2.300 . 2.500 2.018 1.864 2.225 . 0 0 "[ . 1 . 2]" 2
48 2 51 MET O 2 55 SER N 3.300 2.500 3.500 2.980 2.828 3.186 . 0 0 "[ . 1 . 2]" 2
49 2 52 ASP O 2 56 GLU H 2.300 . 2.500 1.934 1.791 2.212 0.009 2 0 "[ . 1 . 2]" 2
50 2 52 ASP O 2 56 GLU N 3.300 2.500 3.500 2.867 2.734 3.131 . 0 0 "[ . 1 . 2]" 2
51 2 53 CYS O 2 57 ALA H 2.300 . 2.500 1.935 1.762 2.276 0.038 4 0 "[ . 1 . 2]" 2
52 2 53 CYS O 2 57 ALA N 3.300 2.500 3.500 2.810 2.712 3.010 . 0 0 "[ . 1 . 2]" 2
53 2 54 ILE O 2 58 PHE H 2.300 . 2.500 2.239 1.993 2.501 0.001 2 0 "[ . 1 . 2]" 2
54 2 54 ILE O 2 58 PHE N 3.300 2.500 3.500 3.155 2.967 3.370 . 0 0 "[ . 1 . 2]" 2
55 2 64 ALA O 2 68 ILE H 2.300 . 2.500 2.072 1.856 2.326 . 0 0 "[ . 1 . 2]" 2
56 2 64 ALA O 2 68 ILE N 3.300 2.500 3.500 3.014 2.824 3.243 . 0 0 "[ . 1 . 2]" 2
57 2 65 VAL O 2 69 LEU H 2.300 . 2.500 1.914 1.835 2.052 . 0 0 "[ . 1 . 2]" 2
58 2 65 VAL O 2 69 LEU N 3.300 2.500 3.500 2.878 2.794 3.012 . 0 0 "[ . 1 . 2]" 2
59 2 78 HIS O 2 82 ILE H 2.300 . 2.500 2.161 1.874 2.525 0.025 18 0 "[ . 1 . 2]" 2
60 2 78 HIS O 2 82 ILE N 3.300 2.500 3.500 3.103 2.829 3.457 . 0 0 "[ . 1 . 2]" 2
61 2 79 LEU O 2 83 LEU H 2.300 . 2.500 2.022 1.871 2.347 . 0 0 "[ . 1 . 2]" 2
62 2 79 LEU O 2 83 LEU N 3.300 2.500 3.500 2.967 2.834 3.284 . 0 0 "[ . 1 . 2]" 2
63 2 80 ALA O 2 84 ASN H 2.300 . 2.500 1.902 1.765 2.177 0.035 14 0 "[ . 1 . 2]" 2
64 2 80 ALA O 2 84 ASN N 3.300 2.500 3.500 2.785 2.671 3.017 . 0 0 "[ . 1 . 2]" 2
65 2 81 ASP O 2 85 SER H 2.300 . 2.500 2.353 1.956 2.578 0.078 8 0 "[ . 1 . 2]" 2
66 2 81 ASP O 2 85 SER N 3.300 2.500 3.500 3.129 2.839 3.440 . 0 0 "[ . 1 . 2]" 2
67 1 20 GLU O 1 24 ALA H 2.300 . 2.500 2.071 1.952 2.228 . 0 0 "[ . 1 . 2]" 2
68 1 20 GLU O 1 24 ALA N 3.300 2.500 3.500 2.924 2.791 3.081 . 0 0 "[ . 1 . 2]" 2
69 1 21 GLU O 1 25 LEU H 2.300 . 2.500 2.409 1.933 2.675 0.175 12 0 "[ . 1 . 2]" 2
70 1 21 GLU O 1 25 LEU N 3.300 2.500 3.500 3.323 2.869 3.604 0.104 9 0 "[ . 1 . 2]" 2
71 1 22 ILE O 1 26 ILE H 2.300 . 2.500 2.018 1.854 2.203 . 0 0 "[ . 1 . 2]" 2
72 1 22 ILE O 1 26 ILE N 3.300 2.500 3.500 2.933 2.771 3.106 . 0 0 "[ . 1 . 2]" 2
73 1 23 ALA O 1 27 VAL H 2.300 . 2.500 1.853 1.784 1.951 0.016 6 0 "[ . 1 . 2]" 2
74 1 23 ALA O 1 27 VAL N 3.300 2.500 3.500 2.833 2.768 2.930 . 0 0 "[ . 1 . 2]" 2
75 1 24 ALA O 1 28 ASN H 2.300 . 2.500 2.116 1.968 2.440 . 0 0 "[ . 1 . 2]" 2
76 1 24 ALA O 1 28 ASN N 3.300 2.500 3.500 2.973 2.853 3.245 . 0 0 "[ . 1 . 2]" 2
77 1 25 LEU O 1 29 TYR H 2.300 . 2.500 1.956 1.835 2.254 . 0 0 "[ . 1 . 2]" 2
78 1 25 LEU O 1 29 TYR N 3.300 2.500 3.500 2.851 2.740 3.141 . 0 0 "[ . 1 . 2]" 2
79 1 26 ILE O 1 30 PHE H 2.300 . 2.500 2.182 1.967 2.427 . 0 0 "[ . 1 . 2]" 2
80 1 26 ILE O 1 30 PHE N 3.300 2.500 3.500 3.151 2.934 3.392 . 0 0 "[ . 1 . 2]" 2
81 1 27 VAL O 1 31 SER H 2.300 . 2.500 1.935 1.837 2.016 . 0 0 "[ . 1 . 2]" 2
82 1 27 VAL O 1 31 SER N 3.300 2.500 3.500 2.859 2.743 2.947 . 0 0 "[ . 1 . 2]" 2
83 1 28 ASN O 1 32 SER H 2.300 . 2.500 2.047 1.824 2.586 0.086 13 0 "[ . 1 . 2]" 2
84 1 28 ASN O 1 32 SER N 3.300 2.500 3.500 2.887 2.740 3.431 . 0 0 "[ . 1 . 2]" 2
85 1 29 TYR O 1 33 ILE H 2.300 . 2.500 2.122 1.923 2.362 . 0 0 "[ . 1 . 2]" 2
86 1 29 TYR O 1 33 ILE N 3.300 2.500 3.500 2.982 2.838 3.242 . 0 0 "[ . 1 . 2]" 2
87 1 30 PHE O 1 34 VAL H 2.300 . 2.500 2.271 2.070 2.499 . 0 0 "[ . 1 . 2]" 2
88 1 30 PHE O 1 34 VAL N 3.300 2.500 3.500 3.219 3.028 3.446 . 0 0 "[ . 1 . 2]" 2
89 1 41 GLU O 1 45 ASP H 2.300 . 2.500 2.061 1.795 2.501 0.005 4 0 "[ . 1 . 2]" 2
90 1 41 GLU O 1 45 ASP N 3.300 2.500 3.500 2.997 2.716 3.427 . 0 0 "[ . 1 . 2]" 2
91 1 42 ASP O 1 46 SER H 2.300 . 2.500 2.105 1.875 2.561 0.061 2 0 "[ . 1 . 2]" 2
92 1 42 ASP O 1 46 SER N 3.300 2.500 3.500 3.010 2.761 3.470 . 0 0 "[ . 1 . 2]" 2
93 1 43 GLY O 1 47 LEU H 2.300 . 2.500 2.029 1.898 2.255 . 0 0 "[ . 1 . 2]" 2
94 1 43 GLY O 1 47 LEU N 3.300 2.500 3.500 2.920 2.818 3.165 . 0 0 "[ . 1 . 2]" 2
95 1 44 ALA O 1 48 ASN H 2.300 . 2.500 2.354 2.123 2.578 0.078 14 0 "[ . 1 . 2]" 2
96 1 44 ALA O 1 48 ASN N 3.300 2.500 3.500 3.091 2.863 3.296 . 0 0 "[ . 1 . 2]" 2
97 1 45 ASP O 1 49 VAL H 2.300 . 2.500 2.402 2.081 2.594 0.094 11 0 "[ . 1 . 2]" 2
98 1 45 ASP O 1 49 VAL N 3.300 2.500 3.500 3.346 3.038 3.529 0.029 11 0 "[ . 1 . 2]" 2
99 1 46 SER O 1 50 ALA H 2.300 . 2.500 2.149 2.005 2.314 . 0 0 "[ . 1 . 2]" 2
100 1 46 SER O 1 50 ALA N 3.300 2.500 3.500 3.069 2.924 3.256 . 0 0 "[ . 1 . 2]" 2
101 1 47 LEU O 1 51 MET H 2.300 . 2.500 1.998 1.902 2.091 . 0 0 "[ . 1 . 2]" 2
102 1 47 LEU O 1 51 MET N 3.300 2.500 3.500 2.783 2.719 2.889 . 0 0 "[ . 1 . 2]" 2
103 1 48 ASN O 1 52 ASP H 2.300 . 2.500 2.379 2.106 2.610 0.110 2 0 "[ . 1 . 2]" 2
104 1 48 ASN O 1 52 ASP N 3.300 2.500 3.500 3.316 3.038 3.531 0.031 2 0 "[ . 1 . 2]" 2
105 1 49 VAL O 1 53 CYS H 2.300 . 2.500 2.302 1.966 2.536 0.036 18 0 "[ . 1 . 2]" 2
106 1 49 VAL O 1 53 CYS N 3.300 2.500 3.500 3.210 2.863 3.495 . 0 0 "[ . 1 . 2]" 2
107 1 50 ALA O 1 54 ILE H 2.300 . 2.500 1.803 1.751 1.926 0.049 6 0 "[ . 1 . 2]" 2
108 1 50 ALA O 1 54 ILE N 3.300 2.500 3.500 2.754 2.706 2.852 . 0 0 "[ . 1 . 2]" 2
109 1 51 MET O 1 55 SER H 2.300 . 2.500 2.017 1.863 2.226 . 0 0 "[ . 1 . 2]" 2
110 1 51 MET O 1 55 SER N 3.300 2.500 3.500 2.979 2.831 3.187 . 0 0 "[ . 1 . 2]" 2
111 1 52 ASP O 1 56 GLU H 2.300 . 2.500 1.932 1.786 2.208 0.014 2 0 "[ . 1 . 2]" 2
112 1 52 ASP O 1 56 GLU N 3.300 2.500 3.500 2.866 2.735 3.129 . 0 0 "[ . 1 . 2]" 2
113 1 64 ALA O 1 68 ILE H 2.300 . 2.500 2.072 1.856 2.332 . 0 0 "[ . 1 . 2]" 2
114 1 64 ALA O 1 68 ILE N 3.300 2.500 3.500 3.014 2.826 3.250 . 0 0 "[ . 1 . 2]" 2
115 1 65 VAL O 1 69 LEU H 2.300 . 2.500 1.915 1.838 2.049 . 0 0 "[ . 1 . 2]" 2
116 1 65 VAL O 1 69 LEU N 3.300 2.500 3.500 2.878 2.797 3.012 . 0 0 "[ . 1 . 2]" 2
117 1 78 HIS O 1 82 ILE H 2.300 . 2.500 2.162 1.875 2.531 0.031 18 0 "[ . 1 . 2]" 2
118 1 78 HIS O 1 82 ILE N 3.300 2.500 3.500 3.103 2.833 3.459 . 0 0 "[ . 1 . 2]" 2
119 1 79 LEU O 1 83 LEU H 2.300 . 2.500 2.022 1.873 2.346 . 0 0 "[ . 1 . 2]" 2
120 1 79 LEU O 1 83 LEU N 3.300 2.500 3.500 2.967 2.832 3.284 . 0 0 "[ . 1 . 2]" 2
121 1 80 ALA O 1 84 ASN H 2.300 . 2.500 1.901 1.750 2.158 0.050 14 0 "[ . 1 . 2]" 2
122 1 80 ALA O 1 84 ASN N 3.300 2.500 3.500 2.785 2.662 3.005 . 0 0 "[ . 1 . 2]" 2
123 1 81 ASP O 1 85 SER H 2.300 . 2.500 2.356 1.962 2.614 0.114 8 0 "[ . 1 . 2]" 2
124 1 81 ASP O 1 85 SER N 3.300 2.500 3.500 3.131 2.842 3.456 . 0 0 "[ . 1 . 2]" 2
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