NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
442901 |
2kdi   |
16114 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kdi
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 2226
_Distance_constraint_stats_list.Viol_count 1091
_Distance_constraint_stats_list.Viol_total 786.153
_Distance_constraint_stats_list.Viol_max 0.248
_Distance_constraint_stats_list.Viol_rms 0.0076
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0009
_Distance_constraint_stats_list.Viol_average_violations_only 0.0360
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 GLU 0.537 0.248 10 0 "[ . 1 . 2]"
1 10 PHE 1.177 0.116 10 0 "[ . 1 . 2]"
1 11 GLN 1.609 0.248 10 0 "[ . 1 . 2]"
1 12 ILE 0.231 0.043 8 0 "[ . 1 . 2]"
1 13 PHE 1.298 0.109 2 0 "[ . 1 . 2]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LYS 1.578 0.103 13 0 "[ . 1 . 2]"
1 16 THR 1.245 0.064 15 0 "[ . 1 . 2]"
1 17 LEU 1.934 0.083 19 0 "[ . 1 . 2]"
1 18 THR 0.711 0.081 13 0 "[ . 1 . 2]"
1 19 GLY 0.314 0.048 13 0 "[ . 1 . 2]"
1 20 LYS 0.460 0.103 13 0 "[ . 1 . 2]"
1 21 THR 0.232 0.039 20 0 "[ . 1 . 2]"
1 22 ILE 0.319 0.052 12 0 "[ . 1 . 2]"
1 23 THR 0.091 0.034 11 0 "[ . 1 . 2]"
1 24 LEU 0.390 0.086 19 0 "[ . 1 . 2]"
1 25 GLU 0.011 0.011 2 0 "[ . 1 . 2]"
1 26 VAL 0.663 0.068 12 0 "[ . 1 . 2]"
1 27 GLU 0.268 0.063 4 0 "[ . 1 . 2]"
1 28 SER 0.999 0.076 11 0 "[ . 1 . 2]"
1 29 SER 4.816 0.204 2 0 "[ . 1 . 2]"
1 30 ASP 0.213 0.056 1 0 "[ . 1 . 2]"
1 31 THR 0.639 0.043 7 0 "[ . 1 . 2]"
1 32 ILE 0.034 0.022 6 0 "[ . 1 . 2]"
1 33 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ASN 0.271 0.056 1 0 "[ . 1 . 2]"
1 35 VAL 0.167 0.029 13 0 "[ . 1 . 2]"
1 36 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 SER 0.218 0.026 19 0 "[ . 1 . 2]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ILE 1.238 0.077 14 0 "[ . 1 . 2]"
1 40 GLN 1.906 0.120 16 0 "[ . 1 . 2]"
1 41 ASP 0.027 0.027 17 0 "[ . 1 . 2]"
1 42 LYS 0.291 0.060 20 0 "[ . 1 . 2]"
1 43 GLU 0.480 0.076 12 0 "[ . 1 . 2]"
1 44 GLY 1.468 0.120 16 0 "[ . 1 . 2]"
1 45 ILE 1.685 0.071 18 0 "[ . 1 . 2]"
1 46 PRO 0.366 0.057 5 0 "[ . 1 . 2]"
1 47 PRO 0.934 0.077 14 0 "[ . 1 . 2]"
1 48 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLN 0.345 0.048 9 0 "[ . 1 . 2]"
1 50 GLN 0.061 0.028 3 0 "[ . 1 . 2]"
1 51 ARG 0.518 0.095 1 0 "[ . 1 . 2]"
1 52 LEU 0.251 0.037 7 0 "[ . 1 . 2]"
1 53 ILE 2.374 0.083 14 0 "[ . 1 . 2]"
1 54 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ALA 1.078 0.095 10 0 "[ . 1 . 2]"
1 56 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LYS 0.232 0.062 4 0 "[ . 1 . 2]"
1 58 GLN 0.357 0.062 4 0 "[ . 1 . 2]"
1 59 LEU 1.564 0.083 14 0 "[ . 1 . 2]"
1 60 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ARG 0.476 0.043 7 0 "[ . 1 . 2]"
1 64 THR 0.196 0.038 3 0 "[ . 1 . 2]"
1 65 LEU 4.985 0.204 2 0 "[ . 1 . 2]"
1 66 SER 1.013 0.076 11 0 "[ . 1 . 2]"
1 67 ASP 0.011 0.011 4 0 "[ . 1 . 2]"
1 68 TYR 0.014 0.014 2 0 "[ . 1 . 2]"
1 69 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 ILE 0.101 0.032 2 0 "[ . 1 . 2]"
1 71 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ARG 0.221 0.040 10 0 "[ . 1 . 2]"
1 73 GLU 0.109 0.026 20 0 "[ . 1 . 2]"
1 74 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 THR 0.171 0.031 13 0 "[ . 1 . 2]"
1 76 LEU 2.018 0.109 2 0 "[ . 1 . 2]"
1 77 HIS 0.106 0.037 14 0 "[ . 1 . 2]"
1 78 LEU 1.398 0.068 11 0 "[ . 1 . 2]"
1 79 VAL 0.642 0.081 9 0 "[ . 1 . 2]"
1 80 LEU 0.372 0.047 1 0 "[ . 1 . 2]"
1 81 ARG 0.372 0.054 2 0 "[ . 1 . 2]"
1 82 LEU 0.541 0.067 17 0 "[ . 1 . 2]"
1 83 ARG 0.156 0.054 2 0 "[ . 1 . 2]"
1 84 GLY 0.039 0.020 15 0 "[ . 1 . 2]"
1 85 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 MET 0.168 0.049 16 0 "[ . 1 . 2]"
1 88 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 GLY 0.049 0.049 9 0 "[ . 1 . 2]"
1 90 ALA 0.177 0.049 9 0 "[ . 1 . 2]"
1 91 ALA 0.738 0.085 15 0 "[ . 1 . 2]"
1 92 ASP 0.621 0.073 4 0 "[ . 1 . 2]"
1 93 GLU 1.098 0.133 4 0 "[ . 1 . 2]"
1 94 GLU 0.129 0.064 12 0 "[ . 1 . 2]"
1 95 GLU 0.947 0.117 20 0 "[ . 1 . 2]"
1 96 LEU 2.505 0.133 4 0 "[ . 1 . 2]"
1 97 ILE 1.525 0.103 6 0 "[ . 1 . 2]"
1 98 ARG 0.411 0.044 17 0 "[ . 1 . 2]"
1 99 LYS 2.082 0.136 14 0 "[ . 1 . 2]"
1 100 ALA 3.537 0.136 14 0 "[ . 1 . 2]"
1 101 ILE 2.357 0.094 18 0 "[ . 1 . 2]"
1 102 GLU 2.018 0.102 8 0 "[ . 1 . 2]"
1 103 LEU 2.428 0.133 6 0 "[ . 1 . 2]"
1 104 SER 1.477 0.131 12 0 "[ . 1 . 2]"
1 105 LEU 3.902 0.131 12 0 "[ . 1 . 2]"
1 106 LYS 2.299 0.159 12 0 "[ . 1 . 2]"
1 107 GLU 0.723 0.159 12 0 "[ . 1 . 2]"
1 108 SER 0.051 0.024 1 0 "[ . 1 . 2]"
1 109 ARG 0.006 0.003 20 0 "[ . 1 . 2]"
1 110 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 22 ILE H 1 22 ILE MD 3.720 . 4.720 3.682 2.506 4.057 . 0 0 "[ . 1 . 2]" 1
2 1 22 ILE H 1 22 ILE MG 3.800 . 4.800 3.918 3.808 3.947 . 0 0 "[ . 1 . 2]" 1
3 1 22 ILE H 1 22 ILE HG12 4.980 . 5.980 4.041 3.641 4.442 . 0 0 "[ . 1 . 2]" 1
4 1 22 ILE H 1 22 ILE HG13 4.980 . 5.980 2.776 2.329 3.349 . 0 0 "[ . 1 . 2]" 1
5 1 22 ILE H 1 22 ILE HB 3.200 . 4.200 2.803 2.628 3.020 . 0 0 "[ . 1 . 2]" 1
6 1 22 ILE H 1 23 THR HA 4.990 . 5.990 4.777 4.746 4.976 . 0 0 "[ . 1 . 2]" 1
7 1 22 ILE H 1 23 THR H 4.570 . 5.570 4.309 4.248 4.424 . 0 0 "[ . 1 . 2]" 1
8 1 22 ILE MD 1 39 ILE HA 5.250 . 6.250 4.575 4.145 5.254 . 0 0 "[ . 1 . 2]" 1
9 1 22 ILE MD 1 43 GLU HG2 3.680 . 4.680 3.163 2.216 4.646 . 0 0 "[ . 1 . 2]" 1
10 1 22 ILE MD 1 80 LEU HG 5.500 . 6.500 5.698 4.970 6.530 0.030 12 0 "[ . 1 . 2]" 1
11 1 22 ILE MD 1 39 ILE HG12 4.000 . 5.000 3.496 2.856 3.935 . 0 0 "[ . 1 . 2]" 1
12 1 22 ILE MD 1 80 LEU QD 3.770 . 4.770 3.893 3.227 4.575 . 0 0 "[ . 1 . 2]" 1
13 1 22 ILE MD 1 22 ILE MG 2.890 . 3.890 2.209 1.926 2.995 . 0 0 "[ . 1 . 2]" 1
14 1 22 ILE HG12 1 22 ILE MG 3.510 . 4.510 2.232 2.061 2.356 . 0 0 "[ . 1 . 2]" 1
15 1 22 ILE HG13 1 22 ILE MG 3.510 . 4.510 3.136 2.766 3.203 . 0 0 "[ . 1 . 2]" 1
16 1 22 ILE MG 1 23 THR HA 4.380 . 5.380 3.961 3.733 4.339 . 0 0 "[ . 1 . 2]" 1
17 1 22 ILE MG 1 24 LEU H 4.240 . 5.240 4.450 3.969 4.855 . 0 0 "[ . 1 . 2]" 1
18 1 22 ILE MG 1 24 LEU HG 4.460 . 5.460 4.320 2.220 5.138 . 0 0 "[ . 1 . 2]" 1
19 1 22 ILE MG 1 23 THR MG 4.970 . 5.970 4.912 4.590 5.234 . 0 0 "[ . 1 . 2]" 1
20 1 22 ILE MG 1 23 THR H 3.120 . 4.120 2.577 2.371 2.720 . 0 0 "[ . 1 . 2]" 1
21 1 22 ILE MG 1 39 ILE MD 2.790 . 3.790 2.198 1.971 2.862 . 0 0 "[ . 1 . 2]" 1
22 1 22 ILE MG 1 39 ILE HA 4.030 . 5.030 3.511 2.970 3.979 . 0 0 "[ . 1 . 2]" 1
23 1 22 ILE MG 1 43 GLU HG2 4.000 . 5.000 3.854 3.006 4.380 . 0 0 "[ . 1 . 2]" 1
24 1 22 ILE MG 1 42 LYS H 5.120 . 6.120 4.790 4.447 5.344 . 0 0 "[ . 1 . 2]" 1
25 1 22 ILE MG 1 43 GLU H 4.900 . 5.900 4.558 4.330 4.824 . 0 0 "[ . 1 . 2]" 1
26 1 22 ILE MG 1 42 LYS HB2 4.300 . 5.300 2.811 2.327 3.946 . 0 0 "[ . 1 . 2]" 1
27 1 22 ILE MG 1 42 LYS HB3 4.300 . 5.300 2.710 2.225 3.499 . 0 0 "[ . 1 . 2]" 1
28 1 22 ILE MG 1 42 LYS HG2 4.060 . 5.060 3.826 2.036 4.725 . 0 0 "[ . 1 . 2]" 1
29 1 22 ILE MG 1 42 LYS HG3 4.060 . 5.060 2.994 2.517 3.752 . 0 0 "[ . 1 . 2]" 1
30 1 22 ILE MG 1 24 LEU HA 4.560 . 5.560 4.511 4.317 4.894 . 0 0 "[ . 1 . 2]" 1
31 1 22 ILE MG 1 39 ILE HG12 3.540 . 4.540 3.154 2.315 3.972 . 0 0 "[ . 1 . 2]" 1
32 1 22 ILE MG 1 42 LYS HA 5.500 . 6.500 4.683 4.203 5.260 . 0 0 "[ . 1 . 2]" 1
33 1 22 ILE MG 1 24 LEU QD 2.670 . 3.670 2.312 1.993 2.614 . 0 0 "[ . 1 . 2]" 1
34 1 22 ILE MG 1 42 LYS QB 3.720 . 4.720 2.441 2.042 3.276 . 0 0 "[ . 1 . 2]" 1
35 1 22 ILE MG 1 42 LYS QG 3.450 . 4.450 2.803 1.979 3.476 . 0 0 "[ . 1 . 2]" 1
36 1 22 ILE MG 1 42 LYS QE 4.140 . 5.140 3.708 1.978 4.844 . 0 0 "[ . 1 . 2]" 1
37 1 21 THR MG 1 22 ILE H 3.130 . 4.130 2.868 2.497 3.436 . 0 0 "[ . 1 . 2]" 1
38 1 21 THR MG 1 23 THR HA 5.060 . 6.060 5.050 4.582 6.082 0.022 7 0 "[ . 1 . 2]" 1
39 1 21 THR MG 1 75 THR MG 3.780 . 4.780 4.240 3.680 4.791 0.011 20 0 "[ . 1 . 2]" 1
40 1 21 THR MG 1 22 ILE HA 4.720 . 5.720 4.160 3.784 5.127 . 0 0 "[ . 1 . 2]" 1
41 1 22 ILE HG12 1 43 GLU HG2 4.880 . 5.880 4.027 2.619 5.083 . 0 0 "[ . 1 . 2]" 1
42 1 15 LYS HD3 1 22 ILE H 4.920 . 5.920 4.838 4.453 5.934 0.014 13 0 "[ . 1 . 2]" 1
43 1 15 LYS HD3 1 21 THR MG 3.510 . 4.510 2.912 2.175 3.850 . 0 0 "[ . 1 . 2]" 1
44 1 15 LYS HD3 1 21 THR HA 3.790 . 4.790 3.123 2.769 4.123 . 0 0 "[ . 1 . 2]" 1
45 1 15 LYS HD3 1 20 LYS H 4.260 . 5.260 5.215 4.859 5.363 0.103 13 0 "[ . 1 . 2]" 1
46 1 15 LYS HD3 1 21 THR H 4.500 . 5.500 4.709 4.255 5.276 . 0 0 "[ . 1 . 2]" 1
47 1 16 THR MG 1 22 ILE H 5.230 . 6.230 4.914 4.543 5.419 . 0 0 "[ . 1 . 2]" 1
48 1 16 THR MG 1 22 ILE MD 3.230 . 4.230 2.174 1.856 2.653 . 0 0 "[ . 1 . 2]" 1
49 1 16 THR MG 1 22 ILE MG 4.700 . 5.700 4.705 4.259 5.159 . 0 0 "[ . 1 . 2]" 1
50 1 16 THR MG 1 22 ILE HG12 4.680 . 5.680 4.295 3.598 5.071 . 0 0 "[ . 1 . 2]" 1
51 1 16 THR MG 1 22 ILE HG13 4.680 . 5.680 3.573 2.991 4.709 . 0 0 "[ . 1 . 2]" 1
52 1 16 THR MG 1 22 ILE HB 5.090 . 6.090 4.413 3.863 4.832 . 0 0 "[ . 1 . 2]" 1
53 1 16 THR MG 1 17 LEU H 4.390 . 5.390 3.711 3.511 3.823 . 0 0 "[ . 1 . 2]" 1
54 1 16 THR MG 1 78 LEU HB2 3.360 . 4.360 4.270 3.871 4.403 0.043 16 0 "[ . 1 . 2]" 1
55 1 16 THR MG 1 80 LEU H 4.960 . 5.960 4.787 3.830 5.314 . 0 0 "[ . 1 . 2]" 1
56 1 16 THR MG 1 79 VAL HA 4.900 . 5.900 4.851 3.920 5.452 . 0 0 "[ . 1 . 2]" 1
57 1 16 THR MG 1 20 LYS H 4.620 . 5.620 3.461 3.083 3.878 . 0 0 "[ . 1 . 2]" 1
58 1 16 THR MG 1 20 LYS HD3 4.350 . 5.350 4.664 3.557 5.345 . 0 0 "[ . 1 . 2]" 1
59 1 16 THR MG 1 20 LYS HB2 5.040 . 6.040 3.408 3.051 3.928 . 0 0 "[ . 1 . 2]" 1
60 1 16 THR MG 1 20 LYS HB3 5.040 . 6.040 2.387 1.949 3.120 . 0 0 "[ . 1 . 2]" 1
61 1 16 THR MG 1 80 LEU HG 4.610 . 5.610 3.630 2.307 4.871 . 0 0 "[ . 1 . 2]" 1
62 1 16 THR MG 1 20 LYS HD2 4.350 . 5.350 3.980 2.923 5.355 0.005 3 0 "[ . 1 . 2]" 1
63 1 16 THR MG 1 24 LEU QD 5.440 . 6.440 5.450 5.160 5.772 . 0 0 "[ . 1 . 2]" 1
64 1 16 THR MG 1 78 LEU QD 3.020 . 4.020 2.262 1.943 2.697 . 0 0 "[ . 1 . 2]" 1
65 1 16 THR MG 1 80 LEU QD 3.170 . 4.170 2.430 1.956 3.208 . 0 0 "[ . 1 . 2]" 1
66 1 15 LYS HD2 1 22 ILE H 4.920 . 5.920 5.817 4.265 5.945 0.025 15 0 "[ . 1 . 2]" 1
67 1 15 LYS HD2 1 21 THR MG 3.510 . 4.510 3.780 2.660 4.309 . 0 0 "[ . 1 . 2]" 1
68 1 15 LYS HD2 1 21 THR HB 4.920 . 5.920 5.368 4.288 5.928 0.008 20 0 "[ . 1 . 2]" 1
69 1 15 LYS HD2 1 21 THR HA 3.790 . 4.790 3.833 2.366 4.066 . 0 0 "[ . 1 . 2]" 1
70 1 15 LYS HD2 1 75 THR MG 4.110 . 5.110 4.855 4.384 5.136 0.026 20 0 "[ . 1 . 2]" 1
71 1 15 LYS HD2 1 21 THR H 4.500 . 5.500 4.350 3.876 4.718 . 0 0 "[ . 1 . 2]" 1
72 1 22 ILE HG13 1 23 THR H 4.460 . 5.460 4.952 4.481 5.177 . 0 0 "[ . 1 . 2]" 1
73 1 22 ILE HB 1 22 ILE MD 3.210 . 4.210 2.192 2.009 2.300 . 0 0 "[ . 1 . 2]" 1
74 1 22 ILE HB 1 23 THR HA 5.390 . 6.390 4.799 4.583 5.045 . 0 0 "[ . 1 . 2]" 1
75 1 22 ILE HB 1 23 THR H 4.360 . 5.360 4.088 3.906 4.323 . 0 0 "[ . 1 . 2]" 1
76 1 22 ILE HB 1 39 ILE MD 4.170 . 5.170 3.393 2.662 4.003 . 0 0 "[ . 1 . 2]" 1
77 1 22 ILE HB 1 24 LEU QD 3.350 . 4.350 3.048 2.559 3.652 . 0 0 "[ . 1 . 2]" 1
78 1 22 ILE HB 1 78 LEU QD 4.770 . 5.770 4.818 4.219 5.459 . 0 0 "[ . 1 . 2]" 1
79 1 21 THR HB 1 22 ILE H 4.430 . 5.430 3.990 3.499 4.318 . 0 0 "[ . 1 . 2]" 1
80 1 21 THR HB 1 22 ILE HA 5.500 . 6.500 4.504 4.238 4.768 . 0 0 "[ . 1 . 2]" 1
81 1 23 THR HA 1 24 LEU H 2.750 . 3.750 2.166 2.145 2.203 . 0 0 "[ . 1 . 2]" 1
82 1 23 THR HA 1 23 THR MG 3.100 . 4.100 2.268 2.187 2.361 . 0 0 "[ . 1 . 2]" 1
83 1 23 THR HA 1 24 LEU HB2 5.030 . 6.030 5.498 4.838 5.682 . 0 0 "[ . 1 . 2]" 1
84 1 23 THR HA 1 24 LEU QD 2.970 . 3.970 2.903 2.333 3.766 . 0 0 "[ . 1 . 2]" 1
85 1 21 THR HA 1 22 ILE H 2.870 . 3.870 2.148 2.135 2.169 . 0 0 "[ . 1 . 2]" 1
86 1 21 THR HA 1 22 ILE MD 4.940 . 5.940 4.546 2.985 5.022 . 0 0 "[ . 1 . 2]" 1
87 1 21 THR HA 1 22 ILE MG 5.480 . 6.480 5.435 5.317 5.477 . 0 0 "[ . 1 . 2]" 1
88 1 21 THR HA 1 21 THR MG 3.040 . 4.040 2.213 2.083 2.311 . 0 0 "[ . 1 . 2]" 1
89 1 21 THR HA 1 22 ILE HB 4.620 . 5.620 4.709 4.407 4.964 . 0 0 "[ . 1 . 2]" 1
90 1 21 THR HA 1 22 ILE HA 5.150 . 6.150 4.420 4.411 4.433 . 0 0 "[ . 1 . 2]" 1
91 1 15 LYS HA 1 22 ILE H 3.730 . 4.730 3.535 3.308 3.772 . 0 0 "[ . 1 . 2]" 1
92 1 15 LYS HA 1 22 ILE MD 4.760 . 5.760 4.165 2.965 4.659 . 0 0 "[ . 1 . 2]" 1
93 1 15 LYS HA 1 22 ILE MG 5.500 . 6.500 6.082 5.931 6.304 . 0 0 "[ . 1 . 2]" 1
94 1 15 LYS HA 1 21 THR MG 3.550 . 4.550 4.169 3.902 4.426 . 0 0 "[ . 1 . 2]" 1
95 1 15 LYS HA 1 15 LYS HD3 4.400 . 5.400 3.176 2.545 4.125 . 0 0 "[ . 1 . 2]" 1
96 1 15 LYS HA 1 16 THR MG 4.330 . 5.330 3.593 3.299 3.813 . 0 0 "[ . 1 . 2]" 1
97 1 15 LYS HA 1 15 LYS HD2 4.400 . 5.400 3.827 3.022 4.096 . 0 0 "[ . 1 . 2]" 1
98 1 15 LYS HA 1 22 ILE HB 4.430 . 5.430 4.952 4.693 5.285 . 0 0 "[ . 1 . 2]" 1
99 1 15 LYS HA 1 21 THR HB 5.440 . 6.440 5.804 5.546 6.054 . 0 0 "[ . 1 . 2]" 1
100 1 15 LYS HA 1 21 THR HA 3.150 . 4.150 2.880 2.557 3.087 . 0 0 "[ . 1 . 2]" 1
101 1 15 LYS HA 1 75 THR MG 4.770 . 5.770 4.809 4.248 5.327 . 0 0 "[ . 1 . 2]" 1
102 1 15 LYS HA 1 16 THR HA 5.000 . 6.000 4.393 4.365 4.413 . 0 0 "[ . 1 . 2]" 1
103 1 15 LYS HA 1 77 HIS HA 5.360 . 6.360 4.949 4.571 5.501 . 0 0 "[ . 1 . 2]" 1
104 1 15 LYS HA 1 22 ILE HA 5.500 . 6.500 6.219 6.034 6.413 . 0 0 "[ . 1 . 2]" 1
105 1 15 LYS HA 1 21 THR H 4.930 . 5.930 4.821 4.633 5.140 . 0 0 "[ . 1 . 2]" 1
106 1 15 LYS HA 1 15 LYS HG2 3.940 . 4.940 3.500 3.397 3.688 . 0 0 "[ . 1 . 2]" 1
107 1 15 LYS HA 1 20 LYS HB2 4.840 . 5.840 5.691 5.358 5.875 0.035 12 0 "[ . 1 . 2]" 1
108 1 15 LYS HA 1 20 LYS HD2 5.500 . 6.500 5.999 4.927 6.527 0.027 18 0 "[ . 1 . 2]" 1
109 1 15 LYS HA 1 15 LYS HE3 5.500 . 6.500 5.072 4.473 5.576 . 0 0 "[ . 1 . 2]" 1
110 1 15 LYS HA 1 15 LYS HE2 5.500 . 6.500 5.002 4.064 5.540 . 0 0 "[ . 1 . 2]" 1
111 1 15 LYS HA 1 15 LYS HG3 3.940 . 4.940 2.219 2.119 2.539 . 0 0 "[ . 1 . 2]" 1
112 1 13 PHE HA 1 22 ILE H 5.000 . 6.000 4.488 4.247 4.913 . 0 0 "[ . 1 . 2]" 1
113 1 13 PHE HA 1 22 ILE MG 5.250 . 6.250 5.372 4.826 5.850 . 0 0 "[ . 1 . 2]" 1
114 1 13 PHE HA 1 21 THR MG 4.770 . 5.770 4.427 3.724 5.245 . 0 0 "[ . 1 . 2]" 1
115 1 13 PHE HA 1 23 THR HA 3.690 . 4.690 2.612 2.283 3.059 . 0 0 "[ . 1 . 2]" 1
116 1 13 PHE HA 1 14 ALA H 2.830 . 3.830 2.155 2.123 2.188 . 0 0 "[ . 1 . 2]" 1
117 1 13 PHE HA 1 75 THR MG 5.270 . 6.270 5.527 5.206 5.805 . 0 0 "[ . 1 . 2]" 1
118 1 13 PHE HA 1 14 ALA MB 4.090 . 5.090 3.944 3.896 4.022 . 0 0 "[ . 1 . 2]" 1
119 1 13 PHE HA 1 75 THR HA 5.170 . 6.170 4.975 4.771 5.225 . 0 0 "[ . 1 . 2]" 1
120 1 13 PHE HA 1 14 ALA HA 5.380 . 6.380 4.404 4.388 4.416 . 0 0 "[ . 1 . 2]" 1
121 1 13 PHE HA 1 24 LEU H 3.860 . 4.860 3.747 3.325 4.347 . 0 0 "[ . 1 . 2]" 1
122 1 13 PHE HA 1 24 LEU HG 5.500 . 6.500 4.639 3.936 6.186 . 0 0 "[ . 1 . 2]" 1
123 1 13 PHE HA 1 23 THR MG 4.170 . 5.170 3.426 2.661 3.906 . 0 0 "[ . 1 . 2]" 1
124 1 13 PHE HA 1 23 THR HB 5.300 . 6.300 5.320 4.762 5.631 . 0 0 "[ . 1 . 2]" 1
125 1 13 PHE HA 1 22 ILE HA 5.500 . 6.500 5.653 5.428 5.970 . 0 0 "[ . 1 . 2]" 1
126 1 13 PHE HA 1 76 LEU HB3 5.500 . 6.500 6.556 6.525 6.609 0.109 2 0 "[ . 1 . 2]" 1
127 1 13 PHE HA 1 24 LEU QD 5.440 . 6.440 3.591 2.886 4.431 . 0 0 "[ . 1 . 2]" 1
128 1 15 LYS H 1 22 ILE H 4.930 . 5.930 4.920 4.757 5.039 . 0 0 "[ . 1 . 2]" 1
129 1 15 LYS H 1 75 THR MG 3.630 . 4.630 3.893 3.317 4.286 . 0 0 "[ . 1 . 2]" 1
130 1 15 LYS H 1 76 LEU H 4.200 . 5.200 3.975 3.543 4.282 . 0 0 "[ . 1 . 2]" 1
131 1 15 LYS H 1 78 LEU H 4.060 . 5.060 2.980 2.559 3.427 . 0 0 "[ . 1 . 2]" 1
132 1 15 LYS H 1 15 LYS HB2 3.400 . 4.400 2.936 2.664 3.074 . 0 0 "[ . 1 . 2]" 1
133 1 15 LYS H 1 15 LYS HB3 3.400 . 4.400 2.823 2.624 2.923 . 0 0 "[ . 1 . 2]" 1
134 1 14 ALA H 1 22 ILE H 3.620 . 4.620 2.917 2.660 3.323 . 0 0 "[ . 1 . 2]" 1
135 1 14 ALA H 1 22 ILE MG 4.140 . 5.140 4.422 3.839 4.873 . 0 0 "[ . 1 . 2]" 1
136 1 14 ALA H 1 22 ILE HB 3.610 . 4.610 3.574 3.281 4.087 . 0 0 "[ . 1 . 2]" 1
137 1 14 ALA H 1 23 THR HA 3.740 . 4.740 3.404 3.059 3.596 . 0 0 "[ . 1 . 2]" 1
138 1 14 ALA H 1 15 LYS H 4.340 . 5.340 4.401 4.267 4.461 . 0 0 "[ . 1 . 2]" 1
139 1 14 ALA H 1 14 ALA MB 2.940 . 3.940 2.434 2.371 2.557 . 0 0 "[ . 1 . 2]" 1
140 1 14 ALA H 1 24 LEU H 4.300 . 5.300 4.542 4.233 4.792 . 0 0 "[ . 1 . 2]" 1
141 1 14 ALA H 1 24 LEU HG 5.040 . 6.040 4.713 3.889 5.707 . 0 0 "[ . 1 . 2]" 1
142 1 14 ALA H 1 23 THR H 4.940 . 5.940 4.809 4.696 4.955 . 0 0 "[ . 1 . 2]" 1
143 1 14 ALA H 1 76 LEU HB3 4.980 . 5.980 5.553 5.433 5.707 . 0 0 "[ . 1 . 2]" 1
144 1 14 ALA H 1 24 LEU QD 5.180 . 6.180 3.108 2.659 3.928 . 0 0 "[ . 1 . 2]" 1
145 1 53 ILE MG 1 55 ALA H 4.720 . 5.720 4.211 3.971 4.404 . 0 0 "[ . 1 . 2]" 1
146 1 53 ILE MG 1 56 GLY H 4.240 . 5.240 3.625 3.227 4.059 . 0 0 "[ . 1 . 2]" 1
147 1 53 ILE MG 1 54 TRP H 3.860 . 4.860 2.792 2.498 2.922 . 0 0 "[ . 1 . 2]" 1
148 1 53 ILE MG 1 57 LYS H 4.500 . 5.500 3.458 2.993 4.028 . 0 0 "[ . 1 . 2]" 1
149 1 53 ILE MG 1 77 HIS QB 3.800 . 4.800 3.397 2.730 3.889 . 0 0 "[ . 1 . 2]" 1
150 1 53 ILE HG13 1 53 ILE MG 3.430 . 4.430 2.432 2.348 2.546 . 0 0 "[ . 1 . 2]" 1
151 1 53 ILE MG 1 59 LEU HG 4.630 . 5.630 4.793 4.446 5.658 0.028 5 0 "[ . 1 . 2]" 1
152 1 53 ILE MG 1 59 LEU H 4.500 . 5.500 4.486 4.131 4.801 . 0 0 "[ . 1 . 2]" 1
153 1 53 ILE MG 1 58 GLN HA 4.230 . 5.230 3.322 2.798 3.761 . 0 0 "[ . 1 . 2]" 1
154 1 53 ILE HG12 1 53 ILE MG 3.430 . 4.430 2.278 2.207 2.351 . 0 0 "[ . 1 . 2]" 1
155 1 53 ILE MG 1 59 LEU MD1 4.460 . 5.460 4.809 4.506 5.230 . 0 0 "[ . 1 . 2]" 1
156 1 53 ILE MG 1 77 HIS HA 5.500 . 6.500 5.987 5.385 6.510 0.010 9 0 "[ . 1 . 2]" 1
157 1 53 ILE MG 1 101 ILE HA 3.450 . 4.450 3.279 2.873 3.816 . 0 0 "[ . 1 . 2]" 1
158 1 53 ILE MG 1 101 ILE HG12 2.840 . 3.840 2.678 2.248 3.165 . 0 0 "[ . 1 . 2]" 1
159 1 53 ILE MG 1 100 ALA MB 3.400 . 4.400 2.825 2.339 3.324 . 0 0 "[ . 1 . 2]" 1
160 1 53 ILE MG 1 101 ILE HB 4.640 . 5.640 4.408 4.185 4.780 . 0 0 "[ . 1 . 2]" 1
161 1 53 ILE MG 1 105 LEU HG 4.380 . 5.380 2.842 1.934 4.179 . 0 0 "[ . 1 . 2]" 1
162 1 53 ILE MG 1 55 ALA HA 4.620 . 5.620 5.390 4.983 5.700 0.080 18 0 "[ . 1 . 2]" 1
163 1 53 ILE MG 1 97 ILE MG 4.580 . 5.580 3.541 3.035 3.896 . 0 0 "[ . 1 . 2]" 1
164 1 53 ILE MG 1 79 VAL QG 3.910 . 4.910 3.466 2.990 4.345 . 0 0 "[ . 1 . 2]" 1
165 1 55 ALA H 1 105 LEU HA 5.210 . 6.210 4.580 3.827 5.120 . 0 0 "[ . 1 . 2]" 1
166 1 55 ALA H 1 56 GLY H 4.310 . 5.310 2.875 2.619 3.024 . 0 0 "[ . 1 . 2]" 1
167 1 55 ALA H 1 108 SER QB 5.340 . 6.340 5.126 3.838 6.188 . 0 0 "[ . 1 . 2]" 1
168 1 105 LEU HA 1 105 LEU MD2 3.540 . 4.540 2.307 2.038 3.702 . 0 0 "[ . 1 . 2]" 1
169 1 105 LEU HA 1 105 LEU MD1 3.540 . 4.540 1.951 1.790 2.179 . 0 0 "[ . 1 . 2]" 1
170 1 105 LEU HA 1 108 SER H 4.070 . 5.070 3.642 2.878 4.098 . 0 0 "[ . 1 . 2]" 1
171 1 56 GLY H 1 105 LEU HA 4.700 . 5.700 4.166 3.599 4.662 . 0 0 "[ . 1 . 2]" 1
172 1 56 GLY H 1 57 LYS H 3.480 . 4.480 2.882 2.820 2.917 . 0 0 "[ . 1 . 2]" 1
173 1 56 GLY H 1 105 LEU HB2 4.240 . 5.240 3.771 3.345 4.071 . 0 0 "[ . 1 . 2]" 1
174 1 56 GLY H 1 105 LEU MD1 4.470 . 5.470 2.083 1.736 3.559 . 0 0 "[ . 1 . 2]" 1
175 1 56 GLY H 1 101 ILE MG 4.150 . 5.150 3.818 3.362 4.278 . 0 0 "[ . 1 . 2]" 1
176 1 53 ILE MD 1 79 VAL H 3.290 . 4.290 3.626 3.094 4.079 . 0 0 "[ . 1 . 2]" 1
177 1 53 ILE MD 1 77 HIS QB 4.440 . 5.440 4.924 3.821 5.448 0.008 10 0 "[ . 1 . 2]" 1
178 1 53 ILE MD 1 59 LEU H 4.120 . 5.120 3.175 2.620 4.107 . 0 0 "[ . 1 . 2]" 1
179 1 53 ILE MD 1 58 GLN HA 3.860 . 4.860 2.738 2.099 3.522 . 0 0 "[ . 1 . 2]" 1
180 1 53 ILE MD 1 58 GLN HB3 4.130 . 5.130 3.406 2.339 5.147 0.017 13 0 "[ . 1 . 2]" 1
181 1 53 ILE MD 1 58 GLN HB2 4.130 . 5.130 3.874 2.597 4.726 . 0 0 "[ . 1 . 2]" 1
182 1 53 ILE MD 1 97 ILE HG12 3.770 . 4.770 2.304 2.069 2.914 . 0 0 "[ . 1 . 2]" 1
183 1 53 ILE MD 1 59 LEU MD1 4.620 . 5.620 4.629 4.424 5.013 . 0 0 "[ . 1 . 2]" 1
184 1 53 ILE MD 1 100 ALA MB 3.800 . 4.800 4.050 2.907 4.777 . 0 0 "[ . 1 . 2]" 1
185 1 53 ILE MD 1 97 ILE HA 3.690 . 4.690 3.629 2.551 4.161 . 0 0 "[ . 1 . 2]" 1
186 1 53 ILE MD 1 97 ILE HG13 3.770 . 4.770 2.907 2.295 3.386 . 0 0 "[ . 1 . 2]" 1
187 1 53 ILE MD 1 58 GLN HG2 5.100 . 6.100 3.223 2.066 5.817 . 0 0 "[ . 1 . 2]" 1
188 1 53 ILE MD 1 58 GLN HG3 5.100 . 6.100 3.601 2.026 5.621 . 0 0 "[ . 1 . 2]" 1
189 1 53 ILE MD 1 96 LEU QD 4.560 . 5.560 3.940 3.441 4.366 . 0 0 "[ . 1 . 2]" 1
190 1 79 VAL H 1 79 VAL MG2 3.770 . 4.770 2.615 1.891 3.591 . 0 0 "[ . 1 . 2]" 1
191 1 79 VAL H 1 79 VAL MG1 3.770 . 4.770 3.275 2.270 3.770 . 0 0 "[ . 1 . 2]" 1
192 1 79 VAL H 1 79 VAL HB 3.780 . 4.780 2.895 2.223 3.837 . 0 0 "[ . 1 . 2]" 1
193 1 79 VAL H 1 80 LEU H 4.740 . 5.740 4.415 4.213 4.565 . 0 0 "[ . 1 . 2]" 1
194 1 79 VAL H 1 79 VAL QG 3.240 . 4.240 2.471 1.827 2.992 . 0 0 "[ . 1 . 2]" 1
195 1 79 VAL MG2 1 96 LEU HB3 4.010 . 5.010 4.821 4.097 5.091 0.081 9 0 "[ . 1 . 2]" 1
196 1 79 VAL MG2 1 100 ALA MB 3.930 . 4.930 2.894 1.925 3.966 . 0 0 "[ . 1 . 2]" 1
197 1 79 VAL MG2 1 97 ILE HA 4.190 . 5.190 2.980 2.302 3.624 . 0 0 "[ . 1 . 2]" 1
198 1 79 VAL MG1 1 96 LEU HB3 4.010 . 5.010 4.193 3.277 5.034 0.024 2 0 "[ . 1 . 2]" 1
199 1 79 VAL MG1 1 100 ALA MB 3.930 . 4.930 3.191 1.794 4.845 . 0 0 "[ . 1 . 2]" 1
200 1 79 VAL MG1 1 97 ILE HA 4.190 . 5.190 3.405 2.596 4.309 . 0 0 "[ . 1 . 2]" 1
201 1 78 LEU HG 1 79 VAL H 3.970 . 4.970 2.291 1.894 3.597 . 0 0 "[ . 1 . 2]" 1
202 1 78 LEU HG 1 79 VAL HA 4.700 . 5.700 4.396 3.717 5.039 . 0 0 "[ . 1 . 2]" 1
203 1 78 LEU HG 1 79 VAL QG 5.050 . 6.050 4.041 3.320 4.514 . 0 0 "[ . 1 . 2]" 1
204 1 78 LEU HG 1 80 LEU QD 4.400 . 5.400 4.141 2.277 5.212 . 0 0 "[ . 1 . 2]" 1
205 1 78 LEU HA 1 79 VAL H 2.840 . 3.840 2.219 2.158 2.299 . 0 0 "[ . 1 . 2]" 1
206 1 78 LEU HA 1 78 LEU HG 4.200 . 5.200 2.381 2.207 3.165 . 0 0 "[ . 1 . 2]" 1
207 1 78 LEU HA 1 79 VAL HB 5.500 . 6.500 4.839 4.079 5.838 . 0 0 "[ . 1 . 2]" 1
208 1 78 LEU HA 1 79 VAL HA 4.800 . 5.800 4.420 4.390 4.498 . 0 0 "[ . 1 . 2]" 1
209 1 78 LEU HA 1 78 LEU MD1 3.960 . 4.960 3.223 2.115 3.486 . 0 0 "[ . 1 . 2]" 1
210 1 78 LEU HA 1 78 LEU MD2 3.960 . 4.960 3.520 3.312 3.910 . 0 0 "[ . 1 . 2]" 1
211 1 78 LEU HA 1 78 LEU QD 3.270 . 4.270 2.952 2.106 3.104 . 0 0 "[ . 1 . 2]" 1
212 1 78 LEU HA 1 79 VAL QG 4.870 . 5.870 3.616 3.095 4.338 . 0 0 "[ . 1 . 2]" 1
213 1 52 LEU HA 1 53 ILE MD 4.300 . 5.300 3.270 2.984 3.579 . 0 0 "[ . 1 . 2]" 1
214 1 52 LEU HA 1 79 VAL H 4.220 . 5.220 3.091 2.480 3.918 . 0 0 "[ . 1 . 2]" 1
215 1 52 LEU HA 1 78 LEU HA 4.700 . 5.700 2.436 2.082 2.790 . 0 0 "[ . 1 . 2]" 1
216 1 52 LEU HA 1 53 ILE H 3.000 . 4.000 2.149 2.123 2.181 . 0 0 "[ . 1 . 2]" 1
217 1 52 LEU HA 1 53 ILE HA 4.980 . 5.980 4.420 4.404 4.435 . 0 0 "[ . 1 . 2]" 1
218 1 52 LEU HA 1 52 LEU MD2 4.420 . 5.420 2.571 2.068 3.547 . 0 0 "[ . 1 . 2]" 1
219 1 52 LEU HA 1 52 LEU MD1 4.420 . 5.420 2.541 1.980 3.583 . 0 0 "[ . 1 . 2]" 1
220 1 52 LEU HA 1 52 LEU QD 3.110 . 4.110 2.224 1.845 2.875 . 0 0 "[ . 1 . 2]" 1
221 1 52 LEU HA 1 78 LEU QD 4.240 . 5.240 3.800 3.123 4.079 . 0 0 "[ . 1 . 2]" 1
222 1 51 ARG H 1 79 VAL H 3.970 . 4.970 3.192 2.648 4.125 . 0 0 "[ . 1 . 2]" 1
223 1 51 ARG H 1 80 LEU HA 3.760 . 4.760 3.762 2.947 4.409 . 0 0 "[ . 1 . 2]" 1
224 1 51 ARG H 1 78 LEU MD1 5.050 . 6.050 3.848 2.139 4.474 . 0 0 "[ . 1 . 2]" 1
225 1 51 ARG H 1 78 LEU MD2 5.050 . 6.050 3.503 2.927 4.559 . 0 0 "[ . 1 . 2]" 1
226 1 51 ARG H 1 51 ARG HD3 4.890 . 5.890 4.796 3.485 5.985 0.095 1 0 "[ . 1 . 2]" 1
227 1 51 ARG H 1 51 ARG HD2 4.890 . 5.890 4.517 2.670 5.419 . 0 0 "[ . 1 . 2]" 1
228 1 51 ARG H 1 78 LEU QD 3.510 . 4.510 3.146 2.135 3.417 . 0 0 "[ . 1 . 2]" 1
229 1 51 ARG H 1 79 VAL QG 4.070 . 5.070 3.119 1.840 4.227 . 0 0 "[ . 1 . 2]" 1
230 1 51 ARG H 1 51 ARG QB 3.560 . 4.560 2.887 2.444 3.301 . 0 0 "[ . 1 . 2]" 1
231 1 51 ARG H 1 51 ARG QG 3.240 . 4.240 2.839 2.093 4.300 0.060 9 0 "[ . 1 . 2]" 1
232 1 75 THR MG 1 76 LEU H 3.970 . 4.970 3.296 3.131 3.629 . 0 0 "[ . 1 . 2]" 1
233 1 75 THR MG 1 77 HIS HA 5.240 . 6.240 4.289 3.601 5.344 . 0 0 "[ . 1 . 2]" 1
234 1 75 THR MG 1 76 LEU HA 4.300 . 5.300 4.340 4.178 5.331 0.031 13 0 "[ . 1 . 2]" 1
235 1 76 LEU H 1 76 LEU HB2 4.090 . 5.090 2.145 2.112 2.199 . 0 0 "[ . 1 . 2]" 1
236 1 76 LEU H 1 76 LEU HG 4.840 . 5.840 4.150 3.667 4.404 . 0 0 "[ . 1 . 2]" 1
237 1 76 LEU H 1 76 LEU QD 4.400 . 5.400 2.662 2.313 2.910 . 0 0 "[ . 1 . 2]" 1
238 1 14 ALA MB 1 22 ILE MD 4.200 . 5.200 3.127 2.698 3.716 . 0 0 "[ . 1 . 2]" 1
239 1 14 ALA MB 1 22 ILE MG 3.530 . 4.530 3.455 2.767 4.027 . 0 0 "[ . 1 . 2]" 1
240 1 14 ALA MB 1 16 THR MG 4.130 . 5.130 4.067 3.858 4.257 . 0 0 "[ . 1 . 2]" 1
241 1 14 ALA MB 1 22 ILE HB 3.290 . 4.290 2.364 2.085 2.953 . 0 0 "[ . 1 . 2]" 1
242 1 14 ALA MB 1 15 LYS H 3.630 . 4.630 2.950 2.664 3.267 . 0 0 "[ . 1 . 2]" 1
243 1 14 ALA MB 1 78 LEU HG 4.870 . 5.870 5.142 4.670 5.641 . 0 0 "[ . 1 . 2]" 1
244 1 14 ALA MB 1 78 LEU HA 4.860 . 5.860 4.927 4.660 5.598 . 0 0 "[ . 1 . 2]" 1
245 1 14 ALA MB 1 76 LEU H 4.780 . 5.780 4.120 3.527 4.474 . 0 0 "[ . 1 . 2]" 1
246 1 14 ALA MB 1 76 LEU HB2 3.790 . 4.790 3.037 2.236 3.710 . 0 0 "[ . 1 . 2]" 1
247 1 14 ALA MB 1 76 LEU HG 4.730 . 5.730 4.875 3.741 5.433 . 0 0 "[ . 1 . 2]" 1
248 1 14 ALA MB 1 24 LEU HG 4.490 . 5.490 3.819 3.198 4.447 . 0 0 "[ . 1 . 2]" 1
249 1 14 ALA MB 1 24 LEU MD2 3.330 . 4.330 2.415 1.969 3.579 . 0 0 "[ . 1 . 2]" 1
250 1 14 ALA MB 1 24 LEU MD1 3.330 . 4.330 2.795 2.230 3.547 . 0 0 "[ . 1 . 2]" 1
251 1 14 ALA MB 1 24 LEU HB2 5.430 . 6.430 5.412 4.570 5.917 . 0 0 "[ . 1 . 2]" 1
252 1 14 ALA MB 1 78 LEU H 3.970 . 4.970 3.984 3.692 4.704 . 0 0 "[ . 1 . 2]" 1
253 1 14 ALA MB 1 16 THR HA 5.490 . 6.490 5.174 4.932 5.479 . 0 0 "[ . 1 . 2]" 1
254 1 14 ALA MB 1 78 LEU HB3 3.940 . 4.940 3.376 3.062 3.677 . 0 0 "[ . 1 . 2]" 1
255 1 14 ALA MB 1 78 LEU HB2 3.940 . 4.940 2.871 2.498 3.571 . 0 0 "[ . 1 . 2]" 1
256 1 14 ALA MB 1 52 LEU HG 5.500 . 6.500 5.405 4.617 6.088 . 0 0 "[ . 1 . 2]" 1
257 1 14 ALA MB 1 77 HIS HA 5.270 . 6.270 4.857 4.351 5.511 . 0 0 "[ . 1 . 2]" 1
258 1 14 ALA MB 1 35 VAL HA 5.500 . 6.500 5.940 5.427 6.369 . 0 0 "[ . 1 . 2]" 1
259 1 14 ALA MB 1 76 LEU HB3 3.790 . 4.790 3.118 2.645 3.609 . 0 0 "[ . 1 . 2]" 1
260 1 14 ALA MB 1 78 LEU MD1 4.050 . 5.050 3.266 2.701 4.349 . 0 0 "[ . 1 . 2]" 1
261 1 14 ALA MB 1 78 LEU MD2 4.050 . 5.050 4.097 3.114 4.529 . 0 0 "[ . 1 . 2]" 1
262 1 14 ALA MB 1 39 ILE HG12 4.240 . 5.240 3.541 3.076 3.844 . 0 0 "[ . 1 . 2]" 1
263 1 14 ALA MB 1 76 LEU HA 5.150 . 6.150 5.106 4.488 5.593 . 0 0 "[ . 1 . 2]" 1
264 1 14 ALA MB 1 24 LEU QD 2.900 . 3.900 2.143 1.902 2.399 . 0 0 "[ . 1 . 2]" 1
265 1 14 ALA MB 1 76 LEU QD 5.000 . 6.000 3.563 2.957 4.485 . 0 0 "[ . 1 . 2]" 1
266 1 14 ALA MB 1 35 VAL QG 3.730 . 4.730 3.563 3.166 4.085 . 0 0 "[ . 1 . 2]" 1
267 1 14 ALA MB 1 52 LEU QD 3.780 . 4.780 3.564 3.242 3.915 . 0 0 "[ . 1 . 2]" 1
268 1 14 ALA MB 1 78 LEU QD 3.330 . 4.330 3.093 2.645 3.404 . 0 0 "[ . 1 . 2]" 1
269 1 76 LEU HB2 1 78 LEU H 4.810 . 5.810 5.845 5.760 5.878 0.068 11 0 "[ . 1 . 2]" 1
270 1 76 LEU HB2 1 76 LEU QD 3.080 . 4.080 2.159 2.018 2.352 . 0 0 "[ . 1 . 2]" 1
271 1 75 THR HA 1 75 THR MG 3.130 . 4.130 2.267 2.132 2.320 . 0 0 "[ . 1 . 2]" 1
272 1 75 THR HA 1 76 LEU H 3.480 . 4.480 2.182 2.156 2.216 . 0 0 "[ . 1 . 2]" 1
273 1 75 THR HA 1 76 LEU HB3 4.890 . 5.890 5.538 5.437 5.640 . 0 0 "[ . 1 . 2]" 1
274 1 75 THR HA 1 76 LEU HA 4.450 . 5.450 4.455 4.433 4.471 . 0 0 "[ . 1 . 2]" 1
275 1 75 THR HA 1 76 LEU QD 4.450 . 5.450 3.858 3.465 4.134 . 0 0 "[ . 1 . 2]" 1
276 1 14 ALA HA 1 16 THR MG 5.500 . 6.500 5.863 5.520 6.115 . 0 0 "[ . 1 . 2]" 1
277 1 14 ALA HA 1 15 LYS HA 5.430 . 6.430 4.412 4.393 4.440 . 0 0 "[ . 1 . 2]" 1
278 1 14 ALA HA 1 15 LYS H 2.840 . 3.840 2.195 2.113 2.286 . 0 0 "[ . 1 . 2]" 1
279 1 14 ALA HA 1 75 THR MG 4.740 . 5.740 4.249 3.621 4.759 . 0 0 "[ . 1 . 2]" 1
280 1 14 ALA HA 1 76 LEU H 4.350 . 5.350 2.732 2.153 3.165 . 0 0 "[ . 1 . 2]" 1
281 1 14 ALA HA 1 76 LEU HB2 4.660 . 5.660 2.493 2.185 2.971 . 0 0 "[ . 1 . 2]" 1
282 1 14 ALA HA 1 76 LEU HG 5.470 . 6.470 4.994 4.673 5.220 . 0 0 "[ . 1 . 2]" 1
283 1 14 ALA HA 1 75 THR HA 5.130 . 6.130 4.314 3.630 4.791 . 0 0 "[ . 1 . 2]" 1
284 1 14 ALA HA 1 78 LEU H 4.570 . 5.570 4.583 4.255 4.944 . 0 0 "[ . 1 . 2]" 1
285 1 14 ALA HA 1 78 LEU HB3 5.270 . 6.270 5.181 4.760 5.854 . 0 0 "[ . 1 . 2]" 1
286 1 14 ALA HA 1 15 LYS HB2 5.430 . 6.430 4.318 4.216 4.483 . 0 0 "[ . 1 . 2]" 1
287 1 14 ALA HA 1 77 HIS HA 5.380 . 6.380 4.538 4.118 4.947 . 0 0 "[ . 1 . 2]" 1
288 1 14 ALA HA 1 76 LEU HB3 4.660 . 5.660 2.958 2.710 3.313 . 0 0 "[ . 1 . 2]" 1
289 1 14 ALA HA 1 76 LEU HA 5.320 . 6.320 4.322 3.959 4.626 . 0 0 "[ . 1 . 2]" 1
290 1 14 ALA HA 1 76 LEU MD1 5.410 . 6.410 4.363 3.609 4.827 . 0 0 "[ . 1 . 2]" 1
291 1 14 ALA HA 1 76 LEU MD2 5.410 . 6.410 4.284 3.848 4.800 . 0 0 "[ . 1 . 2]" 1
292 1 14 ALA HA 1 76 LEU QD 4.600 . 5.600 3.832 3.460 4.288 . 0 0 "[ . 1 . 2]" 1
293 1 54 TRP H 1 57 LYS H 4.240 . 5.240 3.551 3.429 3.637 . 0 0 "[ . 1 . 2]" 1
294 1 54 TRP H 1 77 HIS QB 5.070 . 6.070 5.003 4.586 5.291 . 0 0 "[ . 1 . 2]" 1
295 1 54 TRP H 1 59 LEU HG 4.740 . 5.740 2.562 2.187 3.303 . 0 0 "[ . 1 . 2]" 1
296 1 54 TRP H 1 59 LEU MD2 4.810 . 5.810 3.662 3.062 4.833 . 0 0 "[ . 1 . 2]" 1
297 1 54 TRP H 1 59 LEU H 4.490 . 5.490 3.321 3.022 3.794 . 0 0 "[ . 1 . 2]" 1
298 1 54 TRP H 1 58 GLN HA 5.120 . 6.120 3.329 2.996 3.557 . 0 0 "[ . 1 . 2]" 1
299 1 54 TRP H 1 58 GLN H 4.840 . 5.840 4.919 4.650 5.144 . 0 0 "[ . 1 . 2]" 1
300 1 54 TRP H 1 59 LEU QB 5.340 . 6.340 4.418 3.866 4.880 . 0 0 "[ . 1 . 2]" 1
301 1 57 LYS H 1 59 LEU MD2 5.500 . 6.500 5.332 4.672 6.426 . 0 0 "[ . 1 . 2]" 1
302 1 57 LYS H 1 58 GLN H 4.660 . 5.660 4.407 4.341 4.467 . 0 0 "[ . 1 . 2]" 1
303 1 57 LYS H 1 57 LYS HB2 3.580 . 4.580 2.861 2.459 3.184 . 0 0 "[ . 1 . 2]" 1
304 1 57 LYS H 1 57 LYS HB3 3.580 . 4.580 3.073 2.616 3.768 . 0 0 "[ . 1 . 2]" 1
305 1 77 HIS QB 1 79 VAL QG 4.180 . 5.180 3.988 3.088 4.945 . 0 0 "[ . 1 . 2]" 1
306 1 53 ILE HG13 1 79 VAL MG2 4.550 . 5.550 4.212 3.788 4.737 . 0 0 "[ . 1 . 2]" 1
307 1 53 ILE HG13 1 79 VAL MG1 4.550 . 5.550 5.203 4.336 5.568 0.018 15 0 "[ . 1 . 2]" 1
308 1 53 ILE HG13 1 54 TRP H 5.440 . 6.440 4.016 3.744 4.248 . 0 0 "[ . 1 . 2]" 1
309 1 53 ILE HG13 1 58 GLN HA 4.230 . 5.230 2.078 1.935 2.271 . 0 0 "[ . 1 . 2]" 1
310 1 53 ILE HG13 1 97 ILE HG12 3.950 . 4.950 3.488 3.227 3.708 . 0 0 "[ . 1 . 2]" 1
311 1 53 ILE HG13 1 101 ILE HA 5.480 . 6.480 6.346 6.015 6.524 0.044 4 0 "[ . 1 . 2]" 1
312 1 53 ILE HG13 1 101 ILE H 5.500 . 6.500 6.535 6.502 6.564 0.064 7 0 "[ . 1 . 2]" 1
313 1 53 ILE HG13 1 101 ILE MD 4.140 . 5.140 3.752 3.408 4.154 . 0 0 "[ . 1 . 2]" 1
314 1 53 ILE HG13 1 58 GLN H 5.500 . 6.500 4.006 3.682 4.223 . 0 0 "[ . 1 . 2]" 1
315 1 53 ILE HG13 1 97 ILE MD 4.210 . 5.210 4.830 4.541 5.107 . 0 0 "[ . 1 . 2]" 1
316 1 53 ILE HG13 1 97 ILE MG 4.190 . 5.190 3.454 3.113 3.675 . 0 0 "[ . 1 . 2]" 1
317 1 53 ILE HG13 1 97 ILE HB 5.110 . 6.110 6.036 5.808 6.152 0.042 17 0 "[ . 1 . 2]" 1
318 1 53 ILE HG13 1 79 VAL QG 3.630 . 4.630 4.009 3.704 4.424 . 0 0 "[ . 1 . 2]" 1
319 1 59 LEU MD2 1 60 GLU H 5.500 . 6.500 3.416 2.753 3.791 . 0 0 "[ . 1 . 2]" 1
320 1 59 LEU MD2 1 76 LEU QD 5.130 . 6.130 4.638 3.907 5.330 . 0 0 "[ . 1 . 2]" 1
321 1 24 LEU H 1 26 VAL MG1 4.640 . 5.640 4.464 4.168 4.883 . 0 0 "[ . 1 . 2]" 1
322 1 24 LEU H 1 24 LEU HG 4.660 . 5.660 2.231 1.882 3.788 . 0 0 "[ . 1 . 2]" 1
323 1 24 LEU H 1 24 LEU MD2 4.900 . 5.900 2.694 1.605 4.012 . 0 0 "[ . 1 . 2]" 1
324 1 24 LEU H 1 24 LEU MD1 4.900 . 5.900 3.380 1.821 3.850 . 0 0 "[ . 1 . 2]" 1
325 1 24 LEU H 1 24 LEU HB2 3.500 . 4.500 3.548 2.837 3.745 . 0 0 "[ . 1 . 2]" 1
326 1 24 LEU H 1 25 GLU H 4.610 . 5.610 4.380 4.344 4.421 . 0 0 "[ . 1 . 2]" 1
327 1 24 LEU H 1 24 LEU QD 3.660 . 4.660 2.328 1.545 3.227 . 0 0 "[ . 1 . 2]" 1
328 1 24 LEU H 1 42 LYS QG 5.220 . 6.220 5.491 5.139 6.127 . 0 0 "[ . 1 . 2]" 1
329 1 26 VAL MG1 1 35 VAL HA 4.320 . 5.320 2.687 2.265 3.265 . 0 0 "[ . 1 . 2]" 1
330 1 26 VAL MG1 1 30 ASP H 5.500 . 6.500 5.796 5.479 6.144 . 0 0 "[ . 1 . 2]" 1
331 1 26 VAL MG1 1 65 LEU MD1 4.170 . 5.170 3.447 3.192 3.751 . 0 0 "[ . 1 . 2]" 1
332 1 26 VAL MG1 1 27 GLU H 3.820 . 4.820 3.685 3.436 3.975 . 0 0 "[ . 1 . 2]" 1
333 1 26 VAL MG1 1 27 GLU HA 5.500 . 6.500 5.587 5.482 5.694 . 0 0 "[ . 1 . 2]" 1
334 1 26 VAL MG1 1 65 LEU HG 4.950 . 5.950 5.164 4.825 5.678 . 0 0 "[ . 1 . 2]" 1
335 1 26 VAL MG1 1 35 VAL H 5.420 . 6.420 4.421 4.048 5.093 . 0 0 "[ . 1 . 2]" 1
336 1 26 VAL MG1 1 35 VAL MG2 3.570 . 4.570 2.773 2.313 4.557 . 0 0 "[ . 1 . 2]" 1
337 1 26 VAL MG1 1 35 VAL MG1 3.570 . 4.570 3.353 2.659 3.872 . 0 0 "[ . 1 . 2]" 1
338 1 26 VAL MG1 1 35 VAL QG 3.040 . 4.040 2.588 2.188 3.327 . 0 0 "[ . 1 . 2]" 1
339 1 24 LEU HG 1 26 VAL MG1 3.590 . 4.590 3.594 2.824 4.628 0.038 8 0 "[ . 1 . 2]" 1
340 1 24 LEU MD2 1 26 VAL MG1 4.270 . 5.270 3.981 2.239 4.350 . 0 0 "[ . 1 . 2]" 1
341 1 24 LEU MD2 1 39 ILE H 5.500 . 6.500 4.453 2.852 6.065 . 0 0 "[ . 1 . 2]" 1
342 1 24 LEU MD1 1 26 VAL MG1 4.270 . 5.270 2.384 1.945 4.317 . 0 0 "[ . 1 . 2]" 1
343 1 24 LEU MD1 1 39 ILE H 5.500 . 6.500 4.024 3.075 5.481 . 0 0 "[ . 1 . 2]" 1
344 1 12 ILE HG12 1 24 LEU H 4.280 . 5.280 3.825 3.412 4.015 . 0 0 "[ . 1 . 2]" 1
345 1 12 ILE HG12 1 13 PHE H 3.750 . 4.750 4.491 4.065 4.769 0.019 16 0 "[ . 1 . 2]" 1
346 1 23 THR MG 1 24 LEU H 3.200 . 4.200 2.660 2.446 3.523 . 0 0 "[ . 1 . 2]" 1
347 1 23 THR MG 1 25 GLU QG 4.970 . 5.970 4.638 3.605 5.956 . 0 0 "[ . 1 . 2]" 1
348 1 23 THR MG 1 24 LEU QD 4.470 . 5.470 3.897 3.305 4.280 . 0 0 "[ . 1 . 2]" 1
349 1 24 LEU HB2 1 26 VAL MG1 4.860 . 5.860 2.464 2.071 2.774 . 0 0 "[ . 1 . 2]" 1
350 1 24 LEU HB2 1 39 ILE HA 4.920 . 5.920 5.393 4.540 5.948 0.028 7 0 "[ . 1 . 2]" 1
351 1 24 LEU HB2 1 25 GLU H 3.670 . 4.670 3.237 3.016 4.036 . 0 0 "[ . 1 . 2]" 1
352 1 24 LEU HB2 1 24 LEU QD 3.040 . 4.040 2.165 2.074 2.306 . 0 0 "[ . 1 . 2]" 1
353 1 24 LEU HB2 1 42 LYS QE 4.560 . 5.560 4.592 3.361 5.562 0.002 4 0 "[ . 1 . 2]" 1
354 1 11 GLN HB3 1 24 LEU H 4.320 . 5.320 4.297 3.070 5.362 0.042 16 0 "[ . 1 . 2]" 1
355 1 11 GLN HB3 1 26 VAL MG1 5.270 . 6.270 5.559 5.032 6.225 . 0 0 "[ . 1 . 2]" 1
356 1 11 GLN HB3 1 23 THR MG 4.780 . 5.780 2.844 1.933 3.584 . 0 0 "[ . 1 . 2]" 1
357 1 11 GLN HB3 1 26 VAL H 3.830 . 4.830 4.370 3.865 4.876 0.046 16 0 "[ . 1 . 2]" 1
358 1 11 GLN HB3 1 12 ILE H 4.690 . 5.690 3.708 2.149 4.403 . 0 0 "[ . 1 . 2]" 1
359 1 11 GLN HB3 1 24 LEU HA 5.490 . 6.490 4.760 3.898 5.952 . 0 0 "[ . 1 . 2]" 1
360 1 23 THR HB 1 24 LEU H 4.230 . 5.230 4.053 3.206 4.252 . 0 0 "[ . 1 . 2]" 1
361 1 12 ILE HA 1 13 PHE HA 5.330 . 6.330 4.449 4.398 4.489 . 0 0 "[ . 1 . 2]" 1
362 1 12 ILE HA 1 75 THR HA 5.500 . 6.500 6.238 5.801 6.521 0.021 13 0 "[ . 1 . 2]" 1
363 1 12 ILE HA 1 24 LEU H 5.390 . 6.390 5.056 4.765 5.234 . 0 0 "[ . 1 . 2]" 1
364 1 12 ILE HA 1 26 VAL MG1 5.500 . 6.500 5.916 5.380 6.282 . 0 0 "[ . 1 . 2]" 1
365 1 12 ILE HA 1 23 THR MG 4.560 . 5.560 4.468 4.256 4.710 . 0 0 "[ . 1 . 2]" 1
366 1 12 ILE HA 1 13 PHE H 2.930 . 3.930 2.528 2.377 2.682 . 0 0 "[ . 1 . 2]" 1
367 1 12 ILE HA 1 70 ILE MG 5.500 . 6.500 4.919 4.356 5.448 . 0 0 "[ . 1 . 2]" 1
368 1 12 ILE HA 1 26 VAL MG2 5.500 . 6.500 4.295 4.108 4.612 . 0 0 "[ . 1 . 2]" 1
369 1 12 ILE HA 1 12 ILE MG 3.170 . 4.170 2.402 2.319 2.470 . 0 0 "[ . 1 . 2]" 1
370 1 12 ILE HA 1 72 ARG HB3 4.190 . 5.190 4.557 3.905 5.209 0.019 15 0 "[ . 1 . 2]" 1
371 1 12 ILE HA 1 12 ILE MD 4.240 . 5.240 4.110 4.079 4.128 . 0 0 "[ . 1 . 2]" 1
372 1 12 ILE HA 1 74 SER H 4.000 . 5.000 3.387 3.030 3.746 . 0 0 "[ . 1 . 2]" 1
373 1 12 ILE HA 1 73 GLU HA 4.600 . 5.600 4.496 3.610 5.001 . 0 0 "[ . 1 . 2]" 1
374 1 12 ILE HA 1 24 LEU QD 5.440 . 6.440 5.099 4.228 5.969 . 0 0 "[ . 1 . 2]" 1
375 1 13 PHE H 1 14 ALA H 4.490 . 5.490 4.357 4.289 4.392 . 0 0 "[ . 1 . 2]" 1
376 1 13 PHE H 1 76 LEU H 4.200 . 5.200 3.699 3.432 3.899 . 0 0 "[ . 1 . 2]" 1
377 1 13 PHE H 1 75 THR HA 3.540 . 4.540 3.937 3.562 4.152 . 0 0 "[ . 1 . 2]" 1
378 1 13 PHE H 1 24 LEU H 5.100 . 6.100 5.157 4.795 5.407 . 0 0 "[ . 1 . 2]" 1
379 1 13 PHE H 1 23 THR MG 4.990 . 5.990 4.861 4.510 5.123 . 0 0 "[ . 1 . 2]" 1
380 1 13 PHE H 1 26 VAL MG2 5.330 . 6.330 5.329 5.085 5.585 . 0 0 "[ . 1 . 2]" 1
381 1 13 PHE H 1 74 SER H 4.820 . 5.820 3.522 3.089 4.429 . 0 0 "[ . 1 . 2]" 1
382 1 13 PHE H 1 73 GLU HA 5.500 . 6.500 5.083 4.564 5.752 . 0 0 "[ . 1 . 2]" 1
383 1 13 PHE H 1 74 SER QB 5.130 . 6.130 4.112 3.719 4.781 . 0 0 "[ . 1 . 2]" 1
384 1 13 PHE H 1 13 PHE QB 3.530 . 4.530 2.496 2.295 2.743 . 0 0 "[ . 1 . 2]" 1
385 1 78 LEU H 1 79 VAL H 4.380 . 5.380 4.467 3.887 4.528 . 0 0 "[ . 1 . 2]" 1
386 1 78 LEU H 1 78 LEU HG 5.180 . 6.180 4.433 4.184 4.509 . 0 0 "[ . 1 . 2]" 1
387 1 78 LEU H 1 78 LEU HB3 3.350 . 4.350 2.526 2.344 2.707 . 0 0 "[ . 1 . 2]" 1
388 1 78 LEU H 1 78 LEU HB2 3.350 . 4.350 2.876 2.668 3.085 . 0 0 "[ . 1 . 2]" 1
389 1 78 LEU H 1 78 LEU QD 4.470 . 5.470 3.724 3.516 3.826 . 0 0 "[ . 1 . 2]" 1
390 1 78 LEU H 1 79 VAL QG 4.810 . 5.810 4.578 4.075 5.428 . 0 0 "[ . 1 . 2]" 1
391 1 53 ILE H 1 53 ILE MG 3.820 . 4.820 3.625 3.499 3.762 . 0 0 "[ . 1 . 2]" 1
392 1 53 ILE H 1 53 ILE MD 3.760 . 4.760 2.509 2.248 2.798 . 0 0 "[ . 1 . 2]" 1
393 1 53 ILE H 1 78 LEU HA 4.370 . 5.370 3.182 2.791 3.733 . 0 0 "[ . 1 . 2]" 1
394 1 53 ILE H 1 54 TRP H 4.980 . 5.980 4.355 4.304 4.423 . 0 0 "[ . 1 . 2]" 1
395 1 53 ILE H 1 77 HIS QB 4.070 . 5.070 3.629 2.965 3.835 . 0 0 "[ . 1 . 2]" 1
396 1 53 ILE H 1 59 LEU HG 5.040 . 6.040 4.951 4.528 5.974 . 0 0 "[ . 1 . 2]" 1
397 1 53 ILE H 1 78 LEU H 5.090 . 6.090 5.084 4.899 5.279 . 0 0 "[ . 1 . 2]" 1
398 1 53 ILE H 1 59 LEU H 5.390 . 6.390 4.524 4.379 4.667 . 0 0 "[ . 1 . 2]" 1
399 1 53 ILE H 1 58 GLN HA 5.120 . 6.120 4.874 4.631 5.107 . 0 0 "[ . 1 . 2]" 1
400 1 53 ILE H 1 53 ILE HG12 4.500 . 5.500 4.391 4.298 4.530 . 0 0 "[ . 1 . 2]" 1
401 1 53 ILE H 1 59 LEU MD1 4.680 . 5.680 3.862 3.504 4.485 . 0 0 "[ . 1 . 2]" 1
402 1 53 ILE H 1 77 HIS HA 5.100 . 6.100 5.384 5.010 5.530 . 0 0 "[ . 1 . 2]" 1
403 1 53 ILE H 1 79 VAL QG 5.440 . 6.440 3.249 2.555 4.169 . 0 0 "[ . 1 . 2]" 1
404 1 17 LEU H 1 79 VAL MG2 5.060 . 6.060 4.719 3.722 5.385 . 0 0 "[ . 1 . 2]" 1
405 1 17 LEU H 1 79 VAL MG1 5.060 . 6.060 4.408 2.982 5.393 . 0 0 "[ . 1 . 2]" 1
406 1 17 LEU H 1 78 LEU H 5.150 . 6.150 4.975 4.544 5.291 . 0 0 "[ . 1 . 2]" 1
407 1 17 LEU H 1 18 THR MG 4.670 . 5.670 3.994 3.433 4.375 . 0 0 "[ . 1 . 2]" 1
408 1 17 LEU H 1 17 LEU HB3 3.600 . 4.600 2.690 2.522 2.886 . 0 0 "[ . 1 . 2]" 1
409 1 17 LEU H 1 19 GLY H 4.960 . 5.960 4.004 3.823 4.207 . 0 0 "[ . 1 . 2]" 1
410 1 17 LEU H 1 18 THR H 4.060 . 5.060 2.687 2.551 2.821 . 0 0 "[ . 1 . 2]" 1
411 1 17 LEU H 1 17 LEU HB2 3.600 . 4.600 2.373 2.205 2.535 . 0 0 "[ . 1 . 2]" 1
412 1 17 LEU H 1 17 LEU MD1 4.570 . 5.570 4.004 3.743 4.213 . 0 0 "[ . 1 . 2]" 1
413 1 17 LEU H 1 17 LEU MD2 4.570 . 5.570 3.972 3.551 4.240 . 0 0 "[ . 1 . 2]" 1
414 1 17 LEU H 1 79 VAL QG 4.450 . 5.450 3.837 2.964 4.430 . 0 0 "[ . 1 . 2]" 1
415 1 17 LEU H 1 17 LEU QD 3.950 . 4.950 3.521 3.371 3.646 . 0 0 "[ . 1 . 2]" 1
416 1 16 THR HA 1 16 THR MG 3.150 . 4.150 2.353 2.297 2.442 . 0 0 "[ . 1 . 2]" 1
417 1 16 THR HA 1 78 LEU H 3.820 . 4.820 3.156 2.850 3.593 . 0 0 "[ . 1 . 2]" 1
418 1 16 THR HA 1 17 LEU H 3.440 . 4.440 2.441 2.352 2.544 . 0 0 "[ . 1 . 2]" 1
419 1 16 THR HA 1 78 LEU HB2 5.000 . 6.000 4.486 4.136 4.860 . 0 0 "[ . 1 . 2]" 1
420 1 16 THR HA 1 17 LEU HB3 5.060 . 6.060 5.122 4.956 5.376 . 0 0 "[ . 1 . 2]" 1
421 1 16 THR HA 1 79 VAL HA 5.430 . 6.430 3.989 3.231 4.496 . 0 0 "[ . 1 . 2]" 1
422 1 16 THR HA 1 77 HIS HA 5.350 . 6.350 4.794 4.266 5.506 . 0 0 "[ . 1 . 2]" 1
423 1 16 THR HA 1 18 THR H 4.780 . 5.780 4.270 3.860 4.674 . 0 0 "[ . 1 . 2]" 1
424 1 16 THR HA 1 17 LEU HA 5.120 . 6.120 4.320 4.311 4.331 . 0 0 "[ . 1 . 2]" 1
425 1 16 THR HA 1 78 LEU QD 4.690 . 5.690 3.046 2.156 4.006 . 0 0 "[ . 1 . 2]" 1
426 1 16 THR HA 1 79 VAL QG 4.830 . 5.830 4.613 3.629 5.091 . 0 0 "[ . 1 . 2]" 1
427 1 16 THR HA 1 80 LEU QD 4.890 . 5.890 4.189 3.321 4.901 . 0 0 "[ . 1 . 2]" 1
428 1 15 LYS HB2 1 75 THR MG 3.570 . 4.570 2.808 2.222 3.246 . 0 0 "[ . 1 . 2]" 1
429 1 15 LYS HB2 1 78 LEU H 4.790 . 5.790 5.131 4.648 5.615 . 0 0 "[ . 1 . 2]" 1
430 1 15 LYS HB2 1 77 HIS HA 5.060 . 6.060 4.358 3.802 5.086 . 0 0 "[ . 1 . 2]" 1
431 1 78 LEU HB2 1 79 VAL HA 5.500 . 6.500 5.848 5.741 6.008 . 0 0 "[ . 1 . 2]" 1
432 1 78 LEU HB2 1 78 LEU MD1 3.430 . 4.430 2.089 1.958 2.264 . 0 0 "[ . 1 . 2]" 1
433 1 78 LEU HB2 1 78 LEU MD2 3.430 . 4.430 3.018 2.382 3.121 . 0 0 "[ . 1 . 2]" 1
434 1 78 LEU HB2 1 78 LEU QD 2.890 . 3.890 2.047 1.933 2.132 . 0 0 "[ . 1 . 2]" 1
435 1 80 LEU H 1 80 LEU HB2 3.600 . 4.600 2.428 2.095 2.628 . 0 0 "[ . 1 . 2]" 1
436 1 80 LEU H 1 80 LEU HB3 3.600 . 4.600 3.433 3.005 3.732 . 0 0 "[ . 1 . 2]" 1
437 1 80 LEU H 1 96 LEU HB3 4.900 . 5.900 5.375 4.270 5.885 . 0 0 "[ . 1 . 2]" 1
438 1 80 LEU H 1 81 ARG H 4.570 . 5.570 4.357 3.943 4.566 . 0 0 "[ . 1 . 2]" 1
439 1 80 LEU H 1 80 LEU QD 4.710 . 5.710 3.356 2.671 3.893 . 0 0 "[ . 1 . 2]" 1
440 1 80 LEU H 1 80 LEU QB 2.930 . 3.930 2.373 2.075 2.523 . 0 0 "[ . 1 . 2]" 1
441 1 18 THR MG 1 80 LEU H 5.210 . 6.210 5.061 4.482 5.892 . 0 0 "[ . 1 . 2]" 1
442 1 18 THR MG 1 90 ALA MB 3.850 . 4.850 4.175 3.223 4.884 0.034 13 0 "[ . 1 . 2]" 1
443 1 18 THR MG 1 19 GLY H 4.290 . 5.290 3.981 3.778 4.143 . 0 0 "[ . 1 . 2]" 1
444 1 18 THR MG 1 91 ALA HA 5.470 . 6.470 6.011 5.097 6.494 0.024 20 0 "[ . 1 . 2]" 1
445 1 18 THR MG 1 80 LEU HG 5.290 . 6.290 5.442 3.297 6.311 0.021 18 0 "[ . 1 . 2]" 1
446 1 18 THR MG 1 80 LEU MD2 5.500 . 6.500 5.335 3.477 6.363 . 0 0 "[ . 1 . 2]" 1
447 1 18 THR MG 1 80 LEU MD1 5.500 . 6.500 4.131 2.937 5.629 . 0 0 "[ . 1 . 2]" 1
448 1 18 THR MG 1 79 VAL QG 5.440 . 6.440 5.625 5.040 6.082 . 0 0 "[ . 1 . 2]" 1
449 1 18 THR MG 1 80 LEU QD 4.750 . 5.750 3.830 2.922 4.974 . 0 0 "[ . 1 . 2]" 1
450 1 17 LEU HB3 1 79 VAL MG2 4.860 . 5.860 5.070 3.645 5.925 0.065 8 0 "[ . 1 . 2]" 1
451 1 17 LEU HB3 1 79 VAL MG1 4.860 . 5.860 4.490 3.420 5.785 . 0 0 "[ . 1 . 2]" 1
452 1 17 LEU HB3 1 80 LEU H 5.290 . 6.290 3.946 2.697 4.997 . 0 0 "[ . 1 . 2]" 1
453 1 17 LEU HB3 1 79 VAL HA 4.580 . 5.580 4.194 3.318 5.231 . 0 0 "[ . 1 . 2]" 1
454 1 17 LEU HB3 1 18 THR H 4.790 . 5.790 2.799 2.375 3.505 . 0 0 "[ . 1 . 2]" 1
455 1 17 LEU HB3 1 100 ALA MB 4.100 . 5.100 4.837 3.982 5.153 0.053 20 0 "[ . 1 . 2]" 1
456 1 17 LEU HB3 1 100 ALA HA 5.500 . 6.500 6.382 5.550 6.563 0.063 13 0 "[ . 1 . 2]" 1
457 1 17 LEU HB3 1 79 VAL QG 3.620 . 4.620 4.017 3.136 4.646 0.026 5 0 "[ . 1 . 2]" 1
458 1 17 LEU HB3 1 17 LEU QD 2.930 . 3.930 2.267 2.090 2.440 . 0 0 "[ . 1 . 2]" 1
459 1 96 LEU HB3 1 100 ALA MB 4.630 . 5.630 5.433 4.912 5.694 0.064 6 0 "[ . 1 . 2]" 1
460 1 96 LEU HB3 1 96 LEU QD 2.990 . 3.990 2.157 2.032 2.388 . 0 0 "[ . 1 . 2]" 1
461 1 79 VAL HA 1 79 VAL MG2 3.380 . 4.380 2.594 2.097 3.203 . 0 0 "[ . 1 . 2]" 1
462 1 79 VAL HA 1 79 VAL MG1 3.380 . 4.380 2.492 2.197 3.017 . 0 0 "[ . 1 . 2]" 1
463 1 79 VAL HA 1 80 LEU H 2.670 . 3.670 2.178 2.128 2.251 . 0 0 "[ . 1 . 2]" 1
464 1 79 VAL HA 1 96 LEU HB3 5.500 . 6.500 6.043 5.205 6.556 0.056 7 0 "[ . 1 . 2]" 1
465 1 79 VAL HA 1 100 ALA MB 5.500 . 6.500 4.443 3.648 4.968 . 0 0 "[ . 1 . 2]" 1
466 1 79 VAL HA 1 80 LEU HA 5.140 . 6.140 4.408 4.379 4.437 . 0 0 "[ . 1 . 2]" 1
467 1 79 VAL HA 1 91 ALA MB 5.500 . 6.500 5.117 4.346 5.825 . 0 0 "[ . 1 . 2]" 1
468 1 79 VAL HA 1 80 LEU HG 5.500 . 6.500 4.837 3.424 6.508 0.008 3 0 "[ . 1 . 2]" 1
469 1 79 VAL HA 1 79 VAL QG 2.850 . 3.850 2.150 2.021 2.325 . 0 0 "[ . 1 . 2]" 1
470 1 79 VAL HA 1 96 LEU QD 5.280 . 6.280 3.844 3.375 4.653 . 0 0 "[ . 1 . 2]" 1
471 1 81 ARG H 1 81 ARG QB 2.940 . 3.940 2.260 2.104 2.680 . 0 0 "[ . 1 . 2]" 1
472 1 59 LEU H 1 59 LEU HG 3.050 . 4.050 2.320 2.002 3.144 . 0 0 "[ . 1 . 2]" 1
473 1 59 LEU H 1 59 LEU MD2 4.120 . 5.120 3.600 3.227 4.095 . 0 0 "[ . 1 . 2]" 1
474 1 59 LEU H 1 60 GLU H 4.910 . 5.910 4.535 4.226 4.611 . 0 0 "[ . 1 . 2]" 1
475 1 59 LEU H 1 97 ILE HG12 5.500 . 6.500 6.507 6.378 6.568 0.068 7 0 "[ . 1 . 2]" 1
476 1 59 LEU H 1 59 LEU MD1 4.120 . 5.120 3.437 3.108 3.702 . 0 0 "[ . 1 . 2]" 1
477 1 59 LEU H 1 59 LEU QB 3.420 . 4.420 2.412 2.117 2.623 . 0 0 "[ . 1 . 2]" 1
478 1 60 GLU H 1 61 ASP H 4.510 . 5.510 4.500 4.148 4.572 . 0 0 "[ . 1 . 2]" 1
479 1 53 ILE HA 1 53 ILE MD 3.790 . 4.790 2.565 2.199 3.140 . 0 0 "[ . 1 . 2]" 1
480 1 53 ILE HA 1 77 HIS QB 5.130 . 6.130 5.049 4.688 5.233 . 0 0 "[ . 1 . 2]" 1
481 1 53 ILE HA 1 53 ILE HG13 4.150 . 5.150 2.348 2.262 2.446 . 0 0 "[ . 1 . 2]" 1
482 1 53 ILE HA 1 59 LEU HG 4.410 . 5.410 3.203 2.780 4.362 . 0 0 "[ . 1 . 2]" 1
483 1 53 ILE HA 1 59 LEU MD2 5.290 . 6.290 4.669 4.130 5.552 . 0 0 "[ . 1 . 2]" 1
484 1 53 ILE HA 1 59 LEU H 3.840 . 4.840 2.430 2.231 2.705 . 0 0 "[ . 1 . 2]" 1
485 1 53 ILE HA 1 58 GLN HA 3.770 . 4.770 2.155 1.921 2.404 . 0 0 "[ . 1 . 2]" 1
486 1 53 ILE HA 1 58 GLN HB3 5.500 . 6.500 4.500 3.996 5.295 . 0 0 "[ . 1 . 2]" 1
487 1 53 ILE HA 1 58 GLN HB2 5.500 . 6.500 4.809 3.899 5.391 . 0 0 "[ . 1 . 2]" 1
488 1 53 ILE HA 1 97 ILE HG12 5.190 . 6.190 5.587 5.271 5.791 . 0 0 "[ . 1 . 2]" 1
489 1 53 ILE HA 1 53 ILE HG12 4.150 . 5.150 3.577 3.527 3.623 . 0 0 "[ . 1 . 2]" 1
490 1 53 ILE HA 1 59 LEU MD1 5.290 . 6.290 3.670 3.229 4.250 . 0 0 "[ . 1 . 2]" 1
491 1 53 ILE HA 1 58 GLN QG 5.140 . 6.140 3.908 3.164 5.082 . 0 0 "[ . 1 . 2]" 1
492 1 58 GLN HA 1 59 LEU HG 4.990 . 5.990 3.826 3.354 4.815 . 0 0 "[ . 1 . 2]" 1
493 1 58 GLN HA 1 59 LEU H 2.940 . 3.940 2.163 2.146 2.183 . 0 0 "[ . 1 . 2]" 1
494 1 58 GLN HA 1 97 ILE HG12 4.520 . 5.520 5.007 4.660 5.186 . 0 0 "[ . 1 . 2]" 1
495 1 58 GLN HA 1 59 LEU MD1 4.810 . 5.810 4.864 4.410 5.308 . 0 0 "[ . 1 . 2]" 1
496 1 58 GLN HA 1 58 GLN QG 3.580 . 4.580 2.510 2.128 3.334 . 0 0 "[ . 1 . 2]" 1
497 1 58 GLN HB3 1 59 LEU H 4.340 . 5.340 3.737 3.288 4.274 . 0 0 "[ . 1 . 2]" 1
498 1 58 GLN HB3 1 101 ILE MD 4.690 . 5.690 5.148 3.663 5.712 0.022 8 0 "[ . 1 . 2]" 1
499 1 58 GLN HB3 1 97 ILE MG 4.310 . 5.310 4.399 3.185 4.976 . 0 0 "[ . 1 . 2]" 1
500 1 58 GLN HB2 1 59 LEU H 4.340 . 5.340 4.103 3.340 4.396 . 0 0 "[ . 1 . 2]" 1
501 1 58 GLN HB2 1 101 ILE MD 4.690 . 5.690 4.913 3.404 5.735 0.045 6 0 "[ . 1 . 2]" 1
502 1 97 ILE HG12 1 100 ALA MB 4.100 . 5.100 4.792 4.350 5.119 0.019 15 0 "[ . 1 . 2]" 1
503 1 53 ILE HG12 1 59 LEU H 4.260 . 5.260 5.311 5.278 5.343 0.083 14 0 "[ . 1 . 2]" 1
504 1 53 ILE HG12 1 58 GLN HA 4.230 . 5.230 3.780 3.635 3.915 . 0 0 "[ . 1 . 2]" 1
505 1 53 ILE HG12 1 97 ILE HG12 3.950 . 4.950 2.675 2.200 3.382 . 0 0 "[ . 1 . 2]" 1
506 1 53 ILE HG12 1 58 GLN H 5.500 . 6.500 5.407 5.061 5.780 . 0 0 "[ . 1 . 2]" 1
507 1 53 ILE HG12 1 58 GLN QG 4.770 . 5.770 3.558 2.680 5.602 . 0 0 "[ . 1 . 2]" 1
508 1 59 LEU MD1 1 76 LEU HG 4.660 . 5.660 4.074 3.244 5.045 . 0 0 "[ . 1 . 2]" 1
509 1 59 LEU MD1 1 77 HIS QB 4.140 . 5.140 4.795 3.989 5.177 0.037 14 0 "[ . 1 . 2]" 1
510 1 59 LEU MD1 1 60 GLU H 5.500 . 6.500 4.854 3.733 5.314 . 0 0 "[ . 1 . 2]" 1
511 1 52 LEU HG 1 53 ILE H 4.860 . 5.860 4.715 3.804 5.437 . 0 0 "[ . 1 . 2]" 1
512 1 77 HIS HA 1 78 LEU HA 4.540 . 5.540 4.425 4.408 4.439 . 0 0 "[ . 1 . 2]" 1
513 1 77 HIS HA 1 78 LEU HB3 5.330 . 6.330 4.639 4.466 4.811 . 0 0 "[ . 1 . 2]" 1
514 1 77 HIS HA 1 78 LEU HB2 5.330 . 6.330 4.630 4.420 4.849 . 0 0 "[ . 1 . 2]" 1
515 1 77 HIS HA 1 105 LEU MD2 5.500 . 6.500 5.058 4.224 6.500 0.000 4 0 "[ . 1 . 2]" 1
516 1 23 THR H 1 23 THR MG 3.980 . 4.980 3.801 3.160 3.863 . 0 0 "[ . 1 . 2]" 1
517 1 23 THR H 1 23 THR HB 2.980 . 3.980 2.705 2.530 3.575 . 0 0 "[ . 1 . 2]" 1
518 1 23 THR H 1 39 ILE MD 5.500 . 6.500 5.858 5.409 6.513 0.013 18 0 "[ . 1 . 2]" 1
519 1 23 THR H 1 24 LEU QD 4.000 . 5.000 3.756 3.338 4.592 . 0 0 "[ . 1 . 2]" 1
520 1 23 THR H 1 42 LYS QB 5.330 . 6.330 5.018 4.582 5.596 . 0 0 "[ . 1 . 2]" 1
521 1 23 THR H 1 42 LYS QG 4.730 . 5.730 4.841 4.037 5.620 . 0 0 "[ . 1 . 2]" 1
522 1 22 ILE HA 1 22 ILE MD 3.910 . 4.910 3.867 3.551 3.986 . 0 0 "[ . 1 . 2]" 1
523 1 22 ILE HA 1 22 ILE MG 3.330 . 4.330 2.288 2.173 2.423 . 0 0 "[ . 1 . 2]" 1
524 1 22 ILE HA 1 22 ILE HG12 3.900 . 4.900 2.820 2.589 3.400 . 0 0 "[ . 1 . 2]" 1
525 1 22 ILE HA 1 22 ILE HG13 3.900 . 4.900 2.922 2.395 3.242 . 0 0 "[ . 1 . 2]" 1
526 1 22 ILE HA 1 23 THR HA 4.580 . 5.580 4.409 4.395 4.418 . 0 0 "[ . 1 . 2]" 1
527 1 22 ILE HA 1 23 THR HB 5.110 . 6.110 4.781 4.528 5.615 . 0 0 "[ . 1 . 2]" 1
528 1 22 ILE HA 1 23 THR H 2.620 . 3.620 2.164 2.148 2.182 . 0 0 "[ . 1 . 2]" 1
529 1 39 ILE MD 1 40 GLN H 4.250 . 5.250 4.059 3.833 4.326 . 0 0 "[ . 1 . 2]" 1
530 1 39 ILE MD 1 45 ILE HB 3.640 . 4.640 3.887 2.952 4.450 . 0 0 "[ . 1 . 2]" 1
531 1 39 ILE MD 1 45 ILE H 4.150 . 5.150 4.859 4.216 5.202 0.052 13 0 "[ . 1 . 2]" 1
532 1 39 ILE MD 1 43 GLU HB3 3.940 . 4.940 3.738 3.151 4.199 . 0 0 "[ . 1 . 2]" 1
533 1 39 ILE MD 1 43 GLU HB2 3.940 . 4.940 2.431 1.999 3.085 . 0 0 "[ . 1 . 2]" 1
534 1 39 ILE MD 1 43 GLU HA 4.870 . 5.870 4.526 4.269 4.888 . 0 0 "[ . 1 . 2]" 1
535 1 39 ILE MD 1 43 GLU HG3 4.100 . 5.100 2.861 2.090 4.403 . 0 0 "[ . 1 . 2]" 1
536 1 39 ILE MD 1 42 LYS QB 4.370 . 5.370 2.558 2.047 3.526 . 0 0 "[ . 1 . 2]" 1
537 1 39 ILE MD 1 42 LYS QG 4.220 . 5.220 3.640 2.604 4.933 . 0 0 "[ . 1 . 2]" 1
538 1 82 LEU H 1 82 LEU MD2 4.100 . 5.100 3.990 2.890 4.757 . 0 0 "[ . 1 . 2]" 1
539 1 82 LEU H 1 82 LEU HB2 2.950 . 3.950 2.512 2.112 3.356 . 0 0 "[ . 1 . 2]" 1
540 1 82 LEU H 1 82 LEU HB3 2.950 . 3.950 3.011 2.584 3.317 . 0 0 "[ . 1 . 2]" 1
541 1 82 LEU H 1 93 GLU HB3 4.800 . 5.800 3.932 3.508 4.490 . 0 0 "[ . 1 . 2]" 1
542 1 82 LEU H 1 93 GLU HB2 4.800 . 5.800 2.583 1.784 5.157 . 0 0 "[ . 1 . 2]" 1
543 1 82 LEU H 1 92 ASP HA 4.990 . 5.990 4.908 3.982 5.844 . 0 0 "[ . 1 . 2]" 1
544 1 82 LEU H 1 93 GLU H 4.820 . 5.820 3.820 2.285 4.963 . 0 0 "[ . 1 . 2]" 1
545 1 82 LEU H 1 82 LEU QB 2.550 . 3.550 2.345 2.079 2.711 . 0 0 "[ . 1 . 2]" 1
546 1 82 LEU MD2 1 83 ARG HA 5.500 . 6.500 5.025 3.850 5.875 . 0 0 "[ . 1 . 2]" 1
547 1 82 LEU MD2 1 87 MET HA 5.090 . 6.090 3.907 2.152 5.667 . 0 0 "[ . 1 . 2]" 1
548 1 82 LEU MD2 1 83 ARG H 3.830 . 4.830 3.520 1.821 4.880 0.050 1 0 "[ . 1 . 2]" 1
549 1 93 GLU HB3 1 96 LEU MD2 5.500 . 6.500 4.758 4.266 5.388 . 0 0 "[ . 1 . 2]" 1
550 1 93 GLU HB3 1 96 LEU MD1 5.500 . 6.500 5.304 4.606 5.786 . 0 0 "[ . 1 . 2]" 1
551 1 93 GLU HB3 1 96 LEU QD 4.120 . 5.120 4.418 4.086 4.956 . 0 0 "[ . 1 . 2]" 1
552 1 81 ARG QD 1 82 LEU H 4.460 . 5.460 4.181 2.051 4.904 . 0 0 "[ . 1 . 2]" 1
553 1 81 ARG QD 1 83 ARG H 5.500 . 6.500 6.018 4.760 6.554 0.054 2 0 "[ . 1 . 2]" 1
554 1 81 ARG QD 1 82 LEU HA 5.500 . 6.500 5.883 4.538 6.400 . 0 0 "[ . 1 . 2]" 1
555 1 81 ARG HA 1 82 LEU H 2.620 . 3.620 2.441 2.149 2.889 . 0 0 "[ . 1 . 2]" 1
556 1 81 ARG HA 1 93 GLU HB3 5.210 . 6.210 5.232 4.578 6.080 . 0 0 "[ . 1 . 2]" 1
557 1 81 ARG HA 1 93 GLU HB2 5.210 . 6.210 4.322 3.541 6.074 . 0 0 "[ . 1 . 2]" 1
558 1 81 ARG HA 1 81 ARG QD 4.230 . 5.230 4.009 3.401 4.506 . 0 0 "[ . 1 . 2]" 1
559 1 81 ARG HA 1 93 GLU HA 4.770 . 5.770 2.661 1.986 3.617 . 0 0 "[ . 1 . 2]" 1
560 1 81 ARG HA 1 81 ARG QG 3.190 . 4.190 2.497 2.075 3.311 . 0 0 "[ . 1 . 2]" 1
561 1 81 ARG HA 1 96 LEU QD 5.130 . 6.130 2.013 1.807 2.354 . 0 0 "[ . 1 . 2]" 1
562 1 81 ARG HA 1 82 LEU QB 4.830 . 5.830 4.042 3.830 4.629 . 0 0 "[ . 1 . 2]" 1
563 1 92 ASP HA 1 93 GLU HB2 3.860 . 4.860 4.449 3.948 4.858 . 0 0 "[ . 1 . 2]" 1
564 1 92 ASP HA 1 93 GLU H 3.110 . 4.110 3.156 2.690 3.576 . 0 0 "[ . 1 . 2]" 1
565 1 92 ASP HA 1 92 ASP HB3 2.820 . 3.820 2.492 2.339 2.772 . 0 0 "[ . 1 . 2]" 1
566 1 92 ASP HA 1 93 GLU HA 4.910 . 5.910 4.736 4.452 5.016 . 0 0 "[ . 1 . 2]" 1
567 1 92 ASP HA 1 95 GLU H 5.120 . 6.120 5.943 5.344 6.193 0.073 4 0 "[ . 1 . 2]" 1
568 1 92 ASP HA 1 95 GLU QG 4.730 . 5.730 4.437 4.121 5.175 . 0 0 "[ . 1 . 2]" 1
569 1 93 GLU H 1 93 GLU HB2 3.340 . 4.340 3.219 2.683 3.841 . 0 0 "[ . 1 . 2]" 1
570 1 93 GLU H 1 95 GLU H 4.230 . 5.230 4.155 2.915 5.240 0.010 16 0 "[ . 1 . 2]" 1
571 1 93 GLU H 1 96 LEU QD 4.380 . 5.380 3.033 1.763 4.422 . 0 0 "[ . 1 . 2]" 1
572 1 40 GLN H 1 44 GLY H 5.000 . 6.000 5.163 5.073 5.291 . 0 0 "[ . 1 . 2]" 1
573 1 40 GLN H 1 41 ASP H 3.660 . 4.660 2.705 2.629 2.779 . 0 0 "[ . 1 . 2]" 1
574 1 40 GLN H 1 47 PRO HD2 4.750 . 5.750 5.730 5.486 5.825 0.075 16 0 "[ . 1 . 2]" 1
575 1 40 GLN H 1 41 ASP HA 5.420 . 6.420 5.307 5.210 5.372 . 0 0 "[ . 1 . 2]" 1
576 1 40 GLN H 1 41 ASP HB3 4.690 . 5.690 4.942 4.595 5.396 . 0 0 "[ . 1 . 2]" 1
577 1 40 GLN H 1 40 GLN HB2 3.560 . 4.560 3.503 3.453 3.564 . 0 0 "[ . 1 . 2]" 1
578 1 40 GLN H 1 40 GLN HB3 3.560 . 4.560 2.202 2.136 2.303 . 0 0 "[ . 1 . 2]" 1
579 1 40 GLN H 1 40 GLN HG2 4.170 . 5.170 3.260 2.917 3.742 . 0 0 "[ . 1 . 2]" 1
580 1 40 GLN H 1 45 ILE HB 5.500 . 6.500 5.261 4.792 5.823 . 0 0 "[ . 1 . 2]" 1
581 1 40 GLN H 1 45 ILE H 5.350 . 6.350 6.045 5.764 6.362 0.012 16 0 "[ . 1 . 2]" 1
582 1 40 GLN H 1 42 LYS H 4.490 . 5.490 4.050 3.906 4.269 . 0 0 "[ . 1 . 2]" 1
583 1 40 GLN H 1 42 LYS QG 5.240 . 6.240 5.477 4.574 6.300 0.060 20 0 "[ . 1 . 2]" 1
584 1 44 GLY H 1 45 ILE HB 4.220 . 5.220 5.124 4.879 5.237 0.017 8 0 "[ . 1 . 2]" 1
585 1 44 GLY H 1 45 ILE H 3.250 . 4.250 3.303 3.121 3.534 . 0 0 "[ . 1 . 2]" 1
586 1 44 GLY H 1 45 ILE MG 5.440 . 6.440 6.107 5.915 6.218 . 0 0 "[ . 1 . 2]" 1
587 1 44 GLY H 1 45 ILE HG13 4.940 . 5.940 5.665 4.839 6.011 0.071 18 0 "[ . 1 . 2]" 1
588 1 39 ILE H 1 39 ILE MD 4.480 . 5.480 4.235 4.121 4.358 . 0 0 "[ . 1 . 2]" 1
589 1 39 ILE H 1 40 GLN H 3.410 . 4.410 2.647 2.534 2.724 . 0 0 "[ . 1 . 2]" 1
590 1 39 ILE H 1 39 ILE MG 3.860 . 4.860 3.046 2.904 3.351 . 0 0 "[ . 1 . 2]" 1
591 1 39 ILE H 1 39 ILE HG13 4.750 . 5.750 4.407 4.201 4.516 . 0 0 "[ . 1 . 2]" 1
592 1 41 ASP H 1 44 GLY H 4.970 . 5.970 4.316 4.176 4.387 . 0 0 "[ . 1 . 2]" 1
593 1 41 ASP H 1 41 ASP HB3 3.390 . 4.390 2.445 2.099 2.840 . 0 0 "[ . 1 . 2]" 1
594 1 41 ASP H 1 42 LYS H 3.190 . 4.190 2.375 2.248 2.429 . 0 0 "[ . 1 . 2]" 1
595 1 41 ASP H 1 43 GLU H 4.280 . 5.280 4.051 3.790 4.242 . 0 0 "[ . 1 . 2]" 1
596 1 41 ASP H 1 41 ASP HB2 3.390 . 4.390 2.690 2.308 3.175 . 0 0 "[ . 1 . 2]" 1
597 1 41 ASP H 1 42 LYS QG 4.730 . 5.730 4.162 3.421 5.757 0.027 17 0 "[ . 1 . 2]" 1
598 1 37 SER HA 1 40 GLN H 3.550 . 4.550 3.192 3.078 3.344 . 0 0 "[ . 1 . 2]" 1
599 1 37 SER HA 1 47 PRO HD2 4.660 . 5.660 4.314 3.893 4.906 . 0 0 "[ . 1 . 2]" 1
600 1 37 SER HA 1 39 ILE MG 4.520 . 5.520 4.196 3.929 4.649 . 0 0 "[ . 1 . 2]" 1
601 1 37 SER HA 1 47 PRO HG2 5.210 . 6.210 3.884 3.130 4.248 . 0 0 "[ . 1 . 2]" 1
602 1 37 SER HA 1 47 PRO HB2 4.160 . 5.160 4.249 3.567 4.920 . 0 0 "[ . 1 . 2]" 1
603 1 41 ASP HB3 1 42 LYS H 3.720 . 4.720 2.913 2.669 3.260 . 0 0 "[ . 1 . 2]" 1
604 1 41 ASP HB3 1 43 GLU H 5.500 . 6.500 5.273 5.001 5.580 . 0 0 "[ . 1 . 2]" 1
605 1 41 ASP HB3 1 42 LYS HA 5.410 . 6.410 4.483 4.153 5.077 . 0 0 "[ . 1 . 2]" 1
606 1 40 GLN HB2 1 41 ASP H 4.380 . 5.380 4.231 4.126 4.321 . 0 0 "[ . 1 . 2]" 1
607 1 40 GLN HB2 1 47 PRO HD2 4.630 . 5.630 3.959 3.706 4.471 . 0 0 "[ . 1 . 2]" 1
608 1 40 GLN HB2 1 45 ILE H 5.040 . 6.040 4.594 4.403 4.833 . 0 0 "[ . 1 . 2]" 1
609 1 40 GLN HB2 1 46 PRO HA 4.750 . 5.750 2.769 2.486 3.233 . 0 0 "[ . 1 . 2]" 1
610 1 40 GLN HB2 1 47 PRO HA 5.120 . 6.120 5.182 4.789 5.680 . 0 0 "[ . 1 . 2]" 1
611 1 39 ILE HB 1 39 ILE MD 3.430 . 4.430 3.197 3.169 3.208 . 0 0 "[ . 1 . 2]" 1
612 1 39 ILE HB 1 40 GLN H 3.770 . 4.770 3.346 3.072 3.467 . 0 0 "[ . 1 . 2]" 1
613 1 39 ILE HB 1 42 LYS H 5.500 . 6.500 5.571 5.470 5.796 . 0 0 "[ . 1 . 2]" 1
614 1 39 ILE HB 1 78 LEU QD 4.480 . 5.480 3.270 2.932 3.562 . 0 0 "[ . 1 . 2]" 1
615 1 40 GLN HB3 1 44 GLY H 4.290 . 5.290 5.328 5.246 5.410 0.120 16 0 "[ . 1 . 2]" 1
616 1 40 GLN HB3 1 41 ASP H 4.380 . 5.380 3.786 3.695 4.002 . 0 0 "[ . 1 . 2]" 1
617 1 40 GLN HB3 1 47 PRO HD2 4.630 . 5.630 3.724 3.537 3.909 . 0 0 "[ . 1 . 2]" 1
618 1 40 GLN HB3 1 45 ILE H 5.040 . 6.040 5.615 5.466 5.704 . 0 0 "[ . 1 . 2]" 1
619 1 40 GLN HB3 1 46 PRO HA 4.750 . 5.750 3.295 2.947 3.677 . 0 0 "[ . 1 . 2]" 1
620 1 40 GLN HB3 1 45 ILE HA 4.780 . 5.780 5.776 5.545 5.844 0.064 13 0 "[ . 1 . 2]" 1
621 1 40 GLN HG2 1 41 ASP H 4.180 . 5.180 3.032 2.179 3.991 . 0 0 "[ . 1 . 2]" 1
622 1 40 GLN HG2 1 47 PRO HD2 4.750 . 5.750 4.664 3.525 5.705 . 0 0 "[ . 1 . 2]" 1
623 1 45 ILE HB 1 45 ILE MD 3.320 . 4.320 2.907 2.169 3.215 . 0 0 "[ . 1 . 2]" 1
624 1 45 ILE HB 1 46 PRO HD3 5.040 . 6.040 4.909 4.511 5.225 . 0 0 "[ . 1 . 2]" 1
625 1 45 ILE HB 1 46 PRO HD2 5.040 . 6.040 4.333 4.164 4.494 . 0 0 "[ . 1 . 2]" 1
626 1 45 ILE HB 1 50 GLN QG 4.750 . 5.750 3.529 2.503 4.691 . 0 0 "[ . 1 . 2]" 1
627 1 39 ILE MG 1 78 LEU HG 5.160 . 6.160 5.018 4.686 5.615 . 0 0 "[ . 1 . 2]" 1
628 1 39 ILE MG 1 40 GLN H 3.600 . 4.600 2.058 1.833 2.323 . 0 0 "[ . 1 . 2]" 1
629 1 39 ILE MG 1 44 GLY H 4.520 . 5.520 4.651 4.466 4.962 . 0 0 "[ . 1 . 2]" 1
630 1 39 ILE MG 1 41 ASP H 4.700 . 5.700 4.154 4.006 4.308 . 0 0 "[ . 1 . 2]" 1
631 1 39 ILE MG 1 40 GLN HG2 4.770 . 5.770 4.708 4.328 5.136 . 0 0 "[ . 1 . 2]" 1
632 1 39 ILE MG 1 45 ILE HB 3.420 . 4.420 2.968 2.433 3.612 . 0 0 "[ . 1 . 2]" 1
633 1 39 ILE MG 1 45 ILE MG 3.690 . 4.690 3.638 2.973 4.220 . 0 0 "[ . 1 . 2]" 1
634 1 39 ILE MG 1 45 ILE HG13 5.380 . 6.380 4.518 3.891 5.543 . 0 0 "[ . 1 . 2]" 1
635 1 39 ILE MG 1 43 GLU HB3 3.590 . 4.590 4.480 3.952 4.626 0.036 5 0 "[ . 1 . 2]" 1
636 1 39 ILE MG 1 40 GLN HA 4.400 . 5.400 2.835 2.784 2.871 . 0 0 "[ . 1 . 2]" 1
637 1 39 ILE MG 1 42 LYS H 4.800 . 5.800 4.311 4.109 4.716 . 0 0 "[ . 1 . 2]" 1
638 1 39 ILE MG 1 46 PRO HA 5.060 . 6.060 5.029 4.578 5.467 . 0 0 "[ . 1 . 2]" 1
639 1 39 ILE MG 1 43 GLU H 4.310 . 5.310 3.618 3.398 4.042 . 0 0 "[ . 1 . 2]" 1
640 1 39 ILE MG 1 47 PRO HA 5.160 . 6.160 3.462 2.390 3.898 . 0 0 "[ . 1 . 2]" 1
641 1 39 ILE MG 1 40 GLN HG3 4.770 . 5.770 4.914 4.241 5.381 . 0 0 "[ . 1 . 2]" 1
642 1 39 ILE HG12 1 39 ILE MG 3.470 . 4.470 3.200 3.172 3.206 . 0 0 "[ . 1 . 2]" 1
643 1 39 ILE MG 1 47 PRO HB2 4.870 . 5.870 5.691 4.433 5.947 0.077 14 0 "[ . 1 . 2]" 1
644 1 39 ILE MG 1 45 ILE HG12 5.380 . 6.380 4.791 3.747 6.102 . 0 0 "[ . 1 . 2]" 1
645 1 39 ILE MG 1 80 LEU QD 4.270 . 5.270 3.679 2.899 4.264 . 0 0 "[ . 1 . 2]" 1
646 1 39 ILE MG 1 42 LYS QB 5.270 . 6.270 4.232 3.870 4.919 . 0 0 "[ . 1 . 2]" 1
647 1 39 ILE MG 1 50 GLN QG 4.350 . 5.350 2.809 1.942 3.744 . 0 0 "[ . 1 . 2]" 1
648 1 90 ALA H 1 90 ALA MB 3.010 . 4.010 2.201 2.079 2.255 . 0 0 "[ . 1 . 2]" 1
649 1 90 ALA MB 1 99 LYS HD2 3.830 . 4.830 3.937 2.561 4.856 0.026 7 0 "[ . 1 . 2]" 1
650 1 90 ALA MB 1 91 ALA H 3.610 . 4.610 2.287 1.866 3.128 . 0 0 "[ . 1 . 2]" 1
651 1 64 THR H 1 67 ASP H 4.150 . 5.150 4.016 3.755 4.243 . 0 0 "[ . 1 . 2]" 1
652 1 64 THR H 1 67 ASP HB3 3.750 . 4.750 3.407 2.256 4.489 . 0 0 "[ . 1 . 2]" 1
653 1 64 THR H 1 67 ASP HB2 3.750 . 4.750 2.678 2.176 4.266 . 0 0 "[ . 1 . 2]" 1
654 1 64 THR H 1 64 THR MG 3.140 . 4.140 2.988 2.696 3.213 . 0 0 "[ . 1 . 2]" 1
655 1 64 THR H 1 65 LEU H 5.190 . 6.190 4.487 4.423 4.510 . 0 0 "[ . 1 . 2]" 1
656 1 64 THR H 1 68 TYR H 5.450 . 6.450 5.491 4.488 6.214 . 0 0 "[ . 1 . 2]" 1
657 1 64 THR H 1 67 ASP HA 4.690 . 5.690 4.921 4.552 5.271 . 0 0 "[ . 1 . 2]" 1
658 1 64 THR H 1 67 ASP QB 3.150 . 4.150 2.497 2.135 3.259 . 0 0 "[ . 1 . 2]" 1
659 1 67 ASP H 1 67 ASP HB3 3.610 . 4.610 2.688 2.114 3.477 . 0 0 "[ . 1 . 2]" 1
660 1 67 ASP H 1 67 ASP HB2 3.610 . 4.610 2.514 2.086 3.604 . 0 0 "[ . 1 . 2]" 1
661 1 67 ASP H 1 68 TYR H 3.260 . 4.260 2.855 2.576 3.007 . 0 0 "[ . 1 . 2]" 1
662 1 67 ASP H 1 67 ASP QB 3.100 . 4.100 2.214 2.063 2.422 . 0 0 "[ . 1 . 2]" 1
663 1 38 LYS H 1 40 GLN H 4.300 . 5.300 4.343 4.244 4.498 . 0 0 "[ . 1 . 2]" 1
664 1 38 LYS H 1 39 ILE H 3.580 . 4.580 2.768 2.654 2.814 . 0 0 "[ . 1 . 2]" 1
665 1 38 LYS H 1 39 ILE HB 4.840 . 5.840 4.657 4.523 4.733 . 0 0 "[ . 1 . 2]" 1
666 1 38 LYS H 1 39 ILE HA 5.320 . 6.320 5.370 5.265 5.404 . 0 0 "[ . 1 . 2]" 1
667 1 37 SER H 1 38 LYS H 3.310 . 4.310 2.926 2.875 2.996 . 0 0 "[ . 1 . 2]" 1
668 1 66 SER H 1 67 ASP H 3.670 . 4.670 2.580 2.475 2.678 . 0 0 "[ . 1 . 2]" 1
669 1 66 SER H 1 66 SER HB2 3.610 . 4.610 3.033 2.491 3.612 . 0 0 "[ . 1 . 2]" 1
670 1 66 SER H 1 66 SER HB3 3.610 . 4.610 2.591 2.337 2.778 . 0 0 "[ . 1 . 2]" 1
671 1 66 SER H 1 68 TYR H 4.810 . 5.810 4.894 4.391 5.140 . 0 0 "[ . 1 . 2]" 1
672 1 66 SER H 1 69 ASN H 4.810 . 5.810 4.779 4.562 4.915 . 0 0 "[ . 1 . 2]" 1
673 1 64 THR HB 1 67 ASP H 4.160 . 5.160 3.279 2.952 4.015 . 0 0 "[ . 1 . 2]" 1
674 1 64 THR HB 1 66 SER H 3.590 . 4.590 2.700 2.578 2.848 . 0 0 "[ . 1 . 2]" 1
675 1 64 THR HB 1 66 SER HB2 4.840 . 5.840 4.852 4.451 5.441 . 0 0 "[ . 1 . 2]" 1
676 1 64 THR HB 1 66 SER HB3 4.840 . 5.840 4.084 3.280 4.959 . 0 0 "[ . 1 . 2]" 1
677 1 64 THR HB 1 65 LEU H 3.250 . 4.250 2.363 2.022 2.605 . 0 0 "[ . 1 . 2]" 1
678 1 64 THR HB 1 65 LEU HG 5.290 . 6.290 5.348 5.123 5.576 . 0 0 "[ . 1 . 2]" 1
679 1 34 ASN HA 1 38 LYS H 4.510 . 5.510 3.648 3.347 3.859 . 0 0 "[ . 1 . 2]" 1
680 1 34 ASN HA 1 37 SER H 3.480 . 4.480 3.787 3.493 3.998 . 0 0 "[ . 1 . 2]" 1
681 1 34 ASN HA 1 36 LYS H 4.660 . 5.660 4.524 4.315 4.672 . 0 0 "[ . 1 . 2]" 1
682 1 34 ASN HA 1 35 VAL QG 5.230 . 6.230 4.754 4.433 4.931 . 0 0 "[ . 1 . 2]" 1
683 1 34 ASN HA 1 36 LYS QB 5.340 . 6.340 5.098 4.770 5.329 . 0 0 "[ . 1 . 2]" 1
684 1 34 ASN HA 1 37 SER QB 3.200 . 4.200 3.403 2.520 3.797 . 0 0 "[ . 1 . 2]" 1
685 1 29 SER HA 1 67 ASP H 4.960 . 5.960 4.137 4.005 4.305 . 0 0 "[ . 1 . 2]" 1
686 1 29 SER HA 1 66 SER H 4.370 . 5.370 1.587 1.539 1.639 . 0 0 "[ . 1 . 2]" 1
687 1 29 SER HA 1 64 THR HB 3.380 . 4.380 3.335 3.137 3.568 . 0 0 "[ . 1 . 2]" 1
688 1 29 SER HA 1 66 SER HB2 4.500 . 5.500 2.967 2.221 3.998 . 0 0 "[ . 1 . 2]" 1
689 1 29 SER HA 1 66 SER HB3 4.500 . 5.500 2.635 2.192 3.103 . 0 0 "[ . 1 . 2]" 1
690 1 29 SER HA 1 64 THR MG 3.540 . 4.540 4.521 4.392 4.578 0.038 3 0 "[ . 1 . 2]" 1
691 1 29 SER HA 1 65 LEU HB2 5.500 . 6.500 2.601 2.482 2.687 . 0 0 "[ . 1 . 2]" 1
692 1 29 SER HA 1 65 LEU H 4.620 . 5.620 2.959 2.558 3.172 . 0 0 "[ . 1 . 2]" 1
693 1 29 SER HA 1 65 LEU HG 5.500 . 6.500 4.896 4.773 4.968 . 0 0 "[ . 1 . 2]" 1
694 1 29 SER HA 1 64 THR HA 4.730 . 5.730 5.048 4.840 5.181 . 0 0 "[ . 1 . 2]" 1
695 1 29 SER HA 1 66 SER QB 3.930 . 4.930 2.247 2.105 2.543 . 0 0 "[ . 1 . 2]" 1
696 1 66 SER HB2 1 67 ASP H 4.300 . 5.300 4.214 4.086 4.354 . 0 0 "[ . 1 . 2]" 1
697 1 66 SER HB3 1 67 ASP H 4.300 . 5.300 3.784 3.326 4.356 . 0 0 "[ . 1 . 2]" 1
698 1 39 ILE HA 1 39 ILE MD 3.710 . 4.710 2.285 2.137 2.643 . 0 0 "[ . 1 . 2]" 1
699 1 39 ILE HA 1 41 ASP H 4.510 . 5.510 3.964 3.865 4.117 . 0 0 "[ . 1 . 2]" 1
700 1 39 ILE HA 1 39 ILE MG 3.220 . 4.220 3.041 2.887 3.109 . 0 0 "[ . 1 . 2]" 1
701 1 39 ILE HA 1 40 GLN HA 5.310 . 6.310 4.818 4.747 4.849 . 0 0 "[ . 1 . 2]" 1
702 1 39 ILE HA 1 42 LYS H 3.800 . 4.800 3.262 3.155 3.494 . 0 0 "[ . 1 . 2]" 1
703 1 39 ILE HA 1 43 GLU H 4.250 . 5.250 3.916 3.652 4.162 . 0 0 "[ . 1 . 2]" 1
704 1 39 ILE HA 1 43 GLU HG3 5.500 . 6.500 5.289 4.035 6.576 0.076 12 0 "[ . 1 . 2]" 1
705 1 39 ILE HA 1 42 LYS HG2 4.720 . 5.720 3.667 2.311 4.677 . 0 0 "[ . 1 . 2]" 1
706 1 39 ILE HA 1 42 LYS HG3 4.720 . 5.720 3.612 2.720 5.172 . 0 0 "[ . 1 . 2]" 1
707 1 39 ILE HA 1 39 ILE HG12 3.650 . 4.650 2.293 2.098 2.427 . 0 0 "[ . 1 . 2]" 1
708 1 39 ILE HA 1 42 LYS HA 5.500 . 6.500 5.367 5.101 5.783 . 0 0 "[ . 1 . 2]" 1
709 1 39 ILE HA 1 78 LEU QD 5.440 . 6.440 4.785 4.491 5.114 . 0 0 "[ . 1 . 2]" 1
710 1 39 ILE HA 1 42 LYS QB 3.940 . 4.940 2.738 2.212 3.233 . 0 0 "[ . 1 . 2]" 1
711 1 39 ILE HA 1 42 LYS QG 4.120 . 5.120 3.133 2.241 4.011 . 0 0 "[ . 1 . 2]" 1
712 1 39 ILE HA 1 42 LYS QE 5.340 . 6.340 4.952 4.263 6.008 . 0 0 "[ . 1 . 2]" 1
713 1 35 VAL HA 1 38 LYS H 3.800 . 4.800 3.878 3.766 4.111 . 0 0 "[ . 1 . 2]" 1
714 1 35 VAL HA 1 38 LYS HA 5.500 . 6.500 5.559 5.401 5.738 . 0 0 "[ . 1 . 2]" 1
715 1 35 VAL HA 1 35 VAL MG2 3.340 . 4.340 2.386 2.139 3.135 . 0 0 "[ . 1 . 2]" 1
716 1 35 VAL HA 1 35 VAL MG1 3.340 . 4.340 2.378 2.310 2.675 . 0 0 "[ . 1 . 2]" 1
717 1 35 VAL HA 1 37 SER QB 5.340 . 6.340 6.048 5.346 6.352 0.012 13 0 "[ . 1 . 2]" 1
718 1 67 ASP HB3 1 68 TYR H 4.190 . 5.190 2.504 2.049 3.641 . 0 0 "[ . 1 . 2]" 1
719 1 67 ASP HB2 1 68 TYR H 4.190 . 5.190 3.582 2.863 4.048 . 0 0 "[ . 1 . 2]" 1
720 1 65 LEU HB3 1 67 ASP H 5.050 . 6.050 4.913 4.794 5.073 . 0 0 "[ . 1 . 2]" 1
721 1 65 LEU HB3 1 66 SER H 4.180 . 5.180 3.304 3.143 3.439 . 0 0 "[ . 1 . 2]" 1
722 1 65 LEU HB3 1 66 SER HB2 5.500 . 6.500 5.311 4.555 6.148 . 0 0 "[ . 1 . 2]" 1
723 1 65 LEU HB3 1 66 SER HB3 5.500 . 6.500 5.171 4.575 5.597 . 0 0 "[ . 1 . 2]" 1
724 1 65 LEU HB3 1 66 SER HA 5.310 . 6.310 4.130 4.030 4.214 . 0 0 "[ . 1 . 2]" 1
725 1 65 LEU HB3 1 70 ILE H 5.260 . 6.260 4.283 3.638 4.912 . 0 0 "[ . 1 . 2]" 1
726 1 64 THR MG 1 67 ASP H 4.370 . 5.370 4.500 4.398 4.686 . 0 0 "[ . 1 . 2]" 1
727 1 64 THR MG 1 66 SER H 4.460 . 5.460 4.276 4.064 4.388 . 0 0 "[ . 1 . 2]" 1
728 1 64 THR MG 1 66 SER HB2 5.500 . 6.500 5.731 5.415 6.239 . 0 0 "[ . 1 . 2]" 1
729 1 64 THR MG 1 66 SER HB3 5.500 . 6.500 5.058 4.336 5.947 . 0 0 "[ . 1 . 2]" 1
730 1 64 THR MG 1 65 LEU H 3.890 . 4.890 3.446 3.216 3.641 . 0 0 "[ . 1 . 2]" 1
731 1 64 THR MG 1 66 SER QB 4.690 . 5.690 4.721 4.185 5.417 . 0 0 "[ . 1 . 2]" 1
732 1 27 GLU HB3 1 30 ASP H 3.570 . 4.570 3.355 2.958 3.680 . 0 0 "[ . 1 . 2]" 1
733 1 27 GLU HB3 1 28 SER H 3.560 . 4.560 2.632 2.448 2.812 . 0 0 "[ . 1 . 2]" 1
734 1 27 GLU HB3 1 29 SER H 4.320 . 5.320 2.615 2.220 2.939 . 0 0 "[ . 1 . 2]" 1
735 1 27 GLU HB3 1 28 SER HA 5.500 . 6.500 4.907 4.655 5.014 . 0 0 "[ . 1 . 2]" 1
736 1 30 ASP H 1 64 THR HB 4.640 . 5.640 5.324 4.913 5.644 0.004 10 0 "[ . 1 . 2]" 1
737 1 30 ASP H 1 65 LEU HB3 4.960 . 5.960 3.705 3.626 3.927 . 0 0 "[ . 1 . 2]" 1
738 1 30 ASP H 1 64 THR MG 5.170 . 6.170 5.557 5.193 5.802 . 0 0 "[ . 1 . 2]" 1
739 1 30 ASP H 1 65 LEU HB2 4.960 . 5.960 2.487 2.393 2.692 . 0 0 "[ . 1 . 2]" 1
740 1 30 ASP H 1 65 LEU MD1 5.290 . 6.290 2.915 2.805 3.116 . 0 0 "[ . 1 . 2]" 1
741 1 30 ASP H 1 65 LEU MD2 5.290 . 6.290 4.905 4.839 5.041 . 0 0 "[ . 1 . 2]" 1
742 1 30 ASP H 1 34 ASN HB3 5.500 . 6.500 6.302 5.855 6.556 0.056 1 0 "[ . 1 . 2]" 1
743 1 30 ASP H 1 65 LEU H 4.220 . 5.220 3.885 3.736 4.055 . 0 0 "[ . 1 . 2]" 1
744 1 30 ASP H 1 30 ASP QB 2.750 . 3.750 2.062 2.046 2.113 . 0 0 "[ . 1 . 2]" 1
745 1 65 LEU HB2 1 66 SER H 4.180 . 5.180 2.809 2.709 2.928 . 0 0 "[ . 1 . 2]" 1
746 1 65 LEU HB2 1 70 ILE MG 4.260 . 5.260 4.984 4.414 5.292 0.032 2 0 "[ . 1 . 2]" 1
747 1 65 LEU HB2 1 66 SER HA 5.310 . 6.310 4.765 4.679 4.857 . 0 0 "[ . 1 . 2]" 1
748 1 65 LEU HB2 1 70 ILE H 5.260 . 6.260 5.665 5.108 6.187 . 0 0 "[ . 1 . 2]" 1
749 1 65 LEU HB2 1 66 SER QB 5.340 . 6.340 4.384 4.244 4.575 . 0 0 "[ . 1 . 2]" 1
750 1 65 LEU MD1 1 66 SER H 4.930 . 5.930 4.757 4.625 4.857 . 0 0 "[ . 1 . 2]" 1
751 1 65 LEU MD1 1 70 ILE MG 3.420 . 4.420 3.071 2.317 3.488 . 0 0 "[ . 1 . 2]" 1
752 1 65 LEU MD1 1 71 GLN HA 5.500 . 6.500 5.401 4.363 6.113 . 0 0 "[ . 1 . 2]" 1
753 1 65 LEU MD1 1 70 ILE MD 4.020 . 5.020 4.253 3.716 5.036 0.016 11 0 "[ . 1 . 2]" 1
754 1 65 LEU MD1 1 70 ILE H 5.370 . 6.370 5.420 4.995 5.937 . 0 0 "[ . 1 . 2]" 1
755 1 65 LEU MD1 1 70 ILE HB 4.640 . 5.640 3.728 3.159 4.803 . 0 0 "[ . 1 . 2]" 1
756 1 65 LEU MD2 1 66 SER H 4.930 . 5.930 4.487 4.439 4.520 . 0 0 "[ . 1 . 2]" 1
757 1 65 LEU MD2 1 70 ILE MG 3.420 . 4.420 2.231 1.840 2.418 . 0 0 "[ . 1 . 2]" 1
758 1 65 LEU MD2 1 71 GLN H 5.440 . 6.440 5.485 4.213 5.932 . 0 0 "[ . 1 . 2]" 1
759 1 65 LEU MD2 1 70 ILE HA 4.670 . 5.670 4.622 4.522 4.786 . 0 0 "[ . 1 . 2]" 1
760 1 65 LEU MD2 1 68 TYR H 5.310 . 6.310 4.990 4.753 5.221 . 0 0 "[ . 1 . 2]" 1
761 1 65 LEU MD2 1 70 ILE MD 4.020 . 5.020 2.328 1.866 3.542 . 0 0 "[ . 1 . 2]" 1
762 1 65 LEU MD2 1 70 ILE H 5.370 . 6.370 4.035 3.601 4.342 . 0 0 "[ . 1 . 2]" 1
763 1 65 LEU MD2 1 70 ILE HB 4.640 . 5.640 2.102 1.975 2.613 . 0 0 "[ . 1 . 2]" 1
764 1 34 ASN HB3 1 35 VAL H 3.610 . 4.610 2.950 2.463 3.567 . 0 0 "[ . 1 . 2]" 1
765 1 34 ASN HB3 1 37 SER QB 5.340 . 6.340 5.794 4.820 6.357 0.017 13 0 "[ . 1 . 2]" 1
766 1 29 SER HB2 1 64 THR HB 5.500 . 6.500 4.207 3.224 5.291 . 0 0 "[ . 1 . 2]" 1
767 1 29 SER HB2 1 30 ASP H 4.380 . 5.380 4.230 3.644 4.428 . 0 0 "[ . 1 . 2]" 1
768 1 29 SER HB3 1 64 THR HB 5.500 . 6.500 4.689 3.427 5.324 . 0 0 "[ . 1 . 2]" 1
769 1 29 SER HB3 1 30 ASP H 4.380 . 5.380 4.231 3.626 4.503 . 0 0 "[ . 1 . 2]" 1
770 1 27 GLU H 1 27 GLU HB3 3.560 . 4.560 3.646 3.536 3.730 . 0 0 "[ . 1 . 2]" 1
771 1 27 GLU H 1 30 ASP H 3.650 . 4.650 3.563 3.271 3.865 . 0 0 "[ . 1 . 2]" 1
772 1 27 GLU H 1 65 LEU MD1 5.500 . 6.500 3.424 2.878 3.888 . 0 0 "[ . 1 . 2]" 1
773 1 27 GLU H 1 65 LEU MD2 5.500 . 6.500 6.089 5.574 6.530 0.030 14 0 "[ . 1 . 2]" 1
774 1 27 GLU H 1 28 SER H 4.650 . 5.650 4.585 4.500 4.654 . 0 0 "[ . 1 . 2]" 1
775 1 27 GLU H 1 29 SER H 4.340 . 5.340 4.712 4.480 4.910 . 0 0 "[ . 1 . 2]" 1
776 1 27 GLU H 1 30 ASP HA 5.040 . 6.040 4.257 3.859 4.543 . 0 0 "[ . 1 . 2]" 1
777 1 27 GLU H 1 30 ASP HB2 4.370 . 5.370 2.181 1.690 2.796 . 0 0 "[ . 1 . 2]" 1
778 1 27 GLU H 1 30 ASP HB3 4.370 . 5.370 3.436 2.078 3.992 . 0 0 "[ . 1 . 2]" 1
779 1 27 GLU H 1 35 VAL QG 5.440 . 6.440 5.043 4.556 5.625 . 0 0 "[ . 1 . 2]" 1
780 1 27 GLU H 1 27 GLU QG 3.550 . 4.550 2.488 1.829 3.376 . 0 0 "[ . 1 . 2]" 1
781 1 27 GLU H 1 30 ASP QB 3.640 . 4.640 2.136 1.684 2.745 . 0 0 "[ . 1 . 2]" 1
782 1 65 LEU H 1 65 LEU HB3 3.760 . 4.760 3.475 3.435 3.506 . 0 0 "[ . 1 . 2]" 1
783 1 65 LEU H 1 65 LEU HB2 3.760 . 4.760 2.163 2.131 2.211 . 0 0 "[ . 1 . 2]" 1
784 1 65 LEU H 1 65 LEU MD1 3.980 . 4.980 4.054 3.886 4.170 . 0 0 "[ . 1 . 2]" 1
785 1 65 LEU H 1 65 LEU MD2 3.980 . 4.980 3.682 3.478 3.880 . 0 0 "[ . 1 . 2]" 1
786 1 65 LEU H 1 65 LEU HG 3.190 . 4.190 3.007 2.804 3.287 . 0 0 "[ . 1 . 2]" 1
787 1 65 LEU H 1 66 SER HA 5.500 . 6.500 5.129 4.938 5.275 . 0 0 "[ . 1 . 2]" 1
788 1 65 LEU H 1 68 TYR H 5.500 . 6.500 5.881 5.584 6.050 . 0 0 "[ . 1 . 2]" 1
789 1 28 SER H 1 30 ASP H 4.900 . 5.900 3.979 3.908 4.059 . 0 0 "[ . 1 . 2]" 1
790 1 28 SER H 1 65 LEU HB2 5.500 . 6.500 5.376 5.279 5.487 . 0 0 "[ . 1 . 2]" 1
791 1 28 SER H 1 65 LEU MD1 4.610 . 5.610 4.500 4.366 4.582 . 0 0 "[ . 1 . 2]" 1
792 1 28 SER H 1 29 SER H 3.920 . 4.920 2.627 2.552 2.714 . 0 0 "[ . 1 . 2]" 1
793 1 28 SER H 1 28 SER QB 3.020 . 4.020 2.370 2.051 2.612 . 0 0 "[ . 1 . 2]" 1
794 1 28 SER H 1 66 SER QB 5.340 . 6.340 5.669 5.503 5.812 . 0 0 "[ . 1 . 2]" 1
795 1 105 LEU H 1 107 GLU H 4.220 . 5.220 3.818 3.517 4.293 . 0 0 "[ . 1 . 2]" 1
796 1 105 LEU H 1 106 LYS HB2 4.850 . 5.850 5.617 4.701 5.961 0.111 2 0 "[ . 1 . 2]" 1
797 1 105 LEU H 1 105 LEU HB3 3.710 . 4.710 3.288 2.984 3.468 . 0 0 "[ . 1 . 2]" 1
798 1 105 LEU H 1 105 LEU HB2 3.710 . 4.710 2.168 2.100 2.282 . 0 0 "[ . 1 . 2]" 1
799 1 105 LEU H 1 106 LYS HG3 4.560 . 5.560 4.252 3.299 5.581 0.021 10 0 "[ . 1 . 2]" 1
800 1 105 LEU H 1 105 LEU MD2 4.180 . 5.180 2.921 2.205 3.885 . 0 0 "[ . 1 . 2]" 1
801 1 105 LEU H 1 105 LEU MD1 4.180 . 5.180 4.007 2.623 4.222 . 0 0 "[ . 1 . 2]" 1
802 1 105 LEU H 1 107 GLU QB 5.340 . 6.340 4.749 4.282 5.760 . 0 0 "[ . 1 . 2]" 1
803 1 107 GLU H 1 107 GLU HB3 3.230 . 4.230 2.864 2.393 3.485 . 0 0 "[ . 1 . 2]" 1
804 1 107 GLU H 1 107 GLU HB2 3.230 . 4.230 2.375 2.039 3.602 . 0 0 "[ . 1 . 2]" 1
805 1 102 GLU HA 1 105 LEU H 3.750 . 4.750 4.699 4.603 4.778 0.028 7 0 "[ . 1 . 2]" 1
806 1 102 GLU HA 1 105 LEU HB3 4.640 . 5.640 5.021 4.246 5.450 . 0 0 "[ . 1 . 2]" 1
807 1 102 GLU HA 1 106 LYS H 3.990 . 4.990 3.434 3.040 3.938 . 0 0 "[ . 1 . 2]" 1
808 1 102 GLU HA 1 102 GLU HG3 3.630 . 4.630 2.376 2.082 2.797 . 0 0 "[ . 1 . 2]" 1
809 1 102 GLU HA 1 102 GLU HG2 3.630 . 4.630 3.312 2.504 3.692 . 0 0 "[ . 1 . 2]" 1
810 1 104 SER HB3 1 105 LEU H 5.230 . 6.230 3.821 3.308 4.330 . 0 0 "[ . 1 . 2]" 1
811 1 104 SER HB3 1 105 LEU MD2 5.250 . 6.250 3.706 2.454 6.059 . 0 0 "[ . 1 . 2]" 1
812 1 104 SER HB2 1 105 LEU H 5.230 . 6.230 3.867 3.198 4.320 . 0 0 "[ . 1 . 2]" 1
813 1 104 SER HB2 1 105 LEU MD2 5.250 . 6.250 3.950 2.731 5.437 . 0 0 "[ . 1 . 2]" 1
814 1 101 ILE HA 1 105 LEU HA 4.950 . 5.950 4.645 4.546 4.753 . 0 0 "[ . 1 . 2]" 1
815 1 101 ILE HA 1 105 LEU H 4.560 . 5.560 3.640 3.306 3.832 . 0 0 "[ . 1 . 2]" 1
816 1 101 ILE HA 1 102 GLU HA 4.940 . 5.940 4.668 4.649 4.710 . 0 0 "[ . 1 . 2]" 1
817 1 101 ILE HA 1 105 LEU HB3 5.330 . 6.330 2.626 2.376 2.906 . 0 0 "[ . 1 . 2]" 1
818 1 101 ILE HA 1 105 LEU HB2 5.330 . 6.330 1.880 1.820 2.050 . 0 0 "[ . 1 . 2]" 1
819 1 101 ILE HA 1 105 LEU MD2 3.530 . 4.530 3.231 2.003 3.647 . 0 0 "[ . 1 . 2]" 1
820 1 101 ILE HA 1 101 ILE MD 3.850 . 4.850 3.792 3.746 3.836 . 0 0 "[ . 1 . 2]" 1
821 1 101 ILE HA 1 101 ILE HG12 3.570 . 4.570 2.614 2.396 2.770 . 0 0 "[ . 1 . 2]" 1
822 1 101 ILE HA 1 105 LEU HG 5.500 . 6.500 2.978 2.412 3.939 . 0 0 "[ . 1 . 2]" 1
823 1 101 ILE HA 1 104 SER H 4.430 . 5.430 5.001 4.636 5.241 . 0 0 "[ . 1 . 2]" 1
824 1 101 ILE HA 1 101 ILE MG 3.210 . 4.210 2.457 2.340 2.618 . 0 0 "[ . 1 . 2]" 1
825 1 106 LYS HB2 1 106 LYS QD 3.620 . 4.620 2.414 2.065 3.287 . 0 0 "[ . 1 . 2]" 1
826 1 106 LYS HB2 1 106 LYS QE 4.460 . 5.460 3.579 2.557 4.423 . 0 0 "[ . 1 . 2]" 1
827 1 105 LEU HB3 1 105 LEU MD2 3.350 . 4.350 3.150 2.382 3.203 . 0 0 "[ . 1 . 2]" 1
828 1 105 LEU HB3 1 105 LEU MD1 3.350 . 4.350 2.406 2.232 3.203 . 0 0 "[ . 1 . 2]" 1
829 1 105 LEU HB3 1 106 LYS H 3.910 . 4.910 3.126 2.580 3.458 . 0 0 "[ . 1 . 2]" 1
830 1 105 LEU HB3 1 106 LYS HA 5.500 . 6.500 4.007 3.830 4.157 . 0 0 "[ . 1 . 2]" 1
831 1 105 LEU HB2 1 105 LEU MD1 3.340 . 4.340 3.154 2.374 3.206 . 0 0 "[ . 1 . 2]" 1
832 1 106 LYS HG3 1 107 GLU H 5.100 . 6.100 2.993 1.824 5.354 . 0 0 "[ . 1 . 2]" 1
833 1 105 LEU MD2 1 106 LYS H 5.500 . 6.500 4.416 4.036 4.690 . 0 0 "[ . 1 . 2]" 1
834 1 105 LEU MD2 1 108 SER H 5.500 . 6.500 5.247 4.570 5.949 . 0 0 "[ . 1 . 2]" 1
835 1 105 LEU MD1 1 107 GLU H 5.390 . 6.390 5.002 3.942 5.759 . 0 0 "[ . 1 . 2]" 1
836 1 105 LEU MD1 1 106 LYS H 5.500 . 6.500 4.342 3.839 4.610 . 0 0 "[ . 1 . 2]" 1
837 1 70 ILE MG 1 76 LEU HG 5.500 . 6.500 4.011 3.021 4.684 . 0 0 "[ . 1 . 2]" 1
838 1 70 ILE MG 1 71 GLN H 3.760 . 4.760 2.864 2.296 3.573 . 0 0 "[ . 1 . 2]" 1
839 1 70 ILE MG 1 75 THR H 5.170 . 6.170 5.038 4.680 5.627 . 0 0 "[ . 1 . 2]" 1
840 1 70 ILE MG 1 74 SER HB2 3.740 . 4.740 2.529 2.045 3.199 . 0 0 "[ . 1 . 2]" 1
841 1 70 ILE MG 1 74 SER HB3 3.740 . 4.740 2.389 2.105 2.953 . 0 0 "[ . 1 . 2]" 1
842 1 70 ILE MG 1 71 GLN HA 4.210 . 5.210 3.969 3.351 4.505 . 0 0 "[ . 1 . 2]" 1
843 1 70 ILE MG 1 74 SER H 4.550 . 5.550 4.194 3.714 4.434 . 0 0 "[ . 1 . 2]" 1
844 1 70 ILE MD 1 70 ILE MG 3.170 . 4.170 2.127 1.737 2.656 . 0 0 "[ . 1 . 2]" 1
845 1 70 ILE MG 1 74 SER HA 4.750 . 5.750 4.413 4.172 5.026 . 0 0 "[ . 1 . 2]" 1
846 1 70 ILE MG 1 76 LEU QD 4.960 . 5.960 2.109 1.824 2.489 . 0 0 "[ . 1 . 2]" 1
847 1 71 GLN H 1 71 GLN HB2 3.900 . 4.900 2.657 2.123 3.603 . 0 0 "[ . 1 . 2]" 1
848 1 71 GLN H 1 71 GLN HB3 3.900 . 4.900 3.453 2.661 4.095 . 0 0 "[ . 1 . 2]" 1
849 1 71 GLN H 1 71 GLN HG2 4.310 . 5.310 3.602 2.056 4.569 . 0 0 "[ . 1 . 2]" 1
850 1 71 GLN H 1 71 GLN HG3 4.310 . 5.310 3.259 2.093 4.442 . 0 0 "[ . 1 . 2]" 1
851 1 71 GLN H 1 71 GLN QB 3.380 . 4.380 2.504 2.089 3.320 . 0 0 "[ . 1 . 2]" 1
852 1 71 GLN H 1 74 SER QB 4.830 . 5.830 3.308 1.955 4.878 . 0 0 "[ . 1 . 2]" 1
853 1 71 GLN HB2 1 72 ARG H 3.730 . 4.730 2.995 1.816 3.895 . 0 0 "[ . 1 . 2]" 1
854 1 71 GLN HB3 1 72 ARG H 3.730 . 4.730 2.199 1.669 3.744 . 0 0 "[ . 1 . 2]" 1
855 1 71 GLN HG2 1 72 ARG H 4.570 . 5.570 3.611 1.880 4.348 . 0 0 "[ . 1 . 2]" 1
856 1 71 GLN HG3 1 72 ARG H 4.570 . 5.570 4.125 2.250 4.906 . 0 0 "[ . 1 . 2]" 1
857 1 70 ILE HA 1 70 ILE MG 3.540 . 4.540 2.448 2.298 3.073 . 0 0 "[ . 1 . 2]" 1
858 1 70 ILE HA 1 71 GLN H 3.170 . 4.170 2.287 2.133 3.462 . 0 0 "[ . 1 . 2]" 1
859 1 70 ILE HA 1 71 GLN HA 5.500 . 6.500 4.511 4.374 5.305 . 0 0 "[ . 1 . 2]" 1
860 1 70 ILE HA 1 76 LEU QD 5.440 . 6.440 4.752 3.915 5.453 . 0 0 "[ . 1 . 2]" 1
861 1 19 GLY H 1 20 LYS H 3.160 . 4.160 2.231 2.107 2.399 . 0 0 "[ . 1 . 2]" 1
862 1 19 GLY H 1 20 LYS HB2 5.500 . 6.500 4.232 4.002 4.563 . 0 0 "[ . 1 . 2]" 1
863 1 19 GLY H 1 20 LYS HB3 5.500 . 6.500 4.732 4.260 5.083 . 0 0 "[ . 1 . 2]" 1
864 1 20 LYS H 1 21 THR H 4.480 . 5.480 4.437 4.304 4.575 . 0 0 "[ . 1 . 2]" 1
865 1 20 LYS H 1 20 LYS HD3 5.150 . 6.150 5.243 4.785 6.129 . 0 0 "[ . 1 . 2]" 1
866 1 20 LYS H 1 20 LYS HB2 3.000 . 4.000 2.611 2.352 3.026 . 0 0 "[ . 1 . 2]" 1
867 1 20 LYS H 1 20 LYS HB3 3.000 . 4.000 2.774 2.457 3.020 . 0 0 "[ . 1 . 2]" 1
868 1 20 LYS H 1 20 LYS QG 4.540 . 5.540 3.998 3.890 4.060 . 0 0 "[ . 1 . 2]" 1
869 1 18 THR H 1 18 THR MG 3.330 . 4.330 2.205 1.941 2.671 . 0 0 "[ . 1 . 2]" 1
870 1 18 THR H 1 19 GLY H 3.720 . 4.720 2.493 2.027 2.681 . 0 0 "[ . 1 . 2]" 1
871 1 18 THR H 1 20 LYS H 3.990 . 4.990 3.983 3.487 4.451 . 0 0 "[ . 1 . 2]" 1
872 1 21 THR H 1 22 ILE H 4.640 . 5.640 4.467 4.312 4.533 . 0 0 "[ . 1 . 2]" 1
873 1 21 THR H 1 21 THR MG 3.890 . 4.890 3.679 3.157 3.805 . 0 0 "[ . 1 . 2]" 1
874 1 21 THR H 1 21 THR HB 3.060 . 4.060 2.836 2.600 3.406 . 0 0 "[ . 1 . 2]" 1
875 1 16 THR H 1 22 ILE H 4.600 . 5.600 4.963 4.566 5.475 . 0 0 "[ . 1 . 2]" 1
876 1 16 THR H 1 16 THR MG 2.880 . 3.880 2.227 1.915 2.710 . 0 0 "[ . 1 . 2]" 1
877 1 16 THR H 1 21 THR HA 4.460 . 5.460 4.325 3.940 4.601 . 0 0 "[ . 1 . 2]" 1
878 1 16 THR H 1 17 LEU H 4.830 . 5.830 4.586 4.500 4.637 . 0 0 "[ . 1 . 2]" 1
879 1 16 THR H 1 19 GLY H 4.930 . 5.930 3.795 3.217 4.055 . 0 0 "[ . 1 . 2]" 1
880 1 16 THR H 1 20 LYS H 3.740 . 4.740 2.587 2.163 3.040 . 0 0 "[ . 1 . 2]" 1
881 1 16 THR H 1 20 LYS HB2 4.820 . 5.820 4.245 3.775 4.711 . 0 0 "[ . 1 . 2]" 1
882 1 16 THR H 1 20 LYS HB3 4.820 . 5.820 3.228 2.741 3.747 . 0 0 "[ . 1 . 2]" 1
883 1 16 THR H 1 16 THR HB 4.160 . 5.160 3.623 3.579 3.757 . 0 0 "[ . 1 . 2]" 1
884 1 15 LYS HG2 1 21 THR MG 4.840 . 5.840 5.420 4.648 5.879 0.039 20 0 "[ . 1 . 2]" 1
885 1 15 LYS HG2 1 75 THR MG 5.350 . 6.350 4.467 3.838 4.982 . 0 0 "[ . 1 . 2]" 1
886 1 15 LYS HG2 1 16 THR HA 4.780 . 5.780 5.345 5.104 5.503 . 0 0 "[ . 1 . 2]" 1
887 1 15 LYS HG2 1 19 GLY H 4.580 . 5.580 4.249 4.049 4.709 . 0 0 "[ . 1 . 2]" 1
888 1 15 LYS HG2 1 20 LYS H 4.530 . 5.530 4.259 3.774 4.879 . 0 0 "[ . 1 . 2]" 1
889 1 15 LYS HG2 1 16 THR H 3.520 . 4.520 3.894 3.204 4.194 . 0 0 "[ . 1 . 2]" 1
890 1 15 LYS HG2 1 16 THR HB 5.500 . 6.500 6.540 6.513 6.564 0.064 15 0 "[ . 1 . 2]" 1
891 1 15 LYS HG2 1 19 GLY HA3 4.230 . 5.230 4.426 3.888 5.004 . 0 0 "[ . 1 . 2]" 1
892 1 20 LYS HD3 1 22 ILE MD 3.960 . 4.960 3.910 2.814 4.969 0.009 17 0 "[ . 1 . 2]" 1
893 1 20 LYS HD3 1 22 ILE HG12 4.230 . 5.230 3.773 2.419 5.282 0.052 12 0 "[ . 1 . 2]" 1
894 1 20 LYS HD3 1 21 THR H 4.840 . 5.840 3.544 2.133 5.121 . 0 0 "[ . 1 . 2]" 1
895 1 20 LYS HB2 1 22 ILE MD 4.020 . 5.020 4.291 3.903 4.784 . 0 0 "[ . 1 . 2]" 1
896 1 20 LYS HB2 1 21 THR H 4.580 . 5.580 4.414 4.250 4.522 . 0 0 "[ . 1 . 2]" 1
897 1 20 LYS HB2 1 20 LYS HD2 4.160 . 5.160 3.326 2.470 3.665 . 0 0 "[ . 1 . 2]" 1
898 1 20 LYS HB2 1 20 LYS HE3 5.140 . 6.140 4.504 2.564 5.485 . 0 0 "[ . 1 . 2]" 1
899 1 20 LYS HB2 1 20 LYS HE2 5.140 . 6.140 4.469 2.413 5.499 . 0 0 "[ . 1 . 2]" 1
900 1 20 LYS HB2 1 20 LYS QE 4.600 . 5.600 3.884 2.385 4.481 . 0 0 "[ . 1 . 2]" 1
901 1 20 LYS HB3 1 21 THR H 4.580 . 5.580 4.040 3.742 4.375 . 0 0 "[ . 1 . 2]" 1
902 1 20 LYS HB3 1 20 LYS QE 4.600 . 5.600 3.737 2.376 4.507 . 0 0 "[ . 1 . 2]" 1
903 1 76 LEU HB3 1 76 LEU QD 3.080 . 4.080 2.204 2.098 2.292 . 0 0 "[ . 1 . 2]" 1
904 1 15 LYS HB3 1 75 THR MG 3.570 . 4.570 3.339 2.777 3.846 . 0 0 "[ . 1 . 2]" 1
905 1 15 LYS HB3 1 77 HIS HA 5.060 . 6.060 3.042 2.552 3.794 . 0 0 "[ . 1 . 2]" 1
906 1 52 LEU H 1 78 LEU HA 4.860 . 5.860 5.092 4.847 5.321 . 0 0 "[ . 1 . 2]" 1
907 1 52 LEU H 1 53 ILE H 4.630 . 5.630 4.231 4.133 4.358 . 0 0 "[ . 1 . 2]" 1
908 1 52 LEU H 1 59 LEU MD1 5.320 . 6.320 4.729 4.415 5.239 . 0 0 "[ . 1 . 2]" 1
909 1 52 LEU H 1 52 LEU HG 4.420 . 5.420 4.367 3.813 4.803 . 0 0 "[ . 1 . 2]" 1
910 1 52 LEU H 1 52 LEU HB3 3.710 . 4.710 3.483 3.198 3.693 . 0 0 "[ . 1 . 2]" 1
911 1 52 LEU H 1 52 LEU HB2 3.710 . 4.710 2.463 2.343 2.585 . 0 0 "[ . 1 . 2]" 1
912 1 52 LEU H 1 52 LEU QD 3.900 . 4.900 3.084 2.484 3.886 . 0 0 "[ . 1 . 2]" 1
913 1 51 ARG HA 1 78 LEU HG 5.500 . 6.500 4.970 4.577 6.310 . 0 0 "[ . 1 . 2]" 1
914 1 51 ARG HA 1 78 LEU HA 5.490 . 6.490 5.823 5.530 6.157 . 0 0 "[ . 1 . 2]" 1
915 1 51 ARG HA 1 52 LEU H 2.960 . 3.960 2.407 2.242 2.572 . 0 0 "[ . 1 . 2]" 1
916 1 51 ARG HA 1 52 LEU QD 4.140 . 5.140 3.490 2.877 4.786 . 0 0 "[ . 1 . 2]" 1
917 1 51 ARG HA 1 78 LEU QD 4.500 . 5.500 4.467 3.696 4.896 . 0 0 "[ . 1 . 2]" 1
918 1 51 ARG HA 1 79 VAL QG 5.440 . 6.440 4.409 3.699 5.194 . 0 0 "[ . 1 . 2]" 1
919 1 51 ARG HA 1 51 ARG QD 4.040 . 5.040 3.561 2.194 4.462 . 0 0 "[ . 1 . 2]" 1
920 1 51 ARG HB3 1 52 LEU H 4.130 . 5.130 3.209 2.442 3.999 . 0 0 "[ . 1 . 2]" 1
921 1 51 ARG HB2 1 52 LEU H 4.130 . 5.130 3.319 2.209 4.251 . 0 0 "[ . 1 . 2]" 1
922 1 52 LEU HB3 1 78 LEU HA 4.970 . 5.970 4.734 3.864 5.364 . 0 0 "[ . 1 . 2]" 1
923 1 52 LEU HB2 1 78 LEU HA 4.970 . 5.970 5.018 4.498 5.453 . 0 0 "[ . 1 . 2]" 1
924 1 32 ILE MG 1 52 LEU HG 4.140 . 5.140 3.511 2.237 4.999 . 0 0 "[ . 1 . 2]" 1
925 1 32 ILE MG 1 52 LEU H 3.610 . 4.610 3.901 3.443 4.298 . 0 0 "[ . 1 . 2]" 1
926 1 32 ILE MG 1 52 LEU HB3 3.990 . 4.990 3.566 2.833 4.078 . 0 0 "[ . 1 . 2]" 1
927 1 32 ILE MG 1 52 LEU HB2 3.990 . 4.990 2.605 2.126 3.148 . 0 0 "[ . 1 . 2]" 1
928 1 32 ILE MD 1 32 ILE MG 2.980 . 3.980 1.943 1.831 2.070 . 0 0 "[ . 1 . 2]" 1
929 1 32 ILE MG 1 33 ASP H 5.010 . 6.010 3.352 3.131 3.735 . 0 0 "[ . 1 . 2]" 1
930 1 32 ILE MG 1 61 ASP HA 3.500 . 4.500 2.654 2.100 3.467 . 0 0 "[ . 1 . 2]" 1
931 1 32 ILE MG 1 35 VAL HB 4.020 . 5.020 3.083 2.735 4.957 . 0 0 "[ . 1 . 2]" 1
932 1 32 ILE MG 1 61 ASP H 4.020 . 5.020 4.097 3.708 4.538 . 0 0 "[ . 1 . 2]" 1
933 1 32 ILE MG 1 60 GLU HA 4.390 . 5.390 4.504 3.175 5.077 . 0 0 "[ . 1 . 2]" 1
934 1 32 ILE HG12 1 32 ILE MG 3.520 . 4.520 3.191 3.176 3.199 . 0 0 "[ . 1 . 2]" 1
935 1 32 ILE HG13 1 32 ILE MG 3.520 . 4.520 2.261 2.163 2.464 . 0 0 "[ . 1 . 2]" 1
936 1 32 ILE MG 1 59 LEU HA 5.100 . 6.100 5.355 4.332 5.945 . 0 0 "[ . 1 . 2]" 1
937 1 32 ILE MG 1 52 LEU QB 3.260 . 4.260 2.542 2.083 3.036 . 0 0 "[ . 1 . 2]" 1
938 1 32 ILE MG 1 59 LEU QB 4.130 . 5.130 3.141 2.252 3.702 . 0 0 "[ . 1 . 2]" 1
939 1 32 ILE MG 1 61 ASP QB 4.930 . 5.930 3.843 2.950 4.912 . 0 0 "[ . 1 . 2]" 1
940 1 32 ILE MD 1 76 LEU HG 4.440 . 5.440 5.084 4.745 5.462 0.022 6 0 "[ . 1 . 2]" 1
941 1 32 ILE MD 1 60 GLU H 5.160 . 6.160 4.651 3.429 5.211 . 0 0 "[ . 1 . 2]" 1
942 1 32 ILE MD 1 52 LEU H 4.940 . 5.940 5.303 4.510 5.943 0.003 6 0 "[ . 1 . 2]" 1
943 1 32 ILE MD 1 52 LEU HB3 4.370 . 5.370 3.399 2.650 4.128 . 0 0 "[ . 1 . 2]" 1
944 1 32 ILE MD 1 52 LEU HB2 4.370 . 5.370 3.364 2.654 4.067 . 0 0 "[ . 1 . 2]" 1
945 1 32 ILE MD 1 59 LEU HB2 4.560 . 5.560 3.345 2.584 3.876 . 0 0 "[ . 1 . 2]" 1
946 1 32 ILE MD 1 59 LEU HB3 4.560 . 5.560 2.670 2.070 3.302 . 0 0 "[ . 1 . 2]" 1
947 1 32 ILE MD 1 36 LYS H 5.500 . 6.500 4.943 4.622 5.344 . 0 0 "[ . 1 . 2]" 1
948 1 32 ILE MD 1 35 VAL HB 4.270 . 5.270 3.410 2.974 4.632 . 0 0 "[ . 1 . 2]" 1
949 1 32 ILE MD 1 64 THR HA 5.500 . 6.500 4.209 3.461 5.208 . 0 0 "[ . 1 . 2]" 1
950 1 32 ILE MD 1 35 VAL H 5.500 . 6.500 4.570 4.465 4.706 . 0 0 "[ . 1 . 2]" 1
951 1 32 ILE MD 1 59 LEU HA 4.880 . 5.880 4.756 3.739 5.389 . 0 0 "[ . 1 . 2]" 1
952 1 32 ILE MD 1 35 VAL QG 3.670 . 4.670 2.711 2.394 3.067 . 0 0 "[ . 1 . 2]" 1
953 1 32 ILE MD 1 52 LEU QD 3.950 . 4.950 3.088 2.106 3.728 . 0 0 "[ . 1 . 2]" 1
954 1 32 ILE MD 1 59 LEU QB 3.700 . 4.700 2.559 2.047 3.095 . 0 0 "[ . 1 . 2]" 1
955 1 59 LEU HB2 1 60 GLU H 5.140 . 6.140 3.936 2.566 4.467 . 0 0 "[ . 1 . 2]" 1
956 1 59 LEU HB3 1 60 GLU H 5.140 . 6.140 2.965 1.592 3.611 . 0 0 "[ . 1 . 2]" 1
957 1 16 THR HB 1 22 ILE MD 4.740 . 5.740 4.672 4.293 5.152 . 0 0 "[ . 1 . 2]" 1
958 1 16 THR HB 1 78 LEU HG 5.500 . 6.500 6.229 4.765 6.535 0.035 5 0 "[ . 1 . 2]" 1
959 1 16 THR HB 1 17 LEU H 3.400 . 4.400 2.374 2.142 2.586 . 0 0 "[ . 1 . 2]" 1
960 1 16 THR HB 1 78 LEU HB2 5.500 . 6.500 6.420 6.094 6.542 0.042 15 0 "[ . 1 . 2]" 1
961 1 16 THR HB 1 18 THR MG 3.680 . 4.680 3.671 2.891 4.290 . 0 0 "[ . 1 . 2]" 1
962 1 16 THR HB 1 17 LEU HB3 5.400 . 6.400 4.348 4.061 4.570 . 0 0 "[ . 1 . 2]" 1
963 1 16 THR HB 1 79 VAL HA 5.500 . 6.500 4.630 3.560 5.275 . 0 0 "[ . 1 . 2]" 1
964 1 16 THR HB 1 18 THR HA 5.500 . 6.500 5.596 5.176 5.905 . 0 0 "[ . 1 . 2]" 1
965 1 16 THR HB 1 17 LEU HA 5.080 . 6.080 4.808 4.657 4.942 . 0 0 "[ . 1 . 2]" 1
966 1 16 THR HB 1 78 LEU QD 4.970 . 5.970 3.656 3.037 4.350 . 0 0 "[ . 1 . 2]" 1
967 1 16 THR HB 1 79 VAL QG 4.960 . 5.960 5.327 4.551 5.670 . 0 0 "[ . 1 . 2]" 1
968 1 16 THR HB 1 80 LEU QD 4.430 . 5.430 2.997 2.321 3.971 . 0 0 "[ . 1 . 2]" 1
969 1 16 THR HB 1 17 LEU QD 5.440 . 6.440 5.070 4.838 5.308 . 0 0 "[ . 1 . 2]" 1
970 1 16 THR HB 1 80 LEU QB 5.340 . 6.340 3.812 2.412 5.031 . 0 0 "[ . 1 . 2]" 1
971 1 17 LEU HB2 1 18 THR MG 3.930 . 4.930 4.536 4.096 4.784 . 0 0 "[ . 1 . 2]" 1
972 1 17 LEU HB2 1 18 THR H 4.790 . 5.790 3.858 3.450 4.143 . 0 0 "[ . 1 . 2]" 1
973 1 17 LEU HB2 1 100 ALA HA 5.500 . 6.500 5.360 4.298 5.663 . 0 0 "[ . 1 . 2]" 1
974 1 17 LEU HB2 1 18 THR HA 5.000 . 6.000 5.620 5.455 5.742 . 0 0 "[ . 1 . 2]" 1
975 1 17 LEU HB2 1 91 ALA HA 5.500 . 6.500 5.945 5.466 6.526 0.026 19 0 "[ . 1 . 2]" 1
976 1 17 LEU MD1 1 18 THR MG 4.960 . 5.960 3.826 2.389 5.194 . 0 0 "[ . 1 . 2]" 1
977 1 17 LEU MD1 1 100 ALA MB 3.670 . 4.670 3.264 1.904 4.473 . 0 0 "[ . 1 . 2]" 1
978 1 17 LEU MD1 1 100 ALA HA 4.430 . 5.430 3.486 1.962 4.910 . 0 0 "[ . 1 . 2]" 1
979 1 17 LEU MD1 1 18 THR HA 5.250 . 6.250 3.737 2.575 5.211 . 0 0 "[ . 1 . 2]" 1
980 1 17 LEU MD1 1 96 LEU HA 4.590 . 5.590 4.414 3.842 5.297 . 0 0 "[ . 1 . 2]" 1
981 1 17 LEU MD2 1 18 THR MG 4.960 . 5.960 4.757 4.395 5.055 . 0 0 "[ . 1 . 2]" 1
982 1 17 LEU MD2 1 100 ALA MB 3.670 . 4.670 2.180 1.883 2.676 . 0 0 "[ . 1 . 2]" 1
983 1 17 LEU MD2 1 100 ALA HA 4.430 . 5.430 2.861 2.085 3.869 . 0 0 "[ . 1 . 2]" 1
984 1 17 LEU MD2 1 18 THR HA 5.250 . 6.250 5.109 4.390 5.734 . 0 0 "[ . 1 . 2]" 1
985 1 17 LEU MD2 1 96 LEU HA 4.590 . 5.590 3.144 1.880 4.588 . 0 0 "[ . 1 . 2]" 1
986 1 101 ILE H 1 101 ILE MD 3.640 . 4.640 3.405 3.156 3.754 . 0 0 "[ . 1 . 2]" 1
987 1 101 ILE H 1 101 ILE HG12 3.390 . 4.390 3.966 3.786 4.090 . 0 0 "[ . 1 . 2]" 1
988 1 101 ILE H 1 101 ILE HB 2.820 . 3.820 2.306 2.186 2.415 . 0 0 "[ . 1 . 2]" 1
989 1 101 ILE H 1 105 LEU HG 5.500 . 6.500 5.546 4.730 6.552 0.052 18 0 "[ . 1 . 2]" 1
990 1 101 ILE H 1 103 LEU HG 5.500 . 6.500 5.372 4.156 6.586 0.086 14 0 "[ . 1 . 2]" 1
991 1 101 ILE H 1 103 LEU HB3 5.500 . 6.500 5.939 4.163 6.365 . 0 0 "[ . 1 . 2]" 1
992 1 101 ILE H 1 104 SER H 5.500 . 6.500 5.325 4.580 5.726 . 0 0 "[ . 1 . 2]" 1
993 1 101 ILE H 1 102 GLU H 3.210 . 4.210 2.377 2.171 2.651 . 0 0 "[ . 1 . 2]" 1
994 1 100 ALA MB 1 101 ILE HA 4.660 . 5.660 3.918 3.813 3.980 . 0 0 "[ . 1 . 2]" 1
995 1 100 ALA MB 1 105 LEU MD2 3.910 . 4.910 3.492 2.531 4.463 . 0 0 "[ . 1 . 2]" 1
996 1 100 ALA MB 1 101 ILE H 3.150 . 4.150 2.805 2.580 2.958 . 0 0 "[ . 1 . 2]" 1
997 1 100 ALA MB 1 101 ILE MD 4.480 . 5.480 4.191 3.935 4.486 . 0 0 "[ . 1 . 2]" 1
998 1 100 ALA MB 1 101 ILE HB 5.040 . 6.040 4.531 4.401 4.655 . 0 0 "[ . 1 . 2]" 1
999 1 100 ALA MB 1 103 LEU HG 4.370 . 5.370 4.643 3.895 5.440 0.070 6 0 "[ . 1 . 2]" 1
1000 1 101 ILE HB 1 101 ILE MD 3.010 . 4.010 2.223 2.117 2.324 . 0 0 "[ . 1 . 2]" 1
1001 1 99 LYS HG2 1 101 ILE H 5.500 . 6.500 4.973 4.225 6.302 . 0 0 "[ . 1 . 2]" 1
1002 1 99 LYS HG2 1 100 ALA H 3.980 . 4.980 2.914 1.757 4.536 . 0 0 "[ . 1 . 2]" 1
1003 1 99 LYS HG2 1 103 LEU QD 4.630 . 5.630 3.996 2.065 4.976 . 0 0 "[ . 1 . 2]" 1
1004 1 98 ARG HG2 1 101 ILE H 5.500 . 6.500 5.645 5.391 5.865 . 0 0 "[ . 1 . 2]" 1
1005 1 98 ARG HG2 1 102 GLU H 5.500 . 6.500 6.359 5.996 6.528 0.028 6 0 "[ . 1 . 2]" 1
1006 1 103 LEU HB3 1 104 SER H 3.530 . 4.530 3.001 1.974 3.760 . 0 0 "[ . 1 . 2]" 1
1007 1 103 LEU HB3 1 103 LEU MD2 3.360 . 4.360 2.393 1.964 3.193 . 0 0 "[ . 1 . 2]" 1
1008 1 103 LEU HB3 1 104 SER HA 5.500 . 6.500 4.909 3.930 5.730 . 0 0 "[ . 1 . 2]" 1
1009 1 103 LEU HB3 1 103 LEU MD1 3.360 . 4.360 2.799 2.231 3.188 . 0 0 "[ . 1 . 2]" 1
1010 1 97 ILE HA 1 101 ILE H 4.350 . 5.350 4.296 3.911 4.588 . 0 0 "[ . 1 . 2]" 1
1011 1 97 ILE HA 1 100 ALA MB 3.430 . 4.430 2.636 2.297 2.899 . 0 0 "[ . 1 . 2]" 1
1012 1 97 ILE HA 1 100 ALA HA 5.500 . 6.500 5.505 5.171 5.758 . 0 0 "[ . 1 . 2]" 1
1013 1 97 ILE HA 1 100 ALA H 3.890 . 4.890 3.599 3.305 4.224 . 0 0 "[ . 1 . 2]" 1
1014 1 97 ILE HA 1 97 ILE MD 3.400 . 4.400 3.671 3.624 3.755 . 0 0 "[ . 1 . 2]" 1
1015 1 97 ILE HA 1 97 ILE MG 3.150 . 4.150 2.600 2.492 2.678 . 0 0 "[ . 1 . 2]" 1
1016 1 97 ILE HA 1 99 LYS H 5.100 . 6.100 4.360 4.156 4.651 . 0 0 "[ . 1 . 2]" 1
1017 1 97 ILE HA 1 98 ARG HA 4.960 . 5.960 4.780 4.732 4.859 . 0 0 "[ . 1 . 2]" 1
1018 1 97 ILE HA 1 97 ILE HG13 4.080 . 5.080 2.246 2.171 2.404 . 0 0 "[ . 1 . 2]" 1
1019 1 100 ALA HA 1 101 ILE HA 4.890 . 5.890 4.727 4.653 4.807 . 0 0 "[ . 1 . 2]" 1
1020 1 100 ALA HA 1 105 LEU HB3 5.500 . 6.500 6.532 6.481 6.624 0.124 5 0 "[ . 1 . 2]" 1
1021 1 100 ALA HA 1 105 LEU MD2 4.760 . 5.760 4.518 3.719 5.766 0.006 16 0 "[ . 1 . 2]" 1
1022 1 100 ALA HA 1 101 ILE H 3.490 . 4.490 3.455 3.396 3.548 . 0 0 "[ . 1 . 2]" 1
1023 1 100 ALA HA 1 103 LEU HG 3.990 . 4.990 3.222 2.214 4.199 . 0 0 "[ . 1 . 2]" 1
1024 1 100 ALA HA 1 103 LEU HB3 4.180 . 5.180 3.882 2.106 4.782 . 0 0 "[ . 1 . 2]" 1
1025 1 100 ALA HA 1 103 LEU HB2 4.180 . 5.180 3.814 2.114 5.207 0.027 12 0 "[ . 1 . 2]" 1
1026 1 100 ALA HA 1 103 LEU HA 5.490 . 6.490 5.473 4.950 6.013 . 0 0 "[ . 1 . 2]" 1
1027 1 100 ALA HA 1 103 LEU MD2 4.220 . 5.220 3.069 1.827 4.975 . 0 0 "[ . 1 . 2]" 1
1028 1 100 ALA HA 1 103 LEU MD1 4.220 . 5.220 3.712 2.131 5.041 . 0 0 "[ . 1 . 2]" 1
1029 1 100 ALA HA 1 103 LEU QD 3.680 . 4.680 2.694 1.813 3.930 . 0 0 "[ . 1 . 2]" 1
1030 1 99 LYS HA 1 101 ILE H 4.410 . 5.410 3.955 3.658 4.295 . 0 0 "[ . 1 . 2]" 1
1031 1 99 LYS HA 1 99 LYS HG2 3.780 . 4.780 3.496 2.380 3.817 . 0 0 "[ . 1 . 2]" 1
1032 1 99 LYS HA 1 100 ALA HA 5.070 . 6.070 4.797 4.714 4.931 . 0 0 "[ . 1 . 2]" 1
1033 1 99 LYS HA 1 102 GLU H 3.610 . 4.610 3.217 2.905 3.500 . 0 0 "[ . 1 . 2]" 1
1034 1 99 LYS HA 1 99 LYS HG3 3.780 . 4.780 3.523 2.479 3.931 . 0 0 "[ . 1 . 2]" 1
1035 1 99 LYS HA 1 102 GLU HB3 3.430 . 4.430 3.542 2.872 4.358 . 0 0 "[ . 1 . 2]" 1
1036 1 99 LYS HA 1 102 GLU HG2 4.320 . 5.320 5.133 4.513 5.414 0.094 14 0 "[ . 1 . 2]" 1
1037 1 99 LYS HA 1 103 LEU QD 3.650 . 4.650 3.530 2.701 4.180 . 0 0 "[ . 1 . 2]" 1
1038 1 100 ALA H 1 101 ILE H 3.250 . 4.250 2.521 2.308 3.089 . 0 0 "[ . 1 . 2]" 1
1039 1 100 ALA H 1 100 ALA MB 2.990 . 3.990 2.212 2.166 2.256 . 0 0 "[ . 1 . 2]" 1
1040 1 100 ALA H 1 103 LEU HG 4.710 . 5.710 5.038 3.989 5.755 0.045 8 0 "[ . 1 . 2]" 1
1041 1 100 ALA H 1 103 LEU HB3 4.880 . 5.880 5.661 3.588 6.013 0.133 6 0 "[ . 1 . 2]" 1
1042 1 100 ALA H 1 102 GLU H 4.040 . 5.040 4.050 3.752 4.823 . 0 0 "[ . 1 . 2]" 1
1043 1 98 ARG H 1 101 ILE H 4.800 . 5.800 4.804 4.599 5.025 . 0 0 "[ . 1 . 2]" 1
1044 1 98 ARG H 1 101 ILE MD 5.500 . 6.500 3.925 3.638 4.462 . 0 0 "[ . 1 . 2]" 1
1045 1 98 ARG H 1 98 ARG HG2 4.470 . 5.470 2.081 1.800 2.777 . 0 0 "[ . 1 . 2]" 1
1046 1 98 ARG H 1 98 ARG HB3 3.760 . 4.760 2.527 2.230 2.692 . 0 0 "[ . 1 . 2]" 1
1047 1 98 ARG H 1 98 ARG HG3 4.470 . 5.470 3.401 2.978 3.938 . 0 0 "[ . 1 . 2]" 1
1048 1 98 ARG H 1 98 ARG HD3 5.500 . 6.500 4.357 3.487 4.838 . 0 0 "[ . 1 . 2]" 1
1049 1 98 ARG H 1 98 ARG HD2 5.500 . 6.500 4.124 3.406 4.673 . 0 0 "[ . 1 . 2]" 1
1050 1 104 SER H 1 105 LEU H 3.350 . 4.350 2.308 2.226 2.514 . 0 0 "[ . 1 . 2]" 1
1051 1 104 SER H 1 105 LEU HB3 4.430 . 5.430 5.469 5.192 5.561 0.131 12 0 "[ . 1 . 2]" 1
1052 1 104 SER H 1 105 LEU MD2 3.920 . 4.920 3.930 2.904 4.948 0.028 18 0 "[ . 1 . 2]" 1
1053 1 104 SER H 1 106 LYS H 4.380 . 5.380 4.191 3.891 4.421 . 0 0 "[ . 1 . 2]" 1
1054 1 104 SER H 1 104 SER QB 3.290 . 4.290 2.436 2.256 2.749 . 0 0 "[ . 1 . 2]" 1
1055 1 33 ASP H 1 61 ASP HA 4.750 . 5.750 3.363 2.274 3.940 . 0 0 "[ . 1 . 2]" 1
1056 1 33 ASP H 1 34 ASN H 3.820 . 4.820 2.906 2.838 3.027 . 0 0 "[ . 1 . 2]" 1
1057 1 33 ASP H 1 33 ASP QB 3.590 . 4.590 2.337 2.059 2.827 . 0 0 "[ . 1 . 2]" 1
1058 1 33 ASP H 1 61 ASP QB 4.850 . 5.850 3.914 3.230 4.644 . 0 0 "[ . 1 . 2]" 1
1059 1 61 ASP HA 1 63 ARG H 4.540 . 5.540 3.668 3.444 3.920 . 0 0 "[ . 1 . 2]" 1
1060 1 58 GLN H 1 58 GLN HB3 3.640 . 4.640 3.166 2.429 3.622 . 0 0 "[ . 1 . 2]" 1
1061 1 58 GLN H 1 58 GLN HB2 3.640 . 4.640 2.716 2.382 3.585 . 0 0 "[ . 1 . 2]" 1
1062 1 58 GLN H 1 97 ILE HG12 5.500 . 6.500 6.167 5.513 6.511 0.011 16 0 "[ . 1 . 2]" 1
1063 1 58 GLN H 1 101 ILE MD 3.920 . 4.920 4.067 3.365 4.604 . 0 0 "[ . 1 . 2]" 1
1064 1 58 GLN H 1 58 GLN QG 3.730 . 4.730 2.703 1.834 3.998 . 0 0 "[ . 1 . 2]" 1
1065 1 57 LYS HD2 1 58 GLN H 4.260 . 5.260 4.522 3.049 5.259 . 0 0 "[ . 1 . 2]" 1
1066 1 57 LYS HD3 1 58 GLN H 4.260 . 5.260 4.572 3.418 5.231 . 0 0 "[ . 1 . 2]" 1
1067 1 57 LYS HB2 1 58 GLN H 3.190 . 4.190 4.168 3.997 4.252 0.062 4 0 "[ . 1 . 2]" 1
1068 1 57 LYS HB2 1 57 LYS HD2 4.060 . 5.060 3.182 2.248 3.640 . 0 0 "[ . 1 . 2]" 1
1069 1 57 LYS HB2 1 57 LYS HD3 4.060 . 5.060 3.179 2.118 4.239 . 0 0 "[ . 1 . 2]" 1
1070 1 57 LYS HA 1 101 ILE MD 3.810 . 4.810 3.770 2.823 4.727 . 0 0 "[ . 1 . 2]" 1
1071 1 57 LYS HA 1 58 GLN H 2.480 . 3.480 2.189 2.132 2.316 . 0 0 "[ . 1 . 2]" 1
1072 1 57 LYS HA 1 57 LYS HD2 3.830 . 4.830 3.884 2.024 4.654 . 0 0 "[ . 1 . 2]" 1
1073 1 57 LYS HA 1 57 LYS HD3 3.830 . 4.830 3.783 2.054 4.698 . 0 0 "[ . 1 . 2]" 1
1074 1 36 LYS H 1 38 LYS H 4.940 . 5.940 4.174 4.082 4.272 . 0 0 "[ . 1 . 2]" 1
1075 1 36 LYS H 1 37 SER H 3.510 . 4.510 2.904 2.858 2.988 . 0 0 "[ . 1 . 2]" 1
1076 1 36 LYS H 1 52 LEU QD 4.020 . 5.020 3.967 3.391 4.419 . 0 0 "[ . 1 . 2]" 1
1077 1 36 LYS H 1 36 LYS QB 3.470 . 4.470 2.449 2.226 2.672 . 0 0 "[ . 1 . 2]" 1
1078 1 36 LYS H 1 37 SER QB 4.840 . 5.840 4.901 4.463 5.151 . 0 0 "[ . 1 . 2]" 1
1079 1 36 LYS H 1 36 LYS QD 4.020 . 5.020 3.888 2.454 4.354 . 0 0 "[ . 1 . 2]" 1
1080 1 34 ASN H 1 34 ASN HB3 3.730 . 4.730 3.071 2.560 3.577 . 0 0 "[ . 1 . 2]" 1
1081 1 34 ASN H 1 36 LYS H 4.610 . 5.610 4.179 4.011 4.348 . 0 0 "[ . 1 . 2]" 1
1082 1 34 ASN H 1 35 VAL HB 5.140 . 6.140 4.831 4.509 6.160 0.020 7 0 "[ . 1 . 2]" 1
1083 1 34 ASN H 1 34 ASN HB2 3.730 . 4.730 2.310 2.070 2.518 . 0 0 "[ . 1 . 2]" 1
1084 1 34 ASN H 1 35 VAL H 3.230 . 4.230 2.572 2.469 2.636 . 0 0 "[ . 1 . 2]" 1
1085 1 34 ASN H 1 35 VAL QG 4.450 . 5.450 3.927 3.428 4.165 . 0 0 "[ . 1 . 2]" 1
1086 1 33 ASP HA 1 34 ASN HA 4.930 . 5.930 4.792 4.758 4.814 . 0 0 "[ . 1 . 2]" 1
1087 1 33 ASP HA 1 36 LYS H 3.950 . 4.950 3.541 3.359 3.667 . 0 0 "[ . 1 . 2]" 1
1088 1 33 ASP HA 1 35 VAL H 4.820 . 5.820 4.416 4.281 4.580 . 0 0 "[ . 1 . 2]" 1
1089 1 32 ILE HA 1 35 VAL HA 5.500 . 6.500 5.013 4.857 5.316 . 0 0 "[ . 1 . 2]" 1
1090 1 32 ILE HA 1 34 ASN HB3 5.500 . 6.500 5.636 4.966 6.510 0.010 9 0 "[ . 1 . 2]" 1
1091 1 32 ILE HA 1 32 ILE MG 3.320 . 4.320 2.323 2.228 2.410 . 0 0 "[ . 1 . 2]" 1
1092 1 32 ILE HA 1 32 ILE MD 3.290 . 4.290 2.001 1.948 2.118 . 0 0 "[ . 1 . 2]" 1
1093 1 32 ILE HA 1 61 ASP HA 5.090 . 6.090 4.802 4.608 5.139 . 0 0 "[ . 1 . 2]" 1
1094 1 32 ILE HA 1 36 LYS H 4.760 . 5.760 3.924 3.668 4.155 . 0 0 "[ . 1 . 2]" 1
1095 1 32 ILE HA 1 35 VAL HB 3.570 . 4.570 2.510 2.092 4.494 . 0 0 "[ . 1 . 2]" 1
1096 1 32 ILE HA 1 35 VAL H 3.730 . 4.730 3.184 3.099 3.322 . 0 0 "[ . 1 . 2]" 1
1097 1 32 ILE HA 1 35 VAL MG2 4.310 . 5.310 2.465 2.210 3.031 . 0 0 "[ . 1 . 2]" 1
1098 1 32 ILE HA 1 35 VAL MG1 4.310 . 5.310 3.677 1.946 3.936 . 0 0 "[ . 1 . 2]" 1
1099 1 32 ILE HA 1 35 VAL QG 3.420 . 4.420 2.399 1.888 2.900 . 0 0 "[ . 1 . 2]" 1
1100 1 32 ILE HA 1 52 LEU QD 3.960 . 4.960 4.121 3.200 4.823 . 0 0 "[ . 1 . 2]" 1
1101 1 32 ILE HA 1 52 LEU QB 5.340 . 6.340 4.837 4.472 5.245 . 0 0 "[ . 1 . 2]" 1
1102 1 32 ILE HA 1 59 LEU QB 5.340 . 6.340 5.241 4.206 5.788 . 0 0 "[ . 1 . 2]" 1
1103 1 35 VAL HB 1 36 LYS H 3.270 . 4.270 2.556 2.374 4.099 . 0 0 "[ . 1 . 2]" 1
1104 1 35 VAL HB 1 76 LEU QD 4.940 . 5.940 4.491 2.712 5.883 . 0 0 "[ . 1 . 2]" 1
1105 1 35 VAL HB 1 52 LEU QD 4.210 . 5.210 3.362 2.496 4.156 . 0 0 "[ . 1 . 2]" 1
1106 1 34 ASN HB2 1 36 LYS H 5.500 . 6.500 5.560 5.032 5.965 . 0 0 "[ . 1 . 2]" 1
1107 1 34 ASN HB2 1 35 VAL H 3.610 . 4.610 3.285 2.563 3.845 . 0 0 "[ . 1 . 2]" 1
1108 1 34 ASN HB2 1 35 VAL QG 4.360 . 5.360 4.022 3.171 4.793 . 0 0 "[ . 1 . 2]" 1
1109 1 34 ASN HB2 1 37 SER QB 5.340 . 6.340 5.820 4.882 6.352 0.012 7 0 "[ . 1 . 2]" 1
1110 1 109 ARG HB2 1 110 ASN H 4.320 . 5.320 3.410 2.628 4.004 . 0 0 "[ . 1 . 2]" 1
1111 1 110 ASN H 1 110 ASN HB2 3.990 . 4.990 2.604 2.114 3.588 . 0 0 "[ . 1 . 2]" 1
1112 1 110 ASN H 1 110 ASN HB3 3.990 . 4.990 3.042 2.054 3.613 . 0 0 "[ . 1 . 2]" 1
1113 1 110 ASN H 1 110 ASN QB 3.400 . 4.400 2.310 2.033 2.661 . 0 0 "[ . 1 . 2]" 1
1114 1 109 ARG HB3 1 110 ASN H 4.320 . 5.320 3.207 2.209 4.252 . 0 0 "[ . 1 . 2]" 1
1115 1 110 ASN HB2 1 111 SER H 4.820 . 5.820 3.437 2.519 4.164 . 0 0 "[ . 1 . 2]" 1
1116 1 110 ASN HB3 1 111 SER H 4.820 . 5.820 3.425 2.364 4.385 . 0 0 "[ . 1 . 2]" 1
1117 1 109 ARG HA 1 110 ASN H 3.480 . 4.480 3.491 3.296 3.582 . 0 0 "[ . 1 . 2]" 1
1118 1 109 ARG HA 1 110 ASN HA 4.740 . 5.740 4.817 4.713 4.909 . 0 0 "[ . 1 . 2]" 1
1119 1 109 ARG HA 1 109 ARG QD 3.170 . 4.170 3.573 2.167 4.173 0.003 14 0 "[ . 1 . 2]" 1
1120 1 109 ARG HA 1 109 ARG QG 3.050 . 4.050 2.303 2.091 2.785 . 0 0 "[ . 1 . 2]" 1
1121 1 109 ARG H 1 109 ARG HB2 3.980 . 4.980 2.376 2.120 2.571 . 0 0 "[ . 1 . 2]" 1
1122 1 109 ARG H 1 110 ASN H 4.710 . 5.710 2.610 2.402 2.748 . 0 0 "[ . 1 . 2]" 1
1123 1 109 ARG H 1 109 ARG HB3 3.980 . 4.980 3.124 2.532 3.595 . 0 0 "[ . 1 . 2]" 1
1124 1 109 ARG H 1 109 ARG HG3 5.360 . 6.360 3.619 2.153 4.601 . 0 0 "[ . 1 . 2]" 1
1125 1 109 ARG H 1 109 ARG HG2 5.360 . 6.360 3.887 2.004 4.662 . 0 0 "[ . 1 . 2]" 1
1126 1 109 ARG H 1 109 ARG QB 3.160 . 4.160 2.282 2.087 2.518 . 0 0 "[ . 1 . 2]" 1
1127 1 109 ARG H 1 109 ARG QG 4.670 . 5.670 3.222 1.988 4.033 . 0 0 "[ . 1 . 2]" 1
1128 1 45 ILE H 1 45 ILE HB 2.980 . 3.980 2.765 2.414 3.006 . 0 0 "[ . 1 . 2]" 1
1129 1 45 ILE H 1 45 ILE MD 4.300 . 5.300 2.972 2.133 3.690 . 0 0 "[ . 1 . 2]" 1
1130 1 45 ILE H 1 45 ILE MG 3.890 . 4.890 3.722 3.655 3.770 . 0 0 "[ . 1 . 2]" 1
1131 1 45 ILE H 1 45 ILE HG13 3.460 . 4.460 2.823 1.874 3.378 . 0 0 "[ . 1 . 2]" 1
1132 1 45 ILE H 1 46 PRO QD 4.940 . 5.940 4.105 4.011 4.192 . 0 0 "[ . 1 . 2]" 1
1133 1 45 ILE MD 1 80 LEU HG 5.500 . 6.500 4.493 2.549 6.308 . 0 0 "[ . 1 . 2]" 1
1134 1 45 ILE MD 1 46 PRO QD 4.890 . 5.890 3.504 2.705 4.481 . 0 0 "[ . 1 . 2]" 1
1135 1 45 ILE MD 1 46 PRO QG 4.590 . 5.590 5.017 4.263 5.647 0.057 5 0 "[ . 1 . 2]" 1
1136 1 45 ILE MD 1 45 ILE MG 3.050 . 4.050 1.865 1.743 2.061 . 0 0 "[ . 1 . 2]" 1
1137 1 45 ILE MG 1 46 PRO HA 4.610 . 5.610 4.374 4.178 4.568 . 0 0 "[ . 1 . 2]" 1
1138 1 45 ILE MG 1 50 GLN H 4.680 . 5.680 3.901 3.235 4.534 . 0 0 "[ . 1 . 2]" 1
1139 1 45 ILE MG 1 49 GLN H 4.210 . 5.210 4.095 3.665 4.503 . 0 0 "[ . 1 . 2]" 1
1140 1 45 ILE MG 1 47 PRO HA 4.640 . 5.640 4.685 4.241 4.971 . 0 0 "[ . 1 . 2]" 1
1141 1 45 ILE MG 1 50 GLN HB3 4.510 . 5.510 3.794 2.063 4.796 . 0 0 "[ . 1 . 2]" 1
1142 1 45 ILE MG 1 50 GLN HB2 4.510 . 5.510 4.217 3.427 5.331 . 0 0 "[ . 1 . 2]" 1
1143 1 45 ILE MG 1 46 PRO HD3 3.710 . 4.710 3.455 2.854 3.923 . 0 0 "[ . 1 . 2]" 1
1144 1 45 ILE MG 1 46 PRO HD2 3.710 . 4.710 2.291 1.997 2.618 . 0 0 "[ . 1 . 2]" 1
1145 1 45 ILE HG12 1 45 ILE MG 2.880 . 3.880 2.922 2.287 3.206 . 0 0 "[ . 1 . 2]" 1
1146 1 45 ILE MG 1 46 PRO HG3 4.260 . 5.260 4.591 4.112 4.873 . 0 0 "[ . 1 . 2]" 1
1147 1 45 ILE MG 1 50 GLN HA 4.760 . 5.760 4.087 3.548 4.864 . 0 0 "[ . 1 . 2]" 1
1148 1 45 ILE MG 1 50 GLN HG2 3.370 . 4.370 2.668 1.965 4.061 . 0 0 "[ . 1 . 2]" 1
1149 1 45 ILE MG 1 46 PRO HG2 4.260 . 5.260 3.799 3.008 4.406 . 0 0 "[ . 1 . 2]" 1
1150 1 45 ILE MG 1 50 GLN HG3 3.370 . 4.370 2.890 1.990 4.398 0.028 3 0 "[ . 1 . 2]" 1
1151 1 45 ILE MG 1 80 LEU QD 2.590 . 3.590 2.016 1.761 2.509 . 0 0 "[ . 1 . 2]" 1
1152 1 45 ILE MG 1 50 GLN QG 2.950 . 3.950 2.351 1.854 3.747 . 0 0 "[ . 1 . 2]" 1
1153 1 45 ILE MG 1 46 PRO QD 3.240 . 4.240 2.256 1.987 2.581 . 0 0 "[ . 1 . 2]" 1
1154 1 45 ILE MG 1 46 PRO QG 3.570 . 4.570 3.616 2.937 4.097 . 0 0 "[ . 1 . 2]" 1
1155 1 45 ILE HG13 1 46 PRO QD 5.250 . 6.250 4.773 4.226 5.100 . 0 0 "[ . 1 . 2]" 1
1156 1 43 GLU HB3 1 44 GLY H 3.860 . 4.860 4.281 4.121 4.471 . 0 0 "[ . 1 . 2]" 1
1157 1 43 GLU HB3 1 45 ILE HB 4.540 . 5.540 3.929 3.172 4.434 . 0 0 "[ . 1 . 2]" 1
1158 1 43 GLU HB3 1 45 ILE H 3.950 . 4.950 3.191 2.965 3.499 . 0 0 "[ . 1 . 2]" 1
1159 1 43 GLU HB3 1 45 ILE HG13 4.730 . 5.730 2.988 2.294 3.407 . 0 0 "[ . 1 . 2]" 1
1160 1 43 GLU HB3 1 45 ILE HA 5.500 . 6.500 5.427 5.182 5.759 . 0 0 "[ . 1 . 2]" 1
1161 1 43 GLU HB2 1 44 GLY H 3.860 . 4.860 3.723 3.631 3.837 . 0 0 "[ . 1 . 2]" 1
1162 1 43 GLU HB2 1 45 ILE H 3.950 . 4.950 3.324 2.867 3.929 . 0 0 "[ . 1 . 2]" 1
1163 1 43 GLU HG2 1 45 ILE H 5.250 . 6.250 5.439 5.306 5.556 . 0 0 "[ . 1 . 2]" 1
1164 1 43 GLU HG2 1 45 ILE HG13 5.350 . 6.350 5.275 4.431 5.903 . 0 0 "[ . 1 . 2]" 1
1165 1 40 GLN HA 1 44 GLY H 3.470 . 4.470 2.892 2.792 2.999 . 0 0 "[ . 1 . 2]" 1
1166 1 40 GLN HA 1 41 ASP HA 5.290 . 6.290 4.735 4.706 4.771 . 0 0 "[ . 1 . 2]" 1
1167 1 40 GLN HA 1 40 GLN HG2 4.230 . 5.230 3.933 3.631 4.239 . 0 0 "[ . 1 . 2]" 1
1168 1 40 GLN HA 1 45 ILE HB 4.630 . 5.630 3.613 3.399 3.892 . 0 0 "[ . 1 . 2]" 1
1169 1 40 GLN HA 1 45 ILE H 3.130 . 4.130 3.393 3.177 3.627 . 0 0 "[ . 1 . 2]" 1
1170 1 40 GLN HA 1 45 ILE MG 5.070 . 6.070 4.689 4.222 4.843 . 0 0 "[ . 1 . 2]" 1
1171 1 40 GLN HA 1 43 GLU HB2 5.050 . 6.050 3.896 3.579 4.182 . 0 0 "[ . 1 . 2]" 1
1172 1 40 GLN HA 1 42 LYS H 4.520 . 5.520 3.942 3.797 4.258 . 0 0 "[ . 1 . 2]" 1
1173 1 40 GLN HA 1 46 PRO HA 5.160 . 6.160 4.583 4.297 4.846 . 0 0 "[ . 1 . 2]" 1
1174 1 40 GLN HA 1 43 GLU H 4.150 . 5.150 3.209 3.044 3.430 . 0 0 "[ . 1 . 2]" 1
1175 1 40 GLN HA 1 40 GLN HG3 4.230 . 5.230 3.567 3.521 3.608 . 0 0 "[ . 1 . 2]" 1
1176 1 40 GLN HA 1 44 GLY QA 4.690 . 5.690 3.370 3.091 3.634 . 0 0 "[ . 1 . 2]" 1
1177 1 43 GLU HA 1 45 ILE H 4.910 . 5.910 4.110 4.014 4.225 . 0 0 "[ . 1 . 2]" 1
1178 1 43 GLU HA 1 43 GLU HG2 3.820 . 4.820 2.750 2.206 3.582 . 0 0 "[ . 1 . 2]" 1
1179 1 27 GLU HA 1 65 LEU MD1 5.140 . 6.140 4.524 4.399 4.636 . 0 0 "[ . 1 . 2]" 1
1180 1 27 GLU HA 1 28 SER H 2.870 . 3.870 2.365 2.291 2.416 . 0 0 "[ . 1 . 2]" 1
1181 1 27 GLU HA 1 29 SER H 4.890 . 5.890 3.977 3.814 4.092 . 0 0 "[ . 1 . 2]" 1
1182 1 27 GLU HA 1 28 SER HA 5.040 . 6.040 4.328 4.314 4.344 . 0 0 "[ . 1 . 2]" 1
1183 1 27 GLU HA 1 27 GLU QG 3.340 . 4.340 2.557 2.225 3.021 . 0 0 "[ . 1 . 2]" 1
1184 1 27 GLU HB2 1 28 SER H 3.560 . 4.560 3.731 3.526 3.950 . 0 0 "[ . 1 . 2]" 1
1185 1 26 VAL MG2 1 65 LEU HB3 5.500 . 6.500 4.583 4.247 4.993 . 0 0 "[ . 1 . 2]" 1
1186 1 26 VAL MG2 1 65 LEU MD1 4.170 . 5.170 2.022 1.790 2.303 . 0 0 "[ . 1 . 2]" 1
1187 1 26 VAL MG2 1 65 LEU MD2 4.170 . 5.170 3.630 3.325 3.987 . 0 0 "[ . 1 . 2]" 1
1188 1 26 VAL MG2 1 27 GLU H 3.820 . 4.820 3.119 2.512 3.809 . 0 0 "[ . 1 . 2]" 1
1189 1 26 VAL MG2 1 28 SER H 5.130 . 6.130 4.894 4.460 5.369 . 0 0 "[ . 1 . 2]" 1
1190 1 26 VAL MG2 1 27 GLU HA 5.500 . 6.500 4.016 3.576 4.510 . 0 0 "[ . 1 . 2]" 1
1191 1 26 VAL MG2 1 72 ARG HB3 5.120 . 6.120 5.331 4.919 6.031 . 0 0 "[ . 1 . 2]" 1
1192 1 26 VAL MG2 1 65 LEU HG 4.950 . 5.950 4.167 3.901 4.547 . 0 0 "[ . 1 . 2]" 1
1193 1 26 VAL MG2 1 28 SER HA 5.500 . 6.500 4.225 3.902 4.575 . 0 0 "[ . 1 . 2]" 1
1194 1 26 VAL MG2 1 27 GLU QG 4.900 . 5.900 4.767 4.349 5.149 . 0 0 "[ . 1 . 2]" 1
1195 1 75 THR H 1 75 THR MG 3.900 . 4.900 3.801 3.443 3.859 . 0 0 "[ . 1 . 2]" 1
1196 1 75 THR H 1 76 LEU H 4.910 . 5.910 4.146 4.074 4.192 . 0 0 "[ . 1 . 2]" 1
1197 1 75 THR H 1 75 THR HB 3.350 . 4.350 2.639 2.524 3.351 . 0 0 "[ . 1 . 2]" 1
1198 1 75 THR H 1 76 LEU QD 4.790 . 5.790 3.930 3.617 4.230 . 0 0 "[ . 1 . 2]" 1
1199 1 10 PHE H 1 11 GLN HB2 5.500 . 6.500 6.454 6.162 6.616 0.116 10 0 "[ . 1 . 2]" 1
1200 1 10 PHE H 1 72 ARG QD 4.690 . 5.690 5.059 2.390 5.706 0.016 1 0 "[ . 1 . 2]" 1
1201 1 10 PHE H 1 11 GLN H 4.280 . 5.280 4.304 4.022 4.417 . 0 0 "[ . 1 . 2]" 1
1202 1 11 GLN HB2 1 23 THR MG 4.780 . 5.780 2.512 1.943 4.624 . 0 0 "[ . 1 . 2]" 1
1203 1 11 GLN HB2 1 12 ILE MG 5.500 . 6.500 5.216 4.554 5.575 . 0 0 "[ . 1 . 2]" 1
1204 1 11 GLN HB2 1 12 ILE H 4.690 . 5.690 3.730 2.523 4.326 . 0 0 "[ . 1 . 2]" 1
1205 1 72 ARG QD 1 73 GLU H 4.650 . 5.650 3.993 3.372 4.737 . 0 0 "[ . 1 . 2]" 1
1206 1 72 ARG QD 1 73 GLU QG 3.950 . 4.950 3.810 2.423 4.931 . 0 0 "[ . 1 . 2]" 1
1207 1 74 SER HB2 1 75 THR H 4.180 . 5.180 3.681 2.789 4.114 . 0 0 "[ . 1 . 2]" 1
1208 1 74 SER HB3 1 75 THR H 4.180 . 5.180 3.611 2.749 4.258 . 0 0 "[ . 1 . 2]" 1
1209 1 75 THR HB 1 76 LEU HA 5.500 . 6.500 4.970 4.738 5.096 . 0 0 "[ . 1 . 2]" 1
1210 1 9 GLU HA 1 10 PHE H 3.130 . 4.130 2.935 2.129 3.522 . 0 0 "[ . 1 . 2]" 1
1211 1 72 ARG H 1 72 ARG QD 4.280 . 5.280 3.608 1.926 4.076 . 0 0 "[ . 1 . 2]" 1
1212 1 72 ARG H 1 73 GLU H 3.800 . 4.800 2.463 2.075 2.903 . 0 0 "[ . 1 . 2]" 1
1213 1 72 ARG H 1 72 ARG HB3 3.610 . 4.610 3.044 2.616 3.673 . 0 0 "[ . 1 . 2]" 1
1214 1 72 ARG H 1 72 ARG QG 3.950 . 4.950 1.839 1.636 2.051 . 0 0 "[ . 1 . 2]" 1
1215 1 72 ARG H 1 73 GLU QG 4.720 . 5.720 3.861 3.261 4.690 . 0 0 "[ . 1 . 2]" 1
1216 1 73 GLU H 1 73 GLU HG3 4.420 . 5.420 2.433 1.781 3.714 . 0 0 "[ . 1 . 2]" 1
1217 1 73 GLU H 1 73 GLU HG2 4.420 . 5.420 2.769 1.824 3.806 . 0 0 "[ . 1 . 2]" 1
1218 1 73 GLU H 1 74 SER H 3.720 . 4.720 3.365 2.680 3.924 . 0 0 "[ . 1 . 2]" 1
1219 1 73 GLU H 1 73 GLU QG 3.580 . 4.580 2.091 1.740 2.524 . 0 0 "[ . 1 . 2]" 1
1220 1 71 GLN HA 1 71 GLN HG2 3.620 . 4.620 2.688 2.190 3.553 . 0 0 "[ . 1 . 2]" 1
1221 1 71 GLN HA 1 71 GLN HG3 3.620 . 4.620 3.078 2.242 4.186 . 0 0 "[ . 1 . 2]" 1
1222 1 71 GLN HA 1 72 ARG H 3.130 . 4.130 2.793 2.278 3.237 . 0 0 "[ . 1 . 2]" 1
1223 1 71 GLN HA 1 73 GLU H 4.330 . 5.330 4.815 4.246 5.249 . 0 0 "[ . 1 . 2]" 1
1224 1 71 GLN HA 1 72 ARG HG2 5.500 . 6.500 4.213 3.763 4.701 . 0 0 "[ . 1 . 2]" 1
1225 1 71 GLN HA 1 72 ARG HG3 5.500 . 6.500 5.199 4.279 6.182 . 0 0 "[ . 1 . 2]" 1
1226 1 71 GLN HA 1 72 ARG QG 4.670 . 5.670 4.016 3.532 4.565 . 0 0 "[ . 1 . 2]" 1
1227 1 71 GLN HA 1 71 GLN QG 3.070 . 4.070 2.426 2.136 3.370 . 0 0 "[ . 1 . 2]" 1
1228 1 12 ILE MG 1 13 PHE H 3.740 . 4.740 3.653 3.550 3.730 . 0 0 "[ . 1 . 2]" 1
1229 1 12 ILE MG 1 70 ILE MG 3.210 . 4.210 2.784 2.216 3.430 . 0 0 "[ . 1 . 2]" 1
1230 1 12 ILE MG 1 27 GLU HA 5.500 . 6.500 5.374 4.828 5.988 . 0 0 "[ . 1 . 2]" 1
1231 1 12 ILE MG 1 26 VAL MG2 3.140 . 4.140 1.900 1.813 1.997 . 0 0 "[ . 1 . 2]" 1
1232 1 12 ILE MG 1 74 SER HB2 4.690 . 5.690 4.290 3.323 5.124 . 0 0 "[ . 1 . 2]" 1
1233 1 12 ILE MG 1 74 SER HB3 4.690 . 5.690 4.315 3.504 5.469 . 0 0 "[ . 1 . 2]" 1
1234 1 12 ILE MG 1 73 GLU H 4.260 . 5.260 4.973 4.750 5.249 . 0 0 "[ . 1 . 2]" 1
1235 1 12 ILE MG 1 71 GLN HA 4.920 . 5.920 4.614 3.378 5.464 . 0 0 "[ . 1 . 2]" 1
1236 1 12 ILE MG 1 72 ARG HB3 4.460 . 5.460 3.922 3.624 4.551 . 0 0 "[ . 1 . 2]" 1
1237 1 12 ILE MG 1 25 GLU HA 5.360 . 6.360 4.927 4.491 5.288 . 0 0 "[ . 1 . 2]" 1
1238 1 12 ILE MD 1 12 ILE MG 2.890 . 3.890 1.949 1.783 2.192 . 0 0 "[ . 1 . 2]" 1
1239 1 12 ILE MG 1 65 LEU HG 5.500 . 6.500 4.869 4.226 5.408 . 0 0 "[ . 1 . 2]" 1
1240 1 12 ILE HG13 1 12 ILE MG 3.540 . 4.540 3.187 3.159 3.202 . 0 0 "[ . 1 . 2]" 1
1241 1 12 ILE MG 1 74 SER H 3.410 . 4.410 3.827 3.405 4.280 . 0 0 "[ . 1 . 2]" 1
1242 1 12 ILE MG 1 74 SER HA 5.500 . 6.500 5.804 5.388 6.178 . 0 0 "[ . 1 . 2]" 1
1243 1 12 ILE MG 1 73 GLU HA 4.780 . 5.780 5.462 4.701 5.806 0.026 20 0 "[ . 1 . 2]" 1
1244 1 12 ILE MG 1 72 ARG HA 3.880 . 4.880 2.287 2.004 2.993 . 0 0 "[ . 1 . 2]" 1
1245 1 12 ILE MG 1 71 GLN QB 5.340 . 6.340 4.982 4.366 5.669 . 0 0 "[ . 1 . 2]" 1
1246 1 12 ILE MG 1 74 SER QB 3.890 . 4.890 3.643 3.268 4.389 . 0 0 "[ . 1 . 2]" 1
1247 1 72 ARG HB3 1 72 ARG QD 3.730 . 4.730 2.402 2.155 2.786 . 0 0 "[ . 1 . 2]" 1
1248 1 72 ARG HB3 1 73 GLU H 4.240 . 5.240 4.019 3.795 4.231 . 0 0 "[ . 1 . 2]" 1
1249 1 72 ARG HB2 1 72 ARG QD 3.730 . 4.730 2.562 1.997 3.196 . 0 0 "[ . 1 . 2]" 1
1250 1 72 ARG HB2 1 73 GLU H 4.240 . 5.240 3.336 2.609 3.643 . 0 0 "[ . 1 . 2]" 1
1251 1 11 GLN HA 1 26 VAL MG1 4.870 . 5.870 4.264 3.997 4.592 . 0 0 "[ . 1 . 2]" 1
1252 1 11 GLN HA 1 24 LEU HG 5.500 . 6.500 5.453 4.565 6.586 0.086 19 0 "[ . 1 . 2]" 1
1253 1 11 GLN HA 1 23 THR MG 5.120 . 6.120 4.101 3.537 5.658 . 0 0 "[ . 1 . 2]" 1
1254 1 11 GLN HA 1 12 ILE HA 4.960 . 5.960 4.430 4.383 4.533 . 0 0 "[ . 1 . 2]" 1
1255 1 11 GLN HA 1 26 VAL MG2 4.870 . 5.870 3.251 2.934 4.016 . 0 0 "[ . 1 . 2]" 1
1256 1 11 GLN HA 1 12 ILE MG 4.590 . 5.590 3.544 3.259 3.765 . 0 0 "[ . 1 . 2]" 1
1257 1 11 GLN HA 1 72 ARG HB3 5.150 . 6.150 4.988 4.078 5.758 . 0 0 "[ . 1 . 2]" 1
1258 1 11 GLN HA 1 26 VAL H 3.710 . 4.710 2.399 2.074 2.674 . 0 0 "[ . 1 . 2]" 1
1259 1 11 GLN HA 1 25 GLU HA 3.420 . 4.420 2.118 1.926 2.475 . 0 0 "[ . 1 . 2]" 1
1260 1 11 GLN HA 1 12 ILE MD 5.500 . 6.500 5.339 5.201 5.442 . 0 0 "[ . 1 . 2]" 1
1261 1 11 GLN HA 1 12 ILE H 2.660 . 3.660 2.217 2.129 2.542 . 0 0 "[ . 1 . 2]" 1
1262 1 11 GLN HA 1 11 GLN HG3 3.940 . 4.940 3.415 2.345 4.226 . 0 0 "[ . 1 . 2]" 1
1263 1 11 GLN HA 1 11 GLN HG2 3.940 . 4.940 3.295 2.364 3.656 . 0 0 "[ . 1 . 2]" 1
1264 1 11 GLN HA 1 12 ILE HG13 4.680 . 5.680 4.913 4.603 5.191 . 0 0 "[ . 1 . 2]" 1
1265 1 11 GLN HA 1 26 VAL HA 5.500 . 6.500 5.328 5.006 5.620 . 0 0 "[ . 1 . 2]" 1
1266 1 11 GLN HA 1 25 GLU QG 4.180 . 5.180 3.821 2.959 5.191 0.011 2 0 "[ . 1 . 2]" 1
1267 1 26 VAL H 1 26 VAL MG1 3.640 . 4.640 2.804 2.517 3.123 . 0 0 "[ . 1 . 2]" 1
1268 1 26 VAL H 1 65 LEU MD1 5.040 . 6.040 4.877 4.548 5.264 . 0 0 "[ . 1 . 2]" 1
1269 1 26 VAL H 1 27 GLU H 4.580 . 5.580 4.407 4.333 4.482 . 0 0 "[ . 1 . 2]" 1
1270 1 26 VAL H 1 26 VAL MG2 3.640 . 4.640 2.100 1.945 2.335 . 0 0 "[ . 1 . 2]" 1
1271 1 26 VAL H 1 27 GLU QG 4.450 . 5.450 5.384 5.144 5.513 0.063 4 0 "[ . 1 . 2]" 1
1272 1 25 GLU HA 1 26 VAL MG1 4.010 . 5.010 3.804 3.661 3.975 . 0 0 "[ . 1 . 2]" 1
1273 1 25 GLU HA 1 26 VAL MG2 4.010 . 5.010 3.818 3.539 4.226 . 0 0 "[ . 1 . 2]" 1
1274 1 25 GLU HA 1 26 VAL H 2.700 . 3.700 2.172 2.128 2.214 . 0 0 "[ . 1 . 2]" 1
1275 1 25 GLU HA 1 25 GLU QG 3.230 . 4.230 2.445 2.019 3.300 . 0 0 "[ . 1 . 2]" 1
1276 1 25 GLU HB2 1 26 VAL H 3.790 . 4.790 4.367 3.825 4.589 . 0 0 "[ . 1 . 2]" 1
1277 1 12 ILE MD 1 76 LEU HB2 4.570 . 5.570 2.995 2.515 3.281 . 0 0 "[ . 1 . 2]" 1
1278 1 12 ILE MD 1 76 LEU HG 4.280 . 5.280 3.629 2.066 4.416 . 0 0 "[ . 1 . 2]" 1
1279 1 12 ILE MD 1 26 VAL MG1 3.340 . 4.340 2.755 2.009 3.443 . 0 0 "[ . 1 . 2]" 1
1280 1 12 ILE MD 1 13 PHE H 4.110 . 5.110 3.685 3.374 4.042 . 0 0 "[ . 1 . 2]" 1
1281 1 12 ILE MD 1 27 GLU H 5.500 . 6.500 5.763 5.301 6.439 . 0 0 "[ . 1 . 2]" 1
1282 1 12 ILE MD 1 70 ILE MG 3.260 . 4.260 3.414 2.465 4.196 . 0 0 "[ . 1 . 2]" 1
1283 1 12 ILE MD 1 76 LEU HB3 4.570 . 5.570 3.837 3.516 4.037 . 0 0 "[ . 1 . 2]" 1
1284 1 12 ILE MD 1 26 VAL MG2 3.340 . 4.340 2.131 1.974 2.260 . 0 0 "[ . 1 . 2]" 1
1285 1 12 ILE MD 1 26 VAL H 5.250 . 6.250 4.852 4.358 5.164 . 0 0 "[ . 1 . 2]" 1
1286 1 12 ILE MD 1 26 VAL HB 4.190 . 5.190 4.055 3.801 4.253 . 0 0 "[ . 1 . 2]" 1
1287 1 12 ILE MD 1 74 SER H 5.230 . 6.230 5.590 5.204 6.206 . 0 0 "[ . 1 . 2]" 1
1288 1 12 ILE MD 1 70 ILE MD 4.470 . 5.470 4.689 3.954 5.436 . 0 0 "[ . 1 . 2]" 1
1289 1 12 ILE MD 1 35 VAL QG 3.570 . 4.570 2.300 1.986 2.859 . 0 0 "[ . 1 . 2]" 1
1290 1 12 ILE HB 1 13 PHE HA 4.870 . 5.870 4.550 4.430 4.644 . 0 0 "[ . 1 . 2]" 1
1291 1 12 ILE HB 1 75 THR HA 4.930 . 5.930 5.493 5.156 5.660 . 0 0 "[ . 1 . 2]" 1
1292 1 12 ILE HB 1 26 VAL MG1 5.500 . 6.500 5.248 4.518 5.866 . 0 0 "[ . 1 . 2]" 1
1293 1 12 ILE HB 1 13 PHE H 3.090 . 4.090 2.182 1.992 2.413 . 0 0 "[ . 1 . 2]" 1
1294 1 12 ILE HB 1 26 VAL MG2 5.500 . 6.500 3.769 3.695 3.897 . 0 0 "[ . 1 . 2]" 1
1295 1 12 ILE HB 1 12 ILE MD 3.340 . 4.340 2.296 2.135 2.379 . 0 0 "[ . 1 . 2]" 1
1296 1 12 ILE HB 1 74 SER H 4.460 . 5.460 4.057 3.593 4.764 . 0 0 "[ . 1 . 2]" 1
1297 1 12 ILE HB 1 73 GLU HA 5.500 . 6.500 6.132 5.366 6.494 . 0 0 "[ . 1 . 2]" 1
1298 1 12 ILE HB 1 76 LEU QD 3.940 . 4.940 2.787 2.014 3.456 . 0 0 "[ . 1 . 2]" 1
1299 1 12 ILE H 1 23 THR HA 5.400 . 6.400 5.093 3.818 5.595 . 0 0 "[ . 1 . 2]" 1
1300 1 12 ILE H 1 24 LEU H 3.820 . 4.820 3.591 2.637 3.929 . 0 0 "[ . 1 . 2]" 1
1301 1 12 ILE H 1 24 LEU HG 4.770 . 5.770 4.262 3.380 5.813 0.043 8 0 "[ . 1 . 2]" 1
1302 1 12 ILE H 1 23 THR MG 4.540 . 5.540 3.992 2.887 4.522 . 0 0 "[ . 1 . 2]" 1
1303 1 12 ILE H 1 13 PHE H 4.730 . 5.730 4.520 4.404 4.597 . 0 0 "[ . 1 . 2]" 1
1304 1 12 ILE H 1 26 VAL MG2 3.870 . 4.870 2.564 2.075 3.947 . 0 0 "[ . 1 . 2]" 1
1305 1 12 ILE H 1 26 VAL H 4.210 . 5.210 3.192 2.833 4.331 . 0 0 "[ . 1 . 2]" 1
1306 1 12 ILE H 1 25 GLU HA 3.580 . 4.580 3.762 3.600 4.070 . 0 0 "[ . 1 . 2]" 1
1307 1 12 ILE H 1 12 ILE MD 4.210 . 5.210 3.799 3.657 4.136 . 0 0 "[ . 1 . 2]" 1
1308 1 12 ILE H 1 12 ILE HG13 3.440 . 4.440 2.961 2.650 3.192 . 0 0 "[ . 1 . 2]" 1
1309 1 12 ILE H 1 24 LEU HA 5.500 . 6.500 5.356 4.790 5.524 . 0 0 "[ . 1 . 2]" 1
1310 1 12 ILE H 1 24 LEU QD 5.070 . 6.070 4.021 2.764 4.954 . 0 0 "[ . 1 . 2]" 1
1311 1 11 GLN H 1 12 ILE H 4.840 . 5.840 4.308 4.168 4.596 . 0 0 "[ . 1 . 2]" 1
1312 1 11 GLN H 1 11 GLN QG 3.960 . 4.960 2.342 1.823 3.433 . 0 0 "[ . 1 . 2]" 1
1313 1 101 ILE MG 1 105 LEU HA 5.450 . 6.450 5.350 5.077 5.652 . 0 0 "[ . 1 . 2]" 1
1314 1 101 ILE MG 1 102 GLU HA 3.360 . 4.360 3.385 3.117 3.599 . 0 0 "[ . 1 . 2]" 1
1315 1 101 ILE MG 1 106 LYS HB2 5.170 . 6.170 5.310 4.492 6.151 . 0 0 "[ . 1 . 2]" 1
1316 1 101 ILE MG 1 105 LEU HB3 3.660 . 4.660 2.968 2.506 3.354 . 0 0 "[ . 1 . 2]" 1
1317 1 101 ILE MG 1 105 LEU HB2 3.660 . 4.660 3.463 3.294 3.794 . 0 0 "[ . 1 . 2]" 1
1318 1 101 ILE MG 1 106 LYS HG3 4.560 . 5.560 5.351 4.603 5.654 0.094 18 0 "[ . 1 . 2]" 1
1319 1 101 ILE MG 1 102 GLU H 3.200 . 4.200 3.297 2.765 3.627 . 0 0 "[ . 1 . 2]" 1
1320 1 101 ILE MG 1 106 LYS H 5.040 . 6.040 4.289 3.881 5.069 . 0 0 "[ . 1 . 2]" 1
1321 1 101 ILE MG 1 106 LYS HA 4.830 . 5.830 4.550 3.659 5.776 . 0 0 "[ . 1 . 2]" 1
1322 1 101 ILE MG 1 106 LYS HB3 5.170 . 6.170 4.481 3.421 6.206 0.036 4 0 "[ . 1 . 2]" 1
1323 1 101 ILE MG 1 102 GLU HG3 4.230 . 5.230 4.446 2.845 5.234 0.004 14 0 "[ . 1 . 2]" 1
1324 1 101 ILE MG 1 102 GLU HG2 4.230 . 5.230 4.989 3.687 5.296 0.066 2 0 "[ . 1 . 2]" 1
1325 1 55 ALA HA 1 105 LEU HA 3.860 . 4.860 4.725 4.196 4.955 0.095 10 0 "[ . 1 . 2]" 1
1326 1 55 ALA HA 1 56 GLY H 3.570 . 4.570 2.642 2.553 2.815 . 0 0 "[ . 1 . 2]" 1
1327 1 55 ALA HA 1 57 LYS H 5.040 . 6.040 4.063 4.019 4.111 . 0 0 "[ . 1 . 2]" 1
1328 1 55 ALA HA 1 105 LEU HB2 4.750 . 5.750 5.735 5.235 5.816 0.066 9 0 "[ . 1 . 2]" 1
1329 1 55 ALA HA 1 105 LEU MD2 4.900 . 5.900 4.320 2.643 5.221 . 0 0 "[ . 1 . 2]" 1
1330 1 55 ALA HA 1 105 LEU MD1 4.900 . 5.900 2.298 1.834 4.329 . 0 0 "[ . 1 . 2]" 1
1331 1 55 ALA HA 1 108 SER QB 4.870 . 5.870 4.281 2.607 5.865 . 0 0 "[ . 1 . 2]" 1
1332 1 55 ALA HA 1 56 GLY QA 4.510 . 5.510 3.990 3.966 4.035 . 0 0 "[ . 1 . 2]" 1
1333 1 17 LEU HG 1 18 THR MG 3.650 . 4.650 4.586 4.051 4.731 0.081 13 0 "[ . 1 . 2]" 1
1334 1 17 LEU HG 1 90 ALA MB 4.310 . 5.310 3.941 2.339 5.179 . 0 0 "[ . 1 . 2]" 1
1335 1 17 LEU HG 1 19 GLY H 5.500 . 6.500 6.137 5.337 6.548 0.048 13 0 "[ . 1 . 2]" 1
1336 1 17 LEU HG 1 18 THR H 5.170 . 6.170 4.652 4.166 4.855 . 0 0 "[ . 1 . 2]" 1
1337 1 17 LEU HG 1 100 ALA MB 4.660 . 5.660 3.851 3.273 4.322 . 0 0 "[ . 1 . 2]" 1
1338 1 17 LEU HG 1 100 ALA HA 5.200 . 6.200 4.758 4.198 5.235 . 0 0 "[ . 1 . 2]" 1
1339 1 17 LEU HG 1 100 ALA H 4.960 . 5.960 5.195 4.241 5.819 . 0 0 "[ . 1 . 2]" 1
1340 1 17 LEU HG 1 18 THR HA 5.500 . 6.500 4.989 3.933 5.611 . 0 0 "[ . 1 . 2]" 1
1341 1 17 LEU HG 1 91 ALA MB 4.190 . 5.190 2.999 2.044 3.854 . 0 0 "[ . 1 . 2]" 1
1342 1 17 LEU HG 1 91 ALA HA 5.370 . 6.370 4.573 3.670 5.099 . 0 0 "[ . 1 . 2]" 1
1343 1 17 LEU HG 1 96 LEU HA 3.380 . 4.380 3.963 2.783 4.443 0.063 7 0 "[ . 1 . 2]" 1
1344 1 17 LEU HG 1 79 VAL QG 4.890 . 5.890 4.153 2.837 5.560 . 0 0 "[ . 1 . 2]" 1
1345 1 17 LEU HG 1 103 LEU QD 4.340 . 5.340 4.005 2.828 5.358 0.018 10 0 "[ . 1 . 2]" 1
1346 1 29 SER H 1 65 LEU HB3 3.080 . 4.080 4.252 4.218 4.284 0.204 2 0 "[ . 1 . 2]" 1
1347 1 29 SER H 1 64 THR MG 5.420 . 6.420 6.278 6.029 6.403 . 0 0 "[ . 1 . 2]" 1
1348 1 29 SER H 1 30 ASP H 3.000 . 4.000 2.162 2.064 2.222 . 0 0 "[ . 1 . 2]" 1
1349 1 29 SER H 1 65 LEU MD1 4.910 . 5.910 4.134 3.957 4.301 . 0 0 "[ . 1 . 2]" 1
1350 1 29 SER H 1 65 LEU HG 4.600 . 5.600 5.659 5.636 5.689 0.089 14 0 "[ . 1 . 2]" 1
1351 1 29 SER H 1 66 SER HA 5.500 . 6.500 5.558 5.364 5.767 . 0 0 "[ . 1 . 2]" 1
1352 1 29 SER H 1 30 ASP QB 4.130 . 5.130 3.898 3.748 3.984 . 0 0 "[ . 1 . 2]" 1
1353 1 29 SER H 1 66 SER QB 4.550 . 5.550 3.994 3.828 4.131 . 0 0 "[ . 1 . 2]" 1
1354 1 29 SER H 1 29 SER QB 3.610 . 4.610 2.712 2.410 2.909 . 0 0 "[ . 1 . 2]" 1
1355 1 65 LEU HG 1 66 SER H 5.010 . 6.010 4.739 4.664 4.815 . 0 0 "[ . 1 . 2]" 1
1356 1 65 LEU HG 1 70 ILE MG 5.090 . 6.090 4.658 4.266 4.897 . 0 0 "[ . 1 . 2]" 1
1357 1 28 SER HA 1 66 SER H 4.240 . 5.240 5.286 5.263 5.316 0.076 11 0 "[ . 1 . 2]" 1
1358 1 28 SER HA 1 65 LEU HB3 4.610 . 5.610 3.124 3.030 3.267 . 0 0 "[ . 1 . 2]" 1
1359 1 28 SER HA 1 65 LEU HB2 4.610 . 5.610 4.013 3.931 4.170 . 0 0 "[ . 1 . 2]" 1
1360 1 28 SER HA 1 65 LEU MD1 4.970 . 5.970 2.940 2.586 3.110 . 0 0 "[ . 1 . 2]" 1
1361 1 28 SER HA 1 65 LEU MD2 4.970 . 5.970 4.672 4.491 4.801 . 0 0 "[ . 1 . 2]" 1
1362 1 28 SER HA 1 70 ILE MG 5.500 . 6.500 4.472 3.525 5.337 . 0 0 "[ . 1 . 2]" 1
1363 1 28 SER HA 1 29 SER H 3.300 . 4.300 3.434 3.389 3.464 . 0 0 "[ . 1 . 2]" 1
1364 1 28 SER HA 1 65 LEU HG 5.500 . 6.500 5.507 5.320 5.621 . 0 0 "[ . 1 . 2]" 1
1365 1 28 SER HA 1 66 SER QB 4.130 . 5.130 5.005 4.721 5.155 0.025 5 0 "[ . 1 . 2]" 1
1366 1 66 SER HA 1 68 TYR H 3.690 . 4.690 4.248 3.337 4.704 0.014 2 0 "[ . 1 . 2]" 1
1367 1 66 SER HA 1 69 ASN HB3 5.500 . 6.500 5.236 4.534 5.913 . 0 0 "[ . 1 . 2]" 1
1368 1 66 SER HA 1 69 ASN HB2 5.500 . 6.500 5.126 4.556 5.623 . 0 0 "[ . 1 . 2]" 1
1369 1 18 THR HA 1 18 THR MG 2.740 . 3.740 2.345 2.257 2.470 . 0 0 "[ . 1 . 2]" 1
1370 1 18 THR HA 1 90 ALA MB 5.280 . 6.280 4.649 3.376 6.057 . 0 0 "[ . 1 . 2]" 1
1371 1 18 THR HA 1 19 GLY H 3.560 . 4.560 3.437 3.409 3.455 . 0 0 "[ . 1 . 2]" 1
1372 1 18 THR HA 1 18 THR HB 2.730 . 3.730 2.455 2.357 2.552 . 0 0 "[ . 1 . 2]" 1
1373 1 18 THR HA 1 19 GLY HA2 5.270 . 6.270 5.105 5.069 5.142 . 0 0 "[ . 1 . 2]" 1
1374 1 18 THR HA 1 103 LEU QD 5.440 . 6.440 5.721 5.156 6.471 0.031 18 0 "[ . 1 . 2]" 1
1375 1 31 THR H 1 64 THR MG 4.270 . 5.270 4.447 3.760 4.741 . 0 0 "[ . 1 . 2]" 1
1376 1 31 THR H 1 65 LEU MD1 5.500 . 6.500 5.006 4.782 5.318 . 0 0 "[ . 1 . 2]" 1
1377 1 31 THR H 1 34 ASN HB3 3.970 . 4.970 3.464 2.639 4.772 . 0 0 "[ . 1 . 2]" 1
1378 1 31 THR H 1 34 ASN H 3.750 . 4.750 3.791 3.566 4.278 . 0 0 "[ . 1 . 2]" 1
1379 1 31 THR H 1 34 ASN HB2 3.970 . 4.970 2.908 2.308 3.376 . 0 0 "[ . 1 . 2]" 1
1380 1 31 THR H 1 65 LEU HG 5.350 . 6.350 4.876 4.612 5.340 . 0 0 "[ . 1 . 2]" 1
1381 1 31 THR H 1 31 THR MG 3.270 . 4.270 2.257 1.934 2.437 . 0 0 "[ . 1 . 2]" 1
1382 1 31 THR H 1 64 THR HA 4.610 . 5.610 4.638 4.341 4.729 . 0 0 "[ . 1 . 2]" 1
1383 1 31 THR H 1 35 VAL H 4.480 . 5.480 4.625 4.247 5.285 . 0 0 "[ . 1 . 2]" 1
1384 1 31 THR H 1 32 ILE H 4.850 . 5.850 4.569 4.517 4.656 . 0 0 "[ . 1 . 2]" 1
1385 1 31 THR H 1 35 VAL QG 4.560 . 5.560 4.215 3.916 4.656 . 0 0 "[ . 1 . 2]" 1
1386 1 31 THR H 1 33 ASP QB 5.100 . 6.100 5.224 4.924 5.627 . 0 0 "[ . 1 . 2]" 1
1387 1 31 THR MG 1 64 THR H 4.860 . 5.860 5.274 5.060 5.541 . 0 0 "[ . 1 . 2]" 1
1388 1 31 THR MG 1 64 THR HB 4.460 . 5.460 4.023 3.508 4.394 . 0 0 "[ . 1 . 2]" 1
1389 1 31 THR MG 1 34 ASN HA 5.500 . 6.500 6.052 5.839 6.220 . 0 0 "[ . 1 . 2]" 1
1390 1 31 THR MG 1 65 LEU H 4.380 . 5.380 4.348 4.065 4.550 . 0 0 "[ . 1 . 2]" 1
1391 1 31 THR MG 1 34 ASN H 4.400 . 5.400 4.314 4.206 4.415 . 0 0 "[ . 1 . 2]" 1
1392 1 31 THR MG 1 64 THR HA 3.530 . 4.530 3.243 2.983 3.537 . 0 0 "[ . 1 . 2]" 1
1393 1 31 THR MG 1 63 ARG HA 5.210 . 6.210 5.753 5.537 6.016 . 0 0 "[ . 1 . 2]" 1
1394 1 31 THR MG 1 35 VAL QG 5.240 . 6.240 5.131 4.969 5.287 . 0 0 "[ . 1 . 2]" 1
1395 1 31 THR MG 1 33 ASP QB 4.140 . 5.140 4.348 4.087 4.665 . 0 0 "[ . 1 . 2]" 1
1396 1 30 ASP HA 1 34 ASN HB3 4.420 . 5.420 4.646 4.180 5.346 . 0 0 "[ . 1 . 2]" 1
1397 1 30 ASP HA 1 31 THR H 2.690 . 3.690 2.361 2.185 2.493 . 0 0 "[ . 1 . 2]" 1
1398 1 30 ASP HA 1 31 THR MG 3.810 . 4.810 3.338 3.215 3.568 . 0 0 "[ . 1 . 2]" 1
1399 1 30 ASP HA 1 31 THR HA 4.530 . 5.530 4.381 4.366 4.398 . 0 0 "[ . 1 . 2]" 1
1400 1 64 THR HA 1 66 SER H 4.720 . 5.720 4.390 4.270 4.540 . 0 0 "[ . 1 . 2]" 1
1401 1 64 THR HA 1 65 LEU HB3 5.210 . 6.210 5.770 5.733 5.817 . 0 0 "[ . 1 . 2]" 1
1402 1 64 THR HA 1 64 THR MG 3.110 . 4.110 2.244 2.106 2.319 . 0 0 "[ . 1 . 2]" 1
1403 1 64 THR HA 1 65 LEU MD1 5.500 . 6.500 5.590 5.500 5.706 . 0 0 "[ . 1 . 2]" 1
1404 1 64 THR HA 1 65 LEU H 3.170 . 4.170 2.424 2.343 2.593 . 0 0 "[ . 1 . 2]" 1
1405 1 64 THR HA 1 65 LEU HG 4.810 . 5.810 4.391 4.247 4.578 . 0 0 "[ . 1 . 2]" 1
1406 1 35 VAL H 1 36 LYS H 3.280 . 4.280 2.694 2.614 2.754 . 0 0 "[ . 1 . 2]" 1
1407 1 35 VAL H 1 35 VAL HB 2.990 . 3.990 2.573 2.379 3.567 . 0 0 "[ . 1 . 2]" 1
1408 1 35 VAL H 1 35 VAL MG2 3.780 . 4.780 2.176 2.009 2.824 . 0 0 "[ . 1 . 2]" 1
1409 1 35 VAL H 1 35 VAL MG1 3.780 . 4.780 3.666 1.766 3.779 . 0 0 "[ . 1 . 2]" 1
1410 1 35 VAL H 1 35 VAL QG 2.730 . 3.730 2.110 1.749 2.487 . 0 0 "[ . 1 . 2]" 1
1411 1 32 ILE H 1 64 THR MG 4.860 . 5.860 4.377 3.791 4.645 . 0 0 "[ . 1 . 2]" 1
1412 1 32 ILE H 1 65 LEU H 5.500 . 6.500 5.249 4.557 5.716 . 0 0 "[ . 1 . 2]" 1
1413 1 32 ILE H 1 32 ILE MG 3.820 . 4.820 3.748 3.715 3.759 . 0 0 "[ . 1 . 2]" 1
1414 1 32 ILE H 1 32 ILE MD 3.760 . 4.760 2.918 2.298 3.591 . 0 0 "[ . 1 . 2]" 1
1415 1 32 ILE H 1 33 ASP H 4.130 . 5.130 2.862 2.700 2.965 . 0 0 "[ . 1 . 2]" 1
1416 1 32 ILE H 1 64 THR HA 4.170 . 5.170 3.502 2.932 3.863 . 0 0 "[ . 1 . 2]" 1
1417 1 32 ILE H 1 63 ARG H 4.700 . 5.700 4.092 3.848 4.236 . 0 0 "[ . 1 . 2]" 1
1418 1 32 ILE H 1 32 ILE HB 3.280 . 4.280 2.570 2.424 2.811 . 0 0 "[ . 1 . 2]" 1
1419 1 32 ILE H 1 32 ILE HG12 3.740 . 4.740 2.045 1.840 2.205 . 0 0 "[ . 1 . 2]" 1
1420 1 32 ILE H 1 32 ILE HG13 3.740 . 4.740 3.545 3.409 3.633 . 0 0 "[ . 1 . 2]" 1
1421 1 113 GLY H 1 114 TYR H 4.000 . 5.000 2.681 2.266 2.955 . 0 0 "[ . 1 . 2]" 1
1422 1 89 GLY H 1 90 ALA MB 4.650 . 5.650 4.890 3.419 5.699 0.049 9 0 "[ . 1 . 2]" 1
1423 1 84 GLY QA 1 85 GLY H 3.430 . 4.430 2.400 2.128 2.869 . 0 0 "[ . 1 . 2]" 1
1424 1 63 ARG H 1 64 THR H 4.530 . 5.530 4.612 4.569 4.643 . 0 0 "[ . 1 . 2]" 1
1425 1 63 ARG H 1 63 ARG QG 3.740 . 4.740 3.529 2.559 4.069 . 0 0 "[ . 1 . 2]" 1
1426 1 63 ARG H 1 63 ARG QD 5.240 . 6.240 4.350 3.991 4.688 . 0 0 "[ . 1 . 2]" 1
1427 1 68 TYR H 1 69 ASN H 3.000 . 4.000 2.260 1.811 2.515 . 0 0 "[ . 1 . 2]" 1
1428 1 68 TYR H 1 70 ILE MD 4.330 . 5.330 3.607 2.404 4.947 . 0 0 "[ . 1 . 2]" 1
1429 1 68 TYR H 1 70 ILE H 4.460 . 5.460 3.421 3.041 3.966 . 0 0 "[ . 1 . 2]" 1
1430 1 31 THR HA 1 64 THR H 4.630 . 5.630 4.781 4.633 4.865 . 0 0 "[ . 1 . 2]" 1
1431 1 31 THR HA 1 64 THR HB 4.230 . 5.230 4.179 3.515 4.467 . 0 0 "[ . 1 . 2]" 1
1432 1 31 THR HA 1 65 LEU HB3 5.500 . 6.500 6.487 6.402 6.539 0.039 5 0 "[ . 1 . 2]" 1
1433 1 31 THR HA 1 64 THR MG 3.340 . 4.340 2.955 2.324 3.194 . 0 0 "[ . 1 . 2]" 1
1434 1 31 THR HA 1 65 LEU MD1 5.500 . 6.500 5.396 5.182 5.570 . 0 0 "[ . 1 . 2]" 1
1435 1 31 THR HA 1 65 LEU H 3.750 . 4.750 3.497 3.189 3.806 . 0 0 "[ . 1 . 2]" 1
1436 1 31 THR HA 1 32 ILE MD 5.080 . 6.080 4.053 3.349 4.908 . 0 0 "[ . 1 . 2]" 1
1437 1 31 THR HA 1 32 ILE HA 5.500 . 6.500 4.311 4.301 4.318 . 0 0 "[ . 1 . 2]" 1
1438 1 31 THR HA 1 65 LEU HG 5.390 . 6.390 4.318 4.079 4.593 . 0 0 "[ . 1 . 2]" 1
1439 1 31 THR HA 1 31 THR MG 3.140 . 4.140 2.431 2.346 2.488 . 0 0 "[ . 1 . 2]" 1
1440 1 31 THR HA 1 64 THR HA 3.130 . 4.130 2.077 1.865 2.198 . 0 0 "[ . 1 . 2]" 1
1441 1 31 THR HA 1 32 ILE H 3.290 . 4.290 2.362 2.263 2.483 . 0 0 "[ . 1 . 2]" 1
1442 1 31 THR HA 1 32 ILE HB 5.060 . 6.060 4.917 4.724 5.161 . 0 0 "[ . 1 . 2]" 1
1443 1 31 THR HA 1 32 ILE HG13 4.810 . 5.810 5.618 5.462 5.691 . 0 0 "[ . 1 . 2]" 1
1444 1 63 ARG HA 1 64 THR H 2.960 . 3.960 2.302 2.181 2.451 . 0 0 "[ . 1 . 2]" 1
1445 1 63 ARG HA 1 64 THR MG 3.870 . 4.870 3.737 3.326 4.012 . 0 0 "[ . 1 . 2]" 1
1446 1 63 ARG HA 1 64 THR HA 4.550 . 5.550 4.416 4.403 4.430 . 0 0 "[ . 1 . 2]" 1
1447 1 63 ARG HA 1 63 ARG HG3 4.060 . 5.060 2.924 2.157 3.696 . 0 0 "[ . 1 . 2]" 1
1448 1 63 ARG HA 1 63 ARG HG2 4.060 . 5.060 2.850 2.041 3.795 . 0 0 "[ . 1 . 2]" 1
1449 1 63 ARG HA 1 63 ARG HD3 3.940 . 4.940 3.286 2.072 4.435 . 0 0 "[ . 1 . 2]" 1
1450 1 63 ARG HA 1 63 ARG HD2 3.940 . 4.940 3.739 2.160 4.659 . 0 0 "[ . 1 . 2]" 1
1451 1 63 ARG HA 1 63 ARG QG 3.470 . 4.470 2.310 2.026 2.844 . 0 0 "[ . 1 . 2]" 1
1452 1 63 ARG HA 1 63 ARG QD 3.450 . 4.450 2.960 2.060 4.002 . 0 0 "[ . 1 . 2]" 1
1453 1 63 ARG HA 1 67 ASP QB 4.820 . 5.820 4.189 3.722 5.034 . 0 0 "[ . 1 . 2]" 1
1454 1 63 ARG HG3 1 64 THR H 5.120 . 6.120 3.407 1.874 5.143 . 0 0 "[ . 1 . 2]" 1
1455 1 63 ARG HG2 1 64 THR H 5.120 . 6.120 3.432 1.847 4.631 . 0 0 "[ . 1 . 2]" 1
1456 1 42 LYS H 1 44 GLY H 4.150 . 5.150 3.489 3.370 3.651 . 0 0 "[ . 1 . 2]" 1
1457 1 42 LYS H 1 43 GLU HB2 5.500 . 6.500 4.762 4.530 5.043 . 0 0 "[ . 1 . 2]" 1
1458 1 42 LYS H 1 43 GLU HA 5.020 . 6.020 5.068 5.047 5.100 . 0 0 "[ . 1 . 2]" 1
1459 1 42 LYS H 1 43 GLU H 3.040 . 4.040 2.416 2.370 2.483 . 0 0 "[ . 1 . 2]" 1
1460 1 42 LYS H 1 42 LYS HG2 3.830 . 4.830 2.715 1.934 4.570 . 0 0 "[ . 1 . 2]" 1
1461 1 42 LYS H 1 42 LYS HG3 3.830 . 4.830 3.624 3.100 4.277 . 0 0 "[ . 1 . 2]" 1
1462 1 42 LYS H 1 42 LYS HE3 5.500 . 6.500 5.315 4.346 6.177 . 0 0 "[ . 1 . 2]" 1
1463 1 42 LYS H 1 42 LYS HE2 5.500 . 6.500 5.127 4.175 6.088 . 0 0 "[ . 1 . 2]" 1
1464 1 42 LYS H 1 42 LYS QB 2.890 . 3.890 2.426 2.188 2.729 . 0 0 "[ . 1 . 2]" 1
1465 1 8 GLY H 1 9 GLU H 4.540 . 5.540 3.625 1.791 4.639 . 0 0 "[ . 1 . 2]" 1
1466 1 9 GLU H 1 10 PHE H 4.280 . 5.280 3.280 1.649 4.494 . 0 0 "[ . 1 . 2]" 1
1467 1 9 GLU H 1 11 GLN H 5.300 . 6.300 6.056 5.178 6.548 0.248 10 0 "[ . 1 . 2]" 1
1468 1 9 GLU H 1 10 PHE HA 5.500 . 6.500 4.698 4.207 5.354 . 0 0 "[ . 1 . 2]" 1
1469 1 9 GLU H 1 9 GLU QB 3.340 . 4.340 2.704 2.190 3.425 . 0 0 "[ . 1 . 2]" 1
1470 1 83 ARG HA 1 84 GLY QA 4.530 . 5.530 4.269 4.080 4.511 . 0 0 "[ . 1 . 2]" 1
1471 1 83 ARG HA 1 84 GLY H 3.130 . 4.130 3.348 2.918 3.491 . 0 0 "[ . 1 . 2]" 1
1472 1 83 ARG HA 1 83 ARG HG2 3.700 . 4.700 3.188 2.210 4.066 . 0 0 "[ . 1 . 2]" 1
1473 1 83 ARG HA 1 83 ARG HG3 3.700 . 4.700 3.057 2.060 3.974 . 0 0 "[ . 1 . 2]" 1
1474 1 83 ARG HA 1 83 ARG QG 3.140 . 4.140 2.651 2.032 3.321 . 0 0 "[ . 1 . 2]" 1
1475 1 83 ARG HA 1 83 ARG QD 4.650 . 5.650 3.649 2.141 4.454 . 0 0 "[ . 1 . 2]" 1
1476 1 87 MET HA 1 88 GLY H 3.320 . 4.320 3.479 3.239 3.576 . 0 0 "[ . 1 . 2]" 1
1477 1 87 MET HA 1 87 MET HG2 3.870 . 4.870 2.947 2.119 4.207 . 0 0 "[ . 1 . 2]" 1
1478 1 87 MET HA 1 87 MET HG3 3.870 . 4.870 3.061 2.204 4.010 . 0 0 "[ . 1 . 2]" 1
1479 1 87 MET HA 1 88 GLY HA3 5.230 . 6.230 4.800 4.511 5.342 . 0 0 "[ . 1 . 2]" 1
1480 1 87 MET HA 1 88 GLY HA2 5.230 . 6.230 5.137 4.802 5.387 . 0 0 "[ . 1 . 2]" 1
1481 1 87 MET HA 1 87 MET QG 3.280 . 4.280 2.469 2.101 3.383 . 0 0 "[ . 1 . 2]" 1
1482 1 87 MET HA 1 88 GLY QA 4.520 . 5.520 4.379 4.236 4.521 . 0 0 "[ . 1 . 2]" 1
1483 1 87 MET HB3 1 88 GLY H 4.390 . 5.390 3.305 2.380 4.275 . 0 0 "[ . 1 . 2]" 1
1484 1 87 MET HB2 1 88 GLY H 4.390 . 5.390 3.591 2.371 4.041 . 0 0 "[ . 1 . 2]" 1
1485 1 69 ASN H 1 70 ILE MD 5.060 . 6.060 4.370 3.470 5.503 . 0 0 "[ . 1 . 2]" 1
1486 1 69 ASN H 1 69 ASN HA 2.880 . 3.880 2.300 2.291 2.309 . 0 0 "[ . 1 . 2]" 1
1487 1 69 ASN H 1 70 ILE H 3.630 . 4.630 2.449 2.331 2.706 . 0 0 "[ . 1 . 2]" 1
1488 1 69 ASN H 1 69 ASN QB 3.520 . 4.520 3.230 3.013 3.498 . 0 0 "[ . 1 . 2]" 1
1489 1 69 ASN H 1 70 ILE QG 4.680 . 5.680 3.922 3.375 5.649 . 0 0 "[ . 1 . 2]" 1
1490 1 47 PRO HG2 1 48 ASP H 4.690 . 5.690 3.072 2.816 3.335 . 0 0 "[ . 1 . 2]" 1
1491 1 48 ASP H 1 48 ASP HB2 3.220 . 4.220 2.861 2.415 3.586 . 0 0 "[ . 1 . 2]" 1
1492 1 48 ASP H 1 48 ASP HB3 3.220 . 4.220 3.094 2.400 3.602 . 0 0 "[ . 1 . 2]" 1
1493 1 48 ASP H 1 50 GLN H 4.410 . 5.410 4.003 3.831 4.274 . 0 0 "[ . 1 . 2]" 1
1494 1 48 ASP H 1 49 GLN H 3.070 . 4.070 2.624 2.511 2.791 . 0 0 "[ . 1 . 2]" 1
1495 1 48 ASP H 1 48 ASP QB 2.810 . 3.810 2.510 2.241 2.709 . 0 0 "[ . 1 . 2]" 1
1496 1 47 PRO HB3 1 48 ASP H 3.880 . 4.880 4.087 3.950 4.219 . 0 0 "[ . 1 . 2]" 1
1497 1 47 PRO HG3 1 48 ASP H 4.690 . 5.690 4.322 4.180 4.452 . 0 0 "[ . 1 . 2]" 1
1498 1 48 ASP HB2 1 49 GLN H 4.340 . 5.340 3.365 2.491 4.210 . 0 0 "[ . 1 . 2]" 1
1499 1 48 ASP HB3 1 49 GLN H 4.340 . 5.340 3.719 2.572 4.322 . 0 0 "[ . 1 . 2]" 1
1500 1 47 PRO HD3 1 48 ASP H 3.390 . 4.390 4.144 3.762 4.234 . 0 0 "[ . 1 . 2]" 1
1501 1 47 PRO HD3 1 49 GLN H 5.390 . 6.390 5.468 5.097 5.711 . 0 0 "[ . 1 . 2]" 1
1502 1 46 PRO HA 1 47 PRO HD2 3.670 . 4.670 2.126 1.981 2.618 . 0 0 "[ . 1 . 2]" 1
1503 1 46 PRO HA 1 47 PRO HG2 4.560 . 5.560 4.308 4.209 4.474 . 0 0 "[ . 1 . 2]" 1
1504 1 46 PRO HA 1 48 ASP H 3.870 . 4.870 4.144 3.995 4.305 . 0 0 "[ . 1 . 2]" 1
1505 1 46 PRO HA 1 47 PRO HG3 4.560 . 5.560 4.386 4.100 4.453 . 0 0 "[ . 1 . 2]" 1
1506 1 46 PRO HA 1 47 PRO HD3 3.670 . 4.670 2.322 1.887 2.454 . 0 0 "[ . 1 . 2]" 1
1507 1 46 PRO HA 1 47 PRO HA 4.470 . 5.470 4.433 4.414 4.458 . 0 0 "[ . 1 . 2]" 1
1508 1 50 GLN H 1 51 ARG H 4.570 . 5.570 4.494 4.434 4.538 . 0 0 "[ . 1 . 2]" 1
1509 1 50 GLN H 1 81 ARG H 5.500 . 6.500 5.183 4.439 5.552 . 0 0 "[ . 1 . 2]" 1
1510 1 50 GLN H 1 50 GLN HB3 3.100 . 4.100 3.536 2.898 3.772 . 0 0 "[ . 1 . 2]" 1
1511 1 50 GLN H 1 80 LEU HA 5.500 . 6.500 5.515 4.978 6.103 . 0 0 "[ . 1 . 2]" 1
1512 1 50 GLN H 1 50 GLN QG 3.150 . 4.150 2.329 1.654 2.985 . 0 0 "[ . 1 . 2]" 1
1513 1 49 GLN H 1 50 GLN H 2.930 . 3.930 2.502 2.041 2.726 . 0 0 "[ . 1 . 2]" 1
1514 1 49 GLN H 1 80 LEU QD 5.440 . 6.440 5.761 4.658 6.467 0.027 12 0 "[ . 1 . 2]" 1
1515 1 49 GLN H 1 50 GLN QG 4.700 . 5.700 3.780 2.550 4.576 . 0 0 "[ . 1 . 2]" 1
1516 1 11 GLN HG3 1 23 THR MG 4.050 . 5.050 3.301 1.977 5.084 0.034 11 0 "[ . 1 . 2]" 1
1517 1 11 GLN HG3 1 12 ILE H 4.630 . 5.630 4.740 3.396 5.420 . 0 0 "[ . 1 . 2]" 1
1518 1 11 GLN HG2 1 23 THR MG 4.050 . 5.050 3.746 3.116 4.759 . 0 0 "[ . 1 . 2]" 1
1519 1 11 GLN HG2 1 12 ILE H 4.630 . 5.630 4.756 4.032 5.527 . 0 0 "[ . 1 . 2]" 1
1520 1 12 ILE HG13 1 26 VAL MG1 3.850 . 4.850 3.862 3.032 4.553 . 0 0 "[ . 1 . 2]" 1
1521 1 12 ILE HG13 1 65 LEU MD1 4.130 . 5.130 4.897 4.575 5.157 0.027 11 0 "[ . 1 . 2]" 1
1522 1 12 ILE HG13 1 26 VAL MG2 3.850 . 4.850 3.358 3.291 3.476 . 0 0 "[ . 1 . 2]" 1
1523 1 43 GLU H 1 45 ILE H 4.330 . 5.330 4.158 3.842 4.555 . 0 0 "[ . 1 . 2]" 1
1524 1 43 GLU H 1 45 ILE HG13 5.500 . 6.500 5.606 4.721 5.987 . 0 0 "[ . 1 . 2]" 1
1525 1 43 GLU H 1 43 GLU HB3 4.100 . 5.100 3.695 3.597 3.798 . 0 0 "[ . 1 . 2]" 1
1526 1 43 GLU H 1 43 GLU HB2 4.100 . 5.100 2.518 2.387 2.757 . 0 0 "[ . 1 . 2]" 1
1527 1 43 GLU H 1 43 GLU HG3 4.340 . 5.340 3.490 2.608 4.280 . 0 0 "[ . 1 . 2]" 1
1528 1 43 GLU H 1 44 GLY HA2 4.900 . 5.900 4.463 4.420 4.521 . 0 0 "[ . 1 . 2]" 1
1529 1 43 GLU H 1 44 GLY HA3 4.900 . 5.900 4.860 4.824 4.930 . 0 0 "[ . 1 . 2]" 1
1530 1 43 GLU H 1 44 GLY QA 4.160 . 5.160 4.127 4.091 4.183 . 0 0 "[ . 1 . 2]" 1
1531 1 42 LYS HB2 1 43 GLU H 4.220 . 5.220 2.768 2.594 4.014 . 0 0 "[ . 1 . 2]" 1
1532 1 42 LYS HB2 1 42 LYS HE3 4.660 . 5.660 4.521 2.227 5.521 . 0 0 "[ . 1 . 2]" 1
1533 1 42 LYS HB2 1 42 LYS HE2 4.660 . 5.660 4.528 2.990 5.520 . 0 0 "[ . 1 . 2]" 1
1534 1 42 LYS HB3 1 43 GLU H 4.220 . 5.220 3.649 2.655 3.992 . 0 0 "[ . 1 . 2]" 1
1535 1 42 LYS HB3 1 42 LYS HE3 4.660 . 5.660 4.048 2.131 5.520 . 0 0 "[ . 1 . 2]" 1
1536 1 42 LYS HB3 1 42 LYS HE2 4.660 . 5.660 4.269 2.729 4.737 . 0 0 "[ . 1 . 2]" 1
1537 1 41 ASP HB2 1 42 LYS H 3.720 . 4.720 4.029 3.746 4.309 . 0 0 "[ . 1 . 2]" 1
1538 1 41 ASP HB2 1 43 GLU H 5.500 . 6.500 6.117 5.890 6.395 . 0 0 "[ . 1 . 2]" 1
1539 1 41 ASP HB2 1 42 LYS HA 5.410 . 6.410 5.680 5.575 5.738 . 0 0 "[ . 1 . 2]" 1
1540 1 102 GLU H 1 106 LYS HB2 5.500 . 6.500 6.407 6.197 6.546 0.046 18 0 "[ . 1 . 2]" 1
1541 1 102 GLU H 1 105 LEU HB3 4.470 . 5.470 5.306 4.910 5.491 0.021 9 0 "[ . 1 . 2]" 1
1542 1 102 GLU H 1 106 LYS HG3 5.500 . 6.500 5.653 5.316 5.897 . 0 0 "[ . 1 . 2]" 1
1543 1 102 GLU H 1 103 LEU HG 5.500 . 6.500 4.833 3.834 6.577 0.077 14 0 "[ . 1 . 2]" 1
1544 1 102 GLU H 1 104 SER H 4.270 . 5.270 4.968 4.406 5.132 . 0 0 "[ . 1 . 2]" 1
1545 1 102 GLU H 1 106 LYS HG2 5.500 . 6.500 5.138 4.234 5.863 . 0 0 "[ . 1 . 2]" 1
1546 1 102 GLU H 1 103 LEU H 3.110 . 4.110 2.425 2.305 2.525 . 0 0 "[ . 1 . 2]" 1
1547 1 102 GLU H 1 102 GLU HG3 3.390 . 4.390 4.225 2.577 4.490 0.100 12 0 "[ . 1 . 2]" 1
1548 1 102 GLU H 1 102 GLU HB3 2.730 . 3.730 3.125 2.555 3.618 . 0 0 "[ . 1 . 2]" 1
1549 1 103 LEU HB2 1 104 SER H 3.530 . 4.530 2.964 2.218 3.949 . 0 0 "[ . 1 . 2]" 1
1550 1 103 LEU HB2 1 103 LEU MD2 3.360 . 4.360 2.694 2.182 3.199 . 0 0 "[ . 1 . 2]" 1
1551 1 103 LEU HB2 1 103 LEU MD1 3.360 . 4.360 2.405 2.009 3.185 . 0 0 "[ . 1 . 2]" 1
1552 1 103 LEU HB2 1 103 LEU QD 2.850 . 3.850 2.145 1.968 2.440 . 0 0 "[ . 1 . 2]" 1
1553 1 103 LEU HB2 1 104 SER QB 4.300 . 5.300 4.408 3.837 5.324 0.024 14 0 "[ . 1 . 2]" 1
1554 1 26 VAL HB 1 27 GLU HB3 5.340 . 6.340 5.744 5.492 6.106 . 0 0 "[ . 1 . 2]" 1
1555 1 26 VAL HB 1 65 LEU MD1 3.440 . 4.440 2.699 2.130 3.211 . 0 0 "[ . 1 . 2]" 1
1556 1 26 VAL HB 1 27 GLU H 2.930 . 3.930 2.287 1.805 2.963 . 0 0 "[ . 1 . 2]" 1
1557 1 26 VAL HB 1 35 VAL MG2 5.500 . 6.500 3.664 2.939 6.240 . 0 0 "[ . 1 . 2]" 1
1558 1 26 VAL HB 1 35 VAL MG1 5.500 . 6.500 5.125 3.732 5.597 . 0 0 "[ . 1 . 2]" 1
1559 1 26 VAL HB 1 35 VAL QG 3.990 . 4.990 3.484 2.902 3.951 . 0 0 "[ . 1 . 2]" 1
1560 1 30 ASP HB2 1 65 LEU MD1 4.270 . 5.270 2.261 1.925 3.591 . 0 0 "[ . 1 . 2]" 1
1561 1 30 ASP HB3 1 65 LEU MD1 4.270 . 5.270 2.460 1.972 2.736 . 0 0 "[ . 1 . 2]" 1
1562 1 26 VAL HA 1 26 VAL MG1 3.230 . 4.230 2.352 2.237 2.479 . 0 0 "[ . 1 . 2]" 1
1563 1 26 VAL HA 1 65 LEU MD1 4.510 . 5.510 4.613 4.035 5.028 . 0 0 "[ . 1 . 2]" 1
1564 1 26 VAL HA 1 27 GLU H 2.890 . 3.890 2.473 2.186 2.683 . 0 0 "[ . 1 . 2]" 1
1565 1 106 LYS H 1 107 GLU H 2.970 . 3.970 2.601 2.186 3.062 . 0 0 "[ . 1 . 2]" 1
1566 1 106 LYS H 1 106 LYS HG3 3.650 . 4.650 2.635 1.808 3.738 . 0 0 "[ . 1 . 2]" 1
1567 1 106 LYS H 1 108 SER H 4.620 . 5.620 4.229 3.780 4.684 . 0 0 "[ . 1 . 2]" 1
1568 1 106 LYS H 1 106 LYS HG2 3.650 . 4.650 3.047 2.040 3.548 . 0 0 "[ . 1 . 2]" 1
1569 1 108 SER H 1 109 ARG H 3.720 . 4.720 2.547 2.185 2.874 . 0 0 "[ . 1 . 2]" 1
1570 1 108 SER H 1 108 SER HB3 3.940 . 4.940 2.768 2.478 3.590 . 0 0 "[ . 1 . 2]" 1
1571 1 108 SER H 1 108 SER HB2 3.940 . 4.940 2.771 2.299 3.639 . 0 0 "[ . 1 . 2]" 1
1572 1 108 SER H 1 108 SER QB 3.270 . 4.270 2.374 2.248 2.729 . 0 0 "[ . 1 . 2]" 1
1573 1 107 GLU HA 1 108 SER H 3.330 . 4.330 3.506 3.433 3.558 . 0 0 "[ . 1 . 2]" 1
1574 1 106 LYS HA 1 107 GLU H 3.360 . 4.360 3.470 3.355 3.530 . 0 0 "[ . 1 . 2]" 1
1575 1 106 LYS HA 1 106 LYS HG3 4.230 . 5.230 3.612 3.514 3.734 . 0 0 "[ . 1 . 2]" 1
1576 1 106 LYS HA 1 109 ARG HA 5.500 . 6.500 5.289 4.790 6.503 0.003 20 0 "[ . 1 . 2]" 1
1577 1 106 LYS HA 1 108 SER H 4.410 . 5.410 4.025 3.523 4.475 . 0 0 "[ . 1 . 2]" 1
1578 1 106 LYS HA 1 106 LYS HG2 4.230 . 5.230 4.014 3.376 4.242 . 0 0 "[ . 1 . 2]" 1
1579 1 106 LYS HA 1 106 LYS QD 3.830 . 4.830 3.185 1.991 3.736 . 0 0 "[ . 1 . 2]" 1
1580 1 106 LYS HA 1 106 LYS QE 4.820 . 5.820 4.870 4.016 5.437 . 0 0 "[ . 1 . 2]" 1
1581 1 106 LYS HA 1 109 ARG QB 5.340 . 6.340 2.942 2.009 4.293 . 0 0 "[ . 1 . 2]" 1
1582 1 106 LYS HA 1 109 ARG QD 4.740 . 5.740 4.026 2.214 5.304 . 0 0 "[ . 1 . 2]" 1
1583 1 107 GLU HB3 1 108 SER H 4.390 . 5.390 2.943 2.338 4.198 . 0 0 "[ . 1 . 2]" 1
1584 1 107 GLU HB2 1 108 SER H 4.390 . 5.390 3.674 2.952 3.968 . 0 0 "[ . 1 . 2]" 1
1585 1 106 LYS HB3 1 108 SER H 5.500 . 6.500 5.712 5.430 6.021 . 0 0 "[ . 1 . 2]" 1
1586 1 106 LYS HB3 1 106 LYS QD 3.620 . 4.620 3.089 2.472 3.357 . 0 0 "[ . 1 . 2]" 1
1587 1 106 LYS HB3 1 106 LYS QE 4.460 . 5.460 3.940 3.372 4.520 . 0 0 "[ . 1 . 2]" 1
1588 1 106 LYS HG2 1 107 GLU H 5.100 . 6.100 3.936 3.565 4.246 . 0 0 "[ . 1 . 2]" 1
1589 1 106 LYS HG2 1 108 SER H 5.500 . 6.500 6.201 5.862 6.524 0.024 1 0 "[ . 1 . 2]" 1
1590 1 106 LYS HG2 1 107 GLU QB 4.730 . 5.730 5.101 4.449 5.449 . 0 0 "[ . 1 . 2]" 1
1591 1 106 LYS QE 1 106 LYS HG2 3.410 . 4.410 2.376 2.131 2.956 . 0 0 "[ . 1 . 2]" 1
1592 1 42 LYS HE3 1 42 LYS HG2 3.980 . 4.980 3.305 2.270 3.887 . 0 0 "[ . 1 . 2]" 1
1593 1 42 LYS HE2 1 42 LYS HG2 3.980 . 4.980 2.962 2.141 4.045 . 0 0 "[ . 1 . 2]" 1
1594 1 42 LYS HE3 1 42 LYS HG3 3.980 . 4.980 3.007 2.301 3.798 . 0 0 "[ . 1 . 2]" 1
1595 1 42 LYS HE2 1 42 LYS HG3 3.980 . 4.980 2.890 2.285 4.168 . 0 0 "[ . 1 . 2]" 1
1596 1 65 LEU HA 1 65 LEU MD1 4.070 . 5.070 3.662 3.628 3.696 . 0 0 "[ . 1 . 2]" 1
1597 1 65 LEU HA 1 65 LEU MD2 4.070 . 5.070 1.830 1.782 1.877 . 0 0 "[ . 1 . 2]" 1
1598 1 65 LEU HA 1 70 ILE MG 4.350 . 5.350 4.033 3.598 4.378 . 0 0 "[ . 1 . 2]" 1
1599 1 65 LEU HA 1 65 LEU HG 4.120 . 5.120 2.886 2.810 3.009 . 0 0 "[ . 1 . 2]" 1
1600 1 65 LEU HA 1 68 TYR H 4.240 . 5.240 4.323 4.069 4.533 . 0 0 "[ . 1 . 2]" 1
1601 1 65 LEU HA 1 70 ILE MD 3.960 . 4.960 2.888 2.096 4.808 . 0 0 "[ . 1 . 2]" 1
1602 1 65 LEU HA 1 70 ILE H 4.730 . 5.730 4.229 3.974 4.467 . 0 0 "[ . 1 . 2]" 1
1603 1 65 LEU HA 1 70 ILE HB 4.320 . 5.320 3.114 2.797 3.555 . 0 0 "[ . 1 . 2]" 1
1604 1 74 SER H 1 75 THR H 4.600 . 5.600 4.481 4.430 4.605 . 0 0 "[ . 1 . 2]" 1
1605 1 74 SER H 1 74 SER HB2 3.810 . 4.810 3.104 2.522 3.803 . 0 0 "[ . 1 . 2]" 1
1606 1 74 SER H 1 74 SER HB3 3.810 . 4.810 3.095 2.549 3.792 . 0 0 "[ . 1 . 2]" 1
1607 1 74 SER H 1 74 SER QB 3.260 . 4.260 2.609 2.413 2.970 . 0 0 "[ . 1 . 2]" 1
1608 1 70 ILE MD 1 76 LEU MD1 3.910 . 4.910 2.935 2.166 3.616 . 0 0 "[ . 1 . 2]" 1
1609 1 70 ILE MD 1 76 LEU MD2 3.910 . 4.910 3.288 2.095 4.604 . 0 0 "[ . 1 . 2]" 1
1610 1 70 ILE MD 1 76 LEU QD 3.420 . 4.420 2.623 2.033 3.265 . 0 0 "[ . 1 . 2]" 1
1611 1 70 ILE H 1 70 ILE MG 4.290 . 5.290 3.700 3.068 3.779 . 0 0 "[ . 1 . 2]" 1
1612 1 70 ILE H 1 70 ILE MD 4.300 . 5.300 3.199 2.486 3.886 . 0 0 "[ . 1 . 2]" 1
1613 1 70 ILE H 1 70 ILE HB 3.760 . 4.760 2.407 2.088 2.692 . 0 0 "[ . 1 . 2]" 1
1614 1 70 ILE H 1 70 ILE QG 4.290 . 5.290 2.377 1.814 3.637 . 0 0 "[ . 1 . 2]" 1
1615 1 47 PRO HA 1 50 GLN H 3.990 . 4.990 3.650 3.021 3.937 . 0 0 "[ . 1 . 2]" 1
1616 1 47 PRO HA 1 49 GLN H 4.320 . 5.320 4.250 3.545 4.733 . 0 0 "[ . 1 . 2]" 1
1617 1 47 PRO HA 1 50 GLN HB3 4.250 . 5.250 4.786 3.692 5.179 . 0 0 "[ . 1 . 2]" 1
1618 1 47 PRO HA 1 48 ASP HA 4.980 . 5.980 4.799 4.734 4.885 . 0 0 "[ . 1 . 2]" 1
1619 1 47 PRO HA 1 78 LEU QD 5.290 . 6.290 4.851 4.362 5.365 . 0 0 "[ . 1 . 2]" 1
1620 1 47 PRO HA 1 50 GLN QG 4.210 . 5.210 3.155 2.131 4.849 . 0 0 "[ . 1 . 2]" 1
1621 1 50 GLN HB3 1 78 LEU MD1 4.760 . 5.760 2.878 1.974 4.588 . 0 0 "[ . 1 . 2]" 1
1622 1 50 GLN HB3 1 78 LEU MD2 4.760 . 5.760 2.710 1.941 3.902 . 0 0 "[ . 1 . 2]" 1
1623 1 50 GLN HB3 1 78 LEU QD 4.010 . 5.010 2.341 1.798 3.392 . 0 0 "[ . 1 . 2]" 1
1624 1 50 GLN HB3 1 80 LEU QD 4.980 . 5.980 3.074 1.948 4.418 . 0 0 "[ . 1 . 2]" 1
1625 1 49 GLN HA 1 50 GLN H 3.210 . 4.210 3.394 3.261 3.470 . 0 0 "[ . 1 . 2]" 1
1626 1 49 GLN HA 1 49 GLN HG2 3.740 . 4.740 2.947 2.181 3.609 . 0 0 "[ . 1 . 2]" 1
1627 1 49 GLN HA 1 49 GLN HG3 3.740 . 4.740 2.453 2.090 3.254 . 0 0 "[ . 1 . 2]" 1
1628 1 49 GLN HA 1 80 LEU QD 5.440 . 6.440 5.482 4.176 6.461 0.021 12 0 "[ . 1 . 2]" 1
1629 1 49 GLN HA 1 81 ARG QB 3.570 . 4.570 3.618 2.401 4.618 0.048 9 0 "[ . 1 . 2]" 1
1630 1 80 LEU HA 1 81 ARG H 2.760 . 3.760 2.163 2.140 2.215 . 0 0 "[ . 1 . 2]" 1
1631 1 80 LEU HA 1 81 ARG HA 5.050 . 6.050 4.411 4.362 4.465 . 0 0 "[ . 1 . 2]" 1
1632 1 80 LEU HA 1 80 LEU HG 3.990 . 4.990 2.779 2.080 3.553 . 0 0 "[ . 1 . 2]" 1
1633 1 80 LEU HA 1 80 LEU MD2 3.600 . 4.600 2.319 1.970 3.707 . 0 0 "[ . 1 . 2]" 1
1634 1 80 LEU HA 1 80 LEU MD1 3.600 . 4.600 3.288 2.109 3.909 . 0 0 "[ . 1 . 2]" 1
1635 1 80 LEU HA 1 80 LEU QD 2.900 . 3.900 2.125 1.825 2.502 . 0 0 "[ . 1 . 2]" 1
1636 1 32 ILE HB 1 61 ASP HA 3.650 . 4.650 1.972 1.818 2.162 . 0 0 "[ . 1 . 2]" 1
1637 1 32 ILE HB 1 63 ARG H 4.560 . 5.560 3.808 3.306 4.370 . 0 0 "[ . 1 . 2]" 1
1638 1 32 ILE HB 1 61 ASP H 4.200 . 5.200 4.416 3.755 4.705 . 0 0 "[ . 1 . 2]" 1
1639 1 32 ILE HB 1 61 ASP QB 3.710 . 4.710 3.753 3.229 4.173 . 0 0 "[ . 1 . 2]" 1
1640 1 31 THR HB 1 64 THR HB 5.420 . 6.420 5.873 5.450 6.308 . 0 0 "[ . 1 . 2]" 1
1641 1 31 THR HB 1 64 THR MG 3.850 . 4.850 3.566 3.119 3.900 . 0 0 "[ . 1 . 2]" 1
1642 1 31 THR HB 1 32 ILE HA 5.500 . 6.500 5.013 4.870 5.123 . 0 0 "[ . 1 . 2]" 1
1643 1 31 THR HB 1 64 THR HA 4.310 . 5.310 3.914 3.818 4.068 . 0 0 "[ . 1 . 2]" 1
1644 1 31 THR HB 1 32 ILE H 4.730 . 5.730 2.602 2.329 2.844 . 0 0 "[ . 1 . 2]" 1
1645 1 31 THR HB 1 63 ARG H 4.330 . 5.330 5.047 4.765 5.349 0.019 5 0 "[ . 1 . 2]" 1
1646 1 31 THR HB 1 63 ARG HA 4.830 . 5.830 5.852 5.827 5.873 0.043 7 0 "[ . 1 . 2]" 1
1647 1 31 THR HB 1 32 ILE HB 4.750 . 5.750 4.376 4.111 4.534 . 0 0 "[ . 1 . 2]" 1
1648 1 31 THR HB 1 33 ASP QB 5.060 . 6.060 3.921 3.546 4.578 . 0 0 "[ . 1 . 2]" 1
1649 1 70 ILE HB 1 76 LEU QD 4.940 . 5.940 4.071 3.591 4.500 . 0 0 "[ . 1 . 2]" 1
1650 1 96 LEU H 1 96 LEU HB3 3.610 . 4.610 2.446 2.113 3.079 . 0 0 "[ . 1 . 2]" 1
1651 1 96 LEU H 1 97 ILE HA 5.250 . 6.250 5.321 5.044 5.620 . 0 0 "[ . 1 . 2]" 1
1652 1 96 LEU H 1 98 ARG H 4.020 . 5.020 4.705 4.375 5.044 0.024 16 0 "[ . 1 . 2]" 1
1653 1 96 LEU H 1 97 ILE MD 5.500 . 6.500 4.706 3.932 5.478 . 0 0 "[ . 1 . 2]" 1
1654 1 96 LEU H 1 96 LEU MD2 4.520 . 5.520 2.456 1.647 3.513 . 0 0 "[ . 1 . 2]" 1
1655 1 96 LEU H 1 96 LEU HG 3.920 . 4.920 3.162 1.666 4.151 . 0 0 "[ . 1 . 2]" 1
1656 1 96 LEU H 1 96 LEU MD1 4.520 . 5.520 3.409 1.969 4.051 . 0 0 "[ . 1 . 2]" 1
1657 1 96 LEU H 1 96 LEU HB2 3.610 . 4.610 3.526 3.399 3.616 . 0 0 "[ . 1 . 2]" 1
1658 1 96 LEU H 1 99 LYS HG3 5.350 . 6.350 5.627 3.673 6.378 0.028 15 0 "[ . 1 . 2]" 1
1659 1 96 LEU H 1 99 LYS HD3 5.100 . 6.100 4.816 3.592 6.205 0.105 14 0 "[ . 1 . 2]" 1
1660 1 96 LEU H 1 97 ILE H 3.080 . 4.080 2.751 2.462 3.114 . 0 0 "[ . 1 . 2]" 1
1661 1 96 LEU H 1 99 LYS H 4.870 . 5.870 4.855 4.511 5.260 . 0 0 "[ . 1 . 2]" 1
1662 1 96 LEU H 1 96 LEU QD 3.400 . 4.400 2.113 1.645 2.921 . 0 0 "[ . 1 . 2]" 1
1663 1 97 ILE MD 1 100 ALA MB 4.380 . 5.380 5.296 5.032 5.483 0.103 6 0 "[ . 1 . 2]" 1
1664 1 97 ILE MD 1 98 ARG H 5.210 . 6.210 4.278 4.101 4.417 . 0 0 "[ . 1 . 2]" 1
1665 1 96 LEU HG 1 97 ILE MD 3.410 . 4.410 3.808 3.140 4.436 0.026 12 0 "[ . 1 . 2]" 1
1666 1 96 LEU HG 1 97 ILE H 3.910 . 4.910 3.285 2.808 3.771 . 0 0 "[ . 1 . 2]" 1
1667 1 91 ALA MB 1 92 ASP HA 4.150 . 5.150 4.018 3.777 4.343 . 0 0 "[ . 1 . 2]" 1
1668 1 91 ALA MB 1 96 LEU H 4.780 . 5.780 4.321 3.700 4.704 . 0 0 "[ . 1 . 2]" 1
1669 1 91 ALA MB 1 96 LEU MD2 4.880 . 5.880 3.767 2.234 4.855 . 0 0 "[ . 1 . 2]" 1
1670 1 91 ALA MB 1 96 LEU MD1 4.880 . 5.880 3.635 2.395 4.469 . 0 0 "[ . 1 . 2]" 1
1671 1 91 ALA MB 1 96 LEU HB2 3.040 . 4.040 2.684 2.024 3.244 . 0 0 "[ . 1 . 2]" 1
1672 1 91 ALA MB 1 93 GLU HA 5.130 . 6.130 5.070 4.386 5.993 . 0 0 "[ . 1 . 2]" 1
1673 1 91 ALA MB 1 95 GLU H 5.500 . 6.500 6.119 5.788 6.372 . 0 0 "[ . 1 . 2]" 1
1674 1 91 ALA MB 1 92 ASP H 3.210 . 4.210 3.010 2.098 3.591 . 0 0 "[ . 1 . 2]" 1
1675 1 91 ALA MB 1 96 LEU HA 4.590 . 5.590 3.285 2.426 3.884 . 0 0 "[ . 1 . 2]" 1
1676 1 91 ALA MB 1 96 LEU QD 3.780 . 4.780 3.000 2.224 3.993 . 0 0 "[ . 1 . 2]" 1
1677 1 91 ALA MB 1 95 GLU QG 4.420 . 5.420 4.358 3.953 5.427 0.007 20 0 "[ . 1 . 2]" 1
1678 1 99 LYS HG3 1 103 LEU MD2 5.300 . 6.300 3.499 2.018 6.310 0.010 6 0 "[ . 1 . 2]" 1
1679 1 99 LYS HG3 1 103 LEU MD1 5.300 . 6.300 4.865 2.185 6.350 0.050 4 0 "[ . 1 . 2]" 1
1680 1 99 LYS HG3 1 103 LEU QD 4.630 . 5.630 3.105 2.015 4.894 . 0 0 "[ . 1 . 2]" 1
1681 1 99 LYS HD3 1 100 ALA H 5.500 . 6.500 4.770 3.184 6.219 . 0 0 "[ . 1 . 2]" 1
1682 1 92 ASP HB3 1 96 LEU H 5.500 . 6.500 5.845 5.143 6.495 . 0 0 "[ . 1 . 2]" 1
1683 1 92 ASP HB2 1 96 LEU H 5.500 . 6.500 4.442 3.795 5.042 . 0 0 "[ . 1 . 2]" 1
1684 1 92 ASP HB2 1 93 GLU HA 5.500 . 6.500 5.261 4.442 5.986 . 0 0 "[ . 1 . 2]" 1
1685 1 92 ASP HB2 1 95 GLU H 4.140 . 5.140 3.598 3.245 4.118 . 0 0 "[ . 1 . 2]" 1
1686 1 92 ASP HB2 1 94 GLU H 4.120 . 5.120 4.142 3.084 5.127 0.007 12 0 "[ . 1 . 2]" 1
1687 1 92 ASP HB2 1 94 GLU HA 5.500 . 6.500 6.269 5.842 6.564 0.064 12 0 "[ . 1 . 2]" 1
1688 1 93 GLU HA 1 96 LEU H 4.430 . 5.430 4.637 4.348 4.966 . 0 0 "[ . 1 . 2]" 1
1689 1 93 GLU HA 1 96 LEU MD2 3.650 . 4.650 2.722 1.906 3.608 . 0 0 "[ . 1 . 2]" 1
1690 1 93 GLU HA 1 96 LEU MD1 3.650 . 4.650 3.005 2.394 3.644 . 0 0 "[ . 1 . 2]" 1
1691 1 93 GLU HA 1 96 LEU HB2 4.240 . 5.240 5.269 5.114 5.373 0.133 4 0 "[ . 1 . 2]" 1
1692 1 93 GLU HA 1 96 LEU QD 3.090 . 4.090 2.391 1.869 3.066 . 0 0 "[ . 1 . 2]" 1
1693 1 95 GLU H 1 98 ARG H 5.440 . 6.440 5.483 5.098 5.743 . 0 0 "[ . 1 . 2]" 1
1694 1 95 GLU H 1 96 LEU H 2.980 . 3.980 2.759 2.646 3.000 . 0 0 "[ . 1 . 2]" 1
1695 1 95 GLU H 1 96 LEU MD2 5.500 . 6.500 4.063 3.452 5.037 . 0 0 "[ . 1 . 2]" 1
1696 1 95 GLU H 1 96 LEU HG 5.500 . 6.500 5.444 3.549 6.512 0.012 16 0 "[ . 1 . 2]" 1
1697 1 95 GLU H 1 96 LEU MD1 5.500 . 6.500 5.111 3.779 5.937 . 0 0 "[ . 1 . 2]" 1
1698 1 95 GLU H 1 96 LEU HB2 5.500 . 6.500 6.179 6.006 6.361 . 0 0 "[ . 1 . 2]" 1
1699 1 95 GLU H 1 95 GLU HB2 3.500 . 4.500 3.534 3.065 3.601 . 0 0 "[ . 1 . 2]" 1
1700 1 95 GLU H 1 96 LEU QD 4.290 . 5.290 3.683 3.422 4.104 . 0 0 "[ . 1 . 2]" 1
1701 1 95 GLU H 1 95 GLU QG 3.130 . 4.130 2.017 1.623 2.513 . 0 0 "[ . 1 . 2]" 1
1702 1 97 ILE H 1 97 ILE HG12 4.430 . 5.430 4.375 4.265 4.468 . 0 0 "[ . 1 . 2]" 1
1703 1 97 ILE H 1 97 ILE MG 3.490 . 4.490 3.617 3.551 3.691 . 0 0 "[ . 1 . 2]" 1
1704 1 97 ILE H 1 98 ARG HA 4.870 . 5.870 5.093 4.978 5.295 . 0 0 "[ . 1 . 2]" 1
1705 1 94 GLU H 1 96 LEU H 4.110 . 5.110 3.032 2.294 4.240 . 0 0 "[ . 1 . 2]" 1
1706 1 94 GLU H 1 95 GLU H 3.020 . 4.020 2.714 2.092 3.312 . 0 0 "[ . 1 . 2]" 1
1707 1 94 GLU H 1 94 GLU HB3 3.550 . 4.550 3.303 2.474 4.029 . 0 0 "[ . 1 . 2]" 1
1708 1 94 GLU H 1 94 GLU HB2 3.550 . 4.550 3.250 2.157 3.809 . 0 0 "[ . 1 . 2]" 1
1709 1 94 GLU H 1 96 LEU QD 4.640 . 5.640 2.610 1.583 3.883 . 0 0 "[ . 1 . 2]" 1
1710 1 94 GLU H 1 95 GLU QG 3.630 . 4.630 3.526 2.941 4.117 . 0 0 "[ . 1 . 2]" 1
1711 1 94 GLU H 1 94 GLU QB 3.020 . 4.020 2.832 2.125 3.209 . 0 0 "[ . 1 . 2]" 1
1712 1 95 GLU HB2 1 99 LYS HD3 4.740 . 5.740 4.289 2.977 5.353 . 0 0 "[ . 1 . 2]" 1
1713 1 95 GLU HB2 1 99 LYS H 4.630 . 5.630 4.239 3.487 4.791 . 0 0 "[ . 1 . 2]" 1
1714 1 95 GLU HB2 1 98 ARG HG3 4.460 . 5.460 3.926 3.019 5.462 0.002 20 0 "[ . 1 . 2]" 1
1715 1 95 GLU HB2 1 98 ARG QD 4.350 . 5.350 3.438 2.523 4.606 . 0 0 "[ . 1 . 2]" 1
1716 1 91 ALA HA 1 92 ASP HA 4.550 . 5.550 4.459 4.418 4.671 . 0 0 "[ . 1 . 2]" 1
1717 1 91 ALA HA 1 96 LEU MD2 5.500 . 6.500 4.412 3.499 5.431 . 0 0 "[ . 1 . 2]" 1
1718 1 91 ALA HA 1 96 LEU HG 5.500 . 6.500 4.997 3.380 6.490 . 0 0 "[ . 1 . 2]" 1
1719 1 91 ALA HA 1 96 LEU MD1 5.500 . 6.500 4.743 3.717 5.893 . 0 0 "[ . 1 . 2]" 1
1720 1 91 ALA HA 1 96 LEU HB2 3.860 . 4.860 3.577 2.477 4.536 . 0 0 "[ . 1 . 2]" 1
1721 1 91 ALA HA 1 99 LYS HG3 4.670 . 5.670 5.106 2.609 5.720 0.050 19 0 "[ . 1 . 2]" 1
1722 1 91 ALA HA 1 99 LYS HD3 5.500 . 6.500 3.402 2.393 5.935 . 0 0 "[ . 1 . 2]" 1
1723 1 91 ALA HA 1 95 GLU H 4.460 . 5.460 5.421 5.159 5.545 0.085 15 0 "[ . 1 . 2]" 1
1724 1 91 ALA HA 1 92 ASP H 3.000 . 4.000 2.226 2.160 2.598 . 0 0 "[ . 1 . 2]" 1
1725 1 91 ALA HA 1 99 LYS HD2 5.500 . 6.500 4.085 2.896 6.519 0.019 15 0 "[ . 1 . 2]" 1
1726 1 91 ALA HA 1 99 LYS HB2 5.500 . 6.500 5.879 3.769 6.547 0.047 12 0 "[ . 1 . 2]" 1
1727 1 91 ALA HA 1 96 LEU HA 4.340 . 5.340 2.942 2.483 3.429 . 0 0 "[ . 1 . 2]" 1
1728 1 91 ALA HA 1 95 GLU QG 4.070 . 5.070 3.113 2.668 4.628 . 0 0 "[ . 1 . 2]" 1
1729 1 92 ASP H 1 93 GLU H 2.720 . 3.720 2.635 1.656 3.742 0.022 9 0 "[ . 1 . 2]" 1
1730 1 92 ASP H 1 96 LEU MD2 4.730 . 5.730 3.669 2.605 4.486 . 0 0 "[ . 1 . 2]" 1
1731 1 92 ASP H 1 96 LEU MD1 4.730 . 5.730 4.338 3.521 4.762 . 0 0 "[ . 1 . 2]" 1
1732 1 92 ASP H 1 96 LEU HB2 3.290 . 4.290 4.148 3.690 4.345 0.055 19 0 "[ . 1 . 2]" 1
1733 1 92 ASP H 1 93 GLU HA 4.790 . 5.790 4.419 3.809 5.041 . 0 0 "[ . 1 . 2]" 1
1734 1 92 ASP H 1 95 GLU H 3.820 . 4.820 4.074 3.690 4.554 . 0 0 "[ . 1 . 2]" 1
1735 1 92 ASP H 1 96 LEU QD 4.040 . 5.040 3.434 2.585 4.096 . 0 0 "[ . 1 . 2]" 1
1736 1 92 ASP H 1 95 GLU QG 5.180 . 6.180 2.513 1.952 3.379 . 0 0 "[ . 1 . 2]" 1
1737 1 103 LEU H 1 105 LEU HB3 5.330 . 6.330 5.359 4.870 5.818 . 0 0 "[ . 1 . 2]" 1
1738 1 103 LEU H 1 105 LEU MD2 5.000 . 6.000 5.037 4.264 5.855 . 0 0 "[ . 1 . 2]" 1
1739 1 103 LEU H 1 103 LEU HG 3.930 . 4.930 2.974 1.810 4.311 . 0 0 "[ . 1 . 2]" 1
1740 1 103 LEU H 1 103 LEU HB3 3.550 . 4.550 3.055 2.302 3.564 . 0 0 "[ . 1 . 2]" 1
1741 1 103 LEU H 1 103 LEU HB2 3.550 . 4.550 3.024 2.140 3.754 . 0 0 "[ . 1 . 2]" 1
1742 1 103 LEU H 1 103 LEU QD 3.800 . 4.800 3.070 2.665 3.753 . 0 0 "[ . 1 . 2]" 1
1743 1 102 GLU HG3 1 106 LYS HG3 4.380 . 5.380 4.656 2.918 5.428 0.048 1 0 "[ . 1 . 2]" 1
1744 1 102 GLU HG3 1 106 LYS HG2 4.380 . 5.380 3.704 2.298 4.688 . 0 0 "[ . 1 . 2]" 1
1745 1 102 GLU HB3 1 106 LYS HG3 5.340 . 6.340 5.277 4.003 6.012 . 0 0 "[ . 1 . 2]" 1
1746 1 102 GLU HB3 1 106 LYS HG2 5.340 . 6.340 4.420 3.593 5.360 . 0 0 "[ . 1 . 2]" 1
1747 1 102 GLU HB3 1 103 LEU H 3.590 . 4.590 3.566 2.980 4.120 . 0 0 "[ . 1 . 2]" 1
1748 1 102 GLU HB3 1 103 LEU HA 4.370 . 5.370 4.155 4.065 4.540 . 0 0 "[ . 1 . 2]" 1
1749 1 102 GLU HB3 1 103 LEU QD 3.770 . 4.770 4.220 2.726 4.872 0.102 8 0 "[ . 1 . 2]" 1
1750 1 99 LYS HB3 1 100 ALA H 5.120 . 6.120 3.605 2.614 4.249 . 0 0 "[ . 1 . 2]" 1
1751 1 99 LYS HB3 1 102 GLU H 5.500 . 6.500 5.454 5.071 5.802 . 0 0 "[ . 1 . 2]" 1
1752 1 99 LYS HB3 1 99 LYS HD3 3.950 . 4.950 3.497 2.860 3.695 . 0 0 "[ . 1 . 2]" 1
1753 1 99 LYS HB3 1 103 LEU QD 5.400 . 6.400 3.798 1.836 4.591 . 0 0 "[ . 1 . 2]" 1
1754 1 61 ASP H 1 63 ARG H 5.500 . 6.500 4.227 4.019 4.372 . 0 0 "[ . 1 . 2]" 1
1755 1 61 ASP H 1 61 ASP QB 2.840 . 3.840 2.332 2.048 2.642 . 0 0 "[ . 1 . 2]" 1
1756 1 60 GLU HB2 1 61 ASP H 3.950 . 4.950 3.825 2.309 4.359 . 0 0 "[ . 1 . 2]" 1
1757 1 60 GLU HB3 1 61 ASP H 3.950 . 4.950 3.353 2.252 4.207 . 0 0 "[ . 1 . 2]" 1
1758 1 60 GLU HA 1 61 ASP H 2.480 . 3.480 2.221 2.139 2.461 . 0 0 "[ . 1 . 2]" 1
1759 1 60 GLU HA 1 60 GLU QG 3.540 . 4.540 2.559 1.998 3.361 . 0 0 "[ . 1 . 2]" 1
1760 1 38 LYS HA 1 41 ASP H 3.730 . 4.730 3.592 3.407 3.822 . 0 0 "[ . 1 . 2]" 1
1761 1 38 LYS HA 1 41 ASP HB3 4.460 . 5.460 3.192 2.585 3.751 . 0 0 "[ . 1 . 2]" 1
1762 1 38 LYS HA 1 41 ASP HB2 4.460 . 5.460 3.673 3.238 4.448 . 0 0 "[ . 1 . 2]" 1
1763 1 40 GLN HG3 1 41 ASP H 4.180 . 5.180 2.810 1.992 3.579 . 0 0 "[ . 1 . 2]" 1
1764 1 40 GLN HG3 1 47 PRO HD2 4.750 . 5.750 5.327 4.956 5.724 . 0 0 "[ . 1 . 2]" 1
1765 1 40 GLN HG3 1 46 PRO HA 4.360 . 5.360 4.958 4.371 5.407 0.047 2 0 "[ . 1 . 2]" 1
1766 1 25 GLU H 1 26 VAL MG1 4.310 . 5.310 3.801 3.597 3.919 . 0 0 "[ . 1 . 2]" 1
1767 1 25 GLU H 1 26 VAL H 4.660 . 5.660 4.272 4.126 4.420 . 0 0 "[ . 1 . 2]" 1
1768 1 25 GLU H 1 25 GLU HB2 3.660 . 4.660 2.631 2.224 3.600 . 0 0 "[ . 1 . 2]" 1
1769 1 25 GLU H 1 25 GLU HB3 3.660 . 4.660 3.264 2.612 3.637 . 0 0 "[ . 1 . 2]" 1
1770 1 24 LEU HB3 1 26 VAL MG1 4.860 . 5.860 3.828 2.760 4.259 . 0 0 "[ . 1 . 2]" 1
1771 1 24 LEU HB3 1 39 ILE HA 4.920 . 5.920 4.172 3.363 4.861 . 0 0 "[ . 1 . 2]" 1
1772 1 24 LEU HB3 1 25 GLU H 3.670 . 4.670 3.674 3.287 3.884 . 0 0 "[ . 1 . 2]" 1
1773 1 24 LEU HB3 1 24 LEU QD 3.040 . 4.040 2.081 1.968 2.199 . 0 0 "[ . 1 . 2]" 1
1774 1 24 LEU HA 1 26 VAL MG1 5.230 . 6.230 4.324 3.982 4.556 . 0 0 "[ . 1 . 2]" 1
1775 1 24 LEU HA 1 42 LYS HB2 5.500 . 6.500 6.081 4.474 6.523 0.023 2 0 "[ . 1 . 2]" 1
1776 1 24 LEU HA 1 42 LYS HB3 5.500 . 6.500 6.152 5.423 6.494 . 0 0 "[ . 1 . 2]" 1
1777 1 24 LEU HA 1 42 LYS HG2 5.470 . 6.470 4.828 3.754 5.776 . 0 0 "[ . 1 . 2]" 1
1778 1 24 LEU HA 1 42 LYS HG3 5.470 . 6.470 4.234 3.257 6.487 0.017 17 0 "[ . 1 . 2]" 1
1779 1 24 LEU HA 1 42 LYS HE3 4.880 . 5.880 3.612 2.227 5.333 . 0 0 "[ . 1 . 2]" 1
1780 1 24 LEU HA 1 42 LYS HE2 4.880 . 5.880 3.468 2.393 4.758 . 0 0 "[ . 1 . 2]" 1
1781 1 24 LEU HA 1 25 GLU H 2.510 . 3.510 2.185 2.157 2.217 . 0 0 "[ . 1 . 2]" 1
1782 1 24 LEU HA 1 25 GLU QG 4.840 . 5.840 4.306 3.406 5.781 . 0 0 "[ . 1 . 2]" 1
1783 1 24 LEU HA 1 24 LEU QD 3.340 . 4.340 3.061 2.152 3.335 . 0 0 "[ . 1 . 2]" 1
1784 1 24 LEU HA 1 42 LYS QB 4.780 . 5.780 5.433 4.274 5.783 0.003 2 0 "[ . 1 . 2]" 1
1785 1 24 LEU HA 1 42 LYS QG 4.630 . 5.630 3.849 3.190 4.722 . 0 0 "[ . 1 . 2]" 1
1786 1 24 LEU HA 1 42 LYS QE 4.130 . 5.130 2.879 2.207 3.958 . 0 0 "[ . 1 . 2]" 1
1787 1 35 VAL MG2 1 76 LEU HG 4.370 . 5.370 4.938 4.172 5.398 0.028 2 0 "[ . 1 . 2]" 1
1788 1 35 VAL MG2 1 52 LEU HG 5.270 . 6.270 4.857 3.678 6.299 0.029 13 0 "[ . 1 . 2]" 1
1789 1 35 VAL MG1 1 76 LEU HG 4.370 . 5.370 4.199 3.101 5.097 . 0 0 "[ . 1 . 2]" 1
1790 1 35 VAL MG1 1 52 LEU HG 5.270 . 6.270 3.557 2.421 6.123 . 0 0 "[ . 1 . 2]" 1
1791 1 99 LYS HD2 1 100 ALA HA 5.200 . 6.200 6.115 5.693 6.336 0.136 14 0 "[ . 1 . 2]" 1
1792 1 99 LYS HD2 1 100 ALA H 5.500 . 6.500 4.880 4.034 6.080 . 0 0 "[ . 1 . 2]" 1
1793 1 99 LYS HD2 1 103 LEU QD 4.410 . 5.410 4.148 2.351 5.395 . 0 0 "[ . 1 . 2]" 1
1794 1 99 LYS HB2 1 100 ALA HA 5.500 . 6.500 4.779 3.775 5.678 . 0 0 "[ . 1 . 2]" 1
1795 1 99 LYS HB2 1 100 ALA H 5.120 . 6.120 3.630 1.826 4.202 . 0 0 "[ . 1 . 2]" 1
1796 1 99 LYS HB2 1 99 LYS HD3 3.950 . 4.950 3.593 2.218 4.246 . 0 0 "[ . 1 . 2]" 1
1797 1 99 LYS HB2 1 103 LEU QD 5.400 . 6.400 3.029 1.939 4.464 . 0 0 "[ . 1 . 2]" 1
1798 1 95 GLU HA 1 98 ARG HG2 5.200 . 6.200 2.130 1.954 2.587 . 0 0 "[ . 1 . 2]" 1
1799 1 95 GLU HA 1 100 ALA H 5.500 . 6.500 6.000 5.643 6.522 0.022 8 0 "[ . 1 . 2]" 1
1800 1 95 GLU HA 1 98 ARG H 3.400 . 4.400 3.329 3.030 3.610 . 0 0 "[ . 1 . 2]" 1
1801 1 95 GLU HA 1 99 LYS HD3 5.070 . 6.070 5.645 4.675 6.122 0.052 17 0 "[ . 1 . 2]" 1
1802 1 95 GLU HA 1 97 ILE H 4.420 . 5.420 3.517 3.311 3.883 . 0 0 "[ . 1 . 2]" 1
1803 1 95 GLU HA 1 97 ILE MG 5.230 . 6.230 5.303 5.071 5.613 . 0 0 "[ . 1 . 2]" 1
1804 1 95 GLU HA 1 98 ARG HB3 4.110 . 5.110 4.081 2.924 4.606 . 0 0 "[ . 1 . 2]" 1
1805 1 95 GLU HA 1 99 LYS H 4.110 . 5.110 3.771 3.424 4.139 . 0 0 "[ . 1 . 2]" 1
1806 1 95 GLU HA 1 98 ARG HG3 5.200 . 6.200 3.337 2.777 4.041 . 0 0 "[ . 1 . 2]" 1
1807 1 95 GLU HA 1 98 ARG HB2 4.110 . 5.110 4.848 4.257 5.052 . 0 0 "[ . 1 . 2]" 1
1808 1 95 GLU HA 1 98 ARG HA 5.050 . 6.050 5.583 5.041 5.821 . 0 0 "[ . 1 . 2]" 1
1809 1 95 GLU HA 1 96 LEU HA 4.970 . 5.970 4.859 4.715 5.026 . 0 0 "[ . 1 . 2]" 1
1810 1 95 GLU HA 1 96 LEU QD 4.110 . 5.110 4.216 3.900 4.744 . 0 0 "[ . 1 . 2]" 1
1811 1 95 GLU HA 1 95 GLU QG 3.500 . 4.500 3.290 2.754 3.394 . 0 0 "[ . 1 . 2]" 1
1812 1 95 GLU HA 1 98 ARG QD 4.010 . 5.010 2.501 2.106 3.011 . 0 0 "[ . 1 . 2]" 1
1813 1 83 ARG H 1 83 ARG HB2 3.490 . 4.490 2.830 2.184 3.754 . 0 0 "[ . 1 . 2]" 1
1814 1 83 ARG H 1 83 ARG HB3 3.490 . 4.490 2.916 2.517 3.696 . 0 0 "[ . 1 . 2]" 1
1815 1 83 ARG H 1 83 ARG QB 3.010 . 4.010 2.424 2.154 2.866 . 0 0 "[ . 1 . 2]" 1
1816 1 82 LEU HA 1 82 LEU MD2 3.690 . 4.690 2.597 1.921 3.832 . 0 0 "[ . 1 . 2]" 1
1817 1 82 LEU HA 1 93 GLU HB3 5.430 . 6.430 6.093 5.475 6.467 0.037 15 0 "[ . 1 . 2]" 1
1818 1 82 LEU HA 1 93 GLU HB2 5.430 . 6.430 4.570 3.887 6.497 0.067 17 0 "[ . 1 . 2]" 1
1819 1 82 LEU HA 1 93 GLU HA 5.500 . 6.500 5.251 4.481 5.863 . 0 0 "[ . 1 . 2]" 1
1820 1 82 LEU HA 1 83 ARG H 2.700 . 3.700 2.191 2.129 2.431 . 0 0 "[ . 1 . 2]" 1
1821 1 82 LEU HA 1 82 LEU HG 3.850 . 4.850 2.899 2.085 3.590 . 0 0 "[ . 1 . 2]" 1
1822 1 82 LEU HA 1 82 LEU MD1 3.690 . 4.690 2.662 1.986 3.682 . 0 0 "[ . 1 . 2]" 1
1823 1 82 LEU HA 1 83 ARG QB 5.340 . 6.340 4.271 4.016 4.627 . 0 0 "[ . 1 . 2]" 1
1824 1 87 MET H 1 87 MET HB3 4.150 . 5.150 2.977 2.479 3.632 . 0 0 "[ . 1 . 2]" 1
1825 1 87 MET H 1 87 MET HB2 4.150 . 5.150 2.617 2.075 3.618 . 0 0 "[ . 1 . 2]" 1
1826 1 87 MET H 1 87 MET QB 3.540 . 4.540 2.323 2.055 2.759 . 0 0 "[ . 1 . 2]" 1
1827 1 87 MET H 1 87 MET QG 4.400 . 5.400 3.164 1.844 4.042 . 0 0 "[ . 1 . 2]" 1
1828 1 49 GLN HG2 1 81 ARG H 4.450 . 5.450 3.756 2.457 4.631 . 0 0 "[ . 1 . 2]" 1
1829 1 49 GLN HG2 1 81 ARG QD 4.090 . 5.090 4.210 2.042 5.135 0.045 12 0 "[ . 1 . 2]" 1
1830 1 49 GLN HG2 1 81 ARG HA 5.090 . 6.090 5.431 4.172 6.106 0.016 13 0 "[ . 1 . 2]" 1
1831 1 49 GLN HG2 1 82 LEU HA 5.440 . 6.440 5.360 4.231 6.460 0.020 18 0 "[ . 1 . 2]" 1
1832 1 49 GLN HG2 1 81 ARG HB3 4.370 . 5.370 4.058 3.258 5.405 0.035 4 0 "[ . 1 . 2]" 1
1833 1 49 GLN HG2 1 81 ARG HB2 4.370 . 5.370 3.848 2.019 5.394 0.024 5 0 "[ . 1 . 2]" 1
1834 1 49 GLN HG2 1 80 LEU QD 5.090 . 6.090 4.031 2.257 5.411 . 0 0 "[ . 1 . 2]" 1
1835 1 49 GLN HG2 1 81 ARG QB 3.730 . 4.730 3.285 2.007 4.671 . 0 0 "[ . 1 . 2]" 1
1836 1 49 GLN HG2 1 81 ARG QG 4.500 . 5.500 4.082 1.976 5.526 0.026 17 0 "[ . 1 . 2]" 1
1837 1 49 GLN HG2 1 83 ARG QB 4.430 . 5.430 4.476 3.334 5.449 0.019 7 0 "[ . 1 . 2]" 1
1838 1 49 GLN HG3 1 81 ARG H 4.450 . 5.450 4.655 3.250 5.436 . 0 0 "[ . 1 . 2]" 1
1839 1 49 GLN HG3 1 82 LEU HA 5.440 . 6.440 5.654 3.941 6.475 0.035 19 0 "[ . 1 . 2]" 1
1840 1 49 GLN HG3 1 80 LEU QD 5.090 . 6.090 5.036 3.712 6.041 . 0 0 "[ . 1 . 2]" 1
1841 1 80 LEU HG 1 81 ARG H 5.480 . 6.480 4.582 3.103 5.079 . 0 0 "[ . 1 . 2]" 1
1842 1 82 LEU HG 1 92 ASP HA 5.500 . 6.500 4.015 2.307 5.780 . 0 0 "[ . 1 . 2]" 1
1843 1 82 LEU HG 1 87 MET HA 4.900 . 5.900 4.054 1.993 5.924 0.024 1 0 "[ . 1 . 2]" 1
1844 1 82 LEU HG 1 87 MET H 5.500 . 6.500 4.644 2.750 6.053 . 0 0 "[ . 1 . 2]" 1
1845 1 82 LEU HG 1 87 MET QB 4.220 . 5.220 3.894 2.073 5.260 0.040 8 0 "[ . 1 . 2]" 1
1846 1 82 LEU MD1 1 93 GLU HB3 4.970 . 5.970 5.460 3.616 6.012 0.042 17 0 "[ . 1 . 2]" 1
1847 1 82 LEU MD1 1 93 GLU HB2 4.970 . 5.970 4.421 2.435 5.403 . 0 0 "[ . 1 . 2]" 1
1848 1 82 LEU MD1 1 92 ASP HA 5.280 . 6.280 3.831 2.234 5.737 . 0 0 "[ . 1 . 2]" 1
1849 1 82 LEU MD1 1 84 GLY QA 3.660 . 4.660 3.664 2.409 4.680 0.020 15 0 "[ . 1 . 2]" 1
1850 1 82 LEU MD1 1 83 ARG HA 5.500 . 6.500 5.052 3.865 6.479 . 0 0 "[ . 1 . 2]" 1
1851 1 82 LEU MD1 1 87 MET HA 5.090 . 6.090 3.523 2.001 5.383 . 0 0 "[ . 1 . 2]" 1
1852 1 82 LEU MD1 1 87 MET H 5.500 . 6.500 3.892 1.943 5.519 . 0 0 "[ . 1 . 2]" 1
1853 1 82 LEU MD1 1 87 MET QB 4.640 . 5.640 3.323 1.977 5.285 . 0 0 "[ . 1 . 2]" 1
1854 1 51 ARG HD3 1 97 ILE MD 4.230 . 5.230 3.124 2.103 5.195 . 0 0 "[ . 1 . 2]" 1
1855 1 51 ARG HD2 1 97 ILE MD 4.230 . 5.230 3.519 1.984 5.112 . 0 0 "[ . 1 . 2]" 1
1856 1 50 GLN HB2 1 51 ARG H 4.480 . 5.480 3.278 2.138 4.321 . 0 0 "[ . 1 . 2]" 1
1857 1 50 GLN HB2 1 78 LEU QD 4.010 . 5.010 2.732 2.025 3.621 . 0 0 "[ . 1 . 2]" 1
1858 1 50 GLN HB2 1 80 LEU QD 4.980 . 5.980 3.819 2.216 4.963 . 0 0 "[ . 1 . 2]" 1
1859 1 86 SER HB3 1 87 MET H 5.240 . 6.240 4.236 3.298 4.660 . 0 0 "[ . 1 . 2]" 1
1860 1 86 SER HB2 1 87 MET H 5.240 . 6.240 4.290 2.791 4.641 . 0 0 "[ . 1 . 2]" 1
1861 1 86 SER HA 1 87 MET H 3.380 . 4.380 2.540 2.138 3.380 . 0 0 "[ . 1 . 2]" 1
1862 1 32 ILE HG13 1 59 LEU MD1 4.580 . 5.580 3.945 3.234 4.499 . 0 0 "[ . 1 . 2]" 1
1863 1 32 ILE HG13 1 59 LEU HA 5.500 . 6.500 4.761 3.636 5.341 . 0 0 "[ . 1 . 2]" 1
1864 1 20 LYS HD2 1 22 ILE MD 3.960 . 4.960 3.117 2.229 4.882 . 0 0 "[ . 1 . 2]" 1
1865 1 20 LYS HD2 1 22 ILE HG12 4.230 . 5.230 3.234 2.215 5.222 . 0 0 "[ . 1 . 2]" 1
1866 1 20 LYS HD2 1 21 THR HA 4.960 . 5.960 5.193 4.003 5.965 0.005 8 0 "[ . 1 . 2]" 1
1867 1 20 LYS HD2 1 21 THR H 4.840 . 5.840 3.810 2.378 4.909 . 0 0 "[ . 1 . 2]" 1
1868 1 20 LYS HA 1 21 THR HB 5.500 . 6.500 4.995 4.734 5.553 . 0 0 "[ . 1 . 2]" 1
1869 1 20 LYS HA 1 21 THR HA 4.790 . 5.790 4.406 4.384 4.435 . 0 0 "[ . 1 . 2]" 1
1870 1 20 LYS HA 1 21 THR H 2.530 . 3.530 2.174 2.154 2.226 . 0 0 "[ . 1 . 2]" 1
1871 1 20 LYS HA 1 20 LYS QE 5.250 . 6.250 4.267 3.576 4.914 . 0 0 "[ . 1 . 2]" 1
1872 1 97 ILE HG12 1 97 ILE MG 3.240 . 4.240 2.171 2.134 2.201 . 0 0 "[ . 1 . 2]" 1
1873 1 97 ILE MG 1 101 ILE MD 2.530 . 3.530 2.042 1.886 2.174 . 0 0 "[ . 1 . 2]" 1
1874 1 97 ILE MG 1 100 ALA MB 4.570 . 5.570 4.004 3.684 4.294 . 0 0 "[ . 1 . 2]" 1
1875 1 97 ILE MG 1 98 ARG H 3.370 . 4.370 2.592 2.326 2.890 . 0 0 "[ . 1 . 2]" 1
1876 1 97 ILE MG 1 99 LYS H 4.860 . 5.860 4.506 4.249 4.803 . 0 0 "[ . 1 . 2]" 1
1877 1 97 ILE MG 1 98 ARG HB2 3.960 . 4.960 4.559 4.375 4.887 . 0 0 "[ . 1 . 2]" 1
1878 1 97 ILE MG 1 98 ARG HA 3.380 . 4.380 2.940 2.876 3.047 . 0 0 "[ . 1 . 2]" 1
1879 1 97 ILE HG13 1 97 ILE MG 3.240 . 4.240 3.097 3.035 3.128 . 0 0 "[ . 1 . 2]" 1
1880 1 98 ARG HB3 1 98 ARG QD 3.310 . 4.310 2.499 2.257 2.983 . 0 0 "[ . 1 . 2]" 1
1881 1 99 LYS H 1 101 ILE H 4.210 . 5.210 3.817 3.642 4.047 . 0 0 "[ . 1 . 2]" 1
1882 1 99 LYS H 1 100 ALA MB 4.240 . 5.240 4.183 4.055 4.364 . 0 0 "[ . 1 . 2]" 1
1883 1 99 LYS H 1 102 GLU H 5.220 . 6.220 4.652 4.509 4.929 . 0 0 "[ . 1 . 2]" 1
1884 1 99 LYS H 1 99 LYS HG3 3.210 . 4.210 3.465 1.982 4.318 0.108 15 0 "[ . 1 . 2]" 1
1885 1 98 ARG HG3 1 99 LYS HA 3.930 . 4.930 3.403 3.004 3.619 . 0 0 "[ . 1 . 2]" 1
1886 1 98 ARG HG3 1 99 LYS HB2 3.740 . 4.740 4.353 3.148 4.784 0.044 17 0 "[ . 1 . 2]" 1
1887 1 98 ARG HG3 1 99 LYS H 3.990 . 4.990 2.442 2.112 2.676 . 0 0 "[ . 1 . 2]" 1
1888 1 98 ARG HB2 1 99 LYS H 2.840 . 3.840 3.830 3.714 3.882 0.042 14 0 "[ . 1 . 2]" 1
1889 1 98 ARG HB2 1 98 ARG QD 3.310 . 4.310 2.681 2.235 3.169 . 0 0 "[ . 1 . 2]" 1
1890 1 98 ARG HA 1 101 ILE MD 3.370 . 4.370 2.317 2.013 3.288 . 0 0 "[ . 1 . 2]" 1
1891 1 98 ARG HA 1 100 ALA MB 5.300 . 6.300 5.069 4.818 5.585 . 0 0 "[ . 1 . 2]" 1
1892 1 98 ARG HA 1 101 ILE HB 3.240 . 4.240 2.700 2.258 3.261 . 0 0 "[ . 1 . 2]" 1
1893 1 98 ARG HA 1 98 ARG HG2 3.870 . 4.870 3.668 3.604 3.760 . 0 0 "[ . 1 . 2]" 1
1894 1 98 ARG HA 1 99 LYS HA 4.820 . 5.820 4.732 4.677 4.808 . 0 0 "[ . 1 . 2]" 1
1895 1 98 ARG HA 1 98 ARG HG3 3.870 . 4.870 3.760 3.605 3.851 . 0 0 "[ . 1 . 2]" 1
1896 1 98 ARG HA 1 98 ARG QD 4.130 . 5.130 4.424 4.233 4.546 . 0 0 "[ . 1 . 2]" 1
1897 1 96 LEU HA 1 100 ALA MB 4.340 . 5.340 4.003 3.795 4.174 . 0 0 "[ . 1 . 2]" 1
1898 1 96 LEU HA 1 100 ALA HA 5.500 . 6.500 5.637 5.207 6.195 . 0 0 "[ . 1 . 2]" 1
1899 1 96 LEU HA 1 98 ARG H 4.790 . 5.790 5.066 4.875 5.351 . 0 0 "[ . 1 . 2]" 1
1900 1 96 LEU HA 1 96 LEU MD2 4.300 . 5.300 3.694 3.396 4.106 . 0 0 "[ . 1 . 2]" 1
1901 1 96 LEU HA 1 96 LEU MD1 4.300 . 5.300 3.874 3.415 4.108 . 0 0 "[ . 1 . 2]" 1
1902 1 96 LEU HA 1 99 LYS HG3 3.890 . 4.890 3.545 2.427 4.798 . 0 0 "[ . 1 . 2]" 1
1903 1 96 LEU HA 1 99 LYS HD3 4.770 . 5.770 2.937 1.985 5.802 0.032 6 0 "[ . 1 . 2]" 1
1904 1 96 LEU HA 1 96 LEU QD 3.750 . 4.750 3.299 3.242 3.346 . 0 0 "[ . 1 . 2]" 1
1905 1 97 ILE HB 1 98 ARG H 3.450 . 4.450 2.556 2.409 2.692 . 0 0 "[ . 1 . 2]" 1
1906 1 97 ILE HB 1 97 ILE MD 3.070 . 4.070 2.141 1.979 2.218 . 0 0 "[ . 1 . 2]" 1
1907 1 57 LYS HB3 1 57 LYS HD2 4.060 . 5.060 3.012 2.150 4.020 . 0 0 "[ . 1 . 2]" 1
1908 1 57 LYS HB3 1 57 LYS HD3 4.060 . 5.060 3.032 2.229 3.718 . 0 0 "[ . 1 . 2]" 1
1909 1 39 ILE HG12 1 78 LEU QD 3.760 . 4.760 3.359 2.957 3.862 . 0 0 "[ . 1 . 2]" 1
1910 1 39 ILE HG12 1 80 LEU QD 4.990 . 5.990 5.849 4.913 6.037 0.047 1 0 "[ . 1 . 2]" 1
1911 1 39 ILE HG12 1 42 LYS QG 5.340 . 6.340 4.433 3.743 5.391 . 0 0 "[ . 1 . 2]" 1
1912 1 45 ILE HA 1 45 ILE MD 3.870 . 4.870 2.703 2.039 3.837 . 0 0 "[ . 1 . 2]" 1
1913 1 45 ILE HA 1 45 ILE MG 3.160 . 4.160 2.298 2.096 2.504 . 0 0 "[ . 1 . 2]" 1
1914 1 45 ILE HA 1 46 PRO HD3 3.650 . 4.650 2.219 1.871 2.544 . 0 0 "[ . 1 . 2]" 1
1915 1 45 ILE HA 1 46 PRO HD2 3.650 . 4.650 2.165 1.873 2.633 . 0 0 "[ . 1 . 2]" 1
1916 1 45 ILE HA 1 46 PRO HG3 4.460 . 5.460 4.285 4.078 4.429 . 0 0 "[ . 1 . 2]" 1
1917 1 45 ILE HA 1 46 PRO HG2 4.460 . 5.460 4.269 4.095 4.460 . 0 0 "[ . 1 . 2]" 1
1918 1 45 ILE HA 1 80 LEU QD 4.850 . 5.850 4.664 4.243 5.082 . 0 0 "[ . 1 . 2]" 1
1919 1 45 ILE HA 1 50 GLN QG 5.340 . 6.340 5.094 4.279 6.353 0.013 3 0 "[ . 1 . 2]" 1
1920 1 45 ILE HA 1 46 PRO QD 3.170 . 4.170 1.863 1.823 1.917 . 0 0 "[ . 1 . 2]" 1
1921 1 45 ILE HA 1 46 PRO QB 4.950 . 5.950 4.723 4.710 4.739 . 0 0 "[ . 1 . 2]" 1
1922 1 46 PRO HB3 1 47 PRO HD3 4.370 . 5.370 4.139 3.624 4.399 . 0 0 "[ . 1 . 2]" 1
1923 1 90 ALA HA 1 99 LYS HD3 4.850 . 5.850 4.505 3.560 5.716 . 0 0 "[ . 1 . 2]" 1
1924 1 90 ALA HA 1 99 LYS HB3 5.500 . 6.500 6.070 5.519 6.483 . 0 0 "[ . 1 . 2]" 1
1925 1 90 ALA HA 1 99 LYS HD2 4.850 . 5.850 4.321 3.106 5.824 . 0 0 "[ . 1 . 2]" 1
1926 1 17 LEU HA 1 18 THR MG 4.900 . 5.900 4.834 4.674 4.953 . 0 0 "[ . 1 . 2]" 1
1927 1 17 LEU HA 1 17 LEU HG 3.870 . 4.870 3.366 2.878 3.670 . 0 0 "[ . 1 . 2]" 1
1928 1 17 LEU HA 1 18 THR HA 4.990 . 5.990 4.761 4.600 4.827 . 0 0 "[ . 1 . 2]" 1
1929 1 17 LEU HA 1 17 LEU QD 2.850 . 3.850 1.909 1.837 1.978 . 0 0 "[ . 1 . 2]" 1
1930 1 18 THR HB 1 19 GLY HA2 5.410 . 6.410 5.778 5.605 5.993 . 0 0 "[ . 1 . 2]" 1
1931 1 74 SER HA 1 75 THR MG 5.500 . 6.500 5.374 4.528 5.454 . 0 0 "[ . 1 . 2]" 1
1932 1 74 SER HA 1 75 THR HA 5.090 . 6.090 4.391 4.379 4.412 . 0 0 "[ . 1 . 2]" 1
1933 1 74 SER HA 1 75 THR HB 5.300 . 6.300 4.758 4.605 5.499 . 0 0 "[ . 1 . 2]" 1
1934 1 74 SER HA 1 76 LEU QD 5.440 . 6.440 4.474 3.964 4.904 . 0 0 "[ . 1 . 2]" 1
1935 1 76 LEU HA 1 76 LEU HG 3.740 . 4.740 2.647 2.091 3.583 . 0 0 "[ . 1 . 2]" 1
1936 1 76 LEU HA 1 77 HIS QB 4.570 . 5.570 4.182 3.915 4.577 . 0 0 "[ . 1 . 2]" 1
1937 1 76 LEU HA 1 76 LEU MD1 3.680 . 4.680 2.341 1.965 3.001 . 0 0 "[ . 1 . 2]" 1
1938 1 76 LEU HA 1 76 LEU MD2 3.680 . 4.680 3.094 2.028 3.674 . 0 0 "[ . 1 . 2]" 1
1939 1 76 LEU HA 1 76 LEU QD 3.200 . 4.200 2.244 1.801 2.833 . 0 0 "[ . 1 . 2]" 1
1940 1 15 LYS HE3 1 21 THR MG 4.360 . 5.360 4.746 3.744 5.395 0.035 18 0 "[ . 1 . 2]" 1
1941 1 15 LYS HE3 1 21 THR HA 5.500 . 6.500 5.574 4.016 6.206 . 0 0 "[ . 1 . 2]" 1
1942 1 15 LYS HE2 1 21 THR MG 4.360 . 5.360 4.591 3.462 5.373 0.013 5 0 "[ . 1 . 2]" 1
1943 1 15 LYS HE2 1 21 THR HA 5.500 . 6.500 5.446 3.572 6.203 . 0 0 "[ . 1 . 2]" 1
1944 1 73 GLU HA 1 73 GLU HG3 3.780 . 4.780 3.368 2.780 3.724 . 0 0 "[ . 1 . 2]" 1
1945 1 73 GLU HA 1 73 GLU HG2 3.780 . 4.780 3.071 2.438 3.976 . 0 0 "[ . 1 . 2]" 1
1946 1 73 GLU HA 1 74 SER HA 4.500 . 5.500 4.503 4.398 4.804 . 0 0 "[ . 1 . 2]" 1
1947 1 73 GLU HA 1 74 SER QB 5.070 . 6.070 4.882 4.553 5.316 . 0 0 "[ . 1 . 2]" 1
1948 1 72 ARG HA 1 72 ARG QD 4.420 . 5.420 4.185 3.302 4.468 . 0 0 "[ . 1 . 2]" 1
1949 1 72 ARG HA 1 73 GLU HA 5.500 . 6.500 4.698 4.598 4.735 . 0 0 "[ . 1 . 2]" 1
1950 1 37 SER HB3 1 47 PRO HG2 4.450 . 5.450 4.542 3.840 5.476 0.026 19 0 "[ . 1 . 2]" 1
1951 1 52 LEU MD2 1 78 LEU HA 4.550 . 5.550 2.883 2.074 4.152 . 0 0 "[ . 1 . 2]" 1
1952 1 52 LEU MD2 1 78 LEU HB3 3.810 . 4.810 4.306 3.709 4.838 0.028 13 0 "[ . 1 . 2]" 1
1953 1 103 LEU HA 1 103 LEU HG 3.700 . 4.700 3.404 2.585 3.647 . 0 0 "[ . 1 . 2]" 1
1954 1 103 LEU HA 1 103 LEU MD2 3.260 . 4.260 3.159 1.932 4.118 . 0 0 "[ . 1 . 2]" 1
1955 1 103 LEU HA 1 104 SER HA 4.910 . 5.910 4.556 4.535 4.601 . 0 0 "[ . 1 . 2]" 1
1956 1 103 LEU HA 1 103 LEU MD1 3.260 . 4.260 3.118 2.038 3.791 . 0 0 "[ . 1 . 2]" 1
1957 1 103 LEU HA 1 103 LEU QD 2.770 . 3.770 2.635 1.830 3.412 . 0 0 "[ . 1 . 2]" 1
1958 1 103 LEU HA 1 104 SER QB 4.560 . 5.560 5.212 4.963 5.531 . 0 0 "[ . 1 . 2]" 1
1959 1 72 ARG HG2 1 73 GLU HG3 4.340 . 5.340 4.329 3.026 5.357 0.017 14 0 "[ . 1 . 2]" 1
1960 1 72 ARG HG2 1 73 GLU HG2 4.340 . 5.340 4.506 2.752 5.356 0.016 18 0 "[ . 1 . 2]" 1
1961 1 72 ARG HG3 1 73 GLU HG3 4.340 . 5.340 3.188 2.048 4.367 . 0 0 "[ . 1 . 2]" 1
1962 1 72 ARG HG3 1 73 GLU HG2 4.340 . 5.340 3.285 2.057 4.630 . 0 0 "[ . 1 . 2]" 1
1963 1 59 LEU HA 1 59 LEU MD2 4.320 . 5.320 2.143 2.040 2.313 . 0 0 "[ . 1 . 2]" 1
1964 1 59 LEU HA 1 59 LEU MD1 4.320 . 5.320 3.835 3.711 3.938 . 0 0 "[ . 1 . 2]" 1
1965 1 10 PHE HA 1 26 VAL MG2 4.920 . 5.920 5.852 5.600 5.988 0.068 12 0 "[ . 1 . 2]" 1
1966 1 10 PHE HA 1 72 ARG QD 3.500 . 4.500 3.208 2.386 4.540 0.040 10 0 "[ . 1 . 2]" 1
1967 1 10 PHE HA 1 12 ILE MG 5.490 . 6.490 5.464 5.036 5.684 . 0 0 "[ . 1 . 2]" 1
1968 1 10 PHE HA 1 72 ARG HB3 4.510 . 5.510 3.281 2.419 4.035 . 0 0 "[ . 1 . 2]" 1
1969 1 10 PHE HA 1 72 ARG HB2 4.510 . 5.510 4.031 3.120 4.970 . 0 0 "[ . 1 . 2]" 1
1970 1 10 PHE HA 1 11 GLN HA 4.860 . 5.860 4.384 4.246 4.417 . 0 0 "[ . 1 . 2]" 1
1971 1 10 PHE HA 1 72 ARG HA 4.620 . 5.620 5.194 4.495 5.649 0.029 11 0 "[ . 1 . 2]" 1
1972 1 10 PHE HA 1 11 GLN QG 5.240 . 6.240 3.838 3.315 5.150 . 0 0 "[ . 1 . 2]" 1
1973 1 10 PHE HA 1 72 ARG QG 4.380 . 5.380 4.534 3.324 5.259 . 0 0 "[ . 1 . 2]" 1
1974 1 95 GLU HB3 1 96 LEU HA 4.840 . 5.840 5.633 4.898 5.757 . 0 0 "[ . 1 . 2]" 1
1975 1 104 SER HA 1 105 LEU MD2 5.500 . 6.500 4.731 4.039 6.433 . 0 0 "[ . 1 . 2]" 1
1976 1 104 SER HA 1 105 LEU MD1 5.500 . 6.500 5.714 4.358 6.130 . 0 0 "[ . 1 . 2]" 1
1977 1 104 SER HA 1 107 GLU HB3 4.680 . 5.680 4.070 2.209 5.716 0.036 14 0 "[ . 1 . 2]" 1
1978 1 104 SER HA 1 107 GLU HB2 4.680 . 5.680 3.658 2.224 5.127 . 0 0 "[ . 1 . 2]" 1
1979 1 104 SER HA 1 106 LYS HG2 5.500 . 6.500 5.790 4.728 6.535 0.035 17 0 "[ . 1 . 2]" 1
1980 1 104 SER HA 1 107 GLU QB 4.040 . 5.040 3.294 2.167 4.674 . 0 0 "[ . 1 . 2]" 1
1981 1 42 LYS HA 1 43 GLU HA 4.770 . 5.770 4.560 4.550 4.573 . 0 0 "[ . 1 . 2]" 1
1982 1 42 LYS HA 1 43 GLU HG3 5.400 . 6.400 5.349 4.554 6.291 . 0 0 "[ . 1 . 2]" 1
1983 1 42 LYS HA 1 42 LYS QG 3.490 . 4.490 2.716 2.337 3.184 . 0 0 "[ . 1 . 2]" 1
1984 1 42 LYS HA 1 42 LYS QE 5.040 . 6.040 3.956 3.187 4.374 . 0 0 "[ . 1 . 2]" 1
1985 1 94 GLU HA 1 95 GLU HA 5.020 . 6.020 4.775 4.697 4.891 . 0 0 "[ . 1 . 2]" 1
1986 1 94 GLU HA 1 96 LEU QD 3.970 . 4.970 2.809 2.470 3.285 . 0 0 "[ . 1 . 2]" 1
1987 1 94 GLU HA 1 94 GLU QG 3.380 . 4.380 2.470 1.952 3.443 . 0 0 "[ . 1 . 2]" 1
1988 1 97 ILE HG13 1 101 ILE MD 4.110 . 5.110 5.110 5.001 5.170 0.060 16 0 "[ . 1 . 2]" 1
1989 1 51 ARG HG2 1 53 ILE MD 3.760 . 4.760 3.684 1.932 4.808 0.048 16 0 "[ . 1 . 2]" 1
1990 1 51 ARG HG3 1 53 ILE MD 3.760 . 4.760 3.383 1.897 4.702 . 0 0 "[ . 1 . 2]" 1
1991 1 45 ILE HG12 1 80 LEU MD2 3.780 . 4.780 4.095 3.515 4.731 . 0 0 "[ . 1 . 2]" 1
1992 1 45 ILE HG12 1 80 LEU MD1 3.780 . 4.780 4.499 3.965 4.825 0.045 5 0 "[ . 1 . 2]" 1
1993 1 45 ILE HG12 1 80 LEU QD 3.170 . 4.170 3.745 3.432 4.086 . 0 0 "[ . 1 . 2]" 1
1994 1 50 GLN HA 1 80 LEU MD2 4.890 . 5.890 3.475 2.191 5.615 . 0 0 "[ . 1 . 2]" 1
1995 1 50 GLN HA 1 80 LEU MD1 4.890 . 5.890 4.927 2.458 5.906 0.016 2 0 "[ . 1 . 2]" 1
1996 1 50 GLN HA 1 78 LEU QD 4.490 . 5.490 3.554 2.883 4.243 . 0 0 "[ . 1 . 2]" 1
1997 1 50 GLN HA 1 80 LEU QD 3.810 . 4.810 3.212 2.062 3.980 . 0 0 "[ . 1 . 2]" 1
1998 1 89 GLY HA3 1 90 ALA MB 4.940 . 5.940 4.277 4.007 4.611 . 0 0 "[ . 1 . 2]" 1
1999 1 89 GLY HA2 1 90 ALA MB 4.940 . 5.940 4.637 4.097 5.005 . 0 0 "[ . 1 . 2]" 1
2000 1 13 PHE HB2 1 75 THR MG 3.980 . 4.980 3.971 3.293 5.003 0.023 20 0 "[ . 1 . 2]" 1
2001 1 13 PHE HB3 1 75 THR MG 3.980 . 4.980 3.641 3.088 4.226 . 0 0 "[ . 1 . 2]" 1
2002 1 52 LEU MD1 1 78 LEU HA 4.550 . 5.550 2.925 1.990 4.150 . 0 0 "[ . 1 . 2]" 1
2003 1 52 LEU MD1 1 78 LEU HB3 3.810 . 4.810 4.416 3.640 4.847 0.037 7 0 "[ . 1 . 2]" 1
2004 1 15 LYS HG3 1 21 THR MG 4.840 . 5.840 4.676 3.886 5.502 . 0 0 "[ . 1 . 2]" 1
2005 1 15 LYS HG3 1 21 THR HA 4.710 . 5.710 3.827 3.517 4.672 . 0 0 "[ . 1 . 2]" 1
2006 1 15 LYS HG3 1 75 THR MG 5.350 . 6.350 5.046 4.540 5.489 . 0 0 "[ . 1 . 2]" 1
2007 1 15 LYS QE 1 15 LYS HG3 3.620 . 4.620 3.310 2.395 3.484 . 0 0 "[ . 1 . 2]" 1
2008 1 55 ALA MB 1 105 LEU MD1 3.990 . 4.990 3.527 3.202 4.852 . 0 0 "[ . 1 . 2]" 1
2009 1 37 SER HB2 1 47 PRO HG2 4.450 . 5.450 4.880 3.809 5.468 0.018 14 0 "[ . 1 . 2]" 1
2010 1 46 PRO HB2 1 47 PRO HD3 4.370 . 5.370 4.487 4.080 4.711 . 0 0 "[ . 1 . 2]" 1
2011 1 11 GLN QG 1 24 LEU H 4.920 . 5.920 4.897 4.257 5.952 0.032 16 0 "[ . 1 . 2]" 1
2012 1 11 GLN QG 1 23 THR MG 3.500 . 4.500 2.935 1.957 4.368 . 0 0 "[ . 1 . 2]" 1
2013 1 11 GLN QG 1 26 VAL H 5.340 . 6.340 4.541 3.654 5.638 . 0 0 "[ . 1 . 2]" 1
2014 1 11 GLN QG 1 12 ILE H 3.850 . 4.850 4.180 3.280 4.529 . 0 0 "[ . 1 . 2]" 1
2015 1 72 ARG QG 1 73 GLU H 4.330 . 5.330 2.020 1.688 3.322 . 0 0 "[ . 1 . 2]" 1
2016 1 72 ARG QG 1 73 GLU HA 5.340 . 6.340 4.057 3.404 5.516 . 0 0 "[ . 1 . 2]" 1
2017 1 72 ARG QG 1 73 GLU QG 3.390 . 4.390 2.465 2.026 3.537 . 0 0 "[ . 1 . 2]" 1
2018 1 24 LEU QD 1 26 VAL MG1 3.390 . 4.390 2.252 1.941 3.217 . 0 0 "[ . 1 . 2]" 1
2019 1 24 LEU QD 1 39 ILE H 4.490 . 5.490 3.553 2.836 5.044 . 0 0 "[ . 1 . 2]" 1
2020 1 24 LEU QD 1 39 ILE HB 4.450 . 5.450 3.557 2.877 4.897 . 0 0 "[ . 1 . 2]" 1
2021 1 24 LEU QD 1 39 ILE HA 3.650 . 4.650 3.099 2.010 3.874 . 0 0 "[ . 1 . 2]" 1
2022 1 24 LEU QD 1 25 GLU H 4.190 . 5.190 4.212 3.747 4.338 . 0 0 "[ . 1 . 2]" 1
2023 1 24 LEU QD 1 39 ILE HG12 4.090 . 5.090 2.515 2.028 3.144 . 0 0 "[ . 1 . 2]" 1
2024 1 24 LEU QD 1 42 LYS QB 4.550 . 5.550 3.851 3.033 4.384 . 0 0 "[ . 1 . 2]" 1
2025 1 24 LEU QD 1 42 LYS QG 3.540 . 4.540 3.130 1.958 4.053 . 0 0 "[ . 1 . 2]" 1
2026 1 24 LEU QD 1 42 LYS QE 4.480 . 5.480 3.738 2.321 4.841 . 0 0 "[ . 1 . 2]" 1
2027 1 76 LEU QD 1 77 HIS QB 5.440 . 6.440 4.763 3.708 5.496 . 0 0 "[ . 1 . 2]" 1
2028 1 71 GLN QB 1 72 ARG H 3.050 . 4.050 2.029 1.663 2.679 . 0 0 "[ . 1 . 2]" 1
2029 1 71 GLN QB 1 72 ARG QG 3.710 . 4.710 2.831 2.458 3.368 . 0 0 "[ . 1 . 2]" 1
2030 1 74 SER QB 1 75 THR H 3.470 . 4.470 3.109 2.697 3.631 . 0 0 "[ . 1 . 2]" 1
2031 1 74 SER QB 1 76 LEU QD 4.080 . 5.080 2.678 2.276 3.224 . 0 0 "[ . 1 . 2]" 1
2032 1 35 VAL QG 1 76 LEU HB2 4.440 . 5.440 4.338 4.048 4.772 . 0 0 "[ . 1 . 2]" 1
2033 1 35 VAL QG 1 76 LEU HG 3.520 . 4.520 3.969 3.022 4.469 . 0 0 "[ . 1 . 2]" 1
2034 1 35 VAL QG 1 52 LEU HG 3.900 . 4.900 3.381 2.390 4.165 . 0 0 "[ . 1 . 2]" 1
2035 1 35 VAL QG 1 38 LYS H 5.430 . 6.430 4.638 4.544 4.827 . 0 0 "[ . 1 . 2]" 1
2036 1 35 VAL QG 1 37 SER H 5.240 . 6.240 4.898 4.286 5.025 . 0 0 "[ . 1 . 2]" 1
2037 1 35 VAL QG 1 65 LEU MD2 3.390 . 4.390 2.792 2.412 3.350 . 0 0 "[ . 1 . 2]" 1
2038 1 35 VAL QG 1 65 LEU H 5.240 . 6.240 4.963 4.146 5.518 . 0 0 "[ . 1 . 2]" 1
2039 1 35 VAL QG 1 36 LYS H 4.010 . 5.010 3.058 1.931 3.205 . 0 0 "[ . 1 . 2]" 1
2040 1 35 VAL QG 1 65 LEU HG 4.170 . 5.170 2.931 2.301 3.342 . 0 0 "[ . 1 . 2]" 1
2041 1 35 VAL QG 1 39 ILE HG12 5.440 . 6.440 4.485 3.869 4.846 . 0 0 "[ . 1 . 2]" 1
2042 1 35 VAL QG 1 76 LEU QD 3.530 . 4.530 2.566 1.857 3.740 . 0 0 "[ . 1 . 2]" 1
2043 1 35 VAL QG 1 52 LEU QD 3.240 . 4.240 2.254 1.811 3.062 . 0 0 "[ . 1 . 2]" 1
2044 1 13 PHE QB 1 22 ILE H 4.600 . 5.600 4.579 4.119 5.633 0.033 20 0 "[ . 1 . 2]" 1
2045 1 13 PHE QB 1 21 THR MG 3.250 . 4.250 3.378 2.766 4.285 0.035 20 0 "[ . 1 . 2]" 1
2046 1 13 PHE QB 1 23 THR HA 4.820 . 5.820 4.523 4.030 5.015 . 0 0 "[ . 1 . 2]" 1
2047 1 13 PHE QB 1 15 LYS H 4.570 . 5.570 5.245 4.694 5.631 0.061 20 0 "[ . 1 . 2]" 1
2048 1 13 PHE QB 1 14 ALA H 3.510 . 4.510 3.189 2.950 3.854 . 0 0 "[ . 1 . 2]" 1
2049 1 13 PHE QB 1 75 THR MG 3.390 . 4.390 3.331 2.904 3.883 . 0 0 "[ . 1 . 2]" 1
2050 1 13 PHE QB 1 76 LEU H 4.920 . 5.920 3.505 3.217 3.790 . 0 0 "[ . 1 . 2]" 1
2051 1 13 PHE QB 1 75 THR HA 4.270 . 5.270 2.611 2.202 2.941 . 0 0 "[ . 1 . 2]" 1
2052 1 13 PHE QB 1 24 LEU H 5.340 . 6.340 5.651 5.258 6.161 . 0 0 "[ . 1 . 2]" 1
2053 1 52 LEU QD 1 78 LEU HG 5.000 . 6.000 2.818 2.045 4.121 . 0 0 "[ . 1 . 2]" 1
2054 1 52 LEU QD 1 78 LEU HA 3.310 . 4.310 2.449 1.942 3.471 . 0 0 "[ . 1 . 2]" 1
2055 1 52 LEU QD 1 76 LEU HB2 4.100 . 5.100 3.931 3.626 4.346 . 0 0 "[ . 1 . 2]" 1
2056 1 52 LEU QD 1 76 LEU HG 3.780 . 4.780 3.134 2.469 3.870 . 0 0 "[ . 1 . 2]" 1
2057 1 52 LEU QD 1 78 LEU H 4.250 . 5.250 3.903 3.526 4.915 . 0 0 "[ . 1 . 2]" 1
2058 1 52 LEU QD 1 53 ILE H 3.560 . 4.560 3.130 2.462 4.223 . 0 0 "[ . 1 . 2]" 1
2059 1 52 LEU QD 1 78 LEU HB3 3.320 . 4.320 3.839 3.395 4.303 . 0 0 "[ . 1 . 2]" 1
2060 1 52 LEU QD 1 59 LEU MD1 3.510 . 4.510 2.530 1.973 3.035 . 0 0 "[ . 1 . 2]" 1
2061 1 52 LEU QD 1 77 HIS HA 4.690 . 5.690 4.452 4.014 5.536 . 0 0 "[ . 1 . 2]" 1
2062 1 52 LEU QD 1 76 LEU HB3 4.100 . 5.100 2.611 2.183 3.096 . 0 0 "[ . 1 . 2]" 1
2063 1 52 LEU QD 1 76 LEU HA 4.380 . 5.380 3.966 3.204 4.676 . 0 0 "[ . 1 . 2]" 1
2064 1 52 LEU QD 1 76 LEU QD 3.030 . 4.030 2.177 1.901 2.714 . 0 0 "[ . 1 . 2]" 1
2065 1 78 LEU QD 1 79 VAL H 4.800 . 5.800 2.928 2.295 3.891 . 0 0 "[ . 1 . 2]" 1
2066 1 78 LEU QD 1 80 LEU H 5.440 . 6.440 3.621 2.831 4.152 . 0 0 "[ . 1 . 2]" 1
2067 1 78 LEU QD 1 80 LEU HG 5.280 . 6.280 2.877 1.879 4.237 . 0 0 "[ . 1 . 2]" 1
2068 1 78 LEU QD 1 80 LEU QD 3.430 . 4.430 2.198 1.813 3.014 . 0 0 "[ . 1 . 2]" 1
2069 1 15 LYS QE 1 21 THR MG 3.760 . 4.760 4.044 3.318 4.520 . 0 0 "[ . 1 . 2]" 1
2070 1 79 VAL QG 1 80 LEU H 3.580 . 4.580 2.910 2.007 3.554 . 0 0 "[ . 1 . 2]" 1
2071 1 79 VAL QG 1 96 LEU HB3 3.320 . 4.320 3.863 3.240 4.364 0.044 14 0 "[ . 1 . 2]" 1
2072 1 79 VAL QG 1 81 ARG HA 4.780 . 5.780 4.169 3.405 5.236 . 0 0 "[ . 1 . 2]" 1
2073 1 79 VAL QG 1 100 ALA MB 2.700 . 3.700 2.234 1.789 2.966 . 0 0 "[ . 1 . 2]" 1
2074 1 79 VAL QG 1 97 ILE HA 3.620 . 4.620 2.712 2.246 3.179 . 0 0 "[ . 1 . 2]" 1
2075 1 79 VAL QG 1 80 LEU HA 5.060 . 6.060 3.786 3.267 4.560 . 0 0 "[ . 1 . 2]" 1
2076 1 79 VAL QG 1 91 ALA MB 3.960 . 4.960 3.987 3.260 4.876 . 0 0 "[ . 1 . 2]" 1
2077 1 79 VAL QG 1 96 LEU HA 4.070 . 5.070 3.949 3.216 4.180 . 0 0 "[ . 1 . 2]" 1
2078 1 79 VAL QG 1 96 LEU QD 2.660 . 3.660 1.901 1.641 2.457 . 0 0 "[ . 1 . 2]" 1
2079 1 80 LEU QD 1 81 ARG H 3.480 . 4.480 3.102 2.002 4.033 . 0 0 "[ . 1 . 2]" 1
2080 1 17 LEU QD 1 80 LEU H 5.190 . 6.190 4.441 2.757 5.610 . 0 0 "[ . 1 . 2]" 1
2081 1 17 LEU QD 1 18 THR MG 4.170 . 5.170 3.478 2.381 4.364 . 0 0 "[ . 1 . 2]" 1
2082 1 17 LEU QD 1 79 VAL HA 5.190 . 6.190 3.925 2.856 5.110 . 0 0 "[ . 1 . 2]" 1
2083 1 17 LEU QD 1 90 ALA MB 4.450 . 5.450 3.094 1.848 4.216 . 0 0 "[ . 1 . 2]" 1
2084 1 17 LEU QD 1 105 LEU MD2 4.730 . 5.730 4.844 4.104 5.759 0.029 5 0 "[ . 1 . 2]" 1
2085 1 17 LEU QD 1 19 GLY H 5.140 . 6.140 4.369 3.985 4.948 . 0 0 "[ . 1 . 2]" 1
2086 1 17 LEU QD 1 18 THR H 4.670 . 5.670 3.546 2.732 4.279 . 0 0 "[ . 1 . 2]" 1
2087 1 17 LEU QD 1 100 ALA MB 3.000 . 4.000 1.975 1.833 2.172 . 0 0 "[ . 1 . 2]" 1
2088 1 17 LEU QD 1 99 LYS HG2 3.640 . 4.640 3.378 2.208 4.655 0.015 20 0 "[ . 1 . 2]" 1
2089 1 17 LEU QD 1 103 LEU HG 3.820 . 4.820 3.518 2.564 4.587 . 0 0 "[ . 1 . 2]" 1
2090 1 17 LEU QD 1 103 LEU HB3 3.800 . 4.800 3.925 2.851 4.745 . 0 0 "[ . 1 . 2]" 1
2091 1 17 LEU QD 1 100 ALA HA 3.340 . 4.340 2.262 1.927 2.518 . 0 0 "[ . 1 . 2]" 1
2092 1 17 LEU QD 1 100 ALA H 4.540 . 5.540 3.152 2.368 3.818 . 0 0 "[ . 1 . 2]" 1
2093 1 17 LEU QD 1 18 THR HA 4.420 . 5.420 3.575 2.560 4.716 . 0 0 "[ . 1 . 2]" 1
2094 1 17 LEU QD 1 99 LYS HG3 3.640 . 4.640 2.736 1.974 4.723 0.083 19 0 "[ . 1 . 2]" 1
2095 1 17 LEU QD 1 91 ALA HA 5.440 . 6.440 3.679 2.542 5.195 . 0 0 "[ . 1 . 2]" 1
2096 1 17 LEU QD 1 99 LYS HB3 5.020 . 6.020 4.155 2.363 5.264 . 0 0 "[ . 1 . 2]" 1
2097 1 17 LEU QD 1 99 LYS HD2 4.020 . 5.020 3.911 2.632 4.516 . 0 0 "[ . 1 . 2]" 1
2098 1 17 LEU QD 1 99 LYS HB2 5.020 . 6.020 3.795 2.197 4.724 . 0 0 "[ . 1 . 2]" 1
2099 1 17 LEU QD 1 99 LYS H 5.330 . 6.330 4.608 3.871 5.318 . 0 0 "[ . 1 . 2]" 1
2100 1 17 LEU QD 1 96 LEU HA 3.770 . 4.770 3.001 1.877 4.260 . 0 0 "[ . 1 . 2]" 1
2101 1 17 LEU QD 1 90 ALA HA 5.140 . 6.140 4.939 3.999 6.052 . 0 0 "[ . 1 . 2]" 1
2102 1 17 LEU QD 1 103 LEU HA 5.120 . 6.120 5.610 4.700 6.160 0.040 9 0 "[ . 1 . 2]" 1
2103 1 17 LEU QD 1 79 VAL QG 3.450 . 4.450 2.649 1.726 3.798 . 0 0 "[ . 1 . 2]" 1
2104 1 17 LEU QD 1 103 LEU QD 3.100 . 4.100 2.275 1.768 3.258 . 0 0 "[ . 1 . 2]" 1
2105 1 103 LEU QD 1 104 SER H 4.540 . 5.540 2.739 1.725 3.712 . 0 0 "[ . 1 . 2]" 1
2106 1 103 LEU QD 1 104 SER QB 4.490 . 5.490 3.060 1.814 4.773 . 0 0 "[ . 1 . 2]" 1
2107 1 20 LYS QG 1 22 ILE HG12 5.220 . 6.220 3.979 2.464 5.150 . 0 0 "[ . 1 . 2]" 1
2108 1 20 LYS QG 1 21 THR H 3.640 . 4.640 2.978 2.389 3.532 . 0 0 "[ . 1 . 2]" 1
2109 1 20 LYS QE 1 20 LYS QG 3.030 . 4.030 2.294 2.105 2.856 . 0 0 "[ . 1 . 2]" 1
2110 1 20 LYS QE 1 22 ILE MD 4.050 . 5.050 3.636 2.277 4.417 . 0 0 "[ . 1 . 2]" 1
2111 1 20 LYS QE 1 22 ILE MG 4.530 . 5.530 4.480 3.342 5.527 . 0 0 "[ . 1 . 2]" 1
2112 1 20 LYS QE 1 22 ILE HG12 4.340 . 5.340 3.336 2.162 4.529 . 0 0 "[ . 1 . 2]" 1
2113 1 42 LYS QB 1 43 GLU H 3.650 . 4.650 2.634 2.549 2.731 . 0 0 "[ . 1 . 2]" 1
2114 1 42 LYS QB 1 42 LYS QE 3.440 . 4.440 3.285 2.041 3.884 . 0 0 "[ . 1 . 2]" 1
2115 1 42 LYS QE 1 42 LYS QG 2.820 . 3.820 2.183 2.032 2.331 . 0 0 "[ . 1 . 2]" 1
2116 1 30 ASP QB 1 65 LEU MD1 3.650 . 4.650 2.039 1.868 2.288 . 0 0 "[ . 1 . 2]" 1
2117 1 30 ASP QB 1 34 ASN HB3 4.070 . 5.070 3.322 2.612 4.287 . 0 0 "[ . 1 . 2]" 1
2118 1 30 ASP QB 1 34 ASN H 4.880 . 5.880 5.044 4.607 5.670 . 0 0 "[ . 1 . 2]" 1
2119 1 30 ASP QB 1 34 ASN HB2 4.070 . 5.070 3.867 2.756 5.022 . 0 0 "[ . 1 . 2]" 1
2120 1 30 ASP QB 1 31 THR H 3.350 . 4.350 2.966 2.625 3.546 . 0 0 "[ . 1 . 2]" 1
2121 1 30 ASP QB 1 65 LEU HA 5.340 . 6.340 5.295 4.910 5.771 . 0 0 "[ . 1 . 2]" 1
2122 1 30 ASP QB 1 35 VAL QG 3.600 . 4.600 2.895 2.451 3.796 . 0 0 "[ . 1 . 2]" 1
2123 1 28 SER QB 1 29 SER HA 4.970 . 5.970 4.386 4.114 4.604 . 0 0 "[ . 1 . 2]" 1
2124 1 28 SER QB 1 29 SER H 4.250 . 5.250 3.289 2.945 3.743 . 0 0 "[ . 1 . 2]" 1
2125 1 28 SER QB 1 66 SER HA 3.950 . 4.950 4.381 3.912 4.951 0.001 13 0 "[ . 1 . 2]" 1
2126 1 28 SER QB 1 66 SER QB 3.460 . 4.460 3.831 3.377 4.174 . 0 0 "[ . 1 . 2]" 1
2127 1 66 SER QB 1 67 ASP H 3.570 . 4.570 3.470 3.215 3.776 . 0 0 "[ . 1 . 2]" 1
2128 1 66 SER QB 1 68 TYR H 5.050 . 6.050 5.298 4.637 5.660 . 0 0 "[ . 1 . 2]" 1
2129 1 66 SER QB 1 67 ASP QB 5.180 . 6.180 4.854 4.532 5.153 . 0 0 "[ . 1 . 2]" 1
2130 1 29 SER QB 1 64 THR HB 4.750 . 5.750 3.766 3.168 4.670 . 0 0 "[ . 1 . 2]" 1
2131 1 29 SER QB 1 64 THR MG 4.340 . 5.340 4.069 3.705 4.770 . 0 0 "[ . 1 . 2]" 1
2132 1 29 SER QB 1 30 ASP H 3.590 . 4.590 3.722 3.457 3.937 . 0 0 "[ . 1 . 2]" 1
2133 1 33 ASP QB 1 34 ASN H 3.110 . 4.110 2.504 2.341 3.155 . 0 0 "[ . 1 . 2]" 1
2134 1 52 LEU QB 1 78 LEU HA 4.320 . 5.320 4.313 3.683 4.703 . 0 0 "[ . 1 . 2]" 1
2135 1 52 LEU QB 1 53 ILE H 3.550 . 4.550 3.537 3.236 3.769 . 0 0 "[ . 1 . 2]" 1
2136 1 52 LEU QB 1 53 ILE HA 4.610 . 5.610 4.242 4.180 4.304 . 0 0 "[ . 1 . 2]" 1
2137 1 52 LEU QB 1 59 LEU MD1 3.530 . 4.530 2.069 1.860 2.476 . 0 0 "[ . 1 . 2]" 1
2138 1 52 LEU QB 1 76 LEU QD 4.300 . 5.300 3.864 2.888 4.216 . 0 0 "[ . 1 . 2]" 1
2139 1 59 LEU QB 1 60 GLU H 4.310 . 5.310 2.879 1.582 3.458 . 0 0 "[ . 1 . 2]" 1
2140 1 36 LYS QB 1 37 SER H 3.720 . 4.720 2.131 2.018 2.320 . 0 0 "[ . 1 . 2]" 1
2141 1 36 LYS QB 1 47 PRO HG3 5.300 . 6.300 3.896 3.567 4.221 . 0 0 "[ . 1 . 2]" 1
2142 1 36 LYS QB 1 50 GLN H 4.710 . 5.710 4.615 4.195 5.243 . 0 0 "[ . 1 . 2]" 1
2143 1 36 LYS QB 1 47 PRO HA 3.810 . 4.810 2.178 1.900 2.924 . 0 0 "[ . 1 . 2]" 1
2144 1 37 SER QB 1 47 PRO HD2 4.800 . 5.800 5.144 4.618 5.822 0.022 4 0 "[ . 1 . 2]" 1
2145 1 37 SER QB 1 40 GLN HB2 5.310 . 6.310 5.815 5.506 6.192 . 0 0 "[ . 1 . 2]" 1
2146 1 37 SER QB 1 40 GLN HG2 5.250 . 6.250 3.915 3.336 4.782 . 0 0 "[ . 1 . 2]" 1
2147 1 37 SER QB 1 47 PRO HB3 5.340 . 6.340 3.404 2.835 4.057 . 0 0 "[ . 1 . 2]" 1
2148 1 37 SER QB 1 47 PRO HG3 5.340 . 6.340 2.745 2.329 3.491 . 0 0 "[ . 1 . 2]" 1
2149 1 37 SER QB 1 40 GLN HG3 5.250 . 6.250 4.799 3.986 5.903 . 0 0 "[ . 1 . 2]" 1
2150 1 50 GLN QG 1 78 LEU QD 4.690 . 5.690 2.905 2.017 3.910 . 0 0 "[ . 1 . 2]" 1
2151 1 50 GLN QG 1 80 LEU QD 2.940 . 3.940 2.761 1.903 3.858 . 0 0 "[ . 1 . 2]" 1
2152 1 46 PRO QD 1 49 GLN H 5.350 . 6.350 4.387 3.774 5.079 . 0 0 "[ . 1 . 2]" 1
2153 1 46 PRO QD 1 49 GLN HG3 5.350 . 6.350 4.699 4.006 5.441 . 0 0 "[ . 1 . 2]" 1
2154 1 46 PRO QB 1 48 ASP H 3.900 . 4.900 2.886 2.536 3.130 . 0 0 "[ . 1 . 2]" 1
2155 1 46 PRO QB 1 47 PRO HD3 3.710 . 4.710 3.820 3.391 4.042 . 0 0 "[ . 1 . 2]" 1
2156 1 46 PRO QG 1 49 GLN H 4.200 . 5.200 3.607 3.019 4.510 . 0 0 "[ . 1 . 2]" 1
2157 1 81 ARG QB 1 93 GLU HB3 4.870 . 5.870 4.976 4.061 5.879 0.009 14 0 "[ . 1 . 2]" 1
2158 1 81 ARG QB 1 96 LEU QD 3.780 . 4.780 3.180 2.194 3.775 . 0 0 "[ . 1 . 2]" 1
2159 1 81 ARG QG 1 82 LEU H 3.400 . 4.400 3.149 2.191 3.836 . 0 0 "[ . 1 . 2]" 1
2160 1 81 ARG QG 1 93 GLU HA 3.770 . 4.770 3.194 2.096 4.640 . 0 0 "[ . 1 . 2]" 1
2161 1 81 ARG QG 1 82 LEU HA 5.090 . 6.090 4.897 3.619 5.802 . 0 0 "[ . 1 . 2]" 1
2162 1 81 ARG QG 1 96 LEU QD 3.530 . 4.530 2.825 1.876 4.174 . 0 0 "[ . 1 . 2]" 1
2163 1 83 ARG QB 1 83 ARG QD 2.630 . 3.630 2.172 2.055 2.352 . 0 0 "[ . 1 . 2]" 1
2164 1 51 ARG QB 1 53 ILE MD 3.530 . 4.530 2.642 2.159 3.314 . 0 0 "[ . 1 . 2]" 1
2165 1 51 ARG QB 1 52 LEU H 3.370 . 4.370 2.755 2.191 3.651 . 0 0 "[ . 1 . 2]" 1
2166 1 51 ARG QB 1 97 ILE MD 3.650 . 4.650 3.792 2.779 4.396 . 0 0 "[ . 1 . 2]" 1
2167 1 51 ARG QB 1 51 ARG QD 3.210 . 4.210 2.191 2.040 2.385 . 0 0 "[ . 1 . 2]" 1
2168 1 51 ARG QG 1 53 ILE MD 3.240 . 4.240 3.012 1.856 4.225 . 0 0 "[ . 1 . 2]" 1
2169 1 51 ARG QG 1 79 VAL H 3.850 . 4.850 4.227 3.151 4.856 0.006 7 0 "[ . 1 . 2]" 1
2170 1 51 ARG QG 1 79 VAL HB 4.480 . 5.480 3.732 1.884 5.298 . 0 0 "[ . 1 . 2]" 1
2171 1 51 ARG QG 1 79 VAL HA 5.340 . 6.340 5.454 4.209 6.368 0.028 8 0 "[ . 1 . 2]" 1
2172 1 51 ARG QG 1 97 ILE MD 2.970 . 3.970 3.364 2.198 4.023 0.053 7 0 "[ . 1 . 2]" 1
2173 1 51 ARG QG 1 79 VAL QG 3.390 . 4.390 2.490 1.958 3.546 . 0 0 "[ . 1 . 2]" 1
2174 1 51 ARG QG 1 96 LEU QD 3.700 . 4.700 3.453 2.770 4.179 . 0 0 "[ . 1 . 2]" 1
2175 1 51 ARG QD 1 81 ARG HA 5.290 . 6.290 5.489 3.585 6.331 0.041 2 0 "[ . 1 . 2]" 1
2176 1 51 ARG QD 1 97 ILE MD 3.560 . 4.560 2.820 1.908 4.548 . 0 0 "[ . 1 . 2]" 1
2177 1 51 ARG QD 1 79 VAL QG 3.860 . 4.860 3.105 2.100 4.376 . 0 0 "[ . 1 . 2]" 1
2178 1 51 ARG QD 1 96 LEU QD 4.180 . 5.180 3.383 2.303 4.943 . 0 0 "[ . 1 . 2]" 1
2179 1 96 LEU QD 1 97 ILE HG12 4.270 . 5.270 3.530 3.294 3.849 . 0 0 "[ . 1 . 2]" 1
2180 1 96 LEU QD 1 100 ALA MB 5.250 . 6.250 4.160 3.645 4.558 . 0 0 "[ . 1 . 2]" 1
2181 1 96 LEU QD 1 97 ILE MD 3.830 . 4.830 2.046 1.935 2.328 . 0 0 "[ . 1 . 2]" 1
2182 1 96 LEU QD 1 97 ILE HB 3.820 . 4.820 2.673 2.403 2.964 . 0 0 "[ . 1 . 2]" 1
2183 1 58 GLN QG 1 59 LEU H 3.650 . 4.650 3.754 2.482 4.357 . 0 0 "[ . 1 . 2]" 1
2184 1 58 GLN QG 1 59 LEU HA 5.340 . 6.340 5.312 4.052 6.124 . 0 0 "[ . 1 . 2]" 1
2185 1 108 SER QB 1 109 ARG H 4.300 . 5.300 2.965 2.367 3.805 . 0 0 "[ . 1 . 2]" 1
2186 1 56 GLY QA 1 101 ILE HA 5.340 . 6.340 3.027 2.673 3.644 . 0 0 "[ . 1 . 2]" 1
2187 1 56 GLY QA 1 105 LEU HB2 4.470 . 5.470 3.722 3.211 4.358 . 0 0 "[ . 1 . 2]" 1
2188 1 56 GLY QA 1 101 ILE MD 4.890 . 5.890 3.403 3.009 3.779 . 0 0 "[ . 1 . 2]" 1
2189 1 56 GLY QA 1 101 ILE MG 3.410 . 4.410 2.011 1.886 2.566 . 0 0 "[ . 1 . 2]" 1
2190 1 56 GLY QA 1 101 ILE HG13 4.280 . 5.280 3.689 3.397 4.057 . 0 0 "[ . 1 . 2]" 1
2191 1 57 LYS QD 1 58 GLN H 3.630 . 4.630 3.968 3.015 4.571 . 0 0 "[ . 1 . 2]" 1
2192 1 60 GLU QB 1 61 ASP H 3.400 . 4.400 3.005 2.226 3.588 . 0 0 "[ . 1 . 2]" 1
2193 1 63 ARG QG 1 64 THR H 4.380 . 5.380 2.739 1.840 4.313 . 0 0 "[ . 1 . 2]" 1
2194 1 63 ARG QD 1 64 THR H 4.440 . 5.440 3.237 1.847 4.138 . 0 0 "[ . 1 . 2]" 1
2195 1 63 ARG QD 1 67 ASP H 5.220 . 6.220 5.501 4.318 6.231 0.011 4 0 "[ . 1 . 2]" 1
2196 1 63 ARG QD 1 67 ASP QB 3.810 . 4.810 3.263 2.272 4.006 . 0 0 "[ . 1 . 2]" 1
2197 1 67 ASP QB 1 68 TYR H 3.500 . 4.500 2.417 2.033 3.140 . 0 0 "[ . 1 . 2]" 1
2198 1 70 ILE QG 1 76 LEU QD 4.960 . 5.960 3.180 2.143 4.124 . 0 0 "[ . 1 . 2]" 1
2199 1 71 GLN QG 1 72 ARG H 3.970 . 4.970 3.333 1.870 3.972 . 0 0 "[ . 1 . 2]" 1
2200 1 82 LEU QB 1 93 GLU HB2 4.480 . 5.480 2.573 1.957 4.568 . 0 0 "[ . 1 . 2]" 1
2201 1 82 LEU QB 1 92 ASP HA 5.040 . 6.040 3.046 2.024 5.422 . 0 0 "[ . 1 . 2]" 1
2202 1 82 LEU QB 1 93 GLU H 4.320 . 5.320 3.407 2.105 4.913 . 0 0 "[ . 1 . 2]" 1
2203 1 82 LEU QB 1 87 MET HA 5.340 . 6.340 4.904 3.540 6.358 0.018 18 0 "[ . 1 . 2]" 1
2204 1 87 MET QB 1 92 ASP HA 4.250 . 5.250 3.885 2.128 5.251 0.001 10 0 "[ . 1 . 2]" 1
2205 1 83 ARG QG 1 84 GLY H 4.080 . 5.080 3.656 1.972 4.643 . 0 0 "[ . 1 . 2]" 1
2206 1 86 SER H 1 86 SER QB 3.640 . 4.640 2.726 2.086 3.250 . 0 0 "[ . 1 . 2]" 1
2207 1 87 MET QG 1 92 ASP HA 4.690 . 5.690 4.642 2.662 5.739 0.049 16 0 "[ . 1 . 2]" 1
2208 1 89 GLY QA 1 90 ALA H 2.990 . 3.990 2.400 2.121 2.920 . 0 0 "[ . 1 . 2]" 1
2209 1 89 GLY QA 1 90 ALA MB 4.240 . 5.240 3.926 3.756 4.249 . 0 0 "[ . 1 . 2]" 1
2210 1 89 GLY QA 1 90 ALA HA 4.620 . 5.620 4.010 3.956 4.095 . 0 0 "[ . 1 . 2]" 1
2211 1 95 GLU QG 1 96 LEU H 3.640 . 4.640 2.478 1.685 3.222 . 0 0 "[ . 1 . 2]" 1
2212 1 95 GLU QG 1 99 LYS HD3 3.850 . 4.850 3.988 2.681 4.896 0.046 6 0 "[ . 1 . 2]" 1
2213 1 95 GLU QG 1 99 LYS H 5.180 . 6.180 5.141 4.335 5.978 . 0 0 "[ . 1 . 2]" 1
2214 1 95 GLU QG 1 96 LEU HA 4.090 . 5.090 3.663 3.022 5.207 0.117 20 0 "[ . 1 . 2]" 1
2215 1 95 GLU QG 1 96 LEU QD 4.920 . 5.920 3.801 3.491 4.561 . 0 0 "[ . 1 . 2]" 1
2216 1 94 GLU QB 1 95 GLU H 3.090 . 4.090 2.322 1.793 3.297 . 0 0 "[ . 1 . 2]" 1
2217 1 94 GLU QG 1 96 LEU QD 5.230 . 6.230 4.138 3.879 4.743 . 0 0 "[ . 1 . 2]" 1
2218 1 98 ARG QD 1 99 LYS H 4.700 . 5.700 4.048 3.699 4.296 . 0 0 "[ . 1 . 2]" 1
2219 1 104 SER QB 1 105 LEU H 4.460 . 5.460 3.317 3.064 3.825 . 0 0 "[ . 1 . 2]" 1
2220 1 104 SER QB 1 105 LEU MD2 4.470 . 5.470 3.214 2.427 4.747 . 0 0 "[ . 1 . 2]" 1
2221 1 104 SER QB 1 107 GLU QB 5.180 . 6.180 4.668 3.803 5.488 . 0 0 "[ . 1 . 2]" 1
2222 1 107 GLU QB 1 108 SER H 3.590 . 4.590 2.772 2.311 3.556 . 0 0 "[ . 1 . 2]" 1
2223 1 106 LYS QD 1 107 GLU H 5.020 . 6.020 3.098 2.058 4.294 . 0 0 "[ . 1 . 2]" 1
2224 1 106 LYS QD 1 108 SER H 5.040 . 6.040 4.682 4.191 5.312 . 0 0 "[ . 1 . 2]" 1
2225 1 106 LYS QD 1 107 GLU QB 4.550 . 5.550 3.776 2.292 5.709 0.159 12 0 "[ . 1 . 2]" 1
2226 1 109 ARG QB 1 109 ARG QD 3.080 . 4.080 2.197 2.003 2.429 . 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 46
_Distance_constraint_stats_list.Viol_count 147
_Distance_constraint_stats_list.Viol_total 105.533
_Distance_constraint_stats_list.Viol_max 0.108
_Distance_constraint_stats_list.Viol_rms 0.0163
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0057
_Distance_constraint_stats_list.Viol_average_violations_only 0.0359
_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 12 ILE 0.756 0.069 4 0 "[ . 1 . 2]"
1 13 PHE 0.944 0.108 2 0 "[ . 1 . 2]"
1 14 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 LYS 0.083 0.042 5 0 "[ . 1 . 2]"
1 22 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 LEU 0.756 0.069 4 0 "[ . 1 . 2]"
1 30 ASP 0.043 0.030 3 0 "[ . 1 . 2]"
1 31 THR 0.041 0.018 19 0 "[ . 1 . 2]"
1 32 ILE 0.090 0.043 14 0 "[ . 1 . 2]"
1 33 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 VAL 1.097 0.074 1 0 "[ . 1 . 2]"
1 36 LYS 0.072 0.032 4 0 "[ . 1 . 2]"
1 37 SER 0.896 0.097 2 0 "[ . 1 . 2]"
1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ILE 1.056 0.074 1 0 "[ . 1 . 2]"
1 40 GLN 0.072 0.032 4 0 "[ . 1 . 2]"
1 41 ASP 0.896 0.097 2 0 "[ . 1 . 2]"
1 51 ARG 0.138 0.050 14 0 "[ . 1 . 2]"
1 52 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ILE 0.475 0.065 7 0 "[ . 1 . 2]"
1 54 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ARG 0.090 0.043 14 0 "[ . 1 . 2]"
1 65 LEU 0.043 0.030 3 0 "[ . 1 . 2]"
1 74 SER 0.773 0.108 2 0 "[ . 1 . 2]"
1 76 LEU 0.192 0.049 2 0 "[ . 1 . 2]"
1 77 HIS 0.475 0.065 7 0 "[ . 1 . 2]"
1 78 LEU 0.061 0.042 5 0 "[ . 1 . 2]"
1 79 VAL 0.138 0.050 14 0 "[ . 1 . 2]"
1 97 ILE 0.087 0.052 19 0 "[ . 1 . 2]"
1 98 ARG 0.427 0.064 3 0 "[ . 1 . 2]"
1 99 LYS 0.170 0.085 14 0 "[ . 1 . 2]"
1 101 ILE 0.087 0.052 19 0 "[ . 1 . 2]"
1 102 GLU 0.427 0.064 3 0 "[ . 1 . 2]"
1 103 LEU 0.170 0.085 14 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 14 ALA H 1 22 ILE O 1.950 . 2.300 1.748 1.654 2.023 . 0 0 "[ . 1 . 2]" 2
2 1 14 ALA N 1 22 ILE O 2.900 2.500 3.300 2.692 2.600 2.917 . 0 0 "[ . 1 . 2]" 2
3 1 13 PHE H 1 74 SER O 1.950 . 2.300 2.332 2.167 2.408 0.108 2 0 "[ . 1 . 2]" 2
4 1 13 PHE N 1 74 SER O 2.900 2.500 3.300 3.136 2.988 3.258 . 0 0 "[ . 1 . 2]" 2
5 1 12 ILE H 1 24 LEU O 1.950 . 2.300 2.328 2.201 2.369 0.069 4 0 "[ . 1 . 2]" 2
6 1 12 ILE N 1 24 LEU O 2.900 2.500 3.300 2.979 2.865 3.195 . 0 0 "[ . 1 . 2]" 2
7 1 15 LYS H 1 76 LEU O 1.950 . 2.300 1.806 1.578 2.007 0.022 16 0 "[ . 1 . 2]" 2
8 1 15 LYS N 1 76 LEU O 2.900 2.500 3.300 2.705 2.549 2.938 . 0 0 "[ . 1 . 2]" 2
9 1 32 ILE H 1 63 ARG O 1.950 . 2.300 2.192 1.947 2.343 0.043 14 0 "[ . 1 . 2]" 2
10 1 32 ILE N 1 63 ARG O 2.900 2.500 3.300 3.109 2.920 3.237 . 0 0 "[ . 1 . 2]" 2
11 1 31 THR O 1 35 VAL H 1.950 . 2.300 2.130 1.779 2.318 0.018 19 0 "[ . 1 . 2]" 2
12 1 31 THR O 1 35 VAL N 2.900 2.500 3.300 3.042 2.689 3.239 . 0 0 "[ . 1 . 2]" 2
13 1 32 ILE O 1 36 LYS H 1.950 . 2.300 1.749 1.609 1.929 . 0 0 "[ . 1 . 2]" 2
14 1 32 ILE O 1 36 LYS N 2.900 2.500 3.300 2.701 2.584 2.859 . 0 0 "[ . 1 . 2]" 2
15 1 33 ASP O 1 37 SER H 1.950 . 2.300 1.927 1.765 2.072 . 0 0 "[ . 1 . 2]" 2
16 1 33 ASP O 1 37 SER N 2.900 2.500 3.300 2.876 2.734 3.014 . 0 0 "[ . 1 . 2]" 2
17 1 34 ASN O 1 38 LYS H 1.950 . 2.300 1.897 1.788 2.076 . 0 0 "[ . 1 . 2]" 2
18 1 34 ASN O 1 38 LYS N 2.900 2.500 3.300 2.815 2.719 2.984 . 0 0 "[ . 1 . 2]" 2
19 1 35 VAL O 1 39 ILE H 1.950 . 2.300 2.353 2.322 2.374 0.074 1 0 "[ . 1 . 2]" 2
20 1 35 VAL O 1 39 ILE N 2.900 2.500 3.300 3.131 3.054 3.193 . 0 0 "[ . 1 . 2]" 2
21 1 36 LYS O 1 40 GLN H 1.950 . 2.300 2.231 2.005 2.332 0.032 4 0 "[ . 1 . 2]" 2
22 1 36 LYS O 1 40 GLN N 2.900 2.500 3.300 3.114 2.908 3.217 . 0 0 "[ . 1 . 2]" 2
23 1 37 SER O 1 41 ASP H 1.950 . 2.300 2.338 2.239 2.397 0.097 2 0 "[ . 1 . 2]" 2
24 1 37 SER O 1 41 ASP N 2.900 2.500 3.300 3.168 3.105 3.244 . 0 0 "[ . 1 . 2]" 2
25 1 51 ARG H 1 79 VAL O 1.950 . 2.300 2.083 1.694 2.341 0.041 10 0 "[ . 1 . 2]" 2
26 1 51 ARG N 1 79 VAL O 2.900 2.500 3.300 2.993 2.637 3.287 . 0 0 "[ . 1 . 2]" 2
27 1 53 ILE H 1 77 HIS O 1.950 . 2.300 2.282 1.981 2.365 0.065 7 0 "[ . 1 . 2]" 2
28 1 53 ILE N 1 77 HIS O 2.900 2.500 3.300 3.106 2.881 3.196 . 0 0 "[ . 1 . 2]" 2
29 1 54 TRP H 1 57 LYS O 1.950 . 2.300 1.981 1.771 2.247 . 0 0 "[ . 1 . 2]" 2
30 1 54 TRP N 1 57 LYS O 2.900 2.500 3.300 2.864 2.631 3.209 . 0 0 "[ . 1 . 2]" 2
31 1 52 LEU O 1 59 LEU H 1.950 . 2.300 1.785 1.636 1.970 . 0 0 "[ . 1 . 2]" 2
32 1 52 LEU O 1 59 LEU N 2.900 2.500 3.300 2.672 2.536 2.877 . 0 0 "[ . 1 . 2]" 2
33 1 30 ASP O 1 65 LEU H 1.950 . 2.300 1.857 1.681 2.330 0.030 3 0 "[ . 1 . 2]" 2
34 1 30 ASP O 1 65 LEU N 2.900 2.500 3.300 2.613 2.487 3.136 0.013 12 0 "[ . 1 . 2]" 2
35 1 13 PHE O 1 76 LEU H 1.950 . 2.300 1.604 1.551 1.713 0.049 2 0 "[ . 1 . 2]" 2
36 1 13 PHE O 1 76 LEU N 2.900 2.500 3.300 2.562 2.517 2.623 . 0 0 "[ . 1 . 2]" 2
37 1 15 LYS O 1 78 LEU H 1.950 . 2.300 1.931 1.606 2.342 0.042 5 0 "[ . 1 . 2]" 2
38 1 15 LYS O 1 78 LEU N 2.900 2.500 3.300 2.831 2.531 3.240 . 0 0 "[ . 1 . 2]" 2
39 1 51 ARG O 1 79 VAL H 1.950 . 2.300 1.867 1.580 2.350 0.050 14 0 "[ . 1 . 2]" 2
40 1 51 ARG O 1 79 VAL N 2.900 2.500 3.300 2.790 2.547 3.193 . 0 0 "[ . 1 . 2]" 2
41 1 97 ILE O 1 101 ILE H 1.950 . 2.300 2.186 1.856 2.352 0.052 19 0 "[ . 1 . 2]" 2
42 1 97 ILE O 1 101 ILE N 2.900 2.500 3.300 2.963 2.731 3.101 . 0 0 "[ . 1 . 2]" 2
43 1 98 ARG O 1 102 GLU H 1.950 . 2.300 2.272 2.003 2.364 0.064 3 0 "[ . 1 . 2]" 2
44 1 98 ARG O 1 102 GLU N 2.900 2.500 3.300 3.099 2.823 3.322 0.022 14 0 "[ . 1 . 2]" 2
45 1 99 LYS O 1 103 LEU H 1.950 . 2.300 2.032 1.593 2.307 0.007 14 0 "[ . 1 . 2]" 2
46 1 99 LYS O 1 103 LEU N 2.900 2.500 3.300 2.722 2.415 3.020 0.085 14 0 "[ . 1 . 2]" 2
stop_
save_
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