NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
589938 |
2mqm   |
25039 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mqm
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 2503
_Distance_constraint_stats_list.Viol_count 1433
_Distance_constraint_stats_list.Viol_total 1427.464
_Distance_constraint_stats_list.Viol_max 0.311
_Distance_constraint_stats_list.Viol_rms 0.0105
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0014
_Distance_constraint_stats_list.Viol_average_violations_only 0.0498
_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 2 LYS 1.132 0.109 9 0 "[ . 1 . 2]"
1 3 ILE 0.565 0.070 3 0 "[ . 1 . 2]"
1 6 PRO 1.290 0.109 9 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 SER 0.321 0.117 11 0 "[ . 1 . 2]"
1 10 ASP 0.321 0.117 11 0 "[ . 1 . 2]"
1 11 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 SER 0.042 0.042 18 0 "[ . 1 . 2]"
1 15 VAL 0.864 0.063 8 0 "[ . 1 . 2]"
1 16 ASN 0.753 0.068 6 0 "[ . 1 . 2]"
1 17 SER 0.345 0.068 20 0 "[ . 1 . 2]"
1 18 VAL 2.895 0.110 12 0 "[ . 1 . 2]"
1 19 LEU 0.466 0.053 10 0 "[ . 1 . 2]"
1 20 LEU 1.454 0.143 10 0 "[ . 1 . 2]"
1 21 PHE 2.242 0.120 6 0 "[ . 1 . 2]"
1 22 THR 0.945 0.103 15 0 "[ . 1 . 2]"
1 23 ILE 2.163 0.153 19 0 "[ . 1 . 2]"
1 24 LEU 0.906 0.086 10 0 "[ . 1 . 2]"
1 25 ASN 0.767 0.056 16 0 "[ . 1 . 2]"
1 26 PRO 0.104 0.020 19 0 "[ . 1 . 2]"
1 27 ILE 2.376 0.128 8 0 "[ . 1 . 2]"
1 28 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 SER 1.248 0.112 18 0 "[ . 1 . 2]"
1 30 ILE 1.091 0.082 14 0 "[ . 1 . 2]"
1 31 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 THR 0.333 0.060 5 0 "[ . 1 . 2]"
1 33 ASP 1.502 0.117 7 0 "[ . 1 . 2]"
1 34 VAL 1.581 0.112 18 0 "[ . 1 . 2]"
1 35 LEU 0.157 0.039 11 0 "[ . 1 . 2]"
1 36 TYR 0.323 0.030 3 0 "[ . 1 . 2]"
1 37 THR 1.073 0.093 8 0 "[ . 1 . 2]"
1 38 ILE 1.814 0.093 8 0 "[ . 1 . 2]"
1 39 CYS 0.491 0.052 19 0 "[ . 1 . 2]"
1 40 ASN 2.346 0.122 11 0 "[ . 1 . 2]"
1 41 PRO 1.406 0.122 11 0 "[ . 1 . 2]"
1 42 CYS 0.033 0.033 10 0 "[ . 1 . 2]"
1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 PRO 0.628 0.102 20 0 "[ . 1 . 2]"
1 45 VAL 2.409 0.154 18 0 "[ . 1 . 2]"
1 46 GLN 2.743 0.109 3 0 "[ . 1 . 2]"
1 47 ARG 0.139 0.041 8 0 "[ . 1 . 2]"
1 48 ILE 0.156 0.114 12 0 "[ . 1 . 2]"
1 49 VAL 1.991 0.109 6 0 "[ . 1 . 2]"
1 50 ILE 1.600 0.117 2 0 "[ . 1 . 2]"
1 51 PHE 0.012 0.008 2 0 "[ . 1 . 2]"
1 52 ARG 0.692 0.117 2 0 "[ . 1 . 2]"
1 53 LYS 1.153 0.116 16 0 "[ . 1 . 2]"
1 54 ASN 0.079 0.079 4 0 "[ . 1 . 2]"
1 55 GLY 0.100 0.079 4 0 "[ . 1 . 2]"
1 56 VAL 0.234 0.050 8 0 "[ . 1 . 2]"
1 57 GLN 2.575 0.153 19 0 "[ . 1 . 2]"
1 58 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 MET 0.953 0.106 6 0 "[ . 1 . 2]"
1 60 VAL 0.699 0.073 14 0 "[ . 1 . 2]"
1 61 GLU 0.308 0.100 8 0 "[ . 1 . 2]"
1 62 PHE 6.364 0.154 18 0 "[ . 1 . 2]"
1 63 ASP 2.011 0.104 18 0 "[ . 1 . 2]"
1 64 SER 0.284 0.085 19 0 "[ . 1 . 2]"
1 65 VAL 1.481 0.083 20 0 "[ . 1 . 2]"
1 66 GLN 1.137 0.098 2 0 "[ . 1 . 2]"
1 67 SER 1.202 0.098 2 0 "[ . 1 . 2]"
1 68 ALA 1.851 0.104 18 0 "[ . 1 . 2]"
1 69 GLN 4.307 0.311 6 0 "[ . 1 . 2]"
1 70 ARG 0.243 0.135 18 0 "[ . 1 . 2]"
1 71 ALA 0.016 0.016 6 0 "[ . 1 . 2]"
1 72 LYS 12.340 0.311 6 0 "[ . 1 . 2]"
1 73 ALA 1.428 0.078 13 0 "[ . 1 . 2]"
1 74 SER 0.004 0.004 5 0 "[ . 1 . 2]"
1 75 LEU 0.858 0.084 3 0 "[ . 1 . 2]"
1 76 ASN 0.174 0.151 6 0 "[ . 1 . 2]"
1 77 GLY 0.894 0.084 3 0 "[ . 1 . 2]"
1 78 ALA 1.957 0.090 18 0 "[ . 1 . 2]"
1 79 ASP 1.257 0.106 4 0 "[ . 1 . 2]"
1 80 ILE 3.558 0.137 8 0 "[ . 1 . 2]"
1 81 TYR 2.347 0.119 14 0 "[ . 1 . 2]"
1 82 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 CYS 2.909 0.128 8 0 "[ . 1 . 2]"
1 85 CYS 0.195 0.064 12 0 "[ . 1 . 2]"
1 86 THR 1.124 0.086 10 0 "[ . 1 . 2]"
1 87 LEU 3.500 0.137 8 0 "[ . 1 . 2]"
1 88 LYS 1.173 0.103 15 0 "[ . 1 . 2]"
1 89 ILE 7.213 0.232 15 0 "[ . 1 . 2]"
1 90 GLU 0.152 0.050 9 0 "[ . 1 . 2]"
1 91 TYR 2.694 0.086 10 0 "[ . 1 . 2]"
1 92 ALA 1.974 0.143 10 0 "[ . 1 . 2]"
1 93 LYS 0.287 0.141 10 0 "[ . 1 . 2]"
1 94 PRO 1.689 0.141 10 0 "[ . 1 . 2]"
1 95 THR 0.920 0.065 8 0 "[ . 1 . 2]"
1 96 ARG 2.594 0.180 8 0 "[ . 1 . 2]"
1 97 LEU 4.373 0.180 8 0 "[ . 1 . 2]"
1 98 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 VAL 0.297 0.114 12 0 "[ . 1 . 2]"
1 100 PHE 2.591 0.109 6 0 "[ . 1 . 2]"
1 101 LYS 3.146 0.139 10 0 "[ . 1 . 2]"
1 102 ASN 1.705 0.133 12 0 "[ . 1 . 2]"
1 103 ASP 0.437 0.092 13 0 "[ . 1 . 2]"
1 104 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 ASP 0.042 0.042 11 0 "[ . 1 . 2]"
1 106 THR 0.214 0.071 13 0 "[ . 1 . 2]"
1 107 TRP 3.175 0.117 7 0 "[ . 1 . 2]"
1 108 ASP 0.723 0.133 12 0 "[ . 1 . 2]"
1 109 TYR 1.384 0.113 13 0 "[ . 1 . 2]"
1 110 THR 0.873 0.102 17 0 "[ . 1 . 2]"
1 111 ASN 1.928 0.139 10 0 "[ . 1 . 2]"
1 112 PRO 0.707 0.286 20 0 "[ . 1 . 2]"
1 113 ASN 0.112 0.049 1 0 "[ . 1 . 2]"
1 114 LEU 0.380 0.286 20 0 "[ . 1 . 2]"
1 115 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 GLN 0.218 0.125 19 0 "[ . 1 . 2]"
1 118 GLY 0.218 0.125 19 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 LYS QB 1 3 ILE MG . . 4.450 3.693 2.723 4.306 . 0 0 "[ . 1 . 2]" 1
2 1 2 LYS QB 1 6 PRO HB3 . . 5.480 3.975 2.370 4.745 . 0 0 "[ . 1 . 2]" 1
3 1 2 LYS QB 1 6 PRO QG . . 5.570 4.495 3.361 5.349 . 0 0 "[ . 1 . 2]" 1
4 1 2 LYS QD 1 3 ILE MG . . 4.850 3.721 2.331 4.434 . 0 0 "[ . 1 . 2]" 1
5 1 2 LYS QD 1 6 PRO HA . . 4.730 4.600 3.684 4.839 0.109 9 0 "[ . 1 . 2]" 1
6 1 2 LYS QD 1 6 PRO HB2 . . 4.500 3.657 2.870 4.124 . 0 0 "[ . 1 . 2]" 1
7 1 2 LYS QD 1 6 PRO QG . . 4.690 3.570 2.164 4.641 . 0 0 "[ . 1 . 2]" 1
8 1 2 LYS QE 1 3 ILE MG . . 4.970 3.865 2.747 5.040 0.070 3 0 "[ . 1 . 2]" 1
9 1 2 LYS QE 1 6 PRO HA . . 5.320 4.291 3.050 5.369 0.049 5 0 "[ . 1 . 2]" 1
10 1 2 LYS QE 1 6 PRO HB3 . . 4.590 2.884 1.926 3.802 . 0 0 "[ . 1 . 2]" 1
11 1 2 LYS QE 1 6 PRO QD . . 5.340 4.552 3.367 5.443 0.103 4 0 "[ . 1 . 2]" 1
12 1 3 ILE HB 1 6 PRO HB3 . . 5.720 5.531 4.934 5.786 0.066 1 0 "[ . 1 . 2]" 1
13 1 3 ILE MG 1 6 PRO HB3 . . 4.800 2.942 2.298 4.431 . 0 0 "[ . 1 . 2]" 1
14 1 3 ILE MG 1 6 PRO QG . . 5.340 4.094 3.440 5.391 0.051 13 0 "[ . 1 . 2]" 1
15 1 7 GLY QA 1 8 ASP HA . . 4.890 4.047 3.985 4.137 . 0 0 "[ . 1 . 2]" 1
16 1 7 GLY QA 1 8 ASP QB . . 4.890 3.912 3.624 4.438 . 0 0 "[ . 1 . 2]" 1
17 1 9 SER HA 1 10 ASP QB . . 5.410 4.508 3.946 4.827 . 0 0 "[ . 1 . 2]" 1
18 1 9 SER QB 1 10 ASP HA . . 5.000 4.528 3.858 5.117 0.117 11 0 "[ . 1 . 2]" 1
19 1 10 ASP QB 1 11 ASP H . . 4.890 3.515 2.255 4.083 . 0 0 "[ . 1 . 2]" 1
20 1 14 SER H 1 15 VAL H . . 5.410 4.450 4.224 4.667 . 0 0 "[ . 1 . 2]" 1
21 1 14 SER HA 1 15 VAL H . . 3.570 2.358 2.188 2.648 . 0 0 "[ . 1 . 2]" 1
22 1 14 SER HA 1 15 VAL HA . . 5.310 4.505 4.437 4.539 . 0 0 "[ . 1 . 2]" 1
23 1 14 SER HA 1 15 VAL QG . . 4.530 3.385 3.067 3.553 . 0 0 "[ . 1 . 2]" 1
24 1 14 SER HA 1 16 ASN H . . 5.520 4.552 3.885 5.562 0.042 18 0 "[ . 1 . 2]" 1
25 1 14 SER HA 1 65 VAL QG . . 5.410 2.955 2.253 4.080 . 0 0 "[ . 1 . 2]" 1
26 1 14 SER QB 1 65 VAL QG . . 5.440 2.515 1.899 3.528 . 0 0 "[ . 1 . 2]" 1
27 1 15 VAL H 1 15 VAL QG . . 3.370 2.655 2.373 2.952 . 0 0 "[ . 1 . 2]" 1
28 1 15 VAL H 1 16 ASN H . . 4.600 2.355 1.919 3.150 . 0 0 "[ . 1 . 2]" 1
29 1 15 VAL H 1 16 ASN QB . . 5.660 4.969 4.759 5.248 . 0 0 "[ . 1 . 2]" 1
30 1 15 VAL H 1 65 VAL HB . . 5.750 4.630 4.099 5.292 . 0 0 "[ . 1 . 2]" 1
31 1 15 VAL H 1 65 VAL MG1 . . 5.610 4.257 3.860 4.845 . 0 0 "[ . 1 . 2]" 1
32 1 15 VAL H 1 65 VAL MG2 . . 5.610 2.395 2.055 2.876 . 0 0 "[ . 1 . 2]" 1
33 1 15 VAL H 1 65 VAL QG . . 4.760 2.382 2.048 2.856 . 0 0 "[ . 1 . 2]" 1
34 1 15 VAL HA 1 16 ASN HA . . 5.380 4.696 4.617 4.763 . 0 0 "[ . 1 . 2]" 1
35 1 15 VAL HA 1 65 VAL QG . . 5.230 4.530 4.315 4.814 . 0 0 "[ . 1 . 2]" 1
36 1 15 VAL HB 1 16 ASN H . . 4.800 2.881 1.821 4.028 . 0 0 "[ . 1 . 2]" 1
37 1 15 VAL HB 1 69 GLN HE22 . . 5.900 5.182 4.168 5.963 0.063 8 0 "[ . 1 . 2]" 1
38 1 15 VAL HB 1 91 TYR QE . . 5.750 4.778 3.478 5.808 0.058 10 0 "[ . 1 . 2]" 1
39 1 15 VAL QG 1 16 ASN H . . 3.910 2.397 1.807 2.927 . 0 0 "[ . 1 . 2]" 1
40 1 15 VAL QG 1 16 ASN HA . . 4.910 3.958 3.766 4.145 . 0 0 "[ . 1 . 2]" 1
41 1 15 VAL QG 1 16 ASN QD . . 3.970 3.212 3.004 3.349 . 0 0 "[ . 1 . 2]" 1
42 1 15 VAL QG 1 65 VAL QG . . 3.950 3.765 3.259 3.990 0.040 11 0 "[ . 1 . 2]" 1
43 1 15 VAL QG 1 69 GLN HE21 . . 4.340 3.916 3.430 4.383 0.043 10 0 "[ . 1 . 2]" 1
44 1 15 VAL QG 1 69 GLN HE22 . . 4.570 3.715 2.947 4.295 . 0 0 "[ . 1 . 2]" 1
45 1 15 VAL QG 1 91 TYR H . . 5.540 5.010 4.230 5.374 . 0 0 "[ . 1 . 2]" 1
46 1 15 VAL QG 1 91 TYR HA . . 5.160 4.794 4.312 5.184 0.024 12 0 "[ . 1 . 2]" 1
47 1 15 VAL QG 1 91 TYR QD . . 5.520 3.134 2.727 3.613 . 0 0 "[ . 1 . 2]" 1
48 1 15 VAL QG 1 91 TYR QE . . 4.110 3.617 3.216 4.137 0.027 12 0 "[ . 1 . 2]" 1
49 1 16 ASN H 1 17 SER H . . 5.050 4.379 4.358 4.409 . 0 0 "[ . 1 . 2]" 1
50 1 16 ASN H 1 17 SER HA . . 5.750 4.671 4.580 4.794 . 0 0 "[ . 1 . 2]" 1
51 1 16 ASN H 1 18 VAL H . . 5.430 4.444 4.198 4.673 . 0 0 "[ . 1 . 2]" 1
52 1 16 ASN H 1 65 VAL HB . . 5.380 4.633 4.222 4.997 . 0 0 "[ . 1 . 2]" 1
53 1 16 ASN H 1 65 VAL MG1 . . 5.280 5.155 4.911 5.348 0.068 6 0 "[ . 1 . 2]" 1
54 1 16 ASN H 1 65 VAL MG2 . . 5.280 2.925 2.799 3.085 . 0 0 "[ . 1 . 2]" 1
55 1 16 ASN H 1 65 VAL QG . . 4.470 2.909 2.785 3.063 . 0 0 "[ . 1 . 2]" 1
56 1 16 ASN H 1 69 GLN HE22 . . 5.660 5.542 5.054 5.677 0.017 16 0 "[ . 1 . 2]" 1
57 1 16 ASN H 1 91 TYR QD . . 4.610 3.618 2.896 4.074 . 0 0 "[ . 1 . 2]" 1
58 1 16 ASN H 1 91 TYR QE . . 4.530 3.942 3.358 4.389 . 0 0 "[ . 1 . 2]" 1
59 1 16 ASN HA 1 17 SER H . . 3.660 2.443 2.391 2.494 . 0 0 "[ . 1 . 2]" 1
60 1 16 ASN HA 1 18 VAL H . . 5.010 4.064 3.933 4.170 . 0 0 "[ . 1 . 2]" 1
61 1 16 ASN HA 1 18 VAL QG . . 5.520 4.454 4.138 5.024 . 0 0 "[ . 1 . 2]" 1
62 1 16 ASN HA 1 65 VAL HA . . 5.480 5.183 4.599 5.491 0.011 20 0 "[ . 1 . 2]" 1
63 1 16 ASN HA 1 65 VAL MG1 . . 4.930 4.845 4.253 4.976 0.046 18 0 "[ . 1 . 2]" 1
64 1 16 ASN HA 1 65 VAL MG2 . . 4.930 3.578 2.807 3.893 . 0 0 "[ . 1 . 2]" 1
65 1 16 ASN HA 1 65 VAL QG . . 4.420 3.486 2.770 3.760 . 0 0 "[ . 1 . 2]" 1
66 1 16 ASN HB2 1 17 SER H . . 4.490 2.422 2.317 2.533 . 0 0 "[ . 1 . 2]" 1
67 1 16 ASN HB2 1 18 VAL H . . 4.920 2.728 2.482 2.944 . 0 0 "[ . 1 . 2]" 1
68 1 16 ASN HB2 1 91 TYR QD . . 5.750 5.272 5.137 5.435 . 0 0 "[ . 1 . 2]" 1
69 1 16 ASN HB3 1 17 SER H . . 4.490 3.756 3.705 3.806 . 0 0 "[ . 1 . 2]" 1
70 1 16 ASN HB3 1 18 VAL H . . 4.920 4.181 4.003 4.322 . 0 0 "[ . 1 . 2]" 1
71 1 16 ASN HB3 1 91 TYR QD . . 5.750 5.470 5.267 5.645 . 0 0 "[ . 1 . 2]" 1
72 1 16 ASN HD21 1 95 THR HA . . 4.770 2.729 2.471 2.924 . 0 0 "[ . 1 . 2]" 1
73 1 16 ASN HD21 1 95 THR MG . . 4.890 3.421 3.153 3.535 . 0 0 "[ . 1 . 2]" 1
74 1 16 ASN HD22 1 95 THR HA . . 4.770 4.406 4.044 4.593 . 0 0 "[ . 1 . 2]" 1
75 1 16 ASN HD22 1 95 THR MG . . 4.890 4.836 4.598 4.943 0.053 7 0 "[ . 1 . 2]" 1
76 1 16 ASN QB 1 17 SER H . . 4.070 2.394 2.295 2.497 . 0 0 "[ . 1 . 2]" 1
77 1 16 ASN QB 1 18 VAL H . . 4.520 2.694 2.460 2.894 . 0 0 "[ . 1 . 2]" 1
78 1 16 ASN QB 1 18 VAL QG . . 4.750 2.603 2.175 3.251 . 0 0 "[ . 1 . 2]" 1
79 1 16 ASN QD 1 17 SER H . . 5.660 4.664 4.554 4.781 . 0 0 "[ . 1 . 2]" 1
80 1 16 ASN QD 1 18 VAL H . . 5.060 3.620 3.458 3.797 . 0 0 "[ . 1 . 2]" 1
81 1 16 ASN QD 1 91 TYR HB3 . . 4.950 3.074 2.763 3.527 . 0 0 "[ . 1 . 2]" 1
82 1 16 ASN QD 1 91 TYR QD . . 5.190 4.014 3.859 4.334 . 0 0 "[ . 1 . 2]" 1
83 1 16 ASN QD 1 92 ALA H . . 5.040 3.057 2.751 3.480 . 0 0 "[ . 1 . 2]" 1
84 1 16 ASN QD 1 92 ALA MB . . 4.780 3.245 2.790 3.632 . 0 0 "[ . 1 . 2]" 1
85 1 16 ASN QD 1 93 LYS QB . . 5.570 5.108 4.940 5.297 . 0 0 "[ . 1 . 2]" 1
86 1 16 ASN QD 1 94 PRO HA . . 5.660 4.579 4.462 4.662 . 0 0 "[ . 1 . 2]" 1
87 1 16 ASN QD 1 95 THR H . . 4.900 4.583 4.358 4.722 . 0 0 "[ . 1 . 2]" 1
88 1 16 ASN QD 1 95 THR HA . . 4.040 2.704 2.454 2.893 . 0 0 "[ . 1 . 2]" 1
89 1 16 ASN QD 1 95 THR HB . . 5.090 4.864 4.670 5.034 . 0 0 "[ . 1 . 2]" 1
90 1 16 ASN QD 1 95 THR MG . . 4.280 3.354 3.101 3.460 . 0 0 "[ . 1 . 2]" 1
91 1 17 SER H 1 17 SER HB3 . . 4.100 2.801 2.699 2.880 . 0 0 "[ . 1 . 2]" 1
92 1 17 SER H 1 18 VAL H . . 3.760 2.675 2.520 2.782 . 0 0 "[ . 1 . 2]" 1
93 1 17 SER H 1 18 VAL HA . . 5.360 4.992 4.859 5.132 . 0 0 "[ . 1 . 2]" 1
94 1 17 SER H 1 18 VAL QG . . 4.470 3.073 2.916 3.381 . 0 0 "[ . 1 . 2]" 1
95 1 17 SER H 1 62 PHE H . . 5.660 5.620 5.364 5.728 0.068 20 0 "[ . 1 . 2]" 1
96 1 17 SER H 1 65 VAL HA . . 5.430 4.420 3.980 4.743 . 0 0 "[ . 1 . 2]" 1
97 1 17 SER H 1 65 VAL HB . . 5.460 3.950 3.488 4.191 . 0 0 "[ . 1 . 2]" 1
98 1 17 SER H 1 65 VAL QG . . 5.210 4.037 3.634 4.347 . 0 0 "[ . 1 . 2]" 1
99 1 17 SER H 1 68 ALA MB . . 5.070 4.630 4.482 4.781 . 0 0 "[ . 1 . 2]" 1
100 1 17 SER H 1 95 THR MG . . 5.610 5.209 4.969 5.501 . 0 0 "[ . 1 . 2]" 1
101 1 17 SER HA 1 62 PHE H . . 5.100 4.367 4.181 4.526 . 0 0 "[ . 1 . 2]" 1
102 1 17 SER HA 1 65 VAL HA . . 4.120 2.282 2.173 2.448 . 0 0 "[ . 1 . 2]" 1
103 1 17 SER HA 1 65 VAL MG1 . . 5.480 4.802 4.694 4.912 . 0 0 "[ . 1 . 2]" 1
104 1 17 SER HA 1 65 VAL MG2 . . 5.480 3.079 2.736 3.329 . 0 0 "[ . 1 . 2]" 1
105 1 17 SER HA 1 65 VAL QG . . 4.740 3.043 2.720 3.273 . 0 0 "[ . 1 . 2]" 1
106 1 17 SER HA 1 68 ALA H . . 4.640 4.102 3.864 4.298 . 0 0 "[ . 1 . 2]" 1
107 1 17 SER HA 1 68 ALA HA . . 5.530 5.001 4.796 5.183 . 0 0 "[ . 1 . 2]" 1
108 1 17 SER HA 1 68 ALA MB . . 3.850 2.265 2.111 2.414 . 0 0 "[ . 1 . 2]" 1
109 1 17 SER HA 1 69 GLN H . . 5.490 5.325 5.174 5.505 0.015 15 0 "[ . 1 . 2]" 1
110 1 17 SER HA 1 91 TYR QD . . 5.350 5.076 4.879 5.242 . 0 0 "[ . 1 . 2]" 1
111 1 17 SER HB2 1 18 VAL H . . 5.210 4.473 4.421 4.503 . 0 0 "[ . 1 . 2]" 1
112 1 17 SER HB2 1 61 GLU HA . . 5.480 4.529 4.379 4.677 . 0 0 "[ . 1 . 2]" 1
113 1 17 SER HB2 1 62 PHE H . . 4.590 2.840 2.612 3.001 . 0 0 "[ . 1 . 2]" 1
114 1 17 SER HB2 1 62 PHE HA . . 5.380 4.931 4.593 5.085 . 0 0 "[ . 1 . 2]" 1
115 1 17 SER HB2 1 62 PHE QB . . 4.890 2.885 2.485 3.188 . 0 0 "[ . 1 . 2]" 1
116 1 17 SER HB2 1 62 PHE QD . . 5.440 4.311 4.035 4.489 . 0 0 "[ . 1 . 2]" 1
117 1 17 SER HB2 1 64 SER H . . 4.220 3.730 3.522 3.926 . 0 0 "[ . 1 . 2]" 1
118 1 17 SER HB2 1 64 SER HA . . 5.580 4.161 3.873 4.430 . 0 0 "[ . 1 . 2]" 1
119 1 17 SER HB2 1 65 VAL HA . . 4.890 3.314 3.044 3.531 . 0 0 "[ . 1 . 2]" 1
120 1 17 SER HB2 1 65 VAL HB . . 5.750 4.479 4.136 4.827 . 0 0 "[ . 1 . 2]" 1
121 1 17 SER HB2 1 65 VAL QG . . 5.710 4.486 4.216 4.703 . 0 0 "[ . 1 . 2]" 1
122 1 17 SER HB2 1 68 ALA MB . . 4.430 3.277 3.073 3.415 . 0 0 "[ . 1 . 2]" 1
123 1 17 SER HB3 1 18 VAL H . . 5.210 4.566 4.502 4.610 . 0 0 "[ . 1 . 2]" 1
124 1 17 SER HB3 1 61 GLU QG . . 5.390 4.853 4.609 5.105 . 0 0 "[ . 1 . 2]" 1
125 1 17 SER HB3 1 62 PHE H . . 5.260 4.590 4.343 4.744 . 0 0 "[ . 1 . 2]" 1
126 1 17 SER HB3 1 62 PHE QB . . 5.660 4.290 3.897 4.558 . 0 0 "[ . 1 . 2]" 1
127 1 17 SER HB3 1 64 SER H . . 4.920 4.485 4.153 4.737 . 0 0 "[ . 1 . 2]" 1
128 1 17 SER HB3 1 64 SER HA . . 4.870 3.662 3.383 3.918 . 0 0 "[ . 1 . 2]" 1
129 1 17 SER HB3 1 65 VAL HB . . 5.750 2.929 2.544 3.268 . 0 0 "[ . 1 . 2]" 1
130 1 17 SER HB3 1 65 VAL MG1 . . 5.340 4.161 3.961 4.375 . 0 0 "[ . 1 . 2]" 1
131 1 17 SER HB3 1 65 VAL MG2 . . 5.340 3.938 3.565 4.191 . 0 0 "[ . 1 . 2]" 1
132 1 17 SER HB3 1 65 VAL QG . . 4.940 3.596 3.324 3.794 . 0 0 "[ . 1 . 2]" 1
133 1 17 SER HB3 1 68 ALA MB . . 4.910 3.894 3.715 4.018 . 0 0 "[ . 1 . 2]" 1
134 1 18 VAL H 1 19 LEU H . . 5.320 4.510 4.477 4.547 . 0 0 "[ . 1 . 2]" 1
135 1 18 VAL H 1 19 LEU HA . . 5.690 5.056 4.957 5.192 . 0 0 "[ . 1 . 2]" 1
136 1 18 VAL H 1 19 LEU HG . . 5.750 4.511 4.413 4.625 . 0 0 "[ . 1 . 2]" 1
137 1 18 VAL H 1 61 GLU HA . . 5.440 4.971 4.860 5.083 . 0 0 "[ . 1 . 2]" 1
138 1 18 VAL H 1 62 PHE H . . 5.650 5.271 5.079 5.390 . 0 0 "[ . 1 . 2]" 1
139 1 18 VAL H 1 65 VAL HB . . 5.750 5.766 5.636 5.813 0.063 9 0 "[ . 1 . 2]" 1
140 1 18 VAL H 1 68 ALA MB . . 4.830 3.976 3.779 4.210 . 0 0 "[ . 1 . 2]" 1
141 1 18 VAL H 1 91 TYR QD . . 4.810 4.053 3.723 4.226 . 0 0 "[ . 1 . 2]" 1
142 1 18 VAL H 1 91 TYR QE . . 5.280 5.241 4.838 5.353 0.073 15 0 "[ . 1 . 2]" 1
143 1 18 VAL H 1 92 ALA H . . 5.670 4.790 4.700 4.935 . 0 0 "[ . 1 . 2]" 1
144 1 18 VAL H 1 92 ALA MB . . 5.750 4.768 4.548 4.990 . 0 0 "[ . 1 . 2]" 1
145 1 18 VAL H 1 95 THR HA . . 5.480 4.669 4.319 4.900 . 0 0 "[ . 1 . 2]" 1
146 1 18 VAL H 1 96 ARG HA . . 5.750 5.776 5.591 5.860 0.110 12 0 "[ . 1 . 2]" 1
147 1 18 VAL HA 1 19 LEU H . . 3.820 2.213 2.184 2.237 . 0 0 "[ . 1 . 2]" 1
148 1 18 VAL HA 1 19 LEU HA . . 5.130 4.440 4.422 4.464 . 0 0 "[ . 1 . 2]" 1
149 1 18 VAL HA 1 19 LEU QD . . 5.400 4.179 4.074 4.266 . 0 0 "[ . 1 . 2]" 1
150 1 18 VAL HA 1 59 MET HB3 . . 5.750 5.749 5.679 5.832 0.082 10 0 "[ . 1 . 2]" 1
151 1 18 VAL HA 1 60 VAL H . . 5.100 4.601 4.527 4.736 . 0 0 "[ . 1 . 2]" 1
152 1 18 VAL HA 1 61 GLU H . . 5.360 4.979 4.909 5.092 . 0 0 "[ . 1 . 2]" 1
153 1 18 VAL HA 1 61 GLU HA . . 4.230 2.469 2.388 2.575 . 0 0 "[ . 1 . 2]" 1
154 1 18 VAL HA 1 61 GLU HB2 . . 5.290 3.656 3.410 3.921 . 0 0 "[ . 1 . 2]" 1
155 1 18 VAL HA 1 61 GLU HG2 . . 5.750 4.946 4.735 5.170 . 0 0 "[ . 1 . 2]" 1
156 1 18 VAL HA 1 61 GLU HG3 . . 5.750 3.545 3.294 3.825 . 0 0 "[ . 1 . 2]" 1
157 1 18 VAL HA 1 61 GLU QG . . 5.280 3.470 3.240 3.729 . 0 0 "[ . 1 . 2]" 1
158 1 18 VAL HA 1 92 ALA MB . . 5.470 4.484 4.247 4.567 . 0 0 "[ . 1 . 2]" 1
159 1 18 VAL HA 1 97 LEU HG . . 5.540 4.267 4.090 4.506 . 0 0 "[ . 1 . 2]" 1
160 1 18 VAL HA 1 97 LEU MD1 . . 4.270 3.761 3.493 4.003 . 0 0 "[ . 1 . 2]" 1
161 1 18 VAL HA 1 97 LEU MD2 . . 5.480 4.820 4.382 5.081 . 0 0 "[ . 1 . 2]" 1
162 1 18 VAL HB 1 92 ALA MB . . 4.080 2.945 2.590 3.064 . 0 0 "[ . 1 . 2]" 1
163 1 18 VAL HB 1 95 THR HA . . 5.630 4.739 3.757 5.693 0.063 16 0 "[ . 1 . 2]" 1
164 1 18 VAL HB 1 97 LEU HG . . 5.450 3.645 2.607 4.752 . 0 0 "[ . 1 . 2]" 1
165 1 18 VAL HB 1 97 LEU MD1 . . 5.000 3.760 2.541 4.983 . 0 0 "[ . 1 . 2]" 1
166 1 18 VAL HB 1 97 LEU MD2 . . 5.750 3.580 2.419 4.407 . 0 0 "[ . 1 . 2]" 1
167 1 18 VAL MG1 1 92 ALA MB . . 4.820 3.025 1.943 4.147 . 0 0 "[ . 1 . 2]" 1
168 1 18 VAL MG1 1 95 THR MG . . 5.750 5.482 4.922 5.815 0.065 8 0 "[ . 1 . 2]" 1
169 1 18 VAL MG1 1 97 LEU MD2 . . 4.360 2.565 1.995 3.257 . 0 0 "[ . 1 . 2]" 1
170 1 18 VAL MG2 1 92 ALA MB . . 4.820 3.041 2.069 4.076 . 0 0 "[ . 1 . 2]" 1
171 1 18 VAL MG2 1 95 THR MG . . 5.750 4.368 3.921 4.718 . 0 0 "[ . 1 . 2]" 1
172 1 18 VAL MG2 1 97 LEU MD2 . . 4.360 3.297 3.022 3.441 . 0 0 "[ . 1 . 2]" 1
173 1 18 VAL QG 1 61 GLU HA . . 4.280 2.890 2.557 3.207 . 0 0 "[ . 1 . 2]" 1
174 1 18 VAL QG 1 61 GLU HB2 . . 4.210 2.435 2.194 2.826 . 0 0 "[ . 1 . 2]" 1
175 1 18 VAL QG 1 61 GLU QG . . 4.420 2.196 2.100 2.376 . 0 0 "[ . 1 . 2]" 1
176 1 18 VAL QG 1 91 TYR HB3 . . 5.370 4.844 4.260 5.371 0.001 17 0 "[ . 1 . 2]" 1
177 1 18 VAL QG 1 91 TYR QD . . 5.710 4.678 4.202 5.119 . 0 0 "[ . 1 . 2]" 1
178 1 18 VAL QG 1 92 ALA H . . 4.230 3.176 2.878 3.456 . 0 0 "[ . 1 . 2]" 1
179 1 18 VAL QG 1 92 ALA MB . . 3.600 2.052 1.937 2.163 . 0 0 "[ . 1 . 2]" 1
180 1 18 VAL QG 1 94 PRO HA . . 5.710 4.669 4.370 5.018 . 0 0 "[ . 1 . 2]" 1
181 1 18 VAL QG 1 95 THR HA . . 4.290 2.900 2.487 3.247 . 0 0 "[ . 1 . 2]" 1
182 1 18 VAL QG 1 95 THR HB . . 5.200 4.374 4.135 4.571 . 0 0 "[ . 1 . 2]" 1
183 1 18 VAL QG 1 95 THR MG . . 5.290 4.205 3.775 4.525 . 0 0 "[ . 1 . 2]" 1
184 1 18 VAL QG 1 96 ARG HA . . 4.290 2.213 2.033 2.411 . 0 0 "[ . 1 . 2]" 1
185 1 18 VAL QG 1 96 ARG HE . . 5.580 4.762 4.282 5.145 . 0 0 "[ . 1 . 2]" 1
186 1 18 VAL QG 1 96 ARG QB . . 5.410 3.723 3.479 4.003 . 0 0 "[ . 1 . 2]" 1
187 1 18 VAL QG 1 97 LEU HA . . 5.170 4.014 3.762 4.142 . 0 0 "[ . 1 . 2]" 1
188 1 18 VAL QG 1 97 LEU HB2 . . 5.250 3.665 3.455 3.897 . 0 0 "[ . 1 . 2]" 1
189 1 18 VAL QG 1 97 LEU HG . . 4.290 2.054 1.966 2.153 . 0 0 "[ . 1 . 2]" 1
190 1 18 VAL QG 1 97 LEU MD2 . . 3.810 2.425 1.979 2.951 . 0 0 "[ . 1 . 2]" 1
191 1 19 LEU H 1 19 LEU HB2 . . 4.340 2.609 2.581 2.622 . 0 0 "[ . 1 . 2]" 1
192 1 19 LEU H 1 19 LEU HG . . 4.420 3.086 3.042 3.132 . 0 0 "[ . 1 . 2]" 1
193 1 19 LEU H 1 19 LEU MD1 . . 5.070 4.087 4.062 4.114 . 0 0 "[ . 1 . 2]" 1
194 1 19 LEU H 1 19 LEU MD2 . . 5.070 3.905 3.866 3.944 . 0 0 "[ . 1 . 2]" 1
195 1 19 LEU H 1 19 LEU QD . . 4.560 3.553 3.526 3.579 . 0 0 "[ . 1 . 2]" 1
196 1 19 LEU H 1 21 PHE QD . . 5.530 5.144 5.089 5.254 . 0 0 "[ . 1 . 2]" 1
197 1 19 LEU H 1 59 MET HA . . 5.230 4.644 4.550 4.767 . 0 0 "[ . 1 . 2]" 1
198 1 19 LEU H 1 59 MET HB3 . . 5.750 4.308 4.153 4.517 . 0 0 "[ . 1 . 2]" 1
199 1 19 LEU H 1 60 VAL H . . 4.530 2.823 2.744 2.942 . 0 0 "[ . 1 . 2]" 1
200 1 19 LEU H 1 60 VAL HB . . 5.150 3.845 3.545 4.050 . 0 0 "[ . 1 . 2]" 1
201 1 19 LEU H 1 60 VAL MG1 . . 5.750 4.585 4.344 4.703 . 0 0 "[ . 1 . 2]" 1
202 1 19 LEU H 1 60 VAL MG2 . . 5.750 4.886 4.716 5.025 . 0 0 "[ . 1 . 2]" 1
203 1 19 LEU H 1 60 VAL QG . . 5.220 4.203 4.012 4.314 . 0 0 "[ . 1 . 2]" 1
204 1 19 LEU H 1 62 PHE QD . . 5.390 4.771 4.402 4.968 . 0 0 "[ . 1 . 2]" 1
205 1 19 LEU H 1 62 PHE QE . . 5.470 4.974 4.462 5.233 . 0 0 "[ . 1 . 2]" 1
206 1 19 LEU H 1 68 ALA MB . . 5.380 4.776 4.618 4.880 . 0 0 "[ . 1 . 2]" 1
207 1 19 LEU HA 1 19 LEU QD . . 3.940 2.051 2.026 2.076 . 0 0 "[ . 1 . 2]" 1
208 1 19 LEU HA 1 20 LEU H . . 3.850 2.310 2.271 2.353 . 0 0 "[ . 1 . 2]" 1
209 1 19 LEU HA 1 20 LEU HB3 . . 5.750 4.398 4.350 4.431 . 0 0 "[ . 1 . 2]" 1
210 1 19 LEU HA 1 21 PHE QD . . 5.750 4.982 4.928 5.052 . 0 0 "[ . 1 . 2]" 1
211 1 19 LEU HA 1 60 VAL H . . 5.750 4.800 4.734 4.858 . 0 0 "[ . 1 . 2]" 1
212 1 19 LEU HA 1 60 VAL HB . . 5.750 5.579 5.377 5.746 . 0 0 "[ . 1 . 2]" 1
213 1 19 LEU HA 1 91 TYR HA . . 3.960 2.357 2.308 2.414 . 0 0 "[ . 1 . 2]" 1
214 1 19 LEU HA 1 91 TYR QD . . 4.950 4.006 3.807 4.063 . 0 0 "[ . 1 . 2]" 1
215 1 19 LEU HA 1 92 ALA H . . 4.430 2.567 2.442 2.855 . 0 0 "[ . 1 . 2]" 1
216 1 19 LEU HA 1 92 ALA MB . . 5.140 3.273 3.143 3.539 . 0 0 "[ . 1 . 2]" 1
217 1 19 LEU HB2 1 20 LEU H . . 5.060 3.670 3.597 3.733 . 0 0 "[ . 1 . 2]" 1
218 1 19 LEU HB2 1 21 PHE H . . 5.750 5.769 5.746 5.803 0.053 10 0 "[ . 1 . 2]" 1
219 1 19 LEU HB2 1 21 PHE QD . . 4.780 3.451 3.385 3.566 . 0 0 "[ . 1 . 2]" 1
220 1 19 LEU HB2 1 21 PHE QE . . 4.740 2.219 2.164 2.287 . 0 0 "[ . 1 . 2]" 1
221 1 19 LEU HB2 1 60 VAL H . . 5.490 3.224 3.083 3.480 . 0 0 "[ . 1 . 2]" 1
222 1 19 LEU HB2 1 60 VAL QG . . 5.490 3.557 3.448 3.661 . 0 0 "[ . 1 . 2]" 1
223 1 19 LEU HB2 1 62 PHE QE . . 4.670 3.646 3.212 3.935 . 0 0 "[ . 1 . 2]" 1
224 1 19 LEU HB2 1 89 ILE MG . . 4.870 3.734 3.659 3.804 . 0 0 "[ . 1 . 2]" 1
225 1 19 LEU HB3 1 20 LEU H . . 4.710 2.450 2.377 2.521 . 0 0 "[ . 1 . 2]" 1
226 1 19 LEU HB3 1 21 PHE QD . . 4.960 3.283 3.186 3.381 . 0 0 "[ . 1 . 2]" 1
227 1 19 LEU HB3 1 21 PHE QE . . 4.800 2.579 2.460 2.657 . 0 0 "[ . 1 . 2]" 1
228 1 19 LEU HB3 1 89 ILE MG . . 3.940 2.464 2.339 2.571 . 0 0 "[ . 1 . 2]" 1
229 1 19 LEU HG 1 62 PHE QD . . 4.960 3.694 3.596 3.747 . 0 0 "[ . 1 . 2]" 1
230 1 19 LEU HG 1 62 PHE QE . . 5.110 3.746 3.464 3.887 . 0 0 "[ . 1 . 2]" 1
231 1 19 LEU HG 1 68 ALA H . . 6.000 5.948 5.791 6.029 0.029 19 0 "[ . 1 . 2]" 1
232 1 19 LEU MD1 1 68 ALA HA . . 4.860 2.599 2.442 2.677 . 0 0 "[ . 1 . 2]" 1
233 1 19 LEU MD1 1 68 ALA MB . . 4.170 2.533 2.438 2.720 . 0 0 "[ . 1 . 2]" 1
234 1 19 LEU MD1 1 69 GLN H . . 5.520 4.917 4.848 4.967 . 0 0 "[ . 1 . 2]" 1
235 1 19 LEU MD1 1 69 GLN HA . . 5.320 4.714 4.661 4.805 . 0 0 "[ . 1 . 2]" 1
236 1 19 LEU MD1 1 72 LYS H . . 5.150 2.886 2.760 3.013 . 0 0 "[ . 1 . 2]" 1
237 1 19 LEU MD1 1 72 LYS HB2 . . 5.030 3.584 3.195 3.730 . 0 0 "[ . 1 . 2]" 1
238 1 19 LEU MD1 1 89 ILE MG . . 3.890 2.281 2.180 2.397 . 0 0 "[ . 1 . 2]" 1
239 1 19 LEU MD2 1 68 ALA HA . . 4.860 4.085 3.908 4.166 . 0 0 "[ . 1 . 2]" 1
240 1 19 LEU MD2 1 68 ALA MB . . 4.170 2.607 2.424 2.714 . 0 0 "[ . 1 . 2]" 1
241 1 19 LEU MD2 1 69 GLN H . . 5.520 5.213 4.987 5.298 . 0 0 "[ . 1 . 2]" 1
242 1 19 LEU MD2 1 69 GLN HA . . 5.320 4.443 4.364 4.510 . 0 0 "[ . 1 . 2]" 1
243 1 19 LEU MD2 1 72 LYS H . . 5.150 3.969 3.818 4.061 . 0 0 "[ . 1 . 2]" 1
244 1 19 LEU MD2 1 72 LYS HB2 . . 5.030 3.731 3.188 3.970 . 0 0 "[ . 1 . 2]" 1
245 1 19 LEU MD2 1 89 ILE MG . . 3.890 2.557 2.379 2.732 . 0 0 "[ . 1 . 2]" 1
246 1 19 LEU QD 1 20 LEU H . . 4.450 3.201 3.160 3.240 . 0 0 "[ . 1 . 2]" 1
247 1 19 LEU QD 1 21 PHE HZ . . 4.860 3.238 3.102 3.307 . 0 0 "[ . 1 . 2]" 1
248 1 19 LEU QD 1 21 PHE QE . . 3.970 2.496 2.440 2.592 . 0 0 "[ . 1 . 2]" 1
249 1 19 LEU QD 1 60 VAL QG . . 5.360 3.443 3.264 3.563 . 0 0 "[ . 1 . 2]" 1
250 1 19 LEU QD 1 62 PHE HZ . . 4.760 3.779 3.492 3.967 . 0 0 "[ . 1 . 2]" 1
251 1 19 LEU QD 1 62 PHE QE . . 4.250 2.171 2.095 2.246 . 0 0 "[ . 1 . 2]" 1
252 1 19 LEU QD 1 65 VAL HA . . 5.710 5.394 5.292 5.491 . 0 0 "[ . 1 . 2]" 1
253 1 19 LEU QD 1 68 ALA H . . 5.520 4.646 4.511 4.715 . 0 0 "[ . 1 . 2]" 1
254 1 19 LEU QD 1 68 ALA HA . . 4.050 2.571 2.419 2.644 . 0 0 "[ . 1 . 2]" 1
255 1 19 LEU QD 1 68 ALA MB . . 3.730 2.287 2.167 2.368 . 0 0 "[ . 1 . 2]" 1
256 1 19 LEU QD 1 69 GLN H . . 5.070 4.499 4.378 4.551 . 0 0 "[ . 1 . 2]" 1
257 1 19 LEU QD 1 69 GLN HA . . 4.890 4.066 4.038 4.115 . 0 0 "[ . 1 . 2]" 1
258 1 19 LEU QD 1 71 ALA H . . 5.360 3.814 3.739 3.867 . 0 0 "[ . 1 . 2]" 1
259 1 19 LEU QD 1 71 ALA MB . . 4.980 2.071 1.997 2.149 . 0 0 "[ . 1 . 2]" 1
260 1 19 LEU QD 1 72 LYS H . . 4.430 2.821 2.706 2.931 . 0 0 "[ . 1 . 2]" 1
261 1 19 LEU QD 1 72 LYS HA . . 4.910 3.649 3.513 3.765 . 0 0 "[ . 1 . 2]" 1
262 1 19 LEU QD 1 72 LYS HB2 . . 4.470 3.252 2.843 3.418 . 0 0 "[ . 1 . 2]" 1
263 1 19 LEU QD 1 72 LYS HB3 . . 4.830 2.333 2.219 2.911 . 0 0 "[ . 1 . 2]" 1
264 1 19 LEU QD 1 72 LYS HD2 . . 5.550 3.275 3.040 4.734 . 0 0 "[ . 1 . 2]" 1
265 1 19 LEU QD 1 90 GLU H . . 5.710 3.813 3.664 3.884 . 0 0 "[ . 1 . 2]" 1
266 1 19 LEU QD 1 91 TYR H . . 5.380 3.985 3.887 4.060 . 0 0 "[ . 1 . 2]" 1
267 1 19 LEU QD 1 91 TYR HA . . 4.510 2.207 2.164 2.339 . 0 0 "[ . 1 . 2]" 1
268 1 19 LEU QD 1 91 TYR HB2 . . 5.210 4.339 4.259 4.412 . 0 0 "[ . 1 . 2]" 1
269 1 19 LEU QD 1 91 TYR HB3 . . 5.550 3.681 3.568 3.811 . 0 0 "[ . 1 . 2]" 1
270 1 19 LEU QD 1 91 TYR QD . . 3.920 2.437 2.235 2.531 . 0 0 "[ . 1 . 2]" 1
271 1 19 LEU QD 1 91 TYR QE . . 4.250 2.671 2.592 2.750 . 0 0 "[ . 1 . 2]" 1
272 1 19 LEU QD 1 92 ALA H . . 5.060 3.430 3.318 3.703 . 0 0 "[ . 1 . 2]" 1
273 1 20 LEU H 1 20 LEU HB2 . . 4.200 3.104 3.035 3.213 . 0 0 "[ . 1 . 2]" 1
274 1 20 LEU H 1 20 LEU HB3 . . 4.200 2.535 2.474 2.653 . 0 0 "[ . 1 . 2]" 1
275 1 20 LEU H 1 20 LEU HG . . 5.240 4.362 4.330 4.604 . 0 0 "[ . 1 . 2]" 1
276 1 20 LEU H 1 20 LEU QD . . 5.050 3.900 3.725 3.932 . 0 0 "[ . 1 . 2]" 1
277 1 20 LEU H 1 21 PHE H . . 5.070 4.357 4.318 4.392 . 0 0 "[ . 1 . 2]" 1
278 1 20 LEU H 1 59 MET HA . . 5.430 4.878 4.724 4.946 . 0 0 "[ . 1 . 2]" 1
279 1 20 LEU H 1 89 ILE MG . . 4.740 3.164 2.897 3.304 . 0 0 "[ . 1 . 2]" 1
280 1 20 LEU H 1 90 GLU H . . 4.540 2.894 2.838 2.950 . 0 0 "[ . 1 . 2]" 1
281 1 20 LEU H 1 90 GLU HA . . 5.270 4.810 4.776 4.844 . 0 0 "[ . 1 . 2]" 1
282 1 20 LEU H 1 90 GLU HB2 . . 5.510 5.389 5.339 5.426 . 0 0 "[ . 1 . 2]" 1
283 1 20 LEU H 1 91 TYR HB3 . . 5.750 5.740 5.666 5.787 0.037 10 0 "[ . 1 . 2]" 1
284 1 20 LEU H 1 91 TYR QD . . 5.660 5.539 5.443 5.615 . 0 0 "[ . 1 . 2]" 1
285 1 20 LEU H 1 92 ALA H . . 4.570 3.841 3.734 4.055 . 0 0 "[ . 1 . 2]" 1
286 1 20 LEU H 1 92 ALA MB . . 4.730 3.613 3.466 3.757 . 0 0 "[ . 1 . 2]" 1
287 1 20 LEU HA 1 20 LEU MD1 . . 4.740 2.175 2.086 3.513 . 0 0 "[ . 1 . 2]" 1
288 1 20 LEU HA 1 20 LEU MD2 . . 4.740 3.848 3.423 3.880 . 0 0 "[ . 1 . 2]" 1
289 1 20 LEU HA 1 20 LEU QD . . 3.830 2.145 2.078 3.088 . 0 0 "[ . 1 . 2]" 1
290 1 20 LEU HA 1 21 PHE H . . 3.790 2.187 2.154 2.208 . 0 0 "[ . 1 . 2]" 1
291 1 20 LEU HA 1 21 PHE HB2 . . 5.340 4.329 4.246 4.363 . 0 0 "[ . 1 . 2]" 1
292 1 20 LEU HA 1 21 PHE QD . . 5.320 3.166 2.926 3.257 . 0 0 "[ . 1 . 2]" 1
293 1 20 LEU HA 1 59 MET HA . . 4.420 2.603 2.150 2.669 . 0 0 "[ . 1 . 2]" 1
294 1 20 LEU HA 1 59 MET HB3 . . 5.750 3.822 3.698 3.908 . 0 0 "[ . 1 . 2]" 1
295 1 20 LEU HA 1 59 MET HG2 . . 4.880 2.463 2.358 2.622 . 0 0 "[ . 1 . 2]" 1
296 1 20 LEU HA 1 59 MET HG3 . . 4.930 4.012 3.929 4.156 . 0 0 "[ . 1 . 2]" 1
297 1 20 LEU HA 1 59 MET ME . . 5.280 3.372 3.240 3.834 . 0 0 "[ . 1 . 2]" 1
298 1 20 LEU HA 1 60 VAL H . . 5.360 3.973 3.581 4.078 . 0 0 "[ . 1 . 2]" 1
299 1 20 LEU HA 1 92 ALA MB . . 4.820 3.596 3.466 3.821 . 0 0 "[ . 1 . 2]" 1
300 1 20 LEU HB2 1 21 PHE H . . 5.270 4.222 4.090 4.257 . 0 0 "[ . 1 . 2]" 1
301 1 20 LEU HB2 1 59 MET HG2 . . 5.510 3.571 2.716 3.777 . 0 0 "[ . 1 . 2]" 1
302 1 20 LEU HB2 1 90 GLU H . . 5.440 4.961 4.868 5.310 . 0 0 "[ . 1 . 2]" 1
303 1 20 LEU HB2 1 90 GLU QG . . 5.320 3.590 3.456 3.976 . 0 0 "[ . 1 . 2]" 1
304 1 20 LEU HB2 1 92 ALA H . . 4.930 4.198 4.160 4.252 . 0 0 "[ . 1 . 2]" 1
305 1 20 LEU HB2 1 92 ALA MB . . 4.670 2.423 2.267 2.584 . 0 0 "[ . 1 . 2]" 1
306 1 20 LEU HB2 1 93 LYS H . . 5.750 4.893 4.631 5.182 . 0 0 "[ . 1 . 2]" 1
307 1 20 LEU HB3 1 21 PHE H . . 5.160 4.210 4.173 4.257 . 0 0 "[ . 1 . 2]" 1
308 1 20 LEU HB3 1 59 MET HG2 . . 5.750 4.887 4.219 5.065 . 0 0 "[ . 1 . 2]" 1
309 1 20 LEU HB3 1 90 GLU H . . 4.810 3.396 3.273 3.878 . 0 0 "[ . 1 . 2]" 1
310 1 20 LEU HB3 1 90 GLU HB2 . . 4.920 4.628 4.571 4.927 0.007 10 0 "[ . 1 . 2]" 1
311 1 20 LEU HB3 1 90 GLU HB3 . . 5.540 4.930 4.776 5.322 . 0 0 "[ . 1 . 2]" 1
312 1 20 LEU HB3 1 90 GLU HG2 . . 5.180 2.768 2.498 3.185 . 0 0 "[ . 1 . 2]" 1
313 1 20 LEU HB3 1 90 GLU HG3 . . 5.180 2.290 2.229 2.519 . 0 0 "[ . 1 . 2]" 1
314 1 20 LEU HB3 1 90 GLU QG . . 4.650 2.184 2.095 2.429 . 0 0 "[ . 1 . 2]" 1
315 1 20 LEU HB3 1 92 ALA H . . 5.620 4.606 4.418 4.700 . 0 0 "[ . 1 . 2]" 1
316 1 20 LEU HB3 1 92 ALA MB . . 5.220 3.655 3.538 3.824 . 0 0 "[ . 1 . 2]" 1
317 1 20 LEU HG 1 21 PHE H . . 5.310 3.010 2.462 3.155 . 0 0 "[ . 1 . 2]" 1
318 1 20 LEU HG 1 57 GLN HB3 . . 5.410 4.448 3.509 4.795 . 0 0 "[ . 1 . 2]" 1
319 1 20 LEU HG 1 58 ALA H . . 5.470 4.722 3.549 4.861 . 0 0 "[ . 1 . 2]" 1
320 1 20 LEU HG 1 59 MET HG2 . . 5.750 4.401 2.583 4.555 . 0 0 "[ . 1 . 2]" 1
321 1 20 LEU HG 1 59 MET ME . . 5.280 4.863 3.972 5.015 . 0 0 "[ . 1 . 2]" 1
322 1 20 LEU HG 1 90 GLU QG . . 5.510 3.352 3.205 4.571 . 0 0 "[ . 1 . 2]" 1
323 1 20 LEU MD1 1 57 GLN HE22 . . 5.750 4.552 3.671 5.144 . 0 0 "[ . 1 . 2]" 1
324 1 20 LEU MD1 1 92 ALA H . . 5.750 5.779 5.358 5.826 0.076 4 0 "[ . 1 . 2]" 1
325 1 20 LEU MD1 1 92 ALA MB . . 4.670 3.509 3.400 3.597 . 0 0 "[ . 1 . 2]" 1
326 1 20 LEU MD2 1 57 GLN HE22 . . 5.750 4.159 2.900 4.962 . 0 0 "[ . 1 . 2]" 1
327 1 20 LEU MD2 1 92 ALA H . . 5.750 5.398 5.303 5.893 0.143 10 0 "[ . 1 . 2]" 1
328 1 20 LEU MD2 1 92 ALA MB . . 4.670 3.751 3.494 4.695 0.025 10 0 "[ . 1 . 2]" 1
329 1 20 LEU QD 1 21 PHE H . . 4.330 2.259 2.179 2.945 . 0 0 "[ . 1 . 2]" 1
330 1 20 LEU QD 1 57 GLN HB2 . . 5.110 4.088 3.748 4.334 . 0 0 "[ . 1 . 2]" 1
331 1 20 LEU QD 1 57 GLN HB3 . . 4.420 2.996 2.707 3.165 . 0 0 "[ . 1 . 2]" 1
332 1 20 LEU QD 1 57 GLN HE21 . . 5.520 4.400 2.893 5.088 . 0 0 "[ . 1 . 2]" 1
333 1 20 LEU QD 1 57 GLN HE22 . . 4.910 3.840 2.797 4.484 . 0 0 "[ . 1 . 2]" 1
334 1 20 LEU QD 1 57 GLN QG . . 5.540 3.977 3.472 4.190 . 0 0 "[ . 1 . 2]" 1
335 1 20 LEU QD 1 58 ALA H . . 4.570 3.389 3.270 3.772 . 0 0 "[ . 1 . 2]" 1
336 1 20 LEU QD 1 59 MET H . . 5.230 4.743 4.642 5.328 0.098 10 0 "[ . 1 . 2]" 1
337 1 20 LEU QD 1 59 MET HA . . 4.640 3.465 3.360 4.146 . 0 0 "[ . 1 . 2]" 1
338 1 20 LEU QD 1 59 MET HG2 . . 4.250 2.062 2.000 2.370 . 0 0 "[ . 1 . 2]" 1
339 1 20 LEU QD 1 59 MET HG3 . . 4.420 2.933 2.808 3.305 . 0 0 "[ . 1 . 2]" 1
340 1 20 LEU QD 1 59 MET ME . . 4.620 2.453 2.303 2.529 . 0 0 "[ . 1 . 2]" 1
341 1 20 LEU QD 1 60 VAL H . . 5.710 5.034 4.941 5.405 . 0 0 "[ . 1 . 2]" 1
342 1 20 LEU QD 1 60 VAL QG . . 5.670 5.309 5.223 5.497 . 0 0 "[ . 1 . 2]" 1
343 1 20 LEU QD 1 90 GLU HB2 . . 5.240 4.640 4.567 4.748 . 0 0 "[ . 1 . 2]" 1
344 1 20 LEU QD 1 90 GLU QG . . 5.100 2.490 2.327 2.612 . 0 0 "[ . 1 . 2]" 1
345 1 20 LEU QD 1 92 ALA MB . . 4.220 3.212 3.079 3.324 . 0 0 "[ . 1 . 2]" 1
346 1 20 LEU QD 1 93 LYS H . . 5.710 4.365 4.053 4.646 . 0 0 "[ . 1 . 2]" 1
347 1 20 LEU QD 1 94 PRO HD3 . . 5.710 5.527 5.371 5.682 . 0 0 "[ . 1 . 2]" 1
348 1 21 PHE H 1 21 PHE HB2 . . 4.230 2.452 2.414 2.478 . 0 0 "[ . 1 . 2]" 1
349 1 21 PHE H 1 21 PHE QD . . 4.610 2.803 2.714 2.889 . 0 0 "[ . 1 . 2]" 1
350 1 21 PHE H 1 22 THR H . . 5.230 4.473 4.450 4.494 . 0 0 "[ . 1 . 2]" 1
351 1 21 PHE H 1 57 GLN HB3 . . 5.750 4.224 3.988 4.472 . 0 0 "[ . 1 . 2]" 1
352 1 21 PHE H 1 58 ALA H . . 4.350 2.926 2.834 3.027 . 0 0 "[ . 1 . 2]" 1
353 1 21 PHE H 1 58 ALA MB . . 4.840 3.875 3.586 3.935 . 0 0 "[ . 1 . 2]" 1
354 1 21 PHE H 1 59 MET H . . 5.570 4.772 4.662 4.824 . 0 0 "[ . 1 . 2]" 1
355 1 21 PHE H 1 59 MET HA . . 4.670 3.111 2.977 3.181 . 0 0 "[ . 1 . 2]" 1
356 1 21 PHE H 1 59 MET HG3 . . 5.340 4.282 4.150 4.397 . 0 0 "[ . 1 . 2]" 1
357 1 21 PHE H 1 60 VAL H . . 5.180 4.999 4.826 5.103 . 0 0 "[ . 1 . 2]" 1
358 1 21 PHE H 1 90 GLU H . . 5.530 5.234 5.179 5.297 . 0 0 "[ . 1 . 2]" 1
359 1 21 PHE HA 1 21 PHE QE . . 5.400 4.703 4.666 4.735 . 0 0 "[ . 1 . 2]" 1
360 1 21 PHE HA 1 22 THR H . . 3.660 2.222 2.198 2.252 . 0 0 "[ . 1 . 2]" 1
361 1 21 PHE HA 1 22 THR HB . . 5.190 4.514 4.450 4.576 . 0 0 "[ . 1 . 2]" 1
362 1 21 PHE HA 1 22 THR MG . . 5.750 5.458 5.438 5.480 . 0 0 "[ . 1 . 2]" 1
363 1 21 PHE HA 1 57 GLN HA . . 5.750 5.570 5.429 5.686 . 0 0 "[ . 1 . 2]" 1
364 1 21 PHE HA 1 88 LYS H . . 5.370 4.144 4.096 4.216 . 0 0 "[ . 1 . 2]" 1
365 1 21 PHE HA 1 89 ILE H . . 5.310 5.082 4.995 5.150 . 0 0 "[ . 1 . 2]" 1
366 1 21 PHE HA 1 89 ILE HA . . 4.480 2.650 2.545 2.742 . 0 0 "[ . 1 . 2]" 1
367 1 21 PHE HA 1 89 ILE HG12 . . 5.320 3.003 2.819 4.229 . 0 0 "[ . 1 . 2]" 1
368 1 21 PHE HA 1 89 ILE HG13 . . 5.320 3.957 2.631 4.144 . 0 0 "[ . 1 . 2]" 1
369 1 21 PHE HA 1 89 ILE QG . . 4.830 2.857 2.606 3.030 . 0 0 "[ . 1 . 2]" 1
370 1 21 PHE HA 1 89 ILE MG . . 5.270 3.635 3.433 3.807 . 0 0 "[ . 1 . 2]" 1
371 1 21 PHE HA 1 90 GLU H . . 4.730 3.985 3.904 4.067 . 0 0 "[ . 1 . 2]" 1
372 1 21 PHE HB2 1 22 THR H . . 5.190 4.112 4.015 4.174 . 0 0 "[ . 1 . 2]" 1
373 1 21 PHE HB2 1 23 ILE MD . . 5.220 4.111 3.735 5.264 0.044 3 0 "[ . 1 . 2]" 1
374 1 21 PHE HB2 1 35 LEU QD . . 5.270 3.621 3.249 3.744 . 0 0 "[ . 1 . 2]" 1
375 1 21 PHE HB2 1 58 ALA H . . 4.670 2.878 2.764 3.146 . 0 0 "[ . 1 . 2]" 1
376 1 21 PHE HB2 1 58 ALA MB . . 4.210 2.268 2.194 2.340 . 0 0 "[ . 1 . 2]" 1
377 1 21 PHE HB2 1 89 ILE MD . . 6.000 5.562 5.491 5.698 . 0 0 "[ . 1 . 2]" 1
378 1 21 PHE HB3 1 22 THR H . . 4.440 2.936 2.785 3.021 . 0 0 "[ . 1 . 2]" 1
379 1 21 PHE HB3 1 23 ILE HG13 . . 5.590 4.941 4.092 5.151 . 0 0 "[ . 1 . 2]" 1
380 1 21 PHE HB3 1 23 ILE MD . . 4.640 3.273 3.055 4.468 . 0 0 "[ . 1 . 2]" 1
381 1 21 PHE HB3 1 58 ALA MB . . 4.470 3.209 3.085 3.458 . 0 0 "[ . 1 . 2]" 1
382 1 21 PHE HB3 1 87 LEU QD . . 4.570 3.659 3.385 3.812 . 0 0 "[ . 1 . 2]" 1
383 1 21 PHE HB3 1 88 LYS H . . 5.560 4.402 4.211 4.584 . 0 0 "[ . 1 . 2]" 1
384 1 21 PHE HZ 1 60 VAL HB . . 5.750 4.048 3.786 4.441 . 0 0 "[ . 1 . 2]" 1
385 1 21 PHE HZ 1 62 PHE HZ . . 5.310 4.138 3.893 4.439 . 0 0 "[ . 1 . 2]" 1
386 1 21 PHE HZ 1 71 ALA MB . . 5.050 3.198 3.043 3.313 . 0 0 "[ . 1 . 2]" 1
387 1 21 PHE HZ 1 75 LEU HG . . 5.750 5.387 5.218 5.555 . 0 0 "[ . 1 . 2]" 1
388 1 21 PHE HZ 1 75 LEU MD1 . . 4.360 2.856 2.700 3.000 . 0 0 "[ . 1 . 2]" 1
389 1 21 PHE HZ 1 75 LEU MD2 . . 5.530 5.205 5.067 5.325 . 0 0 "[ . 1 . 2]" 1
390 1 21 PHE HZ 1 87 LEU QD . . 5.710 4.885 4.695 5.045 . 0 0 "[ . 1 . 2]" 1
391 1 21 PHE HZ 1 89 ILE MD . . 4.510 2.659 2.493 4.033 . 0 0 "[ . 1 . 2]" 1
392 1 21 PHE HZ 1 89 ILE MG . . 5.280 3.660 3.508 3.777 . 0 0 "[ . 1 . 2]" 1
393 1 21 PHE QD 1 22 THR H . . 5.180 4.181 4.049 4.253 . 0 0 "[ . 1 . 2]" 1
394 1 21 PHE QD 1 35 LEU MD1 . . 5.350 4.216 3.735 4.413 . 0 0 "[ . 1 . 2]" 1
395 1 21 PHE QD 1 35 LEU MD2 . . 5.350 3.305 3.099 3.471 . 0 0 "[ . 1 . 2]" 1
396 1 21 PHE QD 1 35 LEU QD . . 4.730 3.190 2.978 3.334 . 0 0 "[ . 1 . 2]" 1
397 1 21 PHE QD 1 38 ILE MD . . 4.660 3.881 3.721 4.002 . 0 0 "[ . 1 . 2]" 1
398 1 21 PHE QD 1 58 ALA MB . . 4.980 3.869 3.779 3.965 . 0 0 "[ . 1 . 2]" 1
399 1 21 PHE QD 1 59 MET HA . . 5.330 3.191 2.957 3.447 . 0 0 "[ . 1 . 2]" 1
400 1 21 PHE QD 1 60 VAL H . . 5.020 3.751 3.597 3.988 . 0 0 "[ . 1 . 2]" 1
401 1 21 PHE QD 1 60 VAL HB . . 5.430 3.936 3.647 4.133 . 0 0 "[ . 1 . 2]" 1
402 1 21 PHE QD 1 87 LEU HG . . 5.570 5.470 5.143 5.597 0.027 17 0 "[ . 1 . 2]" 1
403 1 21 PHE QD 1 87 LEU QD . . 4.220 2.661 2.428 2.756 . 0 0 "[ . 1 . 2]" 1
404 1 21 PHE QD 1 88 LYS H . . 5.660 4.512 4.375 4.686 . 0 0 "[ . 1 . 2]" 1
405 1 21 PHE QD 1 89 ILE HA . . 5.290 4.313 4.247 4.440 . 0 0 "[ . 1 . 2]" 1
406 1 21 PHE QD 1 89 ILE HG12 . . 5.460 3.178 3.085 3.631 . 0 0 "[ . 1 . 2]" 1
407 1 21 PHE QD 1 89 ILE HG13 . . 5.460 4.032 3.085 4.177 . 0 0 "[ . 1 . 2]" 1
408 1 21 PHE QD 1 89 ILE MD . . 4.610 3.384 3.214 3.522 . 0 0 "[ . 1 . 2]" 1
409 1 21 PHE QD 1 89 ILE QG . . 4.990 3.048 2.925 3.106 . 0 0 "[ . 1 . 2]" 1
410 1 21 PHE QD 1 89 ILE MG . . 4.540 3.339 3.192 3.483 . 0 0 "[ . 1 . 2]" 1
411 1 21 PHE QD 1 90 GLU H . . 5.270 4.701 4.620 4.842 . 0 0 "[ . 1 . 2]" 1
412 1 21 PHE QE 1 35 LEU HA . . 5.480 5.429 5.219 5.519 0.039 11 0 "[ . 1 . 2]" 1
413 1 21 PHE QE 1 38 ILE MD . . 4.690 3.026 2.668 3.330 . 0 0 "[ . 1 . 2]" 1
414 1 21 PHE QE 1 60 VAL H . . 5.470 4.051 3.782 4.360 . 0 0 "[ . 1 . 2]" 1
415 1 21 PHE QE 1 60 VAL HB . . 5.070 2.642 2.498 2.781 . 0 0 "[ . 1 . 2]" 1
416 1 21 PHE QE 1 60 VAL QG . . 4.450 2.867 2.740 2.950 . 0 0 "[ . 1 . 2]" 1
417 1 21 PHE QE 1 72 LYS H . . 5.750 5.829 5.804 5.870 0.120 6 0 "[ . 1 . 2]" 1
418 1 21 PHE QE 1 72 LYS HA . . 5.620 5.116 5.065 5.190 . 0 0 "[ . 1 . 2]" 1
419 1 21 PHE QE 1 75 LEU MD1 . . 4.780 2.788 2.497 3.132 . 0 0 "[ . 1 . 2]" 1
420 1 21 PHE QE 1 75 LEU MD2 . . 5.210 4.228 4.041 4.445 . 0 0 "[ . 1 . 2]" 1
421 1 21 PHE QE 1 87 LEU QD . . 5.270 2.893 2.686 3.060 . 0 0 "[ . 1 . 2]" 1
422 1 21 PHE QE 1 89 ILE MD . . 4.400 2.439 2.353 2.923 . 0 0 "[ . 1 . 2]" 1
423 1 22 THR H 1 22 THR HB . . 4.000 2.752 2.725 2.797 . 0 0 "[ . 1 . 2]" 1
424 1 22 THR H 1 23 ILE H . . 5.120 4.370 4.346 4.391 . 0 0 "[ . 1 . 2]" 1
425 1 22 THR H 1 23 ILE MD . . 5.310 3.718 3.536 5.399 0.089 3 0 "[ . 1 . 2]" 1
426 1 22 THR H 1 24 LEU QD . . 5.920 5.139 5.021 5.286 . 0 0 "[ . 1 . 2]" 1
427 1 22 THR H 1 57 GLN QG . . 5.470 4.826 4.599 5.011 . 0 0 "[ . 1 . 2]" 1
428 1 22 THR H 1 87 LEU HA . . 5.100 4.332 4.233 4.414 . 0 0 "[ . 1 . 2]" 1
429 1 22 THR H 1 88 LYS H . . 4.450 2.677 2.602 2.748 . 0 0 "[ . 1 . 2]" 1
430 1 22 THR H 1 88 LYS HB2 . . 5.310 4.771 4.598 4.867 . 0 0 "[ . 1 . 2]" 1
431 1 22 THR H 1 88 LYS HB3 . . 4.580 3.332 3.123 3.398 . 0 0 "[ . 1 . 2]" 1
432 1 22 THR H 1 88 LYS HG3 . . 5.750 5.785 5.702 5.853 0.103 15 0 "[ . 1 . 2]" 1
433 1 22 THR H 1 88 LYS QD . . 5.550 4.077 3.772 4.775 . 0 0 "[ . 1 . 2]" 1
434 1 22 THR H 1 89 ILE HA . . 4.660 3.818 3.726 3.954 . 0 0 "[ . 1 . 2]" 1
435 1 22 THR H 1 89 ILE QG . . 5.360 3.856 3.754 3.997 . 0 0 "[ . 1 . 2]" 1
436 1 22 THR H 1 90 GLU H . . 5.690 5.530 5.445 5.659 . 0 0 "[ . 1 . 2]" 1
437 1 22 THR HA 1 23 ILE H . . 4.190 2.246 2.219 2.294 . 0 0 "[ . 1 . 2]" 1
438 1 22 THR HA 1 57 GLN HA . . 4.590 2.336 2.237 2.417 . 0 0 "[ . 1 . 2]" 1
439 1 22 THR HA 1 57 GLN HE21 . . 5.170 4.218 3.500 4.661 . 0 0 "[ . 1 . 2]" 1
440 1 22 THR HA 1 57 GLN HG2 . . 5.130 2.322 2.192 2.479 . 0 0 "[ . 1 . 2]" 1
441 1 22 THR HA 1 57 GLN HG3 . . 5.130 3.788 3.648 3.917 . 0 0 "[ . 1 . 2]" 1
442 1 22 THR HA 1 57 GLN QG . . 4.690 2.302 2.176 2.452 . 0 0 "[ . 1 . 2]" 1
443 1 22 THR HA 1 58 ALA H . . 5.050 3.763 3.662 3.924 . 0 0 "[ . 1 . 2]" 1
444 1 22 THR HB 1 23 ILE H . . 5.100 4.049 3.977 4.101 . 0 0 "[ . 1 . 2]" 1
445 1 22 THR HB 1 24 LEU QD . . 4.830 3.681 3.509 3.800 . 0 0 "[ . 1 . 2]" 1
446 1 22 THR HB 1 88 LYS H . . 4.790 3.964 3.794 4.097 . 0 0 "[ . 1 . 2]" 1
447 1 22 THR HB 1 88 LYS HB2 . . 4.730 3.954 3.735 4.181 . 0 0 "[ . 1 . 2]" 1
448 1 22 THR HB 1 88 LYS HB3 . . 4.120 2.307 2.194 2.479 . 0 0 "[ . 1 . 2]" 1
449 1 22 THR HB 1 88 LYS QD . . 4.780 2.836 2.524 3.340 . 0 0 "[ . 1 . 2]" 1
450 1 22 THR HB 1 88 LYS QE . . 5.330 4.724 4.452 4.957 . 0 0 "[ . 1 . 2]" 1
451 1 22 THR MG 1 23 ILE H . . 3.990 2.396 2.322 2.474 . 0 0 "[ . 1 . 2]" 1
452 1 22 THR MG 1 23 ILE HG13 . . 5.630 5.331 4.460 5.483 . 0 0 "[ . 1 . 2]" 1
453 1 22 THR MG 1 24 LEU H . . 5.510 4.470 4.371 4.608 . 0 0 "[ . 1 . 2]" 1
454 1 22 THR MG 1 24 LEU HA . . 5.510 3.807 3.673 4.075 . 0 0 "[ . 1 . 2]" 1
455 1 22 THR MG 1 24 LEU HG . . 5.140 4.057 3.872 4.215 . 0 0 "[ . 1 . 2]" 1
456 1 22 THR MG 1 24 LEU QD . . 3.690 2.577 2.398 2.730 . 0 0 "[ . 1 . 2]" 1
457 1 22 THR MG 1 56 VAL H . . 5.310 4.047 3.770 4.434 . 0 0 "[ . 1 . 2]" 1
458 1 22 THR MG 1 56 VAL QG . . 4.990 4.490 3.341 4.964 . 0 0 "[ . 1 . 2]" 1
459 1 22 THR MG 1 57 GLN HA . . 4.950 3.822 3.709 3.947 . 0 0 "[ . 1 . 2]" 1
460 1 22 THR MG 1 57 GLN HE21 . . 4.690 2.652 2.462 2.836 . 0 0 "[ . 1 . 2]" 1
461 1 22 THR MG 1 57 GLN HE22 . . 4.820 3.933 3.773 4.177 . 0 0 "[ . 1 . 2]" 1
462 1 22 THR MG 1 57 GLN HG2 . . 4.670 2.334 2.237 2.420 . 0 0 "[ . 1 . 2]" 1
463 1 22 THR MG 1 57 GLN HG3 . . 4.670 3.211 3.021 3.341 . 0 0 "[ . 1 . 2]" 1
464 1 22 THR MG 1 88 LYS H . . 5.610 4.740 4.601 4.856 . 0 0 "[ . 1 . 2]" 1
465 1 22 THR MG 1 88 LYS HB2 . . 5.310 4.473 4.209 4.705 . 0 0 "[ . 1 . 2]" 1
466 1 22 THR MG 1 88 LYS HB3 . . 4.830 3.512 3.389 3.611 . 0 0 "[ . 1 . 2]" 1
467 1 22 THR MG 1 88 LYS QD . . 4.480 3.804 3.308 4.397 . 0 0 "[ . 1 . 2]" 1
468 1 22 THR MG 1 88 LYS QE . . 5.200 5.097 4.858 5.226 0.026 16 0 "[ . 1 . 2]" 1
469 1 23 ILE H 1 23 ILE HB . . 3.970 2.530 2.464 2.660 . 0 0 "[ . 1 . 2]" 1
470 1 23 ILE H 1 23 ILE HG12 . . 4.830 4.200 3.809 4.297 . 0 0 "[ . 1 . 2]" 1
471 1 23 ILE H 1 23 ILE HG13 . . 4.330 3.834 2.755 3.964 . 0 0 "[ . 1 . 2]" 1
472 1 23 ILE H 1 23 ILE MD . . 4.370 2.452 2.321 4.073 . 0 0 "[ . 1 . 2]" 1
473 1 23 ILE H 1 24 LEU H . . 5.210 4.514 4.474 4.531 . 0 0 "[ . 1 . 2]" 1
474 1 23 ILE H 1 56 VAL H . . 5.540 4.198 3.817 4.712 . 0 0 "[ . 1 . 2]" 1
475 1 23 ILE H 1 56 VAL HB . . 5.750 4.214 3.647 5.696 . 0 0 "[ . 1 . 2]" 1
476 1 23 ILE H 1 56 VAL QG . . 4.660 3.596 2.325 4.111 . 0 0 "[ . 1 . 2]" 1
477 1 23 ILE H 1 57 GLN HA . . 4.330 3.370 3.272 3.539 . 0 0 "[ . 1 . 2]" 1
478 1 23 ILE H 1 57 GLN HB2 . . 5.900 5.840 5.703 6.035 0.135 3 0 "[ . 1 . 2]" 1
479 1 23 ILE H 1 57 GLN QG . . 4.750 3.424 3.260 3.687 . 0 0 "[ . 1 . 2]" 1
480 1 23 ILE H 1 58 ALA H . . 5.750 5.459 5.353 5.705 . 0 0 "[ . 1 . 2]" 1
481 1 23 ILE H 1 88 LYS H . . 5.750 5.315 5.242 5.349 . 0 0 "[ . 1 . 2]" 1
482 1 23 ILE HA 1 23 ILE HG13 . . 4.510 2.512 2.442 3.091 . 0 0 "[ . 1 . 2]" 1
483 1 23 ILE HA 1 24 LEU H . . 3.910 2.227 2.202 2.242 . 0 0 "[ . 1 . 2]" 1
484 1 23 ILE HA 1 24 LEU HA . . 5.220 4.358 4.338 4.394 . 0 0 "[ . 1 . 2]" 1
485 1 23 ILE HA 1 24 LEU HB2 . . 5.260 4.627 4.594 4.671 . 0 0 "[ . 1 . 2]" 1
486 1 23 ILE HA 1 25 ASN H . . 4.910 4.088 3.839 4.182 . 0 0 "[ . 1 . 2]" 1
487 1 23 ILE HA 1 86 THR H . . 5.230 5.174 5.131 5.217 . 0 0 "[ . 1 . 2]" 1
488 1 23 ILE HB 1 24 LEU H . . 4.990 4.151 4.091 4.193 . 0 0 "[ . 1 . 2]" 1
489 1 23 ILE HB 1 26 PRO HB2 . . 5.340 4.561 4.307 4.931 . 0 0 "[ . 1 . 2]" 1
490 1 23 ILE HB 1 26 PRO HB3 . . 4.800 2.863 2.622 3.213 . 0 0 "[ . 1 . 2]" 1
491 1 23 ILE HB 1 26 PRO HD3 . . 5.300 3.670 3.447 4.082 . 0 0 "[ . 1 . 2]" 1
492 1 23 ILE HB 1 26 PRO QG . . 5.150 3.884 3.598 4.373 . 0 0 "[ . 1 . 2]" 1
493 1 23 ILE HB 1 56 VAL MG1 . . 3.990 2.867 2.043 3.440 . 0 0 "[ . 1 . 2]" 1
494 1 23 ILE HB 1 56 VAL MG2 . . 3.990 3.583 2.305 3.983 . 0 0 "[ . 1 . 2]" 1
495 1 23 ILE HG12 1 30 ILE MD . . 5.220 3.669 3.428 4.467 . 0 0 "[ . 1 . 2]" 1
496 1 23 ILE HG12 1 30 ILE MG . . 4.440 3.554 3.030 4.486 0.046 3 0 "[ . 1 . 2]" 1
497 1 23 ILE HG12 1 56 VAL QG . . 5.310 3.126 2.758 3.858 . 0 0 "[ . 1 . 2]" 1
498 1 23 ILE HG13 1 24 LEU H . . 5.570 4.323 4.232 5.089 . 0 0 "[ . 1 . 2]" 1
499 1 23 ILE HG13 1 30 ILE MD . . 5.020 4.297 4.151 5.055 0.035 3 0 "[ . 1 . 2]" 1
500 1 23 ILE HG13 1 35 LEU QD . . 5.500 4.371 3.924 4.641 . 0 0 "[ . 1 . 2]" 1
501 1 23 ILE HG13 1 56 VAL QG . . 4.850 4.121 2.804 4.451 . 0 0 "[ . 1 . 2]" 1
502 1 23 ILE HG13 1 57 GLN HA . . 5.440 5.441 3.807 5.593 0.153 19 0 "[ . 1 . 2]" 1
503 1 23 ILE HG13 1 87 LEU QD . . 5.100 2.307 2.180 3.449 . 0 0 "[ . 1 . 2]" 1
504 1 23 ILE MD 1 56 VAL HB . . 4.800 3.498 2.798 4.816 0.016 10 0 "[ . 1 . 2]" 1
505 1 23 ILE MD 1 56 VAL MG1 . . 4.430 2.370 2.071 3.527 . 0 0 "[ . 1 . 2]" 1
506 1 23 ILE MD 1 56 VAL MG2 . . 4.430 3.697 2.061 4.446 0.016 18 0 "[ . 1 . 2]" 1
507 1 23 ILE MD 1 56 VAL QG . . 3.540 2.106 2.037 2.244 . 0 0 "[ . 1 . 2]" 1
508 1 23 ILE MD 1 57 GLN H . . 5.570 3.935 3.743 5.232 . 0 0 "[ . 1 . 2]" 1
509 1 23 ILE MD 1 57 GLN HA . . 5.230 2.783 2.576 4.667 . 0 0 "[ . 1 . 2]" 1
510 1 23 ILE MD 1 58 ALA H . . 5.550 3.938 3.727 5.441 . 0 0 "[ . 1 . 2]" 1
511 1 23 ILE MG 1 24 LEU H . . 4.210 2.445 2.394 2.507 . 0 0 "[ . 1 . 2]" 1
512 1 23 ILE MG 1 24 LEU HA . . 5.490 3.998 3.858 4.063 . 0 0 "[ . 1 . 2]" 1
513 1 23 ILE MG 1 25 ASN H . . 5.250 2.314 2.098 2.457 . 0 0 "[ . 1 . 2]" 1
514 1 23 ILE MG 1 26 PRO HA . . 4.510 2.441 2.305 2.702 . 0 0 "[ . 1 . 2]" 1
515 1 23 ILE MG 1 26 PRO HB2 . . 4.950 3.681 3.571 3.997 . 0 0 "[ . 1 . 2]" 1
516 1 23 ILE MG 1 26 PRO HB3 . . 4.650 2.303 2.199 2.622 . 0 0 "[ . 1 . 2]" 1
517 1 23 ILE MG 1 26 PRO QG . . 4.730 3.471 3.344 3.800 . 0 0 "[ . 1 . 2]" 1
518 1 23 ILE MG 1 30 ILE HG13 . . 4.730 3.464 3.034 3.764 . 0 0 "[ . 1 . 2]" 1
519 1 23 ILE MG 1 30 ILE MD . . 4.490 3.891 3.429 4.066 . 0 0 "[ . 1 . 2]" 1
520 1 23 ILE MG 1 56 VAL MG1 . . 4.640 3.528 2.988 3.995 . 0 0 "[ . 1 . 2]" 1
521 1 23 ILE MG 1 56 VAL MG2 . . 4.640 3.936 3.179 4.241 . 0 0 "[ . 1 . 2]" 1
522 1 23 ILE MG 1 56 VAL QG . . 4.170 3.282 2.738 3.634 . 0 0 "[ . 1 . 2]" 1
523 1 23 ILE MG 1 85 CYS H . . 4.580 3.812 3.648 4.003 . 0 0 "[ . 1 . 2]" 1
524 1 23 ILE MG 1 85 CYS HA . . 4.060 2.130 2.029 2.267 . 0 0 "[ . 1 . 2]" 1
525 1 23 ILE MG 1 85 CYS QB . . 4.520 2.924 2.792 3.030 . 0 0 "[ . 1 . 2]" 1
526 1 23 ILE MG 1 86 THR H . . 4.270 3.553 3.476 3.682 . 0 0 "[ . 1 . 2]" 1
527 1 24 LEU H 1 24 LEU HB2 . . 3.930 2.504 2.469 2.585 . 0 0 "[ . 1 . 2]" 1
528 1 24 LEU H 1 24 LEU HG . . 5.100 2.399 2.314 2.516 . 0 0 "[ . 1 . 2]" 1
529 1 24 LEU H 1 24 LEU MD1 . . 4.850 3.731 3.683 3.822 . 0 0 "[ . 1 . 2]" 1
530 1 24 LEU H 1 24 LEU MD2 . . 4.850 3.397 3.315 3.461 . 0 0 "[ . 1 . 2]" 1
531 1 24 LEU H 1 24 LEU QD . . 4.040 3.151 3.090 3.217 . 0 0 "[ . 1 . 2]" 1
532 1 24 LEU H 1 25 ASN H . . 5.380 2.286 2.120 2.378 . 0 0 "[ . 1 . 2]" 1
533 1 24 LEU H 1 26 PRO HD3 . . 5.290 4.021 3.922 4.175 . 0 0 "[ . 1 . 2]" 1
534 1 24 LEU H 1 85 CYS HA . . 5.540 4.063 3.942 4.190 . 0 0 "[ . 1 . 2]" 1
535 1 24 LEU H 1 86 THR H . . 4.460 3.715 3.681 3.781 . 0 0 "[ . 1 . 2]" 1
536 1 24 LEU H 1 86 THR HB . . 4.510 3.351 3.062 3.483 . 0 0 "[ . 1 . 2]" 1
537 1 24 LEU H 1 86 THR MG . . 5.050 4.420 4.246 4.546 . 0 0 "[ . 1 . 2]" 1
538 1 24 LEU H 1 88 LYS H . . 5.320 5.245 5.098 5.366 0.046 3 0 "[ . 1 . 2]" 1
539 1 24 LEU HA 1 24 LEU QD . . 3.770 2.061 2.033 2.088 . 0 0 "[ . 1 . 2]" 1
540 1 24 LEU HA 1 26 PRO HD2 . . 5.400 4.673 4.523 4.867 . 0 0 "[ . 1 . 2]" 1
541 1 24 LEU HA 1 26 PRO HD3 . . 4.820 3.727 3.505 3.824 . 0 0 "[ . 1 . 2]" 1
542 1 24 LEU HA 1 86 THR HB . . 5.670 5.117 4.856 5.270 . 0 0 "[ . 1 . 2]" 1
543 1 24 LEU HB2 1 25 ASN H . . 4.660 2.876 2.757 3.211 . 0 0 "[ . 1 . 2]" 1
544 1 24 LEU HB2 1 25 ASN HD21 . . 5.750 4.835 3.960 5.177 . 0 0 "[ . 1 . 2]" 1
545 1 24 LEU HB2 1 86 THR H . . 5.190 3.720 3.595 4.023 . 0 0 "[ . 1 . 2]" 1
546 1 24 LEU HB2 1 86 THR HB . . 4.050 2.228 2.053 2.410 . 0 0 "[ . 1 . 2]" 1
547 1 24 LEU HB2 1 86 THR MG . . 4.970 3.668 3.340 3.901 . 0 0 "[ . 1 . 2]" 1
548 1 24 LEU HB3 1 25 ASN H . . 4.690 3.935 3.839 4.185 . 0 0 "[ . 1 . 2]" 1
549 1 24 LEU HB3 1 25 ASN HD21 . . 5.750 5.574 5.050 5.794 0.044 16 0 "[ . 1 . 2]" 1
550 1 24 LEU HB3 1 25 ASN HD22 . . 5.720 4.938 4.630 5.109 . 0 0 "[ . 1 . 2]" 1
551 1 24 LEU HB3 1 86 THR HB . . 4.900 3.854 3.772 3.999 . 0 0 "[ . 1 . 2]" 1
552 1 24 LEU HB3 1 86 THR MG . . 5.410 4.746 4.488 4.960 . 0 0 "[ . 1 . 2]" 1
553 1 24 LEU HG 1 86 THR HB . . 4.450 3.390 3.325 3.505 . 0 0 "[ . 1 . 2]" 1
554 1 24 LEU MD1 1 86 THR HB . . 4.580 2.508 2.371 2.872 . 0 0 "[ . 1 . 2]" 1
555 1 24 LEU MD1 1 86 THR MG . . 4.650 2.481 2.398 2.570 . 0 0 "[ . 1 . 2]" 1
556 1 24 LEU MD1 1 88 LYS HA . . 5.750 4.481 4.221 4.789 . 0 0 "[ . 1 . 2]" 1
557 1 24 LEU MD1 1 88 LYS HG2 . . 5.750 4.484 3.589 5.418 . 0 0 "[ . 1 . 2]" 1
558 1 24 LEU MD2 1 86 THR HB . . 4.580 4.614 4.579 4.666 0.086 10 0 "[ . 1 . 2]" 1
559 1 24 LEU MD2 1 86 THR MG . . 4.650 4.622 4.531 4.681 0.031 18 0 "[ . 1 . 2]" 1
560 1 24 LEU MD2 1 88 LYS HA . . 5.750 5.028 4.736 5.529 . 0 0 "[ . 1 . 2]" 1
561 1 24 LEU MD2 1 88 LYS HG2 . . 5.750 4.554 3.806 5.141 . 0 0 "[ . 1 . 2]" 1
562 1 24 LEU QD 1 25 ASN H . . 5.070 4.180 4.136 4.257 . 0 0 "[ . 1 . 2]" 1
563 1 24 LEU QD 1 26 PRO HD3 . . 5.400 4.974 4.853 5.070 . 0 0 "[ . 1 . 2]" 1
564 1 24 LEU QD 1 86 THR HB . . 4.070 2.496 2.363 2.846 . 0 0 "[ . 1 . 2]" 1
565 1 24 LEU QD 1 86 THR MG . . 3.660 2.471 2.390 2.558 . 0 0 "[ . 1 . 2]" 1
566 1 24 LEU QD 1 88 LYS H . . 4.910 4.319 4.185 4.520 . 0 0 "[ . 1 . 2]" 1
567 1 24 LEU QD 1 88 LYS HA . . 5.290 4.186 3.960 4.516 . 0 0 "[ . 1 . 2]" 1
568 1 24 LEU QD 1 88 LYS HB2 . . 4.030 2.449 2.287 2.721 . 0 0 "[ . 1 . 2]" 1
569 1 24 LEU QD 1 88 LYS HB3 . . 5.180 3.076 2.839 3.447 . 0 0 "[ . 1 . 2]" 1
570 1 24 LEU QD 1 88 LYS HG2 . . 5.210 4.006 3.306 4.524 . 0 0 "[ . 1 . 2]" 1
571 1 24 LEU QD 1 88 LYS HG3 . . 4.410 3.170 2.638 3.921 . 0 0 "[ . 1 . 2]" 1
572 1 24 LEU QD 1 88 LYS QD . . 4.800 3.719 2.467 4.480 . 0 0 "[ . 1 . 2]" 1
573 1 24 LEU QD 1 88 LYS QE . . 5.000 4.392 4.073 4.936 . 0 0 "[ . 1 . 2]" 1
574 1 25 ASN H 1 26 PRO HA . . 5.460 4.279 4.221 4.312 . 0 0 "[ . 1 . 2]" 1
575 1 25 ASN H 1 26 PRO HD2 . . 4.840 3.876 3.813 3.986 . 0 0 "[ . 1 . 2]" 1
576 1 25 ASN H 1 26 PRO HD3 . . 4.430 2.960 2.838 3.066 . 0 0 "[ . 1 . 2]" 1
577 1 25 ASN H 1 26 PRO QG . . 5.510 4.841 4.741 4.925 . 0 0 "[ . 1 . 2]" 1
578 1 25 ASN H 1 85 CYS HA . . 4.650 2.962 2.861 3.063 . 0 0 "[ . 1 . 2]" 1
579 1 25 ASN H 1 86 THR HB . . 5.030 3.762 3.534 3.967 . 0 0 "[ . 1 . 2]" 1
580 1 25 ASN HA 1 25 ASN HD22 . . 5.430 4.706 4.644 4.734 . 0 0 "[ . 1 . 2]" 1
581 1 25 ASN HA 1 26 PRO HD2 . . 4.210 2.242 2.178 2.295 . 0 0 "[ . 1 . 2]" 1
582 1 25 ASN HA 1 26 PRO HD3 . . 4.420 3.030 2.915 3.138 . 0 0 "[ . 1 . 2]" 1
583 1 25 ASN HA 1 26 PRO QG . . 4.860 4.082 4.038 4.125 . 0 0 "[ . 1 . 2]" 1
584 1 25 ASN HA 1 27 ILE H . . 5.750 4.643 3.724 5.341 . 0 0 "[ . 1 . 2]" 1
585 1 25 ASN HA 1 27 ILE QG . . 5.590 5.082 4.404 5.393 . 0 0 "[ . 1 . 2]" 1
586 1 25 ASN HA 1 85 CYS H . . 5.340 4.322 4.255 4.485 . 0 0 "[ . 1 . 2]" 1
587 1 25 ASN HB2 1 26 PRO HD2 . . 5.480 4.941 4.918 4.959 . 0 0 "[ . 1 . 2]" 1
588 1 25 ASN HB2 1 26 PRO HD3 . . 5.560 4.882 4.821 4.925 . 0 0 "[ . 1 . 2]" 1
589 1 25 ASN HB2 1 27 ILE MD . . 5.450 4.948 4.546 5.095 . 0 0 "[ . 1 . 2]" 1
590 1 25 ASN HB2 1 27 ILE QG . . 5.420 4.490 4.136 4.626 . 0 0 "[ . 1 . 2]" 1
591 1 25 ASN HB2 1 27 ILE MG . . 5.680 4.391 4.140 4.641 . 0 0 "[ . 1 . 2]" 1
592 1 25 ASN HB2 1 84 CYS HA . . 5.020 2.585 2.331 2.980 . 0 0 "[ . 1 . 2]" 1
593 1 25 ASN HB2 1 84 CYS QB . . 5.360 3.162 2.757 3.978 . 0 0 "[ . 1 . 2]" 1
594 1 25 ASN HB2 1 85 CYS H . . 4.610 2.286 2.159 2.378 . 0 0 "[ . 1 . 2]" 1
595 1 25 ASN HB2 1 86 THR H . . 5.030 2.586 2.037 2.941 . 0 0 "[ . 1 . 2]" 1
596 1 25 ASN HB2 1 86 THR HB . . 5.750 4.104 3.647 4.460 . 0 0 "[ . 1 . 2]" 1
597 1 25 ASN HB3 1 26 PRO HA . . 5.640 5.164 5.137 5.196 . 0 0 "[ . 1 . 2]" 1
598 1 25 ASN HB3 1 27 ILE H . . 4.860 4.210 3.433 4.897 0.037 2 0 "[ . 1 . 2]" 1
599 1 25 ASN HB3 1 27 ILE MD . . 4.950 3.882 3.208 4.211 . 0 0 "[ . 1 . 2]" 1
600 1 25 ASN HB3 1 27 ILE QG . . 5.200 3.664 2.976 4.012 . 0 0 "[ . 1 . 2]" 1
601 1 25 ASN HB3 1 27 ILE MG . . 4.860 3.079 2.732 3.285 . 0 0 "[ . 1 . 2]" 1
602 1 25 ASN HB3 1 84 CYS HA . . 4.370 3.231 2.786 3.514 . 0 0 "[ . 1 . 2]" 1
603 1 25 ASN HB3 1 84 CYS QB . . 5.220 2.811 2.491 3.547 . 0 0 "[ . 1 . 2]" 1
604 1 25 ASN HB3 1 85 CYS H . . 3.900 2.903 2.614 3.063 . 0 0 "[ . 1 . 2]" 1
605 1 25 ASN HB3 1 86 THR H . . 5.470 4.293 3.746 4.636 . 0 0 "[ . 1 . 2]" 1
606 1 25 ASN HD21 1 27 ILE MD . . 5.250 5.234 5.160 5.297 0.047 15 0 "[ . 1 . 2]" 1
607 1 25 ASN HD21 1 27 ILE QG . . 5.660 5.660 5.538 5.716 0.056 16 0 "[ . 1 . 2]" 1
608 1 25 ASN HD21 1 27 ILE MG . . 5.650 5.288 5.005 5.663 0.013 15 0 "[ . 1 . 2]" 1
609 1 25 ASN HD21 1 84 CYS HA . . 4.350 2.653 2.489 3.198 . 0 0 "[ . 1 . 2]" 1
610 1 25 ASN HD21 1 84 CYS QB . . 5.000 3.959 3.658 4.959 . 0 0 "[ . 1 . 2]" 1
611 1 25 ASN HD22 1 84 CYS HA . . 5.220 4.340 4.227 4.664 . 0 0 "[ . 1 . 2]" 1
612 1 26 PRO HA 1 27 ILE H . . 3.930 2.502 2.215 2.912 . 0 0 "[ . 1 . 2]" 1
613 1 26 PRO HA 1 27 ILE HA . . 5.280 4.527 4.396 4.688 . 0 0 "[ . 1 . 2]" 1
614 1 26 PRO HA 1 27 ILE MG . . 5.430 4.255 4.009 4.565 . 0 0 "[ . 1 . 2]" 1
615 1 26 PRO HA 1 28 TYR H . . 4.880 3.072 2.958 3.215 . 0 0 "[ . 1 . 2]" 1
616 1 26 PRO HA 1 30 ILE MD . . 5.350 4.978 4.366 5.287 . 0 0 "[ . 1 . 2]" 1
617 1 26 PRO HA 1 56 VAL MG1 . . 5.020 4.682 4.214 5.032 0.012 20 0 "[ . 1 . 2]" 1
618 1 26 PRO HA 1 56 VAL MG2 . . 5.020 4.481 4.134 5.027 0.007 4 0 "[ . 1 . 2]" 1
619 1 26 PRO HA 1 85 CYS H . . 5.150 3.932 3.683 4.361 . 0 0 "[ . 1 . 2]" 1
620 1 26 PRO HA 1 85 CYS HA . . 4.720 3.004 2.792 3.269 . 0 0 "[ . 1 . 2]" 1
621 1 26 PRO HA 1 86 THR H . . 5.750 5.621 5.428 5.762 0.012 19 0 "[ . 1 . 2]" 1
622 1 26 PRO HB2 1 56 VAL MG1 . . 5.170 3.573 2.885 4.154 . 0 0 "[ . 1 . 2]" 1
623 1 26 PRO HB2 1 56 VAL MG2 . . 5.170 2.645 2.250 3.863 . 0 0 "[ . 1 . 2]" 1
624 1 26 PRO HB2 1 56 VAL QG . . 4.500 2.469 2.217 2.997 . 0 0 "[ . 1 . 2]" 1
625 1 26 PRO HB3 1 28 TYR H . . 5.750 4.957 4.798 5.144 . 0 0 "[ . 1 . 2]" 1
626 1 26 PRO HB3 1 30 ILE MD . . 5.750 5.599 5.263 5.766 0.016 8 0 "[ . 1 . 2]" 1
627 1 26 PRO HB3 1 56 VAL HB . . 4.520 3.079 2.550 4.529 0.009 4 0 "[ . 1 . 2]" 1
628 1 26 PRO HB3 1 56 VAL MG1 . . 5.220 3.040 2.183 3.606 . 0 0 "[ . 1 . 2]" 1
629 1 26 PRO HB3 1 56 VAL MG2 . . 5.220 2.815 2.611 3.378 . 0 0 "[ . 1 . 2]" 1
630 1 26 PRO HB3 1 56 VAL QG . . 4.320 2.495 2.105 2.752 . 0 0 "[ . 1 . 2]" 1
631 1 26 PRO HD2 1 56 VAL QG . . 4.940 4.595 4.042 4.940 0.000 12 0 "[ . 1 . 2]" 1
632 1 26 PRO QG 1 27 ILE H . . 5.340 4.502 4.067 4.751 . 0 0 "[ . 1 . 2]" 1
633 1 26 PRO QG 1 28 TYR H . . 5.750 5.378 5.150 5.616 . 0 0 "[ . 1 . 2]" 1
634 1 26 PRO QG 1 55 GLY QA . . 5.430 4.220 3.211 5.450 0.020 19 0 "[ . 1 . 2]" 1
635 1 26 PRO QG 1 56 VAL MG1 . . 4.880 3.701 2.127 4.530 . 0 0 "[ . 1 . 2]" 1
636 1 26 PRO QG 1 56 VAL MG2 . . 4.880 2.887 2.277 4.042 . 0 0 "[ . 1 . 2]" 1
637 1 26 PRO QG 1 56 VAL QG . . 3.980 2.434 2.116 2.734 . 0 0 "[ . 1 . 2]" 1
638 1 27 ILE H 1 27 ILE HG12 . . 4.320 2.179 1.987 2.363 . 0 0 "[ . 1 . 2]" 1
639 1 27 ILE H 1 27 ILE HG13 . . 4.320 3.046 2.926 3.182 . 0 0 "[ . 1 . 2]" 1
640 1 27 ILE H 1 27 ILE MD . . 4.700 3.815 3.598 3.993 . 0 0 "[ . 1 . 2]" 1
641 1 27 ILE H 1 27 ILE QG . . 3.830 2.127 1.967 2.279 . 0 0 "[ . 1 . 2]" 1
642 1 27 ILE H 1 27 ILE MG . . 4.280 2.566 2.197 2.933 . 0 0 "[ . 1 . 2]" 1
643 1 27 ILE H 1 28 TYR H . . 4.330 2.267 1.893 2.629 . 0 0 "[ . 1 . 2]" 1
644 1 27 ILE H 1 28 TYR HA . . 6.000 4.960 4.630 5.270 . 0 0 "[ . 1 . 2]" 1
645 1 27 ILE H 1 28 TYR QD . . 5.230 4.351 4.007 4.729 . 0 0 "[ . 1 . 2]" 1
646 1 27 ILE H 1 84 CYS HA . . 5.750 5.662 5.224 5.878 0.128 8 0 "[ . 1 . 2]" 1
647 1 27 ILE H 1 84 CYS QB . . 5.240 3.592 3.293 4.049 . 0 0 "[ . 1 . 2]" 1
648 1 27 ILE H 1 85 CYS H . . 4.930 3.450 3.289 3.572 . 0 0 "[ . 1 . 2]" 1
649 1 27 ILE HA 1 28 TYR QD . . 5.620 5.249 5.208 5.332 . 0 0 "[ . 1 . 2]" 1
650 1 27 ILE HB 1 28 TYR H . . 5.140 4.361 4.318 4.394 . 0 0 "[ . 1 . 2]" 1
651 1 27 ILE HB 1 28 TYR QD . . 5.230 4.749 4.682 4.860 . 0 0 "[ . 1 . 2]" 1
652 1 27 ILE HB 1 28 TYR QE . . 5.650 4.734 4.647 4.894 . 0 0 "[ . 1 . 2]" 1
653 1 27 ILE HG12 1 28 TYR H . . 4.970 3.597 3.458 3.741 . 0 0 "[ . 1 . 2]" 1
654 1 27 ILE HG12 1 28 TYR QD . . 4.850 3.791 3.629 3.933 . 0 0 "[ . 1 . 2]" 1
655 1 27 ILE HG13 1 28 TYR H . . 4.970 3.325 3.202 3.405 . 0 0 "[ . 1 . 2]" 1
656 1 27 ILE HG13 1 28 TYR QD . . 4.850 3.086 2.865 3.172 . 0 0 "[ . 1 . 2]" 1
657 1 27 ILE MD 1 28 TYR H . . 5.640 4.736 4.633 4.809 . 0 0 "[ . 1 . 2]" 1
658 1 27 ILE MD 1 28 TYR QD . . 4.670 3.832 3.705 3.919 . 0 0 "[ . 1 . 2]" 1
659 1 27 ILE MD 1 28 TYR QE . . 4.370 2.857 2.747 3.079 . 0 0 "[ . 1 . 2]" 1
660 1 27 ILE MD 1 84 CYS H . . 5.550 5.026 4.858 5.277 . 0 0 "[ . 1 . 2]" 1
661 1 27 ILE MD 1 84 CYS HB2 . . 4.930 2.557 2.234 3.621 . 0 0 "[ . 1 . 2]" 1
662 1 27 ILE MD 1 84 CYS HB3 . . 4.930 2.644 2.376 2.814 . 0 0 "[ . 1 . 2]" 1
663 1 27 ILE MD 1 84 CYS QB . . 4.380 2.258 2.126 2.632 . 0 0 "[ . 1 . 2]" 1
664 1 27 ILE QG 1 28 TYR H . . 4.570 3.066 2.952 3.149 . 0 0 "[ . 1 . 2]" 1
665 1 27 ILE QG 1 28 TYR QB . . 5.430 3.687 3.621 3.756 . 0 0 "[ . 1 . 2]" 1
666 1 27 ILE QG 1 28 TYR QD . . 4.420 2.957 2.771 3.032 . 0 0 "[ . 1 . 2]" 1
667 1 27 ILE QG 1 28 TYR QE . . 4.890 3.127 3.063 3.288 . 0 0 "[ . 1 . 2]" 1
668 1 27 ILE QG 1 84 CYS H . . 5.660 5.705 5.680 5.750 0.090 13 0 "[ . 1 . 2]" 1
669 1 27 ILE QG 1 84 CYS HA . . 5.380 4.421 4.066 4.606 . 0 0 "[ . 1 . 2]" 1
670 1 27 ILE QG 1 84 CYS QB . . 4.620 2.142 2.035 2.421 . 0 0 "[ . 1 . 2]" 1
671 1 27 ILE QG 1 85 CYS H . . 4.730 3.184 3.062 3.299 . 0 0 "[ . 1 . 2]" 1
672 1 27 ILE MD 1 27 ILE MG . . 3.430 2.030 2.005 2.053 . 0 0 "[ . 1 . 2]" 1
673 1 27 ILE MG 1 28 TYR H . . 5.020 4.200 4.162 4.242 . 0 0 "[ . 1 . 2]" 1
674 1 27 ILE MG 1 28 TYR QD . . 5.340 5.156 5.116 5.255 . 0 0 "[ . 1 . 2]" 1
675 1 27 ILE MG 1 85 CYS H . . 5.670 4.137 3.971 4.554 . 0 0 "[ . 1 . 2]" 1
676 1 28 TYR H 1 28 TYR QD . . 5.020 3.645 3.585 3.761 . 0 0 "[ . 1 . 2]" 1
677 1 28 TYR H 1 29 SER H . . 5.550 4.462 4.440 4.479 . 0 0 "[ . 1 . 2]" 1
678 1 28 TYR H 1 29 SER HA . . 5.670 4.952 4.846 5.036 . 0 0 "[ . 1 . 2]" 1
679 1 28 TYR H 1 81 TYR QD . . 5.750 5.213 4.855 5.475 . 0 0 "[ . 1 . 2]" 1
680 1 28 TYR HA 1 29 SER H . . 4.130 2.487 2.456 2.523 . 0 0 "[ . 1 . 2]" 1
681 1 28 TYR HB2 1 29 SER H . . 5.460 3.529 3.467 3.606 . 0 0 "[ . 1 . 2]" 1
682 1 28 TYR HB2 1 81 TYR QE . . 4.590 2.788 2.528 3.324 . 0 0 "[ . 1 . 2]" 1
683 1 28 TYR HB3 1 29 SER H . . 4.770 2.381 2.307 2.431 . 0 0 "[ . 1 . 2]" 1
684 1 28 TYR HB3 1 81 TYR QE . . 4.590 3.404 3.257 3.730 . 0 0 "[ . 1 . 2]" 1
685 1 28 TYR QB 1 29 SER H . . 4.340 2.346 2.279 2.395 . 0 0 "[ . 1 . 2]" 1
686 1 28 TYR QB 1 81 TYR QD . . 4.630 3.133 2.738 3.569 . 0 0 "[ . 1 . 2]" 1
687 1 28 TYR QB 1 81 TYR QE . . 4.190 2.663 2.460 3.099 . 0 0 "[ . 1 . 2]" 1
688 1 28 TYR QD 1 29 SER H . . 5.250 3.802 3.652 3.880 . 0 0 "[ . 1 . 2]" 1
689 1 28 TYR QD 1 81 TYR HB2 . . 5.460 2.945 2.436 3.884 . 0 0 "[ . 1 . 2]" 1
690 1 28 TYR QD 1 81 TYR HB3 . . 5.030 3.739 3.232 4.599 . 0 0 "[ . 1 . 2]" 1
691 1 28 TYR QD 1 81 TYR QD . . 4.650 2.592 2.365 2.758 . 0 0 "[ . 1 . 2]" 1
692 1 28 TYR QD 1 84 CYS QB . . 5.410 3.420 2.385 4.274 . 0 0 "[ . 1 . 2]" 1
693 1 28 TYR QE 1 81 TYR HB2 . . 5.410 3.185 2.909 4.154 . 0 0 "[ . 1 . 2]" 1
694 1 28 TYR QE 1 81 TYR HB3 . . 5.270 3.431 3.024 4.492 . 0 0 "[ . 1 . 2]" 1
695 1 29 SER H 1 30 ILE H . . 5.390 4.633 4.618 4.649 . 0 0 "[ . 1 . 2]" 1
696 1 29 SER H 1 34 VAL MG2 . . 5.750 5.812 5.773 5.862 0.112 18 0 "[ . 1 . 2]" 1
697 1 29 SER H 1 81 TYR QE . . 5.660 4.579 4.307 4.936 . 0 0 "[ . 1 . 2]" 1
698 1 29 SER HA 1 30 ILE H . . 3.630 2.251 2.207 2.304 . 0 0 "[ . 1 . 2]" 1
699 1 29 SER HA 1 30 ILE HB . . 5.140 4.434 4.394 4.462 . 0 0 "[ . 1 . 2]" 1
700 1 29 SER HA 1 30 ILE HG12 . . 5.510 3.694 3.615 3.770 . 0 0 "[ . 1 . 2]" 1
701 1 29 SER HA 1 31 THR MG . . 5.540 4.796 4.622 4.954 . 0 0 "[ . 1 . 2]" 1
702 1 30 ILE H 1 30 ILE HB . . 4.220 2.706 2.679 2.731 . 0 0 "[ . 1 . 2]" 1
703 1 30 ILE H 1 30 ILE HG12 . . 4.540 3.159 3.094 3.209 . 0 0 "[ . 1 . 2]" 1
704 1 30 ILE H 1 30 ILE HG13 . . 5.230 4.362 4.312 4.407 . 0 0 "[ . 1 . 2]" 1
705 1 30 ILE H 1 30 ILE MD . . 5.000 4.006 3.954 4.049 . 0 0 "[ . 1 . 2]" 1
706 1 30 ILE H 1 30 ILE MG . . 4.800 3.862 3.850 3.872 . 0 0 "[ . 1 . 2]" 1
707 1 30 ILE H 1 31 THR H . . 5.240 4.320 4.276 4.351 . 0 0 "[ . 1 . 2]" 1
708 1 30 ILE H 1 31 THR MG . . 5.190 3.470 3.326 3.587 . 0 0 "[ . 1 . 2]" 1
709 1 30 ILE H 1 34 VAL MG1 . . 5.750 5.593 5.474 5.693 . 0 0 "[ . 1 . 2]" 1
710 1 30 ILE HA 1 30 ILE MD . . 3.910 2.098 2.071 2.120 . 0 0 "[ . 1 . 2]" 1
711 1 30 ILE HA 1 31 THR H . . 3.630 2.212 2.196 2.238 . 0 0 "[ . 1 . 2]" 1
712 1 30 ILE HA 1 31 THR HA . . 5.320 4.488 4.478 4.496 . 0 0 "[ . 1 . 2]" 1
713 1 30 ILE HA 1 34 VAL H . . 5.560 4.931 4.859 5.017 . 0 0 "[ . 1 . 2]" 1
714 1 30 ILE HA 1 34 VAL HB . . 4.800 3.036 2.956 3.151 . 0 0 "[ . 1 . 2]" 1
715 1 30 ILE HA 1 34 VAL MG1 . . 4.470 3.058 2.968 3.131 . 0 0 "[ . 1 . 2]" 1
716 1 30 ILE HA 1 34 VAL MG2 . . 4.230 2.769 2.630 2.889 . 0 0 "[ . 1 . 2]" 1
717 1 30 ILE HA 1 35 LEU QD . . 5.210 4.483 4.319 4.639 . 0 0 "[ . 1 . 2]" 1
718 1 30 ILE HA 1 81 TYR QE . . 5.410 4.629 4.296 5.105 . 0 0 "[ . 1 . 2]" 1
719 1 30 ILE HB 1 56 VAL QG . . 5.090 3.147 2.611 3.714 . 0 0 "[ . 1 . 2]" 1
720 1 30 ILE HG12 1 31 THR H . . 5.640 5.077 5.050 5.113 . 0 0 "[ . 1 . 2]" 1
721 1 30 ILE HG12 1 34 VAL MG1 . . 5.440 4.610 4.494 4.695 . 0 0 "[ . 1 . 2]" 1
722 1 30 ILE HG13 1 34 VAL MG1 . . 5.750 4.765 4.554 4.961 . 0 0 "[ . 1 . 2]" 1
723 1 30 ILE HG13 1 35 LEU QD . . 5.700 4.087 3.926 4.535 . 0 0 "[ . 1 . 2]" 1
724 1 30 ILE HG13 1 56 VAL MG1 . . 5.750 3.773 2.959 5.415 . 0 0 "[ . 1 . 2]" 1
725 1 30 ILE HG13 1 56 VAL MG2 . . 5.750 4.701 3.581 5.457 . 0 0 "[ . 1 . 2]" 1
726 1 30 ILE HG13 1 56 VAL QG . . 4.770 3.379 2.913 4.134 . 0 0 "[ . 1 . 2]" 1
727 1 30 ILE MD 1 31 THR H . . 4.660 3.631 3.581 3.694 . 0 0 "[ . 1 . 2]" 1
728 1 30 ILE MD 1 34 VAL H . . 5.750 5.428 5.287 5.506 . 0 0 "[ . 1 . 2]" 1
729 1 30 ILE MD 1 34 VAL HB . . 5.720 3.406 3.256 3.495 . 0 0 "[ . 1 . 2]" 1
730 1 30 ILE MD 1 34 VAL MG1 . . 3.690 2.231 2.112 2.307 . 0 0 "[ . 1 . 2]" 1
731 1 30 ILE MD 1 35 LEU MD1 . . 5.050 4.477 4.239 4.728 . 0 0 "[ . 1 . 2]" 1
732 1 30 ILE MD 1 35 LEU MD2 . . 5.050 3.100 2.886 3.297 . 0 0 "[ . 1 . 2]" 1
733 1 30 ILE MD 1 35 LEU QD . . 4.030 3.046 2.841 3.238 . 0 0 "[ . 1 . 2]" 1
734 1 30 ILE MD 1 80 ILE HA . . 6.000 5.700 5.590 5.799 . 0 0 "[ . 1 . 2]" 1
735 1 30 ILE MD 1 80 ILE MD . . 3.690 2.119 2.012 2.228 . 0 0 "[ . 1 . 2]" 1
736 1 30 ILE MD 1 81 TYR H . . 5.750 5.794 5.668 5.832 0.082 14 0 "[ . 1 . 2]" 1
737 1 30 ILE MD 1 81 TYR QD . . 4.620 3.873 3.502 4.275 . 0 0 "[ . 1 . 2]" 1
738 1 30 ILE MD 1 81 TYR QE . . 4.090 2.406 2.273 2.641 . 0 0 "[ . 1 . 2]" 1
739 1 30 ILE MD 1 85 CYS HA . . 5.220 4.724 4.219 4.955 . 0 0 "[ . 1 . 2]" 1
740 1 30 ILE MD 1 85 CYS HB2 . . 5.210 3.835 3.133 4.106 . 0 0 "[ . 1 . 2]" 1
741 1 30 ILE MD 1 85 CYS HB3 . . 5.210 2.754 2.290 2.962 . 0 0 "[ . 1 . 2]" 1
742 1 30 ILE MD 1 85 CYS QB . . 4.650 2.696 2.236 2.893 . 0 0 "[ . 1 . 2]" 1
743 1 30 ILE MD 1 30 ILE MG . . 3.380 2.009 1.993 2.026 . 0 0 "[ . 1 . 2]" 1
744 1 30 ILE MG 1 31 THR H . . 4.260 2.500 2.427 2.598 . 0 0 "[ . 1 . 2]" 1
745 1 30 ILE MG 1 31 THR HA . . 4.900 3.482 3.423 3.540 . 0 0 "[ . 1 . 2]" 1
746 1 30 ILE MG 1 31 THR MG . . 5.300 4.190 4.167 4.224 . 0 0 "[ . 1 . 2]" 1
747 1 30 ILE MG 1 32 THR HA . . 5.730 4.928 4.791 5.083 . 0 0 "[ . 1 . 2]" 1
748 1 30 ILE MG 1 34 VAL H . . 5.720 4.447 4.274 4.581 . 0 0 "[ . 1 . 2]" 1
749 1 30 ILE MG 1 34 VAL HB . . 4.690 2.811 2.532 2.964 . 0 0 "[ . 1 . 2]" 1
750 1 30 ILE MG 1 34 VAL MG1 . . 4.730 3.024 2.787 3.214 . 0 0 "[ . 1 . 2]" 1
751 1 30 ILE MG 1 34 VAL MG2 . . 5.420 3.784 3.523 3.967 . 0 0 "[ . 1 . 2]" 1
752 1 30 ILE MG 1 35 LEU H . . 5.130 3.850 3.706 4.091 . 0 0 "[ . 1 . 2]" 1
753 1 30 ILE MG 1 35 LEU HA . . 5.730 4.458 4.283 4.799 . 0 0 "[ . 1 . 2]" 1
754 1 30 ILE MG 1 35 LEU HG . . 4.300 2.437 2.277 2.775 . 0 0 "[ . 1 . 2]" 1
755 1 30 ILE MG 1 35 LEU MD1 . . 3.910 2.504 2.308 2.867 . 0 0 "[ . 1 . 2]" 1
756 1 30 ILE MG 1 35 LEU MD2 . . 3.910 2.292 2.188 2.583 . 0 0 "[ . 1 . 2]" 1
757 1 30 ILE MG 1 35 LEU QD . . 3.300 2.121 2.015 2.405 . 0 0 "[ . 1 . 2]" 1
758 1 30 ILE MG 1 58 ALA MB . . 5.020 3.577 3.364 3.799 . 0 0 "[ . 1 . 2]" 1
759 1 31 THR H 1 32 THR H . . 5.210 4.419 4.407 4.432 . 0 0 "[ . 1 . 2]" 1
760 1 31 THR H 1 32 THR HA . . 5.750 5.050 4.987 5.113 . 0 0 "[ . 1 . 2]" 1
761 1 31 THR H 1 33 ASP H . . 5.440 4.344 4.251 4.444 . 0 0 "[ . 1 . 2]" 1
762 1 31 THR H 1 34 VAL H . . 4.340 3.022 2.971 3.070 . 0 0 "[ . 1 . 2]" 1
763 1 31 THR H 1 34 VAL HA . . 5.510 4.793 4.745 4.838 . 0 0 "[ . 1 . 2]" 1
764 1 31 THR H 1 34 VAL HB . . 3.850 1.985 1.917 2.085 . 0 0 "[ . 1 . 2]" 1
765 1 31 THR H 1 34 VAL MG1 . . 4.640 3.456 3.407 3.523 . 0 0 "[ . 1 . 2]" 1
766 1 31 THR H 1 34 VAL MG2 . . 3.780 2.607 2.462 2.710 . 0 0 "[ . 1 . 2]" 1
767 1 31 THR H 1 35 LEU H . . 5.170 3.727 3.603 3.850 . 0 0 "[ . 1 . 2]" 1
768 1 31 THR H 1 35 LEU QD . . 5.420 4.034 3.914 4.164 . 0 0 "[ . 1 . 2]" 1
769 1 31 THR H 1 50 ILE MD . . 5.560 4.267 3.712 4.815 . 0 0 "[ . 1 . 2]" 1
770 1 31 THR HA 1 104 GLN QB . . 5.660 3.918 3.687 4.208 . 0 0 "[ . 1 . 2]" 1
771 1 31 THR HA 1 104 GLN QG . . 5.680 4.842 4.661 5.084 . 0 0 "[ . 1 . 2]" 1
772 1 31 THR HA 1 105 ASP HA . . 5.640 4.160 3.794 4.712 . 0 0 "[ . 1 . 2]" 1
773 1 31 THR HA 1 32 THR H . . 3.760 2.539 2.508 2.563 . 0 0 "[ . 1 . 2]" 1
774 1 31 THR HA 1 32 THR HA . . 5.350 4.357 4.336 4.369 . 0 0 "[ . 1 . 2]" 1
775 1 31 THR HA 1 32 THR MG . . 5.190 3.792 3.735 3.833 . 0 0 "[ . 1 . 2]" 1
776 1 31 THR HA 1 33 ASP H . . 5.230 4.195 4.137 4.264 . 0 0 "[ . 1 . 2]" 1
777 1 31 THR HA 1 34 VAL H . . 5.340 4.538 4.512 4.575 . 0 0 "[ . 1 . 2]" 1
778 1 31 THR HA 1 34 VAL HB . . 5.610 4.743 4.700 4.813 . 0 0 "[ . 1 . 2]" 1
779 1 31 THR HA 1 50 ILE MD . . 4.510 2.888 2.289 3.376 . 0 0 "[ . 1 . 2]" 1
780 1 31 THR HB 1 104 GLN HA . . 4.850 2.872 2.729 3.231 . 0 0 "[ . 1 . 2]" 1
781 1 31 THR HB 1 104 GLN QB . . 5.340 2.363 2.194 2.551 . 0 0 "[ . 1 . 2]" 1
782 1 31 THR HB 1 32 THR H . . 3.740 2.218 2.159 2.287 . 0 0 "[ . 1 . 2]" 1
783 1 31 THR HB 1 32 THR HA . . 5.530 4.757 4.723 4.783 . 0 0 "[ . 1 . 2]" 1
784 1 31 THR HB 1 33 ASP H . . 4.230 2.804 2.717 2.868 . 0 0 "[ . 1 . 2]" 1
785 1 31 THR HB 1 34 VAL H . . 5.100 4.092 3.988 4.176 . 0 0 "[ . 1 . 2]" 1
786 1 31 THR HB 1 50 ILE MD . . 5.230 4.356 3.867 4.916 . 0 0 "[ . 1 . 2]" 1
787 1 31 THR MG 1 104 GLN HA . . 4.940 3.947 3.773 4.229 . 0 0 "[ . 1 . 2]" 1
788 1 31 THR MG 1 104 GLN HB2 . . 4.520 2.315 2.200 2.537 . 0 0 "[ . 1 . 2]" 1
789 1 31 THR MG 1 104 GLN HB3 . . 4.520 3.564 3.425 3.909 . 0 0 "[ . 1 . 2]" 1
790 1 31 THR MG 1 104 GLN QG . . 4.830 3.481 3.232 3.789 . 0 0 "[ . 1 . 2]" 1
791 1 31 THR MG 1 32 THR H . . 4.760 3.712 3.672 3.739 . 0 0 "[ . 1 . 2]" 1
792 1 31 THR MG 1 32 THR HA . . 5.750 5.683 5.666 5.693 . 0 0 "[ . 1 . 2]" 1
793 1 32 THR H 1 104 GLN HA . . 4.050 2.980 2.761 3.180 . 0 0 "[ . 1 . 2]" 1
794 1 32 THR H 1 104 GLN QB . . 5.270 3.737 3.644 3.879 . 0 0 "[ . 1 . 2]" 1
795 1 32 THR H 1 104 GLN QG . . 5.490 4.897 4.749 5.083 . 0 0 "[ . 1 . 2]" 1
796 1 32 THR H 1 32 THR MG . . 3.790 2.165 2.121 2.227 . 0 0 "[ . 1 . 2]" 1
797 1 32 THR H 1 33 ASP H . . 4.180 2.679 2.662 2.699 . 0 0 "[ . 1 . 2]" 1
798 1 32 THR H 1 34 VAL H . . 5.210 4.193 4.139 4.226 . 0 0 "[ . 1 . 2]" 1
799 1 32 THR H 1 35 LEU H . . 5.630 4.908 4.852 4.994 . 0 0 "[ . 1 . 2]" 1
800 1 32 THR H 1 35 LEU QD . . 5.710 4.720 4.449 5.038 . 0 0 "[ . 1 . 2]" 1
801 1 32 THR H 1 50 ILE MD . . 4.020 2.956 2.647 3.488 . 0 0 "[ . 1 . 2]" 1
802 1 32 THR HA 1 104 GLN HA . . 5.750 5.465 5.257 5.624 . 0 0 "[ . 1 . 2]" 1
803 1 32 THR HA 1 33 ASP QB . . 5.750 5.146 5.129 5.160 . 0 0 "[ . 1 . 2]" 1
804 1 32 THR HA 1 34 VAL H . . 5.190 4.084 4.000 4.184 . 0 0 "[ . 1 . 2]" 1
805 1 32 THR HA 1 34 VAL MG2 . . 5.750 5.756 5.647 5.810 0.060 5 0 "[ . 1 . 2]" 1
806 1 32 THR HA 1 35 LEU H . . 4.650 3.398 3.303 3.508 . 0 0 "[ . 1 . 2]" 1
807 1 32 THR HA 1 35 LEU HB2 . . 4.780 2.845 2.623 3.088 . 0 0 "[ . 1 . 2]" 1
808 1 32 THR HA 1 35 LEU HB3 . . 5.550 4.558 4.311 4.824 . 0 0 "[ . 1 . 2]" 1
809 1 32 THR HA 1 35 LEU QD . . 4.920 3.209 2.813 3.575 . 0 0 "[ . 1 . 2]" 1
810 1 32 THR HA 1 36 TYR H . . 5.230 4.055 3.838 4.141 . 0 0 "[ . 1 . 2]" 1
811 1 32 THR HA 1 48 ILE MD . . 4.890 3.283 3.142 3.497 . 0 0 "[ . 1 . 2]" 1
812 1 32 THR HA 1 48 ILE MG . . 4.250 2.519 2.366 2.691 . 0 0 "[ . 1 . 2]" 1
813 1 32 THR HA 1 50 ILE MD . . 4.120 2.560 2.318 3.049 . 0 0 "[ . 1 . 2]" 1
814 1 32 THR HA 1 58 ALA MB . . 5.750 5.194 4.904 5.503 . 0 0 "[ . 1 . 2]" 1
815 1 32 THR HB 1 104 GLN HA . . 5.290 4.848 4.659 5.072 . 0 0 "[ . 1 . 2]" 1
816 1 32 THR HB 1 106 THR H . . 5.750 5.284 5.073 5.500 . 0 0 "[ . 1 . 2]" 1
817 1 32 THR HB 1 107 TRP H . . 5.440 4.144 4.003 4.337 . 0 0 "[ . 1 . 2]" 1
818 1 32 THR HB 1 107 TRP HB2 . . 4.730 2.822 2.633 3.004 . 0 0 "[ . 1 . 2]" 1
819 1 32 THR HB 1 107 TRP HB3 . . 4.860 2.575 2.414 2.818 . 0 0 "[ . 1 . 2]" 1
820 1 32 THR HB 1 33 ASP H . . 4.620 3.952 3.851 4.016 . 0 0 "[ . 1 . 2]" 1
821 1 32 THR HB 1 36 TYR H . . 5.750 5.111 4.937 5.191 . 0 0 "[ . 1 . 2]" 1
822 1 32 THR HB 1 48 ILE H . . 5.750 5.024 4.704 5.361 . 0 0 "[ . 1 . 2]" 1
823 1 32 THR HB 1 48 ILE HB . . 5.000 3.039 2.735 3.461 . 0 0 "[ . 1 . 2]" 1
824 1 32 THR HB 1 48 ILE MD . . 4.860 3.558 3.327 3.758 . 0 0 "[ . 1 . 2]" 1
825 1 32 THR HB 1 48 ILE MG . . 4.730 3.571 3.396 3.943 . 0 0 "[ . 1 . 2]" 1
826 1 32 THR HB 1 50 ILE MD . . 5.120 4.188 3.848 4.840 . 0 0 "[ . 1 . 2]" 1
827 1 32 THR MG 1 103 ASP H . . 5.290 4.171 3.804 4.485 . 0 0 "[ . 1 . 2]" 1
828 1 32 THR MG 1 104 GLN HA . . 4.870 3.510 3.292 3.790 . 0 0 "[ . 1 . 2]" 1
829 1 32 THR MG 1 105 ASP H . . 5.010 3.586 3.453 3.723 . 0 0 "[ . 1 . 2]" 1
830 1 32 THR MG 1 105 ASP HA . . 4.650 3.015 2.685 3.476 . 0 0 "[ . 1 . 2]" 1
831 1 32 THR MG 1 106 THR H . . 4.370 2.835 2.659 2.953 . 0 0 "[ . 1 . 2]" 1
832 1 32 THR MG 1 106 THR HA . . 4.550 2.304 2.206 2.564 . 0 0 "[ . 1 . 2]" 1
833 1 32 THR MG 1 106 THR HB . . 5.220 4.203 4.144 4.388 . 0 0 "[ . 1 . 2]" 1
834 1 32 THR MG 1 107 TRP H . . 4.470 2.772 2.593 2.960 . 0 0 "[ . 1 . 2]" 1
835 1 32 THR MG 1 107 TRP HB2 . . 4.420 2.624 2.238 3.053 . 0 0 "[ . 1 . 2]" 1
836 1 32 THR MG 1 107 TRP HB3 . . 4.560 3.117 2.779 3.456 . 0 0 "[ . 1 . 2]" 1
837 1 32 THR MG 1 107 TRP HE3 . . 5.450 4.217 3.819 4.602 . 0 0 "[ . 1 . 2]" 1
838 1 32 THR MG 1 33 ASP H . . 5.320 4.088 4.019 4.154 . 0 0 "[ . 1 . 2]" 1
839 1 32 THR MG 1 35 LEU HB2 . . 5.240 4.403 4.167 4.624 . 0 0 "[ . 1 . 2]" 1
840 1 32 THR MG 1 35 LEU QD . . 5.140 3.758 3.320 4.142 . 0 0 "[ . 1 . 2]" 1
841 1 32 THR MG 1 48 ILE H . . 5.100 4.345 4.124 4.596 . 0 0 "[ . 1 . 2]" 1
842 1 32 THR MG 1 48 ILE HB . . 4.190 2.840 2.652 2.997 . 0 0 "[ . 1 . 2]" 1
843 1 32 THR MG 1 48 ILE HG13 . . 5.510 4.958 4.789 5.091 . 0 0 "[ . 1 . 2]" 1
844 1 32 THR MG 1 48 ILE MD . . 4.920 3.900 3.732 4.053 . 0 0 "[ . 1 . 2]" 1
845 1 32 THR MG 1 48 ILE MG . . 3.900 2.347 2.189 2.669 . 0 0 "[ . 1 . 2]" 1
846 1 32 THR MG 1 49 VAL QG . . 5.330 4.097 3.742 4.388 . 0 0 "[ . 1 . 2]" 1
847 1 32 THR MG 1 50 ILE H . . 4.920 3.839 3.600 4.147 . 0 0 "[ . 1 . 2]" 1
848 1 32 THR MG 1 50 ILE MD . . 3.990 2.202 1.878 2.864 . 0 0 "[ . 1 . 2]" 1
849 1 33 ASP H 1 104 GLN HA . . 4.870 3.972 3.701 4.252 . 0 0 "[ . 1 . 2]" 1
850 1 33 ASP H 1 107 TRP HB2 . . 5.750 5.825 5.763 5.867 0.117 7 0 "[ . 1 . 2]" 1
851 1 33 ASP H 1 33 ASP QB . . 3.550 2.230 2.209 2.242 . 0 0 "[ . 1 . 2]" 1
852 1 33 ASP H 1 34 VAL H . . 3.990 2.445 2.390 2.543 . 0 0 "[ . 1 . 2]" 1
853 1 33 ASP H 1 34 VAL HA . . 5.750 5.119 5.075 5.200 . 0 0 "[ . 1 . 2]" 1
854 1 33 ASP H 1 35 LEU H . . 5.390 4.025 3.913 4.129 . 0 0 "[ . 1 . 2]" 1
855 1 33 ASP H 1 36 TYR H . . 5.440 4.665 4.583 4.738 . 0 0 "[ . 1 . 2]" 1
856 1 33 ASP H 1 36 TYR HB2 . . 5.750 5.541 5.463 5.614 . 0 0 "[ . 1 . 2]" 1
857 1 33 ASP HA 1 35 LEU H . . 5.460 4.495 4.403 4.631 . 0 0 "[ . 1 . 2]" 1
858 1 33 ASP HA 1 36 TYR H . . 4.600 3.500 3.369 3.696 . 0 0 "[ . 1 . 2]" 1
859 1 33 ASP HA 1 36 TYR HB2 . . 4.590 3.718 3.545 3.951 . 0 0 "[ . 1 . 2]" 1
860 1 33 ASP HA 1 36 TYR HB3 . . 4.340 2.807 2.680 3.020 . 0 0 "[ . 1 . 2]" 1
861 1 33 ASP HA 1 36 TYR QD . . 5.080 4.271 4.100 4.451 . 0 0 "[ . 1 . 2]" 1
862 1 33 ASP HA 1 37 THR H . . 4.830 4.290 4.222 4.407 . 0 0 "[ . 1 . 2]" 1
863 1 33 ASP HA 1 37 THR HB . . 5.460 5.025 4.927 5.148 . 0 0 "[ . 1 . 2]" 1
864 1 33 ASP HA 1 37 THR MG . . 5.300 4.809 4.739 4.891 . 0 0 "[ . 1 . 2]" 1
865 1 33 ASP QB 1 34 VAL H . . 4.020 2.955 2.879 3.047 . 0 0 "[ . 1 . 2]" 1
866 1 33 ASP QB 1 34 VAL HA . . 5.220 4.350 4.318 4.381 . 0 0 "[ . 1 . 2]" 1
867 1 33 ASP QB 1 34 VAL MG2 . . 4.710 3.163 3.089 3.221 . 0 0 "[ . 1 . 2]" 1
868 1 33 ASP QB 1 35 LEU H . . 5.660 4.912 4.850 4.997 . 0 0 "[ . 1 . 2]" 1
869 1 33 ASP QB 1 36 TYR H . . 5.520 5.048 4.943 5.210 . 0 0 "[ . 1 . 2]" 1
870 1 33 ASP QB 1 36 TYR HB2 . . 5.750 5.591 5.446 5.762 0.012 2 0 "[ . 1 . 2]" 1
871 1 33 ASP QB 1 36 TYR HB3 . . 5.230 4.842 4.718 5.041 . 0 0 "[ . 1 . 2]" 1
872 1 33 ASP QB 1 37 THR H . . 6.000 5.595 5.507 5.776 . 0 0 "[ . 1 . 2]" 1
873 1 34 VAL H 1 34 VAL HB . . 3.680 2.415 2.375 2.436 . 0 0 "[ . 1 . 2]" 1
874 1 34 VAL H 1 34 VAL MG1 . . 4.650 3.760 3.743 3.769 . 0 0 "[ . 1 . 2]" 1
875 1 34 VAL H 1 34 VAL MG2 . . 3.560 2.353 2.311 2.432 . 0 0 "[ . 1 . 2]" 1
876 1 34 VAL H 1 35 LEU H . . 4.050 2.362 2.279 2.421 . 0 0 "[ . 1 . 2]" 1
877 1 34 VAL H 1 35 LEU HB2 . . 5.730 4.540 4.427 4.616 . 0 0 "[ . 1 . 2]" 1
878 1 34 VAL H 1 35 LEU HG . . 5.750 4.103 4.034 4.156 . 0 0 "[ . 1 . 2]" 1
879 1 34 VAL H 1 36 TYR H . . 4.970 3.721 3.629 3.781 . 0 0 "[ . 1 . 2]" 1
880 1 34 VAL HA 1 36 TYR H . . 4.810 4.173 4.115 4.348 . 0 0 "[ . 1 . 2]" 1
881 1 34 VAL HA 1 37 THR MG . . 3.890 2.175 2.117 2.301 . 0 0 "[ . 1 . 2]" 1
882 1 34 VAL HA 1 38 ILE MG . . 5.120 4.088 3.969 4.211 . 0 0 "[ . 1 . 2]" 1
883 1 34 VAL HA 1 80 ILE MG . . 5.480 4.497 4.388 4.710 . 0 0 "[ . 1 . 2]" 1
884 1 34 VAL HB 1 35 LEU H . . 4.000 2.741 2.686 2.770 . 0 0 "[ . 1 . 2]" 1
885 1 34 VAL HB 1 35 LEU HB2 . . 5.400 4.875 4.813 4.931 . 0 0 "[ . 1 . 2]" 1
886 1 34 VAL HB 1 35 LEU HG . . 5.350 3.255 3.170 3.330 . 0 0 "[ . 1 . 2]" 1
887 1 34 VAL HB 1 35 LEU QD . . 5.290 3.668 3.527 3.760 . 0 0 "[ . 1 . 2]" 1
888 1 34 VAL HB 1 36 TYR H . . 5.450 4.938 4.891 4.991 . 0 0 "[ . 1 . 2]" 1
889 1 34 VAL MG1 1 35 LEU H . . 4.610 3.547 3.481 3.585 . 0 0 "[ . 1 . 2]" 1
890 1 34 VAL MG1 1 35 LEU HA . . 4.660 3.517 3.432 3.577 . 0 0 "[ . 1 . 2]" 1
891 1 34 VAL MG1 1 35 LEU HG . . 4.890 3.784 3.639 3.939 . 0 0 "[ . 1 . 2]" 1
892 1 34 VAL MG1 1 35 LEU QD . . 3.980 2.995 2.825 3.170 . 0 0 "[ . 1 . 2]" 1
893 1 34 VAL MG1 1 38 ILE H . . 5.730 4.600 4.553 4.668 . 0 0 "[ . 1 . 2]" 1
894 1 34 VAL MG1 1 38 ILE HG12 . . 4.760 3.783 3.441 4.016 . 0 0 "[ . 1 . 2]" 1
895 1 34 VAL MG1 1 80 ILE HA . . 5.440 5.069 4.897 5.214 . 0 0 "[ . 1 . 2]" 1
896 1 34 VAL MG1 1 80 ILE HG12 . . 5.120 4.101 3.937 4.248 . 0 0 "[ . 1 . 2]" 1
897 1 34 VAL MG1 1 80 ILE MD . . 3.710 2.174 2.112 2.242 . 0 0 "[ . 1 . 2]" 1
898 1 34 VAL MG1 1 80 ILE MG . . 3.810 2.121 2.036 2.246 . 0 0 "[ . 1 . 2]" 1
899 1 34 VAL MG1 1 81 TYR QD . . 5.750 5.011 4.729 5.190 . 0 0 "[ . 1 . 2]" 1
900 1 34 VAL MG1 1 81 TYR QE . . 4.850 3.598 3.084 3.802 . 0 0 "[ . 1 . 2]" 1
901 1 34 VAL MG2 1 35 LEU H . . 4.580 3.935 3.921 3.955 . 0 0 "[ . 1 . 2]" 1
902 1 34 VAL MG2 1 35 LEU HA . . 5.750 5.470 5.450 5.499 . 0 0 "[ . 1 . 2]" 1
903 1 34 VAL MG2 1 35 LEU MD1 . . 5.750 5.602 5.524 5.664 . 0 0 "[ . 1 . 2]" 1
904 1 34 VAL MG2 1 35 LEU MD2 . . 5.750 4.884 4.728 4.993 . 0 0 "[ . 1 . 2]" 1
905 1 34 VAL MG2 1 35 LEU QD . . 4.850 4.595 4.494 4.673 . 0 0 "[ . 1 . 2]" 1
906 1 34 VAL MG2 1 80 ILE MD . . 5.000 4.432 4.304 4.524 . 0 0 "[ . 1 . 2]" 1
907 1 34 VAL MG2 1 81 TYR QE . . 5.170 4.290 3.983 4.552 . 0 0 "[ . 1 . 2]" 1
908 1 35 LEU H 1 35 LEU HB2 . . 4.050 2.415 2.387 2.461 . 0 0 "[ . 1 . 2]" 1
909 1 35 LEU H 1 35 LEU HG . . 4.120 2.337 2.291 2.379 . 0 0 "[ . 1 . 2]" 1
910 1 35 LEU H 1 35 LEU MD1 . . 4.860 3.647 3.583 3.738 . 0 0 "[ . 1 . 2]" 1
911 1 35 LEU H 1 35 LEU MD2 . . 4.860 3.396 3.323 3.485 . 0 0 "[ . 1 . 2]" 1
912 1 35 LEU H 1 35 LEU QD . . 4.210 3.122 3.091 3.158 . 0 0 "[ . 1 . 2]" 1
913 1 35 LEU H 1 36 TYR H . . 4.100 2.516 2.491 2.574 . 0 0 "[ . 1 . 2]" 1
914 1 35 LEU H 1 36 TYR HB2 . . 5.490 4.856 4.824 4.909 . 0 0 "[ . 1 . 2]" 1
915 1 35 LEU H 1 36 TYR HB3 . . 5.490 4.750 4.698 4.819 . 0 0 "[ . 1 . 2]" 1
916 1 35 LEU H 1 37 THR H . . 5.370 4.195 4.160 4.248 . 0 0 "[ . 1 . 2]" 1
917 1 35 LEU H 1 38 ILE H . . 5.610 5.034 4.995 5.078 . 0 0 "[ . 1 . 2]" 1
918 1 35 LEU H 1 48 ILE MD . . 5.480 4.004 3.894 4.174 . 0 0 "[ . 1 . 2]" 1
919 1 35 LEU H 1 48 ILE MG . . 5.280 4.216 4.096 4.341 . 0 0 "[ . 1 . 2]" 1
920 1 35 LEU HA 1 35 LEU QD . . 4.010 2.002 1.984 2.027 . 0 0 "[ . 1 . 2]" 1
921 1 35 LEU HA 1 37 THR H . . 5.370 4.318 4.224 4.401 . 0 0 "[ . 1 . 2]" 1
922 1 35 LEU HA 1 38 ILE H . . 4.540 3.500 3.402 3.575 . 0 0 "[ . 1 . 2]" 1
923 1 35 LEU HA 1 38 ILE HB . . 5.350 4.979 4.905 5.017 . 0 0 "[ . 1 . 2]" 1
924 1 35 LEU HA 1 38 ILE HG12 . . 4.710 2.383 2.060 2.834 . 0 0 "[ . 1 . 2]" 1
925 1 35 LEU HA 1 38 ILE HG13 . . 4.840 2.780 2.052 3.254 . 0 0 "[ . 1 . 2]" 1
926 1 35 LEU HA 1 38 ILE MD . . 4.550 2.567 2.386 2.805 . 0 0 "[ . 1 . 2]" 1
927 1 35 LEU HA 1 38 ILE MG . . 4.560 3.818 3.721 3.923 . 0 0 "[ . 1 . 2]" 1
928 1 35 LEU HA 1 39 CYS H . . 5.030 4.356 4.268 4.571 . 0 0 "[ . 1 . 2]" 1
929 1 35 LEU HA 1 48 ILE MD . . 5.440 4.117 4.018 4.229 . 0 0 "[ . 1 . 2]" 1
930 1 35 LEU HB2 1 36 TYR H . . 4.360 3.080 2.949 3.172 . 0 0 "[ . 1 . 2]" 1
931 1 35 LEU HB2 1 48 ILE MG . . 4.260 2.270 2.152 2.421 . 0 0 "[ . 1 . 2]" 1
932 1 35 LEU HB3 1 36 TYR H . . 4.980 4.020 3.897 4.097 . 0 0 "[ . 1 . 2]" 1
933 1 35 LEU HB3 1 36 TYR HA . . 5.720 4.579 4.476 4.654 . 0 0 "[ . 1 . 2]" 1
934 1 35 LEU HB3 1 38 ILE MD . . 4.790 3.686 3.454 3.804 . 0 0 "[ . 1 . 2]" 1
935 1 35 LEU HB3 1 48 ILE MG . . 5.100 2.989 2.849 3.262 . 0 0 "[ . 1 . 2]" 1
936 1 35 LEU HG 1 36 TYR H . . 5.510 4.519 4.470 4.552 . 0 0 "[ . 1 . 2]" 1
937 1 35 LEU HG 1 50 ILE MD . . 4.810 3.440 3.001 3.886 . 0 0 "[ . 1 . 2]" 1
938 1 35 LEU MD1 1 36 TYR H . . 5.700 4.903 4.788 5.002 . 0 0 "[ . 1 . 2]" 1
939 1 35 LEU MD1 1 58 ALA MB . . 4.720 1.929 1.882 1.988 . 0 0 "[ . 1 . 2]" 1
940 1 35 LEU MD2 1 36 TYR H . . 5.700 4.746 4.705 4.784 . 0 0 "[ . 1 . 2]" 1
941 1 35 LEU MD2 1 58 ALA MB . . 4.720 3.281 3.160 3.560 . 0 0 "[ . 1 . 2]" 1
942 1 35 LEU QD 1 36 TYR H . . 5.010 4.293 4.260 4.312 . 0 0 "[ . 1 . 2]" 1
943 1 35 LEU QD 1 37 THR H . . 5.710 5.356 5.258 5.436 . 0 0 "[ . 1 . 2]" 1
944 1 35 LEU QD 1 38 ILE HG12 . . 5.410 3.202 2.887 3.439 . 0 0 "[ . 1 . 2]" 1
945 1 35 LEU QD 1 38 ILE HG13 . . 5.610 3.653 3.261 3.959 . 0 0 "[ . 1 . 2]" 1
946 1 35 LEU QD 1 50 ILE MD . . 4.080 2.133 1.984 2.287 . 0 0 "[ . 1 . 2]" 1
947 1 35 LEU QD 1 50 ILE MG . . 5.290 3.689 3.194 4.107 . 0 0 "[ . 1 . 2]" 1
948 1 35 LEU QD 1 58 ALA MB . . 3.520 1.916 1.874 1.973 . 0 0 "[ . 1 . 2]" 1
949 1 35 LEU QD 1 87 LEU QD . . 3.980 2.959 2.701 3.146 . 0 0 "[ . 1 . 2]" 1
950 1 36 TYR H 1 36 TYR HB2 . . 3.880 2.629 2.551 2.653 . 0 0 "[ . 1 . 2]" 1
951 1 36 TYR H 1 36 TYR HB3 . . 3.870 2.426 2.401 2.453 . 0 0 "[ . 1 . 2]" 1
952 1 36 TYR H 1 36 TYR QD . . 5.100 4.192 4.180 4.203 . 0 0 "[ . 1 . 2]" 1
953 1 36 TYR H 1 37 THR H . . 4.080 2.529 2.495 2.648 . 0 0 "[ . 1 . 2]" 1
954 1 36 TYR H 1 37 THR HB . . 5.750 4.889 4.843 5.006 . 0 0 "[ . 1 . 2]" 1
955 1 36 TYR H 1 37 THR MG . . 4.850 3.866 3.802 3.990 . 0 0 "[ . 1 . 2]" 1
956 1 36 TYR H 1 38 ILE H . . 5.370 4.013 3.946 4.065 . 0 0 "[ . 1 . 2]" 1
957 1 36 TYR H 1 45 VAL QG . . 5.710 5.069 4.922 5.304 . 0 0 "[ . 1 . 2]" 1
958 1 36 TYR H 1 48 ILE MD . . 4.390 3.013 2.917 3.165 . 0 0 "[ . 1 . 2]" 1
959 1 36 TYR H 1 48 ILE MG . . 5.130 4.348 4.092 4.497 . 0 0 "[ . 1 . 2]" 1
960 1 36 TYR HA 1 36 TYR QD . . 4.360 2.775 2.681 2.886 . 0 0 "[ . 1 . 2]" 1
961 1 36 TYR HA 1 36 TYR QE . . 5.310 4.644 4.598 4.692 . 0 0 "[ . 1 . 2]" 1
962 1 36 TYR HA 1 37 THR HA . . 5.430 4.676 4.650 4.694 . 0 0 "[ . 1 . 2]" 1
963 1 36 TYR HA 1 37 THR MG . . 5.520 5.163 5.125 5.222 . 0 0 "[ . 1 . 2]" 1
964 1 36 TYR HA 1 38 ILE H . . 5.510 4.163 4.090 4.217 . 0 0 "[ . 1 . 2]" 1
965 1 36 TYR HA 1 38 ILE HG13 . . 5.690 5.049 4.746 5.271 . 0 0 "[ . 1 . 2]" 1
966 1 36 TYR HA 1 39 CYS H . . 5.110 3.325 3.254 3.517 . 0 0 "[ . 1 . 2]" 1
967 1 36 TYR HA 1 39 CYS QB . . 5.150 2.924 2.692 4.538 . 0 0 "[ . 1 . 2]" 1
968 1 36 TYR HA 1 40 ASN H . . 5.090 3.871 3.756 4.057 . 0 0 "[ . 1 . 2]" 1
969 1 36 TYR HA 1 45 VAL MG1 . . 4.920 3.519 3.385 3.659 . 0 0 "[ . 1 . 2]" 1
970 1 36 TYR HA 1 45 VAL MG2 . . 4.920 3.257 3.078 3.589 . 0 0 "[ . 1 . 2]" 1
971 1 36 TYR HA 1 45 VAL QG . . 4.380 3.001 2.869 3.224 . 0 0 "[ . 1 . 2]" 1
972 1 36 TYR HA 1 48 ILE HG12 . . 5.750 4.851 4.744 4.943 . 0 0 "[ . 1 . 2]" 1
973 1 36 TYR HA 1 48 ILE MD . . 4.380 2.276 2.167 2.408 . 0 0 "[ . 1 . 2]" 1
974 1 36 TYR HA 1 60 VAL QG . . 5.510 4.314 4.233 4.399 . 0 0 "[ . 1 . 2]" 1
975 1 36 TYR HB2 1 37 THR H . . 4.950 4.069 4.021 4.097 . 0 0 "[ . 1 . 2]" 1
976 1 36 TYR HB2 1 48 ILE MD . . 4.460 2.212 2.150 2.312 . 0 0 "[ . 1 . 2]" 1
977 1 36 TYR HB3 1 37 THR H . . 4.080 2.835 2.759 2.892 . 0 0 "[ . 1 . 2]" 1
978 1 36 TYR HB3 1 48 ILE MD . . 4.650 3.595 3.524 3.711 . 0 0 "[ . 1 . 2]" 1
979 1 36 TYR QD 1 109 TYR QD . . 5.080 3.537 3.386 3.724 . 0 0 "[ . 1 . 2]" 1
980 1 36 TYR QD 1 37 THR H . . 4.620 3.708 3.553 3.836 . 0 0 "[ . 1 . 2]" 1
981 1 36 TYR QD 1 37 THR HA . . 4.790 3.429 3.214 3.627 . 0 0 "[ . 1 . 2]" 1
982 1 36 TYR QD 1 37 THR MG . . 5.450 4.760 4.591 4.885 . 0 0 "[ . 1 . 2]" 1
983 1 36 TYR QD 1 38 ILE H . . 5.750 5.476 5.347 5.591 . 0 0 "[ . 1 . 2]" 1
984 1 36 TYR QD 1 39 CYS H . . 5.670 5.260 5.225 5.328 . 0 0 "[ . 1 . 2]" 1
985 1 36 TYR QD 1 40 ASN H . . 5.360 4.819 4.756 4.968 . 0 0 "[ . 1 . 2]" 1
986 1 36 TYR QD 1 40 ASN HB2 . . 5.250 3.778 3.655 3.983 . 0 0 "[ . 1 . 2]" 1
987 1 36 TYR QD 1 40 ASN HB3 . . 5.750 4.785 4.609 5.010 . 0 0 "[ . 1 . 2]" 1
988 1 36 TYR QD 1 40 ASN HD22 . . 5.750 5.688 5.380 5.771 0.021 14 0 "[ . 1 . 2]" 1
989 1 36 TYR QD 1 45 VAL H . . 5.690 5.034 4.728 5.533 . 0 0 "[ . 1 . 2]" 1
990 1 36 TYR QD 1 45 VAL HB . . 4.520 2.860 2.613 3.305 . 0 0 "[ . 1 . 2]" 1
991 1 36 TYR QD 1 45 VAL MG1 . . 4.500 2.476 2.368 2.614 . 0 0 "[ . 1 . 2]" 1
992 1 36 TYR QD 1 45 VAL MG2 . . 4.500 3.361 3.246 3.457 . 0 0 "[ . 1 . 2]" 1
993 1 36 TYR QD 1 45 VAL QG . . 3.940 2.415 2.322 2.538 . 0 0 "[ . 1 . 2]" 1
994 1 36 TYR QD 1 48 ILE MD . . 4.500 2.613 2.459 2.789 . 0 0 "[ . 1 . 2]" 1
995 1 36 TYR QE 1 109 TYR H . . 5.750 5.676 5.325 5.769 0.019 2 0 "[ . 1 . 2]" 1
996 1 36 TYR QE 1 109 TYR HB3 . . 5.360 3.554 3.314 3.997 . 0 0 "[ . 1 . 2]" 1
997 1 36 TYR QE 1 109 TYR QD . . 5.180 3.436 3.390 3.518 . 0 0 "[ . 1 . 2]" 1
998 1 36 TYR QE 1 37 THR HA . . 5.490 4.683 4.487 4.857 . 0 0 "[ . 1 . 2]" 1
999 1 36 TYR QE 1 40 ASN HB2 . . 4.950 3.600 3.472 3.823 . 0 0 "[ . 1 . 2]" 1
1000 1 36 TYR QE 1 40 ASN HB3 . . 5.550 4.668 4.438 4.832 . 0 0 "[ . 1 . 2]" 1
1001 1 36 TYR QE 1 40 ASN HD21 . . 4.850 3.365 2.922 3.536 . 0 0 "[ . 1 . 2]" 1
1002 1 36 TYR QE 1 40 ASN HD22 . . 5.310 4.068 3.638 4.190 . 0 0 "[ . 1 . 2]" 1
1003 1 36 TYR QE 1 45 VAL H . . 4.860 3.693 3.388 4.062 . 0 0 "[ . 1 . 2]" 1
1004 1 36 TYR QE 1 45 VAL HA . . 5.430 5.028 4.867 5.190 . 0 0 "[ . 1 . 2]" 1
1005 1 36 TYR QE 1 45 VAL HB . . 4.030 2.292 2.222 2.373 . 0 0 "[ . 1 . 2]" 1
1006 1 36 TYR QE 1 45 VAL MG1 . . 4.380 3.200 3.079 3.307 . 0 0 "[ . 1 . 2]" 1
1007 1 36 TYR QE 1 45 VAL MG2 . . 4.380 3.795 3.547 3.929 . 0 0 "[ . 1 . 2]" 1
1008 1 36 TYR QE 1 45 VAL QG . . 3.960 3.038 2.901 3.117 . 0 0 "[ . 1 . 2]" 1
1009 1 36 TYR QE 1 46 GLN H . . 5.750 5.359 5.189 5.542 . 0 0 "[ . 1 . 2]" 1
1010 1 36 TYR QE 1 48 ILE MD . . 4.830 4.553 4.366 4.716 . 0 0 "[ . 1 . 2]" 1
1011 1 36 TYR QE 1 60 VAL QG . . 5.710 5.698 5.634 5.740 0.030 3 0 "[ . 1 . 2]" 1
1012 1 37 THR H 1 37 THR HB . . 3.690 2.598 2.569 2.625 . 0 0 "[ . 1 . 2]" 1
1013 1 37 THR H 1 37 THR MG . . 4.080 2.070 2.042 2.127 . 0 0 "[ . 1 . 2]" 1
1014 1 37 THR H 1 38 ILE H . . 4.080 2.556 2.529 2.593 . 0 0 "[ . 1 . 2]" 1
1015 1 37 THR H 1 38 ILE HA . . 5.700 5.194 5.157 5.222 . 0 0 "[ . 1 . 2]" 1
1016 1 37 THR H 1 38 ILE MG . . 5.250 4.058 4.004 4.104 . 0 0 "[ . 1 . 2]" 1
1017 1 37 THR H 1 39 CYS H . . 4.890 3.987 3.945 4.148 . 0 0 "[ . 1 . 2]" 1
1018 1 37 THR H 1 48 ILE MD . . 5.590 4.715 4.655 4.832 . 0 0 "[ . 1 . 2]" 1
1019 1 37 THR HA 1 38 ILE H . . 4.310 3.518 3.489 3.540 . 0 0 "[ . 1 . 2]" 1
1020 1 37 THR HA 1 39 CYS H . . 5.250 4.123 3.987 4.194 . 0 0 "[ . 1 . 2]" 1
1021 1 37 THR HA 1 40 ASN H . . 5.140 3.528 3.398 3.656 . 0 0 "[ . 1 . 2]" 1
1022 1 37 THR HA 1 40 ASN HB2 . . 5.520 3.470 3.216 3.781 . 0 0 "[ . 1 . 2]" 1
1023 1 37 THR HA 1 40 ASN HB3 . . 5.170 3.127 2.977 3.390 . 0 0 "[ . 1 . 2]" 1
1024 1 37 THR HA 1 40 ASN HD21 . . 5.750 5.305 4.051 5.773 0.023 6 0 "[ . 1 . 2]" 1
1025 1 37 THR HA 1 41 PRO HD3 . . 5.360 3.936 3.705 4.116 . 0 0 "[ . 1 . 2]" 1
1026 1 37 THR HB 1 38 ILE H . . 4.990 4.232 4.196 4.276 . 0 0 "[ . 1 . 2]" 1
1027 1 37 THR HB 1 38 ILE MG . . 5.370 4.795 4.735 4.866 . 0 0 "[ . 1 . 2]" 1
1028 1 37 THR MG 1 38 ILE H . . 4.530 2.606 2.523 2.719 . 0 0 "[ . 1 . 2]" 1
1029 1 37 THR MG 1 38 ILE HA . . 4.730 3.625 3.539 3.708 . 0 0 "[ . 1 . 2]" 1
1030 1 37 THR MG 1 38 ILE HG13 . . 4.780 4.429 3.719 4.873 0.093 8 0 "[ . 1 . 2]" 1
1031 1 37 THR MG 1 38 ILE MG . . 3.850 2.207 2.148 2.252 . 0 0 "[ . 1 . 2]" 1
1032 1 37 THR MG 1 39 CYS H . . 5.540 4.496 4.445 4.604 . 0 0 "[ . 1 . 2]" 1
1033 1 38 ILE H 1 38 ILE HG12 . . 3.980 2.570 1.959 3.519 . 0 0 "[ . 1 . 2]" 1
1034 1 38 ILE H 1 38 ILE HG13 . . 4.340 2.616 1.972 3.066 . 0 0 "[ . 1 . 2]" 1
1035 1 38 ILE H 1 38 ILE MD . . 5.040 3.579 3.276 3.696 . 0 0 "[ . 1 . 2]" 1
1036 1 38 ILE H 1 38 ILE MG . . 4.140 2.474 2.421 2.554 . 0 0 "[ . 1 . 2]" 1
1037 1 38 ILE H 1 39 CYS H . . 3.890 2.367 2.313 2.428 . 0 0 "[ . 1 . 2]" 1
1038 1 38 ILE H 1 39 CYS QB . . 5.460 4.385 4.284 4.613 . 0 0 "[ . 1 . 2]" 1
1039 1 38 ILE H 1 40 ASN H . . 5.340 3.921 3.849 4.012 . 0 0 "[ . 1 . 2]" 1
1040 1 38 ILE H 1 41 PRO HD2 . . 5.320 4.673 4.554 4.965 . 0 0 "[ . 1 . 2]" 1
1041 1 38 ILE H 1 45 VAL QG . . 5.710 5.572 5.434 5.755 0.045 6 0 "[ . 1 . 2]" 1
1042 1 38 ILE HA 1 38 ILE MD . . 4.800 3.953 3.633 4.167 . 0 0 "[ . 1 . 2]" 1
1043 1 38 ILE HA 1 40 ASN H . . 5.250 4.302 4.186 4.444 . 0 0 "[ . 1 . 2]" 1
1044 1 38 ILE HA 1 41 PRO HD2 . . 5.300 3.397 3.265 3.754 . 0 0 "[ . 1 . 2]" 1
1045 1 38 ILE HA 1 41 PRO HD3 . . 5.120 4.008 3.761 4.388 . 0 0 "[ . 1 . 2]" 1
1046 1 38 ILE HA 1 41 PRO QG . . 4.920 3.294 3.077 3.807 . 0 0 "[ . 1 . 2]" 1
1047 1 38 ILE HB 1 39 CYS H . . 4.730 4.190 4.104 4.337 . 0 0 "[ . 1 . 2]" 1
1048 1 38 ILE HB 1 75 LEU MD1 . . 4.990 3.495 3.105 3.903 . 0 0 "[ . 1 . 2]" 1
1049 1 38 ILE HB 1 75 LEU MD2 . . 4.770 2.550 2.180 2.916 . 0 0 "[ . 1 . 2]" 1
1050 1 38 ILE HG12 1 39 CYS H . . 4.830 3.682 3.012 4.810 . 0 0 "[ . 1 . 2]" 1
1051 1 38 ILE HG12 1 87 LEU QD . . 5.310 4.013 3.105 4.629 . 0 0 "[ . 1 . 2]" 1
1052 1 38 ILE HG13 1 39 CYS H . . 4.470 2.850 2.695 3.293 . 0 0 "[ . 1 . 2]" 1
1053 1 38 ILE HG13 1 39 CYS HA . . 5.220 4.170 3.631 5.239 0.019 11 0 "[ . 1 . 2]" 1
1054 1 38 ILE HG13 1 40 ASN H . . 5.200 5.011 4.837 5.251 0.051 11 0 "[ . 1 . 2]" 1
1055 1 38 ILE MD 1 39 CYS H . . 5.200 3.749 2.855 4.324 . 0 0 "[ . 1 . 2]" 1
1056 1 38 ILE MD 1 39 CYS QB . . 4.830 4.199 2.132 4.857 0.027 12 0 "[ . 1 . 2]" 1
1057 1 38 ILE MD 1 75 LEU MD1 . . 3.290 2.635 2.093 3.309 0.019 13 0 "[ . 1 . 2]" 1
1058 1 38 ILE MD 1 89 ILE QG . . 5.600 5.355 4.963 5.608 0.008 13 0 "[ . 1 . 2]" 1
1059 1 38 ILE MD 1 38 ILE MG . . 3.960 2.476 2.012 3.208 . 0 0 "[ . 1 . 2]" 1
1060 1 38 ILE MG 1 39 CYS H . . 4.990 4.162 4.122 4.276 . 0 0 "[ . 1 . 2]" 1
1061 1 38 ILE MG 1 39 CYS HA . . 5.750 5.562 5.517 5.616 . 0 0 "[ . 1 . 2]" 1
1062 1 38 ILE MG 1 75 LEU MD2 . . 4.540 3.767 3.374 4.137 . 0 0 "[ . 1 . 2]" 1
1063 1 38 ILE MG 1 80 ILE HA . . 5.140 3.577 3.187 3.990 . 0 0 "[ . 1 . 2]" 1
1064 1 38 ILE MG 1 80 ILE MG . . 4.670 2.451 2.178 2.954 . 0 0 "[ . 1 . 2]" 1
1065 1 38 ILE MG 1 87 LEU MD1 . . 4.970 3.772 3.635 3.936 . 0 0 "[ . 1 . 2]" 1
1066 1 38 ILE MG 1 87 LEU MD2 . . 4.970 4.995 4.963 5.016 0.046 1 0 "[ . 1 . 2]" 1
1067 1 38 ILE MG 1 87 LEU QD . . 4.200 3.665 3.551 3.801 . 0 0 "[ . 1 . 2]" 1
1068 1 39 CYS H 1 40 ASN H . . 4.050 2.262 2.058 2.313 . 0 0 "[ . 1 . 2]" 1
1069 1 39 CYS H 1 40 ASN HA . . 5.570 4.840 4.608 4.906 . 0 0 "[ . 1 . 2]" 1
1070 1 39 CYS H 1 41 PRO HD3 . . 5.750 4.563 4.321 4.683 . 0 0 "[ . 1 . 2]" 1
1071 1 39 CYS H 1 45 VAL MG1 . . 5.750 5.545 5.386 5.690 . 0 0 "[ . 1 . 2]" 1
1072 1 39 CYS H 1 45 VAL MG2 . . 5.750 4.074 3.953 4.337 . 0 0 "[ . 1 . 2]" 1
1073 1 39 CYS H 1 45 VAL QG . . 4.920 3.975 3.858 4.202 . 0 0 "[ . 1 . 2]" 1
1074 1 39 CYS H 1 60 VAL MG1 . . 5.750 5.464 5.305 5.671 . 0 0 "[ . 1 . 2]" 1
1075 1 39 CYS H 1 60 VAL MG2 . . 5.750 5.670 5.546 5.782 0.032 11 0 "[ . 1 . 2]" 1
1076 1 39 CYS H 1 62 PHE HZ . . 5.730 5.706 5.586 5.782 0.052 19 0 "[ . 1 . 2]" 1
1077 1 39 CYS H 1 75 LEU MD1 . . 5.430 4.024 3.625 4.198 . 0 0 "[ . 1 . 2]" 1
1078 1 39 CYS HA 1 41 PRO HD3 . . 5.750 5.136 4.800 5.258 . 0 0 "[ . 1 . 2]" 1
1079 1 39 CYS HA 1 42 CYS H . . 4.930 3.499 3.266 3.782 . 0 0 "[ . 1 . 2]" 1
1080 1 39 CYS HA 1 42 CYS QB . . 4.940 2.826 2.569 3.148 . 0 0 "[ . 1 . 2]" 1
1081 1 39 CYS HA 1 45 VAL QG . . 5.050 3.985 3.873 4.461 . 0 0 "[ . 1 . 2]" 1
1082 1 39 CYS HA 1 62 PHE HZ . . 5.100 3.725 3.458 4.159 . 0 0 "[ . 1 . 2]" 1
1083 1 39 CYS HA 1 71 ALA HA . . 5.130 4.716 4.439 4.922 . 0 0 "[ . 1 . 2]" 1
1084 1 39 CYS HA 1 71 ALA MB . . 5.070 4.144 3.928 4.309 . 0 0 "[ . 1 . 2]" 1
1085 1 39 CYS HA 1 75 LEU HG . . 5.610 4.528 4.094 4.672 . 0 0 "[ . 1 . 2]" 1
1086 1 39 CYS HA 1 75 LEU MD1 . . 4.080 2.149 2.013 2.254 . 0 0 "[ . 1 . 2]" 1
1087 1 39 CYS HA 1 75 LEU MD2 . . 5.380 3.771 3.458 3.945 . 0 0 "[ . 1 . 2]" 1
1088 1 39 CYS HB2 1 40 ASN H . . 5.300 3.302 3.081 4.391 . 0 0 "[ . 1 . 2]" 1
1089 1 39 CYS HB2 1 48 ILE MD . . 5.690 3.520 3.126 5.009 . 0 0 "[ . 1 . 2]" 1
1090 1 39 CYS HB2 1 62 PHE HZ . . 5.000 3.761 2.065 4.064 . 0 0 "[ . 1 . 2]" 1
1091 1 39 CYS HB3 1 40 ASN H . . 5.300 4.031 3.915 4.394 . 0 0 "[ . 1 . 2]" 1
1092 1 39 CYS HB3 1 48 ILE MD . . 5.690 4.434 4.138 4.663 . 0 0 "[ . 1 . 2]" 1
1093 1 39 CYS HB3 1 62 PHE HZ . . 5.000 2.389 2.155 3.751 . 0 0 "[ . 1 . 2]" 1
1094 1 39 CYS QB 1 40 ASN H . . 4.730 3.147 2.973 3.913 . 0 0 "[ . 1 . 2]" 1
1095 1 39 CYS QB 1 42 CYS H . . 5.660 4.548 4.351 4.687 . 0 0 "[ . 1 . 2]" 1
1096 1 39 CYS QB 1 45 VAL QG . . 3.970 2.092 1.882 3.243 . 0 0 "[ . 1 . 2]" 1
1097 1 39 CYS QB 1 48 ILE HG12 . . 5.660 4.928 4.680 5.682 0.022 11 0 "[ . 1 . 2]" 1
1098 1 39 CYS QB 1 48 ILE MD . . 5.310 3.359 3.039 4.286 . 0 0 "[ . 1 . 2]" 1
1099 1 39 CYS QB 1 60 VAL HB . . 5.520 5.036 4.846 5.145 . 0 0 "[ . 1 . 2]" 1
1100 1 39 CYS QB 1 60 VAL QG . . 4.540 2.807 2.599 3.105 . 0 0 "[ . 1 . 2]" 1
1101 1 39 CYS QB 1 62 PHE HZ . . 4.380 2.213 2.054 2.329 . 0 0 "[ . 1 . 2]" 1
1102 1 39 CYS QB 1 62 PHE QE . . 5.410 2.940 2.785 3.398 . 0 0 "[ . 1 . 2]" 1
1103 1 39 CYS QB 1 75 LEU MD1 . . 4.990 3.381 2.156 3.579 . 0 0 "[ . 1 . 2]" 1
1104 1 40 ASN H 1 40 ASN HB2 . . 3.850 2.474 2.379 2.576 . 0 0 "[ . 1 . 2]" 1
1105 1 40 ASN H 1 40 ASN HB3 . . 3.950 2.490 2.420 2.581 . 0 0 "[ . 1 . 2]" 1
1106 1 40 ASN H 1 40 ASN HD21 . . 5.330 4.540 4.390 4.746 . 0 0 "[ . 1 . 2]" 1
1107 1 40 ASN H 1 41 PRO HD2 . . 4.390 2.316 2.278 2.362 . 0 0 "[ . 1 . 2]" 1
1108 1 40 ASN H 1 41 PRO HD3 . . 4.290 3.056 2.911 3.144 . 0 0 "[ . 1 . 2]" 1
1109 1 40 ASN H 1 41 PRO HG2 . . 5.520 4.626 4.584 4.672 . 0 0 "[ . 1 . 2]" 1
1110 1 40 ASN H 1 41 PRO HG3 . . 5.520 4.819 4.765 4.863 . 0 0 "[ . 1 . 2]" 1
1111 1 40 ASN H 1 41 PRO QG . . 5.090 4.201 4.159 4.236 . 0 0 "[ . 1 . 2]" 1
1112 1 40 ASN H 1 42 CYS H . . 5.240 4.063 3.992 4.157 . 0 0 "[ . 1 . 2]" 1
1113 1 40 ASN H 1 45 VAL QG . . 4.230 3.577 3.346 3.703 . 0 0 "[ . 1 . 2]" 1
1114 1 40 ASN H 1 48 ILE MD . . 5.750 5.320 5.152 5.508 . 0 0 "[ . 1 . 2]" 1
1115 1 40 ASN H 1 60 VAL QG . . 5.710 5.714 5.591 5.783 0.073 14 0 "[ . 1 . 2]" 1
1116 1 40 ASN H 1 75 LEU MD1 . . 5.750 5.023 4.846 5.114 . 0 0 "[ . 1 . 2]" 1
1117 1 40 ASN HA 1 40 ASN HD22 . . 5.030 3.980 3.712 4.700 . 0 0 "[ . 1 . 2]" 1
1118 1 40 ASN HA 1 42 CYS H . . 4.890 3.757 3.610 3.870 . 0 0 "[ . 1 . 2]" 1
1119 1 40 ASN HA 1 43 GLY H . . 4.690 3.430 3.286 3.679 . 0 0 "[ . 1 . 2]" 1
1120 1 40 ASN HA 1 45 VAL H . . 4.480 3.598 3.299 3.955 . 0 0 "[ . 1 . 2]" 1
1121 1 40 ASN HA 1 45 VAL HB . . 5.300 4.174 3.941 4.384 . 0 0 "[ . 1 . 2]" 1
1122 1 40 ASN HA 1 45 VAL QG . . 3.980 2.750 2.389 2.988 . 0 0 "[ . 1 . 2]" 1
1123 1 40 ASN HA 1 62 PHE QE . . 5.490 4.303 3.999 4.486 . 0 0 "[ . 1 . 2]" 1
1124 1 40 ASN HB2 1 41 PRO HD2 . . 4.950 4.148 4.092 4.258 . 0 0 "[ . 1 . 2]" 1
1125 1 40 ASN HB2 1 41 PRO HD3 . . 5.330 3.864 3.806 3.948 . 0 0 "[ . 1 . 2]" 1
1126 1 40 ASN HB2 1 45 VAL H . . 5.650 4.968 4.569 5.430 . 0 0 "[ . 1 . 2]" 1
1127 1 40 ASN HB2 1 45 VAL QG . . 4.680 3.820 3.501 4.057 . 0 0 "[ . 1 . 2]" 1
1128 1 40 ASN HB3 1 41 PRO HD2 . . 4.750 3.104 2.987 3.313 . 0 0 "[ . 1 . 2]" 1
1129 1 40 ASN HB3 1 41 PRO HD3 . . 4.960 2.248 2.188 2.348 . 0 0 "[ . 1 . 2]" 1
1130 1 40 ASN HB3 1 45 VAL QG . . 5.010 4.823 4.563 5.015 0.005 14 0 "[ . 1 . 2]" 1
1131 1 40 ASN HD21 1 41 PRO HD2 . . 5.750 5.803 5.621 5.872 0.122 11 0 "[ . 1 . 2]" 1
1132 1 40 ASN HD22 1 45 VAL QG . . 5.710 5.327 4.572 5.759 0.049 1 0 "[ . 1 . 2]" 1
1133 1 41 PRO HA 1 43 GLY H . . 4.800 3.995 3.686 4.160 . 0 0 "[ . 1 . 2]" 1
1134 1 41 PRO HB2 1 42 CYS H . . 4.640 4.001 3.937 4.131 . 0 0 "[ . 1 . 2]" 1
1135 1 41 PRO HB2 1 43 GLY H . . 5.670 5.548 5.353 5.629 . 0 0 "[ . 1 . 2]" 1
1136 1 41 PRO HB3 1 42 CYS H . . 5.230 4.488 4.449 4.556 . 0 0 "[ . 1 . 2]" 1
1137 1 41 PRO HD2 1 42 CYS H . . 4.700 2.849 2.763 3.007 . 0 0 "[ . 1 . 2]" 1
1138 1 41 PRO HD2 1 43 GLY H . . 5.320 4.676 4.569 4.931 . 0 0 "[ . 1 . 2]" 1
1139 1 41 PRO HD3 1 42 CYS H . . 5.430 3.966 3.914 4.056 . 0 0 "[ . 1 . 2]" 1
1140 1 41 PRO HG2 1 42 CYS H . . 5.420 3.020 2.888 3.261 . 0 0 "[ . 1 . 2]" 1
1141 1 41 PRO HG3 1 42 CYS H . . 5.420 4.434 4.335 4.614 . 0 0 "[ . 1 . 2]" 1
1142 1 42 CYS H 1 42 CYS QB . . 3.750 2.425 2.373 2.519 . 0 0 "[ . 1 . 2]" 1
1143 1 42 CYS H 1 43 GLY H . . 3.680 2.229 2.062 2.356 . 0 0 "[ . 1 . 2]" 1
1144 1 42 CYS H 1 43 GLY QA . . 5.290 4.319 4.166 4.430 . 0 0 "[ . 1 . 2]" 1
1145 1 42 CYS H 1 45 VAL QG . . 5.460 4.662 4.435 4.842 . 0 0 "[ . 1 . 2]" 1
1146 1 42 CYS H 1 62 PHE QE . . 5.300 4.372 4.031 4.558 . 0 0 "[ . 1 . 2]" 1
1147 1 42 CYS H 1 71 ALA MB . . 5.540 5.265 4.960 5.428 . 0 0 "[ . 1 . 2]" 1
1148 1 42 CYS H 1 75 LEU MD1 . . 5.440 4.422 4.093 4.902 . 0 0 "[ . 1 . 2]" 1
1149 1 42 CYS HA 1 70 ARG HD2 . . 5.750 4.953 2.722 5.460 . 0 0 "[ . 1 . 2]" 1
1150 1 42 CYS HA 1 70 ARG HD3 . . 5.750 3.975 2.438 5.783 0.033 10 0 "[ . 1 . 2]" 1
1151 1 42 CYS HA 1 70 ARG QB . . 5.510 4.371 3.650 4.586 . 0 0 "[ . 1 . 2]" 1
1152 1 42 CYS HA 1 70 ARG QG . . 5.290 3.162 2.531 3.391 . 0 0 "[ . 1 . 2]" 1
1153 1 42 CYS HA 1 71 ALA HA . . 5.280 4.593 4.409 4.811 . 0 0 "[ . 1 . 2]" 1
1154 1 42 CYS HA 1 71 ALA MB . . 5.660 5.176 4.867 5.376 . 0 0 "[ . 1 . 2]" 1
1155 1 42 CYS HB2 1 71 ALA HA . . 4.810 3.034 2.743 3.193 . 0 0 "[ . 1 . 2]" 1
1156 1 42 CYS HB2 1 71 ALA MB . . 4.420 3.269 2.856 3.443 . 0 0 "[ . 1 . 2]" 1
1157 1 42 CYS HB3 1 71 ALA HA . . 4.810 2.197 2.103 2.350 . 0 0 "[ . 1 . 2]" 1
1158 1 42 CYS HB3 1 71 ALA MB . . 4.420 3.196 2.774 3.515 . 0 0 "[ . 1 . 2]" 1
1159 1 42 CYS QB 1 43 GLY H . . 4.660 3.158 2.981 3.377 . 0 0 "[ . 1 . 2]" 1
1160 1 42 CYS QB 1 62 PHE QE . . 5.140 3.341 2.978 3.849 . 0 0 "[ . 1 . 2]" 1
1161 1 42 CYS QB 1 70 ARG HA . . 5.660 5.040 4.725 5.314 . 0 0 "[ . 1 . 2]" 1
1162 1 42 CYS QB 1 70 ARG QB . . 5.080 3.607 2.930 3.931 . 0 0 "[ . 1 . 2]" 1
1163 1 42 CYS QB 1 70 ARG QD . . 5.310 4.107 3.424 4.409 . 0 0 "[ . 1 . 2]" 1
1164 1 42 CYS QB 1 70 ARG QG . . 5.310 2.926 2.436 3.273 . 0 0 "[ . 1 . 2]" 1
1165 1 42 CYS QB 1 71 ALA H . . 4.900 3.781 3.267 4.004 . 0 0 "[ . 1 . 2]" 1
1166 1 42 CYS QB 1 71 ALA HA . . 4.360 2.145 2.073 2.278 . 0 0 "[ . 1 . 2]" 1
1167 1 42 CYS QB 1 74 SER H . . 5.660 4.825 4.526 5.177 . 0 0 "[ . 1 . 2]" 1
1168 1 42 CYS QB 1 75 LEU MD1 . . 5.320 2.989 2.483 3.744 . 0 0 "[ . 1 . 2]" 1
1169 1 43 GLY H 1 45 VAL QG . . 5.280 4.105 3.806 4.424 . 0 0 "[ . 1 . 2]" 1
1170 1 43 GLY H 1 62 PHE QD . . 5.730 4.717 4.524 4.933 . 0 0 "[ . 1 . 2]" 1
1171 1 43 GLY H 1 62 PHE QE . . 4.920 3.469 3.231 3.922 . 0 0 "[ . 1 . 2]" 1
1172 1 43 GLY QA 1 44 PRO HA . . 4.830 4.055 4.033 4.077 . 0 0 "[ . 1 . 2]" 1
1173 1 43 GLY QA 1 44 PRO HB3 . . 5.390 4.583 4.532 5.094 . 0 0 "[ . 1 . 2]" 1
1174 1 43 GLY QA 1 44 PRO QD . . 4.380 2.030 1.932 2.046 . 0 0 "[ . 1 . 2]" 1
1175 1 43 GLY QA 1 62 PHE QD . . 5.360 3.012 2.869 3.331 . 0 0 "[ . 1 . 2]" 1
1176 1 43 GLY QA 1 62 PHE QE . . 5.000 3.274 3.002 3.806 . 0 0 "[ . 1 . 2]" 1
1177 1 44 PRO HA 1 45 VAL H . . 3.540 2.182 2.157 2.247 . 0 0 "[ . 1 . 2]" 1
1178 1 44 PRO HA 1 45 VAL HB . . 5.650 4.529 4.477 4.586 . 0 0 "[ . 1 . 2]" 1
1179 1 44 PRO HA 1 45 VAL QG . . 4.610 3.803 3.682 3.891 . 0 0 "[ . 1 . 2]" 1
1180 1 44 PRO HA 1 63 ASP QB . . 5.660 4.941 4.803 5.154 . 0 0 "[ . 1 . 2]" 1
1181 1 44 PRO HB2 1 45 VAL H . . 5.500 3.950 3.790 4.119 . 0 0 "[ . 1 . 2]" 1
1182 1 44 PRO HB2 1 45 VAL HA . . 5.410 4.883 4.696 4.985 . 0 0 "[ . 1 . 2]" 1
1183 1 44 PRO HB2 1 46 GLN HE21 . . 4.300 3.366 2.396 3.718 . 0 0 "[ . 1 . 2]" 1
1184 1 44 PRO HB2 1 46 GLN HE22 . . 4.360 3.781 2.469 4.358 . 0 0 "[ . 1 . 2]" 1
1185 1 44 PRO HB2 1 63 ASP H . . 4.610 3.642 2.848 3.768 . 0 0 "[ . 1 . 2]" 1
1186 1 44 PRO HB2 1 63 ASP HB2 . . 5.270 2.973 2.617 3.159 . 0 0 "[ . 1 . 2]" 1
1187 1 44 PRO HB2 1 63 ASP HB3 . . 5.270 3.190 2.463 3.496 . 0 0 "[ . 1 . 2]" 1
1188 1 44 PRO HB2 1 63 ASP QB . . 4.840 2.730 2.256 2.938 . 0 0 "[ . 1 . 2]" 1
1189 1 44 PRO HB2 1 64 SER H . . 5.750 5.677 4.788 5.835 0.085 19 0 "[ . 1 . 2]" 1
1190 1 44 PRO HB3 1 45 VAL H . . 5.180 4.282 3.925 4.436 . 0 0 "[ . 1 . 2]" 1
1191 1 44 PRO HB3 1 46 GLN HE21 . . 5.370 4.909 4.121 5.071 . 0 0 "[ . 1 . 2]" 1
1192 1 44 PRO HB3 1 46 GLN HE22 . . 5.280 5.173 4.024 5.313 0.033 7 0 "[ . 1 . 2]" 1
1193 1 44 PRO HB3 1 63 ASP H . . 5.640 5.112 4.591 5.236 . 0 0 "[ . 1 . 2]" 1
1194 1 44 PRO HB3 1 63 ASP HB2 . . 5.210 4.600 3.852 4.802 . 0 0 "[ . 1 . 2]" 1
1195 1 44 PRO HB3 1 63 ASP HB3 . . 5.210 4.420 3.953 4.651 . 0 0 "[ . 1 . 2]" 1
1196 1 44 PRO HB3 1 63 ASP QB . . 4.790 4.010 3.474 4.191 . 0 0 "[ . 1 . 2]" 1
1197 1 44 PRO HG2 1 62 PHE QB . . 5.120 3.704 3.405 5.222 0.102 20 0 "[ . 1 . 2]" 1
1198 1 44 PRO HG3 1 63 ASP QB . . 5.310 3.072 2.950 4.383 . 0 0 "[ . 1 . 2]" 1
1199 1 44 PRO QD 1 45 VAL H . . 5.430 4.804 4.704 4.879 . 0 0 "[ . 1 . 2]" 1
1200 1 44 PRO QD 1 62 PHE QB . . 5.660 4.004 3.535 4.317 . 0 0 "[ . 1 . 2]" 1
1201 1 44 PRO QD 1 62 PHE QD . . 5.490 3.398 3.143 3.774 . 0 0 "[ . 1 . 2]" 1
1202 1 45 VAL H 1 45 VAL HB . . 4.270 2.376 2.340 2.409 . 0 0 "[ . 1 . 2]" 1
1203 1 45 VAL H 1 45 VAL MG1 . . 4.630 3.750 3.739 3.762 . 0 0 "[ . 1 . 2]" 1
1204 1 45 VAL H 1 45 VAL MG2 . . 4.630 2.367 2.257 2.483 . 0 0 "[ . 1 . 2]" 1
1205 1 45 VAL H 1 45 VAL QG . . 3.770 2.343 2.240 2.450 . 0 0 "[ . 1 . 2]" 1
1206 1 45 VAL H 1 46 GLN H . . 5.340 4.634 4.612 4.652 . 0 0 "[ . 1 . 2]" 1
1207 1 45 VAL H 1 62 PHE HA . . 5.580 4.849 4.791 4.941 . 0 0 "[ . 1 . 2]" 1
1208 1 45 VAL H 1 62 PHE QD . . 5.280 4.132 3.845 4.312 . 0 0 "[ . 1 . 2]" 1
1209 1 45 VAL H 1 62 PHE QE . . 5.580 4.413 4.024 4.683 . 0 0 "[ . 1 . 2]" 1
1210 1 45 VAL HA 1 46 GLN H . . 3.860 2.305 2.250 2.329 . 0 0 "[ . 1 . 2]" 1
1211 1 45 VAL HA 1 46 GLN HB2 . . 5.750 4.538 4.505 4.626 . 0 0 "[ . 1 . 2]" 1
1212 1 45 VAL HA 1 46 GLN HE21 . . 5.060 3.997 3.675 4.098 . 0 0 "[ . 1 . 2]" 1
1213 1 45 VAL HA 1 46 GLN HG2 . . 4.980 3.546 3.460 3.609 . 0 0 "[ . 1 . 2]" 1
1214 1 45 VAL HA 1 46 GLN HG3 . . 5.750 5.211 5.170 5.273 . 0 0 "[ . 1 . 2]" 1
1215 1 45 VAL HA 1 47 ARG H . . 5.120 4.150 4.030 4.222 . 0 0 "[ . 1 . 2]" 1
1216 1 45 VAL HA 1 60 VAL QG . . 4.970 3.775 3.677 3.856 . 0 0 "[ . 1 . 2]" 1
1217 1 45 VAL HA 1 62 PHE HA . . 4.130 2.329 2.246 2.438 . 0 0 "[ . 1 . 2]" 1
1218 1 45 VAL HA 1 62 PHE QB . . 5.230 3.860 3.787 3.965 . 0 0 "[ . 1 . 2]" 1
1219 1 45 VAL HA 1 62 PHE QD . . 4.920 3.153 3.054 3.327 . 0 0 "[ . 1 . 2]" 1
1220 1 45 VAL HA 1 63 ASP H . . 5.320 3.971 3.877 4.238 . 0 0 "[ . 1 . 2]" 1
1221 1 45 VAL HB 1 109 TYR QD . . 4.790 4.369 4.236 4.540 . 0 0 "[ . 1 . 2]" 1
1222 1 45 VAL HB 1 48 ILE MD . . 5.000 4.097 3.957 4.418 . 0 0 "[ . 1 . 2]" 1
1223 1 45 VAL HB 1 62 PHE HZ . . 6.000 6.107 6.054 6.154 0.154 18 0 "[ . 1 . 2]" 1
1224 1 45 VAL MG1 1 46 GLN H . . 5.130 2.231 2.190 2.331 . 0 0 "[ . 1 . 2]" 1
1225 1 45 VAL MG1 1 62 PHE HA . . 5.410 3.850 3.779 3.996 . 0 0 "[ . 1 . 2]" 1
1226 1 45 VAL MG2 1 46 GLN H . . 5.130 3.822 3.745 3.930 . 0 0 "[ . 1 . 2]" 1
1227 1 45 VAL MG2 1 62 PHE HA . . 5.410 3.983 3.836 4.183 . 0 0 "[ . 1 . 2]" 1
1228 1 45 VAL QG 1 109 TYR HB2 . . 5.710 3.690 3.546 4.072 . 0 0 "[ . 1 . 2]" 1
1229 1 45 VAL QG 1 109 TYR QD . . 4.210 2.814 2.720 2.924 . 0 0 "[ . 1 . 2]" 1
1230 1 45 VAL QG 1 46 GLN H . . 4.210 2.216 2.177 2.312 . 0 0 "[ . 1 . 2]" 1
1231 1 45 VAL QG 1 47 ARG H . . 4.320 2.479 2.389 2.597 . 0 0 "[ . 1 . 2]" 1
1232 1 45 VAL QG 1 47 ARG HA . . 4.910 3.447 3.357 3.547 . 0 0 "[ . 1 . 2]" 1
1233 1 45 VAL QG 1 48 ILE HA . . 5.600 4.360 4.267 4.506 . 0 0 "[ . 1 . 2]" 1
1234 1 45 VAL QG 1 48 ILE HG12 . . 5.040 2.810 2.703 2.986 . 0 0 "[ . 1 . 2]" 1
1235 1 45 VAL QG 1 48 ILE HG13 . . 4.560 2.409 2.307 2.544 . 0 0 "[ . 1 . 2]" 1
1236 1 45 VAL QG 1 48 ILE MD . . 4.070 2.152 2.087 2.315 . 0 0 "[ . 1 . 2]" 1
1237 1 45 VAL QG 1 48 ILE MG . . 4.900 4.165 4.091 4.309 . 0 0 "[ . 1 . 2]" 1
1238 1 45 VAL QG 1 60 VAL HA . . 5.180 3.891 3.783 4.082 . 0 0 "[ . 1 . 2]" 1
1239 1 45 VAL QG 1 60 VAL QG . . 3.580 2.084 1.993 2.185 . 0 0 "[ . 1 . 2]" 1
1240 1 45 VAL QG 1 61 GLU H . . 5.080 2.945 2.781 3.212 . 0 0 "[ . 1 . 2]" 1
1241 1 45 VAL QG 1 62 PHE HA . . 4.840 3.485 3.410 3.591 . 0 0 "[ . 1 . 2]" 1
1242 1 45 VAL QG 1 62 PHE HZ . . 4.980 2.954 2.902 2.981 . 0 0 "[ . 1 . 2]" 1
1243 1 45 VAL QG 1 62 PHE QD . . 5.710 3.106 3.027 3.184 . 0 0 "[ . 1 . 2]" 1
1244 1 45 VAL QG 1 62 PHE QE . . 4.090 2.389 2.294 2.481 . 0 0 "[ . 1 . 2]" 1
1245 1 45 VAL QG 1 63 ASP H . . 5.710 4.872 4.791 5.058 . 0 0 "[ . 1 . 2]" 1
1246 1 45 VAL QG 1 71 ALA MB . . 5.660 4.264 4.199 4.332 . 0 0 "[ . 1 . 2]" 1
1247 1 46 GLN H 1 109 TYR QD . . 5.650 4.670 4.549 4.818 . 0 0 "[ . 1 . 2]" 1
1248 1 46 GLN H 1 110 THR HB . . 5.750 5.778 5.646 5.852 0.102 17 0 "[ . 1 . 2]" 1
1249 1 46 GLN H 1 110 THR MG . . 5.430 5.285 5.161 5.448 0.018 15 0 "[ . 1 . 2]" 1
1250 1 46 GLN H 1 46 GLN HB2 . . 4.350 2.526 2.493 2.610 . 0 0 "[ . 1 . 2]" 1
1251 1 46 GLN H 1 46 GLN HE21 . . 5.140 3.721 3.651 3.899 . 0 0 "[ . 1 . 2]" 1
1252 1 46 GLN H 1 46 GLN HE22 . . 5.460 5.317 5.102 5.395 . 0 0 "[ . 1 . 2]" 1
1253 1 46 GLN H 1 46 GLN HG2 . . 4.720 2.803 2.632 2.883 . 0 0 "[ . 1 . 2]" 1
1254 1 46 GLN H 1 46 GLN HG3 . . 4.790 4.035 3.995 4.083 . 0 0 "[ . 1 . 2]" 1
1255 1 46 GLN H 1 47 ARG H . . 4.090 2.048 2.004 2.113 . 0 0 "[ . 1 . 2]" 1
1256 1 46 GLN H 1 47 ARG HA . . 5.630 4.575 4.534 4.616 . 0 0 "[ . 1 . 2]" 1
1257 1 46 GLN H 1 60 VAL HA . . 5.750 5.693 5.608 5.765 0.015 19 0 "[ . 1 . 2]" 1
1258 1 46 GLN H 1 60 VAL QG . . 5.130 3.904 3.772 4.019 . 0 0 "[ . 1 . 2]" 1
1259 1 46 GLN H 1 61 GLU H . . 5.470 3.671 3.625 3.727 . 0 0 "[ . 1 . 2]" 1
1260 1 46 GLN H 1 61 GLU HA . . 5.720 4.956 4.890 5.006 . 0 0 "[ . 1 . 2]" 1
1261 1 46 GLN H 1 62 PHE H . . 5.740 4.630 4.573 4.686 . 0 0 "[ . 1 . 2]" 1
1262 1 46 GLN H 1 62 PHE HA . . 4.250 2.820 2.784 2.864 . 0 0 "[ . 1 . 2]" 1
1263 1 46 GLN H 1 62 PHE QD . . 5.750 4.790 4.729 4.839 . 0 0 "[ . 1 . 2]" 1
1264 1 46 GLN H 1 63 ASP H . . 5.440 4.716 4.619 4.817 . 0 0 "[ . 1 . 2]" 1
1265 1 46 GLN H 1 63 ASP HA . . 5.850 5.815 5.723 5.902 0.052 6 0 "[ . 1 . 2]" 1
1266 1 46 GLN HA 1 109 TYR H . . 5.030 3.732 3.483 3.887 . 0 0 "[ . 1 . 2]" 1
1267 1 46 GLN HA 1 109 TYR HB2 . . 4.910 2.969 2.807 3.163 . 0 0 "[ . 1 . 2]" 1
1268 1 46 GLN HA 1 109 TYR QD . . 5.220 4.162 3.945 4.358 . 0 0 "[ . 1 . 2]" 1
1269 1 46 GLN HA 1 110 THR HB . . 4.350 2.920 2.826 3.075 . 0 0 "[ . 1 . 2]" 1
1270 1 46 GLN HA 1 110 THR MG . . 3.910 3.371 3.184 3.590 . 0 0 "[ . 1 . 2]" 1
1271 1 46 GLN HA 1 46 GLN HE21 . . 4.620 2.400 2.264 3.693 . 0 0 "[ . 1 . 2]" 1
1272 1 46 GLN HA 1 46 GLN HE22 . . 4.780 3.248 3.191 3.776 . 0 0 "[ . 1 . 2]" 1
1273 1 46 GLN HB2 1 110 THR MG . . 4.380 3.849 3.681 4.048 . 0 0 "[ . 1 . 2]" 1
1274 1 46 GLN HB2 1 46 GLN HE22 . . 5.650 5.177 5.160 5.328 . 0 0 "[ . 1 . 2]" 1
1275 1 46 GLN HB2 1 47 ARG H . . 4.030 2.732 2.659 2.839 . 0 0 "[ . 1 . 2]" 1
1276 1 46 GLN HB2 1 61 GLU HB3 . . 5.130 2.995 2.830 3.212 . 0 0 "[ . 1 . 2]" 1
1277 1 46 GLN HB2 1 61 GLU QG . . 5.050 2.681 2.358 2.929 . 0 0 "[ . 1 . 2]" 1
1278 1 46 GLN HB2 1 62 PHE HA . . 5.220 3.778 3.654 3.928 . 0 0 "[ . 1 . 2]" 1
1279 1 46 GLN HB2 1 63 ASP H . . 5.750 5.065 4.944 5.186 . 0 0 "[ . 1 . 2]" 1
1280 1 46 GLN HB3 1 110 THR HB . . 5.510 3.204 2.774 3.403 . 0 0 "[ . 1 . 2]" 1
1281 1 46 GLN HB3 1 110 THR MG . . 4.270 2.398 2.239 2.624 . 0 0 "[ . 1 . 2]" 1
1282 1 46 GLN HB3 1 47 ARG H . . 5.370 3.778 3.693 3.943 . 0 0 "[ . 1 . 2]" 1
1283 1 46 GLN HE21 1 62 PHE HA . . 5.100 4.254 3.412 4.334 . 0 0 "[ . 1 . 2]" 1
1284 1 46 GLN HE21 1 63 ASP H . . 4.860 4.035 2.811 4.177 . 0 0 "[ . 1 . 2]" 1
1285 1 46 GLN HE21 1 63 ASP HA . . 4.900 4.663 4.047 4.826 . 0 0 "[ . 1 . 2]" 1
1286 1 46 GLN HE21 1 63 ASP QB . . 4.520 3.121 2.398 3.315 . 0 0 "[ . 1 . 2]" 1
1287 1 46 GLN HE22 1 62 PHE HA . . 5.750 5.792 5.143 5.859 0.109 3 0 "[ . 1 . 2]" 1
1288 1 46 GLN HE22 1 63 ASP H . . 5.290 5.078 4.328 5.209 . 0 0 "[ . 1 . 2]" 1
1289 1 46 GLN HE22 1 63 ASP HA . . 5.030 4.968 4.803 5.060 0.030 18 0 "[ . 1 . 2]" 1
1290 1 46 GLN HE22 1 63 ASP QB . . 4.560 3.247 2.849 3.459 . 0 0 "[ . 1 . 2]" 1
1291 1 46 GLN HG2 1 110 THR MG . . 5.270 4.712 4.518 5.057 . 0 0 "[ . 1 . 2]" 1
1292 1 46 GLN HG2 1 62 PHE H . . 5.520 4.657 4.530 4.758 . 0 0 "[ . 1 . 2]" 1
1293 1 46 GLN HG2 1 62 PHE HA . . 4.880 2.605 2.426 2.681 . 0 0 "[ . 1 . 2]" 1
1294 1 46 GLN HG2 1 63 ASP H . . 4.610 2.878 2.789 2.987 . 0 0 "[ . 1 . 2]" 1
1295 1 46 GLN HG2 1 63 ASP HA . . 4.610 3.183 3.092 3.360 . 0 0 "[ . 1 . 2]" 1
1296 1 46 GLN HG2 1 63 ASP QB . . 5.650 2.991 2.887 3.214 . 0 0 "[ . 1 . 2]" 1
1297 1 46 GLN HG3 1 110 THR MG . . 4.940 3.985 3.732 4.354 . 0 0 "[ . 1 . 2]" 1
1298 1 46 GLN HG3 1 47 ARG H . . 5.270 5.019 4.975 5.111 . 0 0 "[ . 1 . 2]" 1
1299 1 46 GLN HG3 1 62 PHE HA . . 5.170 3.849 3.742 3.974 . 0 0 "[ . 1 . 2]" 1
1300 1 46 GLN HG3 1 63 ASP HA . . 4.360 2.547 2.435 2.764 . 0 0 "[ . 1 . 2]" 1
1301 1 46 GLN HG3 1 64 SER H . . 5.750 5.296 5.184 5.455 . 0 0 "[ . 1 . 2]" 1
1302 1 47 ARG H 1 108 ASP HA . . 5.580 4.996 4.724 5.180 . 0 0 "[ . 1 . 2]" 1
1303 1 47 ARG H 1 109 TYR H . . 5.550 4.658 4.512 4.736 . 0 0 "[ . 1 . 2]" 1
1304 1 47 ARG H 1 109 TYR QD . . 5.170 3.933 3.813 4.145 . 0 0 "[ . 1 . 2]" 1
1305 1 47 ARG H 1 110 THR MG . . 5.400 4.946 4.823 5.060 . 0 0 "[ . 1 . 2]" 1
1306 1 47 ARG H 1 47 ARG QD . . 5.550 4.529 2.997 4.686 . 0 0 "[ . 1 . 2]" 1
1307 1 47 ARG H 1 48 ILE H . . 5.230 4.385 4.369 4.420 . 0 0 "[ . 1 . 2]" 1
1308 1 47 ARG H 1 48 ILE HA . . 5.680 4.842 4.809 4.874 . 0 0 "[ . 1 . 2]" 1
1309 1 47 ARG H 1 60 VAL HA . . 5.350 4.631 4.534 4.760 . 0 0 "[ . 1 . 2]" 1
1310 1 47 ARG H 1 60 VAL QG . . 5.310 3.833 3.641 3.957 . 0 0 "[ . 1 . 2]" 1
1311 1 47 ARG H 1 61 GLU H . . 4.420 2.936 2.870 3.028 . 0 0 "[ . 1 . 2]" 1
1312 1 47 ARG H 1 61 GLU HA . . 5.750 4.944 4.806 5.025 . 0 0 "[ . 1 . 2]" 1
1313 1 47 ARG H 1 61 GLU HB2 . . 5.380 4.512 4.251 4.721 . 0 0 "[ . 1 . 2]" 1
1314 1 47 ARG H 1 61 GLU HB3 . . 4.120 2.865 2.550 3.128 . 0 0 "[ . 1 . 2]" 1
1315 1 47 ARG H 1 61 GLU QG . . 5.610 4.194 3.861 4.441 . 0 0 "[ . 1 . 2]" 1
1316 1 47 ARG H 1 62 PHE HA . . 5.420 4.581 4.520 4.637 . 0 0 "[ . 1 . 2]" 1
1317 1 47 ARG H 1 97 LEU MD1 . . 5.540 4.982 4.536 5.329 . 0 0 "[ . 1 . 2]" 1
1318 1 47 ARG HA 1 107 TRP H . . 5.550 4.916 4.758 5.087 . 0 0 "[ . 1 . 2]" 1
1319 1 47 ARG HA 1 108 ASP H . . 5.430 4.971 4.857 5.092 . 0 0 "[ . 1 . 2]" 1
1320 1 47 ARG HA 1 108 ASP HA . . 4.530 2.415 2.121 2.614 . 0 0 "[ . 1 . 2]" 1
1321 1 47 ARG HA 1 108 ASP QB . . 5.140 4.309 3.275 4.598 . 0 0 "[ . 1 . 2]" 1
1322 1 47 ARG HA 1 109 TYR H . . 4.460 2.972 2.692 3.130 . 0 0 "[ . 1 . 2]" 1
1323 1 47 ARG HA 1 109 TYR QD . . 4.830 2.402 2.205 2.762 . 0 0 "[ . 1 . 2]" 1
1324 1 47 ARG HA 1 110 THR H . . 5.380 5.037 4.762 5.311 . 0 0 "[ . 1 . 2]" 1
1325 1 47 ARG HA 1 48 ILE H . . 3.790 2.327 2.295 2.401 . 0 0 "[ . 1 . 2]" 1
1326 1 47 ARG HA 1 48 ILE HB . . 5.320 4.388 4.340 4.437 . 0 0 "[ . 1 . 2]" 1
1327 1 47 ARG HA 1 48 ILE HG13 . . 5.520 3.388 3.289 3.467 . 0 0 "[ . 1 . 2]" 1
1328 1 47 ARG HA 1 61 GLU H . . 5.520 5.059 4.989 5.139 . 0 0 "[ . 1 . 2]" 1
1329 1 47 ARG HA 1 99 VAL QG . . 5.390 3.735 3.532 4.743 . 0 0 "[ . 1 . 2]" 1
1330 1 47 ARG HB2 1 108 ASP HA . . 4.710 3.074 2.630 3.325 . 0 0 "[ . 1 . 2]" 1
1331 1 47 ARG HB2 1 110 THR MG . . 5.260 5.116 4.762 5.289 0.029 14 0 "[ . 1 . 2]" 1
1332 1 47 ARG HB2 1 48 ILE H . . 4.940 2.517 2.459 2.639 . 0 0 "[ . 1 . 2]" 1
1333 1 47 ARG HB3 1 108 ASP HA . . 4.710 2.504 2.130 3.110 . 0 0 "[ . 1 . 2]" 1
1334 1 47 ARG HB3 1 110 THR MG . . 5.260 3.608 3.380 3.759 . 0 0 "[ . 1 . 2]" 1
1335 1 47 ARG HB3 1 48 ILE H . . 4.940 3.699 3.602 3.987 . 0 0 "[ . 1 . 2]" 1
1336 1 47 ARG HD2 1 97 LEU HB2 . . 5.470 2.450 2.057 2.852 . 0 0 "[ . 1 . 2]" 1
1337 1 47 ARG HD2 1 97 LEU HB3 . . 5.750 3.692 2.876 4.112 . 0 0 "[ . 1 . 2]" 1
1338 1 47 ARG HD3 1 97 LEU HB2 . . 5.470 3.091 2.556 4.167 . 0 0 "[ . 1 . 2]" 1
1339 1 47 ARG HD3 1 97 LEU HB3 . . 5.750 3.797 3.300 5.132 . 0 0 "[ . 1 . 2]" 1
1340 1 47 ARG QB 1 108 ASP H . . 5.660 4.737 4.480 4.928 . 0 0 "[ . 1 . 2]" 1
1341 1 47 ARG QB 1 108 ASP HA . . 4.280 2.371 2.090 2.542 . 0 0 "[ . 1 . 2]" 1
1342 1 47 ARG QB 1 108 ASP QB . . 5.160 3.091 1.963 3.463 . 0 0 "[ . 1 . 2]" 1
1343 1 47 ARG QB 1 109 TYR H . . 4.830 3.208 3.025 3.441 . 0 0 "[ . 1 . 2]" 1
1344 1 47 ARG QB 1 109 TYR QD . . 5.660 4.066 3.898 4.311 . 0 0 "[ . 1 . 2]" 1
1345 1 47 ARG QB 1 110 THR MG . . 4.630 3.539 3.313 3.684 . 0 0 "[ . 1 . 2]" 1
1346 1 47 ARG QB 1 48 ILE H . . 4.400 2.478 2.420 2.603 . 0 0 "[ . 1 . 2]" 1
1347 1 47 ARG QB 1 99 VAL HB . . 5.410 3.911 3.135 4.274 . 0 0 "[ . 1 . 2]" 1
1348 1 47 ARG QB 1 99 VAL QG . . 4.680 2.119 1.909 3.278 . 0 0 "[ . 1 . 2]" 1
1349 1 47 ARG QD 1 61 GLU H . . 5.660 5.255 3.091 5.573 . 0 0 "[ . 1 . 2]" 1
1350 1 47 ARG QD 1 96 ARG HE . . 5.570 3.667 2.791 5.040 . 0 0 "[ . 1 . 2]" 1
1351 1 47 ARG QD 1 97 LEU H . . 4.830 3.268 2.625 4.067 . 0 0 "[ . 1 . 2]" 1
1352 1 47 ARG QD 1 97 LEU HB2 . . 4.980 2.321 2.033 2.683 . 0 0 "[ . 1 . 2]" 1
1353 1 47 ARG QD 1 97 LEU HB3 . . 5.270 3.215 2.846 3.416 . 0 0 "[ . 1 . 2]" 1
1354 1 47 ARG QD 1 99 VAL H . . 5.660 4.183 3.775 5.701 0.041 8 0 "[ . 1 . 2]" 1
1355 1 47 ARG QD 1 99 VAL HB . . 5.660 4.116 3.233 5.693 0.033 8 0 "[ . 1 . 2]" 1
1356 1 47 ARG QD 1 99 VAL QG . . 5.230 2.285 2.029 3.447 . 0 0 "[ . 1 . 2]" 1
1357 1 48 ILE H 1 106 THR HA . . 5.270 4.782 4.612 4.945 . 0 0 "[ . 1 . 2]" 1
1358 1 48 ILE H 1 107 TRP H . . 4.330 3.052 2.923 3.204 . 0 0 "[ . 1 . 2]" 1
1359 1 48 ILE H 1 107 TRP HA . . 5.550 4.989 4.915 5.096 . 0 0 "[ . 1 . 2]" 1
1360 1 48 ILE H 1 107 TRP HB3 . . 5.120 3.816 3.624 4.019 . 0 0 "[ . 1 . 2]" 1
1361 1 48 ILE H 1 108 ASP HA . . 4.690 3.560 3.355 3.716 . 0 0 "[ . 1 . 2]" 1
1362 1 48 ILE H 1 109 TYR QD . . 5.270 4.030 3.745 4.480 . 0 0 "[ . 1 . 2]" 1
1363 1 48 ILE H 1 48 ILE HB . . 4.110 2.797 2.757 2.822 . 0 0 "[ . 1 . 2]" 1
1364 1 48 ILE H 1 48 ILE HG12 . . 5.090 4.056 4.001 4.091 . 0 0 "[ . 1 . 2]" 1
1365 1 48 ILE H 1 48 ILE HG13 . . 4.760 3.115 3.061 3.158 . 0 0 "[ . 1 . 2]" 1
1366 1 48 ILE H 1 48 ILE MD . . 5.400 4.329 4.296 4.375 . 0 0 "[ . 1 . 2]" 1
1367 1 48 ILE H 1 49 VAL H . . 5.100 4.354 4.312 4.403 . 0 0 "[ . 1 . 2]" 1
1368 1 48 ILE H 1 49 VAL QG . . 5.690 4.268 3.531 4.869 . 0 0 "[ . 1 . 2]" 1
1369 1 48 ILE H 1 60 VAL HA . . 5.580 5.062 4.975 5.129 . 0 0 "[ . 1 . 2]" 1
1370 1 48 ILE H 1 60 VAL QG . . 5.710 4.858 4.718 4.953 . 0 0 "[ . 1 . 2]" 1
1371 1 48 ILE H 1 99 VAL MG1 . . 5.350 4.627 3.494 5.464 0.114 12 0 "[ . 1 . 2]" 1
1372 1 48 ILE H 1 99 VAL MG2 . . 5.350 3.312 2.962 4.478 . 0 0 "[ . 1 . 2]" 1
1373 1 48 ILE H 1 99 VAL QG . . 4.890 3.231 2.916 4.285 . 0 0 "[ . 1 . 2]" 1
1374 1 48 ILE HA 1 48 ILE MD . . 4.770 3.822 3.809 3.838 . 0 0 "[ . 1 . 2]" 1
1375 1 48 ILE HA 1 49 VAL H . . 3.800 2.251 2.225 2.282 . 0 0 "[ . 1 . 2]" 1
1376 1 48 ILE HA 1 59 MET H . . 5.420 4.410 4.315 4.533 . 0 0 "[ . 1 . 2]" 1
1377 1 48 ILE HA 1 60 VAL HA . . 4.390 2.567 2.481 2.646 . 0 0 "[ . 1 . 2]" 1
1378 1 48 ILE HA 1 60 VAL MG1 . . 5.090 3.812 3.641 3.963 . 0 0 "[ . 1 . 2]" 1
1379 1 48 ILE HA 1 60 VAL MG2 . . 5.090 3.314 3.101 3.442 . 0 0 "[ . 1 . 2]" 1
1380 1 48 ILE HA 1 60 VAL QG . . 4.600 3.121 2.938 3.243 . 0 0 "[ . 1 . 2]" 1
1381 1 48 ILE HB 1 107 TRP H . . 4.730 3.747 3.290 4.048 . 0 0 "[ . 1 . 2]" 1
1382 1 48 ILE HB 1 107 TRP HB2 . . 5.440 4.665 4.358 4.921 . 0 0 "[ . 1 . 2]" 1
1383 1 48 ILE HB 1 49 VAL H . . 5.490 4.012 3.927 4.095 . 0 0 "[ . 1 . 2]" 1
1384 1 48 ILE HG12 1 109 TYR QD . . 5.750 5.202 5.032 5.637 . 0 0 "[ . 1 . 2]" 1
1385 1 48 ILE HG12 1 60 VAL HA . . 5.040 2.754 2.548 3.027 . 0 0 "[ . 1 . 2]" 1
1386 1 48 ILE HG12 1 60 VAL QG . . 4.060 1.991 1.921 2.045 . 0 0 "[ . 1 . 2]" 1
1387 1 48 ILE HG12 1 61 GLU H . . 5.430 3.666 3.439 3.947 . 0 0 "[ . 1 . 2]" 1
1388 1 48 ILE HG13 1 109 TYR QD . . 4.960 3.533 3.342 3.986 . 0 0 "[ . 1 . 2]" 1
1389 1 48 ILE HG13 1 60 VAL QG . . 4.570 3.130 3.060 3.197 . 0 0 "[ . 1 . 2]" 1
1390 1 48 ILE MD 1 109 TYR QD . . 5.290 4.255 3.986 4.566 . 0 0 "[ . 1 . 2]" 1
1391 1 48 ILE MD 1 109 TYR QE . . 4.730 2.746 2.430 3.036 . 0 0 "[ . 1 . 2]" 1
1392 1 48 ILE MD 1 49 VAL H . . 5.480 4.851 4.773 4.972 . 0 0 "[ . 1 . 2]" 1
1393 1 48 ILE MD 1 60 VAL HA . . 5.050 4.296 4.078 4.563 . 0 0 "[ . 1 . 2]" 1
1394 1 48 ILE MD 1 60 VAL QG . . 4.250 2.546 2.388 2.689 . 0 0 "[ . 1 . 2]" 1
1395 1 48 ILE MG 1 106 THR HA . . 5.150 4.177 3.736 4.459 . 0 0 "[ . 1 . 2]" 1
1396 1 48 ILE MG 1 107 TRP H . . 5.400 4.364 4.009 4.593 . 0 0 "[ . 1 . 2]" 1
1397 1 48 ILE HG12 1 48 ILE MG . . 3.730 2.451 2.430 2.469 . 0 0 "[ . 1 . 2]" 1
1398 1 48 ILE MD 1 48 ILE MG . . 3.540 1.955 1.942 1.971 . 0 0 "[ . 1 . 2]" 1
1399 1 48 ILE MG 1 49 VAL H . . 3.870 2.342 2.236 2.469 . 0 0 "[ . 1 . 2]" 1
1400 1 48 ILE MG 1 59 MET H . . 4.870 3.407 3.325 3.587 . 0 0 "[ . 1 . 2]" 1
1401 1 48 ILE MG 1 59 MET HB2 . . 5.690 4.958 4.824 5.194 . 0 0 "[ . 1 . 2]" 1
1402 1 48 ILE MG 1 60 VAL HA . . 4.880 3.469 3.337 3.674 . 0 0 "[ . 1 . 2]" 1
1403 1 49 VAL H 1 106 THR HA . . 5.660 4.741 4.613 4.880 . 0 0 "[ . 1 . 2]" 1
1404 1 49 VAL H 1 58 ALA HA . . 5.460 4.702 4.604 4.888 . 0 0 "[ . 1 . 2]" 1
1405 1 49 VAL H 1 58 ALA MB . . 4.790 3.842 3.661 4.063 . 0 0 "[ . 1 . 2]" 1
1406 1 49 VAL H 1 59 MET H . . 4.420 2.731 2.656 2.848 . 0 0 "[ . 1 . 2]" 1
1407 1 49 VAL H 1 59 MET HB2 . . 5.290 3.543 3.331 3.758 . 0 0 "[ . 1 . 2]" 1
1408 1 49 VAL H 1 60 VAL HA . . 4.970 3.991 3.841 4.122 . 0 0 "[ . 1 . 2]" 1
1409 1 49 VAL H 1 60 VAL QG . . 5.610 3.905 3.757 4.011 . 0 0 "[ . 1 . 2]" 1
1410 1 49 VAL H 1 97 LEU MD1 . . 5.350 4.083 3.833 4.445 . 0 0 "[ . 1 . 2]" 1
1411 1 49 VAL HA 1 106 THR HB . . 4.940 3.103 2.660 3.426 . 0 0 "[ . 1 . 2]" 1
1412 1 49 VAL HA 1 59 MET H . . 5.690 4.791 4.768 4.821 . 0 0 "[ . 1 . 2]" 1
1413 1 49 VAL HB 1 100 PHE QE . . 5.080 5.126 5.043 5.179 0.099 13 0 "[ . 1 . 2]" 1
1414 1 49 VAL HB 1 106 THR MG . . 5.050 4.642 4.345 5.000 . 0 0 "[ . 1 . 2]" 1
1415 1 49 VAL HB 1 50 ILE H . . 4.770 3.474 2.556 4.042 . 0 0 "[ . 1 . 2]" 1
1416 1 49 VAL HB 1 51 PHE QE . . 5.230 4.616 3.891 5.238 0.008 2 0 "[ . 1 . 2]" 1
1417 1 49 VAL HB 1 59 MET H . . 5.590 5.166 4.901 5.391 . 0 0 "[ . 1 . 2]" 1
1418 1 49 VAL HB 1 59 MET HB2 . . 5.410 4.798 4.608 4.967 . 0 0 "[ . 1 . 2]" 1
1419 1 49 VAL MG1 1 100 PHE QE . . 4.970 4.553 3.671 5.057 0.087 8 0 "[ . 1 . 2]" 1
1420 1 49 VAL MG1 1 106 THR HA . . 5.510 4.017 2.589 4.976 . 0 0 "[ . 1 . 2]" 1
1421 1 49 VAL MG1 1 106 THR HB . . 5.190 3.944 2.672 4.849 . 0 0 "[ . 1 . 2]" 1
1422 1 49 VAL MG1 1 51 PHE QE . . 5.320 3.248 2.143 4.969 . 0 0 "[ . 1 . 2]" 1
1423 1 49 VAL MG1 1 59 MET H . . 5.220 3.694 2.729 5.025 . 0 0 "[ . 1 . 2]" 1
1424 1 49 VAL MG2 1 100 PHE QE . . 4.970 4.259 3.457 5.079 0.109 6 0 "[ . 1 . 2]" 1
1425 1 49 VAL MG2 1 106 THR HA . . 5.510 3.989 3.226 4.973 . 0 0 "[ . 1 . 2]" 1
1426 1 49 VAL MG2 1 106 THR HB . . 5.190 3.220 2.076 4.876 . 0 0 "[ . 1 . 2]" 1
1427 1 49 VAL MG2 1 51 PHE QE . . 5.320 2.754 2.166 3.171 . 0 0 "[ . 1 . 2]" 1
1428 1 49 VAL MG2 1 59 MET H . . 5.220 3.847 2.766 4.598 . 0 0 "[ . 1 . 2]" 1
1429 1 49 VAL QG 1 100 PHE QE . . 4.240 3.687 3.398 3.928 . 0 0 "[ . 1 . 2]" 1
1430 1 49 VAL QG 1 106 THR HA . . 4.740 3.128 2.579 3.550 . 0 0 "[ . 1 . 2]" 1
1431 1 49 VAL QG 1 106 THR HB . . 4.470 2.436 2.072 3.043 . 0 0 "[ . 1 . 2]" 1
1432 1 49 VAL QG 1 106 THR MG . . 4.250 3.619 3.415 3.842 . 0 0 "[ . 1 . 2]" 1
1433 1 49 VAL QG 1 107 TRP H . . 5.450 3.933 2.884 4.613 . 0 0 "[ . 1 . 2]" 1
1434 1 49 VAL QG 1 50 ILE H . . 4.480 2.668 2.116 3.358 . 0 0 "[ . 1 . 2]" 1
1435 1 49 VAL QG 1 50 ILE HA . . 4.800 3.684 3.467 3.969 . 0 0 "[ . 1 . 2]" 1
1436 1 49 VAL QG 1 51 PHE H . . 5.330 4.698 4.399 5.114 . 0 0 "[ . 1 . 2]" 1
1437 1 49 VAL QG 1 51 PHE QE . . 4.290 2.294 2.096 2.784 . 0 0 "[ . 1 . 2]" 1
1438 1 49 VAL QG 1 58 ALA MB . . 4.730 4.123 4.002 4.315 . 0 0 "[ . 1 . 2]" 1
1439 1 49 VAL QG 1 59 MET HB2 . . 4.610 2.087 1.980 2.181 . 0 0 "[ . 1 . 2]" 1
1440 1 49 VAL QG 1 99 VAL HA . . 5.320 3.957 3.206 4.774 . 0 0 "[ . 1 . 2]" 1
1441 1 50 ILE H 1 105 ASP HA . . 4.690 3.885 3.634 4.290 . 0 0 "[ . 1 . 2]" 1
1442 1 50 ILE H 1 105 ASP QB . . 5.000 3.944 3.634 5.042 0.042 11 0 "[ . 1 . 2]" 1
1443 1 50 ILE H 1 106 THR HA . . 4.780 3.564 3.439 3.737 . 0 0 "[ . 1 . 2]" 1
1444 1 50 ILE H 1 106 THR HB . . 5.290 3.522 3.246 3.908 . 0 0 "[ . 1 . 2]" 1
1445 1 50 ILE H 1 50 ILE HB . . 3.960 2.546 2.364 2.703 . 0 0 "[ . 1 . 2]" 1
1446 1 50 ILE H 1 50 ILE MD . . 4.150 3.245 2.525 4.172 0.022 3 0 "[ . 1 . 2]" 1
1447 1 50 ILE H 1 50 ILE MG . . 4.750 3.809 3.697 3.896 . 0 0 "[ . 1 . 2]" 1
1448 1 50 ILE H 1 51 PHE H . . 5.210 4.498 4.434 4.549 . 0 0 "[ . 1 . 2]" 1
1449 1 50 ILE H 1 51 PHE QE . . 5.750 5.112 4.828 5.307 . 0 0 "[ . 1 . 2]" 1
1450 1 50 ILE H 1 58 ALA MB . . 5.170 4.741 4.608 4.899 . 0 0 "[ . 1 . 2]" 1
1451 1 50 ILE HA 1 51 PHE H . . 3.690 2.254 2.213 2.272 . 0 0 "[ . 1 . 2]" 1
1452 1 50 ILE HA 1 51 PHE QD . . 5.230 3.722 3.463 4.019 . 0 0 "[ . 1 . 2]" 1
1453 1 50 ILE HA 1 58 ALA H . . 5.390 4.836 4.718 5.049 . 0 0 "[ . 1 . 2]" 1
1454 1 50 ILE HA 1 58 ALA HA . . 4.110 2.189 2.033 2.471 . 0 0 "[ . 1 . 2]" 1
1455 1 50 ILE HA 1 58 ALA MB . . 4.450 2.686 2.585 2.874 . 0 0 "[ . 1 . 2]" 1
1456 1 50 ILE HA 1 59 MET H . . 4.790 3.675 3.493 3.864 . 0 0 "[ . 1 . 2]" 1
1457 1 50 ILE HB 1 105 ASP HA . . 4.320 2.547 2.361 2.858 . 0 0 "[ . 1 . 2]" 1
1458 1 50 ILE HB 1 105 ASP HB2 . . 5.750 4.763 4.281 5.314 . 0 0 "[ . 1 . 2]" 1
1459 1 50 ILE HB 1 105 ASP HB3 . . 5.750 3.534 2.699 5.436 . 0 0 "[ . 1 . 2]" 1
1460 1 50 ILE HB 1 105 ASP QB . . 5.240 3.393 2.672 4.498 . 0 0 "[ . 1 . 2]" 1
1461 1 50 ILE HB 1 106 THR H . . 5.750 5.368 5.172 5.502 . 0 0 "[ . 1 . 2]" 1
1462 1 50 ILE HB 1 51 PHE H . . 5.020 3.965 3.792 4.071 . 0 0 "[ . 1 . 2]" 1
1463 1 50 ILE HB 1 58 ALA MB . . 5.340 4.609 4.379 5.018 . 0 0 "[ . 1 . 2]" 1
1464 1 50 ILE MD 1 105 ASP HA . . 4.540 3.033 2.277 4.484 . 0 0 "[ . 1 . 2]" 1
1465 1 50 ILE MD 1 106 THR HA . . 5.650 4.154 3.120 5.194 . 0 0 "[ . 1 . 2]" 1
1466 1 50 ILE MD 1 58 ALA HA . . 5.510 4.164 3.124 4.874 . 0 0 "[ . 1 . 2]" 1
1467 1 50 ILE MD 1 58 ALA MB . . 3.900 2.845 1.987 3.432 . 0 0 "[ . 1 . 2]" 1
1468 1 50 ILE MD 1 59 MET H . . 5.230 4.373 3.567 5.336 0.106 6 0 "[ . 1 . 2]" 1
1469 1 50 ILE MG 1 105 ASP QB . . 5.450 4.215 3.754 4.893 . 0 0 "[ . 1 . 2]" 1
1470 1 50 ILE MG 1 51 PHE H . . 3.800 2.191 2.148 2.271 . 0 0 "[ . 1 . 2]" 1
1471 1 50 ILE MG 1 51 PHE HA . . 5.000 3.376 3.207 3.604 . 0 0 "[ . 1 . 2]" 1
1472 1 50 ILE MG 1 51 PHE HB2 . . 5.070 4.386 4.256 4.507 . 0 0 "[ . 1 . 2]" 1
1473 1 50 ILE MG 1 51 PHE HB3 . . 5.620 4.971 4.860 5.090 . 0 0 "[ . 1 . 2]" 1
1474 1 50 ILE MG 1 52 ARG H . . 5.270 4.110 3.631 4.315 . 0 0 "[ . 1 . 2]" 1
1475 1 50 ILE MG 1 52 ARG HA . . 5.190 4.464 4.031 4.763 . 0 0 "[ . 1 . 2]" 1
1476 1 50 ILE MG 1 52 ARG HD2 . . 5.710 5.250 4.562 5.766 0.056 6 0 "[ . 1 . 2]" 1
1477 1 50 ILE MG 1 52 ARG HD3 . . 5.710 5.451 4.833 5.806 0.096 4 0 "[ . 1 . 2]" 1
1478 1 50 ILE MG 1 52 ARG HG2 . . 5.000 3.887 3.031 4.466 . 0 0 "[ . 1 . 2]" 1
1479 1 50 ILE MG 1 52 ARG HG3 . . 4.860 3.397 2.405 4.977 0.117 2 0 "[ . 1 . 2]" 1
1480 1 50 ILE MG 1 52 ARG QB . . 5.580 3.245 2.781 3.522 . 0 0 "[ . 1 . 2]" 1
1481 1 50 ILE MG 1 52 ARG QD . . 5.250 4.748 4.200 5.096 . 0 0 "[ . 1 . 2]" 1
1482 1 50 ILE MG 1 53 LYS H . . 5.750 5.708 5.357 5.857 0.107 19 0 "[ . 1 . 2]" 1
1483 1 50 ILE MG 1 57 GLN H . . 5.140 3.626 3.464 3.954 . 0 0 "[ . 1 . 2]" 1
1484 1 50 ILE MG 1 58 ALA MB . . 4.330 3.004 2.444 3.404 . 0 0 "[ . 1 . 2]" 1
1485 1 51 PHE H 1 51 PHE HB2 . . 4.210 2.728 2.677 2.776 . 0 0 "[ . 1 . 2]" 1
1486 1 51 PHE H 1 51 PHE QD . . 4.520 3.215 2.897 3.427 . 0 0 "[ . 1 . 2]" 1
1487 1 51 PHE H 1 52 ARG H . . 5.530 4.336 4.044 4.418 . 0 0 "[ . 1 . 2]" 1
1488 1 51 PHE H 1 52 ARG HA . . 5.550 4.841 4.746 4.933 . 0 0 "[ . 1 . 2]" 1
1489 1 51 PHE H 1 56 VAL HA . . 5.450 4.859 4.616 5.018 . 0 0 "[ . 1 . 2]" 1
1490 1 51 PHE H 1 56 VAL QG . . 5.390 4.319 4.078 4.808 . 0 0 "[ . 1 . 2]" 1
1491 1 51 PHE H 1 57 GLN H . . 4.560 3.177 3.012 3.292 . 0 0 "[ . 1 . 2]" 1
1492 1 51 PHE H 1 58 ALA H . . 5.360 4.703 4.568 4.798 . 0 0 "[ . 1 . 2]" 1
1493 1 51 PHE H 1 58 ALA HA . . 4.210 3.050 2.952 3.156 . 0 0 "[ . 1 . 2]" 1
1494 1 51 PHE H 1 58 ALA MB . . 4.440 3.669 3.535 3.875 . 0 0 "[ . 1 . 2]" 1
1495 1 51 PHE HA 1 51 PHE QD . . 4.460 2.746 2.597 2.910 . 0 0 "[ . 1 . 2]" 1
1496 1 51 PHE HA 1 52 ARG HG2 . . 5.750 5.041 3.580 5.463 . 0 0 "[ . 1 . 2]" 1
1497 1 51 PHE HA 1 52 ARG HG3 . . 5.320 3.646 3.337 4.981 . 0 0 "[ . 1 . 2]" 1
1498 1 51 PHE HA 1 52 ARG QB . . 5.660 4.393 4.173 4.565 . 0 0 "[ . 1 . 2]" 1
1499 1 51 PHE HA 1 53 LYS H . . 5.530 3.849 3.487 4.036 . 0 0 "[ . 1 . 2]" 1
1500 1 51 PHE HA 1 57 GLN H . . 5.430 4.969 4.762 5.130 . 0 0 "[ . 1 . 2]" 1
1501 1 51 PHE HB2 1 53 LYS H . . 5.360 4.582 4.258 5.192 . 0 0 "[ . 1 . 2]" 1
1502 1 51 PHE HB2 1 57 GLN H . . 4.880 3.552 2.980 4.008 . 0 0 "[ . 1 . 2]" 1
1503 1 51 PHE HB2 1 57 GLN HB2 . . 5.360 2.609 2.381 3.022 . 0 0 "[ . 1 . 2]" 1
1504 1 51 PHE HB2 1 57 GLN HB3 . . 5.190 3.929 3.612 4.295 . 0 0 "[ . 1 . 2]" 1
1505 1 51 PHE HB3 1 52 ARG H . . 5.540 3.097 2.750 3.710 . 0 0 "[ . 1 . 2]" 1
1506 1 51 PHE HB3 1 53 LYS H . . 5.140 3.318 2.935 3.952 . 0 0 "[ . 1 . 2]" 1
1507 1 51 PHE HB3 1 53 LYS QB . . 5.550 4.344 3.675 4.967 . 0 0 "[ . 1 . 2]" 1
1508 1 51 PHE HB3 1 57 GLN H . . 5.320 4.706 4.175 5.102 . 0 0 "[ . 1 . 2]" 1
1509 1 51 PHE HB3 1 57 GLN HB2 . . 5.570 4.013 3.618 4.497 . 0 0 "[ . 1 . 2]" 1
1510 1 51 PHE QD 1 52 ARG H . . 5.620 4.015 3.692 4.419 . 0 0 "[ . 1 . 2]" 1
1511 1 51 PHE QD 1 53 LYS QB . . 5.350 4.771 4.173 5.214 . 0 0 "[ . 1 . 2]" 1
1512 1 51 PHE QD 1 57 GLN H . . 5.750 4.922 4.263 5.308 . 0 0 "[ . 1 . 2]" 1
1513 1 51 PHE QD 1 57 GLN HB2 . . 5.620 3.650 2.950 3.997 . 0 0 "[ . 1 . 2]" 1
1514 1 51 PHE QD 1 58 ALA HA . . 4.820 2.953 2.584 3.490 . 0 0 "[ . 1 . 2]" 1
1515 1 51 PHE QD 1 58 ALA MB . . 5.430 4.501 4.223 4.948 . 0 0 "[ . 1 . 2]" 1
1516 1 52 ARG H 1 52 ARG HG2 . . 4.960 3.863 2.382 4.177 . 0 0 "[ . 1 . 2]" 1
1517 1 52 ARG H 1 53 LYS H . . 5.270 2.071 1.976 2.251 . 0 0 "[ . 1 . 2]" 1
1518 1 52 ARG HA 1 53 LYS H . . 4.340 3.059 2.935 3.132 . 0 0 "[ . 1 . 2]" 1
1519 1 52 ARG HA 1 56 VAL HA . . 4.610 2.674 2.365 2.866 . 0 0 "[ . 1 . 2]" 1
1520 1 52 ARG HA 1 56 VAL MG1 . . 5.410 4.206 2.990 5.226 . 0 0 "[ . 1 . 2]" 1
1521 1 52 ARG HA 1 56 VAL MG2 . . 5.410 3.572 2.445 4.160 . 0 0 "[ . 1 . 2]" 1
1522 1 52 ARG HA 1 56 VAL QG . . 5.010 3.365 2.355 3.995 . 0 0 "[ . 1 . 2]" 1
1523 1 52 ARG HA 1 57 GLN H . . 4.610 3.612 3.439 3.873 . 0 0 "[ . 1 . 2]" 1
1524 1 52 ARG HG3 1 53 LYS H . . 5.610 4.251 3.721 4.545 . 0 0 "[ . 1 . 2]" 1
1525 1 52 ARG QB 1 53 LYS HA . . 5.360 4.698 4.604 4.794 . 0 0 "[ . 1 . 2]" 1
1526 1 52 ARG QB 1 56 VAL QG . . 5.030 2.832 2.168 3.271 . 0 0 "[ . 1 . 2]" 1
1527 1 52 ARG QD 1 53 LYS QB . . 5.100 3.951 2.974 5.146 0.046 7 0 "[ . 1 . 2]" 1
1528 1 53 LYS H 1 57 GLN H . . 5.750 5.616 5.066 5.866 0.116 16 0 "[ . 1 . 2]" 1
1529 1 53 LYS QB 1 54 ASN QB . . 5.290 3.828 3.488 4.345 . 0 0 "[ . 1 . 2]" 1
1530 1 54 ASN H 1 55 GLY H . . 5.420 3.603 1.889 4.247 . 0 0 "[ . 1 . 2]" 1
1531 1 54 ASN QD 1 55 GLY H . . 5.660 4.686 3.419 5.739 0.079 4 0 "[ . 1 . 2]" 1
1532 1 55 GLY QA 1 56 VAL H . . 3.640 2.258 2.168 2.337 . 0 0 "[ . 1 . 2]" 1
1533 1 55 GLY QA 1 56 VAL HB . . 5.440 4.368 4.105 4.483 . 0 0 "[ . 1 . 2]" 1
1534 1 55 GLY QA 1 56 VAL QG . . 5.150 3.225 3.110 3.470 . 0 0 "[ . 1 . 2]" 1
1535 1 55 GLY QA 1 57 GLN H . . 5.750 5.305 4.945 5.456 . 0 0 "[ . 1 . 2]" 1
1536 1 56 VAL H 1 56 VAL QG . . 3.890 2.725 2.323 2.894 . 0 0 "[ . 1 . 2]" 1
1537 1 56 VAL H 1 57 GLN HA . . 5.520 4.917 4.855 4.985 . 0 0 "[ . 1 . 2]" 1
1538 1 56 VAL H 1 57 GLN HE21 . . 5.750 5.136 4.531 5.800 0.050 8 0 "[ . 1 . 2]" 1
1539 1 56 VAL H 1 57 GLN QG . . 5.270 3.279 2.992 3.509 . 0 0 "[ . 1 . 2]" 1
1540 1 56 VAL HA 1 57 GLN H . . 3.650 2.143 2.101 2.169 . 0 0 "[ . 1 . 2]" 1
1541 1 56 VAL HB 1 57 GLN H . . 5.390 4.234 4.142 4.401 . 0 0 "[ . 1 . 2]" 1
1542 1 56 VAL MG1 1 57 GLN H . . 5.120 3.092 2.574 4.238 . 0 0 "[ . 1 . 2]" 1
1543 1 56 VAL MG2 1 57 GLN H . . 5.120 3.787 2.674 4.228 . 0 0 "[ . 1 . 2]" 1
1544 1 56 VAL QG 1 57 GLN H . . 3.850 2.726 2.546 3.062 . 0 0 "[ . 1 . 2]" 1
1545 1 56 VAL QG 1 57 GLN HA . . 5.070 3.537 3.328 3.688 . 0 0 "[ . 1 . 2]" 1
1546 1 57 GLN H 1 57 GLN HB2 . . 4.330 2.792 2.763 2.821 . 0 0 "[ . 1 . 2]" 1
1547 1 57 GLN H 1 57 GLN QG . . 4.810 3.218 3.114 3.356 . 0 0 "[ . 1 . 2]" 1
1548 1 57 GLN H 1 58 ALA H . . 5.100 4.418 4.391 4.431 . 0 0 "[ . 1 . 2]" 1
1549 1 57 GLN HA 1 57 GLN HE21 . . 5.380 4.847 4.452 5.039 . 0 0 "[ . 1 . 2]" 1
1550 1 57 GLN HA 1 58 ALA H . . 3.750 2.443 2.411 2.483 . 0 0 "[ . 1 . 2]" 1
1551 1 57 GLN HB2 1 57 GLN HE22 . . 5.600 4.742 4.700 4.792 . 0 0 "[ . 1 . 2]" 1
1552 1 57 GLN HB2 1 58 ALA H . . 4.570 3.625 3.536 3.713 . 0 0 "[ . 1 . 2]" 1
1553 1 57 GLN HB3 1 57 GLN HE22 . . 5.570 4.538 4.168 4.697 . 0 0 "[ . 1 . 2]" 1
1554 1 57 GLN HB3 1 58 ALA H . . 4.120 2.381 2.242 2.481 . 0 0 "[ . 1 . 2]" 1
1555 1 57 GLN QG 1 58 ALA H . . 4.680 3.810 3.658 3.868 . 0 0 "[ . 1 . 2]" 1
1556 1 58 ALA H 1 59 MET H . . 5.050 4.401 4.382 4.418 . 0 0 "[ . 1 . 2]" 1
1557 1 58 ALA HA 1 59 MET H . . 3.790 2.479 2.442 2.501 . 0 0 "[ . 1 . 2]" 1
1558 1 58 ALA MB 1 59 MET H . . 4.070 2.343 2.285 2.438 . 0 0 "[ . 1 . 2]" 1
1559 1 58 ALA MB 1 59 MET HB2 . . 5.700 4.805 4.757 4.860 . 0 0 "[ . 1 . 2]" 1
1560 1 59 MET H 1 59 MET HB2 . . 4.360 2.817 2.781 2.860 . 0 0 "[ . 1 . 2]" 1
1561 1 59 MET H 1 59 MET HG2 . . 5.210 4.006 3.943 4.055 . 0 0 "[ . 1 . 2]" 1
1562 1 59 MET H 1 59 MET HG3 . . 4.660 3.054 2.980 3.141 . 0 0 "[ . 1 . 2]" 1
1563 1 59 MET H 1 59 MET ME . . 5.750 5.233 5.200 5.261 . 0 0 "[ . 1 . 2]" 1
1564 1 59 MET H 1 60 VAL H . . 5.260 4.422 4.396 4.439 . 0 0 "[ . 1 . 2]" 1
1565 1 59 MET H 1 97 LEU MD1 . . 5.650 4.552 4.378 4.705 . 0 0 "[ . 1 . 2]" 1
1566 1 59 MET HA 1 59 MET HG2 . . 4.380 2.494 2.458 2.537 . 0 0 "[ . 1 . 2]" 1
1567 1 59 MET HA 1 59 MET ME . . 5.270 3.774 3.725 3.853 . 0 0 "[ . 1 . 2]" 1
1568 1 59 MET HA 1 60 VAL H . . 3.750 2.300 2.234 2.318 . 0 0 "[ . 1 . 2]" 1
1569 1 59 MET HA 1 60 VAL HA . . 5.160 4.479 4.451 4.492 . 0 0 "[ . 1 . 2]" 1
1570 1 59 MET HA 1 97 LEU MD1 . . 5.050 3.904 3.794 4.042 . 0 0 "[ . 1 . 2]" 1
1571 1 59 MET HA 1 97 LEU MD2 . . 5.210 5.093 4.751 5.283 0.073 8 0 "[ . 1 . 2]" 1
1572 1 59 MET HB2 1 60 VAL H . . 5.280 3.835 3.798 3.961 . 0 0 "[ . 1 . 2]" 1
1573 1 59 MET HB2 1 97 LEU MD2 . . 4.180 3.496 3.126 3.735 . 0 0 "[ . 1 . 2]" 1
1574 1 59 MET HB3 1 59 MET ME . . 4.590 2.150 2.125 2.179 . 0 0 "[ . 1 . 2]" 1
1575 1 59 MET HB3 1 60 VAL H . . 4.290 2.758 2.698 2.909 . 0 0 "[ . 1 . 2]" 1
1576 1 59 MET HB3 1 97 LEU MD1 . . 4.330 2.232 2.131 2.367 . 0 0 "[ . 1 . 2]" 1
1577 1 59 MET HB3 1 97 LEU MD2 . . 4.690 3.045 2.664 3.248 . 0 0 "[ . 1 . 2]" 1
1578 1 59 MET ME 1 59 MET HG2 . . 3.960 2.394 2.371 2.415 . 0 0 "[ . 1 . 2]" 1
1579 1 59 MET HG2 1 60 VAL H . . 5.200 4.246 4.172 4.310 . 0 0 "[ . 1 . 2]" 1
1580 1 59 MET HG2 1 92 ALA MB . . 4.440 3.894 3.734 3.973 . 0 0 "[ . 1 . 2]" 1
1581 1 59 MET HG2 1 97 LEU MD1 . . 4.890 4.308 4.190 4.499 . 0 0 "[ . 1 . 2]" 1
1582 1 59 MET HG2 1 97 LEU MD2 . . 5.190 4.498 4.266 4.658 . 0 0 "[ . 1 . 2]" 1
1583 1 59 MET HG3 1 92 ALA MB . . 5.750 5.218 5.079 5.279 . 0 0 "[ . 1 . 2]" 1
1584 1 59 MET HG3 1 97 LEU MD1 . . 5.300 4.493 4.399 4.573 . 0 0 "[ . 1 . 2]" 1
1585 1 59 MET ME 1 92 ALA MB . . 3.890 1.953 1.920 2.004 . 0 0 "[ . 1 . 2]" 1
1586 1 59 MET ME 1 93 LYS H . . 5.620 3.749 3.257 4.090 . 0 0 "[ . 1 . 2]" 1
1587 1 59 MET ME 1 94 PRO HD2 . . 4.780 3.151 2.718 3.335 . 0 0 "[ . 1 . 2]" 1
1588 1 59 MET ME 1 94 PRO HD3 . . 5.100 3.422 3.163 3.635 . 0 0 "[ . 1 . 2]" 1
1589 1 59 MET ME 1 94 PRO HG2 . . 4.830 3.490 3.265 3.654 . 0 0 "[ . 1 . 2]" 1
1590 1 59 MET ME 1 97 LEU HB3 . . 5.140 4.808 4.628 5.078 . 0 0 "[ . 1 . 2]" 1
1591 1 59 MET ME 1 97 LEU HG . . 5.550 4.106 3.995 4.295 . 0 0 "[ . 1 . 2]" 1
1592 1 59 MET ME 1 97 LEU MD2 . . 4.630 2.020 1.979 2.062 . 0 0 "[ . 1 . 2]" 1
1593 1 60 VAL H 1 60 VAL QG . . 4.090 2.840 2.778 2.867 . 0 0 "[ . 1 . 2]" 1
1594 1 60 VAL H 1 92 ALA MB . . 5.700 4.702 4.304 4.931 . 0 0 "[ . 1 . 2]" 1
1595 1 60 VAL H 1 97 LEU MD1 . . 4.560 2.955 2.788 3.185 . 0 0 "[ . 1 . 2]" 1
1596 1 60 VAL HA 1 61 GLU H . . 3.820 2.275 2.244 2.298 . 0 0 "[ . 1 . 2]" 1
1597 1 60 VAL HA 1 97 LEU MD1 . . 4.690 3.245 3.047 3.498 . 0 0 "[ . 1 . 2]" 1
1598 1 60 VAL HB 1 61 GLU H . . 5.490 3.883 3.849 3.932 . 0 0 "[ . 1 . 2]" 1
1599 1 60 VAL HB 1 62 PHE HZ . . 5.670 4.575 4.365 4.804 . 0 0 "[ . 1 . 2]" 1
1600 1 60 VAL HB 1 62 PHE QE . . 5.610 2.990 2.824 3.180 . 0 0 "[ . 1 . 2]" 1
1601 1 60 VAL HB 1 71 ALA MB . . 5.750 4.792 4.638 4.997 . 0 0 "[ . 1 . 2]" 1
1602 1 60 VAL MG1 1 97 LEU MD1 . . 5.750 4.383 4.236 4.587 . 0 0 "[ . 1 . 2]" 1
1603 1 60 VAL MG2 1 97 LEU MD1 . . 5.750 4.428 4.267 4.597 . 0 0 "[ . 1 . 2]" 1
1604 1 60 VAL QG 1 61 GLU H . . 4.140 2.203 2.152 2.258 . 0 0 "[ . 1 . 2]" 1
1605 1 60 VAL QG 1 61 GLU HA . . 5.390 3.511 3.471 3.549 . 0 0 "[ . 1 . 2]" 1
1606 1 60 VAL QG 1 62 PHE H . . 5.170 4.301 4.210 4.386 . 0 0 "[ . 1 . 2]" 1
1607 1 60 VAL QG 1 62 PHE HA . . 5.240 4.295 4.178 4.413 . 0 0 "[ . 1 . 2]" 1
1608 1 60 VAL QG 1 62 PHE HZ . . 4.610 2.874 2.764 3.016 . 0 0 "[ . 1 . 2]" 1
1609 1 60 VAL QG 1 62 PHE QE . . 4.130 2.423 2.322 2.520 . 0 0 "[ . 1 . 2]" 1
1610 1 60 VAL QG 1 97 LEU MD1 . . 5.340 3.924 3.788 4.090 . 0 0 "[ . 1 . 2]" 1
1611 1 61 GLU H 1 61 GLU HB2 . . 4.280 3.231 3.191 3.281 . 0 0 "[ . 1 . 2]" 1
1612 1 61 GLU H 1 61 GLU HB3 . . 4.260 2.697 2.654 2.734 . 0 0 "[ . 1 . 2]" 1
1613 1 61 GLU H 1 61 GLU HG2 . . 5.410 4.402 4.363 4.435 . 0 0 "[ . 1 . 2]" 1
1614 1 61 GLU H 1 61 GLU HG3 . . 5.410 4.747 4.723 4.777 . 0 0 "[ . 1 . 2]" 1
1615 1 61 GLU H 1 62 PHE QD . . 5.750 4.514 4.422 4.641 . 0 0 "[ . 1 . 2]" 1
1616 1 61 GLU H 1 62 PHE QE . . 5.750 4.829 4.683 4.914 . 0 0 "[ . 1 . 2]" 1
1617 1 61 GLU H 1 97 LEU MD1 . . 4.090 3.466 3.206 3.755 . 0 0 "[ . 1 . 2]" 1
1618 1 61 GLU HA 1 62 PHE H . . 3.870 2.209 2.189 2.236 . 0 0 "[ . 1 . 2]" 1
1619 1 61 GLU HA 1 97 LEU MD1 . . 4.640 3.702 3.488 3.899 . 0 0 "[ . 1 . 2]" 1
1620 1 61 GLU HA 1 97 LEU MD2 . . 5.750 5.621 5.230 5.850 0.100 8 0 "[ . 1 . 2]" 1
1621 1 61 GLU HB2 1 62 PHE H . . 5.320 4.110 4.090 4.152 . 0 0 "[ . 1 . 2]" 1
1622 1 61 GLU HB2 1 97 LEU MD1 . . 4.470 2.234 2.131 2.421 . 0 0 "[ . 1 . 2]" 1
1623 1 61 GLU HB3 1 62 PHE H . . 5.690 4.060 4.019 4.101 . 0 0 "[ . 1 . 2]" 1
1624 1 61 GLU QG 1 62 PHE H . . 4.630 2.442 2.385 2.513 . 0 0 "[ . 1 . 2]" 1
1625 1 61 GLU QG 1 62 PHE QD . . 5.660 4.514 4.402 4.656 . 0 0 "[ . 1 . 2]" 1
1626 1 61 GLU QG 1 96 ARG HA . . 5.190 3.805 3.284 4.191 . 0 0 "[ . 1 . 2]" 1
1627 1 61 GLU QG 1 97 LEU H . . 5.570 3.989 3.851 4.170 . 0 0 "[ . 1 . 2]" 1
1628 1 61 GLU QG 1 97 LEU HG . . 5.660 4.101 3.900 4.217 . 0 0 "[ . 1 . 2]" 1
1629 1 61 GLU QG 1 97 LEU MD1 . . 5.270 4.058 3.968 4.219 . 0 0 "[ . 1 . 2]" 1
1630 1 62 PHE H 1 62 PHE QD . . 4.000 2.700 2.592 2.775 . 0 0 "[ . 1 . 2]" 1
1631 1 62 PHE H 1 63 ASP H . . 5.310 4.501 4.486 4.520 . 0 0 "[ . 1 . 2]" 1
1632 1 62 PHE H 1 64 SER H . . 5.340 4.577 4.510 4.657 . 0 0 "[ . 1 . 2]" 1
1633 1 62 PHE H 1 68 ALA MB . . 4.570 3.700 3.556 3.793 . 0 0 "[ . 1 . 2]" 1
1634 1 62 PHE HA 1 62 PHE QE . . 5.400 4.674 4.640 4.700 . 0 0 "[ . 1 . 2]" 1
1635 1 62 PHE HA 1 63 ASP H . . 3.900 2.447 2.427 2.483 . 0 0 "[ . 1 . 2]" 1
1636 1 62 PHE HA 1 63 ASP HA . . 5.460 4.312 4.296 4.331 . 0 0 "[ . 1 . 2]" 1
1637 1 62 PHE HA 1 64 SER H . . 5.000 4.098 4.020 4.196 . 0 0 "[ . 1 . 2]" 1
1638 1 62 PHE HA 1 67 SER HB2 . . 5.630 4.622 4.548 4.794 . 0 0 "[ . 1 . 2]" 1
1639 1 62 PHE HA 1 68 ALA MB . . 5.750 5.187 5.140 5.272 . 0 0 "[ . 1 . 2]" 1
1640 1 62 PHE HB2 1 63 ASP H . . 4.470 3.595 3.525 3.632 . 0 0 "[ . 1 . 2]" 1
1641 1 62 PHE HB2 1 64 SER H . . 4.260 3.029 2.970 3.158 . 0 0 "[ . 1 . 2]" 1
1642 1 62 PHE HB2 1 67 SER HB2 . . 5.330 2.922 2.749 3.231 . 0 0 "[ . 1 . 2]" 1
1643 1 62 PHE HB2 1 67 SER HB3 . . 5.030 4.104 3.896 4.310 . 0 0 "[ . 1 . 2]" 1
1644 1 62 PHE HB2 1 68 ALA H . . 4.780 3.483 3.423 3.556 . 0 0 "[ . 1 . 2]" 1
1645 1 62 PHE HB2 1 68 ALA MB . . 4.970 2.641 2.601 2.734 . 0 0 "[ . 1 . 2]" 1
1646 1 62 PHE HB3 1 63 ASP H . . 4.470 2.301 2.238 2.328 . 0 0 "[ . 1 . 2]" 1
1647 1 62 PHE HB3 1 64 SER H . . 4.260 2.513 2.365 2.632 . 0 0 "[ . 1 . 2]" 1
1648 1 62 PHE HB3 1 67 SER HB2 . . 5.330 2.130 2.062 2.329 . 0 0 "[ . 1 . 2]" 1
1649 1 62 PHE HB3 1 67 SER HB3 . . 5.030 2.975 2.743 3.297 . 0 0 "[ . 1 . 2]" 1
1650 1 62 PHE HB3 1 68 ALA H . . 4.780 4.147 4.041 4.273 . 0 0 "[ . 1 . 2]" 1
1651 1 62 PHE HB3 1 68 ALA MB . . 4.970 4.032 3.950 4.125 . 0 0 "[ . 1 . 2]" 1
1652 1 62 PHE HZ 1 68 ALA MB . . 5.610 5.371 5.220 5.600 . 0 0 "[ . 1 . 2]" 1
1653 1 62 PHE HZ 1 71 ALA H . . 5.440 5.237 5.060 5.377 . 0 0 "[ . 1 . 2]" 1
1654 1 62 PHE HZ 1 71 ALA MB . . 4.120 2.357 2.293 2.412 . 0 0 "[ . 1 . 2]" 1
1655 1 62 PHE HZ 1 72 LYS H . . 6.000 6.024 5.936 6.108 0.108 18 0 "[ . 1 . 2]" 1
1656 1 62 PHE QB 1 63 ASP H . . 3.970 2.276 2.214 2.302 . 0 0 "[ . 1 . 2]" 1
1657 1 62 PHE QB 1 64 SER H . . 3.860 2.396 2.287 2.484 . 0 0 "[ . 1 . 2]" 1
1658 1 62 PHE QB 1 67 SER HB2 . . 4.780 2.080 2.007 2.278 . 0 0 "[ . 1 . 2]" 1
1659 1 62 PHE QB 1 67 SER HB3 . . 4.610 2.908 2.691 3.195 . 0 0 "[ . 1 . 2]" 1
1660 1 62 PHE QB 1 68 ALA H . . 4.350 3.312 3.260 3.390 . 0 0 "[ . 1 . 2]" 1
1661 1 62 PHE QB 1 68 ALA MB . . 4.570 2.608 2.568 2.697 . 0 0 "[ . 1 . 2]" 1
1662 1 62 PHE QD 1 63 ASP H . . 4.520 3.570 3.469 3.643 . 0 0 "[ . 1 . 2]" 1
1663 1 62 PHE QD 1 64 SER H . . 5.310 4.443 4.304 4.547 . 0 0 "[ . 1 . 2]" 1
1664 1 62 PHE QD 1 67 SER HA . . 5.450 4.738 4.615 4.982 . 0 0 "[ . 1 . 2]" 1
1665 1 62 PHE QD 1 67 SER HB2 . . 5.630 3.153 2.952 3.407 . 0 0 "[ . 1 . 2]" 1
1666 1 62 PHE QD 1 67 SER HB3 . . 4.620 2.519 2.339 2.822 . 0 0 "[ . 1 . 2]" 1
1667 1 62 PHE QD 1 68 ALA HA . . 4.730 3.244 3.080 3.374 . 0 0 "[ . 1 . 2]" 1
1668 1 62 PHE QD 1 68 ALA MB . . 4.140 2.599 2.529 2.695 . 0 0 "[ . 1 . 2]" 1
1669 1 62 PHE QD 1 69 GLN H . . 5.850 5.927 5.893 5.966 0.116 13 0 "[ . 1 . 2]" 1
1670 1 62 PHE QE 1 67 SER HB3 . . 5.210 3.941 3.606 4.158 . 0 0 "[ . 1 . 2]" 1
1671 1 62 PHE QE 1 68 ALA HA . . 4.990 3.478 3.377 3.638 . 0 0 "[ . 1 . 2]" 1
1672 1 62 PHE QE 1 68 ALA MB . . 4.550 3.841 3.724 4.012 . 0 0 "[ . 1 . 2]" 1
1673 1 62 PHE QE 1 71 ALA H . . 5.380 4.954 4.801 5.026 . 0 0 "[ . 1 . 2]" 1
1674 1 62 PHE QE 1 71 ALA MB . . 4.100 2.676 2.564 2.759 . 0 0 "[ . 1 . 2]" 1
1675 1 62 PHE QE 1 72 LYS H . . 5.750 5.499 5.352 5.595 . 0 0 "[ . 1 . 2]" 1
1676 1 63 ASP H 1 63 ASP HB2 . . 4.250 2.546 2.512 2.593 . 0 0 "[ . 1 . 2]" 1
1677 1 63 ASP H 1 63 ASP HB3 . . 4.250 2.442 2.421 2.467 . 0 0 "[ . 1 . 2]" 1
1678 1 63 ASP H 1 64 SER H . . 4.010 2.536 2.467 2.588 . 0 0 "[ . 1 . 2]" 1
1679 1 63 ASP H 1 64 SER HA . . 5.660 5.216 5.164 5.247 . 0 0 "[ . 1 . 2]" 1
1680 1 63 ASP H 1 67 SER H . . 5.750 5.756 5.624 5.819 0.069 17 0 "[ . 1 . 2]" 1
1681 1 63 ASP H 1 67 SER HB2 . . 5.070 3.777 3.606 3.999 . 0 0 "[ . 1 . 2]" 1
1682 1 63 ASP H 1 67 SER HB3 . . 4.970 4.479 4.177 4.958 . 0 0 "[ . 1 . 2]" 1
1683 1 63 ASP H 1 68 ALA MB . . 5.750 5.815 5.788 5.854 0.104 18 0 "[ . 1 . 2]" 1
1684 1 63 ASP HA 1 64 SER HA . . 5.420 4.535 4.509 4.555 . 0 0 "[ . 1 . 2]" 1
1685 1 63 ASP HB2 1 64 SER H . . 4.970 4.237 4.194 4.275 . 0 0 "[ . 1 . 2]" 1
1686 1 63 ASP HB3 1 64 SER H . . 4.970 3.260 3.145 3.371 . 0 0 "[ . 1 . 2]" 1
1687 1 63 ASP QB 1 64 SER H . . 4.570 3.159 3.061 3.252 . 0 0 "[ . 1 . 2]" 1
1688 1 63 ASP QB 1 64 SER QB . . 5.540 3.698 3.550 3.864 . 0 0 "[ . 1 . 2]" 1
1689 1 64 SER H 1 66 GLN H . . 5.750 4.948 4.838 5.035 . 0 0 "[ . 1 . 2]" 1
1690 1 64 SER H 1 67 SER HB2 . . 4.330 2.792 2.612 3.163 . 0 0 "[ . 1 . 2]" 1
1691 1 64 SER H 1 67 SER HB3 . . 5.050 4.315 4.109 4.800 . 0 0 "[ . 1 . 2]" 1
1692 1 64 SER H 1 68 ALA MB . . 5.430 4.736 4.685 4.796 . 0 0 "[ . 1 . 2]" 1
1693 1 64 SER HA 1 65 VAL H . . 4.250 2.326 2.276 2.395 . 0 0 "[ . 1 . 2]" 1
1694 1 64 SER HA 1 65 VAL HA . . 5.730 4.358 4.341 4.377 . 0 0 "[ . 1 . 2]" 1
1695 1 64 SER HA 1 65 VAL MG1 . . 5.750 3.889 3.804 3.994 . 0 0 "[ . 1 . 2]" 1
1696 1 64 SER HA 1 65 VAL MG2 . . 5.750 5.527 5.491 5.561 . 0 0 "[ . 1 . 2]" 1
1697 1 64 SER HA 1 65 VAL QG . . 4.830 3.815 3.740 3.908 . 0 0 "[ . 1 . 2]" 1
1698 1 64 SER HA 1 66 GLN H . . 5.390 3.992 3.879 4.122 . 0 0 "[ . 1 . 2]" 1
1699 1 64 SER HA 1 66 GLN HB2 . . 6.000 5.509 5.294 5.740 . 0 0 "[ . 1 . 2]" 1
1700 1 64 SER HA 1 67 SER H . . 5.410 4.575 4.489 4.705 . 0 0 "[ . 1 . 2]" 1
1701 1 64 SER HA 1 68 ALA H . . 5.750 5.626 5.584 5.667 . 0 0 "[ . 1 . 2]" 1
1702 1 64 SER HB2 1 65 VAL H . . 4.950 3.508 2.522 4.040 . 0 0 "[ . 1 . 2]" 1
1703 1 64 SER HB3 1 65 VAL H . . 4.950 3.921 3.843 4.010 . 0 0 "[ . 1 . 2]" 1
1704 1 64 SER QB 1 65 VAL QG . . 4.850 3.937 3.264 4.338 . 0 0 "[ . 1 . 2]" 1
1705 1 64 SER QB 1 66 GLN H . . 4.170 3.004 2.571 3.282 . 0 0 "[ . 1 . 2]" 1
1706 1 64 SER QB 1 67 SER H . . 5.010 3.023 2.663 3.638 . 0 0 "[ . 1 . 2]" 1
1707 1 64 SER QB 1 67 SER HB2 . . 5.370 3.702 3.189 4.498 . 0 0 "[ . 1 . 2]" 1
1708 1 65 VAL H 1 66 GLN H . . 4.710 2.580 2.561 2.611 . 0 0 "[ . 1 . 2]" 1
1709 1 65 VAL HA 1 68 ALA H . . 4.490 3.009 2.889 3.104 . 0 0 "[ . 1 . 2]" 1
1710 1 65 VAL HA 1 68 ALA MB . . 3.990 2.469 2.290 2.587 . 0 0 "[ . 1 . 2]" 1
1711 1 65 VAL HA 1 69 GLN H . . 5.050 4.154 4.010 4.297 . 0 0 "[ . 1 . 2]" 1
1712 1 65 VAL HA 1 91 TYR QE . . 5.510 5.213 4.788 5.527 0.017 10 0 "[ . 1 . 2]" 1
1713 1 65 VAL HB 1 66 GLN H . . 4.770 4.197 4.170 4.230 . 0 0 "[ . 1 . 2]" 1
1714 1 65 VAL HB 1 66 GLN HA . . 5.750 5.771 5.748 5.833 0.083 20 0 "[ . 1 . 2]" 1
1715 1 65 VAL HB 1 67 SER H . . 6.000 5.681 5.606 5.756 . 0 0 "[ . 1 . 2]" 1
1716 1 65 VAL MG1 1 66 GLN H . . 4.930 2.477 2.419 2.552 . 0 0 "[ . 1 . 2]" 1
1717 1 65 VAL MG1 1 66 GLN HA . . 5.020 3.464 3.402 3.574 . 0 0 "[ . 1 . 2]" 1
1718 1 65 VAL MG1 1 67 SER H . . 5.730 4.449 4.392 4.544 . 0 0 "[ . 1 . 2]" 1
1719 1 65 VAL MG1 1 69 GLN HG3 . . 5.280 4.077 3.942 4.244 . 0 0 "[ . 1 . 2]" 1
1720 1 65 VAL MG2 1 66 GLN H . . 4.930 3.822 3.750 3.889 . 0 0 "[ . 1 . 2]" 1
1721 1 65 VAL MG2 1 66 GLN HA . . 5.020 3.758 3.666 3.850 . 0 0 "[ . 1 . 2]" 1
1722 1 65 VAL MG2 1 67 SER H . . 5.730 4.893 4.794 4.975 . 0 0 "[ . 1 . 2]" 1
1723 1 65 VAL MG2 1 69 GLN HG3 . . 5.280 3.055 2.782 3.312 . 0 0 "[ . 1 . 2]" 1
1724 1 65 VAL QG 1 66 GLN H . . 4.250 2.448 2.393 2.518 . 0 0 "[ . 1 . 2]" 1
1725 1 65 VAL QG 1 66 GLN HA . . 4.330 3.198 3.162 3.276 . 0 0 "[ . 1 . 2]" 1
1726 1 65 VAL QG 1 66 GLN QG . . 5.620 2.537 2.385 3.723 . 0 0 "[ . 1 . 2]" 1
1727 1 65 VAL QG 1 67 SER H . . 5.120 4.128 4.068 4.192 . 0 0 "[ . 1 . 2]" 1
1728 1 65 VAL QG 1 69 GLN H . . 4.970 3.737 3.591 3.863 . 0 0 "[ . 1 . 2]" 1
1729 1 65 VAL QG 1 69 GLN HB2 . . 5.690 4.175 4.017 4.309 . 0 0 "[ . 1 . 2]" 1
1730 1 65 VAL QG 1 69 GLN HB3 . . 5.660 4.836 4.673 4.987 . 0 0 "[ . 1 . 2]" 1
1731 1 65 VAL QG 1 69 GLN HE21 . . 4.850 2.603 2.439 2.794 . 0 0 "[ . 1 . 2]" 1
1732 1 65 VAL QG 1 69 GLN HE22 . . 4.870 3.990 3.818 4.172 . 0 0 "[ . 1 . 2]" 1
1733 1 65 VAL QG 1 69 GLN HG2 . . 4.760 2.541 2.368 2.713 . 0 0 "[ . 1 . 2]" 1
1734 1 65 VAL QG 1 69 GLN HG3 . . 4.350 2.971 2.733 3.195 . 0 0 "[ . 1 . 2]" 1
1735 1 65 VAL QG 1 91 TYR QE . . 5.510 3.511 3.249 3.721 . 0 0 "[ . 1 . 2]" 1
1736 1 66 GLN H 1 66 GLN HB2 . . 3.930 2.422 2.260 2.510 . 0 0 "[ . 1 . 2]" 1
1737 1 66 GLN H 1 66 GLN QE . . 5.310 3.927 2.448 4.867 . 0 0 "[ . 1 . 2]" 1
1738 1 66 GLN H 1 66 GLN QG . . 4.570 2.241 2.061 3.477 . 0 0 "[ . 1 . 2]" 1
1739 1 66 GLN H 1 67 SER H . . 4.290 2.549 2.501 2.599 . 0 0 "[ . 1 . 2]" 1
1740 1 66 GLN H 1 68 ALA H . . 5.270 3.978 3.927 4.037 . 0 0 "[ . 1 . 2]" 1
1741 1 66 GLN H 1 68 ALA MB . . 5.750 4.848 4.736 4.918 . 0 0 "[ . 1 . 2]" 1
1742 1 66 GLN H 1 69 GLN H . . 5.520 4.693 4.612 4.759 . 0 0 "[ . 1 . 2]" 1
1743 1 66 GLN H 1 69 GLN HB2 . . 5.750 5.180 5.085 5.321 . 0 0 "[ . 1 . 2]" 1
1744 1 66 GLN HA 1 68 ALA H . . 5.570 4.180 4.081 4.311 . 0 0 "[ . 1 . 2]" 1
1745 1 66 GLN HA 1 69 GLN HB2 . . 4.480 2.586 2.384 2.740 . 0 0 "[ . 1 . 2]" 1
1746 1 66 GLN HA 1 69 GLN HG3 . . 4.570 2.905 2.668 3.084 . 0 0 "[ . 1 . 2]" 1
1747 1 66 GLN HB2 1 67 SER H . . 4.110 2.959 2.845 3.084 . 0 0 "[ . 1 . 2]" 1
1748 1 66 GLN HB3 1 67 SER H . . 4.540 3.929 3.703 4.037 . 0 0 "[ . 1 . 2]" 1
1749 1 66 GLN QE 1 67 SER H . . 5.660 5.291 4.407 5.758 0.098 2 0 "[ . 1 . 2]" 1
1750 1 66 GLN QG 1 69 GLN HB2 . . 5.480 4.586 4.299 5.238 . 0 0 "[ . 1 . 2]" 1
1751 1 66 GLN QG 1 69 GLN HG3 . . 5.030 4.195 3.726 4.942 . 0 0 "[ . 1 . 2]" 1
1752 1 67 SER H 1 67 SER HB2 . . 3.520 2.447 2.400 2.485 . 0 0 "[ . 1 . 2]" 1
1753 1 67 SER H 1 68 ALA H . . 4.050 2.399 2.333 2.461 . 0 0 "[ . 1 . 2]" 1
1754 1 67 SER H 1 68 ALA HA . . 5.710 5.084 5.018 5.136 . 0 0 "[ . 1 . 2]" 1
1755 1 67 SER H 1 68 ALA MB . . 5.140 4.098 4.042 4.156 . 0 0 "[ . 1 . 2]" 1
1756 1 67 SER H 1 69 GLN H . . 5.010 3.824 3.759 3.886 . 0 0 "[ . 1 . 2]" 1
1757 1 67 SER HA 1 70 ARG H . . 4.830 3.351 2.966 3.442 . 0 0 "[ . 1 . 2]" 1
1758 1 67 SER HA 1 70 ARG QB . . 4.480 2.841 2.408 3.054 . 0 0 "[ . 1 . 2]" 1
1759 1 67 SER HA 1 70 ARG QG . . 5.660 4.786 4.150 5.111 . 0 0 "[ . 1 . 2]" 1
1760 1 67 SER HB2 1 68 ALA H . . 3.720 2.922 2.866 3.078 . 0 0 "[ . 1 . 2]" 1
1761 1 67 SER HB2 1 68 ALA HA . . 5.710 4.463 4.413 4.641 . 0 0 "[ . 1 . 2]" 1
1762 1 67 SER HB3 1 68 ALA H . . 4.770 3.980 3.914 4.029 . 0 0 "[ . 1 . 2]" 1
1763 1 67 SER HB3 1 71 ALA H . . 5.750 5.327 4.875 5.415 . 0 0 "[ . 1 . 2]" 1
1764 1 68 ALA H 1 68 ALA MB . . 3.590 2.220 2.208 2.229 . 0 0 "[ . 1 . 2]" 1
1765 1 68 ALA H 1 69 GLN H . . 3.880 2.415 2.379 2.445 . 0 0 "[ . 1 . 2]" 1
1766 1 68 ALA H 1 69 GLN HB2 . . 5.690 4.450 4.406 4.523 . 0 0 "[ . 1 . 2]" 1
1767 1 68 ALA H 1 69 GLN HG2 . . 5.700 4.330 4.238 4.391 . 0 0 "[ . 1 . 2]" 1
1768 1 68 ALA H 1 69 GLN HG3 . . 5.550 5.423 5.344 5.517 . 0 0 "[ . 1 . 2]" 1
1769 1 68 ALA H 1 70 ARG H . . 5.030 4.010 3.893 4.103 . 0 0 "[ . 1 . 2]" 1
1770 1 68 ALA H 1 71 ALA H . . 5.590 4.601 4.553 4.654 . 0 0 "[ . 1 . 2]" 1
1771 1 68 ALA H 1 71 ALA MB . . 5.750 4.563 4.502 4.659 . 0 0 "[ . 1 . 2]" 1
1772 1 68 ALA H 1 91 TYR QE . . 5.720 5.675 5.275 5.806 0.086 10 0 "[ . 1 . 2]" 1
1773 1 68 ALA HA 1 69 GLN HA . . 5.460 4.824 4.808 4.862 . 0 0 "[ . 1 . 2]" 1
1774 1 68 ALA HA 1 70 ARG H . . 5.070 4.197 4.082 4.283 . 0 0 "[ . 1 . 2]" 1
1775 1 68 ALA HA 1 70 ARG QB . . 5.550 5.045 4.940 5.131 . 0 0 "[ . 1 . 2]" 1
1776 1 68 ALA HA 1 71 ALA H . . 4.450 3.079 3.020 3.168 . 0 0 "[ . 1 . 2]" 1
1777 1 68 ALA HA 1 71 ALA MB . . 4.190 2.318 2.260 2.486 . 0 0 "[ . 1 . 2]" 1
1778 1 68 ALA HA 1 72 LYS H . . 5.070 4.122 3.968 4.195 . 0 0 "[ . 1 . 2]" 1
1779 1 68 ALA MB 1 69 GLN H . . 3.850 2.838 2.771 2.881 . 0 0 "[ . 1 . 2]" 1
1780 1 68 ALA MB 1 69 GLN HA . . 5.430 4.043 4.021 4.071 . 0 0 "[ . 1 . 2]" 1
1781 1 68 ALA MB 1 69 GLN HG2 . . 4.950 3.564 3.493 3.625 . 0 0 "[ . 1 . 2]" 1
1782 1 68 ALA MB 1 69 GLN HG3 . . 5.270 4.998 4.917 5.075 . 0 0 "[ . 1 . 2]" 1
1783 1 68 ALA MB 1 70 ARG H . . 5.270 4.606 4.511 4.652 . 0 0 "[ . 1 . 2]" 1
1784 1 68 ALA MB 1 71 ALA MB . . 5.040 3.525 3.452 3.740 . 0 0 "[ . 1 . 2]" 1
1785 1 68 ALA MB 1 91 TYR QD . . 4.890 4.024 3.869 4.169 . 0 0 "[ . 1 . 2]" 1
1786 1 68 ALA MB 1 91 TYR QE . . 4.180 3.084 2.728 3.242 . 0 0 "[ . 1 . 2]" 1
1787 1 69 GLN H 1 69 GLN HB2 . . 3.700 2.303 2.279 2.356 . 0 0 "[ . 1 . 2]" 1
1788 1 69 GLN H 1 69 GLN HE21 . . 5.400 4.937 4.672 5.056 . 0 0 "[ . 1 . 2]" 1
1789 1 69 GLN H 1 69 GLN HG2 . . 3.850 2.495 2.415 2.556 . 0 0 "[ . 1 . 2]" 1
1790 1 69 GLN H 1 69 GLN HG3 . . 4.630 3.538 3.461 3.622 . 0 0 "[ . 1 . 2]" 1
1791 1 69 GLN H 1 70 ARG H . . 3.910 2.557 2.523 2.574 . 0 0 "[ . 1 . 2]" 1
1792 1 69 GLN H 1 71 ALA H . . 5.230 3.845 3.790 3.958 . 0 0 "[ . 1 . 2]" 1
1793 1 69 GLN H 1 71 ALA MB . . 5.470 4.621 4.561 4.756 . 0 0 "[ . 1 . 2]" 1
1794 1 69 GLN H 1 72 LYS HD2 . . 5.900 5.066 4.897 6.211 0.311 6 0 "[ . 1 . 2]" 1
1795 1 69 GLN H 1 91 TYR QE . . 5.620 4.722 4.413 4.830 . 0 0 "[ . 1 . 2]" 1
1796 1 69 GLN HA 1 69 GLN HE21 . . 5.090 4.361 4.228 4.476 . 0 0 "[ . 1 . 2]" 1
1797 1 69 GLN HA 1 69 GLN HE22 . . 5.590 4.473 4.329 4.597 . 0 0 "[ . 1 . 2]" 1
1798 1 69 GLN HA 1 69 GLN HG2 . . 4.470 2.758 2.715 2.866 . 0 0 "[ . 1 . 2]" 1
1799 1 69 GLN HA 1 71 ALA H . . 5.370 4.233 4.166 4.396 . 0 0 "[ . 1 . 2]" 1
1800 1 69 GLN HA 1 72 LYS H . . 4.940 3.991 3.928 4.071 . 0 0 "[ . 1 . 2]" 1
1801 1 69 GLN HA 1 72 LYS HB3 . . 5.010 4.807 3.652 5.012 0.002 12 0 "[ . 1 . 2]" 1
1802 1 69 GLN HA 1 72 LYS HD3 . . 5.750 3.269 3.081 4.859 . 0 0 "[ . 1 . 2]" 1
1803 1 69 GLN HA 1 72 LYS QE . . 4.570 3.611 2.448 3.712 . 0 0 "[ . 1 . 2]" 1
1804 1 69 GLN HA 1 73 ALA MB . . 5.120 4.369 4.239 4.505 . 0 0 "[ . 1 . 2]" 1
1805 1 69 GLN HA 1 91 TYR QE . . 4.700 3.819 3.693 3.892 . 0 0 "[ . 1 . 2]" 1
1806 1 69 GLN HB2 1 70 ARG H . . 4.050 2.712 2.679 2.754 . 0 0 "[ . 1 . 2]" 1
1807 1 69 GLN HB2 1 70 ARG QB . . 5.340 3.960 3.861 4.009 . 0 0 "[ . 1 . 2]" 1
1808 1 69 GLN HB2 1 71 ALA H . . 5.670 4.886 4.841 4.970 . 0 0 "[ . 1 . 2]" 1
1809 1 69 GLN HB2 1 72 LYS QE . . 6.000 6.023 5.269 6.084 0.084 10 0 "[ . 1 . 2]" 1
1810 1 69 GLN HB2 1 73 ALA MB . . 5.340 5.252 5.200 5.325 . 0 0 "[ . 1 . 2]" 1
1811 1 69 GLN HB3 1 69 GLN HE22 . . 5.610 4.622 4.602 4.672 . 0 0 "[ . 1 . 2]" 1
1812 1 69 GLN HB3 1 70 ARG H . . 4.750 3.621 3.584 3.674 . 0 0 "[ . 1 . 2]" 1
1813 1 69 GLN HB3 1 73 ALA MB . . 5.060 4.351 4.265 4.410 . 0 0 "[ . 1 . 2]" 1
1814 1 69 GLN HB3 1 91 TYR QE . . 5.590 5.624 5.588 5.662 0.072 17 0 "[ . 1 . 2]" 1
1815 1 69 GLN HE21 1 91 TYR QD . . 5.650 5.629 5.367 5.694 0.044 1 0 "[ . 1 . 2]" 1
1816 1 69 GLN HE21 1 91 TYR QE . . 4.460 3.879 3.530 4.081 . 0 0 "[ . 1 . 2]" 1
1817 1 69 GLN HG2 1 70 ARG H . . 5.190 4.531 4.481 4.580 . 0 0 "[ . 1 . 2]" 1
1818 1 69 GLN HG2 1 91 TYR QE . . 5.070 3.766 3.630 3.924 . 0 0 "[ . 1 . 2]" 1
1819 1 70 ARG H 1 70 ARG HD2 . . 5.750 4.942 4.679 5.825 0.075 3 0 "[ . 1 . 2]" 1
1820 1 70 ARG H 1 70 ARG HD3 . . 5.750 4.884 4.675 5.885 0.135 18 0 "[ . 1 . 2]" 1
1821 1 70 ARG H 1 70 ARG HG2 . . 5.310 4.466 4.410 4.602 . 0 0 "[ . 1 . 2]" 1
1822 1 70 ARG H 1 70 ARG HG3 . . 5.310 4.448 4.330 4.487 . 0 0 "[ . 1 . 2]" 1
1823 1 70 ARG H 1 70 ARG QB . . 3.500 2.221 2.150 2.250 . 0 0 "[ . 1 . 2]" 1
1824 1 70 ARG H 1 70 ARG QG . . 4.900 3.969 3.934 4.010 . 0 0 "[ . 1 . 2]" 1
1825 1 70 ARG H 1 71 ALA H . . 3.870 2.466 2.431 2.522 . 0 0 "[ . 1 . 2]" 1
1826 1 70 ARG H 1 71 ALA HA . . 5.690 5.068 5.038 5.134 . 0 0 "[ . 1 . 2]" 1
1827 1 70 ARG H 1 71 ALA MB . . 4.950 4.131 4.094 4.183 . 0 0 "[ . 1 . 2]" 1
1828 1 70 ARG H 1 72 LYS H . . 5.350 4.596 4.336 4.671 . 0 0 "[ . 1 . 2]" 1
1829 1 70 ARG HA 1 70 ARG HD2 . . 5.640 3.904 2.087 4.652 . 0 0 "[ . 1 . 2]" 1
1830 1 70 ARG HA 1 70 ARG HD3 . . 5.640 4.246 2.079 4.743 . 0 0 "[ . 1 . 2]" 1
1831 1 70 ARG HA 1 71 ALA HA . . 5.410 4.804 4.782 4.816 . 0 0 "[ . 1 . 2]" 1
1832 1 70 ARG HA 1 73 ALA MB . . 4.050 2.287 2.098 2.531 . 0 0 "[ . 1 . 2]" 1
1833 1 70 ARG HG2 1 71 ALA H . . 5.390 4.388 4.103 5.107 . 0 0 "[ . 1 . 2]" 1
1834 1 70 ARG HG3 1 71 ALA H . . 5.390 4.801 3.990 5.037 . 0 0 "[ . 1 . 2]" 1
1835 1 70 ARG QB 1 71 ALA H . . 3.830 2.942 2.766 3.000 . 0 0 "[ . 1 . 2]" 1
1836 1 70 ARG QB 1 71 ALA MB . . 5.130 4.054 3.886 4.106 . 0 0 "[ . 1 . 2]" 1
1837 1 70 ARG QB 1 73 ALA MB . . 4.800 4.137 3.929 4.326 . 0 0 "[ . 1 . 2]" 1
1838 1 70 ARG QD 1 71 ALA H . . 5.650 4.968 4.614 5.097 . 0 0 "[ . 1 . 2]" 1
1839 1 70 ARG QG 1 71 ALA MB . . 5.660 4.614 4.337 4.713 . 0 0 "[ . 1 . 2]" 1
1840 1 70 ARG QG 1 74 SER QB . . 5.550 3.461 3.001 4.012 . 0 0 "[ . 1 . 2]" 1
1841 1 71 ALA H 1 71 ALA MB . . 3.510 2.207 2.200 2.215 . 0 0 "[ . 1 . 2]" 1
1842 1 71 ALA H 1 72 LYS H . . 4.020 2.824 2.678 2.872 . 0 0 "[ . 1 . 2]" 1
1843 1 71 ALA H 1 72 LYS HA . . 5.750 5.355 5.300 5.388 . 0 0 "[ . 1 . 2]" 1
1844 1 71 ALA HA 1 73 ALA H . . 5.190 4.153 4.066 4.204 . 0 0 "[ . 1 . 2]" 1
1845 1 71 ALA HA 1 74 SER QB . . 5.030 3.505 3.095 3.869 . 0 0 "[ . 1 . 2]" 1
1846 1 71 ALA HA 1 75 LEU H . . 5.510 4.592 4.500 4.690 . 0 0 "[ . 1 . 2]" 1
1847 1 71 ALA HA 1 75 LEU HG . . 4.920 3.504 3.328 3.824 . 0 0 "[ . 1 . 2]" 1
1848 1 71 ALA HA 1 75 LEU MD1 . . 5.030 3.025 2.743 3.497 . 0 0 "[ . 1 . 2]" 1
1849 1 71 ALA MB 1 72 LYS H . . 3.710 2.402 2.340 2.482 . 0 0 "[ . 1 . 2]" 1
1850 1 71 ALA MB 1 72 LYS HA . . 5.110 3.878 3.832 3.980 . 0 0 "[ . 1 . 2]" 1
1851 1 71 ALA MB 1 72 LYS HD2 . . 5.440 4.621 4.452 5.456 0.016 6 0 "[ . 1 . 2]" 1
1852 1 71 ALA MB 1 73 ALA H . . 5.010 4.218 4.192 4.306 . 0 0 "[ . 1 . 2]" 1
1853 1 71 ALA MB 1 74 SER H . . 5.390 4.649 4.542 4.730 . 0 0 "[ . 1 . 2]" 1
1854 1 71 ALA MB 1 75 LEU H . . 5.550 5.046 4.970 5.091 . 0 0 "[ . 1 . 2]" 1
1855 1 71 ALA MB 1 75 LEU HB2 . . 5.380 4.068 3.909 4.130 . 0 0 "[ . 1 . 2]" 1
1856 1 71 ALA MB 1 75 LEU MD1 . . 3.790 2.667 2.479 2.893 . 0 0 "[ . 1 . 2]" 1
1857 1 72 LYS H 1 72 LYS HB2 . . 4.290 3.567 3.123 3.606 . 0 0 "[ . 1 . 2]" 1
1858 1 72 LYS H 1 72 LYS HB3 . . 3.880 2.323 2.080 2.364 . 0 0 "[ . 1 . 2]" 1
1859 1 72 LYS H 1 72 LYS HD2 . . 4.380 2.937 2.861 3.427 . 0 0 "[ . 1 . 2]" 1
1860 1 72 LYS H 1 72 LYS HD3 . . 5.510 2.692 2.424 5.030 . 0 0 "[ . 1 . 2]" 1
1861 1 72 LYS H 1 72 LYS HG2 . . 4.990 4.057 4.000 4.389 . 0 0 "[ . 1 . 2]" 1
1862 1 72 LYS H 1 72 LYS QE . . 5.280 4.453 3.676 4.624 . 0 0 "[ . 1 . 2]" 1
1863 1 72 LYS H 1 73 ALA H . . 3.980 2.575 2.528 2.616 . 0 0 "[ . 1 . 2]" 1
1864 1 72 LYS H 1 73 ALA MB . . 5.080 4.230 4.195 4.288 . 0 0 "[ . 1 . 2]" 1
1865 1 72 LYS H 1 74 SER H . . 4.990 4.145 4.054 4.249 . 0 0 "[ . 1 . 2]" 1
1866 1 72 LYS H 1 89 ILE HB . . 5.750 5.543 5.413 5.607 . 0 0 "[ . 1 . 2]" 1
1867 1 72 LYS H 1 89 ILE MG . . 5.340 3.881 3.747 4.036 . 0 0 "[ . 1 . 2]" 1
1868 1 72 LYS HA 1 72 LYS HD2 . . 5.230 4.582 3.976 4.671 . 0 0 "[ . 1 . 2]" 1
1869 1 72 LYS HA 1 72 LYS HD3 . . 5.500 3.944 3.856 4.865 . 0 0 "[ . 1 . 2]" 1
1870 1 72 LYS HA 1 74 SER H . . 5.250 3.628 3.557 3.747 . 0 0 "[ . 1 . 2]" 1
1871 1 72 LYS HA 1 75 LEU H . . 5.000 3.096 2.989 3.164 . 0 0 "[ . 1 . 2]" 1
1872 1 72 LYS HA 1 76 ASN H . . 4.650 3.391 3.158 3.639 . 0 0 "[ . 1 . 2]" 1
1873 1 72 LYS HA 1 76 ASN HA . . 5.170 4.568 4.353 4.819 . 0 0 "[ . 1 . 2]" 1
1874 1 72 LYS HA 1 89 ILE H . . 5.590 5.699 5.604 5.734 0.144 2 0 "[ . 1 . 2]" 1
1875 1 72 LYS HA 1 89 ILE HB . . 5.110 3.192 3.058 3.251 . 0 0 "[ . 1 . 2]" 1
1876 1 72 LYS HA 1 89 ILE MD . . 4.200 2.191 2.076 3.065 . 0 0 "[ . 1 . 2]" 1
1877 1 72 LYS HA 1 89 ILE MG . . 4.310 2.752 2.646 2.982 . 0 0 "[ . 1 . 2]" 1
1878 1 72 LYS HB2 1 72 LYS HE2 . . 5.410 4.477 4.124 4.516 . 0 0 "[ . 1 . 2]" 1
1879 1 72 LYS HB2 1 72 LYS HE3 . . 5.410 4.697 3.574 4.775 . 0 0 "[ . 1 . 2]" 1
1880 1 72 LYS HB2 1 72 LYS QE . . 4.960 4.073 3.370 4.124 . 0 0 "[ . 1 . 2]" 1
1881 1 72 LYS HB2 1 73 ALA H . . 5.170 4.491 4.424 4.535 . 0 0 "[ . 1 . 2]" 1
1882 1 72 LYS HB2 1 76 ASN HA . . 5.190 5.035 4.809 5.341 0.151 6 0 "[ . 1 . 2]" 1
1883 1 72 LYS HB2 1 89 ILE H . . 5.390 4.792 4.650 5.370 . 0 0 "[ . 1 . 2]" 1
1884 1 72 LYS HB2 1 89 ILE MG . . 4.650 1.983 1.938 2.109 . 0 0 "[ . 1 . 2]" 1
1885 1 72 LYS HB3 1 73 ALA H . . 4.530 4.058 3.402 4.123 . 0 0 "[ . 1 . 2]" 1
1886 1 72 LYS HB3 1 73 ALA HA . . 5.700 5.700 5.173 5.750 0.050 17 0 "[ . 1 . 2]" 1
1887 1 72 LYS HB3 1 89 ILE MG . . 5.410 2.335 2.216 3.393 . 0 0 "[ . 1 . 2]" 1
1888 1 72 LYS HD2 1 73 ALA H . . 4.570 3.736 2.461 3.845 . 0 0 "[ . 1 . 2]" 1
1889 1 72 LYS HD2 1 73 ALA HA . . 5.300 5.238 3.170 5.378 0.078 13 0 "[ . 1 . 2]" 1
1890 1 72 LYS HD2 1 73 ALA MB . . 5.160 4.181 2.761 4.355 . 0 0 "[ . 1 . 2]" 1
1891 1 72 LYS HD2 1 89 ILE MG . . 5.410 4.458 4.345 5.206 . 0 0 "[ . 1 . 2]" 1
1892 1 72 LYS HD2 1 91 TYR QE . . 5.540 3.695 3.438 5.229 . 0 0 "[ . 1 . 2]" 1
1893 1 72 LYS HD3 1 73 ALA HA . . 5.750 3.650 3.539 3.762 . 0 0 "[ . 1 . 2]" 1
1894 1 72 LYS HD3 1 73 ALA MB . . 4.770 2.879 2.775 3.592 . 0 0 "[ . 1 . 2]" 1
1895 1 72 LYS HD3 1 89 ILE MG . . 5.730 4.822 4.684 5.555 . 0 0 "[ . 1 . 2]" 1
1896 1 72 LYS HD3 1 91 TYR QE . . 5.400 4.934 4.685 5.071 . 0 0 "[ . 1 . 2]" 1
1897 1 72 LYS HE2 1 89 ILE MG . . 5.320 5.508 5.105 5.552 0.232 15 0 "[ . 1 . 2]" 1
1898 1 72 LYS HE2 1 91 TYR QE . . 5.180 4.119 2.544 4.802 . 0 0 "[ . 1 . 2]" 1
1899 1 72 LYS HE3 1 89 ILE MG . . 5.320 5.340 4.818 5.402 0.082 10 0 "[ . 1 . 2]" 1
1900 1 72 LYS HE3 1 91 TYR QE . . 5.180 2.658 2.180 3.297 . 0 0 "[ . 1 . 2]" 1
1901 1 72 LYS HG2 1 73 ALA H . . 4.560 3.803 3.674 4.060 . 0 0 "[ . 1 . 2]" 1
1902 1 72 LYS HG2 1 73 ALA HA . . 5.020 3.700 3.595 3.835 . 0 0 "[ . 1 . 2]" 1
1903 1 72 LYS HG2 1 76 ASN H . . 5.260 5.097 4.050 5.271 0.011 7 0 "[ . 1 . 2]" 1
1904 1 72 LYS HG2 1 76 ASN QB . . 4.640 3.487 2.312 3.776 . 0 0 "[ . 1 . 2]" 1
1905 1 72 LYS HG2 1 89 ILE HB . . 5.030 4.163 3.534 4.292 . 0 0 "[ . 1 . 2]" 1
1906 1 72 LYS HG2 1 89 ILE MG . . 4.940 3.887 3.848 3.963 . 0 0 "[ . 1 . 2]" 1
1907 1 72 LYS HG3 1 76 ASN QB . . 5.660 4.564 3.574 4.940 . 0 0 "[ . 1 . 2]" 1
1908 1 72 LYS HG3 1 89 ILE HB . . 4.820 4.302 3.792 4.430 . 0 0 "[ . 1 . 2]" 1
1909 1 72 LYS HG3 1 89 ILE MG . . 4.320 3.241 3.137 3.516 . 0 0 "[ . 1 . 2]" 1
1910 1 72 LYS HG3 1 90 GLU HA . . 5.550 4.014 3.803 4.213 . 0 0 "[ . 1 . 2]" 1
1911 1 72 LYS QE 1 73 ALA H . . 5.270 4.025 3.737 4.275 . 0 0 "[ . 1 . 2]" 1
1912 1 72 LYS QE 1 73 ALA MB . . 5.660 3.301 2.926 4.278 . 0 0 "[ . 1 . 2]" 1
1913 1 72 LYS QE 1 89 ILE MG . . 5.500 4.828 4.408 4.867 . 0 0 "[ . 1 . 2]" 1
1914 1 72 LYS QE 1 90 GLU HA . . 5.660 5.360 4.797 5.651 . 0 0 "[ . 1 . 2]" 1
1915 1 72 LYS QE 1 91 TYR QD . . 5.480 4.568 4.218 4.985 . 0 0 "[ . 1 . 2]" 1
1916 1 72 LYS QE 1 91 TYR QE . . 4.720 2.592 2.169 3.228 . 0 0 "[ . 1 . 2]" 1
1917 1 73 ALA H 1 73 ALA MB . . 3.310 2.242 2.229 2.258 . 0 0 "[ . 1 . 2]" 1
1918 1 73 ALA H 1 74 SER H . . 3.860 2.485 2.431 2.581 . 0 0 "[ . 1 . 2]" 1
1919 1 73 ALA H 1 74 SER HA . . 5.710 5.142 5.100 5.211 . 0 0 "[ . 1 . 2]" 1
1920 1 73 ALA H 1 74 SER QB . . 5.270 4.496 4.172 4.623 . 0 0 "[ . 1 . 2]" 1
1921 1 73 ALA H 1 75 LEU H . . 5.190 3.985 3.926 4.095 . 0 0 "[ . 1 . 2]" 1
1922 1 73 ALA HA 1 75 LEU H . . 5.210 4.298 4.238 4.373 . 0 0 "[ . 1 . 2]" 1
1923 1 73 ALA MB 1 74 SER H . . 4.160 3.170 3.057 3.212 . 0 0 "[ . 1 . 2]" 1
1924 1 73 ALA MB 1 74 SER HA . . 4.970 4.210 4.191 4.227 . 0 0 "[ . 1 . 2]" 1
1925 1 73 ALA MB 1 74 SER QB . . 5.340 4.135 3.554 4.337 . 0 0 "[ . 1 . 2]" 1
1926 1 73 ALA MB 1 75 LEU H . . 5.240 4.697 4.628 4.727 . 0 0 "[ . 1 . 2]" 1
1927 1 74 SER H 1 74 SER QB . . 3.720 2.601 2.494 2.645 . 0 0 "[ . 1 . 2]" 1
1928 1 74 SER H 1 75 LEU H . . 3.870 2.075 2.001 2.170 . 0 0 "[ . 1 . 2]" 1
1929 1 74 SER H 1 75 LEU HA . . 5.390 4.751 4.714 4.789 . 0 0 "[ . 1 . 2]" 1
1930 1 74 SER H 1 75 LEU HB2 . . 4.820 4.102 4.066 4.184 . 0 0 "[ . 1 . 2]" 1
1931 1 74 SER H 1 75 LEU HG . . 5.010 3.678 3.557 3.881 . 0 0 "[ . 1 . 2]" 1
1932 1 74 SER H 1 75 LEU MD1 . . 5.390 4.583 4.476 4.735 . 0 0 "[ . 1 . 2]" 1
1933 1 74 SER H 1 75 LEU MD2 . . 5.520 4.904 4.780 5.043 . 0 0 "[ . 1 . 2]" 1
1934 1 74 SER H 1 76 ASN H . . 5.530 3.668 3.586 3.867 . 0 0 "[ . 1 . 2]" 1
1935 1 74 SER H 1 89 ILE MD . . 5.540 4.611 4.495 5.450 . 0 0 "[ . 1 . 2]" 1
1936 1 74 SER HA 1 75 LEU H . . 4.250 3.350 3.299 3.402 . 0 0 "[ . 1 . 2]" 1
1937 1 74 SER HA 1 75 LEU HB2 . . 5.750 5.703 5.663 5.754 0.004 5 0 "[ . 1 . 2]" 1
1938 1 74 SER QB 1 75 LEU H . . 4.790 3.469 3.375 3.558 . 0 0 "[ . 1 . 2]" 1
1939 1 74 SER QB 1 75 LEU HG . . 4.540 2.861 2.716 3.148 . 0 0 "[ . 1 . 2]" 1
1940 1 74 SER QB 1 75 LEU MD1 . . 5.380 4.027 3.874 4.340 . 0 0 "[ . 1 . 2]" 1
1941 1 74 SER QB 1 75 LEU MD2 . . 4.690 3.584 3.421 3.879 . 0 0 "[ . 1 . 2]" 1
1942 1 75 LEU H 1 75 LEU HB2 . . 3.720 2.659 2.623 2.683 . 0 0 "[ . 1 . 2]" 1
1943 1 75 LEU H 1 75 LEU MD1 . . 4.890 4.033 3.976 4.114 . 0 0 "[ . 1 . 2]" 1
1944 1 75 LEU H 1 75 LEU MD2 . . 4.950 3.939 3.850 3.991 . 0 0 "[ . 1 . 2]" 1
1945 1 75 LEU H 1 76 ASN H . . 3.890 1.968 1.915 2.054 . 0 0 "[ . 1 . 2]" 1
1946 1 75 LEU H 1 76 ASN HA . . 5.470 4.557 4.525 4.609 . 0 0 "[ . 1 . 2]" 1
1947 1 75 LEU H 1 76 ASN HB2 . . 5.070 4.077 4.012 4.132 . 0 0 "[ . 1 . 2]" 1
1948 1 75 LEU H 1 76 ASN HB3 . . 5.070 4.321 4.244 4.427 . 0 0 "[ . 1 . 2]" 1
1949 1 75 LEU H 1 89 ILE MD . . 4.520 3.341 3.277 3.811 . 0 0 "[ . 1 . 2]" 1
1950 1 75 LEU HA 1 75 LEU MD1 . . 4.760 3.854 3.830 3.870 . 0 0 "[ . 1 . 2]" 1
1951 1 75 LEU HA 1 75 LEU MD2 . . 3.590 2.056 2.005 2.084 . 0 0 "[ . 1 . 2]" 1
1952 1 75 LEU HA 1 76 ASN H . . 4.300 3.408 3.384 3.468 . 0 0 "[ . 1 . 2]" 1
1953 1 75 LEU HA 1 77 GLY H . . 5.750 5.792 5.755 5.834 0.084 3 0 "[ . 1 . 2]" 1
1954 1 75 LEU HA 1 78 ALA MB . . 3.780 2.241 2.151 2.332 . 0 0 "[ . 1 . 2]" 1
1955 1 75 LEU HA 1 87 LEU QD . . 4.910 3.725 3.460 3.925 . 0 0 "[ . 1 . 2]" 1
1956 1 75 LEU HA 1 89 ILE MD . . 5.100 3.909 3.846 3.983 . 0 0 "[ . 1 . 2]" 1
1957 1 75 LEU HB2 1 75 LEU MD1 . . 3.630 2.270 2.258 2.293 . 0 0 "[ . 1 . 2]" 1
1958 1 75 LEU HB2 1 76 ASN H . . 4.590 3.528 3.475 3.553 . 0 0 "[ . 1 . 2]" 1
1959 1 75 LEU HB2 1 89 ILE MD . . 4.060 2.125 2.071 2.633 . 0 0 "[ . 1 . 2]" 1
1960 1 75 LEU HB3 1 76 ASN H . . 5.500 4.290 4.236 4.323 . 0 0 "[ . 1 . 2]" 1
1961 1 75 LEU HB3 1 87 LEU HB2 . . 5.310 4.321 4.161 4.497 . 0 0 "[ . 1 . 2]" 1
1962 1 75 LEU HB3 1 87 LEU HB3 . . 5.310 4.439 4.174 4.656 . 0 0 "[ . 1 . 2]" 1
1963 1 75 LEU HB3 1 87 LEU QB . . 4.710 3.899 3.713 4.052 . 0 0 "[ . 1 . 2]" 1
1964 1 75 LEU HB3 1 87 LEU QD . . 3.900 2.789 2.538 2.930 . 0 0 "[ . 1 . 2]" 1
1965 1 75 LEU HB3 1 89 ILE MD . . 4.040 2.441 2.296 2.690 . 0 0 "[ . 1 . 2]" 1
1966 1 75 LEU MD1 1 76 ASN H . . 5.690 5.172 5.129 5.209 . 0 0 "[ . 1 . 2]" 1
1967 1 75 LEU MD1 1 89 ILE MD . . 4.510 3.064 2.971 3.703 . 0 0 "[ . 1 . 2]" 1
1968 1 75 LEU MD1 1 89 ILE MG . . 5.420 4.695 4.566 4.786 . 0 0 "[ . 1 . 2]" 1
1969 1 75 LEU MD2 1 76 ASN H . . 5.500 4.852 4.807 4.889 . 0 0 "[ . 1 . 2]" 1
1970 1 75 LEU MD2 1 78 ALA H . . 5.700 5.121 4.977 5.259 . 0 0 "[ . 1 . 2]" 1
1971 1 75 LEU MD2 1 78 ALA MB . . 4.110 2.923 2.806 3.063 . 0 0 "[ . 1 . 2]" 1
1972 1 75 LEU MD2 1 79 ASP H . . 5.750 5.259 4.978 5.547 . 0 0 "[ . 1 . 2]" 1
1973 1 75 LEU MD2 1 87 LEU QD . . 3.610 3.088 2.717 3.293 . 0 0 "[ . 1 . 2]" 1
1974 1 76 ASN H 1 76 ASN QB . . 3.480 2.269 2.257 2.284 . 0 0 "[ . 1 . 2]" 1
1975 1 76 ASN H 1 77 GLY H . . 5.000 4.605 4.598 4.615 . 0 0 "[ . 1 . 2]" 1
1976 1 76 ASN H 1 78 ALA H . . 5.470 4.335 4.241 4.391 . 0 0 "[ . 1 . 2]" 1
1977 1 76 ASN H 1 89 ILE MD . . 4.320 3.025 2.893 3.207 . 0 0 "[ . 1 . 2]" 1
1978 1 76 ASN HA 1 77 GLY H . . 3.690 2.207 2.189 2.217 . 0 0 "[ . 1 . 2]" 1
1979 1 76 ASN HA 1 77 GLY QA . . 5.440 3.976 3.963 3.986 . 0 0 "[ . 1 . 2]" 1
1980 1 76 ASN HA 1 78 ALA H . . 4.950 3.296 3.254 3.335 . 0 0 "[ . 1 . 2]" 1
1981 1 76 ASN HA 1 87 LEU QB . . 5.310 3.489 3.358 3.652 . 0 0 "[ . 1 . 2]" 1
1982 1 76 ASN HA 1 88 LYS HA . . 5.460 3.331 3.048 3.532 . 0 0 "[ . 1 . 2]" 1
1983 1 76 ASN HA 1 89 ILE H . . 4.720 3.323 3.145 3.530 . 0 0 "[ . 1 . 2]" 1
1984 1 76 ASN HA 1 89 ILE HB . . 5.210 3.360 3.175 3.714 . 0 0 "[ . 1 . 2]" 1
1985 1 76 ASN HA 1 89 ILE HG12 . . 5.470 4.465 4.186 4.784 . 0 0 "[ . 1 . 2]" 1
1986 1 76 ASN HA 1 89 ILE HG13 . . 5.470 2.863 2.496 4.829 . 0 0 "[ . 1 . 2]" 1
1987 1 76 ASN HA 1 89 ILE MD . . 4.210 2.759 2.152 2.891 . 0 0 "[ . 1 . 2]" 1
1988 1 76 ASN HA 1 89 ILE MG . . 5.580 4.712 4.511 5.111 . 0 0 "[ . 1 . 2]" 1
1989 1 76 ASN HB2 1 77 GLY H . . 5.270 4.295 4.275 4.321 . 0 0 "[ . 1 . 2]" 1
1990 1 76 ASN HB2 1 89 ILE MD . . 5.250 2.909 2.789 3.086 . 0 0 "[ . 1 . 2]" 1
1991 1 76 ASN HB3 1 77 GLY H . . 5.270 4.152 4.114 4.187 . 0 0 "[ . 1 . 2]" 1
1992 1 76 ASN HB3 1 89 ILE MD . . 5.250 4.201 4.115 4.294 . 0 0 "[ . 1 . 2]" 1
1993 1 76 ASN QB 1 77 GLY H . . 4.850 3.759 3.734 3.782 . 0 0 "[ . 1 . 2]" 1
1994 1 76 ASN QB 1 89 ILE H . . 5.240 3.507 3.415 3.571 . 0 0 "[ . 1 . 2]" 1
1995 1 76 ASN QB 1 89 ILE HB . . 5.100 2.533 2.388 3.134 . 0 0 "[ . 1 . 2]" 1
1996 1 76 ASN QB 1 89 ILE MD . . 4.760 2.859 2.746 3.013 . 0 0 "[ . 1 . 2]" 1
1997 1 76 ASN QD 1 88 LYS HA . . 5.320 4.358 4.234 4.488 . 0 0 "[ . 1 . 2]" 1
1998 1 76 ASN QD 1 88 LYS HG2 . . 5.580 4.150 3.828 4.888 . 0 0 "[ . 1 . 2]" 1
1999 1 76 ASN QD 1 89 ILE H . . 5.260 3.449 3.272 3.893 . 0 0 "[ . 1 . 2]" 1
2000 1 77 GLY H 1 78 ALA H . . 3.990 2.647 2.621 2.686 . 0 0 "[ . 1 . 2]" 1
2001 1 77 GLY H 1 78 ALA HA . . 5.750 5.291 5.273 5.324 . 0 0 "[ . 1 . 2]" 1
2002 1 77 GLY H 1 78 ALA MB . . 5.080 4.346 4.314 4.380 . 0 0 "[ . 1 . 2]" 1
2003 1 77 GLY H 1 86 THR MG . . 5.120 4.098 3.833 4.349 . 0 0 "[ . 1 . 2]" 1
2004 1 77 GLY H 1 87 LEU HG . . 5.750 5.641 5.463 5.771 0.021 10 0 "[ . 1 . 2]" 1
2005 1 77 GLY H 1 87 LEU QB . . 4.600 3.288 3.162 3.416 . 0 0 "[ . 1 . 2]" 1
2006 1 77 GLY H 1 88 LYS H . . 5.320 4.489 4.416 4.578 . 0 0 "[ . 1 . 2]" 1
2007 1 77 GLY H 1 88 LYS HA . . 4.740 2.712 2.590 2.875 . 0 0 "[ . 1 . 2]" 1
2008 1 77 GLY H 1 89 ILE H . . 5.100 3.997 3.666 4.246 . 0 0 "[ . 1 . 2]" 1
2009 1 77 GLY H 1 89 ILE MD . . 4.660 4.512 3.432 4.651 . 0 0 "[ . 1 . 2]" 1
2010 1 77 GLY H 1 89 ILE QG . . 5.660 4.176 3.790 5.668 0.008 11 0 "[ . 1 . 2]" 1
2011 1 77 GLY HA2 1 78 ALA HA . . 5.470 4.773 4.752 4.789 . 0 0 "[ . 1 . 2]" 1
2012 1 77 GLY HA2 1 86 THR MG . . 4.720 2.827 2.543 3.208 . 0 0 "[ . 1 . 2]" 1
2013 1 77 GLY HA3 1 78 ALA HA . . 5.470 4.541 4.529 4.552 . 0 0 "[ . 1 . 2]" 1
2014 1 77 GLY HA3 1 86 THR MG . . 4.720 4.086 3.813 4.476 . 0 0 "[ . 1 . 2]" 1
2015 1 77 GLY QA 1 78 ALA H . . 3.980 2.968 2.958 2.976 . 0 0 "[ . 1 . 2]" 1
2016 1 77 GLY QA 1 78 ALA HA . . 5.020 4.140 4.126 4.148 . 0 0 "[ . 1 . 2]" 1
2017 1 77 GLY QA 1 78 ALA MB . . 5.240 4.269 4.252 4.282 . 0 0 "[ . 1 . 2]" 1
2018 1 78 ALA H 1 78 ALA MB . . 3.460 2.226 2.217 2.240 . 0 0 "[ . 1 . 2]" 1
2019 1 78 ALA H 1 86 THR MG . . 4.750 4.155 3.969 4.384 . 0 0 "[ . 1 . 2]" 1
2020 1 78 ALA H 1 87 LEU H . . 4.740 3.621 3.508 3.732 . 0 0 "[ . 1 . 2]" 1
2021 1 78 ALA H 1 87 LEU HG . . 5.110 4.425 4.226 4.659 . 0 0 "[ . 1 . 2]" 1
2022 1 78 ALA H 1 87 LEU QB . . 4.310 2.696 2.558 2.852 . 0 0 "[ . 1 . 2]" 1
2023 1 78 ALA H 1 87 LEU MD1 . . 5.750 3.786 3.665 3.941 . 0 0 "[ . 1 . 2]" 1
2024 1 78 ALA H 1 87 LEU MD2 . . 5.750 5.377 5.262 5.539 . 0 0 "[ . 1 . 2]" 1
2025 1 78 ALA H 1 87 LEU QD . . 4.800 3.714 3.600 3.857 . 0 0 "[ . 1 . 2]" 1
2026 1 78 ALA H 1 89 ILE MD . . 5.060 4.681 3.960 4.816 . 0 0 "[ . 1 . 2]" 1
2027 1 78 ALA HA 1 79 ASP H . . 4.630 2.542 2.501 2.586 . 0 0 "[ . 1 . 2]" 1
2028 1 78 ALA HA 1 79 ASP HA . . 5.430 4.559 4.530 4.590 . 0 0 "[ . 1 . 2]" 1
2029 1 78 ALA HA 1 79 ASP QB . . 5.310 4.169 3.755 4.439 . 0 0 "[ . 1 . 2]" 1
2030 1 78 ALA HA 1 86 THR MG . . 5.280 4.330 4.155 4.546 . 0 0 "[ . 1 . 2]" 1
2031 1 78 ALA HA 1 87 LEU H . . 5.750 4.676 4.640 4.719 . 0 0 "[ . 1 . 2]" 1
2032 1 78 ALA MB 1 79 ASP H . . 3.890 2.147 2.069 2.228 . 0 0 "[ . 1 . 2]" 1
2033 1 78 ALA MB 1 79 ASP HA . . 5.520 3.960 3.895 4.024 . 0 0 "[ . 1 . 2]" 1
2034 1 78 ALA MB 1 79 ASP QB . . 5.620 4.331 4.104 4.458 . 0 0 "[ . 1 . 2]" 1
2035 1 78 ALA MB 1 80 ILE H . . 5.310 5.268 5.106 5.349 0.039 7 0 "[ . 1 . 2]" 1
2036 1 78 ALA MB 1 80 ILE MG . . 5.750 5.824 5.801 5.840 0.090 18 0 "[ . 1 . 2]" 1
2037 1 78 ALA MB 1 86 THR HA . . 5.370 5.062 4.914 5.157 . 0 0 "[ . 1 . 2]" 1
2038 1 78 ALA MB 1 86 THR MG . . 5.130 4.623 4.535 4.797 . 0 0 "[ . 1 . 2]" 1
2039 1 78 ALA MB 1 87 LEU H . . 5.030 3.944 3.808 4.039 . 0 0 "[ . 1 . 2]" 1
2040 1 78 ALA MB 1 87 LEU HA . . 5.510 5.472 5.282 5.544 0.034 17 0 "[ . 1 . 2]" 1
2041 1 78 ALA MB 1 87 LEU HG . . 4.830 3.463 3.309 3.597 . 0 0 "[ . 1 . 2]" 1
2042 1 78 ALA MB 1 87 LEU QB . . 5.170 2.866 2.649 2.969 . 0 0 "[ . 1 . 2]" 1
2043 1 78 ALA MB 1 87 LEU QD . . 3.970 2.262 2.135 2.372 . 0 0 "[ . 1 . 2]" 1
2044 1 78 ALA MB 1 89 ILE MD . . 5.110 4.273 3.877 4.395 . 0 0 "[ . 1 . 2]" 1
2045 1 79 ASP H 1 80 ILE H . . 4.980 4.415 4.391 4.432 . 0 0 "[ . 1 . 2]" 1
2046 1 79 ASP H 1 80 ILE HG13 . . 5.750 4.883 4.629 5.160 . 0 0 "[ . 1 . 2]" 1
2047 1 79 ASP H 1 81 TYR H . . 5.750 5.590 5.397 5.715 . 0 0 "[ . 1 . 2]" 1
2048 1 79 ASP H 1 86 THR MG . . 5.650 4.895 4.771 5.128 . 0 0 "[ . 1 . 2]" 1
2049 1 79 ASP H 1 87 LEU H . . 5.550 4.850 4.696 4.991 . 0 0 "[ . 1 . 2]" 1
2050 1 79 ASP H 1 87 LEU HG . . 5.750 4.585 4.531 4.651 . 0 0 "[ . 1 . 2]" 1
2051 1 79 ASP H 1 87 LEU MD1 . . 5.750 4.369 4.289 4.501 . 0 0 "[ . 1 . 2]" 1
2052 1 79 ASP H 1 87 LEU MD2 . . 5.750 5.812 5.771 5.856 0.106 4 0 "[ . 1 . 2]" 1
2053 1 79 ASP H 1 87 LEU QD . . 5.090 4.250 4.180 4.359 . 0 0 "[ . 1 . 2]" 1
2054 1 79 ASP HA 1 80 ILE H . . 3.840 2.351 2.277 2.430 . 0 0 "[ . 1 . 2]" 1
2055 1 79 ASP HA 1 80 ILE HB . . 5.430 4.611 4.542 4.663 . 0 0 "[ . 1 . 2]" 1
2056 1 79 ASP HA 1 80 ILE HG13 . . 5.250 3.305 3.131 3.536 . 0 0 "[ . 1 . 2]" 1
2057 1 79 ASP HA 1 81 TYR H . . 5.000 4.039 3.868 4.225 . 0 0 "[ . 1 . 2]" 1
2058 1 79 ASP HA 1 86 THR HB . . 5.750 5.593 5.221 5.766 0.016 18 0 "[ . 1 . 2]" 1
2059 1 79 ASP HA 1 86 THR MG . . 5.000 3.899 3.724 4.051 . 0 0 "[ . 1 . 2]" 1
2060 1 79 ASP HA 1 87 LEU HG . . 5.440 3.098 2.876 3.407 . 0 0 "[ . 1 . 2]" 1
2061 1 79 ASP QB 1 80 ILE H . . 4.820 2.862 2.450 3.594 . 0 0 "[ . 1 . 2]" 1
2062 1 79 ASP QB 1 81 TYR H . . 5.290 3.128 2.699 4.002 . 0 0 "[ . 1 . 2]" 1
2063 1 79 ASP QB 1 83 GLY H . . 4.890 2.983 2.253 3.990 . 0 0 "[ . 1 . 2]" 1
2064 1 80 ILE H 1 80 ILE HB . . 4.150 2.553 2.436 2.651 . 0 0 "[ . 1 . 2]" 1
2065 1 80 ILE H 1 80 ILE HG12 . . 4.410 3.702 3.588 3.782 . 0 0 "[ . 1 . 2]" 1
2066 1 80 ILE H 1 80 ILE HG13 . . 4.110 2.562 2.395 2.707 . 0 0 "[ . 1 . 2]" 1
2067 1 80 ILE H 1 80 ILE MD . . 5.220 3.889 3.733 4.036 . 0 0 "[ . 1 . 2]" 1
2068 1 80 ILE H 1 80 ILE MG . . 4.640 3.839 3.779 3.881 . 0 0 "[ . 1 . 2]" 1
2069 1 80 ILE H 1 81 TYR H . . 4.970 2.102 1.963 2.301 . 0 0 "[ . 1 . 2]" 1
2070 1 80 ILE H 1 81 TYR HA . . 6.000 4.857 4.744 5.036 . 0 0 "[ . 1 . 2]" 1
2071 1 80 ILE H 1 81 TYR QB . . 6.000 4.215 4.059 4.478 . 0 0 "[ . 1 . 2]" 1
2072 1 80 ILE H 1 81 TYR QD . . 6.000 3.846 3.492 4.208 . 0 0 "[ . 1 . 2]" 1
2073 1 80 ILE H 1 85 CYS HB2 . . 5.210 3.302 2.791 3.716 . 0 0 "[ . 1 . 2]" 1
2074 1 80 ILE H 1 85 CYS HB3 . . 5.210 4.191 3.866 4.483 . 0 0 "[ . 1 . 2]" 1
2075 1 80 ILE H 1 85 CYS QB . . 4.630 3.182 2.743 3.545 . 0 0 "[ . 1 . 2]" 1
2076 1 80 ILE H 1 86 THR HA . . 4.930 4.292 3.969 4.418 . 0 0 "[ . 1 . 2]" 1
2077 1 80 ILE H 1 86 THR MG . . 5.740 5.720 5.515 5.807 0.067 18 0 "[ . 1 . 2]" 1
2078 1 80 ILE H 1 87 LEU H . . 5.330 5.402 5.345 5.467 0.137 8 0 "[ . 1 . 2]" 1
2079 1 80 ILE HA 1 80 ILE HG12 . . 4.340 2.488 2.405 2.542 . 0 0 "[ . 1 . 2]" 1
2080 1 80 ILE HA 1 87 LEU MD1 . . 5.710 4.624 4.136 4.941 . 0 0 "[ . 1 . 2]" 1
2081 1 80 ILE HA 1 87 LEU MD2 . . 5.710 5.467 5.125 5.678 . 0 0 "[ . 1 . 2]" 1
2082 1 80 ILE HA 1 87 LEU QD . . 5.010 4.389 3.971 4.653 . 0 0 "[ . 1 . 2]" 1
2083 1 80 ILE HB 1 81 TYR H . . 5.190 3.253 3.162 3.350 . 0 0 "[ . 1 . 2]" 1
2084 1 80 ILE HB 1 81 TYR QD . . 4.590 2.980 2.673 3.491 . 0 0 "[ . 1 . 2]" 1
2085 1 80 ILE HB 1 85 CYS HB2 . . 4.630 3.332 2.273 3.834 . 0 0 "[ . 1 . 2]" 1
2086 1 80 ILE HB 1 85 CYS HB3 . . 4.630 3.639 3.154 4.025 . 0 0 "[ . 1 . 2]" 1
2087 1 80 ILE HB 1 85 CYS QB . . 4.210 3.070 2.224 3.493 . 0 0 "[ . 1 . 2]" 1
2088 1 80 ILE HG12 1 81 TYR H . . 5.750 5.126 5.101 5.163 . 0 0 "[ . 1 . 2]" 1
2089 1 80 ILE HG13 1 85 CYS QB . . 5.100 3.873 3.165 4.253 . 0 0 "[ . 1 . 2]" 1
2090 1 80 ILE HG13 1 87 LEU QD . . 4.120 2.390 2.185 2.554 . 0 0 "[ . 1 . 2]" 1
2091 1 80 ILE MD 1 81 TYR QD . . 5.170 4.450 4.230 4.850 . 0 0 "[ . 1 . 2]" 1
2092 1 80 ILE MD 1 85 CYS QB . . 4.990 3.311 2.594 3.789 . 0 0 "[ . 1 . 2]" 1
2093 1 80 ILE MD 1 80 ILE MG . . 3.600 1.941 1.928 1.950 . 0 0 "[ . 1 . 2]" 1
2094 1 80 ILE MG 1 81 TYR H . . 4.840 3.943 3.809 4.039 . 0 0 "[ . 1 . 2]" 1
2095 1 80 ILE MG 1 81 TYR QD . . 4.290 3.531 3.342 3.714 . 0 0 "[ . 1 . 2]" 1
2096 1 80 ILE MG 1 81 TYR QE . . 4.170 3.225 2.927 3.466 . 0 0 "[ . 1 . 2]" 1
2097 1 80 ILE MG 1 85 CYS QB . . 5.070 4.281 3.658 4.675 . 0 0 "[ . 1 . 2]" 1
2098 1 80 ILE MG 1 87 LEU QD . . 5.130 3.954 3.852 4.037 . 0 0 "[ . 1 . 2]" 1
2099 1 81 TYR H 1 81 TYR QE . . 5.720 5.069 4.926 5.268 . 0 0 "[ . 1 . 2]" 1
2100 1 81 TYR H 1 82 SER H . . 5.750 2.662 2.375 3.544 . 0 0 "[ . 1 . 2]" 1
2101 1 81 TYR H 1 83 GLY H . . 5.580 2.929 2.714 3.488 . 0 0 "[ . 1 . 2]" 1
2102 1 81 TYR H 1 84 CYS H . . 6.000 5.606 2.992 6.119 0.119 14 0 "[ . 1 . 2]" 1
2103 1 81 TYR H 1 85 CYS HB2 . . 5.190 3.690 3.260 3.922 . 0 0 "[ . 1 . 2]" 1
2104 1 81 TYR H 1 85 CYS HB3 . . 5.190 5.127 4.961 5.254 0.064 12 0 "[ . 1 . 2]" 1
2105 1 81 TYR H 1 85 CYS QB . . 4.620 3.610 3.219 3.818 . 0 0 "[ . 1 . 2]" 1
2106 1 81 TYR HA 1 81 TYR QD . . 4.010 2.657 2.395 2.899 . 0 0 "[ . 1 . 2]" 1
2107 1 81 TYR HB2 1 82 SER H . . 5.490 4.207 4.065 4.524 . 0 0 "[ . 1 . 2]" 1
2108 1 81 TYR HB2 1 84 CYS H . . 6.000 5.434 3.404 5.877 . 0 0 "[ . 1 . 2]" 1
2109 1 81 TYR HB2 1 85 CYS QB . . 5.480 3.638 3.443 4.172 . 0 0 "[ . 1 . 2]" 1
2110 1 81 TYR HB3 1 82 SER H . . 5.590 4.456 4.183 4.538 . 0 0 "[ . 1 . 2]" 1
2111 1 81 TYR QD 1 82 SER H . . 5.750 4.906 4.675 4.979 . 0 0 "[ . 1 . 2]" 1
2112 1 81 TYR QD 1 85 CYS H . . 5.750 5.159 4.502 5.480 . 0 0 "[ . 1 . 2]" 1
2113 1 81 TYR QD 1 85 CYS HB2 . . 4.610 2.317 2.231 2.607 . 0 0 "[ . 1 . 2]" 1
2114 1 81 TYR QD 1 85 CYS HB3 . . 4.610 3.432 3.196 3.921 . 0 0 "[ . 1 . 2]" 1
2115 1 81 TYR QD 1 85 CYS QB . . 4.200 2.282 2.191 2.571 . 0 0 "[ . 1 . 2]" 1
2116 1 81 TYR QE 1 85 CYS QB . . 5.140 3.323 3.104 3.491 . 0 0 "[ . 1 . 2]" 1
2117 1 83 GLY H 1 84 CYS H . . 5.550 3.877 2.460 4.247 . 0 0 "[ . 1 . 2]" 1
2118 1 83 GLY QA 1 84 CYS H . . 3.950 2.313 2.144 2.979 . 0 0 "[ . 1 . 2]" 1
2119 1 84 CYS H 1 85 CYS H . . 5.170 4.631 4.546 4.659 . 0 0 "[ . 1 . 2]" 1
2120 1 84 CYS HA 1 85 CYS H . . 4.020 2.647 2.457 2.723 . 0 0 "[ . 1 . 2]" 1
2121 1 84 CYS HA 1 85 CYS HA . . 5.430 4.563 4.437 4.627 . 0 0 "[ . 1 . 2]" 1
2122 1 84 CYS HA 1 86 THR H . . 5.060 3.161 3.056 3.348 . 0 0 "[ . 1 . 2]" 1
2123 1 84 CYS HB2 1 85 CYS H . . 4.690 3.150 2.122 3.554 . 0 0 "[ . 1 . 2]" 1
2124 1 84 CYS HB3 1 85 CYS H . . 4.690 2.266 1.966 3.674 . 0 0 "[ . 1 . 2]" 1
2125 1 84 CYS QB 1 85 CYS H . . 3.960 2.090 1.947 2.420 . 0 0 "[ . 1 . 2]" 1
2126 1 85 CYS H 1 86 THR H . . 4.250 2.828 2.786 2.902 . 0 0 "[ . 1 . 2]" 1
2127 1 85 CYS H 1 86 THR HA . . 5.590 5.289 5.212 5.329 . 0 0 "[ . 1 . 2]" 1
2128 1 85 CYS HA 1 86 THR H . . 3.850 2.861 2.739 2.921 . 0 0 "[ . 1 . 2]" 1
2129 1 85 CYS HB2 1 86 THR H . . 5.250 4.282 4.219 4.389 . 0 0 "[ . 1 . 2]" 1
2130 1 85 CYS HB3 1 86 THR H . . 5.250 4.524 4.495 4.535 . 0 0 "[ . 1 . 2]" 1
2131 1 85 CYS QB 1 86 THR H . . 4.800 3.912 3.879 3.959 . 0 0 "[ . 1 . 2]" 1
2132 1 86 THR H 1 86 THR HB . . 3.770 2.622 2.586 2.673 . 0 0 "[ . 1 . 2]" 1
2133 1 86 THR H 1 86 THR MG . . 4.640 3.720 3.701 3.734 . 0 0 "[ . 1 . 2]" 1
2134 1 86 THR H 1 87 LEU H . . 5.340 4.644 4.626 4.660 . 0 0 "[ . 1 . 2]" 1
2135 1 86 THR HA 1 87 LEU H . . 3.740 2.224 2.200 2.250 . 0 0 "[ . 1 . 2]" 1
2136 1 86 THR HA 1 87 LEU HG . . 5.030 3.479 3.390 3.570 . 0 0 "[ . 1 . 2]" 1
2137 1 86 THR HB 1 87 LEU H . . 4.880 3.946 3.904 3.982 . 0 0 "[ . 1 . 2]" 1
2138 1 86 THR MG 1 87 LEU H . . 4.140 2.406 2.328 2.481 . 0 0 "[ . 1 . 2]" 1
2139 1 86 THR MG 1 87 LEU QB . . 5.170 4.045 3.989 4.185 . 0 0 "[ . 1 . 2]" 1
2140 1 86 THR MG 1 88 LYS HB2 . . 5.110 4.533 4.377 4.764 . 0 0 "[ . 1 . 2]" 1
2141 1 87 LEU H 1 87 LEU HG . . 4.580 2.438 2.339 2.573 . 0 0 "[ . 1 . 2]" 1
2142 1 87 LEU H 1 87 LEU MD1 . . 5.010 3.793 3.713 3.850 . 0 0 "[ . 1 . 2]" 1
2143 1 87 LEU H 1 87 LEU MD2 . . 5.010 3.351 3.299 3.486 . 0 0 "[ . 1 . 2]" 1
2144 1 87 LEU H 1 87 LEU QD . . 4.550 3.140 3.093 3.240 . 0 0 "[ . 1 . 2]" 1
2145 1 87 LEU HA 1 87 LEU QD . . 3.980 2.058 2.033 2.090 . 0 0 "[ . 1 . 2]" 1
2146 1 87 LEU HA 1 88 LYS H . . 3.650 2.244 2.217 2.254 . 0 0 "[ . 1 . 2]" 1
2147 1 87 LEU HA 1 88 LYS HB2 . . 5.390 4.400 4.220 4.540 . 0 0 "[ . 1 . 2]" 1
2148 1 87 LEU HB2 1 88 LYS H . . 5.330 3.758 3.713 3.792 . 0 0 "[ . 1 . 2]" 1
2149 1 87 LEU HB2 1 89 ILE MD . . 4.970 3.971 3.034 4.188 . 0 0 "[ . 1 . 2]" 1
2150 1 87 LEU HB3 1 88 LYS H . . 5.330 2.687 2.631 2.762 . 0 0 "[ . 1 . 2]" 1
2151 1 87 LEU HB3 1 89 ILE MD . . 4.970 3.451 2.413 3.700 . 0 0 "[ . 1 . 2]" 1
2152 1 87 LEU QB 1 88 LYS H . . 4.920 2.631 2.579 2.699 . 0 0 "[ . 1 . 2]" 1
2153 1 87 LEU QB 1 89 ILE QG . . 5.200 3.058 2.904 3.714 . 0 0 "[ . 1 . 2]" 1
2154 1 87 LEU QD 1 88 LYS H . . 4.990 3.435 3.400 3.517 . 0 0 "[ . 1 . 2]" 1
2155 1 87 LEU QD 1 89 ILE MD . . 4.220 3.203 2.904 3.371 . 0 0 "[ . 1 . 2]" 1
2156 1 88 LYS H 1 88 LYS HB2 . . 4.200 3.233 3.089 3.306 . 0 0 "[ . 1 . 2]" 1
2157 1 88 LYS H 1 88 LYS HB3 . . 4.120 2.824 2.732 2.887 . 0 0 "[ . 1 . 2]" 1
2158 1 88 LYS H 1 88 LYS HG2 . . 5.250 4.654 4.381 4.766 . 0 0 "[ . 1 . 2]" 1
2159 1 88 LYS H 1 89 ILE H . . 5.100 4.248 4.150 4.321 . 0 0 "[ . 1 . 2]" 1
2160 1 88 LYS H 1 89 ILE QG . . 5.490 3.425 3.287 3.931 . 0 0 "[ . 1 . 2]" 1
2161 1 88 LYS HA 1 88 LYS QE . . 5.430 4.572 4.243 4.908 . 0 0 "[ . 1 . 2]" 1
2162 1 88 LYS HA 1 89 ILE H . . 3.560 2.246 2.230 2.277 . 0 0 "[ . 1 . 2]" 1
2163 1 88 LYS HA 1 89 ILE HB . . 5.280 4.503 4.428 4.626 . 0 0 "[ . 1 . 2]" 1
2164 1 88 LYS HB2 1 89 ILE H . . 5.340 4.321 4.217 4.492 . 0 0 "[ . 1 . 2]" 1
2165 1 88 LYS HB3 1 89 ILE H . . 5.150 4.194 4.115 4.253 . 0 0 "[ . 1 . 2]" 1
2166 1 88 LYS HB3 1 89 ILE HA . . 5.610 4.828 4.736 4.923 . 0 0 "[ . 1 . 2]" 1
2167 1 88 LYS HG2 1 89 ILE H . . 5.310 2.956 2.658 3.593 . 0 0 "[ . 1 . 2]" 1
2168 1 88 LYS HG3 1 89 ILE H . . 5.750 4.291 3.012 4.834 . 0 0 "[ . 1 . 2]" 1
2169 1 88 LYS QD 1 89 ILE H . . 5.580 3.036 2.327 4.624 . 0 0 "[ . 1 . 2]" 1
2170 1 88 LYS QD 1 89 ILE HA . . 5.350 3.619 3.081 5.398 0.048 7 0 "[ . 1 . 2]" 1
2171 1 88 LYS QD 1 90 GLU QG . . 4.720 3.780 3.452 4.770 0.050 9 0 "[ . 1 . 2]" 1
2172 1 88 LYS QE 1 90 GLU QG . . 4.850 4.074 3.262 4.860 0.010 1 0 "[ . 1 . 2]" 1
2173 1 89 ILE H 1 89 ILE HB . . 3.980 2.672 2.619 2.760 . 0 0 "[ . 1 . 2]" 1
2174 1 89 ILE H 1 89 ILE HG12 . . 4.980 4.063 3.893 4.555 . 0 0 "[ . 1 . 2]" 1
2175 1 89 ILE H 1 89 ILE HG13 . . 4.980 2.941 2.736 3.832 . 0 0 "[ . 1 . 2]" 1
2176 1 89 ILE H 1 89 ILE MD . . 4.490 3.956 2.583 4.133 . 0 0 "[ . 1 . 2]" 1
2177 1 89 ILE H 1 89 ILE QG . . 4.320 2.874 2.684 3.643 . 0 0 "[ . 1 . 2]" 1
2178 1 89 ILE H 1 89 ILE MG . . 4.760 3.883 3.862 3.916 . 0 0 "[ . 1 . 2]" 1
2179 1 89 ILE H 1 90 GLU H . . 5.330 4.444 4.384 4.474 . 0 0 "[ . 1 . 2]" 1
2180 1 89 ILE HA 1 90 GLU H . . 3.620 2.182 2.145 2.206 . 0 0 "[ . 1 . 2]" 1
2181 1 89 ILE HB 1 90 GLU H . . 5.430 3.966 3.925 4.057 . 0 0 "[ . 1 . 2]" 1
2182 1 89 ILE QG 1 90 GLU H . . 5.030 3.959 3.890 4.044 . 0 0 "[ . 1 . 2]" 1
2183 1 89 ILE MG 1 90 GLU H . . 4.030 2.248 2.158 2.369 . 0 0 "[ . 1 . 2]" 1
2184 1 89 ILE MG 1 90 GLU HA . . 4.700 3.176 3.103 3.301 . 0 0 "[ . 1 . 2]" 1
2185 1 90 GLU H 1 90 GLU HG2 . . 4.510 2.518 2.437 2.572 . 0 0 "[ . 1 . 2]" 1
2186 1 90 GLU H 1 90 GLU HG3 . . 4.510 3.284 3.183 3.337 . 0 0 "[ . 1 . 2]" 1
2187 1 90 GLU H 1 90 GLU QG . . 4.030 2.441 2.378 2.487 . 0 0 "[ . 1 . 2]" 1
2188 1 90 GLU HA 1 91 TYR H . . 4.070 2.546 2.496 2.587 . 0 0 "[ . 1 . 2]" 1
2189 1 90 GLU HA 1 91 TYR QD . . 5.200 3.831 3.632 4.234 . 0 0 "[ . 1 . 2]" 1
2190 1 90 GLU HB2 1 91 TYR H . . 5.470 2.428 2.366 2.515 . 0 0 "[ . 1 . 2]" 1
2191 1 90 GLU HB2 1 91 TYR QD . . 5.750 4.337 4.198 4.500 . 0 0 "[ . 1 . 2]" 1
2192 1 90 GLU HB3 1 91 TYR H . . 5.040 3.837 3.796 3.884 . 0 0 "[ . 1 . 2]" 1
2193 1 91 TYR H 1 91 TYR QD . . 4.420 2.388 2.285 2.591 . 0 0 "[ . 1 . 2]" 1
2194 1 91 TYR H 1 91 TYR QE . . 5.140 4.412 4.300 4.501 . 0 0 "[ . 1 . 2]" 1
2195 1 91 TYR HA 1 91 TYR QD . . 3.930 2.860 2.668 2.955 . 0 0 "[ . 1 . 2]" 1
2196 1 91 TYR HA 1 92 ALA H . . 3.510 2.238 2.200 2.265 . 0 0 "[ . 1 . 2]" 1
2197 1 91 TYR HB2 1 92 ALA H . . 5.130 4.059 3.987 4.113 . 0 0 "[ . 1 . 2]" 1
2198 1 91 TYR HB3 1 92 ALA H . . 4.440 2.939 2.856 3.015 . 0 0 "[ . 1 . 2]" 1
2199 1 91 TYR HB3 1 92 ALA MB . . 5.340 4.562 4.488 4.608 . 0 0 "[ . 1 . 2]" 1
2200 1 91 TYR QD 1 92 ALA H . . 4.730 3.802 3.715 3.891 . 0 0 "[ . 1 . 2]" 1
2201 1 91 TYR QD 1 92 ALA MB . . 5.570 5.156 5.087 5.242 . 0 0 "[ . 1 . 2]" 1
2202 1 91 TYR QE 1 92 ALA H . . 6.000 5.936 5.847 6.020 0.020 8 0 "[ . 1 . 2]" 1
2203 1 92 ALA H 1 94 PRO HD2 . . 5.530 4.519 4.388 5.184 . 0 0 "[ . 1 . 2]" 1
2204 1 92 ALA H 1 97 LEU MD2 . . 5.750 5.731 5.364 5.853 0.103 9 0 "[ . 1 . 2]" 1
2205 1 92 ALA MB 1 93 LYS H . . 4.020 2.381 2.317 2.435 . 0 0 "[ . 1 . 2]" 1
2206 1 92 ALA MB 1 94 PRO HD2 . . 3.970 1.978 1.943 2.133 . 0 0 "[ . 1 . 2]" 1
2207 1 92 ALA MB 1 94 PRO HD3 . . 4.460 3.086 2.887 3.691 . 0 0 "[ . 1 . 2]" 1
2208 1 92 ALA MB 1 94 PRO HG2 . . 4.340 3.129 3.048 3.190 . 0 0 "[ . 1 . 2]" 1
2209 1 92 ALA MB 1 94 PRO QB . . 5.310 4.504 4.470 4.610 . 0 0 "[ . 1 . 2]" 1
2210 1 92 ALA MB 1 97 LEU MD2 . . 4.820 3.210 2.942 3.373 . 0 0 "[ . 1 . 2]" 1
2211 1 93 LYS H 1 93 LYS HG2 . . 5.450 2.363 1.938 4.399 . 0 0 "[ . 1 . 2]" 1
2212 1 93 LYS H 1 93 LYS HG3 . . 5.450 3.386 3.043 4.539 . 0 0 "[ . 1 . 2]" 1
2213 1 93 LYS H 1 93 LYS QG . . 4.920 2.284 1.918 3.951 . 0 0 "[ . 1 . 2]" 1
2214 1 93 LYS H 1 94 PRO HD2 . . 4.070 2.319 2.118 2.427 . 0 0 "[ . 1 . 2]" 1
2215 1 93 LYS H 1 94 PRO HD3 . . 4.250 2.582 2.389 3.045 . 0 0 "[ . 1 . 2]" 1
2216 1 93 LYS H 1 94 PRO HG2 . . 5.550 4.592 4.440 4.660 . 0 0 "[ . 1 . 2]" 1
2217 1 93 LYS H 1 94 PRO HG3 . . 5.350 4.570 4.489 4.741 . 0 0 "[ . 1 . 2]" 1
2218 1 93 LYS H 1 97 LEU MD2 . . 5.750 5.429 5.166 5.662 . 0 0 "[ . 1 . 2]" 1
2219 1 93 LYS HG2 1 94 PRO HD3 . . 5.310 2.400 2.190 3.549 . 0 0 "[ . 1 . 2]" 1
2220 1 93 LYS HG3 1 94 PRO HD3 . . 5.310 2.607 2.102 4.735 . 0 0 "[ . 1 . 2]" 1
2221 1 93 LYS QE 1 94 PRO HD3 . . 5.120 3.514 3.168 4.168 . 0 0 "[ . 1 . 2]" 1
2222 1 93 LYS QE 1 94 PRO HG3 . . 5.520 4.921 4.763 5.661 0.141 10 0 "[ . 1 . 2]" 1
2223 1 93 LYS QE 1 94 PRO QB . . 5.160 4.356 4.254 4.410 . 0 0 "[ . 1 . 2]" 1
2224 1 93 LYS QG 1 94 PRO HD2 . . 5.390 3.284 3.049 4.314 . 0 0 "[ . 1 . 2]" 1
2225 1 93 LYS QG 1 94 PRO QB . . 4.180 3.522 3.348 4.215 0.035 18 0 "[ . 1 . 2]" 1
2226 1 94 PRO HA 1 95 THR H . . 4.140 2.501 2.387 2.614 . 0 0 "[ . 1 . 2]" 1
2227 1 94 PRO HA 1 95 THR MG . . 4.760 3.500 3.443 3.536 . 0 0 "[ . 1 . 2]" 1
2228 1 94 PRO HA 1 96 ARG H . . 4.630 4.031 3.885 4.170 . 0 0 "[ . 1 . 2]" 1
2229 1 94 PRO HG2 1 97 LEU HG . . 4.900 4.082 3.806 4.606 . 0 0 "[ . 1 . 2]" 1
2230 1 94 PRO HG3 1 97 LEU HB3 . . 5.750 5.820 5.780 5.869 0.119 6 0 "[ . 1 . 2]" 1
2231 1 94 PRO QB 1 95 THR HA . . 5.590 4.410 4.283 4.537 . 0 0 "[ . 1 . 2]" 1
2232 1 95 THR H 1 95 THR MG . . 3.910 2.609 2.460 2.804 . 0 0 "[ . 1 . 2]" 1
2233 1 95 THR H 1 96 ARG H . . 3.950 2.189 2.018 2.354 . 0 0 "[ . 1 . 2]" 1
2234 1 95 THR H 1 96 ARG HA . . 5.670 4.918 4.748 5.059 . 0 0 "[ . 1 . 2]" 1
2235 1 95 THR HA 1 95 THR MG . . 3.750 2.306 2.278 2.337 . 0 0 "[ . 1 . 2]" 1
2236 1 95 THR HB 1 96 ARG HA . . 5.700 5.108 5.064 5.151 . 0 0 "[ . 1 . 2]" 1
2237 1 95 THR MG 1 96 ARG H . . 5.080 4.175 4.150 4.212 . 0 0 "[ . 1 . 2]" 1
2238 1 96 ARG H 1 96 ARG QD . . 5.540 3.840 2.864 4.667 . 0 0 "[ . 1 . 2]" 1
2239 1 96 ARG H 1 97 LEU H . . 5.080 4.338 4.215 4.395 . 0 0 "[ . 1 . 2]" 1
2240 1 96 ARG H 1 97 LEU MD2 . . 5.390 4.146 3.899 4.376 . 0 0 "[ . 1 . 2]" 1
2241 1 96 ARG HA 1 96 ARG HE . . 5.270 3.908 3.277 4.318 . 0 0 "[ . 1 . 2]" 1
2242 1 96 ARG HA 1 97 LEU H . . 3.610 2.352 2.235 2.499 . 0 0 "[ . 1 . 2]" 1
2243 1 96 ARG HA 1 97 LEU HG . . 4.340 3.622 3.423 3.829 . 0 0 "[ . 1 . 2]" 1
2244 1 96 ARG HA 1 97 LEU MD2 . . 5.410 4.319 4.134 4.450 . 0 0 "[ . 1 . 2]" 1
2245 1 96 ARG HE 1 97 LEU H . . 4.860 2.720 1.993 3.664 . 0 0 "[ . 1 . 2]" 1
2246 1 96 ARG HE 1 97 LEU HB2 . . 5.650 4.357 3.920 4.692 . 0 0 "[ . 1 . 2]" 1
2247 1 96 ARG HE 1 97 LEU MD1 . . 5.740 5.728 5.478 5.855 0.115 6 0 "[ . 1 . 2]" 1
2248 1 96 ARG QB 1 96 ARG HE . . 4.900 2.927 2.362 4.344 . 0 0 "[ . 1 . 2]" 1
2249 1 96 ARG QB 1 97 LEU H . . 4.440 2.858 2.333 3.651 . 0 0 "[ . 1 . 2]" 1
2250 1 96 ARG QB 1 97 LEU HA . . 5.260 4.368 4.006 4.709 . 0 0 "[ . 1 . 2]" 1
2251 1 96 ARG QD 1 97 LEU H . . 4.640 2.899 1.901 3.752 . 0 0 "[ . 1 . 2]" 1
2252 1 96 ARG QD 1 97 LEU HB3 . . 5.750 5.508 4.700 5.930 0.180 8 0 "[ . 1 . 2]" 1
2253 1 97 LEU H 1 97 LEU HG . . 3.630 2.782 2.360 3.017 . 0 0 "[ . 1 . 2]" 1
2254 1 97 LEU H 1 97 LEU MD1 . . 5.080 3.961 3.732 4.096 . 0 0 "[ . 1 . 2]" 1
2255 1 97 LEU H 1 97 LEU MD2 . . 4.880 3.651 3.276 3.858 . 0 0 "[ . 1 . 2]" 1
2256 1 97 LEU HA 1 97 LEU MD2 . . 4.110 2.073 2.042 2.116 . 0 0 "[ . 1 . 2]" 1
2257 1 97 LEU HB2 1 98 ASN H . . 5.360 3.449 3.269 3.550 . 0 0 "[ . 1 . 2]" 1
2258 1 97 LEU HB3 1 98 ASN H . . 4.910 2.307 2.200 2.392 . 0 0 "[ . 1 . 2]" 1
2259 1 97 LEU HB3 1 98 ASN QB . . 5.660 4.628 4.520 5.046 . 0 0 "[ . 1 . 2]" 1
2260 1 97 LEU MD1 1 98 ASN H . . 5.720 4.260 4.149 4.356 . 0 0 "[ . 1 . 2]" 1
2261 1 97 LEU MD2 1 98 ASN H . . 5.170 3.537 3.412 3.635 . 0 0 "[ . 1 . 2]" 1
2262 1 98 ASN HA 1 99 VAL H . . 3.560 2.349 2.266 2.428 . 0 0 "[ . 1 . 2]" 1
2263 1 98 ASN HA 1 99 VAL HB . . 5.390 4.388 4.168 4.577 . 0 0 "[ . 1 . 2]" 1
2264 1 98 ASN HA 1 99 VAL QG . . 5.410 3.400 2.864 3.533 . 0 0 "[ . 1 . 2]" 1
2265 1 98 ASN QB 1 100 PHE HZ . . 5.290 3.488 3.144 4.564 . 0 0 "[ . 1 . 2]" 1
2266 1 98 ASN QB 1 100 PHE QE . . 5.140 3.787 3.346 4.300 . 0 0 "[ . 1 . 2]" 1
2267 1 98 ASN QB 1 99 VAL H . . 4.600 3.283 2.358 3.507 . 0 0 "[ . 1 . 2]" 1
2268 1 98 ASN QD 1 100 PHE QE . . 4.840 2.842 2.492 3.207 . 0 0 "[ . 1 . 2]" 1
2269 1 99 VAL H 1 99 VAL HB . . 4.190 2.754 2.668 3.301 . 0 0 "[ . 1 . 2]" 1
2270 1 99 VAL HA 1 100 PHE QB . . 5.660 4.451 4.369 4.631 . 0 0 "[ . 1 . 2]" 1
2271 1 99 VAL HA 1 100 PHE QD . . 5.250 3.264 3.044 3.507 . 0 0 "[ . 1 . 2]" 1
2272 1 99 VAL HA 1 101 LYS H . . 5.050 3.977 3.887 4.135 . 0 0 "[ . 1 . 2]" 1
2273 1 99 VAL HA 1 106 THR HB . . 5.410 5.011 4.589 5.232 . 0 0 "[ . 1 . 2]" 1
2274 1 99 VAL HA 1 106 THR MG . . 5.310 4.074 3.531 4.692 . 0 0 "[ . 1 . 2]" 1
2275 1 99 VAL HB 1 108 ASP HB2 . . 5.070 2.569 2.267 4.225 . 0 0 "[ . 1 . 2]" 1
2276 1 99 VAL HB 1 108 ASP HB3 . . 5.070 3.732 2.542 4.622 . 0 0 "[ . 1 . 2]" 1
2277 1 99 VAL HB 1 108 ASP QB . . 4.570 2.408 2.248 2.908 . 0 0 "[ . 1 . 2]" 1
2278 1 99 VAL HB 1 111 ASN QB . . 5.660 5.023 4.339 5.751 0.091 12 0 "[ . 1 . 2]" 1
2279 1 99 VAL QG 1 100 PHE H . . 5.350 2.131 1.969 3.431 . 0 0 "[ . 1 . 2]" 1
2280 1 99 VAL QG 1 100 PHE QB . . 5.400 3.985 3.903 4.322 . 0 0 "[ . 1 . 2]" 1
2281 1 99 VAL QG 1 101 LYS H . . 3.610 2.166 2.002 2.597 . 0 0 "[ . 1 . 2]" 1
2282 1 99 VAL QG 1 102 ASN HA . . 5.030 3.680 3.469 3.842 . 0 0 "[ . 1 . 2]" 1
2283 1 99 VAL QG 1 102 ASN HD22 . . 5.710 4.644 4.314 5.062 . 0 0 "[ . 1 . 2]" 1
2284 1 99 VAL QG 1 103 ASP H . . 5.580 4.656 4.305 4.852 . 0 0 "[ . 1 . 2]" 1
2285 1 99 VAL QG 1 106 THR H . . 5.710 4.983 4.654 5.223 . 0 0 "[ . 1 . 2]" 1
2286 1 99 VAL QG 1 106 THR HA . . 5.640 3.866 3.413 4.442 . 0 0 "[ . 1 . 2]" 1
2287 1 99 VAL QG 1 106 THR HB . . 5.360 3.882 3.705 4.159 . 0 0 "[ . 1 . 2]" 1
2288 1 99 VAL QG 1 106 THR MG . . 4.030 2.775 2.297 3.222 . 0 0 "[ . 1 . 2]" 1
2289 1 99 VAL QG 1 107 TRP H . . 4.760 2.952 2.468 3.528 . 0 0 "[ . 1 . 2]" 1
2290 1 99 VAL QG 1 107 TRP HA . . 4.560 2.874 2.638 3.164 . 0 0 "[ . 1 . 2]" 1
2291 1 99 VAL QG 1 108 ASP H . . 4.330 2.918 2.654 3.246 . 0 0 "[ . 1 . 2]" 1
2292 1 99 VAL QG 1 108 ASP HA . . 4.830 2.927 2.668 3.617 . 0 0 "[ . 1 . 2]" 1
2293 1 99 VAL QG 1 108 ASP QB . . 4.060 1.945 1.820 2.050 . 0 0 "[ . 1 . 2]" 1
2294 1 99 VAL QG 1 109 TYR H . . 5.690 4.562 4.282 4.977 . 0 0 "[ . 1 . 2]" 1
2295 1 99 VAL QG 1 110 THR H . . 5.710 5.314 5.006 5.501 . 0 0 "[ . 1 . 2]" 1
2296 1 99 VAL QG 1 111 ASN QB . . 5.230 4.403 3.369 4.947 . 0 0 "[ . 1 . 2]" 1
2297 1 99 VAL QG 1 111 ASN QD . . 4.550 3.713 3.105 4.030 . 0 0 "[ . 1 . 2]" 1
2298 1 100 PHE H 1 101 LYS H . . 4.400 1.914 1.761 3.449 . 0 0 "[ . 1 . 2]" 1
2299 1 100 PHE HA 1 101 LYS HA . . 5.570 4.650 4.604 4.696 . 0 0 "[ . 1 . 2]" 1
2300 1 100 PHE HB2 1 101 LYS H . . 4.870 3.093 2.845 3.266 . 0 0 "[ . 1 . 2]" 1
2301 1 100 PHE HB2 1 101 LYS QG . . 5.750 3.136 2.370 4.382 . 0 0 "[ . 1 . 2]" 1
2302 1 100 PHE HB3 1 101 LYS H . . 5.540 4.206 4.059 4.311 . 0 0 "[ . 1 . 2]" 1
2303 1 100 PHE HB3 1 101 LYS QG . . 5.750 4.485 3.713 5.437 . 0 0 "[ . 1 . 2]" 1
2304 1 100 PHE QB 1 101 LYS H . . 4.410 3.017 2.792 3.173 . 0 0 "[ . 1 . 2]" 1
2305 1 100 PHE QB 1 101 LYS HA . . 5.460 4.554 4.471 4.629 . 0 0 "[ . 1 . 2]" 1
2306 1 100 PHE QB 1 101 LYS QB . . 5.570 3.593 3.426 3.776 . 0 0 "[ . 1 . 2]" 1
2307 1 100 PHE QB 1 101 LYS QD . . 4.930 3.312 2.059 4.153 . 0 0 "[ . 1 . 2]" 1
2308 1 100 PHE QB 1 101 LYS QE . . 4.470 3.197 2.087 3.821 . 0 0 "[ . 1 . 2]" 1
2309 1 100 PHE QB 1 101 LYS QG . . 5.230 3.067 2.344 4.208 . 0 0 "[ . 1 . 2]" 1
2310 1 100 PHE QE 1 101 LYS QE . . 5.660 5.673 5.478 5.728 0.068 1 0 "[ . 1 . 2]" 1
2311 1 101 LYS H 1 101 LYS HG2 . . 4.480 2.779 2.465 3.392 . 0 0 "[ . 1 . 2]" 1
2312 1 101 LYS H 1 101 LYS QE . . 5.360 4.370 3.453 4.673 . 0 0 "[ . 1 . 2]" 1
2313 1 101 LYS H 1 101 LYS QG . . 5.100 2.692 2.390 3.291 . 0 0 "[ . 1 . 2]" 1
2314 1 101 LYS H 1 102 ASN H . . 5.100 4.365 4.346 4.398 . 0 0 "[ . 1 . 2]" 1
2315 1 101 LYS H 1 102 ASN HA . . 5.330 4.565 4.522 4.649 . 0 0 "[ . 1 . 2]" 1
2316 1 101 LYS H 1 106 THR HB . . 5.620 5.513 5.292 5.691 0.071 13 0 "[ . 1 . 2]" 1
2317 1 101 LYS H 1 106 THR MG . . 5.120 2.947 2.613 3.242 . 0 0 "[ . 1 . 2]" 1
2318 1 101 LYS H 1 111 ASN QD . . 5.660 5.590 5.133 5.749 0.089 8 0 "[ . 1 . 2]" 1
2319 1 101 LYS HA 1 102 ASN H . . 3.790 2.519 2.482 2.597 . 0 0 "[ . 1 . 2]" 1
2320 1 101 LYS HA 1 111 ASN HD21 . . 5.750 5.475 5.053 5.824 0.074 9 0 "[ . 1 . 2]" 1
2321 1 101 LYS HA 1 111 ASN HD22 . . 5.750 5.533 4.876 5.889 0.139 10 0 "[ . 1 . 2]" 1
2322 1 101 LYS HA 1 111 ASN QD . . 5.270 4.880 4.443 5.120 . 0 0 "[ . 1 . 2]" 1
2323 1 101 LYS HB2 1 102 ASN H . . 4.950 2.342 2.237 2.436 . 0 0 "[ . 1 . 2]" 1
2324 1 101 LYS HB2 1 106 THR MG . . 5.440 4.394 4.098 4.900 . 0 0 "[ . 1 . 2]" 1
2325 1 101 LYS HB3 1 102 ASN H . . 4.950 3.748 3.666 3.826 . 0 0 "[ . 1 . 2]" 1
2326 1 101 LYS HB3 1 106 THR MG . . 5.440 4.563 4.202 5.003 . 0 0 "[ . 1 . 2]" 1
2327 1 101 LYS HG2 1 102 ASN H . . 4.580 4.266 3.190 4.674 0.094 4 0 "[ . 1 . 2]" 1
2328 1 101 LYS HG2 1 103 ASP H . . 5.530 5.003 3.703 5.622 0.092 13 0 "[ . 1 . 2]" 1
2329 1 101 LYS QB 1 102 ASN H . . 4.500 2.320 2.220 2.410 . 0 0 "[ . 1 . 2]" 1
2330 1 101 LYS QB 1 106 THR MG . . 5.030 3.983 3.695 4.408 . 0 0 "[ . 1 . 2]" 1
2331 1 101 LYS QD 1 103 ASP H . . 5.610 5.251 4.480 5.627 0.017 8 0 "[ . 1 . 2]" 1
2332 1 101 LYS QG 1 103 ASP HB2 . . 5.750 5.035 4.463 5.367 . 0 0 "[ . 1 . 2]" 1
2333 1 101 LYS QG 1 103 ASP HB3 . . 5.340 3.923 3.220 4.287 . 0 0 "[ . 1 . 2]" 1
2334 1 102 ASN H 1 102 ASN HB2 . . 3.680 2.485 2.423 2.533 . 0 0 "[ . 1 . 2]" 1
2335 1 102 ASN H 1 102 ASN HD21 . . 5.390 4.760 4.547 5.013 . 0 0 "[ . 1 . 2]" 1
2336 1 102 ASN H 1 102 ASN HD22 . . 5.750 5.281 5.100 5.499 . 0 0 "[ . 1 . 2]" 1
2337 1 102 ASN H 1 103 ASP H . . 4.910 4.166 3.928 4.340 . 0 0 "[ . 1 . 2]" 1
2338 1 102 ASN H 1 103 ASP HB3 . . 5.580 4.602 4.199 4.898 . 0 0 "[ . 1 . 2]" 1
2339 1 102 ASN H 1 106 THR MG . . 5.360 4.692 4.549 4.921 . 0 0 "[ . 1 . 2]" 1
2340 1 102 ASN H 1 107 TRP HA . . 5.440 4.993 4.913 5.081 . 0 0 "[ . 1 . 2]" 1
2341 1 102 ASN H 1 108 ASP H . . 5.750 5.743 5.484 5.883 0.133 12 0 "[ . 1 . 2]" 1
2342 1 102 ASN HA 1 103 ASP H . . 3.670 2.131 2.080 2.238 . 0 0 "[ . 1 . 2]" 1
2343 1 102 ASN HA 1 107 TRP H . . 5.320 4.753 4.672 4.816 . 0 0 "[ . 1 . 2]" 1
2344 1 102 ASN HA 1 107 TRP HA . . 4.610 2.212 2.107 2.312 . 0 0 "[ . 1 . 2]" 1
2345 1 102 ASN HA 1 107 TRP HB2 . . 5.430 3.686 3.493 3.900 . 0 0 "[ . 1 . 2]" 1
2346 1 102 ASN HA 1 107 TRP HE3 . . 5.170 3.489 3.330 3.642 . 0 0 "[ . 1 . 2]" 1
2347 1 102 ASN HA 1 108 ASP H . . 4.390 3.669 3.512 3.834 . 0 0 "[ . 1 . 2]" 1
2348 1 102 ASN HB2 1 103 ASP H . . 5.750 4.503 4.434 4.571 . 0 0 "[ . 1 . 2]" 1
2349 1 102 ASN HB2 1 103 ASP HB3 . . 5.750 5.538 5.336 5.659 . 0 0 "[ . 1 . 2]" 1
2350 1 102 ASN HB2 1 107 TRP HE1 . . 5.750 5.751 5.629 5.824 0.074 16 0 "[ . 1 . 2]" 1
2351 1 102 ASN HB2 1 107 TRP HE3 . . 5.670 4.827 4.763 4.941 . 0 0 "[ . 1 . 2]" 1
2352 1 102 ASN HB2 1 107 TRP HZ2 . . 5.500 5.058 4.962 5.148 . 0 0 "[ . 1 . 2]" 1
2353 1 102 ASN HB2 1 107 TRP HZ3 . . 5.510 4.760 4.641 4.835 . 0 0 "[ . 1 . 2]" 1
2354 1 102 ASN HB2 1 108 ASP H . . 5.440 4.897 4.699 5.175 . 0 0 "[ . 1 . 2]" 1
2355 1 102 ASN HB3 1 103 ASP H . . 4.970 3.745 3.546 4.013 . 0 0 "[ . 1 . 2]" 1
2356 1 102 ASN HB3 1 107 TRP HA . . 4.950 3.797 3.622 3.985 . 0 0 "[ . 1 . 2]" 1
2357 1 102 ASN HB3 1 107 TRP HD1 . . 5.750 5.072 4.980 5.198 . 0 0 "[ . 1 . 2]" 1
2358 1 102 ASN HB3 1 107 TRP HE1 . . 5.210 4.523 4.362 4.667 . 0 0 "[ . 1 . 2]" 1
2359 1 102 ASN HB3 1 107 TRP HE3 . . 5.350 3.254 3.153 3.458 . 0 0 "[ . 1 . 2]" 1
2360 1 102 ASN HB3 1 107 TRP HZ2 . . 5.100 3.920 3.728 4.033 . 0 0 "[ . 1 . 2]" 1
2361 1 102 ASN HB3 1 107 TRP HZ3 . . 5.120 3.490 3.389 3.602 . 0 0 "[ . 1 . 2]" 1
2362 1 102 ASN HB3 1 108 ASP H . . 5.190 4.193 3.949 4.527 . 0 0 "[ . 1 . 2]" 1
2363 1 102 ASN HD21 1 107 TRP HA . . 5.750 5.052 4.665 5.598 . 0 0 "[ . 1 . 2]" 1
2364 1 102 ASN HD21 1 107 TRP HE1 . . 5.340 3.900 3.390 4.666 . 0 0 "[ . 1 . 2]" 1
2365 1 102 ASN HD21 1 107 TRP HZ2 . . 5.270 3.726 3.366 4.360 . 0 0 "[ . 1 . 2]" 1
2366 1 102 ASN HD21 1 108 ASP H . . 5.340 4.150 3.667 4.760 . 0 0 "[ . 1 . 2]" 1
2367 1 102 ASN HD22 1 107 TRP HA . . 5.630 4.603 4.221 5.222 . 0 0 "[ . 1 . 2]" 1
2368 1 102 ASN HD22 1 107 TRP HE1 . . 4.830 3.807 3.323 4.531 . 0 0 "[ . 1 . 2]" 1
2369 1 102 ASN HD22 1 107 TRP HZ2 . . 5.460 4.808 4.544 5.333 . 0 0 "[ . 1 . 2]" 1
2370 1 102 ASN HD22 1 108 ASP H . . 4.690 3.046 2.525 3.818 . 0 0 "[ . 1 . 2]" 1
2371 1 102 ASN HD22 1 109 TYR HA . . 5.490 4.837 4.297 5.527 0.037 20 0 "[ . 1 . 2]" 1
2372 1 102 ASN HD22 1 114 LEU H . . 5.530 5.027 4.296 5.587 0.057 20 0 "[ . 1 . 2]" 1
2373 1 102 ASN HD22 1 114 LEU HA . . 5.750 4.153 2.323 5.787 0.037 15 0 "[ . 1 . 2]" 1
2374 1 102 ASN HD22 1 114 LEU QB . . 5.380 3.371 2.079 4.746 . 0 0 "[ . 1 . 2]" 1
2375 1 103 ASP H 1 104 GLN H . . 5.170 4.327 4.300 4.355 . 0 0 "[ . 1 . 2]" 1
2376 1 103 ASP H 1 104 GLN HA . . 5.660 4.912 4.824 4.992 . 0 0 "[ . 1 . 2]" 1
2377 1 103 ASP H 1 105 ASP H . . 5.120 3.845 3.711 3.965 . 0 0 "[ . 1 . 2]" 1
2378 1 103 ASP H 1 106 THR H . . 4.350 3.023 2.909 3.144 . 0 0 "[ . 1 . 2]" 1
2379 1 103 ASP H 1 106 THR HA . . 5.310 4.854 4.795 4.904 . 0 0 "[ . 1 . 2]" 1
2380 1 103 ASP H 1 107 TRP H . . 5.510 4.820 4.749 4.888 . 0 0 "[ . 1 . 2]" 1
2381 1 103 ASP H 1 107 TRP HA . . 4.500 3.312 3.147 3.426 . 0 0 "[ . 1 . 2]" 1
2382 1 103 ASP H 1 107 TRP HB2 . . 5.430 3.381 3.128 3.578 . 0 0 "[ . 1 . 2]" 1
2383 1 103 ASP H 1 107 TRP HB3 . . 5.680 5.008 4.797 5.189 . 0 0 "[ . 1 . 2]" 1
2384 1 103 ASP H 1 107 TRP HE3 . . 4.220 2.808 2.682 2.921 . 0 0 "[ . 1 . 2]" 1
2385 1 103 ASP H 1 107 TRP HZ3 . . 5.220 4.388 4.264 4.471 . 0 0 "[ . 1 . 2]" 1
2386 1 103 ASP H 1 108 ASP H . . 5.490 5.343 5.115 5.508 0.018 12 0 "[ . 1 . 2]" 1
2387 1 103 ASP HA 1 104 GLN H . . 3.950 2.758 2.716 2.820 . 0 0 "[ . 1 . 2]" 1
2388 1 103 ASP HA 1 106 THR H . . 5.470 4.837 4.776 4.896 . 0 0 "[ . 1 . 2]" 1
2389 1 103 ASP HA 1 107 TRP HE3 . . 5.230 3.131 2.958 3.339 . 0 0 "[ . 1 . 2]" 1
2390 1 103 ASP HA 1 107 TRP HZ3 . . 4.500 2.905 2.723 3.144 . 0 0 "[ . 1 . 2]" 1
2391 1 103 ASP HB2 1 104 GLN H . . 3.710 2.002 1.928 2.056 . 0 0 "[ . 1 . 2]" 1
2392 1 103 ASP HB2 1 105 ASP H . . 5.210 3.461 3.220 3.713 . 0 0 "[ . 1 . 2]" 1
2393 1 103 ASP HB2 1 107 TRP HZ3 . . 5.710 5.302 5.100 5.576 . 0 0 "[ . 1 . 2]" 1
2394 1 103 ASP HB3 1 104 GLN H . . 4.490 3.554 3.504 3.597 . 0 0 "[ . 1 . 2]" 1
2395 1 103 ASP HB3 1 104 GLN QG . . 5.380 4.798 4.727 4.864 . 0 0 "[ . 1 . 2]" 1
2396 1 104 GLN H 1 104 GLN HG2 . . 4.590 2.027 1.983 2.068 . 0 0 "[ . 1 . 2]" 1
2397 1 104 GLN H 1 104 GLN HG3 . . 4.590 3.256 3.206 3.316 . 0 0 "[ . 1 . 2]" 1
2398 1 104 GLN H 1 104 GLN QG . . 4.180 2.008 1.965 2.048 . 0 0 "[ . 1 . 2]" 1
2399 1 104 GLN H 1 105 ASP H . . 4.220 2.814 2.746 2.854 . 0 0 "[ . 1 . 2]" 1
2400 1 104 GLN H 1 105 ASP QB . . 5.390 4.662 4.235 4.796 . 0 0 "[ . 1 . 2]" 1
2401 1 104 GLN H 1 106 THR H . . 5.130 4.365 4.293 4.485 . 0 0 "[ . 1 . 2]" 1
2402 1 104 GLN H 1 107 TRP HZ3 . . 5.620 5.019 4.697 5.232 . 0 0 "[ . 1 . 2]" 1
2403 1 104 GLN HA 1 104 GLN QE . . 5.660 5.470 4.734 5.607 . 0 0 "[ . 1 . 2]" 1
2404 1 104 GLN HA 1 107 TRP HE3 . . 5.170 4.171 3.855 4.404 . 0 0 "[ . 1 . 2]" 1
2405 1 104 GLN HA 1 107 TRP HZ3 . . 5.750 5.155 4.881 5.393 . 0 0 "[ . 1 . 2]" 1
2406 1 104 GLN QG 1 105 ASP H . . 4.570 3.038 2.964 3.108 . 0 0 "[ . 1 . 2]" 1
2407 1 104 GLN QG 1 106 THR H . . 5.230 4.766 4.690 4.888 . 0 0 "[ . 1 . 2]" 1
2408 1 105 ASP H 1 105 ASP QB . . 3.920 2.470 2.274 2.541 . 0 0 "[ . 1 . 2]" 1
2409 1 105 ASP H 1 106 THR H . . 3.620 1.997 1.926 2.077 . 0 0 "[ . 1 . 2]" 1
2410 1 105 ASP H 1 106 THR HA . . 5.630 4.696 4.651 4.734 . 0 0 "[ . 1 . 2]" 1
2411 1 105 ASP H 1 106 THR MG . . 4.950 3.683 3.486 3.995 . 0 0 "[ . 1 . 2]" 1
2412 1 105 ASP HA 1 106 THR H . . 4.410 3.499 3.438 3.572 . 0 0 "[ . 1 . 2]" 1
2413 1 105 ASP HA 1 106 THR MG . . 5.400 4.772 4.620 4.959 . 0 0 "[ . 1 . 2]" 1
2414 1 105 ASP HB2 1 106 THR MG . . 4.860 3.362 3.058 4.782 . 0 0 "[ . 1 . 2]" 1
2415 1 105 ASP HB3 1 106 THR MG . . 4.860 3.924 2.962 4.363 . 0 0 "[ . 1 . 2]" 1
2416 1 105 ASP QB 1 106 THR H . . 5.180 3.048 2.818 3.212 . 0 0 "[ . 1 . 2]" 1
2417 1 105 ASP QB 1 106 THR HB . . 5.380 3.915 3.750 4.344 . 0 0 "[ . 1 . 2]" 1
2418 1 106 THR H 1 106 THR MG . . 4.220 2.513 2.434 2.559 . 0 0 "[ . 1 . 2]" 1
2419 1 106 THR H 1 107 TRP H . . 4.950 4.264 4.206 4.327 . 0 0 "[ . 1 . 2]" 1
2420 1 106 THR H 1 107 TRP HA . . 5.380 4.765 4.681 4.850 . 0 0 "[ . 1 . 2]" 1
2421 1 106 THR H 1 107 TRP HB2 . . 5.710 4.154 4.019 4.315 . 0 0 "[ . 1 . 2]" 1
2422 1 106 THR H 1 107 TRP HE3 . . 5.720 4.759 4.583 4.916 . 0 0 "[ . 1 . 2]" 1
2423 1 106 THR HA 1 107 TRP H . . 3.750 2.256 2.233 2.308 . 0 0 "[ . 1 . 2]" 1
2424 1 106 THR HA 1 107 TRP HA . . 5.190 4.484 4.468 4.505 . 0 0 "[ . 1 . 2]" 1
2425 1 106 THR HB 1 107 TRP H . . 4.930 4.116 4.028 4.298 . 0 0 "[ . 1 . 2]" 1
2426 1 106 THR MG 1 107 TRP H . . 5.000 3.929 3.705 4.108 . 0 0 "[ . 1 . 2]" 1
2427 1 107 TRP H 1 107 TRP HE3 . . 5.750 5.510 5.421 5.611 . 0 0 "[ . 1 . 2]" 1
2428 1 107 TRP H 1 108 ASP H . . 5.140 4.356 4.307 4.400 . 0 0 "[ . 1 . 2]" 1
2429 1 107 TRP HA 1 107 TRP HE3 . . 4.880 3.859 3.725 4.032 . 0 0 "[ . 1 . 2]" 1
2430 1 107 TRP HA 1 108 ASP H . . 3.890 2.267 2.240 2.315 . 0 0 "[ . 1 . 2]" 1
2431 1 107 TRP HB2 1 108 ASP H . . 4.960 4.156 4.099 4.268 . 0 0 "[ . 1 . 2]" 1
2432 1 107 TRP HB3 1 107 TRP HE1 . . 5.510 4.840 4.825 4.857 . 0 0 "[ . 1 . 2]" 1
2433 1 107 TRP HB3 1 108 ASP H . . 5.120 3.800 3.710 3.942 . 0 0 "[ . 1 . 2]" 1
2434 1 107 TRP HB3 1 109 TYR H . . 5.750 5.762 5.228 5.863 0.113 13 0 "[ . 1 . 2]" 1
2435 1 107 TRP HD1 1 109 TYR QD . . 4.250 3.250 3.095 3.333 . 0 0 "[ . 1 . 2]" 1
2436 1 107 TRP HE1 1 108 ASP H . . 5.120 4.037 3.926 4.205 . 0 0 "[ . 1 . 2]" 1
2437 1 107 TRP HE1 1 109 TYR H . . 5.580 5.297 4.763 5.550 . 0 0 "[ . 1 . 2]" 1
2438 1 107 TRP HE1 1 109 TYR HA . . 4.520 3.419 2.833 3.676 . 0 0 "[ . 1 . 2]" 1
2439 1 107 TRP HE1 1 109 TYR HB2 . . 5.750 5.593 5.183 5.813 0.063 16 0 "[ . 1 . 2]" 1
2440 1 107 TRP HE1 1 109 TYR HB3 . . 5.500 4.934 4.548 5.170 . 0 0 "[ . 1 . 2]" 1
2441 1 107 TRP HE1 1 109 TYR QD . . 4.290 3.200 2.983 3.372 . 0 0 "[ . 1 . 2]" 1
2442 1 107 TRP HE1 1 109 TYR QE . . 5.190 3.312 3.233 3.455 . 0 0 "[ . 1 . 2]" 1
2443 1 107 TRP HE3 1 108 ASP H . . 5.750 5.283 5.111 5.545 . 0 0 "[ . 1 . 2]" 1
2444 1 108 ASP H 1 109 TYR H . . 5.220 4.399 4.182 4.450 . 0 0 "[ . 1 . 2]" 1
2445 1 108 ASP H 1 109 TYR QD . . 5.650 4.990 4.877 5.128 . 0 0 "[ . 1 . 2]" 1
2446 1 108 ASP HA 1 109 TYR H . . 3.970 2.194 2.140 2.222 . 0 0 "[ . 1 . 2]" 1
2447 1 108 ASP HA 1 109 TYR QD . . 4.790 3.406 3.111 3.757 . 0 0 "[ . 1 . 2]" 1
2448 1 108 ASP HA 1 110 THR H . . 4.620 3.794 3.480 3.917 . 0 0 "[ . 1 . 2]" 1
2449 1 108 ASP HB2 1 111 ASN H . . 5.440 4.731 3.656 5.164 . 0 0 "[ . 1 . 2]" 1
2450 1 108 ASP HB3 1 111 ASN H . . 5.440 3.777 3.346 5.484 0.044 15 0 "[ . 1 . 2]" 1
2451 1 108 ASP QB 1 111 ASN HA . . 5.410 4.932 4.091 5.440 0.030 18 0 "[ . 1 . 2]" 1
2452 1 108 ASP QB 1 111 ASN QB . . 4.610 2.711 2.192 3.453 . 0 0 "[ . 1 . 2]" 1
2453 1 109 TYR H 1 109 TYR HB2 . . 4.290 2.535 2.404 2.599 . 0 0 "[ . 1 . 2]" 1
2454 1 109 TYR H 1 109 TYR QD . . 4.000 2.722 2.440 2.933 . 0 0 "[ . 1 . 2]" 1
2455 1 109 TYR H 1 110 THR H . . 4.320 2.283 2.109 2.479 . 0 0 "[ . 1 . 2]" 1
2456 1 109 TYR H 1 110 THR HB . . 5.390 4.291 4.108 4.596 . 0 0 "[ . 1 . 2]" 1
2457 1 109 TYR H 1 110 THR MG . . 4.700 3.290 3.148 3.551 . 0 0 "[ . 1 . 2]" 1
2458 1 109 TYR H 1 111 ASN H . . 5.080 3.868 3.673 4.259 . 0 0 "[ . 1 . 2]" 1
2459 1 109 TYR HA 1 109 TYR QD . . 4.440 2.863 2.761 2.964 . 0 0 "[ . 1 . 2]" 1
2460 1 109 TYR HA 1 110 THR MG . . 5.460 4.962 4.865 5.081 . 0 0 "[ . 1 . 2]" 1
2461 1 109 TYR HA 1 111 ASN H . . 4.950 3.915 3.123 4.239 . 0 0 "[ . 1 . 2]" 1
2462 1 109 TYR HB2 1 110 THR H . . 4.800 3.732 3.337 3.960 . 0 0 "[ . 1 . 2]" 1
2463 1 109 TYR HB2 1 110 THR MG . . 5.460 4.479 4.392 4.696 . 0 0 "[ . 1 . 2]" 1
2464 1 109 TYR HB3 1 110 THR H . . 5.230 4.389 4.220 4.478 . 0 0 "[ . 1 . 2]" 1
2465 1 109 TYR HB3 1 110 THR MG . . 5.750 5.426 5.334 5.622 . 0 0 "[ . 1 . 2]" 1
2466 1 109 TYR QD 1 110 THR H . . 5.170 4.682 4.311 4.875 . 0 0 "[ . 1 . 2]" 1
2467 1 109 TYR QD 1 110 THR MG . . 5.460 5.201 5.061 5.318 . 0 0 "[ . 1 . 2]" 1
2468 1 110 THR H 1 110 THR MG . . 3.840 2.202 1.934 2.297 . 0 0 "[ . 1 . 2]" 1
2469 1 110 THR H 1 111 ASN H . . 3.900 1.955 1.795 2.511 . 0 0 "[ . 1 . 2]" 1
2470 1 110 THR H 1 111 ASN QB . . 5.230 3.668 3.434 3.973 . 0 0 "[ . 1 . 2]" 1
2471 1 110 THR HA 1 111 ASN H . . 4.420 3.309 3.024 3.438 . 0 0 "[ . 1 . 2]" 1
2472 1 110 THR HB 1 111 ASN H . . 5.160 4.358 4.281 4.541 . 0 0 "[ . 1 . 2]" 1
2473 1 110 THR MG 1 111 ASN H . . 4.550 3.032 2.792 3.581 . 0 0 "[ . 1 . 2]" 1
2474 1 111 ASN H 1 111 ASN QD . . 5.320 4.274 3.892 4.506 . 0 0 "[ . 1 . 2]" 1
2475 1 111 ASN H 1 112 PRO QD . . 5.390 4.322 4.204 4.439 . 0 0 "[ . 1 . 2]" 1
2476 1 111 ASN H 1 113 ASN H . . 5.750 4.970 4.432 5.403 . 0 0 "[ . 1 . 2]" 1
2477 1 111 ASN HA 1 112 PRO HD2 . . 4.060 2.549 2.091 3.152 . 0 0 "[ . 1 . 2]" 1
2478 1 111 ASN HA 1 112 PRO HD3 . . 4.060 2.134 1.950 2.479 . 0 0 "[ . 1 . 2]" 1
2479 1 111 ASN HA 1 112 PRO HG2 . . 5.340 4.490 4.319 4.665 . 0 0 "[ . 1 . 2]" 1
2480 1 111 ASN HA 1 112 PRO HG3 . . 5.340 4.288 3.993 4.603 . 0 0 "[ . 1 . 2]" 1
2481 1 111 ASN HA 1 112 PRO QD . . 3.630 1.971 1.901 2.167 . 0 0 "[ . 1 . 2]" 1
2482 1 111 ASN HA 1 113 ASN H . . 5.030 3.861 3.644 4.579 . 0 0 "[ . 1 . 2]" 1
2483 1 111 ASN QB 1 112 PRO QB . . 5.540 5.222 4.248 5.624 0.084 3 0 "[ . 1 . 2]" 1
2484 1 111 ASN QB 1 112 PRO QD . . 5.320 3.134 1.986 3.658 . 0 0 "[ . 1 . 2]" 1
2485 1 111 ASN QD 1 113 ASN H . . 5.660 3.795 3.494 4.514 . 0 0 "[ . 1 . 2]" 1
2486 1 111 ASN QD 1 113 ASN QB . . 5.570 3.199 2.437 5.596 0.026 15 0 "[ . 1 . 2]" 1
2487 1 112 PRO HA 1 114 LEU H . . 5.220 3.879 3.442 5.506 0.286 20 0 "[ . 1 . 2]" 1
2488 1 112 PRO HD2 1 113 ASN H . . 5.130 2.995 2.702 4.505 . 0 0 "[ . 1 . 2]" 1
2489 1 112 PRO HD3 1 113 ASN H . . 5.130 4.041 3.882 4.872 . 0 0 "[ . 1 . 2]" 1
2490 1 112 PRO QB 1 113 ASN H . . 4.830 3.418 3.063 4.043 . 0 0 "[ . 1 . 2]" 1
2491 1 112 PRO QD 1 113 ASN H . . 4.620 2.913 2.654 4.155 . 0 0 "[ . 1 . 2]" 1
2492 1 112 PRO QD 1 113 ASN QD . . 5.500 4.193 2.617 5.549 0.049 1 0 "[ . 1 . 2]" 1
2493 1 113 ASN H 1 113 ASN QD . . 5.360 3.386 2.167 4.917 . 0 0 "[ . 1 . 2]" 1
2494 1 113 ASN H 1 114 LEU H . . 4.760 2.573 2.082 4.502 . 0 0 "[ . 1 . 2]" 1
2495 1 113 ASN HA 1 114 LEU HA . . 5.750 4.748 4.315 5.316 . 0 0 "[ . 1 . 2]" 1
2496 1 113 ASN HB2 1 114 LEU H . . 5.080 3.791 2.921 4.629 . 0 0 "[ . 1 . 2]" 1
2497 1 113 ASN HB3 1 114 LEU H . . 5.080 4.286 3.450 4.540 . 0 0 "[ . 1 . 2]" 1
2498 1 114 LEU H 1 115 SER H . . 5.210 2.405 1.735 3.100 . 0 0 "[ . 1 . 2]" 1
2499 1 115 SER HA 1 116 GLY QA . . 5.120 4.197 3.930 4.445 . 0 0 "[ . 1 . 2]" 1
2500 1 117 GLN H 1 118 GLY H . . 3.810 2.148 1.739 2.743 . 0 0 "[ . 1 . 2]" 1
2501 1 117 GLN HA 1 118 GLY QA . . 5.000 4.257 4.148 4.428 . 0 0 "[ . 1 . 2]" 1
2502 1 117 GLN QB 1 118 GLY QA . . 5.170 4.331 3.827 4.646 . 0 0 "[ . 1 . 2]" 1
2503 1 117 GLN QE 1 118 GLY H . . 5.660 5.304 4.674 5.785 0.125 19 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 74
_Distance_constraint_stats_list.Viol_count 1423
_Distance_constraint_stats_list.Viol_total 15561.938
_Distance_constraint_stats_list.Viol_max 1.159
_Distance_constraint_stats_list.Viol_rms 0.2813
_Distance_constraint_stats_list.Viol_average_all_restraints 0.5257
_Distance_constraint_stats_list.Viol_average_violations_only 0.5468
_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 17 SER 23.591 0.948 17 20 [***********-****+***]
1 18 VAL 34.302 1.081 12 20 [*********-*+********]
1 19 LEU 40.008 0.980 2 20 [*+**-***************]
1 20 LEU 27.120 0.733 17 20 [**********-*****+***]
1 21 PHE 24.091 0.688 15 20 [**************+*-***]
1 22 THR 32.615 0.611 7 20 [*****-+*************]
1 23 ILE 25.751 1.074 4 20 [***+**-*************]
1 31 THR 19.115 0.755 3 20 [**+****************-]
1 32 THR 26.552 0.816 1 20 [+****-**************]
1 34 VAL 37.761 1.109 8 20 [*******+**********-*]
1 35 LEU 48.961 0.940 6 20 [*****+*************-]
1 36 TYR 41.134 0.816 1 20 [+********-**********]
1 38 ILE 37.761 1.109 8 20 [*******+**********-*]
1 39 CYS 29.846 0.940 6 20 [*****+**-***********]
1 40 ASN 14.582 0.578 9 5 "[ * . +-* . * 2]"
1 46 GLN 15.737 0.443 3 0 "[ . 1 . 2]"
1 47 ARG 59.378 1.159 20 20 [*******************+]
1 48 ILE 29.743 0.718 9 20 [********+*-*********]
1 49 VAL 32.555 0.790 17 20 [********-*******+***]
1 50 ILE 11.786 0.570 6 3 "[ .+ 1* - . 2]"
1 51 PHE 25.027 0.631 18 19 "[-****** *********+**]"
1 56 VAL 25.751 1.074 4 20 [***+**-*************]
1 57 GLN 25.027 0.631 18 19 "[-****** *********+**]"
1 58 ALA 24.091 0.688 15 20 [**************+*-***]
1 59 MET 32.555 0.790 17 20 [********-*******+***]
1 60 VAL 40.008 0.980 2 20 [*+**-***************]
1 61 GLU 66.533 1.159 20 20 [*******************+]
1 62 PHE 23.591 0.948 17 20 [***********-****+***]
1 64 SER 33.365 0.992 2 20 [*+****************-*]
1 65 VAL 15.643 0.617 11 11 "[ *-* **+ * *** *]"
1 66 GLN 33.439 1.019 1 20 [+******-************]
1 67 SER 25.952 0.797 3 20 [**+**************-**]
1 68 ALA 65.814 1.039 18 20 [*****-***********+**]
1 69 GLN 51.896 1.025 13 20 [****-*******+*******]
1 70 ARG 63.369 1.019 1 20 [+************-******]
1 71 ALA 50.024 0.797 3 20 [**+**************-**]
1 72 LYS 32.448 1.039 18 20 [*****-***********+**]
1 73 ALA 36.253 1.025 13 20 [*****-******+*******]
1 74 SER 29.930 0.968 11 20 [**********+**-******]
1 75 LEU 24.071 0.650 11 20 [**********+******-**]
1 88 LYS 32.615 0.611 7 20 [*****-+*************]
1 90 GLU 27.120 0.733 17 20 [**********-*****+***]
1 92 ALA 34.302 1.081 12 20 [*********-*+********]
1 102 ASN 18.680 0.775 15 18 "[**-******1****+* ***]"
1 103 ASP 18.754 0.695 4 19 [***+***-******.*****]
1 105 ASP 11.786 0.570 6 3 "[ .+ 1* - . 2]"
1 106 THR 18.754 0.695 4 19 [***+***-******.*****]
1 107 TRP 29.743 0.718 9 20 [********+*-*********]
1 108 ASP 18.680 0.775 15 18 "[**-******1****+* ***]"
1 109 TYR 8.582 0.443 3 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 19 LEU H 1 60 VAL O . . 1.800 1.935 1.869 2.013 0.213 16 0 "[ . 1 . 2]" 2
2 1 20 LEU H 1 90 GLU O . . 1.800 1.799 1.764 1.822 0.022 2 0 "[ . 1 . 2]" 2
3 1 21 PHE H 1 58 ALA O . . 1.800 1.777 1.747 1.794 . 0 0 "[ . 1 . 2]" 2
4 1 22 THR H 1 88 LYS O . . 1.800 1.997 1.920 2.130 0.330 3 0 "[ . 1 . 2]" 2
5 1 23 ILE H 1 56 VAL O . . 1.800 2.251 2.070 2.476 0.676 4 7 "[ *+. - * * .* *2]" 2
6 1 46 GLN H 1 61 GLU O . . 1.800 1.769 1.743 1.799 . 0 0 "[ . 1 . 2]" 2
7 1 47 ARG H 1 61 GLU O . . 1.800 2.561 2.530 2.602 0.802 20 20 [************-******+] 2
8 1 48 ILE H 1 107 TRP O . . 1.800 1.996 1.884 2.113 0.313 9 0 "[ . 1 . 2]" 2
9 1 49 VAL H 1 59 MET O . . 1.800 2.151 2.087 2.232 0.432 17 0 "[ . 1 . 2]" 2
10 1 50 ILE H 1 105 ASP O . . 1.800 1.952 1.820 2.222 0.422 6 0 "[ . 1 . 2]" 2
11 1 51 PHE H 1 57 GLN O . . 1.800 1.854 1.801 1.927 0.127 19 0 "[ . 1 . 2]" 2
12 1 51 PHE O 1 57 GLN H . . 1.800 1.981 1.873 2.034 0.234 13 0 "[ . 1 . 2]" 2
13 1 21 PHE O 1 58 ALA H . . 1.800 2.036 1.966 2.115 0.315 15 0 "[ . 1 . 2]" 2
14 1 49 VAL O 1 59 MET H . . 1.800 1.903 1.854 1.997 0.197 4 0 "[ . 1 . 2]" 2
15 1 19 LEU O 1 60 VAL H . . 1.800 2.292 1.967 2.414 0.614 2 12 "[ +**** 1 * -** ***]" 2
16 1 47 ARG O 1 61 GLU H . . 1.800 2.202 2.124 2.317 0.517 20 1 "[ . 1 . +]" 2
17 1 17 SER O 1 62 PHE H . . 1.800 2.213 2.071 2.402 0.602 17 4 "[* . * 1 - . + 2]" 2
18 1 22 THR O 1 88 LYS H . . 1.800 2.187 2.112 2.250 0.450 15 0 "[ . 1 . 2]" 2
19 1 20 LEU O 1 90 GLU H . . 1.800 2.105 2.046 2.164 0.364 17 0 "[ . 1 . 2]" 2
20 1 18 VAL O 1 92 ALA H . . 1.800 2.456 2.419 2.474 0.674 12 20 [*********-*+********] 2
21 1 103 ASP OD1 1 106 THR H . . 1.800 2.148 1.974 2.356 0.556 9 2 "[ -. +1 . 2]" 2
22 1 48 ILE O 1 107 TRP H . . 1.800 1.955 1.900 2.050 0.250 7 0 "[ . 1 . 2]" 2
23 1 102 ASN OD1 1 108 ASP H . . 1.800 2.118 1.988 2.246 0.446 13 0 "[ . 1 . 2]" 2
24 1 46 GLN O 1 109 TYR H . . 1.800 1.825 1.782 1.873 0.073 3 0 "[ . 1 . 2]" 2
25 1 31 THR O 1 35 LEU H . . 1.800 2.095 2.015 2.197 0.397 3 0 "[ . 1 . 2]" 2
26 1 32 THR O 1 36 TYR H . . 1.800 2.370 2.190 2.433 0.633 10 17 "[* ***-***+ ** ******]" 2
27 1 34 VAL O 1 38 ILE H . . 1.800 2.622 2.587 2.655 0.855 11 20 [**********+*******-*] 2
28 1 35 LEU O 1 39 CYS H . . 1.800 2.473 2.438 2.541 0.741 6 20 [*****+**-***********] 2
29 1 36 TYR O 1 40 ASN H . . 1.800 2.041 1.974 2.161 0.361 11 0 "[ . 1 . 2]" 2
30 1 64 SER O 1 68 ALA H . . 1.800 2.515 2.478 2.544 0.744 7 20 [******+***********-*] 2
31 1 65 VAL O 1 69 GLN H . . 1.800 2.065 1.973 2.196 0.396 11 0 "[ . 1 . 2]" 2
32 1 66 GLN O 1 70 ARG H . . 1.800 2.495 2.462 2.527 0.727 15 20 [*******-******+*****] 2
33 1 67 SER O 1 71 ALA H . . 1.800 2.366 2.095 2.429 0.629 5 17 "[ **-+ *********** **]" 2
34 1 68 ALA O 1 72 LYS H . . 1.800 2.411 2.303 2.438 0.638 3 20 [**+**-**************] 2
35 1 69 GLN O 1 73 ALA H . . 1.800 2.626 2.491 2.671 0.871 17 20 [*****-**********+***] 2
36 1 70 ARG O 1 74 SER H . . 1.800 2.572 2.511 2.690 0.890 11 20 [**********+**-******] 2
37 1 71 ALA O 1 75 LEU H . . 1.800 2.416 2.355 2.450 0.650 11 20 [**********+******-**] 2
38 1 19 LEU N 1 60 VAL O . . 2.400 2.915 2.864 2.984 0.584 16 15 "[****-*** 1* **.+ ***]" 2
39 1 20 LEU N 1 90 GLU O . . 2.400 2.780 2.754 2.806 0.406 10 0 "[ . 1 . 2]" 2
40 1 21 PHE N 1 58 ALA O . . 2.400 2.758 2.741 2.774 0.374 8 0 "[ . 1 . 2]" 2
41 1 22 THR N 1 88 LYS O . . 2.400 2.912 2.856 3.011 0.611 7 10 "[* * .-+**1 * .*** 2]" 2
42 1 23 ILE N 1 56 VAL O . . 2.400 3.237 3.069 3.474 1.074 4 20 [***+**********-*****] 2
43 1 46 GLN N 1 61 GLU O . . 2.400 2.758 2.735 2.783 0.383 6 0 "[ . 1 . 2]" 2
44 1 47 ARG N 1 61 GLU O . . 2.400 3.525 3.484 3.559 1.159 20 20 [************-******+] 2
45 1 48 ILE N 1 107 TRP O . . 2.400 2.994 2.868 3.118 0.718 9 19 "[********+** *******-]" 2
46 1 49 VAL N 1 59 MET O . . 2.400 3.121 3.074 3.190 0.790 17 20 [*********-******+***] 2
47 1 50 ILE N 1 105 ASP O . . 2.400 2.837 2.744 2.970 0.570 6 3 "[ .+ 1* - . 2]" 2
48 1 51 PHE N 1 57 GLN O . . 2.400 2.848 2.803 2.936 0.536 19 3 "[- .* 1 . +2]" 2
49 1 51 PHE O 1 57 GLN N . . 2.400 2.969 2.869 3.031 0.631 18 18 "[ ****** *-*******+**]" 2
50 1 21 PHE O 1 58 ALA N . . 2.400 3.011 2.950 3.088 0.688 15 20 [**************+*-***] 2
51 1 49 VAL O 1 59 MET N . . 2.400 2.852 2.805 2.955 0.555 4 3 "[ +. *-1 . 2]" 2
52 1 19 LEU O 1 60 VAL N . . 2.400 3.258 2.949 3.380 0.980 2 20 [*+*******-**********] 2
53 1 47 ARG O 1 61 GLU N . . 2.400 3.081 2.992 3.194 0.794 20 20 [****-**************+] 2
54 1 17 SER O 1 62 PHE N . . 2.400 3.167 3.000 3.348 0.948 17 20 [*************-**+***] 2
55 1 22 THR O 1 88 LYS N . . 2.400 2.935 2.893 3.001 0.601 3 17 "[**+*** ******** **-]" 2
56 1 20 LEU O 1 90 GLU N . . 2.400 3.067 3.003 3.133 0.733 17 20 [**********-*****+***] 2
57 1 18 VAL O 1 92 ALA N . . 2.400 3.459 3.415 3.481 1.081 12 20 [*********-*+********] 2
58 1 103 ASP OD1 1 106 THR N . . 2.400 2.989 2.846 3.095 0.695 4 19 [***+***-******.*****] 2
59 1 48 ILE O 1 107 TRP N . . 2.400 2.942 2.898 3.020 0.620 16 19 "[**********-* **+****]" 2
60 1 102 ASN OD1 1 108 ASP N . . 2.400 3.016 2.893 3.175 0.775 15 18 "[**-******1****+* ***]" 2
61 1 46 GLN O 1 109 TYR N . . 2.400 2.803 2.740 2.843 0.443 3 0 "[ . 1 . 2]" 2
62 1 31 THR O 1 35 LEU N . . 2.400 3.061 2.986 3.155 0.755 3 20 [**+****************-] 2
63 1 32 THR O 1 36 TYR N . . 2.400 3.158 3.045 3.216 0.816 1 20 [+-******************] 2
64 1 34 VAL O 1 38 ILE N . . 2.400 3.466 3.422 3.509 1.109 8 20 [*******+***********-] 2
65 1 35 LEU O 1 39 CYS N . . 2.400 3.219 3.132 3.340 0.940 6 20 [*****+**-***********] 2
66 1 36 TYR O 1 40 ASN N . . 2.400 2.888 2.841 2.978 0.578 9 5 "[ * . +-* . * 2]" 2
67 1 64 SER O 1 68 ALA N . . 2.400 3.354 3.303 3.392 0.992 2 20 [*+*****************-] 2
68 1 65 VAL O 1 69 GLN N . . 2.400 2.917 2.850 3.017 0.617 11 11 "[ *-* **+ * *** *]" 2
69 1 66 GLN O 1 70 ARG N . . 2.400 3.377 3.315 3.419 1.019 1 20 [+****-**************] 2
70 1 67 SER O 1 71 ALA N . . 2.400 3.131 2.936 3.197 0.797 3 20 [**+**************-**] 2
71 1 68 ALA O 1 72 LYS N . . 2.400 3.411 3.304 3.439 1.039 18 20 [*****-***********+**] 2
72 1 69 GLN O 1 73 ALA N . . 2.400 3.387 3.271 3.425 1.025 13 20 [*****-******+*******] 2
73 1 70 ARG O 1 74 SER N . . 2.400 3.124 3.032 3.368 0.968 11 20 [**********+**-******] 2
74 1 71 ALA O 1 75 LEU N . . 2.400 2.988 2.930 3.022 0.622 17 20 [****************+-**] 2
stop_
save_
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