NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
629698 |
6fd7   |
19758 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6fd7
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 2570
_Distance_constraint_stats_list.Viol_count 6895
_Distance_constraint_stats_list.Viol_total 3902.404
_Distance_constraint_stats_list.Viol_max 0.854
_Distance_constraint_stats_list.Viol_rms 0.0197
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0038
_Distance_constraint_stats_list.Viol_average_violations_only 0.0283
_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 PRO 0.061 0.017 1 0 "[ . 1 . 2]"
1 3 HIS 0.272 0.057 3 0 "[ . 1 . 2]"
1 4 MET 3.971 0.370 4 0 "[ . 1 . 2]"
1 5 ALA 3.935 0.370 4 0 "[ . 1 . 2]"
1 6 LEU 1.699 0.049 1 0 "[ . 1 . 2]"
1 7 VAL 3.538 0.286 4 0 "[ . 1 . 2]"
1 8 LEU 3.226 0.103 18 0 "[ . 1 . 2]"
1 9 LYS 4.338 0.103 10 0 "[ . 1 . 2]"
1 10 GLU 1.361 0.061 16 0 "[ . 1 . 2]"
1 11 LYS 3.558 0.286 4 0 "[ . 1 . 2]"
1 12 GLY 0.899 0.054 5 0 "[ . 1 . 2]"
1 13 ASN 1.252 0.061 16 0 "[ . 1 . 2]"
1 14 LYS 3.221 0.118 7 0 "[ . 1 . 2]"
1 15 TYR 12.773 0.782 7 9 "[ *.*+ -* *** *2]"
1 16 PHE 2.067 0.060 19 0 "[ . 1 . 2]"
1 17 LYS 4.870 0.110 7 0 "[ . 1 . 2]"
1 18 GLN 6.475 0.084 14 0 "[ . 1 . 2]"
1 19 GLY 1.244 0.054 2 0 "[ . 1 . 2]"
1 20 LYS 6.776 0.185 11 0 "[ . 1 . 2]"
1 21 TYR 3.145 0.108 14 0 "[ . 1 . 2]"
1 22 ASP 1.663 0.082 20 0 "[ . 1 . 2]"
1 23 GLU 7.978 0.782 7 9 "[ *.*+ -* *** *2]"
1 24 ALA 3.038 0.082 20 0 "[ . 1 . 2]"
1 25 ILE 4.797 0.316 4 0 "[ . 1 . 2]"
1 26 ASP 1.398 0.063 15 0 "[ . 1 . 2]"
1 27 CYS 1.962 0.103 18 0 "[ . 1 . 2]"
1 28 TYR 4.802 0.111 9 0 "[ . 1 . 2]"
1 29 THR 2.094 0.111 9 0 "[ . 1 . 2]"
1 30 LYS 1.684 0.057 4 0 "[ . 1 . 2]"
1 31 GLY 1.746 0.070 1 0 "[ . 1 . 2]"
1 32 MET 3.597 0.068 15 0 "[ . 1 . 2]"
1 33 ASP 3.586 0.096 14 0 "[ . 1 . 2]"
1 34 ALA 2.542 0.096 14 0 "[ . 1 . 2]"
1 35 ASP 2.710 0.073 13 0 "[ . 1 . 2]"
1 36 PRO 2.798 0.096 17 0 "[ . 1 . 2]"
1 37 TYR 3.338 0.096 17 0 "[ . 1 . 2]"
1 38 ASN 3.333 0.120 2 0 "[ . 1 . 2]"
1 39 PRO 1.009 0.045 18 0 "[ . 1 . 2]"
1 40 VAL 2.718 0.057 20 0 "[ . 1 . 2]"
1 41 LEU 2.786 0.060 7 0 "[ . 1 . 2]"
1 42 PRO 1.766 0.063 11 0 "[ . 1 . 2]"
1 43 THR 3.080 0.051 13 0 "[ . 1 . 2]"
1 44 ASN 3.068 0.076 17 0 "[ . 1 . 2]"
1 45 ARG 3.992 0.114 9 0 "[ . 1 . 2]"
1 46 ALA 0.879 0.051 7 0 "[ . 1 . 2]"
1 47 SER 1.421 0.051 7 0 "[ . 1 . 2]"
1 48 ALA 0.893 0.044 18 0 "[ . 1 . 2]"
1 49 TYR 5.731 0.316 4 0 "[ . 1 . 2]"
1 50 PHE 1.207 0.108 19 0 "[ . 1 . 2]"
1 51 ARG 2.274 0.082 8 0 "[ . 1 . 2]"
1 52 LEU 3.518 0.107 6 0 "[ . 1 . 2]"
1 53 LYS 0.614 0.047 8 0 "[ . 1 . 2]"
1 54 LYS 3.183 0.107 6 0 "[ . 1 . 2]"
1 55 PHE 2.754 0.052 14 0 "[ . 1 . 2]"
1 56 ALA 2.696 0.067 11 0 "[ . 1 . 2]"
1 57 VAL 4.731 0.180 12 0 "[ . 1 . 2]"
1 58 ALA 1.395 0.108 19 0 "[ . 1 . 2]"
1 59 GLU 0.626 0.031 4 0 "[ . 1 . 2]"
1 60 SER 1.366 0.057 9 0 "[ . 1 . 2]"
1 61 ASP 3.233 0.114 9 0 "[ . 1 . 2]"
1 62 CYS 1.772 0.063 15 0 "[ . 1 . 2]"
1 63 ASN 0.801 0.036 5 0 "[ . 1 . 2]"
1 64 LEU 1.939 0.064 15 0 "[ . 1 . 2]"
1 65 ALA 0.227 0.018 10 0 "[ . 1 . 2]"
1 66 VAL 4.781 0.064 15 0 "[ . 1 . 2]"
1 67 ALA 1.998 0.050 14 0 "[ . 1 . 2]"
1 68 LEU 2.270 0.073 20 0 "[ . 1 . 2]"
1 69 ASN 4.237 0.086 20 0 "[ . 1 . 2]"
1 70 ARG 3.091 0.085 20 0 "[ . 1 . 2]"
1 71 SER 0.814 0.049 20 0 "[ . 1 . 2]"
1 72 TYR 2.057 0.054 8 0 "[ . 1 . 2]"
1 73 THR 11.784 0.700 14 1 "[ . 1 +. 2]"
1 74 LYS 1.166 0.048 15 0 "[ . 1 . 2]"
1 75 ALA 2.010 0.106 13 0 "[ . 1 . 2]"
1 76 TYR 3.553 0.106 13 0 "[ . 1 . 2]"
1 77 SER 0.912 0.045 18 0 "[ . 1 . 2]"
1 78 ARG 0.526 0.048 15 0 "[ . 1 . 2]"
1 79 ARG 3.690 0.063 15 0 "[ . 1 . 2]"
1 80 GLY 0.654 0.030 6 0 "[ . 1 . 2]"
1 81 ALA 2.020 0.063 7 0 "[ . 1 . 2]"
1 82 ALA 1.688 0.047 5 0 "[ . 1 . 2]"
1 83 ARG 0.094 0.024 16 0 "[ . 1 . 2]"
1 84 PHE 11.819 0.854 3 8 "[ +*. 1*-*** * 2]"
1 85 ALA 2.146 0.053 19 0 "[ . 1 . 2]"
1 86 LEU 1.744 0.057 2 0 "[ . 1 . 2]"
1 87 GLN 3.900 0.078 20 0 "[ . 1 . 2]"
1 88 LYS 2.524 0.081 18 0 "[ . 1 . 2]"
1 89 LEU 5.119 0.096 20 0 "[ . 1 . 2]"
1 90 GLU 1.965 0.081 18 0 "[ . 1 . 2]"
1 91 GLU 0.318 0.035 13 0 "[ . 1 . 2]"
1 92 ALA 3.216 0.335 13 0 "[ . 1 . 2]"
1 93 LYS 4.917 0.505 12 1 "[ . 1 + . 2]"
1 94 LYS 1.171 0.062 6 0 "[ . 1 . 2]"
1 95 ASP 2.229 0.063 7 0 "[ . 1 . 2]"
1 96 TYR 1.445 0.041 8 0 "[ . 1 . 2]"
1 97 GLU 1.267 0.041 8 0 "[ . 1 . 2]"
1 98 ARG 4.844 0.093 10 0 "[ . 1 . 2]"
1 99 VAL 2.142 0.118 14 0 "[ . 1 . 2]"
1 100 LEU 2.444 0.073 3 0 "[ . 1 . 2]"
1 101 GLU 3.386 0.069 14 0 "[ . 1 . 2]"
1 102 LEU 0.794 0.044 12 0 "[ . 1 . 2]"
1 103 GLU 11.842 0.700 14 1 "[ . 1 +. 2]"
1 104 PRO 0.782 0.075 20 0 "[ . 1 . 2]"
1 105 ASN 3.112 0.075 20 0 "[ . 1 . 2]"
1 106 ASN 4.553 0.095 13 0 "[ . 1 . 2]"
1 107 PHE 0.783 0.055 1 0 "[ . 1 . 2]"
1 108 GLU 1.872 0.061 4 0 "[ . 1 . 2]"
1 109 ALA 3.763 0.069 9 0 "[ . 1 . 2]"
1 110 THR 2.190 0.229 12 0 "[ . 1 . 2]"
1 111 ASN 1.444 0.062 5 0 "[ . 1 . 2]"
1 112 GLU 1.557 0.050 16 0 "[ . 1 . 2]"
1 113 LEU 2.700 0.074 10 0 "[ . 1 . 2]"
1 114 ARG 2.355 0.229 12 0 "[ . 1 . 2]"
1 115 LYS 1.943 0.054 10 0 "[ . 1 . 2]"
1 116 ILE 13.435 0.854 3 8 "[ +*. 1*-*** * 2]"
1 117 SER 1.931 0.049 3 0 "[ . 1 . 2]"
1 118 GLN 3.546 0.101 10 0 "[ . 1 . 2]"
1 119 ALA 4.464 0.123 20 0 "[ . 1 . 2]"
1 120 LEU 5.801 0.096 20 0 "[ . 1 . 2]"
1 121 ALA 3.110 0.075 19 0 "[ . 1 . 2]"
1 122 SER 2.420 0.079 19 0 "[ . 1 . 2]"
1 123 LYS 2.583 0.084 1 0 "[ . 1 . 2]"
1 124 GLU 1.263 0.068 3 0 "[ . 1 . 2]"
1 125 ASN 1.942 0.102 3 0 "[ . 1 . 2]"
1 126 SER 0.865 0.112 17 0 "[ . 1 . 2]"
1 127 TYR 0.472 0.112 17 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 PRO HA 1 4 MET H . . 4.370 3.924 3.709 4.377 0.007 13 0 "[ . 1 . 2]" 1
2 1 2 PRO HA 1 5 ALA H . . 3.950 3.302 3.052 3.626 . 0 0 "[ . 1 . 2]" 1
3 1 2 PRO HA 1 5 ALA MB . . 3.720 3.206 2.800 3.536 . 0 0 "[ . 1 . 2]" 1
4 1 2 PRO HA 1 35 ASP HB3 . . 3.980 3.766 2.980 3.997 0.017 1 0 "[ . 1 . 2]" 1
5 1 3 HIS HA 1 3 HIS HD2 . . 4.560 4.188 3.821 4.471 . 0 0 "[ . 1 . 2]" 1
6 1 3 HIS HA 1 6 LEU H . . 3.960 3.310 2.941 3.622 . 0 0 "[ . 1 . 2]" 1
7 1 3 HIS HA 1 6 LEU MD1 . . 3.480 2.236 2.163 2.387 . 0 0 "[ . 1 . 2]" 1
8 1 3 HIS HA 1 6 LEU HG . . 3.610 3.008 2.449 3.623 0.013 13 0 "[ . 1 . 2]" 1
9 1 3 HIS QB 1 3 HIS HD2 . . 3.400 2.756 2.632 2.927 . 0 0 "[ . 1 . 2]" 1
10 1 3 HIS QB 1 5 ALA H . . 5.570 5.061 4.868 5.386 . 0 0 "[ . 1 . 2]" 1
11 1 3 HIS QB 1 6 LEU MD1 . . 4.360 3.485 2.682 3.901 . 0 0 "[ . 1 . 2]" 1
12 1 3 HIS QB 1 7 VAL MG2 . . 5.460 4.128 3.599 4.653 . 0 0 "[ . 1 . 2]" 1
13 1 3 HIS HB2 1 4 MET H . . 4.480 4.030 3.871 4.285 . 0 0 "[ . 1 . 2]" 1
14 1 3 HIS HB2 1 6 LEU MD1 . . 4.990 3.721 2.833 4.079 . 0 0 "[ . 1 . 2]" 1
15 1 3 HIS HB3 1 4 MET H . . 4.480 3.397 2.645 4.331 . 0 0 "[ . 1 . 2]" 1
16 1 3 HIS HB3 1 6 LEU MD1 . . 4.990 4.304 3.131 4.996 0.006 16 0 "[ . 1 . 2]" 1
17 1 3 HIS HD2 1 4 MET HA . . 4.410 3.236 3.010 3.401 . 0 0 "[ . 1 . 2]" 1
18 1 3 HIS HD2 1 4 MET QG . . 5.200 5.156 4.900 5.257 0.057 3 0 "[ . 1 . 2]" 1
19 1 3 HIS HD2 1 7 VAL MG2 . . 3.500 2.939 2.170 3.526 0.026 14 0 "[ . 1 . 2]" 1
20 1 4 MET H 1 4 MET HB2 . . 3.900 2.603 2.448 2.728 . 0 0 "[ . 1 . 2]" 1
21 1 4 MET H 1 4 MET QB . . 3.420 2.196 2.112 2.271 . 0 0 "[ . 1 . 2]" 1
22 1 4 MET H 1 4 MET HB3 . . 3.900 2.377 2.224 2.547 . 0 0 "[ . 1 . 2]" 1
23 1 4 MET H 1 4 MET QG . . 4.030 3.951 3.891 3.978 . 0 0 "[ . 1 . 2]" 1
24 1 4 MET H 1 5 ALA H . . 4.100 2.790 2.677 2.932 . 0 0 "[ . 1 . 2]" 1
25 1 4 MET H 1 5 ALA MB . . 4.590 4.453 4.360 4.541 . 0 0 "[ . 1 . 2]" 1
26 1 4 MET H 1 6 LEU H . . 4.970 4.111 3.984 4.224 . 0 0 "[ . 1 . 2]" 1
27 1 4 MET H 1 6 LEU MD1 . . 5.260 5.267 5.129 5.285 0.025 1 0 "[ . 1 . 2]" 1
28 1 4 MET H 1 7 VAL MG2 . . 5.580 4.746 4.414 4.863 . 0 0 "[ . 1 . 2]" 1
29 1 4 MET H 1 8 LEU MD1 . . 5.600 5.404 5.313 5.549 . 0 0 "[ . 1 . 2]" 1
30 1 4 MET HA 1 4 MET QG . . 3.430 2.523 2.358 2.627 . 0 0 "[ . 1 . 2]" 1
31 1 4 MET HA 1 6 LEU H . . 4.160 4.182 4.171 4.195 0.035 16 0 "[ . 1 . 2]" 1
32 1 4 MET HA 1 7 VAL H . . 3.640 3.277 3.166 3.456 . 0 0 "[ . 1 . 2]" 1
33 1 4 MET HA 1 7 VAL MG1 . . 4.510 4.193 3.816 4.476 . 0 0 "[ . 1 . 2]" 1
34 1 4 MET HA 1 7 VAL MG2 . . 3.150 3.099 2.712 3.168 0.018 13 0 "[ . 1 . 2]" 1
35 1 4 MET QB 1 5 ALA H . . 3.450 2.756 2.586 2.887 . 0 0 "[ . 1 . 2]" 1
36 1 4 MET QB 1 34 ALA MB . . 3.950 2.328 2.142 2.678 . 0 0 "[ . 1 . 2]" 1
37 1 4 MET HB2 1 4 MET QG . . 2.790 2.415 2.374 2.443 . 0 0 "[ . 1 . 2]" 1
38 1 4 MET HB2 1 5 ALA H . . 4.140 4.087 3.979 4.157 0.017 15 0 "[ . 1 . 2]" 1
39 1 4 MET HB3 1 4 MET QG . . 2.790 2.322 2.289 2.358 . 0 0 "[ . 1 . 2]" 1
40 1 4 MET HB3 1 5 ALA H . . 4.140 2.802 2.620 2.946 . 0 0 "[ . 1 . 2]" 1
41 1 4 MET ME 1 8 LEU MD1 . . 2.770 2.186 1.981 2.782 0.012 5 0 "[ . 1 . 2]" 1
42 1 4 MET ME 1 31 GLY H . . 4.820 4.540 4.034 4.830 0.010 5 0 "[ . 1 . 2]" 1
43 1 4 MET ME 1 34 ALA H . . 4.820 4.373 3.668 4.833 0.013 3 0 "[ . 1 . 2]" 1
44 1 4 MET QG 1 5 ALA H . . 4.070 3.512 3.280 3.753 . 0 0 "[ . 1 . 2]" 1
45 1 4 MET QG 1 5 ALA MB . . 4.170 4.197 4.007 4.540 0.370 4 0 "[ . 1 . 2]" 1
46 1 4 MET QG 1 7 VAL H . . 4.630 4.649 4.529 4.683 0.053 2 0 "[ . 1 . 2]" 1
47 1 4 MET QG 1 8 LEU H . . 4.420 3.952 3.786 4.091 . 0 0 "[ . 1 . 2]" 1
48 1 4 MET QG 1 8 LEU HB2 . . 4.320 4.044 3.967 4.123 . 0 0 "[ . 1 . 2]" 1
49 1 4 MET QG 1 8 LEU MD1 . . 3.320 1.972 1.893 2.034 . 0 0 "[ . 1 . 2]" 1
50 1 4 MET QG 1 8 LEU MD2 . . 4.020 3.884 3.647 4.101 0.081 9 0 "[ . 1 . 2]" 1
51 1 4 MET QG 1 31 GLY H . . 5.020 5.056 5.037 5.090 0.070 1 0 "[ . 1 . 2]" 1
52 1 4 MET QG 1 34 ALA MB . . 3.530 2.763 2.430 3.441 . 0 0 "[ . 1 . 2]" 1
53 1 5 ALA H 1 5 ALA MB . . 2.830 2.225 2.174 2.269 . 0 0 "[ . 1 . 2]" 1
54 1 5 ALA H 1 6 LEU H . . 3.340 2.605 2.521 2.724 . 0 0 "[ . 1 . 2]" 1
55 1 5 ALA H 1 6 LEU MD2 . . 5.200 5.150 4.716 5.235 0.035 13 0 "[ . 1 . 2]" 1
56 1 5 ALA H 1 6 LEU HG . . 4.210 4.172 4.029 4.240 0.030 9 0 "[ . 1 . 2]" 1
57 1 5 ALA H 1 7 VAL H . . 4.480 4.128 4.014 4.272 . 0 0 "[ . 1 . 2]" 1
58 1 5 ALA H 1 8 LEU MD1 . . 4.270 4.112 4.002 4.196 . 0 0 "[ . 1 . 2]" 1
59 1 5 ALA H 1 34 ALA H . . 5.380 5.357 5.214 5.431 0.051 9 0 "[ . 1 . 2]" 1
60 1 5 ALA H 1 34 ALA MB . . 3.390 2.707 2.464 2.866 . 0 0 "[ . 1 . 2]" 1
61 1 5 ALA H 1 35 ASP H . . 5.400 5.239 5.088 5.369 . 0 0 "[ . 1 . 2]" 1
62 1 5 ALA HA 1 7 VAL H . . 4.270 4.259 4.166 4.292 0.022 1 0 "[ . 1 . 2]" 1
63 1 5 ALA HA 1 8 LEU MD1 . . 3.260 2.653 2.513 2.746 . 0 0 "[ . 1 . 2]" 1
64 1 5 ALA HA 1 31 GLY H . . 4.680 4.410 4.279 4.560 . 0 0 "[ . 1 . 2]" 1
65 1 5 ALA HA 1 34 ALA H . . 4.900 4.864 4.717 4.928 0.028 18 0 "[ . 1 . 2]" 1
66 1 5 ALA HA 1 35 ASP H . . 5.340 5.136 4.964 5.281 . 0 0 "[ . 1 . 2]" 1
67 1 5 ALA HA 1 41 LEU MD2 . . 3.960 3.157 2.976 3.409 . 0 0 "[ . 1 . 2]" 1
68 1 5 ALA MB 1 6 LEU H . . 3.230 2.662 2.585 2.750 . 0 0 "[ . 1 . 2]" 1
69 1 5 ALA MB 1 6 LEU HA . . 3.820 3.858 3.853 3.869 0.049 1 0 "[ . 1 . 2]" 1
70 1 5 ALA MB 1 7 VAL H . . 4.730 4.530 4.451 4.593 . 0 0 "[ . 1 . 2]" 1
71 1 5 ALA MB 1 8 LEU MD1 . . 3.970 3.931 3.781 3.989 0.019 20 0 "[ . 1 . 2]" 1
72 1 5 ALA MB 1 31 GLY HA2 . . 4.830 2.919 2.773 3.042 . 0 0 "[ . 1 . 2]" 1
73 1 5 ALA MB 1 31 GLY QA . . 4.130 2.686 2.567 2.811 . 0 0 "[ . 1 . 2]" 1
74 1 5 ALA MB 1 31 GLY HA3 . . 4.830 3.139 2.980 3.306 . 0 0 "[ . 1 . 2]" 1
75 1 5 ALA MB 1 32 MET H . . 4.710 4.459 4.367 4.566 . 0 0 "[ . 1 . 2]" 1
76 1 5 ALA MB 1 32 MET HA . . 3.930 3.962 3.907 3.998 0.068 15 0 "[ . 1 . 2]" 1
77 1 5 ALA MB 1 34 ALA H . . 3.730 3.712 3.571 3.762 0.032 11 0 "[ . 1 . 2]" 1
78 1 5 ALA MB 1 34 ALA HA . . 4.850 4.565 4.384 4.708 . 0 0 "[ . 1 . 2]" 1
79 1 5 ALA MB 1 35 ASP H . . 3.360 3.007 2.895 3.131 . 0 0 "[ . 1 . 2]" 1
80 1 5 ALA MB 1 35 ASP HA . . 4.790 4.177 3.999 4.295 . 0 0 "[ . 1 . 2]" 1
81 1 5 ALA MB 1 35 ASP HB2 . . 3.480 2.707 2.392 2.945 . 0 0 "[ . 1 . 2]" 1
82 1 5 ALA MB 1 35 ASP HB3 . . 3.380 2.229 2.074 2.338 . 0 0 "[ . 1 . 2]" 1
83 1 5 ALA MB 1 38 ASN H . . 4.900 4.898 4.819 4.936 0.036 4 0 "[ . 1 . 2]" 1
84 1 5 ALA MB 1 38 ASN HD21 . . 4.790 3.690 3.393 4.086 . 0 0 "[ . 1 . 2]" 1
85 1 5 ALA MB 1 38 ASN HD22 . . 4.960 4.815 4.539 4.982 0.022 15 0 "[ . 1 . 2]" 1
86 1 5 ALA MB 1 41 LEU MD1 . . 3.080 2.075 2.015 2.141 . 0 0 "[ . 1 . 2]" 1
87 1 6 LEU H 1 6 LEU HB2 . . 3.130 2.535 2.404 2.692 . 0 0 "[ . 1 . 2]" 1
88 1 6 LEU H 1 6 LEU MD1 . . 3.650 3.582 3.484 3.650 . 0 0 "[ . 1 . 2]" 1
89 1 6 LEU H 1 6 LEU MD2 . . 3.500 3.376 2.953 3.495 . 0 0 "[ . 1 . 2]" 1
90 1 6 LEU H 1 6 LEU HG . . 2.860 2.255 2.067 2.343 . 0 0 "[ . 1 . 2]" 1
91 1 6 LEU H 1 7 VAL HA . . 5.350 5.292 5.247 5.355 0.005 17 0 "[ . 1 . 2]" 1
92 1 6 LEU H 1 7 VAL HB . . 5.260 4.794 4.634 4.990 . 0 0 "[ . 1 . 2]" 1
93 1 6 LEU H 1 9 LYS H . . 5.000 4.718 4.575 4.830 . 0 0 "[ . 1 . 2]" 1
94 1 6 LEU H 1 35 ASP HB3 . . 5.630 5.284 5.058 5.446 . 0 0 "[ . 1 . 2]" 1
95 1 6 LEU HA 1 6 LEU MD2 . . 2.860 2.196 2.128 2.269 . 0 0 "[ . 1 . 2]" 1
96 1 6 LEU HA 1 9 LYS H . . 4.050 3.572 3.328 3.757 . 0 0 "[ . 1 . 2]" 1
97 1 6 LEU HA 1 9 LYS HE2 . . 4.630 2.915 2.373 3.352 . 0 0 "[ . 1 . 2]" 1
98 1 6 LEU HB2 1 7 VAL H . . 3.550 2.943 2.778 3.111 . 0 0 "[ . 1 . 2]" 1
99 1 6 LEU HB3 1 7 VAL H . . 4.090 3.955 3.900 4.044 . 0 0 "[ . 1 . 2]" 1
100 1 6 LEU HB3 1 7 VAL HA . . 4.850 4.745 4.652 4.851 0.001 6 0 "[ . 1 . 2]" 1
101 1 6 LEU MD2 1 38 ASN HD21 . . 4.240 2.656 2.371 3.156 . 0 0 "[ . 1 . 2]" 1
102 1 6 LEU MD2 1 38 ASN HD22 . . 4.100 2.767 2.396 3.571 . 0 0 "[ . 1 . 2]" 1
103 1 7 VAL H 1 7 VAL HB . . 3.130 2.438 2.309 2.544 . 0 0 "[ . 1 . 2]" 1
104 1 7 VAL H 1 7 VAL MG1 . . 3.830 3.804 3.759 3.839 0.009 13 0 "[ . 1 . 2]" 1
105 1 7 VAL H 1 7 VAL MG2 . . 2.690 2.416 2.316 2.541 . 0 0 "[ . 1 . 2]" 1
106 1 7 VAL H 1 8 LEU H . . 3.440 2.606 2.548 2.691 . 0 0 "[ . 1 . 2]" 1
107 1 7 VAL H 1 8 LEU MD1 . . 4.670 4.642 4.504 4.688 0.018 5 0 "[ . 1 . 2]" 1
108 1 7 VAL H 1 9 LYS H . . 4.250 3.893 3.796 3.972 . 0 0 "[ . 1 . 2]" 1
109 1 7 VAL H 1 10 GLU H . . 5.170 5.071 4.930 5.174 0.004 15 0 "[ . 1 . 2]" 1
110 1 7 VAL HA 1 7 VAL MG1 . . 3.030 2.495 2.428 2.621 . 0 0 "[ . 1 . 2]" 1
111 1 7 VAL HA 1 7 VAL MG2 . . 2.810 2.379 2.302 2.446 . 0 0 "[ . 1 . 2]" 1
112 1 7 VAL HA 1 9 LYS H . . 4.270 4.310 4.289 4.325 0.055 17 0 "[ . 1 . 2]" 1
113 1 7 VAL HA 1 10 GLU H . . 3.820 3.696 3.517 3.795 . 0 0 "[ . 1 . 2]" 1
114 1 7 VAL HA 1 10 GLU QB . . 3.710 3.488 3.228 3.675 . 0 0 "[ . 1 . 2]" 1
115 1 7 VAL HA 1 10 GLU HG3 . . 5.240 4.996 4.449 5.270 0.030 12 0 "[ . 1 . 2]" 1
116 1 7 VAL HA 1 11 LYS H . . 4.250 4.080 3.962 4.223 . 0 0 "[ . 1 . 2]" 1
117 1 7 VAL HB 1 8 LEU H . . 3.400 2.438 2.308 2.524 . 0 0 "[ . 1 . 2]" 1
118 1 7 VAL MG1 1 8 LEU H . . 3.160 3.155 3.004 3.174 0.014 17 0 "[ . 1 . 2]" 1
119 1 7 VAL MG1 1 8 LEU HA . . 3.760 3.355 3.213 3.486 . 0 0 "[ . 1 . 2]" 1
120 1 7 VAL MG1 1 11 LYS H . . 4.080 3.990 3.750 4.089 0.009 5 0 "[ . 1 . 2]" 1
121 1 7 VAL MG1 1 11 LYS QB . . 3.590 2.822 2.682 3.042 . 0 0 "[ . 1 . 2]" 1
122 1 7 VAL MG1 1 11 LYS QD . . 3.530 2.931 2.733 3.133 . 0 0 "[ . 1 . 2]" 1
123 1 7 VAL MG1 1 11 LYS QE . . 4.650 4.631 4.398 4.686 0.036 13 0 "[ . 1 . 2]" 1
124 1 7 VAL MG1 1 11 LYS QG . . 4.200 4.238 4.046 4.486 0.286 4 0 "[ . 1 . 2]" 1
125 1 8 LEU H 1 8 LEU HB2 . . 3.150 2.306 2.270 2.339 . 0 0 "[ . 1 . 2]" 1
126 1 8 LEU H 1 8 LEU HB3 . . 3.750 3.532 3.508 3.552 . 0 0 "[ . 1 . 2]" 1
127 1 8 LEU H 1 8 LEU MD1 . . 3.520 3.075 2.979 3.122 . 0 0 "[ . 1 . 2]" 1
128 1 8 LEU H 1 9 LYS H . . 3.430 2.805 2.724 2.851 . 0 0 "[ . 1 . 2]" 1
129 1 8 LEU H 1 9 LYS HA . . 5.490 5.461 5.399 5.495 0.005 18 0 "[ . 1 . 2]" 1
130 1 8 LEU H 1 11 LYS QB . . 4.380 4.272 4.172 4.386 0.006 4 0 "[ . 1 . 2]" 1
131 1 8 LEU H 1 31 GLY H . . 6.000 5.989 5.902 6.034 0.034 15 0 "[ . 1 . 2]" 1
132 1 8 LEU HA 1 8 LEU MD1 . . 3.950 3.802 3.773 3.853 . 0 0 "[ . 1 . 2]" 1
133 1 8 LEU HA 1 8 LEU MD2 . . 2.830 2.298 2.241 2.354 . 0 0 "[ . 1 . 2]" 1
134 1 8 LEU HA 1 11 LYS H . . 3.630 3.373 3.186 3.547 . 0 0 "[ . 1 . 2]" 1
135 1 8 LEU HA 1 11 LYS QB . . 3.490 2.135 2.035 2.257 . 0 0 "[ . 1 . 2]" 1
136 1 8 LEU HA 1 11 LYS QD . . 4.160 3.040 2.628 3.422 . 0 0 "[ . 1 . 2]" 1
137 1 8 LEU HA 1 11 LYS QG . . 4.170 4.064 3.887 4.180 0.010 13 0 "[ . 1 . 2]" 1
138 1 8 LEU HA 1 12 GLY H . . 4.230 3.493 3.414 3.634 . 0 0 "[ . 1 . 2]" 1
139 1 8 LEU HB2 1 8 LEU MD1 . . 2.820 2.150 2.123 2.189 . 0 0 "[ . 1 . 2]" 1
140 1 8 LEU HB2 1 9 LYS H . . 3.540 2.814 2.765 2.876 . 0 0 "[ . 1 . 2]" 1
141 1 8 LEU HB2 1 31 GLY H . . 3.940 3.792 3.709 3.877 . 0 0 "[ . 1 . 2]" 1
142 1 8 LEU HB3 1 8 LEU MD1 . . 2.940 2.592 2.514 2.642 . 0 0 "[ . 1 . 2]" 1
143 1 8 LEU HB3 1 8 LEU MD2 . . 2.720 2.306 2.291 2.325 . 0 0 "[ . 1 . 2]" 1
144 1 8 LEU HB3 1 12 GLY H . . 4.680 4.637 4.512 4.696 0.016 1 0 "[ . 1 . 2]" 1
145 1 8 LEU HB3 1 27 CYS HA . . 3.900 3.330 3.195 3.480 . 0 0 "[ . 1 . 2]" 1
146 1 8 LEU HB3 1 31 GLY H . . 3.670 3.377 3.266 3.504 . 0 0 "[ . 1 . 2]" 1
147 1 8 LEU MD1 1 9 LYS H . . 4.440 4.486 4.461 4.504 0.064 16 0 "[ . 1 . 2]" 1
148 1 8 LEU MD1 1 30 LYS H . . 3.900 3.875 3.754 3.916 0.016 20 0 "[ . 1 . 2]" 1
149 1 8 LEU MD1 1 30 LYS HA . . 4.250 4.135 4.027 4.247 . 0 0 "[ . 1 . 2]" 1
150 1 8 LEU MD1 1 30 LYS QB . . 3.100 2.209 2.107 2.298 . 0 0 "[ . 1 . 2]" 1
151 1 8 LEU MD1 1 31 GLY H . . 3.450 2.383 2.182 2.492 . 0 0 "[ . 1 . 2]" 1
152 1 8 LEU MD1 1 31 GLY QA . . 3.450 2.223 2.155 2.342 . 0 0 "[ . 1 . 2]" 1
153 1 8 LEU MD1 1 32 MET H . . 4.830 4.646 4.494 4.737 . 0 0 "[ . 1 . 2]" 1
154 1 8 LEU MD1 1 34 ALA H . . 4.880 4.581 4.417 4.703 . 0 0 "[ . 1 . 2]" 1
155 1 8 LEU MD1 1 34 ALA MB . . 3.790 3.407 3.268 3.572 . 0 0 "[ . 1 . 2]" 1
156 1 8 LEU MD2 1 12 GLY H . . 4.760 4.506 4.301 4.735 . 0 0 "[ . 1 . 2]" 1
157 1 8 LEU MD2 1 27 CYS H . . 4.230 4.289 4.263 4.333 0.103 18 0 "[ . 1 . 2]" 1
158 1 8 LEU MD2 1 27 CYS HA . . 3.680 1.923 1.896 1.955 . 0 0 "[ . 1 . 2]" 1
159 1 8 LEU MD2 1 28 TYR H . . 4.600 4.607 4.557 4.631 0.031 2 0 "[ . 1 . 2]" 1
160 1 8 LEU MD2 1 29 THR H . . 5.280 5.287 5.257 5.300 0.020 2 0 "[ . 1 . 2]" 1
161 1 8 LEU MD2 1 30 LYS H . . 4.100 3.988 3.904 4.073 . 0 0 "[ . 1 . 2]" 1
162 1 8 LEU MD2 1 31 GLY H . . 3.520 3.494 3.400 3.538 0.018 18 0 "[ . 1 . 2]" 1
163 1 9 LYS H 1 9 LYS QB . . 3.710 2.201 2.157 2.259 . 0 0 "[ . 1 . 2]" 1
164 1 9 LYS H 1 9 LYS HE2 . . 4.750 4.513 4.284 4.776 0.026 13 0 "[ . 1 . 2]" 1
165 1 9 LYS H 1 9 LYS HE3 . . 4.940 4.969 4.853 5.006 0.066 2 0 "[ . 1 . 2]" 1
166 1 9 LYS H 1 9 LYS QG . . 4.140 4.001 3.974 4.058 . 0 0 "[ . 1 . 2]" 1
167 1 9 LYS H 1 10 GLU H . . 3.480 2.913 2.801 3.030 . 0 0 "[ . 1 . 2]" 1
168 1 9 LYS HA 1 9 LYS QG . . 3.630 2.520 2.420 2.587 . 0 0 "[ . 1 . 2]" 1
169 1 9 LYS HA 1 28 TYR QD . . 4.320 2.517 2.311 2.670 . 0 0 "[ . 1 . 2]" 1
170 1 9 LYS HA 1 28 TYR QE . . 4.330 2.504 2.236 2.901 . 0 0 "[ . 1 . 2]" 1
171 1 9 LYS QB 1 10 GLU H . . 4.170 2.421 2.318 2.633 . 0 0 "[ . 1 . 2]" 1
172 1 9 LYS QB 1 13 ASN HD22 . . 5.380 4.911 4.451 5.282 . 0 0 "[ . 1 . 2]" 1
173 1 9 LYS QB 1 40 VAL MG1 . . 4.400 4.070 3.903 4.409 0.009 13 0 "[ . 1 . 2]" 1
174 1 9 LYS HE2 1 10 GLU H . . 4.190 3.681 3.304 4.102 . 0 0 "[ . 1 . 2]" 1
175 1 9 LYS HE3 1 10 GLU H . . 4.240 3.411 3.235 3.537 . 0 0 "[ . 1 . 2]" 1
176 1 9 LYS HE3 1 10 GLU HG3 . . 4.190 3.833 3.578 4.192 0.002 8 0 "[ . 1 . 2]" 1
177 1 9 LYS HE3 1 11 LYS H . . 5.730 5.769 5.730 5.833 0.103 10 0 "[ . 1 . 2]" 1
178 1 9 LYS HE3 1 13 ASN HD21 . . 5.610 3.951 3.132 5.069 . 0 0 "[ . 1 . 2]" 1
179 1 9 LYS HE3 1 13 ASN HD22 . . 4.550 3.684 2.994 4.489 . 0 0 "[ . 1 . 2]" 1
180 1 9 LYS HE3 1 40 VAL MG1 . . 4.030 4.066 4.036 4.087 0.057 20 0 "[ . 1 . 2]" 1
181 1 9 LYS QG 1 10 GLU H . . 3.850 3.617 3.452 3.851 0.001 8 0 "[ . 1 . 2]" 1
182 1 9 LYS QG 1 13 ASN HD21 . . 5.210 3.855 3.471 4.727 . 0 0 "[ . 1 . 2]" 1
183 1 9 LYS QG 1 13 ASN HD22 . . 4.480 2.897 2.311 3.310 . 0 0 "[ . 1 . 2]" 1
184 1 9 LYS QG 1 44 ASN H . . 5.520 5.525 5.398 5.596 0.076 17 0 "[ . 1 . 2]" 1
185 1 9 LYS QG 1 44 ASN HD21 . . 4.670 2.874 2.346 4.554 . 0 0 "[ . 1 . 2]" 1
186 1 9 LYS QG 1 44 ASN HD22 . . 5.010 3.297 2.854 4.753 . 0 0 "[ . 1 . 2]" 1
187 1 10 GLU H 1 10 GLU QB . . 3.020 2.353 2.137 2.550 . 0 0 "[ . 1 . 2]" 1
188 1 10 GLU H 1 10 GLU HG2 . . 3.310 2.648 2.323 3.009 . 0 0 "[ . 1 . 2]" 1
189 1 10 GLU H 1 10 GLU HG3 . . 3.900 3.782 3.555 3.931 0.031 9 0 "[ . 1 . 2]" 1
190 1 10 GLU H 1 11 LYS H . . 3.220 2.540 2.385 2.720 . 0 0 "[ . 1 . 2]" 1
191 1 10 GLU H 1 11 LYS QB . . 4.440 4.263 4.132 4.440 . 0 0 "[ . 1 . 2]" 1
192 1 10 GLU H 1 12 GLY H . . 4.550 4.375 4.226 4.474 . 0 0 "[ . 1 . 2]" 1
193 1 10 GLU H 1 13 ASN H . . 5.200 4.734 4.572 5.145 . 0 0 "[ . 1 . 2]" 1
194 1 10 GLU HA 1 10 GLU HG2 . . 3.720 2.897 2.533 3.212 . 0 0 "[ . 1 . 2]" 1
195 1 10 GLU HA 1 10 GLU HG3 . . 3.730 3.721 3.566 3.785 0.055 8 0 "[ . 1 . 2]" 1
196 1 10 GLU HA 1 12 GLY H . . 4.540 4.536 4.435 4.572 0.032 4 0 "[ . 1 . 2]" 1
197 1 10 GLU HA 1 13 ASN H . . 3.800 3.114 2.932 3.604 . 0 0 "[ . 1 . 2]" 1
198 1 10 GLU HA 1 13 ASN HB2 . . 4.110 2.363 2.136 3.443 . 0 0 "[ . 1 . 2]" 1
199 1 10 GLU HA 1 13 ASN HB3 . . 4.750 3.901 3.700 4.752 0.002 14 0 "[ . 1 . 2]" 1
200 1 10 GLU HA 1 13 ASN HD21 . . 4.240 2.328 2.137 2.637 . 0 0 "[ . 1 . 2]" 1
201 1 10 GLU HA 1 13 ASN HD22 . . 4.660 3.376 2.782 3.503 . 0 0 "[ . 1 . 2]" 1
202 1 10 GLU QB 1 11 LYS H . . 3.280 2.856 2.587 2.998 . 0 0 "[ . 1 . 2]" 1
203 1 10 GLU QB 1 11 LYS HA . . 4.040 4.044 3.896 4.092 0.052 13 0 "[ . 1 . 2]" 1
204 1 10 GLU QB 1 12 GLY H . . 5.190 5.016 4.886 5.119 . 0 0 "[ . 1 . 2]" 1
205 1 10 GLU QB 1 13 ASN HD22 . . 5.160 5.151 4.763 5.221 0.061 16 0 "[ . 1 . 2]" 1
206 1 10 GLU HG2 1 11 LYS H . . 4.900 4.641 4.341 4.915 0.015 9 0 "[ . 1 . 2]" 1
207 1 10 GLU HG3 1 11 LYS H . . 5.400 5.206 4.993 5.386 . 0 0 "[ . 1 . 2]" 1
208 1 11 LYS H 1 11 LYS QB . . 2.830 2.224 2.153 2.290 . 0 0 "[ . 1 . 2]" 1
209 1 11 LYS H 1 11 LYS QD . . 4.560 4.359 4.188 4.469 . 0 0 "[ . 1 . 2]" 1
210 1 11 LYS H 1 11 LYS QG . . 4.170 3.998 3.935 4.074 . 0 0 "[ . 1 . 2]" 1
211 1 11 LYS H 1 12 GLY H . . 3.390 2.755 2.633 2.880 . 0 0 "[ . 1 . 2]" 1
212 1 11 LYS H 1 12 GLY HA2 . . 5.530 5.410 5.319 5.503 . 0 0 "[ . 1 . 2]" 1
213 1 11 LYS H 1 13 ASN H . . 4.340 3.879 3.743 4.230 . 0 0 "[ . 1 . 2]" 1
214 1 11 LYS H 1 14 LYS H . . 5.550 5.062 4.703 5.530 . 0 0 "[ . 1 . 2]" 1
215 1 11 LYS H 1 27 CYS HB3 . . 5.420 4.969 4.810 5.156 . 0 0 "[ . 1 . 2]" 1
216 1 11 LYS HA 1 11 LYS QG . . 3.210 2.473 2.341 2.643 . 0 0 "[ . 1 . 2]" 1
217 1 11 LYS HA 1 13 ASN H . . 4.120 4.132 4.026 4.164 0.044 10 0 "[ . 1 . 2]" 1
218 1 11 LYS HA 1 14 LYS H . . 3.860 3.557 3.264 3.832 . 0 0 "[ . 1 . 2]" 1
219 1 11 LYS HA 1 14 LYS QB . . 4.000 3.361 2.982 3.733 . 0 0 "[ . 1 . 2]" 1
220 1 11 LYS QB 1 12 GLY H . . 3.340 2.488 2.394 2.633 . 0 0 "[ . 1 . 2]" 1
221 1 11 LYS QB 1 12 GLY HA2 . . 5.500 4.394 4.290 4.546 . 0 0 "[ . 1 . 2]" 1
222 1 11 LYS QB 1 13 ASN H . . 4.760 4.600 4.520 4.729 . 0 0 "[ . 1 . 2]" 1
223 1 11 LYS QD 1 12 GLY H . . 4.830 4.465 4.310 4.689 . 0 0 "[ . 1 . 2]" 1
224 1 11 LYS QE 1 12 GLY H . . 5.490 5.502 5.266 5.544 0.054 5 0 "[ . 1 . 2]" 1
225 1 11 LYS QE 1 15 TYR QE . . 3.460 2.482 2.163 2.954 . 0 0 "[ . 1 . 2]" 1
226 1 11 LYS QG 1 12 GLY H . . 4.160 3.595 3.487 3.689 . 0 0 "[ . 1 . 2]" 1
227 1 11 LYS QG 1 15 TYR H . . 4.980 4.575 4.373 4.853 . 0 0 "[ . 1 . 2]" 1
228 1 11 LYS QG 1 15 TYR QE . . 3.480 2.817 2.333 3.180 . 0 0 "[ . 1 . 2]" 1
229 1 12 GLY H 1 13 ASN H . . 3.510 2.763 2.673 2.899 . 0 0 "[ . 1 . 2]" 1
230 1 12 GLY H 1 14 LYS H . . 4.720 4.448 4.274 4.663 . 0 0 "[ . 1 . 2]" 1
231 1 12 GLY H 1 15 TYR H . . 5.570 5.076 4.878 5.399 . 0 0 "[ . 1 . 2]" 1
232 1 12 GLY H 1 15 TYR QD . . 5.120 4.490 4.195 4.685 . 0 0 "[ . 1 . 2]" 1
233 1 12 GLY H 1 27 CYS HB2 . . 4.200 3.424 3.266 3.739 . 0 0 "[ . 1 . 2]" 1
234 1 12 GLY H 1 27 CYS HB3 . . 4.170 3.186 2.947 3.335 . 0 0 "[ . 1 . 2]" 1
235 1 12 GLY H 1 28 TYR QD . . 4.840 4.620 4.317 4.843 0.003 2 0 "[ . 1 . 2]" 1
236 1 12 GLY H 1 28 TYR QE . . 4.710 3.520 3.235 3.920 . 0 0 "[ . 1 . 2]" 1
237 1 12 GLY HA2 1 15 TYR H . . 4.280 3.339 3.262 3.572 . 0 0 "[ . 1 . 2]" 1
238 1 12 GLY HA2 1 24 ALA HA . . 4.680 2.155 2.032 2.392 . 0 0 "[ . 1 . 2]" 1
239 1 12 GLY HA2 1 24 ALA MB . . 5.040 3.109 2.838 3.355 . 0 0 "[ . 1 . 2]" 1
240 1 12 GLY HA2 1 27 CYS H . . 4.760 4.692 4.510 4.796 0.036 17 0 "[ . 1 . 2]" 1
241 1 12 GLY HA2 1 28 TYR H . . 5.480 5.382 5.174 5.499 0.019 15 0 "[ . 1 . 2]" 1
242 1 12 GLY HA3 1 13 ASN HA . . 4.610 4.439 4.364 4.472 . 0 0 "[ . 1 . 2]" 1
243 1 12 GLY HA3 1 14 LYS H . . 5.480 4.819 4.605 4.981 . 0 0 "[ . 1 . 2]" 1
244 1 12 GLY HA3 1 15 TYR HB2 . . 4.760 3.976 3.866 4.277 . 0 0 "[ . 1 . 2]" 1
245 1 12 GLY HA3 1 15 TYR QD . . 5.380 3.881 3.653 4.119 . 0 0 "[ . 1 . 2]" 1
246 1 12 GLY HA3 1 24 ALA HA . . 4.120 2.914 2.712 3.154 . 0 0 "[ . 1 . 2]" 1
247 1 12 GLY HA3 1 24 ALA MB . . 4.710 3.312 3.172 3.432 . 0 0 "[ . 1 . 2]" 1
248 1 12 GLY HA3 1 27 CYS H . . 5.320 4.742 4.496 5.069 . 0 0 "[ . 1 . 2]" 1
249 1 12 GLY HA3 1 28 TYR H . . 4.650 4.494 4.196 4.658 0.008 17 0 "[ . 1 . 2]" 1
250 1 13 ASN H 1 13 ASN HB2 . . 3.500 2.434 2.344 2.557 . 0 0 "[ . 1 . 2]" 1
251 1 13 ASN H 1 13 ASN HB3 . . 3.600 3.604 3.576 3.619 0.019 9 0 "[ . 1 . 2]" 1
252 1 13 ASN H 1 13 ASN HD21 . . 5.030 4.083 3.939 4.342 . 0 0 "[ . 1 . 2]" 1
253 1 13 ASN H 1 14 LYS H . . 3.400 2.756 2.673 2.849 . 0 0 "[ . 1 . 2]" 1
254 1 13 ASN H 1 14 LYS QB . . 4.640 4.650 4.581 4.677 0.037 4 0 "[ . 1 . 2]" 1
255 1 13 ASN H 1 15 TYR H . . 4.830 4.454 4.311 4.612 . 0 0 "[ . 1 . 2]" 1
256 1 13 ASN H 1 28 TYR QE . . 4.200 3.451 3.080 3.716 . 0 0 "[ . 1 . 2]" 1
257 1 13 ASN HA 1 14 LYS HA . . 4.950 4.832 4.709 4.951 0.001 10 0 "[ . 1 . 2]" 1
258 1 13 ASN HA 1 14 LYS QB . . 5.470 5.373 5.320 5.436 . 0 0 "[ . 1 . 2]" 1
259 1 13 ASN HA 1 16 PHE H . . 4.330 3.667 3.440 3.928 . 0 0 "[ . 1 . 2]" 1
260 1 13 ASN HA 1 16 PHE QB . . 4.430 2.850 2.558 3.190 . 0 0 "[ . 1 . 2]" 1
261 1 13 ASN HA 1 17 LYS H . . 4.450 4.339 4.096 4.467 0.017 18 0 "[ . 1 . 2]" 1
262 1 13 ASN HA 1 24 ALA MB . . 4.840 4.406 4.005 4.790 . 0 0 "[ . 1 . 2]" 1
263 1 13 ASN HB2 1 14 LYS H . . 3.920 3.030 2.809 3.294 . 0 0 "[ . 1 . 2]" 1
264 1 13 ASN HB3 1 14 LYS H . . 3.960 3.805 3.545 3.975 0.015 9 0 "[ . 1 . 2]" 1
265 1 14 LYS H 1 14 LYS QB . . 2.810 2.326 2.209 2.440 . 0 0 "[ . 1 . 2]" 1
266 1 14 LYS H 1 14 LYS QE . . 5.090 5.059 4.793 5.119 0.029 11 0 "[ . 1 . 2]" 1
267 1 14 LYS H 1 14 LYS HG2 . . 3.950 3.503 3.199 3.660 . 0 0 "[ . 1 . 2]" 1
268 1 14 LYS H 1 14 LYS HG3 . . 3.390 3.042 2.792 3.223 . 0 0 "[ . 1 . 2]" 1
269 1 14 LYS H 1 15 TYR H . . 3.250 2.845 2.709 3.003 . 0 0 "[ . 1 . 2]" 1
270 1 14 LYS H 1 15 TYR HA . . 5.650 5.419 5.286 5.568 . 0 0 "[ . 1 . 2]" 1
271 1 14 LYS H 1 15 TYR HB2 . . 5.930 4.782 4.578 4.962 . 0 0 "[ . 1 . 2]" 1
272 1 14 LYS H 1 15 TYR QD . . 5.510 5.279 5.080 5.462 . 0 0 "[ . 1 . 2]" 1
273 1 14 LYS H 1 16 PHE H . . 5.110 4.535 4.414 4.657 . 0 0 "[ . 1 . 2]" 1
274 1 14 LYS H 1 17 LYS H . . 4.950 4.905 4.783 4.978 0.028 10 0 "[ . 1 . 2]" 1
275 1 14 LYS H 1 17 LYS QB . . 4.790 4.671 4.595 4.746 . 0 0 "[ . 1 . 2]" 1
276 1 14 LYS HA 1 14 LYS HD3 . . 3.540 3.597 3.500 3.658 0.118 7 0 "[ . 1 . 2]" 1
277 1 14 LYS HA 1 14 LYS HG2 . . 3.760 2.178 2.095 2.305 . 0 0 "[ . 1 . 2]" 1
278 1 14 LYS HA 1 16 PHE H . . 5.000 4.888 4.765 5.003 0.003 17 0 "[ . 1 . 2]" 1
279 1 14 LYS HA 1 17 LYS H . . 3.730 3.601 3.454 3.750 0.020 17 0 "[ . 1 . 2]" 1
280 1 14 LYS HA 1 17 LYS QB . . 3.380 2.609 2.466 2.760 . 0 0 "[ . 1 . 2]" 1
281 1 14 LYS HA 1 18 GLN H . . 4.200 4.123 4.039 4.202 0.002 13 0 "[ . 1 . 2]" 1
282 1 14 LYS HA 1 18 GLN HE21 . . 4.920 3.711 3.571 3.868 . 0 0 "[ . 1 . 2]" 1
283 1 14 LYS QB 1 14 LYS HD3 . . 3.270 2.273 2.186 2.340 . 0 0 "[ . 1 . 2]" 1
284 1 14 LYS QB 1 15 TYR H . . 3.090 2.376 2.198 2.484 . 0 0 "[ . 1 . 2]" 1
285 1 14 LYS QB 1 16 PHE H . . 4.930 4.904 4.832 4.946 0.016 9 0 "[ . 1 . 2]" 1
286 1 14 LYS QB 1 18 GLN H . . 4.560 4.568 4.521 4.596 0.036 13 0 "[ . 1 . 2]" 1
287 1 14 LYS QB 1 18 GLN HE21 . . 4.320 2.575 2.267 3.047 . 0 0 "[ . 1 . 2]" 1
288 1 14 LYS QB 1 18 GLN HE22 . . 4.610 3.296 2.808 3.743 . 0 0 "[ . 1 . 2]" 1
289 1 14 LYS HD3 1 18 GLN HE21 . . 4.040 2.271 2.075 2.462 . 0 0 "[ . 1 . 2]" 1
290 1 14 LYS HD3 1 18 GLN HE22 . . 4.410 2.896 2.678 3.231 . 0 0 "[ . 1 . 2]" 1
291 1 14 LYS QE 1 18 GLN HE21 . . 4.180 4.117 3.850 4.202 0.022 15 0 "[ . 1 . 2]" 1
292 1 14 LYS QE 1 18 GLN HE22 . . 4.780 4.726 4.325 4.820 0.040 3 0 "[ . 1 . 2]" 1
293 1 14 LYS HG2 1 15 TYR H . . 4.980 4.837 4.743 4.947 . 0 0 "[ . 1 . 2]" 1
294 1 14 LYS HG2 1 18 GLN HE21 . . 4.310 3.818 3.536 4.127 . 0 0 "[ . 1 . 2]" 1
295 1 14 LYS HG2 1 18 GLN HE22 . . 5.590 5.038 4.781 5.210 . 0 0 "[ . 1 . 2]" 1
296 1 14 LYS HG3 1 15 TYR H . . 5.350 4.623 4.387 4.761 . 0 0 "[ . 1 . 2]" 1
297 1 14 LYS HG3 1 18 GLN HE21 . . 4.760 4.804 4.779 4.836 0.076 14 0 "[ . 1 . 2]" 1
298 1 14 LYS HG3 1 18 GLN HE22 . . 6.000 5.576 5.320 5.795 . 0 0 "[ . 1 . 2]" 1
299 1 15 TYR H 1 15 TYR HB2 . . 3.490 2.465 2.431 2.498 . 0 0 "[ . 1 . 2]" 1
300 1 15 TYR H 1 15 TYR HB3 . . 3.810 3.572 3.538 3.598 . 0 0 "[ . 1 . 2]" 1
301 1 15 TYR H 1 15 TYR QD . . 3.600 3.232 3.173 3.286 . 0 0 "[ . 1 . 2]" 1
302 1 15 TYR H 1 15 TYR QE . . 4.590 4.650 4.610 4.676 0.086 8 0 "[ . 1 . 2]" 1
303 1 15 TYR H 1 16 PHE H . . 3.460 3.190 3.099 3.261 . 0 0 "[ . 1 . 2]" 1
304 1 15 TYR H 1 17 LYS H . . 4.150 4.174 4.137 4.200 0.050 4 0 "[ . 1 . 2]" 1
305 1 15 TYR H 1 17 LYS QB . . 4.790 4.862 4.826 4.900 0.110 7 0 "[ . 1 . 2]" 1
306 1 15 TYR H 1 18 GLN H . . 5.080 4.817 4.731 4.918 . 0 0 "[ . 1 . 2]" 1
307 1 15 TYR H 1 24 ALA MB . . 4.120 4.128 4.106 4.139 0.019 20 0 "[ . 1 . 2]" 1
308 1 15 TYR HA 1 15 TYR QD . . 3.490 2.064 1.997 2.152 . 0 0 "[ . 1 . 2]" 1
309 1 15 TYR HA 1 15 TYR QE . . 4.420 4.369 4.328 4.420 0.000 11 0 "[ . 1 . 2]" 1
310 1 15 TYR HA 1 18 GLN H . . 4.410 3.450 3.312 3.554 . 0 0 "[ . 1 . 2]" 1
311 1 15 TYR HA 1 18 GLN HB2 . . 4.350 3.072 2.730 3.150 . 0 0 "[ . 1 . 2]" 1
312 1 15 TYR HA 1 18 GLN HB3 . . 4.810 4.754 4.340 4.830 0.020 11 0 "[ . 1 . 2]" 1
313 1 15 TYR HA 1 20 LYS HB2 . . 4.360 2.451 2.382 2.553 . 0 0 "[ . 1 . 2]" 1
314 1 15 TYR HA 1 20 LYS HB3 . . 4.290 4.087 3.990 4.216 . 0 0 "[ . 1 . 2]" 1
315 1 15 TYR HA 1 20 LYS QD . . 4.610 2.577 2.393 2.700 . 0 0 "[ . 1 . 2]" 1
316 1 15 TYR HA 1 20 LYS HG2 . . 5.010 5.019 4.892 5.063 0.053 5 0 "[ . 1 . 2]" 1
317 1 15 TYR HA 1 24 ALA H . . 4.990 5.029 5.011 5.052 0.062 20 0 "[ . 1 . 2]" 1
318 1 15 TYR HB2 1 24 ALA H . . 3.870 3.285 3.083 3.411 . 0 0 "[ . 1 . 2]" 1
319 1 15 TYR HB2 1 24 ALA MB . . 4.780 2.236 2.186 2.294 . 0 0 "[ . 1 . 2]" 1
320 1 15 TYR HB3 1 16 PHE H . . 4.290 3.402 3.331 3.457 . 0 0 "[ . 1 . 2]" 1
321 1 15 TYR HB3 1 18 GLN H . . 5.670 5.433 5.277 5.540 . 0 0 "[ . 1 . 2]" 1
322 1 15 TYR HB3 1 20 LYS H . . 4.360 4.066 3.968 4.170 . 0 0 "[ . 1 . 2]" 1
323 1 15 TYR HB3 1 23 GLU H . . 4.440 4.073 3.838 4.221 . 0 0 "[ . 1 . 2]" 1
324 1 15 TYR HB3 1 23 GLU HB3 . . 5.910 3.743 3.321 4.150 . 0 0 "[ . 1 . 2]" 1
325 1 15 TYR HB3 1 24 ALA H . . 4.050 2.554 2.510 2.624 . 0 0 "[ . 1 . 2]" 1
326 1 15 TYR HB3 1 24 ALA HA . . 4.620 3.437 3.282 3.629 . 0 0 "[ . 1 . 2]" 1
327 1 15 TYR HB3 1 24 ALA MB . . 3.790 2.533 2.401 2.796 . 0 0 "[ . 1 . 2]" 1
328 1 15 TYR HB3 1 25 ILE H . . 5.970 5.258 5.107 5.415 . 0 0 "[ . 1 . 2]" 1
329 1 15 TYR QD 1 16 PHE H . . 4.590 4.497 4.382 4.568 . 0 0 "[ . 1 . 2]" 1
330 1 15 TYR QD 1 18 GLN HB2 . . 4.090 3.987 3.650 4.112 0.022 3 0 "[ . 1 . 2]" 1
331 1 15 TYR QD 1 20 LYS H . . 4.810 4.814 4.613 4.851 0.041 19 0 "[ . 1 . 2]" 1
332 1 15 TYR QD 1 20 LYS HB3 . . 3.910 3.787 3.443 3.933 0.023 19 0 "[ . 1 . 2]" 1
333 1 15 TYR QD 1 23 GLU H . . 5.210 5.063 4.923 5.151 . 0 0 "[ . 1 . 2]" 1
334 1 15 TYR QD 1 23 GLU HA . . 5.120 4.522 4.267 4.752 . 0 0 "[ . 1 . 2]" 1
335 1 15 TYR QD 1 23 GLU HB3 . . 3.980 3.224 2.728 3.599 . 0 0 "[ . 1 . 2]" 1
336 1 15 TYR QD 1 23 GLU QG . . 4.920 4.469 3.705 4.996 0.076 16 0 "[ . 1 . 2]" 1
337 1 15 TYR QD 1 24 ALA H . . 4.180 3.680 3.486 3.916 . 0 0 "[ . 1 . 2]" 1
338 1 15 TYR QD 1 24 ALA HA . . 3.710 2.382 2.226 2.605 . 0 0 "[ . 1 . 2]" 1
339 1 15 TYR QD 1 24 ALA MB . . 4.080 3.575 3.446 3.665 . 0 0 "[ . 1 . 2]" 1
340 1 15 TYR QD 1 25 ILE H . . 5.430 5.409 5.275 5.465 0.035 11 0 "[ . 1 . 2]" 1
341 1 15 TYR QD 1 27 CYS H . . 4.620 4.258 4.103 4.412 . 0 0 "[ . 1 . 2]" 1
342 1 15 TYR QE 1 20 LYS QD . . 3.300 3.275 3.065 3.485 0.185 11 0 "[ . 1 . 2]" 1
343 1 15 TYR QE 1 23 GLU H . . 6.000 6.029 6.003 6.056 0.056 7 0 "[ . 1 . 2]" 1
344 1 15 TYR QE 1 23 GLU QG . . 4.090 4.251 3.303 4.872 0.782 7 9 "[ *.*+ -* *** *2]" 1
345 1 15 TYR QE 1 24 ALA H . . 5.490 5.368 5.238 5.491 0.001 11 0 "[ . 1 . 2]" 1
346 1 15 TYR QE 1 24 ALA HA . . 4.820 4.572 4.403 4.823 0.003 13 0 "[ . 1 . 2]" 1
347 1 16 PHE H 1 16 PHE QB . . 3.750 2.151 2.113 2.198 . 0 0 "[ . 1 . 2]" 1
348 1 16 PHE H 1 16 PHE QD . . 4.310 4.126 4.059 4.187 . 0 0 "[ . 1 . 2]" 1
349 1 16 PHE H 1 17 LYS H . . 3.560 2.757 2.701 2.791 . 0 0 "[ . 1 . 2]" 1
350 1 16 PHE H 1 17 LYS HA . . 5.450 5.419 5.354 5.451 0.001 2 0 "[ . 1 . 2]" 1
351 1 16 PHE H 1 17 LYS QB . . 4.540 4.415 4.331 4.488 . 0 0 "[ . 1 . 2]" 1
352 1 16 PHE H 1 18 GLN H . . 4.620 4.434 4.332 4.531 . 0 0 "[ . 1 . 2]" 1
353 1 16 PHE H 1 24 ALA H . . 5.140 4.663 4.469 4.777 . 0 0 "[ . 1 . 2]" 1
354 1 16 PHE H 1 24 ALA MB . . 3.600 2.312 2.241 2.389 . 0 0 "[ . 1 . 2]" 1
355 1 16 PHE HA 1 16 PHE QD . . 3.990 3.207 3.134 3.298 . 0 0 "[ . 1 . 2]" 1
356 1 16 PHE HA 1 18 GLN H . . 4.960 4.590 4.482 4.750 . 0 0 "[ . 1 . 2]" 1
357 1 16 PHE HA 1 19 GLY H . . 4.160 3.587 3.431 3.736 . 0 0 "[ . 1 . 2]" 1
358 1 16 PHE HA 1 20 LYS H . . 4.260 3.599 3.493 3.747 . 0 0 "[ . 1 . 2]" 1
359 1 16 PHE HA 1 20 LYS HA . . 5.360 5.398 5.378 5.416 0.056 16 0 "[ . 1 . 2]" 1
360 1 16 PHE HA 1 21 TYR H . . 4.760 4.312 4.144 4.493 . 0 0 "[ . 1 . 2]" 1
361 1 16 PHE HA 1 21 TYR QD . . 4.320 2.452 2.364 2.575 . 0 0 "[ . 1 . 2]" 1
362 1 16 PHE HA 1 21 TYR QE . . 4.190 3.146 2.947 3.572 . 0 0 "[ . 1 . 2]" 1
363 1 16 PHE HA 1 24 ALA MB . . 3.310 3.017 2.934 3.111 . 0 0 "[ . 1 . 2]" 1
364 1 16 PHE QB 1 17 LYS H . . 3.890 2.943 2.834 3.073 . 0 0 "[ . 1 . 2]" 1
365 1 16 PHE QB 1 24 ALA MB . . 3.910 2.389 2.333 2.463 . 0 0 "[ . 1 . 2]" 1
366 1 16 PHE QB 1 48 ALA H . . 4.840 4.857 4.842 4.884 0.044 18 0 "[ . 1 . 2]" 1
367 1 16 PHE QD 1 17 LYS H . . 3.840 3.311 3.039 3.440 . 0 0 "[ . 1 . 2]" 1
368 1 16 PHE QD 1 17 LYS HA . . 4.020 3.071 2.844 3.241 . 0 0 "[ . 1 . 2]" 1
369 1 16 PHE QD 1 17 LYS HG2 . . 5.280 5.307 5.288 5.340 0.060 19 0 "[ . 1 . 2]" 1
370 1 16 PHE QD 1 17 LYS HG3 . . 4.810 4.182 4.071 4.363 . 0 0 "[ . 1 . 2]" 1
371 1 16 PHE QD 1 21 TYR H . . 6.000 6.009 5.994 6.023 0.023 2 0 "[ . 1 . 2]" 1
372 1 16 PHE QD 1 21 TYR QE . . 3.880 3.248 2.949 3.636 . 0 0 "[ . 1 . 2]" 1
373 1 16 PHE QD 1 24 ALA MB . . 3.910 3.738 3.588 3.888 . 0 0 "[ . 1 . 2]" 1
374 1 16 PHE QD 1 47 SER H . . 5.860 5.849 5.749 5.889 0.029 2 0 "[ . 1 . 2]" 1
375 1 16 PHE QD 1 48 ALA H . . 3.790 3.680 3.551 3.802 0.012 3 0 "[ . 1 . 2]" 1
376 1 16 PHE QD 1 48 ALA HA . . 3.790 2.349 2.281 2.492 . 0 0 "[ . 1 . 2]" 1
377 1 16 PHE QD 1 48 ALA MB . . 3.620 2.490 2.364 2.659 . 0 0 "[ . 1 . 2]" 1
378 1 17 LYS H 1 17 LYS QB . . 2.790 2.226 2.184 2.288 . 0 0 "[ . 1 . 2]" 1
379 1 17 LYS H 1 17 LYS HG2 . . 4.510 4.499 4.371 4.533 0.023 12 0 "[ . 1 . 2]" 1
380 1 17 LYS H 1 17 LYS HG3 . . 4.500 4.402 4.246 4.517 0.017 19 0 "[ . 1 . 2]" 1
381 1 17 LYS H 1 18 GLN H . . 3.350 2.437 2.379 2.500 . 0 0 "[ . 1 . 2]" 1
382 1 17 LYS H 1 18 GLN HA . . 5.110 5.143 5.122 5.159 0.049 14 0 "[ . 1 . 2]" 1
383 1 17 LYS H 1 18 GLN HG2 . . 5.040 5.049 4.921 5.110 0.070 18 0 "[ . 1 . 2]" 1
384 1 17 LYS H 1 19 GLY H . . 4.000 3.677 3.591 3.838 . 0 0 "[ . 1 . 2]" 1
385 1 17 LYS H 1 21 TYR QD . . 6.000 5.790 5.684 5.889 . 0 0 "[ . 1 . 2]" 1
386 1 17 LYS H 1 24 ALA MB . . 4.530 4.579 4.551 4.599 0.069 17 0 "[ . 1 . 2]" 1
387 1 17 LYS HA 1 17 LYS HG2 . . 3.330 2.808 2.554 3.063 . 0 0 "[ . 1 . 2]" 1
388 1 17 LYS HA 1 17 LYS HG3 . . 3.210 2.521 2.392 2.701 . 0 0 "[ . 1 . 2]" 1
389 1 17 LYS HA 1 19 GLY H . . 4.160 3.873 3.728 4.066 . 0 0 "[ . 1 . 2]" 1
390 1 17 LYS QB 1 18 GLN H . . 3.220 2.646 2.454 2.797 . 0 0 "[ . 1 . 2]" 1
391 1 17 LYS QB 1 18 GLN HE21 . . 4.810 4.310 3.990 4.641 . 0 0 "[ . 1 . 2]" 1
392 1 17 LYS QB 1 18 GLN HG3 . . 3.510 3.285 3.044 3.518 0.008 19 0 "[ . 1 . 2]" 1
393 1 17 LYS QD 1 18 GLN H . . 5.090 4.731 4.477 4.894 . 0 0 "[ . 1 . 2]" 1
394 1 17 LYS QD 1 18 GLN HE21 . . 5.150 4.899 4.546 5.163 0.013 17 0 "[ . 1 . 2]" 1
395 1 17 LYS QE 1 17 LYS HG2 . . 3.650 3.066 2.344 3.527 . 0 0 "[ . 1 . 2]" 1
396 1 17 LYS QE 1 17 LYS HG3 . . 3.630 2.603 2.307 3.242 . 0 0 "[ . 1 . 2]" 1
397 1 17 LYS HG2 1 18 GLN H . . 4.470 4.226 3.954 4.384 . 0 0 "[ . 1 . 2]" 1
398 1 17 LYS HG3 1 18 GLN H . . 5.090 5.030 4.944 5.120 0.030 9 0 "[ . 1 . 2]" 1
399 1 18 GLN H 1 18 GLN HB2 . . 3.270 2.655 2.533 2.753 . 0 0 "[ . 1 . 2]" 1
400 1 18 GLN H 1 18 GLN HB3 . . 3.780 3.639 3.598 3.693 . 0 0 "[ . 1 . 2]" 1
401 1 18 GLN H 1 18 GLN HE21 . . 4.360 4.367 4.270 4.394 0.034 11 0 "[ . 1 . 2]" 1
402 1 18 GLN H 1 18 GLN HG2 . . 3.340 2.937 2.827 3.056 . 0 0 "[ . 1 . 2]" 1
403 1 18 GLN H 1 18 GLN HG3 . . 3.470 2.040 1.958 2.129 . 0 0 "[ . 1 . 2]" 1
404 1 18 GLN H 1 19 GLY H . . 3.100 2.567 2.508 2.659 . 0 0 "[ . 1 . 2]" 1
405 1 18 GLN H 1 19 GLY HA2 . . 5.110 4.954 4.876 5.055 . 0 0 "[ . 1 . 2]" 1
406 1 18 GLN H 1 19 GLY HA3 . . 6.000 5.340 5.285 5.415 . 0 0 "[ . 1 . 2]" 1
407 1 18 GLN H 1 20 LYS H . . 4.070 3.673 3.588 3.748 . 0 0 "[ . 1 . 2]" 1
408 1 18 GLN H 1 20 LYS QD . . 4.310 4.318 4.218 4.349 0.039 3 0 "[ . 1 . 2]" 1
409 1 18 GLN H 1 20 LYS HG3 . . 5.120 4.926 4.504 5.128 0.008 13 0 "[ . 1 . 2]" 1
410 1 18 GLN HA 1 18 GLN HG2 . . 3.490 2.540 2.452 2.647 . 0 0 "[ . 1 . 2]" 1
411 1 18 GLN HA 1 18 GLN HG3 . . 3.550 3.338 3.190 3.438 . 0 0 "[ . 1 . 2]" 1
412 1 18 GLN HA 1 19 GLY HA3 . . 4.710 4.626 4.530 4.680 . 0 0 "[ . 1 . 2]" 1
413 1 18 GLN HB2 1 18 GLN HE21 . . 4.430 4.397 4.333 4.438 0.008 5 0 "[ . 1 . 2]" 1
414 1 18 GLN HB2 1 18 GLN HE22 . . 4.770 4.764 4.639 4.824 0.054 4 0 "[ . 1 . 2]" 1
415 1 18 GLN HB2 1 19 GLY H . . 4.000 3.332 3.166 3.612 . 0 0 "[ . 1 . 2]" 1
416 1 18 GLN HB2 1 20 LYS H . . 4.160 3.086 2.867 3.322 . 0 0 "[ . 1 . 2]" 1
417 1 18 GLN HB3 1 18 GLN HE21 . . 4.460 4.452 4.408 4.480 0.020 12 0 "[ . 1 . 2]" 1
418 1 18 GLN HB3 1 18 GLN HE22 . . 4.620 4.663 4.633 4.701 0.081 18 0 "[ . 1 . 2]" 1
419 1 18 GLN HB3 1 20 LYS H . . 4.670 4.475 4.238 4.682 0.012 2 0 "[ . 1 . 2]" 1
420 1 18 GLN HE21 1 18 GLN HG2 . . 3.520 2.608 2.528 2.742 . 0 0 "[ . 1 . 2]" 1
421 1 18 GLN HE21 1 18 GLN HG3 . . 3.450 2.464 2.401 2.547 . 0 0 "[ . 1 . 2]" 1
422 1 18 GLN HE21 1 20 LYS QE . . 5.180 5.091 4.841 5.207 0.027 8 0 "[ . 1 . 2]" 1
423 1 18 GLN HE22 1 18 GLN HG2 . . 3.860 3.666 3.552 3.780 . 0 0 "[ . 1 . 2]" 1
424 1 18 GLN HE22 1 18 GLN HG3 . . 3.760 3.547 3.486 3.605 . 0 0 "[ . 1 . 2]" 1
425 1 18 GLN HE22 1 20 LYS QE . . 4.780 4.367 3.950 4.606 . 0 0 "[ . 1 . 2]" 1
426 1 18 GLN HG2 1 19 GLY H . . 4.830 4.860 4.844 4.884 0.054 10 0 "[ . 1 . 2]" 1
427 1 18 GLN HG3 1 19 GLY H . . 4.440 4.287 4.221 4.378 . 0 0 "[ . 1 . 2]" 1
428 1 18 GLN HG3 1 20 LYS H . . 4.690 4.742 4.702 4.774 0.084 14 0 "[ . 1 . 2]" 1
429 1 19 GLY H 1 20 LYS HB2 . . 4.670 4.445 4.298 4.601 . 0 0 "[ . 1 . 2]" 1
430 1 19 GLY H 1 20 LYS QD . . 4.710 4.737 4.621 4.764 0.054 2 0 "[ . 1 . 2]" 1
431 1 19 GLY H 1 20 LYS HG2 . . 5.950 5.749 5.373 5.962 0.012 19 0 "[ . 1 . 2]" 1
432 1 19 GLY H 1 20 LYS HG3 . . 4.680 4.104 3.736 4.348 . 0 0 "[ . 1 . 2]" 1
433 1 19 GLY H 1 21 TYR H . . 5.600 5.109 4.942 5.337 . 0 0 "[ . 1 . 2]" 1
434 1 19 GLY H 1 21 TYR QE . . 4.450 4.301 4.090 4.452 0.002 18 0 "[ . 1 . 2]" 1
435 1 19 GLY HA2 1 21 TYR H . . 4.980 4.171 4.010 4.366 . 0 0 "[ . 1 . 2]" 1
436 1 19 GLY HA2 1 21 TYR QE . . 4.350 3.119 2.776 3.367 . 0 0 "[ . 1 . 2]" 1
437 1 19 GLY HA3 1 21 TYR QE . . 4.870 4.212 3.957 4.425 . 0 0 "[ . 1 . 2]" 1
438 1 20 LYS H 1 20 LYS HB2 . . 3.500 2.454 2.395 2.521 . 0 0 "[ . 1 . 2]" 1
439 1 20 LYS H 1 20 LYS HB3 . . 3.810 3.601 3.550 3.631 . 0 0 "[ . 1 . 2]" 1
440 1 20 LYS H 1 20 LYS QD . . 3.500 3.455 3.385 3.519 0.019 6 0 "[ . 1 . 2]" 1
441 1 20 LYS H 1 20 LYS QE . . 4.640 4.489 4.190 4.681 0.041 10 0 "[ . 1 . 2]" 1
442 1 20 LYS H 1 20 LYS HG2 . . 4.170 3.850 3.585 3.963 . 0 0 "[ . 1 . 2]" 1
443 1 20 LYS H 1 20 LYS HG3 . . 3.700 2.525 2.266 2.652 . 0 0 "[ . 1 . 2]" 1
444 1 20 LYS H 1 21 TYR H . . 4.060 3.613 3.502 3.725 . 0 0 "[ . 1 . 2]" 1
445 1 20 LYS H 1 21 TYR QE . . 5.050 4.981 4.790 5.065 0.015 15 0 "[ . 1 . 2]" 1
446 1 20 LYS H 1 23 GLU H . . 5.870 5.827 5.727 5.901 0.031 20 0 "[ . 1 . 2]" 1
447 1 20 LYS H 1 24 ALA H . . 5.480 5.429 5.321 5.489 0.009 8 0 "[ . 1 . 2]" 1
448 1 20 LYS HA 1 20 LYS QE . . 5.290 5.058 4.816 5.183 . 0 0 "[ . 1 . 2]" 1
449 1 20 LYS HA 1 20 LYS HG2 . . 3.640 2.796 2.690 2.874 . 0 0 "[ . 1 . 2]" 1
450 1 20 LYS HA 1 21 TYR H . . 2.910 2.374 2.330 2.410 . 0 0 "[ . 1 . 2]" 1
451 1 20 LYS HA 1 21 TYR HB2 . . 5.660 4.785 4.730 4.842 . 0 0 "[ . 1 . 2]" 1
452 1 20 LYS HA 1 22 ASP H . . 3.750 3.643 3.493 3.767 0.017 9 0 "[ . 1 . 2]" 1
453 1 20 LYS HA 1 23 GLU H . . 4.530 4.065 3.874 4.175 . 0 0 "[ . 1 . 2]" 1
454 1 20 LYS HB2 1 23 GLU HB3 . . 5.980 4.651 4.314 4.919 . 0 0 "[ . 1 . 2]" 1
455 1 20 LYS HB3 1 21 TYR H . . 4.120 4.212 4.194 4.228 0.108 14 0 "[ . 1 . 2]" 1
456 1 20 LYS QD 1 23 GLU HB3 . . 6.000 4.521 4.065 4.882 . 0 0 "[ . 1 . 2]" 1
457 1 20 LYS HG3 1 21 TYR H . . 5.010 4.911 4.786 5.005 . 0 0 "[ . 1 . 2]" 1
458 1 21 TYR H 1 21 TYR HB2 . . 3.590 2.595 2.528 2.651 . 0 0 "[ . 1 . 2]" 1
459 1 21 TYR H 1 21 TYR HB3 . . 3.780 3.611 3.586 3.632 . 0 0 "[ . 1 . 2]" 1
460 1 21 TYR H 1 21 TYR QE . . 4.430 4.277 4.129 4.441 0.011 19 0 "[ . 1 . 2]" 1
461 1 21 TYR H 1 22 ASP H . . 3.080 2.810 2.729 2.928 . 0 0 "[ . 1 . 2]" 1
462 1 21 TYR H 1 22 ASP HB2 . . 4.740 4.751 4.682 4.767 0.027 19 0 "[ . 1 . 2]" 1
463 1 21 TYR H 1 23 GLU H . . 4.480 4.385 4.281 4.494 0.014 20 0 "[ . 1 . 2]" 1
464 1 21 TYR H 1 24 ALA H . . 4.780 4.753 4.658 4.804 0.024 3 0 "[ . 1 . 2]" 1
465 1 21 TYR H 1 24 ALA MB . . 4.560 4.531 4.451 4.582 0.022 9 0 "[ . 1 . 2]" 1
466 1 21 TYR H 1 48 ALA MB . . 5.040 4.966 4.848 5.048 0.008 11 0 "[ . 1 . 2]" 1
467 1 21 TYR H 1 52 LEU MD1 . . 4.740 4.595 4.359 4.748 0.008 6 0 "[ . 1 . 2]" 1
468 1 21 TYR H 1 52 LEU MD2 . . 4.050 3.952 3.771 4.061 0.011 19 0 "[ . 1 . 2]" 1
469 1 21 TYR HA 1 21 TYR QD . . 3.560 2.333 2.246 2.418 . 0 0 "[ . 1 . 2]" 1
470 1 21 TYR HA 1 21 TYR QE . . 4.600 4.514 4.453 4.600 . 0 0 "[ . 1 . 2]" 1
471 1 21 TYR HA 1 23 GLU H . . 4.910 4.445 4.269 4.597 . 0 0 "[ . 1 . 2]" 1
472 1 21 TYR HA 1 24 ALA H . . 3.900 3.390 3.322 3.480 . 0 0 "[ . 1 . 2]" 1
473 1 21 TYR HA 1 24 ALA MB . . 3.550 2.388 2.298 2.540 . 0 0 "[ . 1 . 2]" 1
474 1 21 TYR HA 1 25 ILE H . . 4.880 3.917 3.805 4.140 . 0 0 "[ . 1 . 2]" 1
475 1 21 TYR HA 1 48 ALA MB . . 4.410 2.768 2.636 2.898 . 0 0 "[ . 1 . 2]" 1
476 1 21 TYR HA 1 52 LEU MD2 . . 4.920 4.866 4.725 4.924 0.004 14 0 "[ . 1 . 2]" 1
477 1 21 TYR HB2 1 22 ASP H . . 3.880 2.852 2.707 2.985 . 0 0 "[ . 1 . 2]" 1
478 1 21 TYR HB2 1 23 GLU H . . 5.390 5.252 5.171 5.393 0.003 18 0 "[ . 1 . 2]" 1
479 1 21 TYR HB2 1 25 ILE MD . . 4.630 3.936 3.786 4.050 . 0 0 "[ . 1 . 2]" 1
480 1 21 TYR HB2 1 52 LEU MD1 . . 4.050 2.475 2.311 2.678 . 0 0 "[ . 1 . 2]" 1
481 1 21 TYR HB2 1 52 LEU MD2 . . 3.170 2.198 2.111 2.243 . 0 0 "[ . 1 . 2]" 1
482 1 21 TYR HB2 1 52 LEU HG . . 4.980 2.660 2.460 2.927 . 0 0 "[ . 1 . 2]" 1
483 1 21 TYR HB3 1 22 ASP H . . 4.280 3.929 3.846 3.990 . 0 0 "[ . 1 . 2]" 1
484 1 21 TYR HB3 1 48 ALA HA . . 4.460 3.245 3.066 3.390 . 0 0 "[ . 1 . 2]" 1
485 1 21 TYR HB3 1 52 LEU MD1 . . 4.460 2.826 2.623 3.046 . 0 0 "[ . 1 . 2]" 1
486 1 21 TYR QD 1 22 ASP H . . 4.700 4.414 4.208 4.603 . 0 0 "[ . 1 . 2]" 1
487 1 21 TYR QD 1 24 ALA MB . . 3.890 3.597 3.439 3.907 0.017 8 0 "[ . 1 . 2]" 1
488 1 21 TYR QD 1 48 ALA MB . . 3.810 2.967 2.798 3.114 . 0 0 "[ . 1 . 2]" 1
489 1 21 TYR QD 1 52 LEU HA . . 4.320 4.341 4.325 4.360 0.040 9 0 "[ . 1 . 2]" 1
490 1 21 TYR QD 1 52 LEU MD1 . . 4.140 3.887 3.723 4.094 . 0 0 "[ . 1 . 2]" 1
491 1 21 TYR QD 1 52 LEU MD2 . . 3.090 2.204 2.077 2.323 . 0 0 "[ . 1 . 2]" 1
492 1 21 TYR QE 1 48 ALA HA . . 4.690 4.253 3.989 4.564 . 0 0 "[ . 1 . 2]" 1
493 1 21 TYR QE 1 48 ALA MB . . 4.830 4.712 4.524 4.848 0.018 4 0 "[ . 1 . 2]" 1
494 1 21 TYR QE 1 51 ARG HB3 . . 3.970 2.965 2.758 3.147 . 0 0 "[ . 1 . 2]" 1
495 1 21 TYR QE 1 51 ARG HD2 . . 4.710 4.446 4.030 4.751 0.041 4 0 "[ . 1 . 2]" 1
496 1 21 TYR QE 1 51 ARG HG2 . . 4.500 4.239 3.950 4.495 . 0 0 "[ . 1 . 2]" 1
497 1 21 TYR QE 1 51 ARG HG3 . . 4.440 2.802 2.479 3.201 . 0 0 "[ . 1 . 2]" 1
498 1 21 TYR QE 1 52 LEU MD2 . . 4.110 3.876 3.671 4.103 . 0 0 "[ . 1 . 2]" 1
499 1 22 ASP H 1 22 ASP HB2 . . 3.010 2.210 2.039 2.320 . 0 0 "[ . 1 . 2]" 1
500 1 22 ASP H 1 22 ASP HB3 . . 3.600 3.402 2.741 3.570 . 0 0 "[ . 1 . 2]" 1
501 1 22 ASP H 1 23 GLU H . . 3.090 2.654 2.494 2.736 . 0 0 "[ . 1 . 2]" 1
502 1 22 ASP H 1 23 GLU HA . . 5.290 5.307 5.229 5.340 0.050 3 0 "[ . 1 . 2]" 1
503 1 22 ASP H 1 23 GLU HB2 . . 4.850 4.788 4.485 4.877 0.027 6 0 "[ . 1 . 2]" 1
504 1 22 ASP H 1 24 ALA H . . 4.120 4.033 3.817 4.136 0.016 16 0 "[ . 1 . 2]" 1
505 1 22 ASP H 1 24 ALA MB . . 4.710 4.629 4.491 4.705 . 0 0 "[ . 1 . 2]" 1
506 1 22 ASP H 1 25 ILE MD . . 4.560 4.249 4.010 4.404 . 0 0 "[ . 1 . 2]" 1
507 1 22 ASP H 1 52 LEU MD1 . . 3.890 3.392 3.091 3.671 . 0 0 "[ . 1 . 2]" 1
508 1 22 ASP H 1 52 LEU MD2 . . 4.100 3.740 3.509 4.089 . 0 0 "[ . 1 . 2]" 1
509 1 22 ASP HA 1 25 ILE H . . 4.080 3.573 3.235 3.832 . 0 0 "[ . 1 . 2]" 1
510 1 22 ASP HA 1 25 ILE HB . . 3.670 2.828 2.548 3.108 . 0 0 "[ . 1 . 2]" 1
511 1 22 ASP HA 1 25 ILE MD . . 3.500 2.574 2.314 2.798 . 0 0 "[ . 1 . 2]" 1
512 1 22 ASP HA 1 25 ILE MG . . 4.910 4.202 3.998 4.436 . 0 0 "[ . 1 . 2]" 1
513 1 22 ASP HA 1 26 ASP H . . 4.790 4.130 3.830 4.392 . 0 0 "[ . 1 . 2]" 1
514 1 22 ASP HA 1 52 LEU MD1 . . 3.860 3.105 2.762 3.413 . 0 0 "[ . 1 . 2]" 1
515 1 22 ASP HB2 1 23 GLU H . . 3.400 2.895 2.578 3.451 0.051 20 0 "[ . 1 . 2]" 1
516 1 22 ASP HB2 1 24 ALA H . . 5.300 5.143 4.950 5.382 0.082 20 0 "[ . 1 . 2]" 1
517 1 22 ASP HB2 1 25 ILE MD . . 5.530 5.006 4.315 5.371 . 0 0 "[ . 1 . 2]" 1
518 1 22 ASP HB3 1 23 GLU H . . 3.430 3.292 2.425 3.468 0.038 18 0 "[ . 1 . 2]" 1
519 1 22 ASP HB3 1 23 GLU QG . . 4.770 4.156 2.888 4.781 0.011 17 0 "[ . 1 . 2]" 1
520 1 22 ASP HB3 1 25 ILE MD . . 5.450 4.946 4.558 5.386 . 0 0 "[ . 1 . 2]" 1
521 1 22 ASP HB3 1 52 LEU MD1 . . 5.380 4.672 4.196 5.066 . 0 0 "[ . 1 . 2]" 1
522 1 23 GLU H 1 23 GLU HB2 . . 3.590 2.381 2.229 2.484 . 0 0 "[ . 1 . 2]" 1
523 1 23 GLU H 1 23 GLU HB3 . . 3.640 3.585 3.513 3.638 . 0 0 "[ . 1 . 2]" 1
524 1 23 GLU H 1 23 GLU QG . . 3.540 2.932 2.143 3.571 0.031 20 0 "[ . 1 . 2]" 1
525 1 23 GLU H 1 24 ALA H . . 3.430 2.557 2.411 2.672 . 0 0 "[ . 1 . 2]" 1
526 1 23 GLU H 1 24 ALA MB . . 4.310 4.210 4.116 4.296 . 0 0 "[ . 1 . 2]" 1
527 1 23 GLU H 1 25 ILE H . . 5.170 4.221 4.070 4.340 . 0 0 "[ . 1 . 2]" 1
528 1 23 GLU H 1 26 ASP H . . 5.000 4.649 4.511 4.803 . 0 0 "[ . 1 . 2]" 1
529 1 23 GLU H 1 26 ASP QB . . 5.260 4.606 4.429 4.842 . 0 0 "[ . 1 . 2]" 1
530 1 23 GLU HA 1 23 GLU QG . . 3.270 2.381 2.234 2.937 . 0 0 "[ . 1 . 2]" 1
531 1 23 GLU HA 1 25 ILE H . . 4.620 4.507 4.272 4.625 0.005 1 0 "[ . 1 . 2]" 1
532 1 23 GLU HA 1 26 ASP H . . 3.800 3.251 2.898 3.566 . 0 0 "[ . 1 . 2]" 1
533 1 23 GLU HA 1 26 ASP HB2 . . 4.020 3.049 2.455 3.474 . 0 0 "[ . 1 . 2]" 1
534 1 23 GLU HA 1 26 ASP QB . . 3.530 2.304 2.114 2.685 . 0 0 "[ . 1 . 2]" 1
535 1 23 GLU HA 1 26 ASP HB3 . . 4.020 2.397 2.161 2.831 . 0 0 "[ . 1 . 2]" 1
536 1 23 GLU HA 1 27 CYS H . . 5.730 4.379 4.189 4.715 . 0 0 "[ . 1 . 2]" 1
537 1 23 GLU HB2 1 24 ALA H . . 3.940 2.918 2.769 3.057 . 0 0 "[ . 1 . 2]" 1
538 1 23 GLU HB3 1 24 ALA H . . 3.970 3.749 3.560 3.925 . 0 0 "[ . 1 . 2]" 1
539 1 23 GLU QG 1 24 ALA H . . 4.780 4.433 4.054 4.735 . 0 0 "[ . 1 . 2]" 1
540 1 24 ALA H 1 24 ALA MB . . 2.950 2.225 2.198 2.261 . 0 0 "[ . 1 . 2]" 1
541 1 24 ALA H 1 25 ILE H . . 3.760 2.867 2.748 2.960 . 0 0 "[ . 1 . 2]" 1
542 1 24 ALA H 1 26 ASP H . . 4.130 4.125 4.067 4.173 0.043 2 0 "[ . 1 . 2]" 1
543 1 24 ALA H 1 27 CYS H . . 5.520 4.911 4.807 5.011 . 0 0 "[ . 1 . 2]" 1
544 1 24 ALA HA 1 27 CYS H . . 3.910 3.497 3.352 3.603 . 0 0 "[ . 1 . 2]" 1
545 1 24 ALA HA 1 27 CYS HB2 . . 5.100 3.171 2.997 3.342 . 0 0 "[ . 1 . 2]" 1
546 1 24 ALA HA 1 28 TYR H . . 5.140 4.571 4.327 4.883 . 0 0 "[ . 1 . 2]" 1
547 1 24 ALA MB 1 25 ILE H . . 3.450 2.422 2.356 2.468 . 0 0 "[ . 1 . 2]" 1
548 1 24 ALA MB 1 25 ILE MD . . 4.260 4.166 4.057 4.238 . 0 0 "[ . 1 . 2]" 1
549 1 24 ALA MB 1 26 ASP H . . 4.440 4.461 4.450 4.475 0.035 17 0 "[ . 1 . 2]" 1
550 1 24 ALA MB 1 27 CYS H . . 4.720 4.584 4.483 4.673 . 0 0 "[ . 1 . 2]" 1
551 1 24 ALA MB 1 28 TYR H . . 5.290 4.889 4.707 5.165 . 0 0 "[ . 1 . 2]" 1
552 1 25 ILE H 1 25 ILE HB . . 3.520 2.439 2.383 2.492 . 0 0 "[ . 1 . 2]" 1
553 1 25 ILE H 1 25 ILE MD . . 3.540 3.315 3.226 3.406 . 0 0 "[ . 1 . 2]" 1
554 1 25 ILE H 1 25 ILE HG12 . . 4.140 3.688 3.625 3.745 . 0 0 "[ . 1 . 2]" 1
555 1 25 ILE H 1 25 ILE HG13 . . 3.530 2.254 2.201 2.311 . 0 0 "[ . 1 . 2]" 1
556 1 25 ILE H 1 25 ILE MG . . 3.820 3.777 3.758 3.797 . 0 0 "[ . 1 . 2]" 1
557 1 25 ILE H 1 26 ASP H . . 3.560 2.695 2.656 2.739 . 0 0 "[ . 1 . 2]" 1
558 1 25 ILE H 1 26 ASP HA . . 5.430 5.378 5.348 5.405 . 0 0 "[ . 1 . 2]" 1
559 1 25 ILE H 1 26 ASP QB . . 4.680 4.415 4.314 4.507 . 0 0 "[ . 1 . 2]" 1
560 1 25 ILE H 1 27 CYS H . . 4.780 4.182 4.055 4.304 . 0 0 "[ . 1 . 2]" 1
561 1 25 ILE H 1 27 CYS HB2 . . 6.000 5.401 5.290 5.473 . 0 0 "[ . 1 . 2]" 1
562 1 25 ILE H 1 28 TYR H . . 5.210 4.980 4.827 5.178 . 0 0 "[ . 1 . 2]" 1
563 1 25 ILE H 1 28 TYR QD . . 4.750 4.488 4.255 4.659 . 0 0 "[ . 1 . 2]" 1
564 1 25 ILE H 1 28 TYR QE . . 4.680 4.310 4.101 4.461 . 0 0 "[ . 1 . 2]" 1
565 1 25 ILE H 1 48 ALA MB . . 4.190 3.400 3.228 3.536 . 0 0 "[ . 1 . 2]" 1
566 1 25 ILE HA 1 25 ILE MD . . 4.010 3.877 3.851 3.901 . 0 0 "[ . 1 . 2]" 1
567 1 25 ILE HA 1 27 CYS H . . 4.850 4.084 3.930 4.281 . 0 0 "[ . 1 . 2]" 1
568 1 25 ILE HA 1 28 TYR H . . 4.210 3.288 3.161 3.482 . 0 0 "[ . 1 . 2]" 1
569 1 25 ILE HA 1 28 TYR QD . . 4.610 2.238 2.156 2.359 . 0 0 "[ . 1 . 2]" 1
570 1 25 ILE HA 1 29 THR H . . 5.170 3.932 3.657 4.307 . 0 0 "[ . 1 . 2]" 1
571 1 25 ILE HA 1 48 ALA MB . . 4.460 3.785 3.583 3.951 . 0 0 "[ . 1 . 2]" 1
572 1 25 ILE HB 1 25 ILE MD . . 3.380 2.337 2.321 2.358 . 0 0 "[ . 1 . 2]" 1
573 1 25 ILE HB 1 26 ASP H . . 3.600 2.706 2.598 2.803 . 0 0 "[ . 1 . 2]" 1
574 1 25 ILE HB 1 27 CYS H . . 5.140 5.107 5.051 5.148 0.008 7 0 "[ . 1 . 2]" 1
575 1 25 ILE MD 1 25 ILE MG . . 2.950 2.149 2.127 2.171 . 0 0 "[ . 1 . 2]" 1
576 1 25 ILE MD 1 26 ASP H . . 4.710 4.544 4.448 4.627 . 0 0 "[ . 1 . 2]" 1
577 1 25 ILE MD 1 48 ALA H . . 4.740 4.611 4.433 4.725 . 0 0 "[ . 1 . 2]" 1
578 1 25 ILE MD 1 48 ALA MB . . 3.430 2.424 2.311 2.624 . 0 0 "[ . 1 . 2]" 1
579 1 25 ILE MD 1 49 TYR H . . 4.160 3.131 2.977 3.275 . 0 0 "[ . 1 . 2]" 1
580 1 25 ILE MD 1 49 TYR HA . . 3.730 2.894 2.654 3.115 . 0 0 "[ . 1 . 2]" 1
581 1 25 ILE MD 1 49 TYR QD . . 3.820 2.881 2.641 3.104 . 0 0 "[ . 1 . 2]" 1
582 1 25 ILE MD 1 49 TYR QE . . 3.740 2.771 2.543 2.951 . 0 0 "[ . 1 . 2]" 1
583 1 25 ILE MD 1 52 LEU H . . 5.070 4.780 4.631 5.063 . 0 0 "[ . 1 . 2]" 1
584 1 25 ILE MD 1 52 LEU MD1 . . 3.170 2.104 1.990 2.201 . 0 0 "[ . 1 . 2]" 1
585 1 25 ILE HG12 1 25 ILE MG . . 3.690 2.324 2.288 2.355 . 0 0 "[ . 1 . 2]" 1
586 1 25 ILE HG12 1 48 ALA H . . 5.160 4.654 4.537 4.808 . 0 0 "[ . 1 . 2]" 1
587 1 25 ILE HG13 1 25 ILE MG . . 3.430 3.195 3.179 3.207 . 0 0 "[ . 1 . 2]" 1
588 1 25 ILE HG13 1 26 ASP H . . 4.350 4.390 4.371 4.413 0.063 15 0 "[ . 1 . 2]" 1
589 1 25 ILE MG 1 26 ASP H . . 3.810 3.359 3.226 3.508 . 0 0 "[ . 1 . 2]" 1
590 1 25 ILE MG 1 26 ASP HA . . 4.240 3.449 3.198 3.609 . 0 0 "[ . 1 . 2]" 1
591 1 25 ILE MG 1 26 ASP QB . . 5.350 4.157 3.896 4.313 . 0 0 "[ . 1 . 2]" 1
592 1 25 ILE MG 1 27 CYS H . . 4.870 4.845 4.814 4.881 0.011 7 0 "[ . 1 . 2]" 1
593 1 25 ILE MG 1 28 TYR H . . 4.490 4.536 4.516 4.555 0.065 3 0 "[ . 1 . 2]" 1
594 1 25 ILE MG 1 28 TYR HB3 . . 5.810 5.481 5.143 5.814 0.004 2 0 "[ . 1 . 2]" 1
595 1 25 ILE MG 1 29 THR H . . 4.010 3.789 3.643 3.997 . 0 0 "[ . 1 . 2]" 1
596 1 25 ILE MG 1 29 THR HG1 . . 3.810 2.403 2.221 2.594 . 0 0 "[ . 1 . 2]" 1
597 1 25 ILE MG 1 45 ARG H . . 6.000 6.032 6.014 6.045 0.045 13 0 "[ . 1 . 2]" 1
598 1 25 ILE MG 1 45 ARG QD . . 3.470 2.059 1.997 2.141 . 0 0 "[ . 1 . 2]" 1
599 1 25 ILE MG 1 45 ARG HE . . 5.060 4.239 4.032 4.432 . 0 0 "[ . 1 . 2]" 1
600 1 25 ILE MG 1 48 ALA MB . . 4.520 4.123 4.022 4.199 . 0 0 "[ . 1 . 2]" 1
601 1 25 ILE MG 1 49 TYR QD . . 4.020 4.121 3.874 4.336 0.316 4 0 "[ . 1 . 2]" 1
602 1 25 ILE MG 1 49 TYR QE . . 3.640 3.081 2.877 3.273 . 0 0 "[ . 1 . 2]" 1
603 1 26 ASP H 1 26 ASP HB2 . . 3.020 2.490 2.363 2.645 . 0 0 "[ . 1 . 2]" 1
604 1 26 ASP H 1 26 ASP HB3 . . 3.020 2.552 2.331 2.705 . 0 0 "[ . 1 . 2]" 1
605 1 26 ASP H 1 27 CYS H . . 3.400 2.794 2.706 2.842 . 0 0 "[ . 1 . 2]" 1
606 1 26 ASP H 1 28 TYR H . . 4.480 4.443 4.358 4.497 0.017 14 0 "[ . 1 . 2]" 1
607 1 26 ASP H 1 29 THR H . . 5.190 4.986 4.856 5.182 . 0 0 "[ . 1 . 2]" 1
608 1 26 ASP HA 1 29 THR H . . 4.110 3.874 3.615 4.080 . 0 0 "[ . 1 . 2]" 1
609 1 26 ASP QB 1 27 CYS H . . 3.770 2.939 2.773 3.125 . 0 0 "[ . 1 . 2]" 1
610 1 27 CYS H 1 27 CYS HB2 . . 3.190 2.452 2.211 2.521 . 0 0 "[ . 1 . 2]" 1
611 1 27 CYS H 1 27 CYS HB3 . . 3.720 3.587 3.490 3.614 . 0 0 "[ . 1 . 2]" 1
612 1 27 CYS H 1 28 TYR H . . 3.440 2.675 2.592 2.834 . 0 0 "[ . 1 . 2]" 1
613 1 27 CYS H 1 28 TYR QD . . 4.770 4.792 4.720 4.820 0.050 10 0 "[ . 1 . 2]" 1
614 1 27 CYS H 1 29 THR H . . 4.310 4.146 4.047 4.292 . 0 0 "[ . 1 . 2]" 1
615 1 27 CYS H 1 30 LYS H . . 5.870 5.068 4.924 5.190 . 0 0 "[ . 1 . 2]" 1
616 1 27 CYS HA 1 30 LYS H . . 4.090 3.846 3.727 3.999 . 0 0 "[ . 1 . 2]" 1
617 1 27 CYS HA 1 30 LYS QB . . 3.920 3.308 3.082 3.521 . 0 0 "[ . 1 . 2]" 1
618 1 27 CYS HA 1 31 GLY H . . 4.990 4.214 4.120 4.308 . 0 0 "[ . 1 . 2]" 1
619 1 27 CYS HB2 1 28 TYR H . . 3.590 2.584 2.470 2.753 . 0 0 "[ . 1 . 2]" 1
620 1 27 CYS HB2 1 28 TYR QE . . 4.160 4.028 3.687 4.194 0.034 19 0 "[ . 1 . 2]" 1
621 1 27 CYS HB3 1 28 TYR H . . 3.890 3.551 3.302 3.642 . 0 0 "[ . 1 . 2]" 1
622 1 28 TYR H 1 28 TYR HB2 . . 3.900 2.717 2.617 2.779 . 0 0 "[ . 1 . 2]" 1
623 1 28 TYR H 1 28 TYR HB3 . . 3.620 3.630 3.615 3.647 0.027 2 0 "[ . 1 . 2]" 1
624 1 28 TYR H 1 28 TYR QD . . 3.820 3.008 2.908 3.050 . 0 0 "[ . 1 . 2]" 1
625 1 28 TYR H 1 28 TYR QE . . 4.300 4.256 4.193 4.326 0.026 2 0 "[ . 1 . 2]" 1
626 1 28 TYR H 1 29 THR H . . 3.440 2.612 2.458 2.698 . 0 0 "[ . 1 . 2]" 1
627 1 28 TYR H 1 29 THR HB . . 5.080 4.875 4.614 5.006 . 0 0 "[ . 1 . 2]" 1
628 1 28 TYR H 1 29 THR HG1 . . 4.670 4.295 4.068 4.713 0.043 2 0 "[ . 1 . 2]" 1
629 1 28 TYR H 1 29 THR MG . . 6.000 5.899 5.736 5.989 . 0 0 "[ . 1 . 2]" 1
630 1 28 TYR H 1 30 LYS H . . 4.440 4.354 4.216 4.448 0.008 4 0 "[ . 1 . 2]" 1
631 1 28 TYR H 1 30 LYS QB . . 5.710 5.426 5.227 5.625 . 0 0 "[ . 1 . 2]" 1
632 1 28 TYR H 1 45 ARG HB2 . . 5.170 5.111 4.844 5.185 0.015 4 0 "[ . 1 . 2]" 1
633 1 28 TYR HA 1 30 LYS H . . 4.310 4.315 4.242 4.342 0.032 19 0 "[ . 1 . 2]" 1
634 1 28 TYR HA 1 31 GLY H . . 4.250 3.158 2.991 3.373 . 0 0 "[ . 1 . 2]" 1
635 1 28 TYR HA 1 32 MET H . . 4.610 3.666 3.490 3.831 . 0 0 "[ . 1 . 2]" 1
636 1 28 TYR HA 1 41 LEU MD1 . . 4.570 4.547 4.395 4.604 0.034 12 0 "[ . 1 . 2]" 1
637 1 28 TYR HB2 1 29 THR H . . 4.710 2.744 2.603 2.900 . 0 0 "[ . 1 . 2]" 1
638 1 28 TYR HB3 1 29 THR H . . 4.100 3.901 3.752 4.049 . 0 0 "[ . 1 . 2]" 1
639 1 28 TYR HB3 1 29 THR HA . . 5.560 4.736 4.580 4.915 . 0 0 "[ . 1 . 2]" 1
640 1 28 TYR HB3 1 32 MET H . . 4.430 4.454 4.391 4.483 0.053 10 0 "[ . 1 . 2]" 1
641 1 28 TYR HB3 1 32 MET ME . . 3.770 3.282 2.376 3.791 0.021 5 0 "[ . 1 . 2]" 1
642 1 28 TYR QD 1 29 THR H . . 4.600 4.173 4.071 4.218 . 0 0 "[ . 1 . 2]" 1
643 1 28 TYR QD 1 31 GLY H . . 5.240 5.190 5.034 5.258 0.018 17 0 "[ . 1 . 2]" 1
644 1 28 TYR QD 1 45 ARG H . . 4.250 3.729 3.517 3.916 . 0 0 "[ . 1 . 2]" 1
645 1 28 TYR QD 1 45 ARG HA . . 4.220 2.238 2.133 2.350 . 0 0 "[ . 1 . 2]" 1
646 1 28 TYR QD 1 46 ALA H . . 5.520 5.363 5.231 5.516 . 0 0 "[ . 1 . 2]" 1
647 1 28 TYR QD 1 48 ALA MB . . 4.340 3.828 3.589 4.058 . 0 0 "[ . 1 . 2]" 1
648 1 28 TYR QE 1 29 THR H . . 6.000 6.055 6.022 6.111 0.111 9 0 "[ . 1 . 2]" 1
649 1 28 TYR QE 1 45 ARG H . . 4.670 4.436 4.263 4.645 . 0 0 "[ . 1 . 2]" 1
650 1 28 TYR QE 1 45 ARG HA . . 4.550 2.948 2.789 3.151 . 0 0 "[ . 1 . 2]" 1
651 1 28 TYR QE 1 47 SER H . . 5.350 5.371 5.361 5.384 0.034 2 0 "[ . 1 . 2]" 1
652 1 28 TYR QE 1 48 ALA H . . 4.360 3.929 3.754 4.136 . 0 0 "[ . 1 . 2]" 1
653 1 29 THR H 1 29 THR HB . . 3.470 2.567 2.453 2.667 . 0 0 "[ . 1 . 2]" 1
654 1 29 THR H 1 29 THR HG1 . . 3.340 2.261 2.013 2.829 . 0 0 "[ . 1 . 2]" 1
655 1 29 THR H 1 29 THR MG . . 3.790 3.788 3.744 3.807 0.017 13 0 "[ . 1 . 2]" 1
656 1 29 THR H 1 30 LYS H . . 3.580 2.794 2.737 2.858 . 0 0 "[ . 1 . 2]" 1
657 1 29 THR H 1 30 LYS HA . . 5.450 5.460 5.434 5.490 0.040 9 0 "[ . 1 . 2]" 1
658 1 29 THR H 1 30 LYS QB . . 5.010 4.772 4.608 4.929 . 0 0 "[ . 1 . 2]" 1
659 1 29 THR H 1 30 LYS QG . . 4.860 4.648 4.421 4.878 0.018 14 0 "[ . 1 . 2]" 1
660 1 29 THR H 1 31 GLY H . . 4.490 4.098 3.979 4.289 . 0 0 "[ . 1 . 2]" 1
661 1 29 THR H 1 45 ARG HB2 . . 5.260 5.012 4.781 5.202 . 0 0 "[ . 1 . 2]" 1
662 1 29 THR H 1 45 ARG QD . . 5.380 3.240 2.991 3.446 . 0 0 "[ . 1 . 2]" 1
663 1 29 THR H 1 45 ARG QH1 . . 4.950 4.020 3.806 4.740 . 0 0 "[ . 1 . 2]" 1
664 1 29 THR HA 1 29 THR MG . . 3.230 2.368 2.317 2.471 . 0 0 "[ . 1 . 2]" 1
665 1 29 THR HA 1 31 GLY H . . 5.100 4.648 4.499 4.832 . 0 0 "[ . 1 . 2]" 1
666 1 29 THR HA 1 32 MET H . . 4.490 3.779 3.537 4.065 . 0 0 "[ . 1 . 2]" 1
667 1 29 THR HA 1 32 MET QB . . 4.570 3.018 2.768 3.231 . 0 0 "[ . 1 . 2]" 1
668 1 29 THR HA 1 32 MET ME . . 4.900 2.437 2.098 3.017 . 0 0 "[ . 1 . 2]" 1
669 1 29 THR HA 1 33 ASP H . . 5.030 4.808 4.525 4.991 . 0 0 "[ . 1 . 2]" 1
670 1 29 THR HA 1 33 ASP HB2 . . 6.000 5.542 5.180 5.832 . 0 0 "[ . 1 . 2]" 1
671 1 29 THR HA 1 45 ARG QH1 . . 4.810 2.787 2.370 3.470 . 0 0 "[ . 1 . 2]" 1
672 1 29 THR HB 1 30 LYS H . . 3.710 2.708 2.474 2.858 . 0 0 "[ . 1 . 2]" 1
673 1 29 THR HB 1 31 GLY H . . 5.330 5.093 4.907 5.252 . 0 0 "[ . 1 . 2]" 1
674 1 29 THR HG1 1 29 THR MG . . 3.460 2.899 2.551 2.994 . 0 0 "[ . 1 . 2]" 1
675 1 29 THR HG1 1 30 LYS H . . 4.270 4.182 3.970 4.304 0.034 20 0 "[ . 1 . 2]" 1
676 1 29 THR MG 1 30 LYS H . . 3.630 3.595 3.445 3.655 0.025 1 0 "[ . 1 . 2]" 1
677 1 29 THR MG 1 31 GLY H . . 5.330 5.324 5.215 5.361 0.031 4 0 "[ . 1 . 2]" 1
678 1 29 THR MG 1 33 ASP H . . 5.180 5.099 4.797 5.192 0.012 3 0 "[ . 1 . 2]" 1
679 1 29 THR MG 1 45 ARG QH1 . . 3.580 2.300 2.123 2.736 . 0 0 "[ . 1 . 2]" 1
680 1 30 LYS H 1 30 LYS QB . . 3.210 2.368 2.262 2.477 . 0 0 "[ . 1 . 2]" 1
681 1 30 LYS H 1 30 LYS QD . . 4.270 3.936 3.566 4.310 0.040 6 0 "[ . 1 . 2]" 1
682 1 30 LYS H 1 30 LYS QE . . 4.790 4.293 3.367 4.847 0.057 4 0 "[ . 1 . 2]" 1
683 1 30 LYS H 1 30 LYS QG . . 3.250 2.426 2.216 2.606 . 0 0 "[ . 1 . 2]" 1
684 1 30 LYS H 1 31 GLY H . . 3.570 2.566 2.479 2.638 . 0 0 "[ . 1 . 2]" 1
685 1 30 LYS H 1 32 MET H . . 4.620 4.288 4.130 4.434 . 0 0 "[ . 1 . 2]" 1
686 1 30 LYS H 1 33 ASP H . . 5.170 4.882 4.752 5.045 . 0 0 "[ . 1 . 2]" 1
687 1 30 LYS H 1 33 ASP HB2 . . 5.070 5.016 4.740 5.104 0.034 7 0 "[ . 1 . 2]" 1
688 1 30 LYS HA 1 30 LYS QD . . 3.960 3.964 3.842 4.005 0.045 5 0 "[ . 1 . 2]" 1
689 1 30 LYS HA 1 30 LYS QG . . 3.320 2.356 2.252 2.441 . 0 0 "[ . 1 . 2]" 1
690 1 30 LYS HA 1 32 MET H . . 4.760 4.580 4.440 4.718 . 0 0 "[ . 1 . 2]" 1
691 1 30 LYS HA 1 33 ASP H . . 3.590 3.379 3.182 3.533 . 0 0 "[ . 1 . 2]" 1
692 1 30 LYS HA 1 33 ASP HB2 . . 3.910 2.430 2.184 2.643 . 0 0 "[ . 1 . 2]" 1
693 1 30 LYS HA 1 33 ASP HB3 . . 4.040 3.811 3.255 4.045 0.005 12 0 "[ . 1 . 2]" 1
694 1 30 LYS HA 1 34 ALA H . . 4.850 4.589 4.476 4.677 . 0 0 "[ . 1 . 2]" 1
695 1 30 LYS QB 1 31 GLY H . . 3.630 2.661 2.520 2.852 . 0 0 "[ . 1 . 2]" 1
696 1 30 LYS QB 1 33 ASP H . . 4.700 4.653 4.523 4.723 0.023 4 0 "[ . 1 . 2]" 1
697 1 30 LYS QB 1 34 ALA H . . 5.000 4.999 4.882 5.038 0.038 5 0 "[ . 1 . 2]" 1
698 1 30 LYS QD 1 31 GLY H . . 5.100 4.861 4.628 5.121 0.021 14 0 "[ . 1 . 2]" 1
699 1 31 GLY H 1 32 MET H . . 3.630 2.913 2.825 2.970 . 0 0 "[ . 1 . 2]" 1
700 1 31 GLY H 1 32 MET HA . . 5.510 5.478 5.415 5.525 0.015 9 0 "[ . 1 . 2]" 1
701 1 31 GLY H 1 32 MET QB . . 4.650 4.614 4.418 4.695 0.045 3 0 "[ . 1 . 2]" 1
702 1 31 GLY H 1 33 ASP H . . 4.370 3.994 3.927 4.071 . 0 0 "[ . 1 . 2]" 1
703 1 31 GLY H 1 33 ASP HB2 . . 5.130 4.944 4.689 5.043 . 0 0 "[ . 1 . 2]" 1
704 1 31 GLY H 1 34 ALA H . . 4.880 4.825 4.762 4.904 0.024 14 0 "[ . 1 . 2]" 1
705 1 31 GLY H 1 34 ALA MB . . 5.500 4.868 4.709 4.952 . 0 0 "[ . 1 . 2]" 1
706 1 31 GLY QA 1 33 ASP H . . 4.190 3.644 3.605 3.730 . 0 0 "[ . 1 . 2]" 1
707 1 31 GLY QA 1 34 ALA H . . 3.850 3.159 3.088 3.240 . 0 0 "[ . 1 . 2]" 1
708 1 31 GLY QA 1 34 ALA MB . . 4.580 2.618 2.481 2.713 . 0 0 "[ . 1 . 2]" 1
709 1 31 GLY QA 1 41 LEU MD1 . . 5.010 3.124 3.062 3.154 . 0 0 "[ . 1 . 2]" 1
710 1 31 GLY QA 1 41 LEU MD2 . . 4.480 2.301 2.096 2.563 . 0 0 "[ . 1 . 2]" 1
711 1 31 GLY HA2 1 33 ASP H . . 4.780 3.915 3.852 4.013 . 0 0 "[ . 1 . 2]" 1
712 1 31 GLY HA2 1 34 ALA H . . 4.590 3.233 3.155 3.322 . 0 0 "[ . 1 . 2]" 1
713 1 31 GLY HA2 1 41 LEU MD2 . . 5.280 3.656 3.434 3.948 . 0 0 "[ . 1 . 2]" 1
714 1 31 GLY HA3 1 33 ASP H . . 4.780 4.342 4.298 4.430 . 0 0 "[ . 1 . 2]" 1
715 1 31 GLY HA3 1 34 ALA H . . 4.590 4.434 4.386 4.502 . 0 0 "[ . 1 . 2]" 1
716 1 31 GLY HA3 1 41 LEU MD2 . . 5.280 2.326 2.114 2.596 . 0 0 "[ . 1 . 2]" 1
717 1 32 MET H 1 32 MET QB . . 3.390 2.182 2.086 2.326 . 0 0 "[ . 1 . 2]" 1
718 1 32 MET H 1 32 MET ME . . 4.000 3.471 3.003 3.849 . 0 0 "[ . 1 . 2]" 1
719 1 32 MET H 1 32 MET HG2 . . 4.520 4.020 3.441 4.499 . 0 0 "[ . 1 . 2]" 1
720 1 32 MET H 1 32 MET QG . . 3.860 3.060 2.365 3.895 0.035 12 0 "[ . 1 . 2]" 1
721 1 32 MET H 1 32 MET HG3 . . 4.520 3.240 2.402 4.337 . 0 0 "[ . 1 . 2]" 1
722 1 32 MET H 1 33 ASP H . . 3.400 2.725 2.653 2.804 . 0 0 "[ . 1 . 2]" 1
723 1 32 MET H 1 34 ALA H . . 4.190 4.168 4.104 4.199 0.009 7 0 "[ . 1 . 2]" 1
724 1 32 MET H 1 35 ASP H . . 4.890 4.774 4.671 4.883 . 0 0 "[ . 1 . 2]" 1
725 1 32 MET H 1 41 LEU HB2 . . 5.620 4.855 4.627 4.994 . 0 0 "[ . 1 . 2]" 1
726 1 32 MET H 1 41 LEU MD1 . . 3.800 2.979 2.872 3.128 . 0 0 "[ . 1 . 2]" 1
727 1 32 MET H 1 41 LEU MD2 . . 4.100 3.039 2.845 3.320 . 0 0 "[ . 1 . 2]" 1
728 1 32 MET HA 1 32 MET ME . . 4.370 4.296 4.074 4.396 0.026 15 0 "[ . 1 . 2]" 1
729 1 32 MET HA 1 32 MET QG . . 3.330 2.280 2.203 2.387 . 0 0 "[ . 1 . 2]" 1
730 1 32 MET HA 1 34 ALA H . . 4.360 4.027 3.872 4.165 . 0 0 "[ . 1 . 2]" 1
731 1 32 MET HA 1 35 ASP H . . 3.900 3.106 2.850 3.313 . 0 0 "[ . 1 . 2]" 1
732 1 32 MET HA 1 41 LEU MD2 . . 3.790 3.830 3.810 3.850 0.060 7 0 "[ . 1 . 2]" 1
733 1 32 MET QB 1 32 MET ME . . 2.470 2.082 1.906 2.178 . 0 0 "[ . 1 . 2]" 1
734 1 32 MET QB 1 33 ASP H . . 3.500 3.050 2.998 3.088 . 0 0 "[ . 1 . 2]" 1
735 1 32 MET QB 1 34 ALA H . . 4.950 4.776 4.666 4.895 . 0 0 "[ . 1 . 2]" 1
736 1 32 MET ME 1 33 ASP H . . 4.770 4.800 4.777 4.833 0.063 4 0 "[ . 1 . 2]" 1
737 1 32 MET ME 1 42 PRO HA . . 3.570 3.069 2.326 3.587 0.017 13 0 "[ . 1 . 2]" 1
738 1 32 MET ME 1 45 ARG HE . . 4.700 3.013 2.660 3.210 . 0 0 "[ . 1 . 2]" 1
739 1 32 MET ME 1 45 ARG QH1 . . 3.470 2.865 2.506 3.474 0.004 1 0 "[ . 1 . 2]" 1
740 1 32 MET QG 1 41 LEU HB2 . . 5.470 2.784 2.282 3.682 . 0 0 "[ . 1 . 2]" 1
741 1 32 MET QG 1 41 LEU MD2 . . 4.860 3.681 2.873 4.912 0.052 11 0 "[ . 1 . 2]" 1
742 1 32 MET QG 1 42 PRO QD . . 4.630 2.910 2.402 3.392 . 0 0 "[ . 1 . 2]" 1
743 1 33 ASP H 1 33 ASP HB2 . . 2.870 2.220 2.079 2.316 . 0 0 "[ . 1 . 2]" 1
744 1 33 ASP H 1 33 ASP HB3 . . 3.530 3.396 3.073 3.552 0.022 20 0 "[ . 1 . 2]" 1
745 1 33 ASP H 1 34 ALA H . . 2.990 2.349 2.274 2.423 . 0 0 "[ . 1 . 2]" 1
746 1 33 ASP H 1 34 ALA MB . . 4.180 4.073 3.945 4.162 . 0 0 "[ . 1 . 2]" 1
747 1 33 ASP H 1 35 ASP H . . 3.790 3.821 3.796 3.843 0.053 4 0 "[ . 1 . 2]" 1
748 1 33 ASP H 1 41 LEU MD1 . . 4.420 4.455 4.427 4.477 0.057 2 0 "[ . 1 . 2]" 1
749 1 33 ASP HA 1 33 ASP HB3 . . 3.010 2.758 2.590 2.957 . 0 0 "[ . 1 . 2]" 1
750 1 33 ASP HA 1 35 ASP H . . 4.300 4.266 4.115 4.332 0.032 1 0 "[ . 1 . 2]" 1
751 1 33 ASP HB2 1 34 ALA H . . 3.260 3.295 3.204 3.356 0.096 14 0 "[ . 1 . 2]" 1
752 1 33 ASP HB2 1 34 ALA MB . . 4.640 4.471 4.350 4.588 . 0 0 "[ . 1 . 2]" 1
753 1 33 ASP HB3 1 34 ALA H . . 3.680 3.449 2.914 3.730 0.050 17 0 "[ . 1 . 2]" 1
754 1 33 ASP HB3 1 34 ALA HA . . 4.460 4.315 3.896 4.512 0.052 20 0 "[ . 1 . 2]" 1
755 1 33 ASP HB3 1 34 ALA MB . . 4.650 4.206 3.674 4.572 . 0 0 "[ . 1 . 2]" 1
756 1 34 ALA H 1 34 ALA MB . . 2.720 2.250 2.207 2.298 . 0 0 "[ . 1 . 2]" 1
757 1 34 ALA H 1 35 ASP H . . 3.000 2.450 2.393 2.479 . 0 0 "[ . 1 . 2]" 1
758 1 34 ALA H 1 35 ASP HA . . 5.100 5.112 5.100 5.145 0.045 7 0 "[ . 1 . 2]" 1
759 1 34 ALA H 1 41 LEU MD1 . . 4.560 4.570 4.498 4.613 0.053 1 0 "[ . 1 . 2]" 1
760 1 34 ALA HA 1 35 ASP H . . 3.560 3.515 3.478 3.562 0.002 20 0 "[ . 1 . 2]" 1
761 1 34 ALA MB 1 35 ASP H . . 3.200 2.993 2.918 3.133 . 0 0 "[ . 1 . 2]" 1
762 1 35 ASP H 1 35 ASP HB2 . . 3.510 3.455 3.315 3.523 0.013 13 0 "[ . 1 . 2]" 1
763 1 35 ASP H 1 35 ASP HB3 . . 3.500 3.201 3.098 3.281 . 0 0 "[ . 1 . 2]" 1
764 1 35 ASP H 1 36 PRO HD2 . . 3.900 3.849 3.753 3.906 0.006 2 0 "[ . 1 . 2]" 1
765 1 35 ASP H 1 36 PRO HD3 . . 3.890 2.990 2.951 3.015 . 0 0 "[ . 1 . 2]" 1
766 1 35 ASP H 1 36 PRO HG2 . . 5.560 5.578 5.559 5.595 0.035 10 0 "[ . 1 . 2]" 1
767 1 35 ASP H 1 36 PRO HG3 . . 5.210 5.261 5.249 5.283 0.073 13 0 "[ . 1 . 2]" 1
768 1 35 ASP H 1 41 LEU MD1 . . 3.860 3.594 3.488 3.716 . 0 0 "[ . 1 . 2]" 1
769 1 35 ASP HA 1 36 PRO HD2 . . 3.740 2.065 2.030 2.099 . 0 0 "[ . 1 . 2]" 1
770 1 35 ASP HA 1 36 PRO HD3 . . 3.690 2.851 2.783 2.964 . 0 0 "[ . 1 . 2]" 1
771 1 35 ASP HA 1 36 PRO HG2 . . 4.320 4.219 4.141 4.274 . 0 0 "[ . 1 . 2]" 1
772 1 35 ASP HA 1 36 PRO HG3 . . 4.740 4.586 4.542 4.631 . 0 0 "[ . 1 . 2]" 1
773 1 35 ASP HA 1 37 TYR H . . 3.810 3.418 3.281 3.506 . 0 0 "[ . 1 . 2]" 1
774 1 35 ASP HB3 1 37 TYR H . . 4.280 4.270 4.169 4.319 0.039 1 0 "[ . 1 . 2]" 1
775 1 35 ASP HB3 1 38 ASN H . . 4.450 3.933 3.728 4.143 . 0 0 "[ . 1 . 2]" 1
776 1 35 ASP HB3 1 41 LEU MD2 . . 5.370 4.634 4.014 4.840 . 0 0 "[ . 1 . 2]" 1
777 1 36 PRO HA 1 38 ASN H . . 4.650 4.191 3.987 4.385 . 0 0 "[ . 1 . 2]" 1
778 1 36 PRO QB 1 38 ASN H . . 5.580 5.320 5.150 5.504 . 0 0 "[ . 1 . 2]" 1
779 1 36 PRO HD2 1 37 TYR H . . 3.900 3.156 3.059 3.240 . 0 0 "[ . 1 . 2]" 1
780 1 36 PRO HD2 1 37 TYR QD . . 5.270 2.951 2.563 3.405 . 0 0 "[ . 1 . 2]" 1
781 1 36 PRO HD2 1 37 TYR QE . . 4.180 3.442 2.985 4.026 . 0 0 "[ . 1 . 2]" 1
782 1 36 PRO HG2 1 37 TYR H . . 3.610 3.221 3.154 3.275 . 0 0 "[ . 1 . 2]" 1
783 1 36 PRO HG2 1 37 TYR QD . . 4.890 3.170 2.548 3.478 . 0 0 "[ . 1 . 2]" 1
784 1 36 PRO HG2 1 37 TYR QE . . 4.030 3.109 2.876 3.524 . 0 0 "[ . 1 . 2]" 1
785 1 36 PRO HG2 1 38 ASN H . . 6.000 5.665 5.527 5.786 . 0 0 "[ . 1 . 2]" 1
786 1 36 PRO HG3 1 37 TYR H . . 4.510 4.579 4.544 4.606 0.096 17 0 "[ . 1 . 2]" 1
787 1 37 TYR H 1 37 TYR HB2 . . 3.750 2.391 2.315 2.518 . 0 0 "[ . 1 . 2]" 1
788 1 37 TYR H 1 37 TYR QB . . 3.080 2.357 2.286 2.476 . 0 0 "[ . 1 . 2]" 1
789 1 37 TYR H 1 37 TYR HB3 . . 3.750 3.582 3.546 3.666 . 0 0 "[ . 1 . 2]" 1
790 1 37 TYR H 1 37 TYR QD . . 3.560 2.686 2.295 3.129 . 0 0 "[ . 1 . 2]" 1
791 1 37 TYR H 1 37 TYR QE . . 4.710 4.531 4.358 4.732 0.022 2 0 "[ . 1 . 2]" 1
792 1 37 TYR H 1 38 ASN H . . 2.990 2.516 2.278 2.613 . 0 0 "[ . 1 . 2]" 1
793 1 37 TYR H 1 39 PRO QD . . 6.000 6.018 5.997 6.045 0.045 18 0 "[ . 1 . 2]" 1
794 1 37 TYR H 1 41 LEU MD1 . . 4.860 4.282 4.118 4.424 . 0 0 "[ . 1 . 2]" 1
795 1 37 TYR H 1 68 LEU MD1 . . 4.400 4.433 4.418 4.465 0.065 12 0 "[ . 1 . 2]" 1
796 1 37 TYR H 1 68 LEU MD2 . . 5.260 4.478 4.290 4.608 . 0 0 "[ . 1 . 2]" 1
797 1 37 TYR HA 1 37 TYR QD . . 3.810 2.651 2.271 2.991 . 0 0 "[ . 1 . 2]" 1
798 1 37 TYR HA 1 37 TYR QE . . 4.680 4.532 4.352 4.683 0.003 12 0 "[ . 1 . 2]" 1
799 1 37 TYR HA 1 68 LEU MD1 . . 4.520 2.731 2.519 2.877 . 0 0 "[ . 1 . 2]" 1
800 1 37 TYR HA 1 68 LEU MD2 . . 3.360 2.066 1.976 2.177 . 0 0 "[ . 1 . 2]" 1
801 1 37 TYR QB 1 38 ASN H . . 3.180 3.059 2.939 3.189 0.009 2 0 "[ . 1 . 2]" 1
802 1 37 TYR HB2 1 38 ASN H . . 4.000 3.171 3.018 3.345 . 0 0 "[ . 1 . 2]" 1
803 1 37 TYR HB2 1 68 LEU MD2 . . 4.920 4.545 4.309 4.840 . 0 0 "[ . 1 . 2]" 1
804 1 37 TYR HB3 1 38 ASN H . . 4.000 4.029 4.003 4.066 0.066 20 0 "[ . 1 . 2]" 1
805 1 37 TYR HB3 1 68 LEU MD2 . . 4.920 3.566 3.235 4.077 . 0 0 "[ . 1 . 2]" 1
806 1 37 TYR QD 1 38 ASN H . . 4.660 4.552 4.401 4.685 0.025 4 0 "[ . 1 . 2]" 1
807 1 37 TYR QD 1 68 LEU MD1 . . 5.160 4.539 4.215 4.787 . 0 0 "[ . 1 . 2]" 1
808 1 37 TYR QD 1 68 LEU MD2 . . 3.410 2.771 2.306 3.140 . 0 0 "[ . 1 . 2]" 1
809 1 37 TYR QE 1 68 LEU MD2 . . 4.300 4.094 3.515 4.315 0.015 9 0 "[ . 1 . 2]" 1
810 1 38 ASN H 1 38 ASN HB2 . . 3.180 2.359 2.262 2.475 . 0 0 "[ . 1 . 2]" 1
811 1 38 ASN H 1 38 ASN HB3 . . 3.580 2.318 2.228 2.436 . 0 0 "[ . 1 . 2]" 1
812 1 38 ASN H 1 38 ASN HD21 . . 4.230 4.336 4.304 4.350 0.120 2 0 "[ . 1 . 2]" 1
813 1 38 ASN H 1 38 ASN HD22 . . 5.690 5.610 5.581 5.638 . 0 0 "[ . 1 . 2]" 1
814 1 38 ASN H 1 39 PRO QD . . 4.310 4.270 4.239 4.307 . 0 0 "[ . 1 . 2]" 1
815 1 38 ASN H 1 41 LEU MD1 . . 3.630 3.108 3.025 3.251 . 0 0 "[ . 1 . 2]" 1
816 1 38 ASN H 1 41 LEU HG . . 4.880 4.890 4.868 4.936 0.056 7 0 "[ . 1 . 2]" 1
817 1 38 ASN H 1 68 LEU MD1 . . 4.120 3.905 3.833 3.989 . 0 0 "[ . 1 . 2]" 1
818 1 38 ASN HA 1 38 ASN HD22 . . 5.000 4.538 4.291 4.699 . 0 0 "[ . 1 . 2]" 1
819 1 38 ASN HA 1 39 PRO QD . . 3.550 2.044 2.013 2.069 . 0 0 "[ . 1 . 2]" 1
820 1 38 ASN HA 1 39 PRO HG2 . . 4.620 4.404 4.337 4.469 . 0 0 "[ . 1 . 2]" 1
821 1 38 ASN HA 1 39 PRO HG3 . . 4.690 4.545 4.485 4.578 . 0 0 "[ . 1 . 2]" 1
822 1 38 ASN HA 1 40 VAL H . . 4.190 3.800 3.724 3.910 . 0 0 "[ . 1 . 2]" 1
823 1 38 ASN HA 1 40 VAL MG2 . . 5.200 4.666 4.408 4.921 . 0 0 "[ . 1 . 2]" 1
824 1 38 ASN HA 1 41 LEU MD1 . . 5.550 4.539 4.474 4.632 . 0 0 "[ . 1 . 2]" 1
825 1 38 ASN HB2 1 39 PRO QD . . 5.830 4.052 3.951 4.131 . 0 0 "[ . 1 . 2]" 1
826 1 38 ASN HB3 1 39 PRO QD . . 5.290 4.316 4.193 4.384 . 0 0 "[ . 1 . 2]" 1
827 1 38 ASN HB3 1 40 VAL H . . 4.410 4.241 4.107 4.344 . 0 0 "[ . 1 . 2]" 1
828 1 38 ASN HB3 1 41 LEU H . . 4.990 3.668 3.496 3.827 . 0 0 "[ . 1 . 2]" 1
829 1 38 ASN HB3 1 41 LEU MD2 . . 4.060 4.011 3.885 4.071 0.011 5 0 "[ . 1 . 2]" 1
830 1 38 ASN HD21 1 40 VAL HB . . 5.560 4.693 4.381 4.979 . 0 0 "[ . 1 . 2]" 1
831 1 38 ASN HD21 1 41 LEU MD1 . . 3.850 3.478 2.926 3.874 0.024 7 0 "[ . 1 . 2]" 1
832 1 38 ASN HD22 1 40 VAL H . . 5.420 4.440 4.156 4.683 . 0 0 "[ . 1 . 2]" 1
833 1 38 ASN HD22 1 40 VAL HB . . 4.940 3.469 3.121 3.818 . 0 0 "[ . 1 . 2]" 1
834 1 38 ASN HD22 1 41 LEU HG . . 5.180 4.077 3.629 4.476 . 0 0 "[ . 1 . 2]" 1
835 1 39 PRO HA 1 41 LEU H . . 5.220 4.021 3.848 4.168 . 0 0 "[ . 1 . 2]" 1
836 1 39 PRO HA 1 41 LEU HB2 . . 4.720 4.624 4.443 4.723 0.003 7 0 "[ . 1 . 2]" 1
837 1 39 PRO HA 1 42 PRO QG . . 3.890 2.707 2.501 2.859 . 0 0 "[ . 1 . 2]" 1
838 1 39 PRO HA 1 43 THR H . . 4.400 4.294 4.085 4.405 0.005 14 0 "[ . 1 . 2]" 1
839 1 39 PRO HA 1 65 ALA HA . . 4.300 2.797 2.600 3.000 . 0 0 "[ . 1 . 2]" 1
840 1 39 PRO HA 1 68 LEU MD1 . . 3.690 2.503 2.389 2.619 . 0 0 "[ . 1 . 2]" 1
841 1 39 PRO HB3 1 40 VAL H . . 4.420 4.442 4.425 4.462 0.042 9 0 "[ . 1 . 2]" 1
842 1 39 PRO HB3 1 68 LEU H . . 4.400 4.242 4.074 4.403 0.003 17 0 "[ . 1 . 2]" 1
843 1 39 PRO HB3 1 69 ASN H . . 4.200 3.271 3.064 3.573 . 0 0 "[ . 1 . 2]" 1
844 1 39 PRO QD 1 40 VAL H . . 3.680 2.843 2.656 2.962 . 0 0 "[ . 1 . 2]" 1
845 1 39 PRO QD 1 40 VAL MG2 . . 4.970 3.369 3.000 3.592 . 0 0 "[ . 1 . 2]" 1
846 1 39 PRO QD 1 68 LEU MD2 . . 5.710 4.427 3.935 4.920 . 0 0 "[ . 1 . 2]" 1
847 1 39 PRO QD 1 69 ASN H . . 5.070 4.776 4.523 4.929 . 0 0 "[ . 1 . 2]" 1
848 1 39 PRO QD 1 69 ASN HD21 . . 5.150 3.998 3.652 4.555 . 0 0 "[ . 1 . 2]" 1
849 1 39 PRO QD 1 69 ASN HD22 . . 6.000 5.480 5.135 6.015 0.015 18 0 "[ . 1 . 2]" 1
850 1 39 PRO HG2 1 40 VAL H . . 3.790 2.907 2.792 3.037 . 0 0 "[ . 1 . 2]" 1
851 1 39 PRO HG2 1 69 ASN HD21 . . 4.910 3.856 3.305 4.937 0.027 4 0 "[ . 1 . 2]" 1
852 1 39 PRO HG3 1 69 ASN H . . 4.230 4.151 3.877 4.265 0.035 15 0 "[ . 1 . 2]" 1
853 1 39 PRO HG3 1 69 ASN HD21 . . 4.980 2.693 2.142 3.426 . 0 0 "[ . 1 . 2]" 1
854 1 39 PRO HG3 1 69 ASN HD22 . . 5.170 4.283 3.846 4.741 . 0 0 "[ . 1 . 2]" 1
855 1 40 VAL H 1 40 VAL HB . . 3.130 2.584 2.512 2.663 . 0 0 "[ . 1 . 2]" 1
856 1 40 VAL H 1 40 VAL MG1 . . 3.810 3.815 3.779 3.828 0.018 16 0 "[ . 1 . 2]" 1
857 1 40 VAL H 1 40 VAL MG2 . . 2.860 2.190 2.113 2.272 . 0 0 "[ . 1 . 2]" 1
858 1 40 VAL H 1 41 LEU H . . 3.500 2.569 2.471 2.605 . 0 0 "[ . 1 . 2]" 1
859 1 40 VAL H 1 41 LEU HA . . 5.200 5.207 5.161 5.223 0.023 9 0 "[ . 1 . 2]" 1
860 1 40 VAL H 1 41 LEU HG . . 5.360 4.247 3.945 4.475 . 0 0 "[ . 1 . 2]" 1
861 1 40 VAL H 1 43 THR H . . 4.980 4.975 4.896 5.010 0.030 2 0 "[ . 1 . 2]" 1
862 1 40 VAL H 1 65 ALA MB . . 5.790 5.302 5.152 5.502 . 0 0 "[ . 1 . 2]" 1
863 1 40 VAL H 1 68 LEU MD1 . . 5.070 5.070 4.980 5.089 0.019 4 0 "[ . 1 . 2]" 1
864 1 40 VAL HA 1 40 VAL MG1 . . 3.450 2.327 2.283 2.403 . 0 0 "[ . 1 . 2]" 1
865 1 40 VAL HA 1 40 VAL MG2 . . 3.330 2.444 2.338 2.540 . 0 0 "[ . 1 . 2]" 1
866 1 40 VAL HA 1 43 THR H . . 4.330 3.626 3.486 3.676 . 0 0 "[ . 1 . 2]" 1
867 1 40 VAL HA 1 43 THR HB . . 4.800 2.503 2.389 2.614 . 0 0 "[ . 1 . 2]" 1
868 1 40 VAL HA 1 43 THR MG . . 4.200 3.844 3.702 3.999 . 0 0 "[ . 1 . 2]" 1
869 1 40 VAL HA 1 44 ASN H . . 4.500 3.839 3.744 4.011 . 0 0 "[ . 1 . 2]" 1
870 1 40 VAL HA 1 44 ASN HA . . 5.970 5.970 5.897 6.019 0.049 13 0 "[ . 1 . 2]" 1
871 1 40 VAL HA 1 65 ALA MB . . 5.040 4.784 4.644 5.041 0.001 17 0 "[ . 1 . 2]" 1
872 1 40 VAL HB 1 41 LEU H . . 3.650 2.835 2.686 2.959 . 0 0 "[ . 1 . 2]" 1
873 1 40 VAL MG1 1 41 LEU H . . 3.870 3.699 3.619 3.769 . 0 0 "[ . 1 . 2]" 1
874 1 40 VAL MG1 1 41 LEU HA . . 4.040 3.704 3.553 3.982 . 0 0 "[ . 1 . 2]" 1
875 1 40 VAL MG1 1 43 THR H . . 4.820 4.831 4.757 4.862 0.042 13 0 "[ . 1 . 2]" 1
876 1 40 VAL MG1 1 44 ASN H . . 4.170 3.807 3.696 4.020 . 0 0 "[ . 1 . 2]" 1
877 1 40 VAL MG1 1 44 ASN HD21 . . 4.090 2.708 2.002 2.879 . 0 0 "[ . 1 . 2]" 1
878 1 40 VAL MG1 1 44 ASN HD22 . . 4.640 2.392 2.239 2.584 . 0 0 "[ . 1 . 2]" 1
879 1 40 VAL MG2 1 44 ASN HD21 . . 5.440 5.357 4.412 5.477 0.037 19 0 "[ . 1 . 2]" 1
880 1 40 VAL MG2 1 44 ASN HD22 . . 5.260 4.740 4.355 4.989 . 0 0 "[ . 1 . 2]" 1
881 1 41 LEU H 1 41 LEU HB2 . . 3.920 2.463 2.432 2.571 . 0 0 "[ . 1 . 2]" 1
882 1 41 LEU H 1 41 LEU HB3 . . 3.850 3.589 3.572 3.599 . 0 0 "[ . 1 . 2]" 1
883 1 41 LEU H 1 41 LEU MD1 . . 3.860 3.413 3.371 3.479 . 0 0 "[ . 1 . 2]" 1
884 1 41 LEU H 1 41 LEU HG . . 3.490 2.295 2.093 2.448 . 0 0 "[ . 1 . 2]" 1
885 1 41 LEU H 1 42 PRO HD2 . . 4.020 2.464 2.397 2.542 . 0 0 "[ . 1 . 2]" 1
886 1 41 LEU H 1 42 PRO QD . . 3.490 2.427 2.365 2.504 . 0 0 "[ . 1 . 2]" 1
887 1 41 LEU H 1 42 PRO HD3 . . 4.020 3.658 3.578 3.775 . 0 0 "[ . 1 . 2]" 1
888 1 41 LEU H 1 42 PRO QG . . 4.330 4.291 4.221 4.341 0.011 20 0 "[ . 1 . 2]" 1
889 1 41 LEU H 1 43 THR H . . 4.670 4.212 4.143 4.272 . 0 0 "[ . 1 . 2]" 1
890 1 41 LEU HA 1 41 LEU MD2 . . 3.010 2.272 2.195 2.330 . 0 0 "[ . 1 . 2]" 1
891 1 41 LEU HA 1 41 LEU HG . . 3.480 2.959 2.914 3.102 . 0 0 "[ . 1 . 2]" 1
892 1 41 LEU HA 1 43 THR H . . 4.760 4.689 4.609 4.751 . 0 0 "[ . 1 . 2]" 1
893 1 41 LEU HA 1 44 ASN H . . 4.190 3.901 3.787 4.059 . 0 0 "[ . 1 . 2]" 1
894 1 41 LEU HB2 1 42 PRO QD . . 4.990 2.034 1.990 2.082 . 0 0 "[ . 1 . 2]" 1
895 1 41 LEU HB2 1 43 THR H . . 4.910 4.914 4.867 4.934 0.024 4 0 "[ . 1 . 2]" 1
896 1 41 LEU HB3 1 41 LEU MD2 . . 3.310 2.272 2.236 2.309 . 0 0 "[ . 1 . 2]" 1
897 1 41 LEU HB3 1 42 PRO HD2 . . 4.740 3.835 3.734 3.922 . 0 0 "[ . 1 . 2]" 1
898 1 41 LEU HB3 1 42 PRO QD . . 4.100 3.048 2.933 3.142 . 0 0 "[ . 1 . 2]" 1
899 1 41 LEU HB3 1 42 PRO HD3 . . 4.740 3.200 3.066 3.317 . 0 0 "[ . 1 . 2]" 1
900 1 41 LEU MD1 1 42 PRO HD2 . . 4.960 4.053 3.955 4.152 . 0 0 "[ . 1 . 2]" 1
901 1 41 LEU MD1 1 42 PRO HD3 . . 4.960 3.699 3.605 3.823 . 0 0 "[ . 1 . 2]" 1
902 1 41 LEU MD2 1 42 PRO QD . . 5.350 4.341 4.292 4.377 . 0 0 "[ . 1 . 2]" 1
903 1 42 PRO HA 1 45 ARG H . . 3.880 3.079 2.968 3.183 . 0 0 "[ . 1 . 2]" 1
904 1 42 PRO HA 1 45 ARG HB2 . . 4.270 2.869 2.724 3.064 . 0 0 "[ . 1 . 2]" 1
905 1 42 PRO HA 1 45 ARG HB3 . . 4.410 2.489 2.355 2.657 . 0 0 "[ . 1 . 2]" 1
906 1 42 PRO HA 1 45 ARG HE . . 5.120 3.728 3.491 4.009 . 0 0 "[ . 1 . 2]" 1
907 1 42 PRO HA 1 46 ALA H . . 4.680 3.837 3.733 3.961 . 0 0 "[ . 1 . 2]" 1
908 1 42 PRO HB2 1 43 THR H . . 4.300 3.323 3.265 3.436 . 0 0 "[ . 1 . 2]" 1
909 1 42 PRO HB2 1 44 ASN H . . 5.320 5.363 5.344 5.383 0.063 11 0 "[ . 1 . 2]" 1
910 1 42 PRO HB2 1 62 CYS H . . 5.100 4.939 4.681 5.123 0.023 13 0 "[ . 1 . 2]" 1
911 1 42 PRO HB2 1 64 LEU H . . 5.150 4.676 4.535 4.920 . 0 0 "[ . 1 . 2]" 1
912 1 42 PRO HB2 1 65 ALA MB . . 3.860 2.856 2.442 3.209 . 0 0 "[ . 1 . 2]" 1
913 1 42 PRO QD 1 43 THR H . . 4.410 2.848 2.798 2.898 . 0 0 "[ . 1 . 2]" 1
914 1 42 PRO QD 1 44 ASN H . . 4.800 4.499 4.421 4.584 . 0 0 "[ . 1 . 2]" 1
915 1 42 PRO QG 1 65 ALA HA . . 3.800 2.519 2.237 2.815 . 0 0 "[ . 1 . 2]" 1
916 1 42 PRO HG2 1 43 THR H . . 3.820 2.222 2.205 2.245 . 0 0 "[ . 1 . 2]" 1
917 1 42 PRO HG2 1 65 ALA HA . . 4.430 2.807 2.470 3.109 . 0 0 "[ . 1 . 2]" 1
918 1 42 PRO HG2 1 65 ALA MB . . 3.600 2.169 2.137 2.221 . 0 0 "[ . 1 . 2]" 1
919 1 42 PRO HG3 1 43 THR H . . 3.820 3.859 3.845 3.871 0.051 13 0 "[ . 1 . 2]" 1
920 1 42 PRO HG3 1 65 ALA HA . . 4.430 2.854 2.548 3.249 . 0 0 "[ . 1 . 2]" 1
921 1 42 PRO HG3 1 65 ALA MB . . 3.600 3.207 3.104 3.326 . 0 0 "[ . 1 . 2]" 1
922 1 43 THR H 1 43 THR HB . . 3.720 2.598 2.508 2.671 . 0 0 "[ . 1 . 2]" 1
923 1 43 THR H 1 43 THR MG . . 3.770 3.796 3.788 3.808 0.038 17 0 "[ . 1 . 2]" 1
924 1 43 THR H 1 44 ASN H . . 3.410 2.742 2.683 2.779 . 0 0 "[ . 1 . 2]" 1
925 1 43 THR H 1 44 ASN HB2 . . 4.730 4.740 4.734 4.759 0.029 14 0 "[ . 1 . 2]" 1
926 1 43 THR H 1 45 ARG H . . 4.920 4.058 3.973 4.119 . 0 0 "[ . 1 . 2]" 1
927 1 43 THR H 1 46 ALA H . . 5.020 4.812 4.744 4.890 . 0 0 "[ . 1 . 2]" 1
928 1 43 THR H 1 65 ALA MB . . 3.750 3.029 2.896 3.211 . 0 0 "[ . 1 . 2]" 1
929 1 43 THR H 1 68 LEU MD1 . . 6.000 5.663 5.413 5.955 . 0 0 "[ . 1 . 2]" 1
930 1 43 THR HA 1 43 THR MG . . 3.370 2.375 2.317 2.442 . 0 0 "[ . 1 . 2]" 1
931 1 43 THR HA 1 46 ALA H . . 4.320 3.641 3.452 3.743 . 0 0 "[ . 1 . 2]" 1
932 1 43 THR HA 1 46 ALA MB . . 3.660 2.723 2.598 2.890 . 0 0 "[ . 1 . 2]" 1
933 1 43 THR HA 1 65 ALA MB . . 4.720 3.377 3.175 3.596 . 0 0 "[ . 1 . 2]" 1
934 1 43 THR HA 1 75 ALA MB . . 4.970 4.460 4.289 4.756 . 0 0 "[ . 1 . 2]" 1
935 1 43 THR HB 1 44 ASN H . . 3.720 2.658 2.595 2.775 . 0 0 "[ . 1 . 2]" 1
936 1 43 THR HB 1 45 ARG H . . 5.010 5.028 5.015 5.040 0.030 12 0 "[ . 1 . 2]" 1
937 1 43 THR MG 1 44 ASN H . . 3.800 3.636 3.584 3.762 . 0 0 "[ . 1 . 2]" 1
938 1 43 THR MG 1 44 ASN HA . . 4.290 3.804 3.720 3.889 . 0 0 "[ . 1 . 2]" 1
939 1 43 THR MG 1 45 ARG H . . 5.240 5.219 5.153 5.251 0.011 19 0 "[ . 1 . 2]" 1
940 1 43 THR MG 1 46 ALA H . . 5.050 5.004 4.896 5.064 0.014 18 0 "[ . 1 . 2]" 1
941 1 43 THR MG 1 46 ALA MB . . 4.220 3.713 3.558 3.846 . 0 0 "[ . 1 . 2]" 1
942 1 43 THR MG 1 47 SER H . . 5.180 4.591 4.425 4.771 . 0 0 "[ . 1 . 2]" 1
943 1 43 THR MG 1 65 ALA MB . . 4.100 3.627 3.555 3.722 . 0 0 "[ . 1 . 2]" 1
944 1 43 THR MG 1 72 TYR QD . . 4.210 3.633 3.308 3.911 . 0 0 "[ . 1 . 2]" 1
945 1 43 THR MG 1 74 LYS H . . 4.990 4.682 4.445 4.899 . 0 0 "[ . 1 . 2]" 1
946 1 43 THR MG 1 74 LYS HA . . 4.490 4.144 4.037 4.253 . 0 0 "[ . 1 . 2]" 1
947 1 43 THR MG 1 74 LYS HB2 . . 3.740 3.764 3.751 3.786 0.046 18 0 "[ . 1 . 2]" 1
948 1 43 THR MG 1 74 LYS QB . . 3.180 2.310 2.225 2.398 . 0 0 "[ . 1 . 2]" 1
949 1 43 THR MG 1 74 LYS HB3 . . 3.740 2.332 2.241 2.425 . 0 0 "[ . 1 . 2]" 1
950 1 43 THR MG 1 74 LYS QE . . 4.820 4.380 3.751 4.804 . 0 0 "[ . 1 . 2]" 1
951 1 43 THR MG 1 74 LYS HG2 . . 4.230 2.458 2.147 2.873 . 0 0 "[ . 1 . 2]" 1
952 1 43 THR MG 1 74 LYS QG . . 3.630 2.217 2.039 2.541 . 0 0 "[ . 1 . 2]" 1
953 1 43 THR MG 1 74 LYS HG3 . . 4.230 2.749 2.211 3.554 . 0 0 "[ . 1 . 2]" 1
954 1 43 THR MG 1 75 ALA H . . 3.960 3.533 3.279 3.859 . 0 0 "[ . 1 . 2]" 1
955 1 43 THR MG 1 75 ALA HA . . 3.180 2.535 2.317 2.898 . 0 0 "[ . 1 . 2]" 1
956 1 43 THR MG 1 75 ALA MB . . 3.720 3.228 3.102 3.492 . 0 0 "[ . 1 . 2]" 1
957 1 43 THR MG 1 78 ARG H . . 4.840 4.046 3.787 4.236 . 0 0 "[ . 1 . 2]" 1
958 1 43 THR MG 1 78 ARG HA . . 5.650 5.095 4.786 5.346 . 0 0 "[ . 1 . 2]" 1
959 1 43 THR MG 1 78 ARG HD2 . . 5.350 5.059 4.572 5.362 0.012 14 0 "[ . 1 . 2]" 1
960 1 44 ASN H 1 44 ASN HB2 . . 3.620 2.266 2.227 2.310 . 0 0 "[ . 1 . 2]" 1
961 1 44 ASN H 1 44 ASN HB3 . . 3.650 3.521 3.500 3.541 . 0 0 "[ . 1 . 2]" 1
962 1 44 ASN H 1 44 ASN HD21 . . 4.540 4.184 2.205 4.473 . 0 0 "[ . 1 . 2]" 1
963 1 44 ASN H 1 44 ASN HD22 . . 5.010 4.717 3.852 4.886 . 0 0 "[ . 1 . 2]" 1
964 1 44 ASN H 1 45 ARG H . . 3.450 2.606 2.487 2.689 . 0 0 "[ . 1 . 2]" 1
965 1 44 ASN H 1 45 ARG HB2 . . 5.080 4.734 4.563 4.872 . 0 0 "[ . 1 . 2]" 1
966 1 44 ASN H 1 46 ALA H . . 4.650 4.225 4.025 4.351 . 0 0 "[ . 1 . 2]" 1
967 1 44 ASN H 1 65 ALA MB . . 5.560 5.206 5.055 5.413 . 0 0 "[ . 1 . 2]" 1
968 1 44 ASN HA 1 44 ASN HD22 . . 5.360 4.505 3.708 4.622 . 0 0 "[ . 1 . 2]" 1
969 1 44 ASN HB2 1 45 ARG H . . 3.870 3.006 2.929 3.186 . 0 0 "[ . 1 . 2]" 1
970 1 44 ASN HB3 1 45 ARG H . . 3.670 3.708 3.686 3.744 0.074 20 0 "[ . 1 . 2]" 1
971 1 44 ASN HD21 1 45 ARG H . . 5.520 5.448 4.518 5.580 0.060 9 0 "[ . 1 . 2]" 1
972 1 45 ARG H 1 45 ARG HB2 . . 3.750 2.344 2.254 2.460 . 0 0 "[ . 1 . 2]" 1
973 1 45 ARG H 1 45 ARG HB3 . . 3.800 2.691 2.556 2.760 . 0 0 "[ . 1 . 2]" 1
974 1 45 ARG H 1 45 ARG QD . . 4.550 4.525 4.349 4.593 0.043 19 0 "[ . 1 . 2]" 1
975 1 45 ARG H 1 45 ARG HE . . 5.600 5.137 4.978 5.284 . 0 0 "[ . 1 . 2]" 1
976 1 45 ARG H 1 45 ARG QG . . 4.450 3.922 3.897 3.957 . 0 0 "[ . 1 . 2]" 1
977 1 45 ARG H 1 46 ALA H . . 3.530 2.638 2.525 2.704 . 0 0 "[ . 1 . 2]" 1
978 1 45 ARG H 1 47 SER H . . 4.280 3.895 3.776 4.030 . 0 0 "[ . 1 . 2]" 1
979 1 45 ARG H 1 48 ALA H . . 5.270 4.936 4.744 5.162 . 0 0 "[ . 1 . 2]" 1
980 1 45 ARG H 1 61 ASP HB3 . . 4.610 4.688 4.659 4.724 0.114 9 0 "[ . 1 . 2]" 1
981 1 45 ARG HA 1 47 SER H . . 4.270 4.087 3.991 4.191 . 0 0 "[ . 1 . 2]" 1
982 1 45 ARG HA 1 48 ALA H . . 4.200 3.405 3.231 3.576 . 0 0 "[ . 1 . 2]" 1
983 1 45 ARG HA 1 48 ALA MB . . 4.250 2.885 2.708 3.151 . 0 0 "[ . 1 . 2]" 1
984 1 45 ARG HB2 1 45 ARG HE . . 5.090 3.503 3.396 3.600 . 0 0 "[ . 1 . 2]" 1
985 1 45 ARG HB2 1 46 ALA H . . 4.070 3.789 3.697 3.903 . 0 0 "[ . 1 . 2]" 1
986 1 45 ARG QD 1 46 ALA H . . 5.370 5.299 5.229 5.373 0.003 20 0 "[ . 1 . 2]" 1
987 1 45 ARG HE 1 46 ALA H . . 4.960 4.777 4.601 4.974 0.014 1 0 "[ . 1 . 2]" 1
988 1 45 ARG HE 1 49 TYR QD . . 4.330 3.964 3.698 4.339 0.009 14 0 "[ . 1 . 2]" 1
989 1 45 ARG HE 1 49 TYR QE . . 4.010 2.751 2.391 3.083 . 0 0 "[ . 1 . 2]" 1
990 1 45 ARG QG 1 46 ALA H . . 4.990 3.975 3.782 4.115 . 0 0 "[ . 1 . 2]" 1
991 1 46 ALA H 1 46 ALA MB . . 3.000 2.175 2.154 2.196 . 0 0 "[ . 1 . 2]" 1
992 1 46 ALA H 1 47 SER H . . 3.640 2.749 2.712 2.799 . 0 0 "[ . 1 . 2]" 1
993 1 46 ALA H 1 47 SER HA . . 5.320 5.350 5.335 5.371 0.051 7 0 "[ . 1 . 2]" 1
994 1 46 ALA H 1 48 ALA H . . 4.700 4.472 4.397 4.557 . 0 0 "[ . 1 . 2]" 1
995 1 46 ALA H 1 49 TYR QD . . 4.610 4.078 3.856 4.232 . 0 0 "[ . 1 . 2]" 1
996 1 46 ALA H 1 58 ALA HA . . 5.100 4.585 4.398 4.738 . 0 0 "[ . 1 . 2]" 1
997 1 46 ALA H 1 61 ASP H . . 5.970 5.906 5.758 5.991 0.021 7 0 "[ . 1 . 2]" 1
998 1 46 ALA H 1 61 ASP HB2 . . 3.990 3.714 3.599 3.816 . 0 0 "[ . 1 . 2]" 1
999 1 46 ALA H 1 61 ASP HB3 . . 4.090 3.135 2.917 3.320 . 0 0 "[ . 1 . 2]" 1
1000 1 46 ALA HA 1 58 ALA MB . . 3.540 2.575 2.420 2.719 . 0 0 "[ . 1 . 2]" 1
1001 1 46 ALA HA 1 61 ASP H . . 5.210 5.075 4.817 5.220 0.010 7 0 "[ . 1 . 2]" 1
1002 1 46 ALA MB 1 47 SER H . . 3.320 2.765 2.646 2.866 . 0 0 "[ . 1 . 2]" 1
1003 1 46 ALA MB 1 47 SER HA . . 4.130 3.970 3.875 4.086 . 0 0 "[ . 1 . 2]" 1
1004 1 46 ALA MB 1 49 TYR QD . . 4.490 3.934 3.560 4.045 . 0 0 "[ . 1 . 2]" 1
1005 1 46 ALA MB 1 49 TYR QE . . 5.570 5.467 4.999 5.594 0.024 4 0 "[ . 1 . 2]" 1
1006 1 46 ALA MB 1 58 ALA H . . 5.610 4.881 4.761 4.987 . 0 0 "[ . 1 . 2]" 1
1007 1 46 ALA MB 1 58 ALA HA . . 3.440 2.639 2.498 2.779 . 0 0 "[ . 1 . 2]" 1
1008 1 46 ALA MB 1 58 ALA MB . . 3.090 2.297 2.223 2.403 . 0 0 "[ . 1 . 2]" 1
1009 1 46 ALA MB 1 60 SER H . . 6.000 5.246 5.100 5.334 . 0 0 "[ . 1 . 2]" 1
1010 1 46 ALA MB 1 61 ASP H . . 3.890 3.846 3.708 3.904 0.014 7 0 "[ . 1 . 2]" 1
1011 1 46 ALA MB 1 61 ASP HB3 . . 3.620 2.491 2.307 2.732 . 0 0 "[ . 1 . 2]" 1
1012 1 46 ALA MB 1 62 CYS H . . 3.490 3.185 2.998 3.388 . 0 0 "[ . 1 . 2]" 1
1013 1 46 ALA MB 1 62 CYS HA . . 4.360 3.949 3.714 4.138 . 0 0 "[ . 1 . 2]" 1
1014 1 46 ALA MB 1 78 ARG HD2 . . 3.890 3.592 2.948 3.904 0.014 4 0 "[ . 1 . 2]" 1
1015 1 46 ALA MB 1 78 ARG QG . . 3.630 2.246 1.991 2.465 . 0 0 "[ . 1 . 2]" 1
1016 1 47 SER H 1 47 SER QB . . 3.480 2.511 2.246 2.749 . 0 0 "[ . 1 . 2]" 1
1017 1 47 SER H 1 48 ALA H . . 3.470 2.714 2.620 2.777 . 0 0 "[ . 1 . 2]" 1
1018 1 47 SER H 1 48 ALA MB . . 4.310 4.307 4.249 4.331 0.021 16 0 "[ . 1 . 2]" 1
1019 1 47 SER H 1 49 TYR H . . 4.830 4.147 4.064 4.270 . 0 0 "[ . 1 . 2]" 1
1020 1 47 SER H 1 50 PHE H . . 5.170 4.705 4.580 4.803 . 0 0 "[ . 1 . 2]" 1
1021 1 47 SER H 1 50 PHE HB3 . . 6.000 5.129 4.876 5.498 . 0 0 "[ . 1 . 2]" 1
1022 1 47 SER H 1 61 ASP HB3 . . 6.000 5.728 5.455 5.975 . 0 0 "[ . 1 . 2]" 1
1023 1 47 SER H 1 78 ARG HD2 . . 4.320 3.976 3.333 4.337 0.017 10 0 "[ . 1 . 2]" 1
1024 1 47 SER H 1 78 ARG HD3 . . 6.000 5.553 4.969 5.899 . 0 0 "[ . 1 . 2]" 1
1025 1 47 SER H 1 78 ARG QG . . 4.600 3.453 3.228 3.818 . 0 0 "[ . 1 . 2]" 1
1026 1 47 SER HA 1 50 PHE H . . 4.030 3.558 3.351 3.721 . 0 0 "[ . 1 . 2]" 1
1027 1 47 SER HA 1 78 ARG QG . . 4.050 3.404 3.127 4.070 0.020 19 0 "[ . 1 . 2]" 1
1028 1 47 SER QB 1 48 ALA H . . 3.790 2.596 2.340 2.799 . 0 0 "[ . 1 . 2]" 1
1029 1 47 SER QB 1 50 PHE H . . 5.160 5.005 4.866 5.167 0.007 5 0 "[ . 1 . 2]" 1
1030 1 48 ALA H 1 48 ALA MB . . 2.940 2.163 2.140 2.190 . 0 0 "[ . 1 . 2]" 1
1031 1 48 ALA H 1 49 TYR H . . 3.370 2.760 2.615 2.843 . 0 0 "[ . 1 . 2]" 1
1032 1 48 ALA H 1 49 TYR HB2 . . 4.790 4.699 4.538 4.798 0.008 15 0 "[ . 1 . 2]" 1
1033 1 48 ALA H 1 49 TYR QD . . 5.250 5.265 5.250 5.285 0.035 11 0 "[ . 1 . 2]" 1
1034 1 48 ALA H 1 50 PHE H . . 4.450 4.234 4.180 4.318 . 0 0 "[ . 1 . 2]" 1
1035 1 48 ALA HA 1 51 ARG H . . 3.700 3.385 3.287 3.503 . 0 0 "[ . 1 . 2]" 1
1036 1 48 ALA MB 1 49 TYR H . . 3.130 2.574 2.518 2.681 . 0 0 "[ . 1 . 2]" 1
1037 1 48 ALA MB 1 51 ARG H . . 4.550 4.530 4.468 4.555 0.005 19 0 "[ . 1 . 2]" 1
1038 1 48 ALA MB 1 52 LEU MD1 . . 4.670 3.633 3.511 3.746 . 0 0 "[ . 1 . 2]" 1
1039 1 49 TYR H 1 49 TYR HB2 . . 3.730 2.306 2.259 2.381 . 0 0 "[ . 1 . 2]" 1
1040 1 49 TYR H 1 49 TYR HB3 . . 3.830 3.552 3.516 3.575 . 0 0 "[ . 1 . 2]" 1
1041 1 49 TYR H 1 49 TYR QD . . 3.700 3.330 3.260 3.436 . 0 0 "[ . 1 . 2]" 1
1042 1 49 TYR H 1 49 TYR QE . . 5.220 5.016 4.862 5.140 . 0 0 "[ . 1 . 2]" 1
1043 1 49 TYR H 1 50 PHE H . . 3.640 2.896 2.853 2.955 . 0 0 "[ . 1 . 2]" 1
1044 1 49 TYR H 1 50 PHE HA . . 5.670 5.509 5.476 5.539 . 0 0 "[ . 1 . 2]" 1
1045 1 49 TYR H 1 50 PHE HB2 . . 6.000 5.359 5.242 5.459 . 0 0 "[ . 1 . 2]" 1
1046 1 49 TYR H 1 50 PHE HB3 . . 5.120 4.846 4.642 5.007 . 0 0 "[ . 1 . 2]" 1
1047 1 49 TYR H 1 51 ARG H . . 4.270 4.257 4.158 4.301 0.031 3 0 "[ . 1 . 2]" 1
1048 1 49 TYR H 1 52 LEU MD1 . . 4.780 4.680 4.453 4.784 0.004 10 0 "[ . 1 . 2]" 1
1049 1 49 TYR H 1 57 VAL MG2 . . 5.100 5.084 4.983 5.124 0.024 12 0 "[ . 1 . 2]" 1
1050 1 49 TYR H 1 58 ALA MB . . 4.370 4.203 4.132 4.301 . 0 0 "[ . 1 . 2]" 1
1051 1 49 TYR HA 1 49 TYR QD . . 3.700 2.149 2.069 2.235 . 0 0 "[ . 1 . 2]" 1
1052 1 49 TYR HA 1 49 TYR QE . . 4.530 4.357 4.297 4.414 . 0 0 "[ . 1 . 2]" 1
1053 1 49 TYR HA 1 52 LEU H . . 3.650 3.130 3.045 3.222 . 0 0 "[ . 1 . 2]" 1
1054 1 49 TYR HA 1 52 LEU MD1 . . 3.950 2.998 2.706 3.189 . 0 0 "[ . 1 . 2]" 1
1055 1 49 TYR HA 1 54 LYS QB . . 3.810 3.127 2.906 3.307 . 0 0 "[ . 1 . 2]" 1
1056 1 49 TYR HA 1 54 LYS HG2 . . 5.340 5.122 4.718 5.347 0.007 5 0 "[ . 1 . 2]" 1
1057 1 49 TYR HB2 1 50 PHE H . . 4.190 2.859 2.736 2.946 . 0 0 "[ . 1 . 2]" 1
1058 1 49 TYR HB2 1 58 ALA H . . 4.510 4.197 4.054 4.321 . 0 0 "[ . 1 . 2]" 1
1059 1 49 TYR HB2 1 58 ALA MB . . 3.800 2.426 2.264 2.556 . 0 0 "[ . 1 . 2]" 1
1060 1 49 TYR HB3 1 50 PHE H . . 4.370 3.494 3.410 3.593 . 0 0 "[ . 1 . 2]" 1
1061 1 49 TYR HB3 1 50 PHE HB2 . . 5.260 5.085 4.983 5.206 . 0 0 "[ . 1 . 2]" 1
1062 1 49 TYR HB3 1 57 VAL HB . . 5.650 5.380 5.128 5.535 . 0 0 "[ . 1 . 2]" 1
1063 1 49 TYR HB3 1 57 VAL MG2 . . 4.390 2.697 2.519 2.812 . 0 0 "[ . 1 . 2]" 1
1064 1 49 TYR HB3 1 58 ALA H . . 4.170 3.460 3.340 3.556 . 0 0 "[ . 1 . 2]" 1
1065 1 49 TYR HB3 1 58 ALA MB . . 3.940 2.403 2.297 2.460 . 0 0 "[ . 1 . 2]" 1
1066 1 49 TYR QD 1 50 PHE H . . 4.730 4.671 4.618 4.725 . 0 0 "[ . 1 . 2]" 1
1067 1 49 TYR QD 1 54 LYS H . . 4.300 4.320 4.268 4.348 0.048 14 0 "[ . 1 . 2]" 1
1068 1 49 TYR QD 1 54 LYS HA . . 5.290 5.204 5.101 5.291 0.001 8 0 "[ . 1 . 2]" 1
1069 1 49 TYR QD 1 54 LYS QD . . 3.140 2.283 2.067 2.536 . 0 0 "[ . 1 . 2]" 1
1070 1 49 TYR QD 1 54 LYS HG3 . . 3.760 2.988 2.661 3.198 . 0 0 "[ . 1 . 2]" 1
1071 1 49 TYR QD 1 57 VAL HB . . 4.990 4.622 4.416 4.898 . 0 0 "[ . 1 . 2]" 1
1072 1 49 TYR QD 1 57 VAL MG1 . . 4.710 4.824 4.743 4.890 0.180 12 0 "[ . 1 . 2]" 1
1073 1 49 TYR QD 1 57 VAL MG2 . . 3.680 2.748 2.708 2.798 . 0 0 "[ . 1 . 2]" 1
1074 1 49 TYR QD 1 58 ALA MB . . 4.000 3.673 3.382 3.841 . 0 0 "[ . 1 . 2]" 1
1075 1 49 TYR QD 1 61 ASP H . . 5.450 5.187 4.808 5.396 . 0 0 "[ . 1 . 2]" 1
1076 1 49 TYR QE 1 54 LYS QD . . 3.520 2.588 2.385 2.741 . 0 0 "[ . 1 . 2]" 1
1077 1 49 TYR QE 1 57 VAL HB . . 5.300 4.179 3.580 4.527 . 0 0 "[ . 1 . 2]" 1
1078 1 49 TYR QE 1 57 VAL MG2 . . 3.680 2.965 2.790 3.121 . 0 0 "[ . 1 . 2]" 1
1079 1 50 PHE H 1 50 PHE HB2 . . 3.900 2.578 2.492 2.664 . 0 0 "[ . 1 . 2]" 1
1080 1 50 PHE H 1 50 PHE HB3 . . 3.690 2.282 2.179 2.381 . 0 0 "[ . 1 . 2]" 1
1081 1 50 PHE H 1 50 PHE QD . . 4.540 4.128 4.043 4.191 . 0 0 "[ . 1 . 2]" 1
1082 1 50 PHE H 1 51 ARG H . . 3.800 2.857 2.793 2.910 . 0 0 "[ . 1 . 2]" 1
1083 1 50 PHE H 1 51 ARG HB2 . . 5.410 5.196 5.081 5.318 . 0 0 "[ . 1 . 2]" 1
1084 1 50 PHE H 1 52 LEU H . . 4.800 4.140 4.016 4.278 . 0 0 "[ . 1 . 2]" 1
1085 1 50 PHE H 1 58 ALA MB . . 3.510 3.099 2.933 3.223 . 0 0 "[ . 1 . 2]" 1
1086 1 50 PHE HA 1 50 PHE QD . . 3.850 3.208 3.063 3.296 . 0 0 "[ . 1 . 2]" 1
1087 1 50 PHE HA 1 52 LEU H . . 4.550 4.174 3.979 4.383 . 0 0 "[ . 1 . 2]" 1
1088 1 50 PHE HA 1 53 LYS H . . 4.490 3.759 3.618 4.087 . 0 0 "[ . 1 . 2]" 1
1089 1 50 PHE HA 1 54 LYS H . . 3.990 3.542 3.405 3.711 . 0 0 "[ . 1 . 2]" 1
1090 1 50 PHE HA 1 55 PHE H . . 4.720 4.632 4.383 4.740 0.020 14 0 "[ . 1 . 2]" 1
1091 1 50 PHE HA 1 55 PHE QD . . 4.160 2.817 2.689 2.973 . 0 0 "[ . 1 . 2]" 1
1092 1 50 PHE HA 1 58 ALA MB . . 3.630 3.524 3.293 3.643 0.013 14 0 "[ . 1 . 2]" 1
1093 1 50 PHE HB2 1 55 PHE QE . . 4.270 4.132 3.942 4.268 . 0 0 "[ . 1 . 2]" 1
1094 1 50 PHE HB2 1 58 ALA MB . . 4.930 3.000 2.787 3.190 . 0 0 "[ . 1 . 2]" 1
1095 1 50 PHE HB2 1 82 ALA HA . . 4.240 4.276 4.263 4.287 0.047 5 0 "[ . 1 . 2]" 1
1096 1 50 PHE HB3 1 51 ARG H . . 4.110 3.168 2.981 3.305 . 0 0 "[ . 1 . 2]" 1
1097 1 50 PHE QD 1 51 ARG HA . . 4.570 3.707 3.254 4.076 . 0 0 "[ . 1 . 2]" 1
1098 1 50 PHE QD 1 51 ARG HD2 . . 4.580 3.841 2.845 4.275 . 0 0 "[ . 1 . 2]" 1
1099 1 50 PHE QD 1 58 ALA MB . . 4.030 3.967 3.863 4.138 0.108 19 0 "[ . 1 . 2]" 1
1100 1 50 PHE QD 1 81 ALA MB . . 4.340 3.355 3.218 3.634 . 0 0 "[ . 1 . 2]" 1
1101 1 50 PHE QD 1 82 ALA H . . 4.360 3.733 3.497 3.967 . 0 0 "[ . 1 . 2]" 1
1102 1 50 PHE QD 1 82 ALA HA . . 3.850 2.526 2.464 2.596 . 0 0 "[ . 1 . 2]" 1
1103 1 50 PHE QD 1 82 ALA MB . . 3.800 3.236 3.049 3.318 . 0 0 "[ . 1 . 2]" 1
1104 1 50 PHE QD 1 85 ALA MB . . 4.340 3.886 3.681 4.107 . 0 0 "[ . 1 . 2]" 1
1105 1 50 PHE QE 1 51 ARG HD2 . . 4.780 4.392 3.550 4.794 0.014 2 0 "[ . 1 . 2]" 1
1106 1 50 PHE QE 1 51 ARG HD3 . . 4.230 3.350 2.990 4.091 . 0 0 "[ . 1 . 2]" 1
1107 1 50 PHE QE 1 81 ALA MB . . 3.610 2.673 2.479 3.125 . 0 0 "[ . 1 . 2]" 1
1108 1 50 PHE QE 1 82 ALA H . . 4.470 4.326 4.070 4.486 0.016 2 0 "[ . 1 . 2]" 1
1109 1 50 PHE QE 1 82 ALA HA . . 4.240 3.513 3.299 3.634 . 0 0 "[ . 1 . 2]" 1
1110 1 50 PHE QE 1 82 ALA MB . . 4.650 4.639 4.487 4.666 0.016 17 0 "[ . 1 . 2]" 1
1111 1 50 PHE QE 1 85 ALA MB . . 3.790 3.306 2.851 3.795 0.005 10 0 "[ . 1 . 2]" 1
1112 1 50 PHE HZ 1 81 ALA MB . . 4.410 3.546 3.205 4.130 . 0 0 "[ . 1 . 2]" 1
1113 1 51 ARG H 1 51 ARG HB2 . . 3.600 2.512 2.460 2.601 . 0 0 "[ . 1 . 2]" 1
1114 1 51 ARG H 1 51 ARG HB3 . . 3.690 3.658 3.600 3.692 0.002 7 0 "[ . 1 . 2]" 1
1115 1 51 ARG H 1 51 ARG HD2 . . 4.480 4.422 3.966 4.540 0.060 17 0 "[ . 1 . 2]" 1
1116 1 51 ARG H 1 51 ARG HG2 . . 3.790 2.454 2.312 2.591 . 0 0 "[ . 1 . 2]" 1
1117 1 51 ARG H 1 51 ARG HG3 . . 3.940 3.801 3.633 3.943 0.003 20 0 "[ . 1 . 2]" 1
1118 1 51 ARG H 1 52 LEU H . . 3.490 2.375 2.316 2.470 . 0 0 "[ . 1 . 2]" 1
1119 1 51 ARG H 1 52 LEU MD1 . . 5.230 5.230 5.143 5.250 0.020 11 0 "[ . 1 . 2]" 1
1120 1 51 ARG H 1 52 LEU MD2 . . 5.140 5.161 5.078 5.185 0.045 17 0 "[ . 1 . 2]" 1
1121 1 51 ARG H 1 53 LYS H . . 4.320 3.952 3.727 4.134 . 0 0 "[ . 1 . 2]" 1
1122 1 51 ARG HA 1 51 ARG HD2 . . 4.070 2.522 2.166 2.991 . 0 0 "[ . 1 . 2]" 1
1123 1 51 ARG HA 1 51 ARG HD3 . . 4.120 2.705 2.160 3.850 . 0 0 "[ . 1 . 2]" 1
1124 1 51 ARG HA 1 51 ARG HG2 . . 3.910 3.148 2.954 3.330 . 0 0 "[ . 1 . 2]" 1
1125 1 51 ARG HA 1 51 ARG HG3 . . 4.090 3.798 3.738 3.856 . 0 0 "[ . 1 . 2]" 1
1126 1 51 ARG HA 1 53 LYS H . . 4.690 3.452 3.280 3.640 . 0 0 "[ . 1 . 2]" 1
1127 1 51 ARG HG2 1 52 LEU H . . 4.430 4.477 4.445 4.512 0.082 8 0 "[ . 1 . 2]" 1
1128 1 52 LEU H 1 52 LEU HB2 . . 3.410 2.409 2.349 2.473 . 0 0 "[ . 1 . 2]" 1
1129 1 52 LEU H 1 52 LEU HB3 . . 3.750 3.629 3.585 3.685 . 0 0 "[ . 1 . 2]" 1
1130 1 52 LEU H 1 52 LEU MD1 . . 3.950 3.846 3.781 3.926 . 0 0 "[ . 1 . 2]" 1
1131 1 52 LEU H 1 52 LEU MD2 . . 3.680 3.608 3.518 3.681 0.001 8 0 "[ . 1 . 2]" 1
1132 1 52 LEU H 1 52 LEU HG . . 3.400 2.698 2.568 2.814 . 0 0 "[ . 1 . 2]" 1
1133 1 52 LEU H 1 53 LYS H . . 3.380 2.584 2.503 2.699 . 0 0 "[ . 1 . 2]" 1
1134 1 52 LEU H 1 53 LYS HA . . 4.910 4.629 4.514 4.767 . 0 0 "[ . 1 . 2]" 1
1135 1 52 LEU H 1 54 LYS H . . 3.660 3.554 3.394 3.706 0.046 15 0 "[ . 1 . 2]" 1
1136 1 52 LEU H 1 54 LYS HG3 . . 4.030 4.099 4.067 4.137 0.107 6 0 "[ . 1 . 2]" 1
1137 1 52 LEU HA 1 52 LEU MD1 . . 3.890 3.832 3.803 3.849 . 0 0 "[ . 1 . 2]" 1
1138 1 52 LEU HA 1 52 LEU MD2 . . 2.570 2.103 2.077 2.133 . 0 0 "[ . 1 . 2]" 1
1139 1 52 LEU HB2 1 53 LYS H . . 3.950 3.830 3.693 3.918 . 0 0 "[ . 1 . 2]" 1
1140 1 52 LEU HB3 1 53 LYS H . . 4.430 4.392 4.328 4.440 0.010 5 0 "[ . 1 . 2]" 1
1141 1 52 LEU MD1 1 53 LYS H . . 5.560 5.449 5.369 5.504 . 0 0 "[ . 1 . 2]" 1
1142 1 52 LEU MD1 1 54 LYS H . . 5.440 5.131 4.954 5.251 . 0 0 "[ . 1 . 2]" 1
1143 1 52 LEU MD2 1 53 LYS H . . 4.720 4.667 4.603 4.712 . 0 0 "[ . 1 . 2]" 1
1144 1 53 LYS H 1 53 LYS QB . . 3.430 3.378 3.330 3.445 0.015 7 0 "[ . 1 . 2]" 1
1145 1 53 LYS H 1 53 LYS QE . . 5.360 4.855 4.466 5.257 . 0 0 "[ . 1 . 2]" 1
1146 1 53 LYS H 1 53 LYS HG2 . . 3.790 3.224 2.986 3.517 . 0 0 "[ . 1 . 2]" 1
1147 1 53 LYS H 1 53 LYS HG3 . . 4.060 2.948 2.780 3.115 . 0 0 "[ . 1 . 2]" 1
1148 1 53 LYS H 1 54 LYS H . . 3.300 2.769 2.613 2.831 . 0 0 "[ . 1 . 2]" 1
1149 1 53 LYS H 1 54 LYS HA . . 5.570 5.447 5.323 5.497 . 0 0 "[ . 1 . 2]" 1
1150 1 53 LYS H 1 54 LYS HG2 . . 5.400 5.086 4.703 5.266 . 0 0 "[ . 1 . 2]" 1
1151 1 53 LYS H 1 55 PHE H . . 5.430 5.439 5.397 5.466 0.036 6 0 "[ . 1 . 2]" 1
1152 1 53 LYS H 1 55 PHE QE . . 4.630 4.291 4.145 4.390 . 0 0 "[ . 1 . 2]" 1
1153 1 53 LYS HA 1 53 LYS QD . . 3.880 3.881 3.746 3.927 0.047 8 0 "[ . 1 . 2]" 1
1154 1 53 LYS HA 1 53 LYS QE . . 5.350 4.562 4.387 4.796 . 0 0 "[ . 1 . 2]" 1
1155 1 53 LYS HA 1 53 LYS HG2 . . 3.860 2.436 2.340 2.619 . 0 0 "[ . 1 . 2]" 1
1156 1 53 LYS HA 1 55 PHE H . . 4.660 3.895 3.771 4.021 . 0 0 "[ . 1 . 2]" 1
1157 1 53 LYS HA 1 55 PHE QE . . 4.270 2.872 2.605 3.019 . 0 0 "[ . 1 . 2]" 1
1158 1 53 LYS HA 1 55 PHE HZ . . 4.120 2.805 2.661 2.924 . 0 0 "[ . 1 . 2]" 1
1159 1 53 LYS QD 1 55 PHE QE . . 4.040 3.425 2.765 4.039 . 0 0 "[ . 1 . 2]" 1
1160 1 53 LYS QD 1 55 PHE HZ . . 4.920 3.836 2.857 4.695 . 0 0 "[ . 1 . 2]" 1
1161 1 53 LYS QE 1 55 PHE QE . . 5.590 4.546 4.037 5.367 . 0 0 "[ . 1 . 2]" 1
1162 1 53 LYS HG2 1 55 PHE QE . . 4.190 3.283 2.850 3.865 . 0 0 "[ . 1 . 2]" 1
1163 1 53 LYS HG2 1 55 PHE HZ . . 3.970 2.568 2.256 3.567 . 0 0 "[ . 1 . 2]" 1
1164 1 54 LYS H 1 54 LYS QB . . 2.810 2.712 2.612 2.802 . 0 0 "[ . 1 . 2]" 1
1165 1 54 LYS H 1 54 LYS HG2 . . 3.390 3.169 2.880 3.395 0.005 14 0 "[ . 1 . 2]" 1
1166 1 54 LYS H 1 54 LYS HG3 . . 3.630 2.526 2.387 2.645 . 0 0 "[ . 1 . 2]" 1
1167 1 54 LYS H 1 55 PHE H . . 3.620 3.497 3.434 3.618 . 0 0 "[ . 1 . 2]" 1
1168 1 54 LYS H 1 55 PHE QE . . 4.780 4.791 4.659 4.815 0.035 13 0 "[ . 1 . 2]" 1
1169 1 54 LYS HA 1 54 LYS HG2 . . 3.890 2.602 2.488 2.684 . 0 0 "[ . 1 . 2]" 1
1170 1 54 LYS HA 1 54 LYS HG3 . . 3.850 3.516 3.389 3.633 . 0 0 "[ . 1 . 2]" 1
1171 1 54 LYS HA 1 55 PHE H . . 2.950 2.486 2.437 2.534 . 0 0 "[ . 1 . 2]" 1
1172 1 54 LYS HA 1 55 PHE QD . . 5.570 4.409 4.312 4.543 . 0 0 "[ . 1 . 2]" 1
1173 1 54 LYS HA 1 56 ALA H . . 4.110 3.516 3.369 3.615 . 0 0 "[ . 1 . 2]" 1
1174 1 54 LYS HA 1 57 VAL MG1 . . 4.680 4.502 4.300 4.682 0.002 13 0 "[ . 1 . 2]" 1
1175 1 54 LYS QB 1 55 PHE H . . 3.940 3.949 3.922 3.963 0.023 19 0 "[ . 1 . 2]" 1
1176 1 54 LYS QB 1 57 VAL H . . 3.600 3.452 3.280 3.563 . 0 0 "[ . 1 . 2]" 1
1177 1 54 LYS QB 1 57 VAL HB . . 4.640 4.666 4.644 4.693 0.053 19 0 "[ . 1 . 2]" 1
1178 1 54 LYS QB 1 57 VAL MG1 . . 3.230 3.183 2.948 3.254 0.024 10 0 "[ . 1 . 2]" 1
1179 1 54 LYS QB 1 57 VAL MG2 . . 3.500 2.064 2.029 2.130 . 0 0 "[ . 1 . 2]" 1
1180 1 54 LYS HG2 1 55 PHE H . . 4.950 4.843 4.772 4.957 0.007 14 0 "[ . 1 . 2]" 1
1181 1 55 PHE H 1 55 PHE HB2 . . 3.620 2.579 2.548 2.604 . 0 0 "[ . 1 . 2]" 1
1182 1 55 PHE H 1 55 PHE HB3 . . 3.700 3.565 3.542 3.602 . 0 0 "[ . 1 . 2]" 1
1183 1 55 PHE H 1 55 PHE QD . . 3.260 2.476 2.364 2.667 . 0 0 "[ . 1 . 2]" 1
1184 1 55 PHE H 1 56 ALA H . . 3.480 2.570 2.528 2.606 . 0 0 "[ . 1 . 2]" 1
1185 1 55 PHE H 1 56 ALA MB . . 4.090 4.124 4.111 4.142 0.052 14 0 "[ . 1 . 2]" 1
1186 1 55 PHE H 1 57 VAL H . . 4.570 4.452 4.362 4.557 . 0 0 "[ . 1 . 2]" 1
1187 1 55 PHE H 1 57 VAL MG2 . . 5.180 4.812 4.657 4.984 . 0 0 "[ . 1 . 2]" 1
1188 1 55 PHE H 1 58 ALA MB . . 4.540 4.386 4.316 4.459 . 0 0 "[ . 1 . 2]" 1
1189 1 55 PHE H 1 85 ALA MB . . 4.600 4.624 4.602 4.640 0.040 18 0 "[ . 1 . 2]" 1
1190 1 55 PHE H 1 86 LEU MD1 . . 5.350 5.044 4.909 5.173 . 0 0 "[ . 1 . 2]" 1
1191 1 55 PHE H 1 86 LEU MD2 . . 3.930 3.901 3.785 3.940 0.010 20 0 "[ . 1 . 2]" 1
1192 1 55 PHE HA 1 55 PHE QD . . 3.730 2.690 2.579 2.762 . 0 0 "[ . 1 . 2]" 1
1193 1 55 PHE HA 1 55 PHE QE . . 4.790 4.706 4.670 4.749 . 0 0 "[ . 1 . 2]" 1
1194 1 55 PHE HA 1 58 ALA H . . 4.320 3.233 3.164 3.298 . 0 0 "[ . 1 . 2]" 1
1195 1 55 PHE HA 1 58 ALA MB . . 3.450 2.140 2.092 2.200 . 0 0 "[ . 1 . 2]" 1
1196 1 55 PHE HA 1 59 GLU H . . 4.260 3.881 3.725 4.089 . 0 0 "[ . 1 . 2]" 1
1197 1 55 PHE HA 1 82 ALA MB . . 4.050 2.910 2.733 3.126 . 0 0 "[ . 1 . 2]" 1
1198 1 55 PHE HA 1 85 ALA MB . . 4.950 4.506 4.381 4.613 . 0 0 "[ . 1 . 2]" 1
1199 1 55 PHE HA 1 86 LEU MD2 . . 4.720 4.543 4.462 4.636 . 0 0 "[ . 1 . 2]" 1
1200 1 55 PHE HB2 1 56 ALA H . . 4.020 2.814 2.710 2.873 . 0 0 "[ . 1 . 2]" 1
1201 1 55 PHE HB2 1 56 ALA MB . . 4.330 4.091 4.008 4.163 . 0 0 "[ . 1 . 2]" 1
1202 1 55 PHE HB2 1 58 ALA MB . . 5.000 4.643 4.594 4.679 . 0 0 "[ . 1 . 2]" 1
1203 1 55 PHE HB2 1 59 GLU H . . 5.920 5.473 5.413 5.618 . 0 0 "[ . 1 . 2]" 1
1204 1 55 PHE HB2 1 82 ALA MB . . 4.550 4.019 3.847 4.187 . 0 0 "[ . 1 . 2]" 1
1205 1 55 PHE HB2 1 86 LEU MD2 . . 3.460 2.303 2.246 2.360 . 0 0 "[ . 1 . 2]" 1
1206 1 55 PHE HB3 1 56 ALA H . . 4.150 3.948 3.892 3.984 . 0 0 "[ . 1 . 2]" 1
1207 1 55 PHE HB3 1 58 ALA MB . . 4.500 3.796 3.739 3.849 . 0 0 "[ . 1 . 2]" 1
1208 1 55 PHE HB3 1 82 ALA MB . . 4.590 2.640 2.382 2.865 . 0 0 "[ . 1 . 2]" 1
1209 1 55 PHE HB3 1 83 ARG H . . 5.220 5.068 4.908 5.228 0.008 7 0 "[ . 1 . 2]" 1
1210 1 55 PHE HB3 1 85 ALA MB . . 4.420 2.805 2.646 2.973 . 0 0 "[ . 1 . 2]" 1
1211 1 55 PHE HB3 1 86 LEU H . . 5.000 3.845 3.680 4.022 . 0 0 "[ . 1 . 2]" 1
1212 1 55 PHE HB3 1 86 LEU HA . . 5.480 5.144 4.953 5.298 . 0 0 "[ . 1 . 2]" 1
1213 1 55 PHE HB3 1 86 LEU MD1 . . 4.920 3.280 3.161 3.404 . 0 0 "[ . 1 . 2]" 1
1214 1 55 PHE HB3 1 86 LEU MD2 . . 3.800 3.403 3.351 3.470 . 0 0 "[ . 1 . 2]" 1
1215 1 55 PHE QD 1 56 ALA H . . 3.950 3.966 3.954 3.980 0.030 6 0 "[ . 1 . 2]" 1
1216 1 55 PHE QD 1 58 ALA MB . . 4.210 3.673 3.584 3.787 . 0 0 "[ . 1 . 2]" 1
1217 1 55 PHE QD 1 82 ALA H . . 4.910 4.926 4.910 4.940 0.030 7 0 "[ . 1 . 2]" 1
1218 1 55 PHE QD 1 82 ALA HA . . 4.060 2.449 2.341 2.533 . 0 0 "[ . 1 . 2]" 1
1219 1 55 PHE QD 1 82 ALA MB . . 4.100 3.327 2.905 3.559 . 0 0 "[ . 1 . 2]" 1
1220 1 55 PHE QD 1 85 ALA MB . . 3.830 2.711 2.638 2.778 . 0 0 "[ . 1 . 2]" 1
1221 1 55 PHE QD 1 86 LEU H . . 4.840 4.735 4.663 4.841 0.001 19 0 "[ . 1 . 2]" 1
1222 1 55 PHE QD 1 86 LEU MD2 . . 3.530 3.255 3.113 3.476 . 0 0 "[ . 1 . 2]" 1
1223 1 55 PHE QD 1 86 LEU HG . . 4.560 3.987 3.826 4.120 . 0 0 "[ . 1 . 2]" 1
1224 1 55 PHE QE 1 82 ALA HA . . 4.980 4.352 4.022 4.552 . 0 0 "[ . 1 . 2]" 1
1225 1 55 PHE QE 1 85 ALA H . . 5.490 5.346 5.130 5.491 0.001 5 0 "[ . 1 . 2]" 1
1226 1 55 PHE QE 1 85 ALA HA . . 5.180 5.027 4.888 5.144 . 0 0 "[ . 1 . 2]" 1
1227 1 55 PHE QE 1 85 ALA MB . . 3.850 2.793 2.675 2.896 . 0 0 "[ . 1 . 2]" 1
1228 1 55 PHE HZ 1 85 ALA MB . . 4.370 3.205 3.070 3.427 . 0 0 "[ . 1 . 2]" 1
1229 1 56 ALA H 1 56 ALA MB . . 2.790 2.147 2.122 2.177 . 0 0 "[ . 1 . 2]" 1
1230 1 56 ALA H 1 57 VAL H . . 3.260 2.814 2.763 2.880 . 0 0 "[ . 1 . 2]" 1
1231 1 56 ALA H 1 57 VAL MG1 . . 4.510 4.348 4.256 4.462 . 0 0 "[ . 1 . 2]" 1
1232 1 56 ALA H 1 57 VAL MG2 . . 4.810 4.332 4.192 4.540 . 0 0 "[ . 1 . 2]" 1
1233 1 56 ALA H 1 58 ALA H . . 3.860 3.911 3.883 3.927 0.067 11 0 "[ . 1 . 2]" 1
1234 1 56 ALA H 1 58 ALA MB . . 4.700 4.513 4.473 4.545 . 0 0 "[ . 1 . 2]" 1
1235 1 56 ALA H 1 59 GLU H . . 5.010 4.748 4.660 4.867 . 0 0 "[ . 1 . 2]" 1
1236 1 56 ALA H 1 86 LEU MD1 . . 4.080 3.623 3.490 3.781 . 0 0 "[ . 1 . 2]" 1
1237 1 56 ALA H 1 86 LEU MD2 . . 3.520 2.731 2.608 2.929 . 0 0 "[ . 1 . 2]" 1
1238 1 56 ALA H 1 86 LEU HG . . 5.020 4.430 4.278 4.657 . 0 0 "[ . 1 . 2]" 1
1239 1 56 ALA HA 1 59 GLU H . . 4.100 3.839 3.612 4.043 . 0 0 "[ . 1 . 2]" 1
1240 1 56 ALA HA 1 86 LEU MD1 . . 3.360 2.257 2.142 2.390 . 0 0 "[ . 1 . 2]" 1
1241 1 56 ALA HA 1 86 LEU MD2 . . 3.050 2.848 2.589 3.058 0.008 8 0 "[ . 1 . 2]" 1
1242 1 56 ALA MB 1 57 VAL H . . 2.950 2.393 2.322 2.449 . 0 0 "[ . 1 . 2]" 1
1243 1 56 ALA MB 1 57 VAL HA . . 3.890 3.923 3.912 3.933 0.043 12 0 "[ . 1 . 2]" 1
1244 1 56 ALA MB 1 57 VAL MG1 . . 3.200 2.833 2.722 2.989 . 0 0 "[ . 1 . 2]" 1
1245 1 56 ALA MB 1 57 VAL MG2 . . 4.050 3.921 3.692 4.052 0.002 15 0 "[ . 1 . 2]" 1
1246 1 56 ALA MB 1 58 ALA H . . 4.380 4.297 4.204 4.366 . 0 0 "[ . 1 . 2]" 1
1247 1 56 ALA MB 1 59 GLU H . . 4.900 4.805 4.695 4.901 0.001 20 0 "[ . 1 . 2]" 1
1248 1 56 ALA MB 1 86 LEU MD1 . . 3.570 3.384 3.178 3.528 . 0 0 "[ . 1 . 2]" 1
1249 1 56 ALA MB 1 86 LEU MD2 . . 3.040 2.576 2.395 2.797 . 0 0 "[ . 1 . 2]" 1
1250 1 57 VAL H 1 57 VAL HB . . 3.740 3.715 3.699 3.739 . 0 0 "[ . 1 . 2]" 1
1251 1 57 VAL H 1 57 VAL MG1 . . 2.800 2.260 2.191 2.358 . 0 0 "[ . 1 . 2]" 1
1252 1 57 VAL H 1 57 VAL MG2 . . 3.370 2.297 2.192 2.441 . 0 0 "[ . 1 . 2]" 1
1253 1 57 VAL H 1 58 ALA H . . 3.130 2.447 2.322 2.555 . 0 0 "[ . 1 . 2]" 1
1254 1 57 VAL H 1 58 ALA HA . . 5.200 5.135 5.034 5.219 0.019 6 0 "[ . 1 . 2]" 1
1255 1 57 VAL H 1 58 ALA MB . . 4.270 4.145 4.024 4.254 . 0 0 "[ . 1 . 2]" 1
1256 1 57 VAL H 1 59 GLU H . . 4.320 4.145 4.049 4.237 . 0 0 "[ . 1 . 2]" 1
1257 1 57 VAL H 1 60 SER H . . 5.220 4.839 4.634 5.054 . 0 0 "[ . 1 . 2]" 1
1258 1 57 VAL HA 1 57 VAL MG1 . . 3.010 2.408 2.355 2.472 . 0 0 "[ . 1 . 2]" 1
1259 1 57 VAL HA 1 57 VAL MG2 . . 3.240 3.235 3.226 3.245 0.005 8 0 "[ . 1 . 2]" 1
1260 1 57 VAL HA 1 60 SER H . . 3.580 3.052 2.887 3.190 . 0 0 "[ . 1 . 2]" 1
1261 1 57 VAL HA 1 60 SER HB3 . . 3.690 2.773 2.369 3.202 . 0 0 "[ . 1 . 2]" 1
1262 1 57 VAL HB 1 58 ALA H . . 4.210 4.145 4.058 4.211 0.001 15 0 "[ . 1 . 2]" 1
1263 1 57 VAL HB 1 58 ALA HA . . 4.990 4.920 4.783 5.000 0.010 5 0 "[ . 1 . 2]" 1
1264 1 57 VAL HB 1 59 GLU H . . 5.850 5.807 5.753 5.853 0.003 9 0 "[ . 1 . 2]" 1
1265 1 57 VAL MG1 1 58 ALA H . . 4.010 3.981 3.914 4.022 0.012 13 0 "[ . 1 . 2]" 1
1266 1 57 VAL MG1 1 59 GLU H . . 5.420 5.437 5.423 5.451 0.031 4 0 "[ . 1 . 2]" 1
1267 1 57 VAL MG1 1 60 SER H . . 5.350 4.997 4.811 5.176 . 0 0 "[ . 1 . 2]" 1
1268 1 57 VAL MG1 1 61 ASP H . . 6.000 5.748 5.438 6.011 0.011 15 0 "[ . 1 . 2]" 1
1269 1 57 VAL MG2 1 58 ALA H . . 3.510 2.567 2.472 2.656 . 0 0 "[ . 1 . 2]" 1
1270 1 57 VAL MG2 1 58 ALA HA . . 4.110 3.440 3.366 3.528 . 0 0 "[ . 1 . 2]" 1
1271 1 57 VAL MG2 1 58 ALA MB . . 4.510 3.359 3.290 3.453 . 0 0 "[ . 1 . 2]" 1
1272 1 57 VAL MG2 1 59 GLU H . . 4.710 4.681 4.631 4.725 0.015 16 0 "[ . 1 . 2]" 1
1273 1 57 VAL MG2 1 60 SER H . . 4.910 4.887 4.821 4.925 0.015 7 0 "[ . 1 . 2]" 1
1274 1 57 VAL MG2 1 60 SER HB3 . . 4.940 4.820 4.637 4.967 0.027 15 0 "[ . 1 . 2]" 1
1275 1 57 VAL MG2 1 61 ASP H . . 4.790 4.810 4.791 4.831 0.041 19 0 "[ . 1 . 2]" 1
1276 1 58 ALA H 1 58 ALA MB . . 2.780 2.235 2.226 2.247 . 0 0 "[ . 1 . 2]" 1
1277 1 58 ALA H 1 59 GLU H . . 3.470 2.681 2.618 2.754 . 0 0 "[ . 1 . 2]" 1
1278 1 58 ALA H 1 86 LEU MD1 . . 5.820 5.126 4.961 5.360 . 0 0 "[ . 1 . 2]" 1
1279 1 58 ALA HA 1 61 ASP H . . 3.840 3.303 3.194 3.389 . 0 0 "[ . 1 . 2]" 1
1280 1 58 ALA HA 1 62 CYS H . . 4.890 4.206 4.116 4.354 . 0 0 "[ . 1 . 2]" 1
1281 1 58 ALA MB 1 59 GLU H . . 3.150 2.612 2.544 2.696 . 0 0 "[ . 1 . 2]" 1
1282 1 58 ALA MB 1 60 SER H . . 4.620 4.502 4.374 4.591 . 0 0 "[ . 1 . 2]" 1
1283 1 58 ALA MB 1 61 ASP H . . 4.790 4.605 4.515 4.668 . 0 0 "[ . 1 . 2]" 1
1284 1 58 ALA MB 1 62 CYS H . . 5.040 4.683 4.551 4.813 . 0 0 "[ . 1 . 2]" 1
1285 1 59 GLU H 1 59 GLU HB2 . . 3.530 2.484 2.399 2.560 . 0 0 "[ . 1 . 2]" 1
1286 1 59 GLU H 1 59 GLU HB3 . . 3.440 2.456 2.354 2.573 . 0 0 "[ . 1 . 2]" 1
1287 1 59 GLU H 1 59 GLU HG2 . . 4.680 4.456 4.409 4.501 . 0 0 "[ . 1 . 2]" 1
1288 1 59 GLU H 1 59 GLU QG . . 4.110 3.978 3.939 4.014 . 0 0 "[ . 1 . 2]" 1
1289 1 59 GLU H 1 59 GLU HG3 . . 4.680 4.476 4.397 4.520 . 0 0 "[ . 1 . 2]" 1
1290 1 59 GLU H 1 60 SER H . . 3.360 2.724 2.656 2.807 . 0 0 "[ . 1 . 2]" 1
1291 1 59 GLU H 1 61 ASP H . . 4.520 4.295 4.249 4.371 . 0 0 "[ . 1 . 2]" 1
1292 1 59 GLU H 1 61 ASP HB2 . . 6.000 5.301 5.168 5.403 . 0 0 "[ . 1 . 2]" 1
1293 1 59 GLU H 1 86 LEU MD1 . . 4.140 3.866 3.656 4.049 . 0 0 "[ . 1 . 2]" 1
1294 1 59 GLU HA 1 60 SER HA . . 4.870 4.810 4.759 4.866 . 0 0 "[ . 1 . 2]" 1
1295 1 59 GLU HA 1 61 ASP H . . 4.560 4.556 4.472 4.578 0.018 13 0 "[ . 1 . 2]" 1
1296 1 59 GLU HA 1 62 CYS H . . 4.160 3.396 3.307 3.485 . 0 0 "[ . 1 . 2]" 1
1297 1 59 GLU HA 1 63 ASN H . . 4.490 4.002 3.870 4.165 . 0 0 "[ . 1 . 2]" 1
1298 1 59 GLU HB2 1 60 SER H . . 4.250 3.991 3.880 4.068 . 0 0 "[ . 1 . 2]" 1
1299 1 59 GLU HB2 1 62 CYS H . . 6.000 5.688 5.617 5.766 . 0 0 "[ . 1 . 2]" 1
1300 1 59 GLU HB3 1 60 SER H . . 3.620 2.739 2.623 2.835 . 0 0 "[ . 1 . 2]" 1
1301 1 59 GLU QG 1 60 SER H . . 3.840 3.764 3.623 3.868 0.028 9 0 "[ . 1 . 2]" 1
1302 1 60 SER H 1 60 SER HB2 . . 3.880 2.477 2.097 2.700 . 0 0 "[ . 1 . 2]" 1
1303 1 60 SER H 1 60 SER HB3 . . 3.000 2.623 2.363 3.007 0.007 16 0 "[ . 1 . 2]" 1
1304 1 60 SER H 1 61 ASP H . . 3.310 2.601 2.527 2.670 . 0 0 "[ . 1 . 2]" 1
1305 1 60 SER H 1 61 ASP HB2 . . 4.550 4.543 4.508 4.558 0.008 1 0 "[ . 1 . 2]" 1
1306 1 60 SER H 1 61 ASP HB3 . . 6.000 6.042 6.024 6.057 0.057 9 0 "[ . 1 . 2]" 1
1307 1 60 SER H 1 63 ASN H . . 4.740 4.641 4.588 4.704 . 0 0 "[ . 1 . 2]" 1
1308 1 60 SER H 1 63 ASN HB2 . . 5.030 4.794 4.684 4.892 . 0 0 "[ . 1 . 2]" 1
1309 1 60 SER H 1 63 ASN HD21 . . 4.790 4.772 4.530 4.826 0.036 5 0 "[ . 1 . 2]" 1
1310 1 60 SER H 1 86 LEU MD1 . . 5.450 5.378 5.177 5.470 0.020 19 0 "[ . 1 . 2]" 1
1311 1 60 SER HA 1 62 CYS H . . 5.160 4.391 4.126 4.533 . 0 0 "[ . 1 . 2]" 1
1312 1 60 SER HA 1 63 ASN H . . 5.190 3.387 3.123 3.578 . 0 0 "[ . 1 . 2]" 1
1313 1 60 SER HA 1 63 ASN HB2 . . 4.490 2.299 2.173 2.494 . 0 0 "[ . 1 . 2]" 1
1314 1 60 SER HA 1 63 ASN HB3 . . 4.570 3.793 3.621 3.966 . 0 0 "[ . 1 . 2]" 1
1315 1 60 SER HA 1 63 ASN HD21 . . 3.930 2.598 2.455 2.807 . 0 0 "[ . 1 . 2]" 1
1316 1 60 SER HA 1 63 ASN HD22 . . 4.440 4.097 3.720 4.443 0.003 4 0 "[ . 1 . 2]" 1
1317 1 60 SER HB2 1 61 ASP H . . 4.420 3.920 3.578 4.110 . 0 0 "[ . 1 . 2]" 1
1318 1 60 SER HB2 1 63 ASN HD21 . . 4.940 4.391 4.073 4.944 0.004 16 0 "[ . 1 . 2]" 1
1319 1 60 SER HB3 1 61 ASP H . . 3.360 2.792 2.616 3.028 . 0 0 "[ . 1 . 2]" 1
1320 1 61 ASP H 1 62 CYS H . . 3.410 2.772 2.704 2.825 . 0 0 "[ . 1 . 2]" 1
1321 1 61 ASP H 1 64 LEU H . . 5.070 4.854 4.708 4.986 . 0 0 "[ . 1 . 2]" 1
1322 1 61 ASP H 1 64 LEU MD2 . . 5.710 5.615 5.291 5.743 0.033 14 0 "[ . 1 . 2]" 1
1323 1 61 ASP HA 1 63 ASN H . . 4.890 4.479 4.354 4.594 . 0 0 "[ . 1 . 2]" 1
1324 1 61 ASP HA 1 64 LEU H . . 3.990 3.323 3.159 3.469 . 0 0 "[ . 1 . 2]" 1
1325 1 61 ASP HA 1 64 LEU QB . . 3.810 2.578 2.278 2.775 . 0 0 "[ . 1 . 2]" 1
1326 1 61 ASP HA 1 64 LEU MD2 . . 3.850 3.184 2.852 3.362 . 0 0 "[ . 1 . 2]" 1
1327 1 61 ASP HB2 1 62 CYS H . . 3.200 3.131 2.975 3.211 0.011 4 0 "[ . 1 . 2]" 1
1328 1 61 ASP HB3 1 62 CYS H . . 4.040 3.646 3.444 3.795 . 0 0 "[ . 1 . 2]" 1
1329 1 62 CYS H 1 62 CYS HB2 . . 3.880 2.506 2.462 2.530 . 0 0 "[ . 1 . 2]" 1
1330 1 62 CYS H 1 62 CYS HB3 . . 3.880 3.614 3.592 3.630 . 0 0 "[ . 1 . 2]" 1
1331 1 62 CYS H 1 63 ASN H . . 3.360 2.615 2.561 2.675 . 0 0 "[ . 1 . 2]" 1
1332 1 62 CYS H 1 63 ASN HB2 . . 4.410 4.429 4.415 4.442 0.032 7 0 "[ . 1 . 2]" 1
1333 1 62 CYS H 1 64 LEU H . . 4.330 4.035 3.932 4.160 . 0 0 "[ . 1 . 2]" 1
1334 1 62 CYS H 1 65 ALA H . . 4.840 4.675 4.601 4.762 . 0 0 "[ . 1 . 2]" 1
1335 1 62 CYS H 1 79 ARG HA . . 4.930 4.975 4.948 4.993 0.063 15 0 "[ . 1 . 2]" 1
1336 1 62 CYS H 1 79 ARG QG . . 4.310 4.330 4.319 4.348 0.038 15 0 "[ . 1 . 2]" 1
1337 1 62 CYS HA 1 65 ALA MB . . 3.420 2.308 2.242 2.383 . 0 0 "[ . 1 . 2]" 1
1338 1 62 CYS QB 1 63 ASN H . . 3.580 2.718 2.634 2.776 . 0 0 "[ . 1 . 2]" 1
1339 1 62 CYS QB 1 79 ARG H . . 4.900 3.366 3.258 3.466 . 0 0 "[ . 1 . 2]" 1
1340 1 62 CYS QB 1 79 ARG HA . . 4.420 2.894 2.767 2.989 . 0 0 "[ . 1 . 2]" 1
1341 1 62 CYS HB2 1 63 ASN H . . 4.110 2.782 2.687 2.845 . 0 0 "[ . 1 . 2]" 1
1342 1 62 CYS HB2 1 79 ARG HA . . 5.080 3.055 2.911 3.159 . 0 0 "[ . 1 . 2]" 1
1343 1 62 CYS HB3 1 63 ASN H . . 4.110 3.816 3.759 3.863 . 0 0 "[ . 1 . 2]" 1
1344 1 62 CYS HB3 1 79 ARG HA . . 5.080 3.588 3.325 3.787 . 0 0 "[ . 1 . 2]" 1
1345 1 63 ASN H 1 63 ASN HB2 . . 3.440 2.224 2.144 2.325 . 0 0 "[ . 1 . 2]" 1
1346 1 63 ASN H 1 63 ASN HB3 . . 3.680 3.508 3.464 3.548 . 0 0 "[ . 1 . 2]" 1
1347 1 63 ASN H 1 63 ASN HD21 . . 4.160 3.959 3.744 4.165 0.005 18 0 "[ . 1 . 2]" 1
1348 1 63 ASN H 1 63 ASN HD22 . . 4.570 4.540 4.441 4.590 0.020 6 0 "[ . 1 . 2]" 1
1349 1 63 ASN H 1 64 LEU H . . 3.260 2.791 2.740 2.826 . 0 0 "[ . 1 . 2]" 1
1350 1 63 ASN H 1 64 LEU QB . . 4.510 4.485 4.387 4.524 0.014 18 0 "[ . 1 . 2]" 1
1351 1 63 ASN H 1 65 ALA H . . 4.470 4.304 4.238 4.364 . 0 0 "[ . 1 . 2]" 1
1352 1 63 ASN H 1 66 VAL MG2 . . 4.440 4.320 4.213 4.430 . 0 0 "[ . 1 . 2]" 1
1353 1 63 ASN H 1 79 ARG HA . . 5.710 5.659 5.482 5.723 0.013 10 0 "[ . 1 . 2]" 1
1354 1 63 ASN H 1 79 ARG HB2 . . 5.600 4.927 4.740 5.095 . 0 0 "[ . 1 . 2]" 1
1355 1 63 ASN H 1 79 ARG QG . . 4.030 3.979 3.743 4.037 0.007 18 0 "[ . 1 . 2]" 1
1356 1 63 ASN HA 1 63 ASN HD22 . . 5.340 4.595 4.512 4.665 . 0 0 "[ . 1 . 2]" 1
1357 1 63 ASN HA 1 66 VAL H . . 4.160 3.839 3.707 4.104 . 0 0 "[ . 1 . 2]" 1
1358 1 63 ASN HA 1 66 VAL MG1 . . 4.220 3.908 3.773 4.109 . 0 0 "[ . 1 . 2]" 1
1359 1 63 ASN HA 1 66 VAL MG2 . . 3.560 2.268 2.151 2.517 . 0 0 "[ . 1 . 2]" 1
1360 1 63 ASN HB2 1 64 LEU H . . 3.760 3.036 2.879 3.218 . 0 0 "[ . 1 . 2]" 1
1361 1 63 ASN HB3 1 63 ASN HD22 . . 4.070 3.717 3.648 3.772 . 0 0 "[ . 1 . 2]" 1
1362 1 63 ASN HB3 1 64 LEU H . . 3.840 3.677 3.574 3.817 . 0 0 "[ . 1 . 2]" 1
1363 1 63 ASN HD21 1 64 LEU H . . 5.510 5.427 5.262 5.522 0.012 9 0 "[ . 1 . 2]" 1
1364 1 64 LEU H 1 64 LEU QB . . 2.950 2.163 2.096 2.237 . 0 0 "[ . 1 . 2]" 1
1365 1 64 LEU H 1 64 LEU HG . . 4.420 4.313 4.130 4.425 0.005 19 0 "[ . 1 . 2]" 1
1366 1 64 LEU H 1 65 ALA H . . 3.350 2.481 2.386 2.558 . 0 0 "[ . 1 . 2]" 1
1367 1 64 LEU H 1 65 ALA HA . . 5.200 5.131 5.053 5.196 . 0 0 "[ . 1 . 2]" 1
1368 1 64 LEU H 1 65 ALA MB . . 4.150 4.086 3.986 4.146 . 0 0 "[ . 1 . 2]" 1
1369 1 64 LEU H 1 66 VAL H . . 4.570 4.032 3.907 4.090 . 0 0 "[ . 1 . 2]" 1
1370 1 64 LEU H 1 66 VAL MG1 . . 5.390 5.385 5.236 5.408 0.018 2 0 "[ . 1 . 2]" 1
1371 1 64 LEU H 1 66 VAL MG2 . . 4.840 4.162 4.058 4.247 . 0 0 "[ . 1 . 2]" 1
1372 1 64 LEU HA 1 66 VAL H . . 4.210 4.197 4.150 4.230 0.020 19 0 "[ . 1 . 2]" 1
1373 1 64 LEU HA 1 66 VAL MG2 . . 4.470 4.238 4.139 4.331 . 0 0 "[ . 1 . 2]" 1
1374 1 64 LEU HA 1 67 ALA MB . . 2.920 2.368 2.277 2.469 . 0 0 "[ . 1 . 2]" 1
1375 1 64 LEU QB 1 67 ALA MB . . 3.980 3.985 3.879 4.005 0.025 18 0 "[ . 1 . 2]" 1
1376 1 64 LEU MD1 1 65 ALA HA . . 5.160 4.748 4.204 5.166 0.006 19 0 "[ . 1 . 2]" 1
1377 1 64 LEU MD1 1 67 ALA H . . 4.570 4.331 4.121 4.573 0.003 7 0 "[ . 1 . 2]" 1
1378 1 64 LEU MD1 1 67 ALA HA . . 5.980 5.378 5.264 5.529 . 0 0 "[ . 1 . 2]" 1
1379 1 64 LEU MD2 1 65 ALA HA . . 4.880 4.537 4.446 4.685 . 0 0 "[ . 1 . 2]" 1
1380 1 64 LEU MD2 1 65 ALA MB . . 4.460 4.468 4.453 4.478 0.018 10 0 "[ . 1 . 2]" 1
1381 1 64 LEU MD2 1 66 VAL H . . 6.000 6.056 6.046 6.064 0.064 15 0 "[ . 1 . 2]" 1
1382 1 64 LEU MD2 1 68 LEU MD1 . . 3.790 3.437 3.086 3.793 0.003 11 0 "[ . 1 . 2]" 1
1383 1 65 ALA H 1 65 ALA MB . . 3.310 2.175 2.158 2.191 . 0 0 "[ . 1 . 2]" 1
1384 1 65 ALA H 1 66 VAL H . . 3.570 2.852 2.806 2.893 . 0 0 "[ . 1 . 2]" 1
1385 1 65 ALA H 1 66 VAL MG2 . . 4.220 4.149 4.057 4.222 0.002 13 0 "[ . 1 . 2]" 1
1386 1 65 ALA HA 1 68 LEU H . . 4.150 3.920 3.749 4.086 . 0 0 "[ . 1 . 2]" 1
1387 1 65 ALA HA 1 68 LEU MD1 . . 3.890 2.672 2.533 2.857 . 0 0 "[ . 1 . 2]" 1
1388 1 65 ALA HA 1 69 ASN H . . 4.760 4.468 4.284 4.713 . 0 0 "[ . 1 . 2]" 1
1389 1 65 ALA HA 1 75 ALA MB . . 5.440 4.318 4.185 4.428 . 0 0 "[ . 1 . 2]" 1
1390 1 65 ALA MB 1 66 VAL H . . 3.110 2.657 2.609 2.725 . 0 0 "[ . 1 . 2]" 1
1391 1 65 ALA MB 1 66 VAL HA . . 4.410 4.002 3.970 4.057 . 0 0 "[ . 1 . 2]" 1
1392 1 65 ALA MB 1 66 VAL MG1 . . 3.660 3.118 3.029 3.221 . 0 0 "[ . 1 . 2]" 1
1393 1 65 ALA MB 1 66 VAL MG2 . . 3.970 3.948 3.869 3.980 0.010 17 0 "[ . 1 . 2]" 1
1394 1 65 ALA MB 1 67 ALA H . . 4.640 4.477 4.415 4.539 . 0 0 "[ . 1 . 2]" 1
1395 1 65 ALA MB 1 72 TYR QD . . 4.260 3.010 2.725 3.420 . 0 0 "[ . 1 . 2]" 1
1396 1 66 VAL H 1 66 VAL HB . . 3.670 3.699 3.686 3.710 0.040 19 0 "[ . 1 . 2]" 1
1397 1 66 VAL H 1 66 VAL MG1 . . 3.230 2.504 2.449 2.592 . 0 0 "[ . 1 . 2]" 1
1398 1 66 VAL H 1 66 VAL MG2 . . 3.020 2.095 2.030 2.143 . 0 0 "[ . 1 . 2]" 1
1399 1 66 VAL H 1 67 ALA H . . 3.230 2.463 2.432 2.479 . 0 0 "[ . 1 . 2]" 1
1400 1 66 VAL H 1 67 ALA HA . . 5.050 5.091 5.076 5.100 0.050 14 0 "[ . 1 . 2]" 1
1401 1 66 VAL H 1 68 LEU H . . 4.350 4.137 3.998 4.278 . 0 0 "[ . 1 . 2]" 1
1402 1 66 VAL H 1 70 ARG HA . . 6.000 5.932 5.689 6.033 0.033 12 0 "[ . 1 . 2]" 1
1403 1 66 VAL H 1 75 ALA MB . . 4.390 3.492 3.433 3.551 . 0 0 "[ . 1 . 2]" 1
1404 1 66 VAL HA 1 66 VAL MG1 . . 3.270 2.335 2.309 2.370 . 0 0 "[ . 1 . 2]" 1
1405 1 66 VAL HA 1 66 VAL MG2 . . 3.210 3.239 3.235 3.243 0.033 18 0 "[ . 1 . 2]" 1
1406 1 66 VAL HA 1 68 LEU H . . 4.380 3.868 3.600 4.021 . 0 0 "[ . 1 . 2]" 1
1407 1 66 VAL HA 1 69 ASN H . . 3.480 3.085 2.988 3.173 . 0 0 "[ . 1 . 2]" 1
1408 1 66 VAL HA 1 70 ARG H . . 5.080 4.681 4.547 4.861 . 0 0 "[ . 1 . 2]" 1
1409 1 66 VAL HA 1 72 TYR H . . 5.090 4.433 4.203 4.736 . 0 0 "[ . 1 . 2]" 1
1410 1 66 VAL HA 1 75 ALA MB . . 4.600 3.614 3.436 3.747 . 0 0 "[ . 1 . 2]" 1
1411 1 66 VAL HB 1 70 ARG HD2 . . 3.730 3.522 3.480 3.579 . 0 0 "[ . 1 . 2]" 1
1412 1 66 VAL HB 1 70 ARG HD3 . . 3.480 2.137 2.036 2.229 . 0 0 "[ . 1 . 2]" 1
1413 1 66 VAL HB 1 75 ALA MB . . 4.420 4.429 4.342 4.446 0.026 14 0 "[ . 1 . 2]" 1
1414 1 66 VAL HB 1 76 TYR QE . . 4.480 3.979 3.731 4.271 . 0 0 "[ . 1 . 2]" 1
1415 1 66 VAL MG1 1 67 ALA H . . 4.160 4.153 4.116 4.174 0.014 11 0 "[ . 1 . 2]" 1
1416 1 66 VAL MG1 1 70 ARG H . . 5.910 5.663 5.502 5.862 . 0 0 "[ . 1 . 2]" 1
1417 1 66 VAL MG1 1 70 ARG HA . . 3.790 3.513 3.338 3.698 . 0 0 "[ . 1 . 2]" 1
1418 1 66 VAL MG1 1 70 ARG HD2 . . 4.660 4.695 4.679 4.708 0.048 15 0 "[ . 1 . 2]" 1
1419 1 66 VAL MG1 1 70 ARG HD3 . . 4.180 3.710 3.633 3.797 . 0 0 "[ . 1 . 2]" 1
1420 1 66 VAL MG1 1 72 TYR H . . 4.750 4.214 3.945 4.472 . 0 0 "[ . 1 . 2]" 1
1421 1 66 VAL MG1 1 75 ALA HA . . 4.300 4.296 4.227 4.312 0.012 8 0 "[ . 1 . 2]" 1
1422 1 66 VAL MG1 1 75 ALA MB . . 3.240 2.107 2.071 2.155 . 0 0 "[ . 1 . 2]" 1
1423 1 66 VAL MG1 1 76 TYR H . . 4.740 4.032 3.893 4.224 . 0 0 "[ . 1 . 2]" 1
1424 1 66 VAL MG1 1 76 TYR QD . . 4.070 3.501 3.338 3.641 . 0 0 "[ . 1 . 2]" 1
1425 1 66 VAL MG1 1 76 TYR QE . . 3.800 2.834 2.631 3.087 . 0 0 "[ . 1 . 2]" 1
1426 1 66 VAL MG2 1 67 ALA H . . 3.360 2.542 2.448 2.606 . 0 0 "[ . 1 . 2]" 1
1427 1 66 VAL MG2 1 67 ALA HA . . 4.610 3.425 3.328 3.514 . 0 0 "[ . 1 . 2]" 1
1428 1 66 VAL MG2 1 67 ALA MB . . 3.330 3.333 3.270 3.342 0.012 19 0 "[ . 1 . 2]" 1
1429 1 66 VAL MG2 1 68 LEU H . . 4.580 4.531 4.462 4.581 0.001 2 0 "[ . 1 . 2]" 1
1430 1 66 VAL MG2 1 69 ASN H . . 5.240 5.223 5.173 5.260 0.020 17 0 "[ . 1 . 2]" 1
1431 1 66 VAL MG2 1 70 ARG HD2 . . 4.930 4.186 3.855 4.348 . 0 0 "[ . 1 . 2]" 1
1432 1 66 VAL MG2 1 75 ALA MB . . 4.050 3.943 3.863 4.037 . 0 0 "[ . 1 . 2]" 1
1433 1 66 VAL MG2 1 76 TYR QE . . 4.200 4.008 3.769 4.211 0.011 20 0 "[ . 1 . 2]" 1
1434 1 67 ALA H 1 67 ALA MB . . 2.610 2.190 2.160 2.219 . 0 0 "[ . 1 . 2]" 1
1435 1 67 ALA H 1 68 LEU H . . 3.130 2.620 2.541 2.679 . 0 0 "[ . 1 . 2]" 1
1436 1 67 ALA H 1 68 LEU MD1 . . 4.890 4.787 4.644 4.891 0.001 15 0 "[ . 1 . 2]" 1
1437 1 67 ALA H 1 69 ASN H . . 4.320 4.301 4.217 4.345 0.025 17 0 "[ . 1 . 2]" 1
1438 1 67 ALA H 1 70 ARG HD3 . . 5.300 4.884 4.691 5.082 . 0 0 "[ . 1 . 2]" 1
1439 1 67 ALA HA 1 68 LEU MD2 . . 6.000 5.395 5.081 5.705 . 0 0 "[ . 1 . 2]" 1
1440 1 67 ALA HA 1 69 ASN H . . 5.020 4.972 4.888 5.046 0.026 12 0 "[ . 1 . 2]" 1
1441 1 67 ALA HA 1 70 ARG HG2 . . 4.390 4.209 3.879 4.414 0.024 4 0 "[ . 1 . 2]" 1
1442 1 67 ALA MB 1 68 LEU H . . 3.150 2.732 2.570 3.015 . 0 0 "[ . 1 . 2]" 1
1443 1 67 ALA MB 1 68 LEU MD1 . . 3.940 3.970 3.957 3.983 0.043 12 0 "[ . 1 . 2]" 1
1444 1 68 LEU H 1 68 LEU QB . . 3.490 2.332 2.261 2.430 . 0 0 "[ . 1 . 2]" 1
1445 1 68 LEU H 1 68 LEU MD1 . . 3.430 3.365 3.303 3.448 0.018 8 0 "[ . 1 . 2]" 1
1446 1 68 LEU H 1 68 LEU MD2 . . 3.850 3.652 3.430 3.865 0.015 12 0 "[ . 1 . 2]" 1
1447 1 68 LEU H 1 68 LEU HG . . 3.270 2.411 2.167 2.648 . 0 0 "[ . 1 . 2]" 1
1448 1 68 LEU H 1 69 ASN H . . 3.130 2.485 2.247 2.620 . 0 0 "[ . 1 . 2]" 1
1449 1 68 LEU H 1 69 ASN HA . . 5.190 5.042 4.830 5.167 . 0 0 "[ . 1 . 2]" 1
1450 1 68 LEU H 1 69 ASN QB . . 4.900 4.577 4.399 4.817 . 0 0 "[ . 1 . 2]" 1
1451 1 68 LEU HA 1 68 LEU MD1 . . 4.090 3.899 3.856 3.950 . 0 0 "[ . 1 . 2]" 1
1452 1 68 LEU HA 1 68 LEU MD2 . . 2.750 2.242 2.152 2.305 . 0 0 "[ . 1 . 2]" 1
1453 1 68 LEU QB 1 68 LEU MD2 . . 3.150 2.254 2.199 2.311 . 0 0 "[ . 1 . 2]" 1
1454 1 68 LEU QB 1 69 ASN H . . 3.180 2.379 2.321 2.446 . 0 0 "[ . 1 . 2]" 1
1455 1 68 LEU HB2 1 69 ASN H . . 3.840 2.421 2.358 2.483 . 0 0 "[ . 1 . 2]" 1
1456 1 68 LEU HB3 1 69 ASN H . . 3.840 3.502 3.352 3.683 . 0 0 "[ . 1 . 2]" 1
1457 1 68 LEU MD1 1 69 ASN H . . 4.150 4.185 4.133 4.223 0.073 20 0 "[ . 1 . 2]" 1
1458 1 69 ASN H 1 69 ASN QB . . 3.540 2.488 2.382 2.588 . 0 0 "[ . 1 . 2]" 1
1459 1 69 ASN H 1 69 ASN HD21 . . 4.940 4.994 4.954 5.026 0.086 20 0 "[ . 1 . 2]" 1
1460 1 69 ASN H 1 69 ASN HD22 . . 6.000 6.025 5.998 6.066 0.066 20 0 "[ . 1 . 2]" 1
1461 1 69 ASN H 1 70 ARG H . . 4.250 4.046 3.927 4.174 . 0 0 "[ . 1 . 2]" 1
1462 1 69 ASN H 1 70 ARG HG2 . . 4.610 4.650 4.628 4.695 0.085 20 0 "[ . 1 . 2]" 1
1463 1 69 ASN H 1 72 TYR H . . 5.720 5.203 4.969 5.477 . 0 0 "[ . 1 . 2]" 1
1464 1 69 ASN H 1 72 TYR HB2 . . 5.450 5.054 4.733 5.464 0.014 14 0 "[ . 1 . 2]" 1
1465 1 69 ASN HA 1 70 ARG H . . 2.990 2.107 2.072 2.145 . 0 0 "[ . 1 . 2]" 1
1466 1 69 ASN QB 1 69 ASN HD22 . . 3.790 3.216 3.182 3.282 . 0 0 "[ . 1 . 2]" 1
1467 1 69 ASN QB 1 70 ARG H . . 3.890 3.926 3.891 3.953 0.063 13 0 "[ . 1 . 2]" 1
1468 1 69 ASN QB 1 71 SER H . . 3.890 3.749 3.613 3.906 0.016 3 0 "[ . 1 . 2]" 1
1469 1 69 ASN QB 1 72 TYR H . . 3.870 3.643 3.432 3.863 . 0 0 "[ . 1 . 2]" 1
1470 1 69 ASN HD21 1 71 SER H . . 5.470 4.859 4.280 5.171 . 0 0 "[ . 1 . 2]" 1
1471 1 69 ASN HD21 1 72 TYR HB2 . . 5.160 3.213 2.239 4.679 . 0 0 "[ . 1 . 2]" 1
1472 1 69 ASN HD22 1 71 SER H . . 5.140 4.185 3.677 4.588 . 0 0 "[ . 1 . 2]" 1
1473 1 69 ASN HD22 1 71 SER HB3 . . 6.000 4.970 4.186 5.656 . 0 0 "[ . 1 . 2]" 1
1474 1 70 ARG H 1 70 ARG QB . . 3.110 2.369 2.286 2.455 . 0 0 "[ . 1 . 2]" 1
1475 1 70 ARG H 1 70 ARG HD3 . . 4.500 4.122 4.029 4.215 . 0 0 "[ . 1 . 2]" 1
1476 1 70 ARG H 1 70 ARG HG2 . . 3.520 2.529 2.417 2.648 . 0 0 "[ . 1 . 2]" 1
1477 1 70 ARG H 1 70 ARG HG3 . . 3.940 3.700 3.600 3.811 . 0 0 "[ . 1 . 2]" 1
1478 1 70 ARG H 1 71 SER HB2 . . 5.150 4.631 4.478 4.764 . 0 0 "[ . 1 . 2]" 1
1479 1 70 ARG H 1 71 SER HB3 . . 6.000 6.028 6.003 6.049 0.049 20 0 "[ . 1 . 2]" 1
1480 1 70 ARG H 1 72 TYR H . . 4.680 4.556 4.434 4.654 . 0 0 "[ . 1 . 2]" 1
1481 1 70 ARG HA 1 70 ARG HD2 . . 4.400 3.200 3.106 3.437 . 0 0 "[ . 1 . 2]" 1
1482 1 70 ARG HA 1 70 ARG HD3 . . 4.050 2.224 2.127 2.330 . 0 0 "[ . 1 . 2]" 1
1483 1 70 ARG HA 1 70 ARG HG2 . . 4.140 2.947 2.888 2.998 . 0 0 "[ . 1 . 2]" 1
1484 1 70 ARG HA 1 70 ARG HG3 . . 4.090 3.792 3.772 3.828 . 0 0 "[ . 1 . 2]" 1
1485 1 70 ARG HA 1 72 TYR H . . 4.490 3.817 3.708 3.948 . 0 0 "[ . 1 . 2]" 1
1486 1 70 ARG QB 1 70 ARG HD2 . . 3.610 2.392 2.306 2.446 . 0 0 "[ . 1 . 2]" 1
1487 1 70 ARG QB 1 70 ARG HD3 . . 3.520 2.902 2.799 2.954 . 0 0 "[ . 1 . 2]" 1
1488 1 70 ARG QB 1 71 SER H . . 3.880 3.555 3.433 3.652 . 0 0 "[ . 1 . 2]" 1
1489 1 70 ARG QB 1 72 TYR H . . 5.070 5.065 4.941 5.106 0.036 17 0 "[ . 1 . 2]" 1
1490 1 71 SER H 1 71 SER HB2 . . 3.390 2.606 2.436 2.722 . 0 0 "[ . 1 . 2]" 1
1491 1 71 SER H 1 71 SER HB3 . . 3.870 3.750 3.646 3.809 . 0 0 "[ . 1 . 2]" 1
1492 1 71 SER H 1 72 TYR H . . 3.190 2.279 2.090 2.504 . 0 0 "[ . 1 . 2]" 1
1493 1 71 SER H 1 72 TYR HB2 . . 4.160 4.122 3.963 4.190 0.030 13 0 "[ . 1 . 2]" 1
1494 1 71 SER H 1 76 TYR QE . . 4.650 4.155 3.828 4.530 . 0 0 "[ . 1 . 2]" 1
1495 1 71 SER H 1 102 LEU MD2 . . 4.980 4.662 4.521 4.878 . 0 0 "[ . 1 . 2]" 1
1496 1 71 SER HA 1 102 LEU MD1 . . 3.830 2.200 2.095 2.474 . 0 0 "[ . 1 . 2]" 1
1497 1 71 SER HA 1 102 LEU MD2 . . 3.760 2.247 2.103 2.467 . 0 0 "[ . 1 . 2]" 1
1498 1 71 SER HB2 1 72 TYR H . . 4.460 3.861 3.512 4.002 . 0 0 "[ . 1 . 2]" 1
1499 1 71 SER HB2 1 73 THR H . . 6.000 5.736 5.503 5.992 . 0 0 "[ . 1 . 2]" 1
1500 1 71 SER HB2 1 102 LEU MD2 . . 4.410 3.878 3.650 4.300 . 0 0 "[ . 1 . 2]" 1
1501 1 71 SER HB3 1 72 TYR H . . 4.490 4.428 4.287 4.495 0.005 10 0 "[ . 1 . 2]" 1
1502 1 71 SER HB3 1 73 THR H . . 5.250 5.104 4.866 5.268 0.018 20 0 "[ . 1 . 2]" 1
1503 1 71 SER HB3 1 76 TYR QE . . 5.500 5.452 5.218 5.518 0.018 14 0 "[ . 1 . 2]" 1
1504 1 71 SER HB3 1 102 LEU MD2 . . 4.110 2.517 2.278 2.945 . 0 0 "[ . 1 . 2]" 1
1505 1 72 TYR H 1 72 TYR HB2 . . 3.450 2.671 2.533 2.786 . 0 0 "[ . 1 . 2]" 1
1506 1 72 TYR H 1 72 TYR HB3 . . 3.990 2.518 2.399 2.638 . 0 0 "[ . 1 . 2]" 1
1507 1 72 TYR H 1 72 TYR QD . . 4.420 4.277 4.223 4.337 . 0 0 "[ . 1 . 2]" 1
1508 1 72 TYR H 1 73 THR H . . 4.340 4.118 4.047 4.241 . 0 0 "[ . 1 . 2]" 1
1509 1 72 TYR H 1 75 ALA H . . 5.100 5.137 5.116 5.154 0.054 8 0 "[ . 1 . 2]" 1
1510 1 72 TYR H 1 75 ALA MB . . 4.290 4.132 4.081 4.203 . 0 0 "[ . 1 . 2]" 1
1511 1 72 TYR H 1 76 TYR QD . . 4.550 4.488 4.329 4.568 0.018 13 0 "[ . 1 . 2]" 1
1512 1 72 TYR H 1 76 TYR QE . . 4.230 3.175 2.829 3.507 . 0 0 "[ . 1 . 2]" 1
1513 1 72 TYR H 1 102 LEU MD1 . . 4.830 3.774 3.582 4.027 . 0 0 "[ . 1 . 2]" 1
1514 1 72 TYR H 1 102 LEU MD2 . . 5.070 4.831 4.680 5.067 . 0 0 "[ . 1 . 2]" 1
1515 1 72 TYR HA 1 73 THR H . . 2.920 2.157 2.121 2.202 . 0 0 "[ . 1 . 2]" 1
1516 1 72 TYR HB2 1 73 THR H . . 4.860 4.511 4.453 4.555 . 0 0 "[ . 1 . 2]" 1
1517 1 72 TYR HB3 1 73 THR H . . 4.400 4.437 4.423 4.449 0.049 20 0 "[ . 1 . 2]" 1
1518 1 72 TYR HB3 1 75 ALA H . . 4.400 3.505 3.379 3.691 . 0 0 "[ . 1 . 2]" 1
1519 1 72 TYR HB3 1 75 ALA MB . . 4.440 2.810 2.637 2.970 . 0 0 "[ . 1 . 2]" 1
1520 1 72 TYR QD 1 73 THR H . . 3.620 3.458 2.904 3.645 0.025 5 0 "[ . 1 . 2]" 1
1521 1 72 TYR QD 1 74 LYS H . . 4.250 3.654 2.874 3.997 . 0 0 "[ . 1 . 2]" 1
1522 1 72 TYR QD 1 75 ALA H . . 3.440 3.219 2.909 3.459 0.019 19 0 "[ . 1 . 2]" 1
1523 1 72 TYR QD 1 75 ALA MB . . 3.530 2.326 2.172 2.550 . 0 0 "[ . 1 . 2]" 1
1524 1 73 THR H 1 73 THR HB . . 3.510 3.012 2.905 3.251 . 0 0 "[ . 1 . 2]" 1
1525 1 73 THR H 1 73 THR MG . . 3.500 3.515 3.402 3.547 0.047 5 0 "[ . 1 . 2]" 1
1526 1 73 THR H 1 74 LYS H . . 3.530 3.061 2.978 3.176 . 0 0 "[ . 1 . 2]" 1
1527 1 73 THR H 1 74 LYS QB . . 5.470 4.765 4.634 4.947 . 0 0 "[ . 1 . 2]" 1
1528 1 73 THR H 1 75 ALA H . . 4.490 4.482 4.443 4.514 0.024 2 0 "[ . 1 . 2]" 1
1529 1 73 THR H 1 75 ALA MB . . 5.960 5.222 5.169 5.260 . 0 0 "[ . 1 . 2]" 1
1530 1 73 THR H 1 76 TYR H . . 5.160 5.177 5.117 5.208 0.048 2 0 "[ . 1 . 2]" 1
1531 1 73 THR H 1 76 TYR QD . . 4.100 4.121 4.104 4.137 0.037 10 0 "[ . 1 . 2]" 1
1532 1 73 THR H 1 99 VAL MG2 . . 6.000 5.931 5.779 6.009 0.009 20 0 "[ . 1 . 2]" 1
1533 1 73 THR H 1 102 LEU HB3 . . 4.960 3.919 3.658 4.284 . 0 0 "[ . 1 . 2]" 1
1534 1 73 THR H 1 102 LEU MD1 . . 3.650 3.279 2.834 3.654 0.004 19 0 "[ . 1 . 2]" 1
1535 1 73 THR H 1 102 LEU MD2 . . 5.290 4.519 4.151 4.832 . 0 0 "[ . 1 . 2]" 1
1536 1 73 THR HA 1 73 THR MG . . 3.380 2.145 2.092 2.195 . 0 0 "[ . 1 . 2]" 1
1537 1 73 THR HA 1 76 TYR H . . 4.260 3.443 3.305 3.543 . 0 0 "[ . 1 . 2]" 1
1538 1 73 THR HA 1 76 TYR QD . . 3.970 2.207 2.155 2.251 . 0 0 "[ . 1 . 2]" 1
1539 1 73 THR HA 1 76 TYR QE . . 4.180 4.063 3.909 4.190 0.010 18 0 "[ . 1 . 2]" 1
1540 1 73 THR HA 1 102 LEU MD1 . . 3.900 2.701 2.317 2.991 . 0 0 "[ . 1 . 2]" 1
1541 1 73 THR HB 1 74 LYS H . . 4.010 2.687 2.552 2.872 . 0 0 "[ . 1 . 2]" 1
1542 1 73 THR HB 1 99 VAL MG1 . . 4.580 3.829 3.414 4.043 . 0 0 "[ . 1 . 2]" 1
1543 1 73 THR MG 1 76 TYR H . . 4.550 4.407 4.236 4.563 0.013 18 0 "[ . 1 . 2]" 1
1544 1 73 THR MG 1 76 TYR QD . . 4.020 3.667 3.616 3.733 . 0 0 "[ . 1 . 2]" 1
1545 1 73 THR MG 1 76 TYR QE . . 5.150 5.183 5.169 5.208 0.058 2 0 "[ . 1 . 2]" 1
1546 1 73 THR MG 1 77 SER H . . 4.240 4.086 3.838 4.245 0.005 18 0 "[ . 1 . 2]" 1
1547 1 73 THR MG 1 99 VAL H . . 4.470 4.422 4.280 4.488 0.018 13 0 "[ . 1 . 2]" 1
1548 1 73 THR MG 1 99 VAL HA . . 3.330 2.061 1.972 2.132 . 0 0 "[ . 1 . 2]" 1
1549 1 73 THR MG 1 99 VAL MG1 . . 2.690 1.941 1.891 1.982 . 0 0 "[ . 1 . 2]" 1
1550 1 73 THR MG 1 99 VAL MG2 . . 3.330 2.638 2.406 2.906 . 0 0 "[ . 1 . 2]" 1
1551 1 73 THR MG 1 100 LEU HA . . 4.910 4.670 4.573 4.773 . 0 0 "[ . 1 . 2]" 1
1552 1 73 THR MG 1 101 GLU H . . 4.910 4.897 4.679 4.945 0.035 11 0 "[ . 1 . 2]" 1
1553 1 73 THR MG 1 102 LEU H . . 4.140 3.601 3.446 3.769 . 0 0 "[ . 1 . 2]" 1
1554 1 73 THR MG 1 102 LEU HA . . 5.310 4.415 4.040 4.675 . 0 0 "[ . 1 . 2]" 1
1555 1 73 THR MG 1 103 GLU H . . 3.870 3.078 2.885 3.283 . 0 0 "[ . 1 . 2]" 1
1556 1 73 THR MG 1 103 GLU HB2 . . 4.170 2.256 2.152 2.588 . 0 0 "[ . 1 . 2]" 1
1557 1 73 THR MG 1 103 GLU HB3 . . 3.610 2.507 2.346 2.697 . 0 0 "[ . 1 . 2]" 1
1558 1 73 THR MG 1 103 GLU QG . . 3.550 3.936 3.824 4.250 0.700 14 1 "[ . 1 +. 2]" 1
1559 1 73 THR MG 1 106 ASN H . . 5.290 5.331 5.305 5.355 0.065 3 0 "[ . 1 . 2]" 1
1560 1 73 THR MG 1 106 ASN HD21 . . 4.590 3.491 2.561 3.971 . 0 0 "[ . 1 . 2]" 1
1561 1 73 THR MG 1 106 ASN HD22 . . 4.800 3.636 3.344 3.812 . 0 0 "[ . 1 . 2]" 1
1562 1 74 LYS H 1 74 LYS HB2 . . 3.310 2.284 2.124 2.449 . 0 0 "[ . 1 . 2]" 1
1563 1 74 LYS H 1 74 LYS QB . . 2.760 2.182 2.085 2.279 . 0 0 "[ . 1 . 2]" 1
1564 1 74 LYS H 1 74 LYS HB3 . . 3.310 2.797 2.681 3.030 . 0 0 "[ . 1 . 2]" 1
1565 1 74 LYS H 1 74 LYS QE . . 4.230 3.644 2.997 4.251 0.021 11 0 "[ . 1 . 2]" 1
1566 1 74 LYS H 1 74 LYS HG2 . . 4.850 4.634 4.551 4.697 . 0 0 "[ . 1 . 2]" 1
1567 1 74 LYS H 1 74 LYS QG . . 4.140 4.060 3.966 4.121 . 0 0 "[ . 1 . 2]" 1
1568 1 74 LYS H 1 74 LYS HG3 . . 4.850 4.495 4.275 4.618 . 0 0 "[ . 1 . 2]" 1
1569 1 74 LYS H 1 75 ALA H . . 3.540 2.868 2.780 2.949 . 0 0 "[ . 1 . 2]" 1
1570 1 74 LYS H 1 75 ALA MB . . 4.630 4.563 4.470 4.629 . 0 0 "[ . 1 . 2]" 1
1571 1 74 LYS H 1 76 TYR H . . 4.290 4.318 4.298 4.333 0.043 1 0 "[ . 1 . 2]" 1
1572 1 74 LYS H 1 99 VAL MG1 . . 5.720 5.391 5.157 5.520 . 0 0 "[ . 1 . 2]" 1
1573 1 74 LYS H 1 102 LEU MD1 . . 6.000 5.374 5.045 5.721 . 0 0 "[ . 1 . 2]" 1
1574 1 74 LYS HA 1 74 LYS QG . . 3.660 2.557 2.142 2.921 . 0 0 "[ . 1 . 2]" 1
1575 1 74 LYS HA 1 77 SER H . . 4.370 3.276 3.110 3.467 . 0 0 "[ . 1 . 2]" 1
1576 1 74 LYS HA 1 99 VAL MG1 . . 4.960 4.711 4.357 4.933 . 0 0 "[ . 1 . 2]" 1
1577 1 74 LYS QB 1 75 ALA H . . 3.530 2.837 2.677 3.041 . 0 0 "[ . 1 . 2]" 1
1578 1 74 LYS QE 1 78 ARG H . . 5.810 4.930 3.574 5.858 0.048 15 0 "[ . 1 . 2]" 1
1579 1 75 ALA H 1 75 ALA MB . . 2.920 2.255 2.244 2.265 . 0 0 "[ . 1 . 2]" 1
1580 1 75 ALA H 1 76 TYR H . . 3.150 2.612 2.533 2.662 . 0 0 "[ . 1 . 2]" 1
1581 1 75 ALA H 1 77 SER H . . 4.220 4.155 4.060 4.214 . 0 0 "[ . 1 . 2]" 1
1582 1 75 ALA HA 1 77 SER H . . 4.480 4.508 4.488 4.525 0.045 18 0 "[ . 1 . 2]" 1
1583 1 75 ALA HA 1 78 ARG H . . 3.930 3.578 3.400 3.784 . 0 0 "[ . 1 . 2]" 1
1584 1 75 ALA HA 1 79 ARG H . . 4.350 3.949 3.851 4.028 . 0 0 "[ . 1 . 2]" 1
1585 1 75 ALA MB 1 76 TYR H . . 3.430 2.795 2.722 2.895 . 0 0 "[ . 1 . 2]" 1
1586 1 75 ALA MB 1 76 TYR HA . . 4.330 4.032 3.969 4.095 . 0 0 "[ . 1 . 2]" 1
1587 1 75 ALA MB 1 76 TYR QD . . 3.810 3.748 3.603 3.916 0.106 13 0 "[ . 1 . 2]" 1
1588 1 75 ALA MB 1 77 SER H . . 4.750 4.703 4.666 4.747 . 0 0 "[ . 1 . 2]" 1
1589 1 75 ALA MB 1 78 ARG H . . 5.020 4.836 4.701 5.036 0.016 15 0 "[ . 1 . 2]" 1
1590 1 76 TYR H 1 76 TYR HB2 . . 3.810 2.451 2.412 2.500 . 0 0 "[ . 1 . 2]" 1
1591 1 76 TYR H 1 76 TYR HB3 . . 3.700 3.635 3.609 3.658 . 0 0 "[ . 1 . 2]" 1
1592 1 76 TYR H 1 76 TYR QE . . 4.830 4.424 4.253 4.575 . 0 0 "[ . 1 . 2]" 1
1593 1 76 TYR H 1 77 SER H . . 3.160 2.563 2.452 2.672 . 0 0 "[ . 1 . 2]" 1
1594 1 76 TYR H 1 78 ARG H . . 4.310 4.229 4.120 4.316 0.006 15 0 "[ . 1 . 2]" 1
1595 1 76 TYR H 1 79 ARG H . . 4.780 4.682 4.603 4.733 . 0 0 "[ . 1 . 2]" 1
1596 1 76 TYR H 1 99 VAL MG1 . . 5.390 5.349 5.221 5.418 0.028 4 0 "[ . 1 . 2]" 1
1597 1 76 TYR H 1 99 VAL MG2 . . 3.750 3.721 3.627 3.752 0.002 13 0 "[ . 1 . 2]" 1
1598 1 76 TYR H 1 102 LEU MD1 . . 5.760 4.662 4.478 4.822 . 0 0 "[ . 1 . 2]" 1
1599 1 76 TYR HA 1 76 TYR QD . . 4.270 2.602 2.508 2.741 . 0 0 "[ . 1 . 2]" 1
1600 1 76 TYR HA 1 76 TYR QE . . 5.240 4.440 4.338 4.509 . 0 0 "[ . 1 . 2]" 1
1601 1 76 TYR HA 1 79 ARG H . . 3.900 3.424 3.334 3.499 . 0 0 "[ . 1 . 2]" 1
1602 1 76 TYR HA 1 80 GLY H . . 4.310 3.789 3.634 3.959 . 0 0 "[ . 1 . 2]" 1
1603 1 76 TYR HA 1 99 VAL MG2 . . 3.910 3.899 3.851 3.932 0.022 3 0 "[ . 1 . 2]" 1
1604 1 76 TYR HB2 1 77 SER H . . 3.990 2.781 2.628 2.879 . 0 0 "[ . 1 . 2]" 1
1605 1 76 TYR HB2 1 78 ARG H . . 6.000 5.368 5.279 5.530 . 0 0 "[ . 1 . 2]" 1
1606 1 76 TYR HB2 1 99 VAL H . . 4.570 3.796 3.681 3.887 . 0 0 "[ . 1 . 2]" 1
1607 1 76 TYR HB2 1 99 VAL MG2 . . 3.840 2.185 2.138 2.234 . 0 0 "[ . 1 . 2]" 1
1608 1 76 TYR HB3 1 77 SER H . . 3.780 3.724 3.577 3.796 0.016 7 0 "[ . 1 . 2]" 1
1609 1 76 TYR HB3 1 98 ARG H . . 4.190 4.218 4.197 4.239 0.049 10 0 "[ . 1 . 2]" 1
1610 1 76 TYR HB3 1 99 VAL MG2 . . 3.850 2.351 2.288 2.401 . 0 0 "[ . 1 . 2]" 1
1611 1 76 TYR QD 1 80 GLY H . . 5.890 5.417 5.244 5.635 . 0 0 "[ . 1 . 2]" 1
1612 1 76 TYR QD 1 98 ARG H . . 4.990 5.001 4.931 5.018 0.028 14 0 "[ . 1 . 2]" 1
1613 1 76 TYR QD 1 98 ARG HD3 . . 5.450 5.299 5.104 5.456 0.006 19 0 "[ . 1 . 2]" 1
1614 1 76 TYR QD 1 98 ARG HE . . 5.460 4.729 4.254 5.389 . 0 0 "[ . 1 . 2]" 1
1615 1 76 TYR QD 1 98 ARG QG . . 5.360 2.874 2.709 3.025 . 0 0 "[ . 1 . 2]" 1
1616 1 76 TYR QD 1 99 VAL H . . 5.040 4.708 4.598 4.806 . 0 0 "[ . 1 . 2]" 1
1617 1 76 TYR QD 1 99 VAL HA . . 5.550 4.157 4.043 4.302 . 0 0 "[ . 1 . 2]" 1
1618 1 76 TYR QD 1 99 VAL MG2 . . 3.880 3.772 3.728 3.836 . 0 0 "[ . 1 . 2]" 1
1619 1 76 TYR QD 1 102 LEU MD1 . . 3.650 2.526 2.420 2.599 . 0 0 "[ . 1 . 2]" 1
1620 1 76 TYR QE 1 98 ARG HD3 . . 5.560 4.963 4.778 5.305 . 0 0 "[ . 1 . 2]" 1
1621 1 76 TYR QE 1 98 ARG HE . . 4.770 3.590 3.203 4.342 . 0 0 "[ . 1 . 2]" 1
1622 1 76 TYR QE 1 102 LEU MD1 . . 3.840 2.300 2.184 2.482 . 0 0 "[ . 1 . 2]" 1
1623 1 76 TYR QE 1 102 LEU MD2 . . 4.320 4.142 3.992 4.276 . 0 0 "[ . 1 . 2]" 1
1624 1 77 SER H 1 77 SER HB2 . . 3.240 2.692 2.424 3.203 . 0 0 "[ . 1 . 2]" 1
1625 1 77 SER H 1 78 ARG QB . . 4.760 4.531 4.401 4.661 . 0 0 "[ . 1 . 2]" 1
1626 1 77 SER H 1 96 TYR QE . . 5.620 5.540 5.345 5.644 0.024 18 0 "[ . 1 . 2]" 1
1627 1 77 SER H 1 99 VAL MG1 . . 4.200 4.015 3.818 4.199 . 0 0 "[ . 1 . 2]" 1
1628 1 77 SER H 1 99 VAL MG2 . . 3.330 2.426 2.309 2.472 . 0 0 "[ . 1 . 2]" 1
1629 1 77 SER HA 1 96 TYR QE . . 3.680 3.019 2.820 3.215 . 0 0 "[ . 1 . 2]" 1
1630 1 77 SER HA 1 99 VAL MG2 . . 4.400 2.273 2.175 2.395 . 0 0 "[ . 1 . 2]" 1
1631 1 77 SER HB2 1 96 TYR QE . . 4.170 3.685 3.069 4.126 . 0 0 "[ . 1 . 2]" 1
1632 1 77 SER HB2 1 99 VAL MG1 . . 4.040 2.703 2.550 3.025 . 0 0 "[ . 1 . 2]" 1
1633 1 77 SER HB2 1 99 VAL MG2 . . 3.700 2.282 2.162 2.599 . 0 0 "[ . 1 . 2]" 1
1634 1 77 SER HB2 1 109 ALA MB . . 4.300 4.284 3.992 4.322 0.022 14 0 "[ . 1 . 2]" 1
1635 1 77 SER HB3 1 99 VAL MG1 . . 4.100 4.026 3.503 4.109 0.009 5 0 "[ . 1 . 2]" 1
1636 1 78 ARG H 1 78 ARG HB2 . . 3.570 2.342 2.280 2.419 . 0 0 "[ . 1 . 2]" 1
1637 1 78 ARG H 1 78 ARG HB3 . . 3.570 2.669 2.577 2.811 . 0 0 "[ . 1 . 2]" 1
1638 1 78 ARG H 1 78 ARG HD3 . . 4.670 4.595 4.306 4.702 0.032 12 0 "[ . 1 . 2]" 1
1639 1 78 ARG H 1 78 ARG QG . . 4.390 4.081 4.040 4.108 . 0 0 "[ . 1 . 2]" 1
1640 1 78 ARG H 1 79 ARG H . . 3.450 2.831 2.791 2.953 . 0 0 "[ . 1 . 2]" 1
1641 1 78 ARG H 1 80 GLY H . . 4.760 4.550 4.503 4.675 . 0 0 "[ . 1 . 2]" 1
1642 1 78 ARG H 1 81 ALA MB . . 4.920 4.468 4.378 4.656 . 0 0 "[ . 1 . 2]" 1
1643 1 78 ARG HA 1 78 ARG HD2 . . 4.380 3.666 3.522 3.773 . 0 0 "[ . 1 . 2]" 1
1644 1 78 ARG HA 1 78 ARG HD3 . . 4.310 2.117 2.034 2.210 . 0 0 "[ . 1 . 2]" 1
1645 1 78 ARG HA 1 78 ARG QG . . 3.700 2.891 2.675 3.045 . 0 0 "[ . 1 . 2]" 1
1646 1 78 ARG HA 1 81 ALA H . . 3.840 3.305 3.210 3.516 . 0 0 "[ . 1 . 2]" 1
1647 1 78 ARG HA 1 81 ALA MB . . 3.680 2.306 2.209 2.414 . 0 0 "[ . 1 . 2]" 1
1648 1 78 ARG HA 1 82 ALA H . . 4.630 3.912 3.771 4.026 . 0 0 "[ . 1 . 2]" 1
1649 1 78 ARG HB2 1 79 ARG H . . 4.090 4.084 4.004 4.127 0.037 11 0 "[ . 1 . 2]" 1
1650 1 78 ARG HB3 1 79 ARG H . . 4.090 3.052 2.865 3.172 . 0 0 "[ . 1 . 2]" 1
1651 1 79 ARG H 1 79 ARG HB2 . . 3.840 2.473 2.421 2.513 . 0 0 "[ . 1 . 2]" 1
1652 1 79 ARG H 1 79 ARG HB3 . . 3.860 2.781 2.729 2.832 . 0 0 "[ . 1 . 2]" 1
1653 1 79 ARG H 1 79 ARG QD . . 5.330 4.793 4.717 4.844 . 0 0 "[ . 1 . 2]" 1
1654 1 79 ARG H 1 79 ARG QG . . 4.070 4.000 3.981 4.027 . 0 0 "[ . 1 . 2]" 1
1655 1 79 ARG H 1 80 GLY H . . 3.630 2.651 2.578 2.719 . 0 0 "[ . 1 . 2]" 1
1656 1 79 ARG H 1 80 GLY HA3 . . 5.220 4.875 4.793 4.975 . 0 0 "[ . 1 . 2]" 1
1657 1 79 ARG H 1 81 ALA H . . 4.520 3.845 3.786 3.907 . 0 0 "[ . 1 . 2]" 1
1658 1 79 ARG H 1 95 ASP HB3 . . 4.470 4.509 4.492 4.527 0.057 7 0 "[ . 1 . 2]" 1
1659 1 79 ARG H 1 99 VAL MG2 . . 5.220 5.197 5.131 5.246 0.026 9 0 "[ . 1 . 2]" 1
1660 1 79 ARG HA 1 81 ALA H . . 4.210 4.239 4.220 4.256 0.046 15 0 "[ . 1 . 2]" 1
1661 1 79 ARG HA 1 82 ALA H . . 3.890 3.450 3.375 3.556 . 0 0 "[ . 1 . 2]" 1
1662 1 79 ARG HA 1 82 ALA MB . . 3.670 2.760 2.685 2.874 . 0 0 "[ . 1 . 2]" 1
1663 1 79 ARG HA 1 83 ARG H . . 4.490 3.949 3.842 4.041 . 0 0 "[ . 1 . 2]" 1
1664 1 79 ARG HA 1 83 ARG QG . . 5.020 4.162 3.707 4.288 . 0 0 "[ . 1 . 2]" 1
1665 1 79 ARG HA 1 95 ASP HB3 . . 5.640 5.544 5.420 5.645 0.005 3 0 "[ . 1 . 2]" 1
1666 1 79 ARG HB3 1 80 GLY H . . 4.310 2.518 2.497 2.537 . 0 0 "[ . 1 . 2]" 1
1667 1 79 ARG HB3 1 81 ALA H . . 4.880 4.912 4.899 4.926 0.046 16 0 "[ . 1 . 2]" 1
1668 1 79 ARG QD 1 80 GLY H . . 5.290 5.288 5.261 5.307 0.017 6 0 "[ . 1 . 2]" 1
1669 1 79 ARG QG 1 80 GLY H . . 4.550 3.893 3.838 3.946 . 0 0 "[ . 1 . 2]" 1
1670 1 79 ARG QG 1 83 ARG H . . 4.930 4.096 3.967 4.259 . 0 0 "[ . 1 . 2]" 1
1671 1 80 GLY H 1 81 ALA H . . 3.560 2.724 2.665 2.782 . 0 0 "[ . 1 . 2]" 1
1672 1 80 GLY H 1 81 ALA MB . . 4.570 4.429 4.365 4.493 . 0 0 "[ . 1 . 2]" 1
1673 1 80 GLY H 1 82 ALA H . . 5.070 4.576 4.468 4.670 . 0 0 "[ . 1 . 2]" 1
1674 1 80 GLY H 1 82 ALA MB . . 5.710 5.064 4.990 5.131 . 0 0 "[ . 1 . 2]" 1
1675 1 80 GLY H 1 83 ARG H . . 5.170 4.783 4.744 4.830 . 0 0 "[ . 1 . 2]" 1
1676 1 80 GLY H 1 83 ARG QB . . 5.470 4.649 4.589 4.796 . 0 0 "[ . 1 . 2]" 1
1677 1 80 GLY H 1 92 ALA HA . . 4.940 4.675 4.542 4.801 . 0 0 "[ . 1 . 2]" 1
1678 1 80 GLY H 1 92 ALA MB . . 5.960 5.158 4.996 5.298 . 0 0 "[ . 1 . 2]" 1
1679 1 80 GLY H 1 95 ASP H . . 5.690 5.676 5.614 5.705 0.015 7 0 "[ . 1 . 2]" 1
1680 1 80 GLY H 1 95 ASP HB2 . . 4.340 3.415 3.335 3.486 . 0 0 "[ . 1 . 2]" 1
1681 1 80 GLY H 1 95 ASP HB3 . . 4.040 2.456 2.420 2.509 . 0 0 "[ . 1 . 2]" 1
1682 1 80 GLY H 1 96 TYR H . . 5.030 5.009 4.892 5.049 0.019 2 0 "[ . 1 . 2]" 1
1683 1 80 GLY H 1 96 TYR QE . . 4.990 4.945 4.835 5.000 0.010 17 0 "[ . 1 . 2]" 1
1684 1 80 GLY HA2 1 82 ALA H . . 4.970 4.819 4.617 4.957 . 0 0 "[ . 1 . 2]" 1
1685 1 80 GLY HA2 1 83 ARG H . . 4.350 3.537 3.408 3.661 . 0 0 "[ . 1 . 2]" 1
1686 1 80 GLY HA2 1 92 ALA H . . 4.840 4.691 4.563 4.770 . 0 0 "[ . 1 . 2]" 1
1687 1 80 GLY HA2 1 92 ALA HA . . 4.190 2.123 2.031 2.214 . 0 0 "[ . 1 . 2]" 1
1688 1 80 GLY HA2 1 92 ALA MB . . 3.770 2.850 2.664 3.015 . 0 0 "[ . 1 . 2]" 1
1689 1 80 GLY HA2 1 95 ASP H . . 4.590 4.558 4.412 4.609 0.019 13 0 "[ . 1 . 2]" 1
1690 1 80 GLY HA3 1 83 ARG H . . 5.060 4.780 4.678 4.877 . 0 0 "[ . 1 . 2]" 1
1691 1 80 GLY HA3 1 92 ALA H . . 5.960 5.970 5.881 5.990 0.030 6 0 "[ . 1 . 2]" 1
1692 1 80 GLY HA3 1 92 ALA HA . . 4.560 3.205 3.092 3.259 . 0 0 "[ . 1 . 2]" 1
1693 1 80 GLY HA3 1 92 ALA MB . . 5.130 3.461 3.299 3.600 . 0 0 "[ . 1 . 2]" 1
1694 1 80 GLY HA3 1 95 ASP H . . 4.860 4.680 4.532 4.773 . 0 0 "[ . 1 . 2]" 1
1695 1 80 GLY HA3 1 96 TYR QE . . 4.180 3.307 3.114 3.418 . 0 0 "[ . 1 . 2]" 1
1696 1 81 ALA H 1 81 ALA MB . . 2.850 2.269 2.254 2.288 . 0 0 "[ . 1 . 2]" 1
1697 1 81 ALA H 1 82 ALA H . . 3.350 2.891 2.806 2.959 . 0 0 "[ . 1 . 2]" 1
1698 1 81 ALA H 1 82 ALA MB . . 4.560 4.395 4.346 4.449 . 0 0 "[ . 1 . 2]" 1
1699 1 81 ALA H 1 83 ARG H . . 4.650 4.164 4.097 4.221 . 0 0 "[ . 1 . 2]" 1
1700 1 81 ALA H 1 83 ARG QB . . 5.470 4.848 4.740 5.114 . 0 0 "[ . 1 . 2]" 1
1701 1 81 ALA H 1 92 ALA MB . . 5.920 4.972 4.856 5.046 . 0 0 "[ . 1 . 2]" 1
1702 1 81 ALA H 1 95 ASP HB3 . . 4.830 4.870 4.837 4.893 0.063 7 0 "[ . 1 . 2]" 1
1703 1 81 ALA H 1 96 TYR QE . . 4.360 3.742 3.621 3.865 . 0 0 "[ . 1 . 2]" 1
1704 1 81 ALA HA 1 84 PHE H . . 4.100 3.499 3.354 3.728 . 0 0 "[ . 1 . 2]" 1
1705 1 81 ALA HA 1 84 PHE HB2 . . 4.440 3.030 2.782 3.392 . 0 0 "[ . 1 . 2]" 1
1706 1 81 ALA HA 1 84 PHE HB3 . . 4.440 3.281 2.906 3.804 . 0 0 "[ . 1 . 2]" 1
1707 1 81 ALA HA 1 85 ALA H . . 5.340 4.742 4.486 5.098 . 0 0 "[ . 1 . 2]" 1
1708 1 81 ALA HA 1 96 TYR QE . . 4.280 2.984 2.717 3.291 . 0 0 "[ . 1 . 2]" 1
1709 1 81 ALA MB 1 82 ALA H . . 3.100 2.408 2.331 2.485 . 0 0 "[ . 1 . 2]" 1
1710 1 81 ALA MB 1 82 ALA HA . . 4.200 3.984 3.931 4.028 . 0 0 "[ . 1 . 2]" 1
1711 1 81 ALA MB 1 82 ALA MB . . 3.910 3.706 3.647 3.796 . 0 0 "[ . 1 . 2]" 1
1712 1 81 ALA MB 1 83 ARG H . . 4.640 4.575 4.514 4.645 0.005 10 0 "[ . 1 . 2]" 1
1713 1 81 ALA MB 1 84 PHE H . . 4.760 4.595 4.489 4.763 0.003 10 0 "[ . 1 . 2]" 1
1714 1 81 ALA MB 1 85 ALA H . . 5.440 5.194 5.010 5.443 0.003 18 0 "[ . 1 . 2]" 1
1715 1 82 ALA H 1 82 ALA MB . . 2.870 2.175 2.159 2.185 . 0 0 "[ . 1 . 2]" 1
1716 1 82 ALA H 1 83 ARG H . . 3.430 2.840 2.732 2.916 . 0 0 "[ . 1 . 2]" 1
1717 1 82 ALA H 1 84 PHE H . . 4.180 4.169 4.116 4.195 0.015 2 0 "[ . 1 . 2]" 1
1718 1 82 ALA H 1 85 ALA H . . 5.720 5.139 5.014 5.296 . 0 0 "[ . 1 . 2]" 1
1719 1 82 ALA HA 1 85 ALA MB . . 3.620 3.078 2.915 3.245 . 0 0 "[ . 1 . 2]" 1
1720 1 82 ALA MB 1 83 ARG H . . 3.380 2.435 2.394 2.490 . 0 0 "[ . 1 . 2]" 1
1721 1 82 ALA MB 1 84 PHE H . . 4.390 4.413 4.402 4.428 0.038 15 0 "[ . 1 . 2]" 1
1722 1 82 ALA MB 1 85 ALA H . . 4.730 4.676 4.574 4.738 0.008 17 0 "[ . 1 . 2]" 1
1723 1 82 ALA MB 1 85 ALA MB . . 4.400 4.144 4.016 4.321 . 0 0 "[ . 1 . 2]" 1
1724 1 82 ALA MB 1 86 LEU MD1 . . 4.140 3.208 3.033 3.366 . 0 0 "[ . 1 . 2]" 1
1725 1 83 ARG H 1 83 ARG QB . . 3.700 2.293 2.251 2.390 . 0 0 "[ . 1 . 2]" 1
1726 1 83 ARG H 1 83 ARG QG . . 3.740 2.492 2.458 2.578 . 0 0 "[ . 1 . 2]" 1
1727 1 83 ARG H 1 84 PHE QB . . 5.520 4.497 4.397 4.591 . 0 0 "[ . 1 . 2]" 1
1728 1 83 ARG H 1 85 ALA H . . 5.220 4.377 4.245 4.479 . 0 0 "[ . 1 . 2]" 1
1729 1 83 ARG H 1 85 ALA MB . . 5.460 5.145 5.007 5.296 . 0 0 "[ . 1 . 2]" 1
1730 1 83 ARG H 1 86 LEU H . . 4.910 4.813 4.727 4.913 0.003 8 0 "[ . 1 . 2]" 1
1731 1 83 ARG H 1 86 LEU MD1 . . 4.820 4.120 4.005 4.243 . 0 0 "[ . 1 . 2]" 1
1732 1 83 ARG H 1 92 ALA HA . . 5.040 4.907 4.753 5.019 . 0 0 "[ . 1 . 2]" 1
1733 1 83 ARG HA 1 86 LEU H . . 4.030 3.147 3.000 3.287 . 0 0 "[ . 1 . 2]" 1
1734 1 83 ARG HA 1 86 LEU MD1 . . 4.010 2.489 2.309 2.687 . 0 0 "[ . 1 . 2]" 1
1735 1 83 ARG HA 1 88 LYS H . . 4.390 3.645 3.448 3.881 . 0 0 "[ . 1 . 2]" 1
1736 1 83 ARG QB 1 84 PHE H . . 3.560 3.046 2.913 3.195 . 0 0 "[ . 1 . 2]" 1
1737 1 83 ARG QB 1 84 PHE QB . . 5.710 4.316 4.240 4.472 . 0 0 "[ . 1 . 2]" 1
1738 1 83 ARG QB 1 85 ALA H . . 4.980 4.951 4.861 5.004 0.024 16 0 "[ . 1 . 2]" 1
1739 1 83 ARG QB 1 88 LYS H . . 3.980 3.763 3.638 3.920 . 0 0 "[ . 1 . 2]" 1
1740 1 83 ARG QG 1 84 PHE H . . 4.560 4.436 4.367 4.492 . 0 0 "[ . 1 . 2]" 1
1741 1 83 ARG QG 1 92 ALA MB . . 4.370 4.119 3.984 4.217 . 0 0 "[ . 1 . 2]" 1
1742 1 84 PHE H 1 84 PHE HB2 . . 3.430 2.332 2.182 2.517 . 0 0 "[ . 1 . 2]" 1
1743 1 84 PHE H 1 84 PHE HB3 . . 3.430 2.739 2.560 2.878 . 0 0 "[ . 1 . 2]" 1
1744 1 84 PHE H 1 85 ALA H . . 3.430 2.631 2.555 2.741 . 0 0 "[ . 1 . 2]" 1
1745 1 84 PHE H 1 85 ALA MB . . 4.750 4.293 4.212 4.405 . 0 0 "[ . 1 . 2]" 1
1746 1 84 PHE H 1 86 LEU H . . 3.960 3.988 3.971 4.017 0.057 2 0 "[ . 1 . 2]" 1
1747 1 84 PHE H 1 87 GLN H . . 5.560 4.960 4.802 5.178 . 0 0 "[ . 1 . 2]" 1
1748 1 84 PHE H 1 89 LEU MD2 . . 4.890 4.508 4.278 4.783 . 0 0 "[ . 1 . 2]" 1
1749 1 84 PHE H 1 92 ALA HA . . 4.970 4.949 4.780 5.006 0.036 2 0 "[ . 1 . 2]" 1
1750 1 84 PHE H 1 92 ALA MB . . 3.800 3.128 2.901 3.249 . 0 0 "[ . 1 . 2]" 1
1751 1 84 PHE H 1 116 ILE MD . . 5.670 5.326 5.104 5.673 0.003 9 0 "[ . 1 . 2]" 1
1752 1 84 PHE HA 1 84 PHE QD . . 3.520 2.402 2.152 2.805 . 0 0 "[ . 1 . 2]" 1
1753 1 84 PHE HA 1 84 PHE QE . . 4.260 4.313 4.297 4.335 0.075 19 0 "[ . 1 . 2]" 1
1754 1 84 PHE HA 1 85 ALA H . . 3.530 3.556 3.547 3.569 0.039 18 0 "[ . 1 . 2]" 1
1755 1 84 PHE HA 1 87 GLN H . . 4.450 3.714 3.518 3.967 . 0 0 "[ . 1 . 2]" 1
1756 1 84 PHE HA 1 88 LYS H . . 4.080 3.928 3.754 4.085 0.005 2 0 "[ . 1 . 2]" 1
1757 1 84 PHE HA 1 89 LEU MD2 . . 3.730 2.214 2.033 2.429 . 0 0 "[ . 1 . 2]" 1
1758 1 84 PHE HA 1 92 ALA H . . 5.540 5.484 5.274 5.572 0.032 13 0 "[ . 1 . 2]" 1
1759 1 84 PHE QB 1 85 ALA H . . 3.260 2.605 2.500 2.776 . 0 0 "[ . 1 . 2]" 1
1760 1 84 PHE QB 1 86 LEU H . . 5.150 4.653 4.531 4.747 . 0 0 "[ . 1 . 2]" 1
1761 1 84 PHE QB 1 92 ALA MB . . 4.680 3.031 2.571 3.211 . 0 0 "[ . 1 . 2]" 1
1762 1 84 PHE QB 1 96 TYR QE . . 4.540 3.195 2.901 3.467 . 0 0 "[ . 1 . 2]" 1
1763 1 84 PHE HB2 1 85 ALA H . . 3.920 3.727 3.561 3.921 0.001 19 0 "[ . 1 . 2]" 1
1764 1 84 PHE HB3 1 85 ALA H . . 3.920 2.661 2.540 2.839 . 0 0 "[ . 1 . 2]" 1
1765 1 84 PHE QD 1 85 ALA HA . . 4.850 4.156 3.391 4.629 . 0 0 "[ . 1 . 2]" 1
1766 1 84 PHE QD 1 89 LEU MD2 . . 3.110 2.293 2.025 2.686 . 0 0 "[ . 1 . 2]" 1
1767 1 84 PHE QD 1 92 ALA MB . . 3.810 3.574 2.951 4.145 0.335 13 0 "[ . 1 . 2]" 1
1768 1 84 PHE QD 1 116 ILE HA . . 4.810 4.540 4.025 4.851 0.041 3 0 "[ . 1 . 2]" 1
1769 1 84 PHE QD 1 116 ILE MD . . 4.090 3.212 2.782 3.540 . 0 0 "[ . 1 . 2]" 1
1770 1 84 PHE QD 1 116 ILE MG . . 4.180 4.382 3.652 5.034 0.854 3 8 "[ +*. 1*-*** * 2]" 1
1771 1 84 PHE QD 1 119 ALA MB . . 4.470 4.100 3.839 4.593 0.123 20 0 "[ . 1 . 2]" 1
1772 1 84 PHE QE 1 89 LEU MD2 . . 3.410 2.795 2.610 2.968 . 0 0 "[ . 1 . 2]" 1
1773 1 84 PHE QE 1 115 LYS QB . . 4.000 3.090 2.371 3.923 . 0 0 "[ . 1 . 2]" 1
1774 1 84 PHE QE 1 116 ILE H . . 4.680 3.796 3.496 4.307 . 0 0 "[ . 1 . 2]" 1
1775 1 84 PHE QE 1 116 ILE HA . . 4.300 2.976 2.198 3.564 . 0 0 "[ . 1 . 2]" 1
1776 1 84 PHE QE 1 116 ILE MD . . 4.420 3.751 3.415 4.247 . 0 0 "[ . 1 . 2]" 1
1777 1 84 PHE QE 1 119 ALA H . . 5.120 4.731 4.373 4.898 . 0 0 "[ . 1 . 2]" 1
1778 1 84 PHE QE 1 119 ALA MB . . 3.470 2.425 2.228 2.827 . 0 0 "[ . 1 . 2]" 1
1779 1 84 PHE HZ 1 115 LYS QB . . 3.890 2.811 2.104 3.621 . 0 0 "[ . 1 . 2]" 1
1780 1 84 PHE HZ 1 116 ILE H . . 5.190 4.322 3.328 5.210 0.020 8 0 "[ . 1 . 2]" 1
1781 1 84 PHE HZ 1 116 ILE HA . . 4.790 3.620 2.967 4.661 . 0 0 "[ . 1 . 2]" 1
1782 1 84 PHE HZ 1 119 ALA MB . . 3.840 2.754 2.322 3.355 . 0 0 "[ . 1 . 2]" 1
1783 1 85 ALA H 1 85 ALA MB . . 2.790 2.217 2.196 2.240 . 0 0 "[ . 1 . 2]" 1
1784 1 85 ALA H 1 86 LEU H . . 3.250 2.476 2.409 2.540 . 0 0 "[ . 1 . 2]" 1
1785 1 85 ALA H 1 86 LEU QB . . 4.360 4.383 4.372 4.392 0.032 13 0 "[ . 1 . 2]" 1
1786 1 85 ALA H 1 86 LEU MD1 . . 5.390 5.134 5.032 5.266 . 0 0 "[ . 1 . 2]" 1
1787 1 85 ALA H 1 86 LEU MD2 . . 5.650 5.421 5.265 5.558 . 0 0 "[ . 1 . 2]" 1
1788 1 85 ALA H 1 86 LEU HG . . 4.570 4.378 4.240 4.570 . 0 0 "[ . 1 . 2]" 1
1789 1 85 ALA H 1 87 GLN H . . 4.180 3.821 3.682 3.956 . 0 0 "[ . 1 . 2]" 1
1790 1 85 ALA H 1 88 LYS H . . 5.200 5.206 5.118 5.224 0.024 14 0 "[ . 1 . 2]" 1
1791 1 85 ALA H 1 89 LEU MD2 . . 5.300 4.881 4.650 5.087 . 0 0 "[ . 1 . 2]" 1
1792 1 85 ALA HA 1 86 LEU HA . . 4.910 4.812 4.759 4.842 . 0 0 "[ . 1 . 2]" 1
1793 1 85 ALA HA 1 87 GLN H . . 3.810 3.567 3.473 3.646 . 0 0 "[ . 1 . 2]" 1
1794 1 85 ALA MB 1 86 LEU H . . 3.400 2.712 2.624 2.833 . 0 0 "[ . 1 . 2]" 1
1795 1 85 ALA MB 1 86 LEU QB . . 5.210 4.352 4.264 4.462 . 0 0 "[ . 1 . 2]" 1
1796 1 85 ALA MB 1 86 LEU MD2 . . 4.300 3.934 3.765 4.048 . 0 0 "[ . 1 . 2]" 1
1797 1 85 ALA MB 1 87 GLN H . . 4.210 4.225 4.170 4.263 0.053 19 0 "[ . 1 . 2]" 1
1798 1 85 ALA MB 1 88 LYS H . . 6.000 5.884 5.836 5.957 . 0 0 "[ . 1 . 2]" 1
1799 1 86 LEU H 1 86 LEU QB . . 3.150 2.303 2.255 2.348 . 0 0 "[ . 1 . 2]" 1
1800 1 86 LEU H 1 86 LEU MD1 . . 3.880 3.621 3.567 3.695 . 0 0 "[ . 1 . 2]" 1
1801 1 86 LEU H 1 86 LEU MD2 . . 3.840 3.585 3.508 3.641 . 0 0 "[ . 1 . 2]" 1
1802 1 86 LEU H 1 87 GLN H . . 3.300 2.599 2.485 2.693 . 0 0 "[ . 1 . 2]" 1
1803 1 86 LEU H 1 87 GLN HA . . 5.690 4.718 4.606 4.845 . 0 0 "[ . 1 . 2]" 1
1804 1 86 LEU H 1 87 GLN HG2 . . 5.500 4.776 4.552 5.098 . 0 0 "[ . 1 . 2]" 1
1805 1 86 LEU H 1 88 LYS H . . 3.900 3.885 3.778 3.922 0.022 7 0 "[ . 1 . 2]" 1
1806 1 86 LEU H 1 88 LYS HG3 . . 4.550 4.467 4.363 4.553 0.003 18 0 "[ . 1 . 2]" 1
1807 1 86 LEU HA 1 86 LEU MD1 . . 3.960 3.896 3.880 3.913 . 0 0 "[ . 1 . 2]" 1
1808 1 86 LEU HA 1 86 LEU MD2 . . 3.060 2.128 2.086 2.167 . 0 0 "[ . 1 . 2]" 1
1809 1 86 LEU QB 1 86 LEU MD1 . . 2.990 2.099 2.080 2.122 . 0 0 "[ . 1 . 2]" 1
1810 1 86 LEU QB 1 86 LEU MD2 . . 2.710 2.298 2.266 2.334 . 0 0 "[ . 1 . 2]" 1
1811 1 86 LEU QB 1 87 GLN H . . 3.970 3.285 3.112 3.425 . 0 0 "[ . 1 . 2]" 1
1812 1 86 LEU MD1 1 87 GLN H . . 5.500 5.167 5.017 5.271 . 0 0 "[ . 1 . 2]" 1
1813 1 86 LEU MD1 1 88 LYS H . . 5.020 4.770 4.633 4.904 . 0 0 "[ . 1 . 2]" 1
1814 1 86 LEU MD2 1 87 GLN H . . 4.770 4.793 4.782 4.804 0.034 11 0 "[ . 1 . 2]" 1
1815 1 86 LEU MD2 1 88 LYS H . . 5.520 5.443 5.364 5.526 0.006 7 0 "[ . 1 . 2]" 1
1816 1 87 GLN H 1 87 GLN QB . . 3.410 3.325 3.285 3.372 . 0 0 "[ . 1 . 2]" 1
1817 1 87 GLN H 1 87 GLN HE21 . . 4.620 3.316 2.996 4.214 . 0 0 "[ . 1 . 2]" 1
1818 1 87 GLN H 1 87 GLN HG2 . . 3.490 2.637 2.599 2.731 . 0 0 "[ . 1 . 2]" 1
1819 1 87 GLN H 1 87 GLN HG3 . . 4.130 4.164 4.143 4.192 0.062 19 0 "[ . 1 . 2]" 1
1820 1 87 GLN H 1 88 LYS H . . 3.270 2.657 2.536 2.777 . 0 0 "[ . 1 . 2]" 1
1821 1 87 GLN H 1 88 LYS HG2 . . 5.540 5.591 5.572 5.615 0.075 10 0 "[ . 1 . 2]" 1
1822 1 87 GLN H 1 88 LYS HG3 . . 5.100 4.151 4.075 4.249 . 0 0 "[ . 1 . 2]" 1
1823 1 87 GLN H 1 89 LEU H . . 5.090 5.121 5.065 5.168 0.078 20 0 "[ . 1 . 2]" 1
1824 1 87 GLN H 1 89 LEU MD2 . . 4.030 3.448 3.327 3.568 . 0 0 "[ . 1 . 2]" 1
1825 1 87 GLN HA 1 87 GLN HE21 . . 4.140 2.864 2.429 4.149 0.009 12 0 "[ . 1 . 2]" 1
1826 1 87 GLN HA 1 87 GLN HE22 . . 4.530 3.822 3.617 4.345 . 0 0 "[ . 1 . 2]" 1
1827 1 87 GLN HA 1 87 GLN HG2 . . 3.730 2.772 2.546 2.857 . 0 0 "[ . 1 . 2]" 1
1828 1 87 GLN HA 1 87 GLN HG3 . . 3.740 3.711 3.660 3.758 0.018 3 0 "[ . 1 . 2]" 1
1829 1 87 GLN HA 1 88 LYS H . . 3.370 2.784 2.694 2.879 . 0 0 "[ . 1 . 2]" 1
1830 1 87 GLN HA 1 89 LEU H . . 4.530 3.527 3.447 3.625 . 0 0 "[ . 1 . 2]" 1
1831 1 87 GLN HA 1 89 LEU MD2 . . 3.450 2.159 2.075 2.450 . 0 0 "[ . 1 . 2]" 1
1832 1 87 GLN HA 1 89 LEU HG . . 4.320 3.046 2.671 3.314 . 0 0 "[ . 1 . 2]" 1
1833 1 87 GLN QB 1 87 GLN HE21 . . 3.930 3.723 3.426 3.991 0.061 19 0 "[ . 1 . 2]" 1
1834 1 87 GLN QB 1 87 GLN HE22 . . 4.310 4.176 3.945 4.349 0.039 12 0 "[ . 1 . 2]" 1
1835 1 87 GLN QB 1 88 LYS H . . 3.900 3.896 3.867 3.915 0.015 19 0 "[ . 1 . 2]" 1
1836 1 87 GLN QB 1 89 LEU H . . 4.830 4.154 4.031 4.366 . 0 0 "[ . 1 . 2]" 1
1837 1 87 GLN QB 1 89 LEU MD2 . . 4.950 3.558 3.332 4.029 . 0 0 "[ . 1 . 2]" 1
1838 1 87 GLN HE21 1 87 GLN HG2 . . 3.340 2.306 2.217 2.363 . 0 0 "[ . 1 . 2]" 1
1839 1 87 GLN HE21 1 87 GLN HG3 . . 3.460 3.402 2.732 3.516 0.056 3 0 "[ . 1 . 2]" 1
1840 1 87 GLN HE21 1 89 LEU MD2 . . 4.580 2.895 2.607 4.484 . 0 0 "[ . 1 . 2]" 1
1841 1 87 GLN HE22 1 87 GLN HG2 . . 3.870 3.547 3.511 3.580 . 0 0 "[ . 1 . 2]" 1
1842 1 87 GLN HE22 1 87 GLN HG3 . . 4.090 3.986 3.685 4.071 . 0 0 "[ . 1 . 2]" 1
1843 1 87 GLN HE22 1 89 LEU HG . . 5.820 4.887 4.432 5.633 . 0 0 "[ . 1 . 2]" 1
1844 1 87 GLN HG2 1 88 LYS H . . 4.850 4.787 4.711 4.853 0.003 13 0 "[ . 1 . 2]" 1
1845 1 87 GLN HG2 1 89 LEU MD2 . . 4.740 4.039 3.832 4.195 . 0 0 "[ . 1 . 2]" 1
1846 1 88 LYS H 1 88 LYS QB . . 3.190 2.504 2.443 2.558 . 0 0 "[ . 1 . 2]" 1
1847 1 88 LYS H 1 88 LYS QD . . 4.190 3.987 3.874 4.122 . 0 0 "[ . 1 . 2]" 1
1848 1 88 LYS H 1 88 LYS HG3 . . 3.480 2.487 2.366 2.640 . 0 0 "[ . 1 . 2]" 1
1849 1 88 LYS H 1 89 LEU H . . 3.510 3.313 3.222 3.425 . 0 0 "[ . 1 . 2]" 1
1850 1 88 LYS H 1 89 LEU HA . . 4.500 4.323 4.197 4.491 . 0 0 "[ . 1 . 2]" 1
1851 1 88 LYS H 1 89 LEU MD2 . . 3.710 3.118 2.948 3.283 . 0 0 "[ . 1 . 2]" 1
1852 1 88 LYS H 1 90 GLU H . . 5.340 5.392 5.364 5.421 0.081 18 0 "[ . 1 . 2]" 1
1853 1 88 LYS HA 1 89 LEU H . . 3.190 2.634 2.556 2.729 . 0 0 "[ . 1 . 2]" 1
1854 1 88 LYS HA 1 90 GLU H . . 4.130 3.570 3.465 3.641 . 0 0 "[ . 1 . 2]" 1
1855 1 88 LYS HA 1 91 GLU H . . 4.580 4.095 3.912 4.314 . 0 0 "[ . 1 . 2]" 1
1856 1 88 LYS QB 1 91 GLU H . . 3.920 3.435 3.260 3.593 . 0 0 "[ . 1 . 2]" 1
1857 1 89 LEU H 1 89 LEU HB2 . . 3.550 2.587 2.523 2.634 . 0 0 "[ . 1 . 2]" 1
1858 1 89 LEU H 1 89 LEU HB3 . . 3.740 3.530 3.502 3.576 . 0 0 "[ . 1 . 2]" 1
1859 1 89 LEU H 1 89 LEU MD1 . . 3.710 3.675 3.610 3.727 0.017 10 0 "[ . 1 . 2]" 1
1860 1 89 LEU H 1 89 LEU MD2 . . 2.970 2.659 2.540 2.884 . 0 0 "[ . 1 . 2]" 1
1861 1 89 LEU H 1 89 LEU HG . . 2.950 2.070 1.993 2.200 . 0 0 "[ . 1 . 2]" 1
1862 1 89 LEU H 1 90 GLU H . . 3.290 2.684 2.466 2.801 . 0 0 "[ . 1 . 2]" 1
1863 1 89 LEU H 1 90 GLU QG . . 4.340 4.329 4.065 4.393 0.053 2 0 "[ . 1 . 2]" 1
1864 1 89 LEU H 1 91 GLU H . . 4.610 4.364 4.104 4.618 0.008 7 0 "[ . 1 . 2]" 1
1865 1 89 LEU H 1 92 ALA H . . 4.990 4.648 4.538 4.726 . 0 0 "[ . 1 . 2]" 1
1866 1 89 LEU H 1 116 ILE MG . . 4.960 4.998 4.977 5.026 0.066 6 0 "[ . 1 . 2]" 1
1867 1 89 LEU H 1 120 LEU HA . . 5.640 5.679 5.623 5.736 0.096 20 0 "[ . 1 . 2]" 1
1868 1 89 LEU HA 1 89 LEU MD1 . . 3.820 3.799 3.770 3.822 0.002 3 0 "[ . 1 . 2]" 1
1869 1 89 LEU HA 1 89 LEU MD2 . . 3.070 2.243 2.181 2.286 . 0 0 "[ . 1 . 2]" 1
1870 1 89 LEU HA 1 89 LEU HG . . 3.750 3.467 3.360 3.535 . 0 0 "[ . 1 . 2]" 1
1871 1 89 LEU HA 1 92 ALA H . . 3.860 3.150 2.996 3.302 . 0 0 "[ . 1 . 2]" 1
1872 1 89 LEU HA 1 92 ALA MB . . 3.650 2.088 2.034 2.198 . 0 0 "[ . 1 . 2]" 1
1873 1 89 LEU HA 1 116 ILE MG . . 3.940 3.247 3.093 3.387 . 0 0 "[ . 1 . 2]" 1
1874 1 89 LEU HB2 1 89 LEU MD1 . . 3.370 2.445 2.419 2.479 . 0 0 "[ . 1 . 2]" 1
1875 1 89 LEU HB2 1 90 GLU H . . 3.670 2.855 2.637 2.973 . 0 0 "[ . 1 . 2]" 1
1876 1 89 LEU HB2 1 116 ILE MG . . 4.730 3.446 3.286 3.590 . 0 0 "[ . 1 . 2]" 1
1877 1 89 LEU HB2 1 120 LEU H . . 5.000 5.002 4.928 5.032 0.032 14 0 "[ . 1 . 2]" 1
1878 1 89 LEU HB2 1 120 LEU MD1 . . 5.120 3.436 3.076 3.686 . 0 0 "[ . 1 . 2]" 1
1879 1 89 LEU HB3 1 89 LEU MD1 . . 3.270 2.255 2.225 2.294 . 0 0 "[ . 1 . 2]" 1
1880 1 89 LEU HB3 1 89 LEU MD2 . . 3.310 2.538 2.467 2.587 . 0 0 "[ . 1 . 2]" 1
1881 1 89 LEU HB3 1 90 GLU H . . 5.080 3.941 3.808 4.037 . 0 0 "[ . 1 . 2]" 1
1882 1 89 LEU HB3 1 93 LYS H . . 5.070 4.705 4.572 4.838 . 0 0 "[ . 1 . 2]" 1
1883 1 89 LEU HB3 1 116 ILE MD . . 4.760 4.430 4.118 4.715 . 0 0 "[ . 1 . 2]" 1
1884 1 89 LEU HB3 1 116 ILE MG . . 3.820 2.036 1.999 2.091 . 0 0 "[ . 1 . 2]" 1
1885 1 89 LEU MD1 1 116 ILE HA . . 4.750 3.158 2.991 3.345 . 0 0 "[ . 1 . 2]" 1
1886 1 89 LEU MD1 1 119 ALA H . . 4.120 4.137 4.069 4.174 0.054 7 0 "[ . 1 . 2]" 1
1887 1 89 LEU MD1 1 119 ALA MB . . 2.840 1.999 1.950 2.069 . 0 0 "[ . 1 . 2]" 1
1888 1 89 LEU MD1 1 120 LEU H . . 3.360 2.918 2.797 3.036 . 0 0 "[ . 1 . 2]" 1
1889 1 89 LEU MD1 1 120 LEU HA . . 3.520 2.092 2.027 2.231 . 0 0 "[ . 1 . 2]" 1
1890 1 89 LEU MD1 1 122 SER H . . 4.490 4.333 4.073 4.495 0.005 20 0 "[ . 1 . 2]" 1
1891 1 89 LEU MD2 1 92 ALA H . . 4.850 4.651 4.513 4.833 . 0 0 "[ . 1 . 2]" 1
1892 1 89 LEU MD2 1 93 LYS H . . 5.300 5.242 5.027 5.329 0.029 6 0 "[ . 1 . 2]" 1
1893 1 89 LEU MD2 1 116 ILE HA . . 4.580 3.808 3.518 4.014 . 0 0 "[ . 1 . 2]" 1
1894 1 89 LEU HG 1 90 GLU H . . 4.190 4.190 3.983 4.247 0.057 7 0 "[ . 1 . 2]" 1
1895 1 89 LEU HG 1 120 LEU HA . . 4.250 4.268 4.190 4.299 0.049 18 0 "[ . 1 . 2]" 1
1896 1 89 LEU HG 1 120 LEU MD2 . . 3.410 3.456 3.439 3.481 0.071 1 0 "[ . 1 . 2]" 1
1897 1 90 GLU H 1 90 GLU HB2 . . 2.820 2.648 2.448 2.862 0.042 5 0 "[ . 1 . 2]" 1
1898 1 90 GLU H 1 90 GLU QG . . 2.890 2.379 2.181 2.564 . 0 0 "[ . 1 . 2]" 1
1899 1 90 GLU H 1 91 GLU H . . 3.110 2.636 2.478 2.759 . 0 0 "[ . 1 . 2]" 1
1900 1 90 GLU H 1 92 ALA H . . 4.190 3.973 3.839 4.100 . 0 0 "[ . 1 . 2]" 1
1901 1 90 GLU H 1 92 ALA MB . . 4.820 4.539 4.428 4.675 . 0 0 "[ . 1 . 2]" 1
1902 1 90 GLU H 1 93 LYS H . . 4.940 4.736 4.570 4.915 . 0 0 "[ . 1 . 2]" 1
1903 1 90 GLU H 1 120 LEU MD1 . . 4.370 4.205 3.769 4.381 0.011 14 0 "[ . 1 . 2]" 1
1904 1 90 GLU H 1 120 LEU MD2 . . 3.340 3.098 2.879 3.290 . 0 0 "[ . 1 . 2]" 1
1905 1 90 GLU HA 1 90 GLU QG . . 3.740 2.631 2.383 2.941 . 0 0 "[ . 1 . 2]" 1
1906 1 90 GLU HA 1 93 LYS H . . 4.270 3.879 3.495 4.200 . 0 0 "[ . 1 . 2]" 1
1907 1 90 GLU HB2 1 91 GLU H . . 3.570 2.692 2.316 2.958 . 0 0 "[ . 1 . 2]" 1
1908 1 90 GLU QG 1 120 LEU MD1 . . 4.160 3.365 2.528 3.831 . 0 0 "[ . 1 . 2]" 1
1909 1 90 GLU QG 1 120 LEU MD2 . . 3.240 2.227 2.063 2.615 . 0 0 "[ . 1 . 2]" 1
1910 1 91 GLU H 1 91 GLU HB2 . . 3.100 2.378 2.273 2.524 . 0 0 "[ . 1 . 2]" 1
1911 1 91 GLU H 1 91 GLU HB3 . . 3.740 3.593 3.520 3.644 . 0 0 "[ . 1 . 2]" 1
1912 1 91 GLU H 1 92 ALA H . . 3.280 2.394 2.274 2.634 . 0 0 "[ . 1 . 2]" 1
1913 1 91 GLU H 1 92 ALA MB . . 4.390 4.055 3.921 4.297 . 0 0 "[ . 1 . 2]" 1
1914 1 91 GLU H 1 93 LYS H . . 4.210 3.969 3.854 4.177 . 0 0 "[ . 1 . 2]" 1
1915 1 91 GLU HA 1 91 GLU QG . . 3.030 2.384 2.255 2.511 . 0 0 "[ . 1 . 2]" 1
1916 1 91 GLU HA 1 93 LYS H . . 4.610 4.258 4.110 4.395 . 0 0 "[ . 1 . 2]" 1
1917 1 91 GLU HB2 1 92 ALA H . . 3.540 2.794 2.657 2.973 . 0 0 "[ . 1 . 2]" 1
1918 1 91 GLU HB3 1 92 ALA H . . 3.680 3.667 3.425 3.715 0.035 13 0 "[ . 1 . 2]" 1
1919 1 92 ALA H 1 92 ALA MB . . 2.950 2.217 2.190 2.238 . 0 0 "[ . 1 . 2]" 1
1920 1 92 ALA H 1 93 LYS H . . 3.420 2.818 2.716 2.944 . 0 0 "[ . 1 . 2]" 1
1921 1 92 ALA H 1 94 LYS H . . 4.420 4.387 4.248 4.449 0.029 13 0 "[ . 1 . 2]" 1
1922 1 92 ALA H 1 95 ASP H . . 5.180 4.825 4.715 4.954 . 0 0 "[ . 1 . 2]" 1
1923 1 92 ALA H 1 116 ILE MD . . 5.120 4.882 4.666 5.050 . 0 0 "[ . 1 . 2]" 1
1924 1 92 ALA H 1 116 ILE MG . . 4.860 4.820 4.676 4.882 0.022 2 0 "[ . 1 . 2]" 1
1925 1 92 ALA HA 1 95 ASP H . . 3.850 3.335 3.157 3.467 . 0 0 "[ . 1 . 2]" 1
1926 1 92 ALA HA 1 96 TYR H . . 4.790 3.997 3.888 4.125 . 0 0 "[ . 1 . 2]" 1
1927 1 92 ALA MB 1 93 LYS H . . 3.110 2.623 2.494 2.713 . 0 0 "[ . 1 . 2]" 1
1928 1 92 ALA MB 1 95 ASP H . . 4.950 4.512 4.404 4.648 . 0 0 "[ . 1 . 2]" 1
1929 1 92 ALA MB 1 96 TYR H . . 4.960 4.436 4.303 4.535 . 0 0 "[ . 1 . 2]" 1
1930 1 92 ALA MB 1 96 TYR QE . . 3.620 3.386 3.086 3.631 0.011 19 0 "[ . 1 . 2]" 1
1931 1 92 ALA MB 1 116 ILE MD . . 3.120 2.526 2.381 2.710 . 0 0 "[ . 1 . 2]" 1
1932 1 93 LYS H 1 93 LYS HB2 . . 3.360 2.477 2.308 2.649 . 0 0 "[ . 1 . 2]" 1
1933 1 93 LYS H 1 93 LYS HB3 . . 3.390 2.504 2.340 2.782 . 0 0 "[ . 1 . 2]" 1
1934 1 93 LYS H 1 93 LYS QD . . 4.390 4.360 4.264 4.415 0.025 6 0 "[ . 1 . 2]" 1
1935 1 93 LYS H 1 93 LYS QG . . 4.170 3.968 3.907 4.011 . 0 0 "[ . 1 . 2]" 1
1936 1 93 LYS H 1 94 LYS H . . 3.450 2.816 2.739 2.890 . 0 0 "[ . 1 . 2]" 1
1937 1 93 LYS H 1 94 LYS HA . . 5.410 5.427 5.381 5.446 0.036 9 0 "[ . 1 . 2]" 1
1938 1 93 LYS H 1 94 LYS QB . . 5.430 4.810 4.505 5.181 . 0 0 "[ . 1 . 2]" 1
1939 1 93 LYS H 1 94 LYS QE . . 6.000 5.807 5.160 6.062 0.062 6 0 "[ . 1 . 2]" 1
1940 1 93 LYS H 1 95 ASP H . . 4.540 4.047 3.960 4.163 . 0 0 "[ . 1 . 2]" 1
1941 1 93 LYS H 1 96 TYR H . . 5.230 4.915 4.826 4.998 . 0 0 "[ . 1 . 2]" 1
1942 1 93 LYS H 1 96 TYR HB2 . . 6.000 5.495 5.378 5.647 . 0 0 "[ . 1 . 2]" 1
1943 1 93 LYS H 1 113 LEU MD2 . . 5.130 4.570 4.414 4.719 . 0 0 "[ . 1 . 2]" 1
1944 1 93 LYS H 1 116 ILE MD . . 3.840 3.367 3.057 3.716 . 0 0 "[ . 1 . 2]" 1
1945 1 93 LYS H 1 116 ILE MG . . 3.330 3.157 2.928 3.339 0.009 14 0 "[ . 1 . 2]" 1
1946 1 93 LYS HA 1 93 LYS QG . . 3.700 2.422 2.285 2.538 . 0 0 "[ . 1 . 2]" 1
1947 1 93 LYS HA 1 95 ASP H . . 4.250 4.158 4.046 4.257 0.007 10 0 "[ . 1 . 2]" 1
1948 1 93 LYS HA 1 96 TYR H . . 3.850 3.615 3.472 3.718 . 0 0 "[ . 1 . 2]" 1
1949 1 93 LYS HA 1 96 TYR HB2 . . 4.630 3.215 3.087 3.340 . 0 0 "[ . 1 . 2]" 1
1950 1 93 LYS HA 1 96 TYR HB3 . . 5.020 4.830 4.742 4.969 . 0 0 "[ . 1 . 2]" 1
1951 1 93 LYS HA 1 116 ILE MD . . 3.550 2.635 2.355 2.983 . 0 0 "[ . 1 . 2]" 1
1952 1 93 LYS HA 1 116 ILE MG . . 3.460 3.322 3.076 3.472 0.012 11 0 "[ . 1 . 2]" 1
1953 1 93 LYS HB2 1 93 LYS QD . . 3.680 2.367 2.278 2.477 . 0 0 "[ . 1 . 2]" 1
1954 1 93 LYS HB2 1 94 LYS H . . 4.980 3.891 3.722 4.034 . 0 0 "[ . 1 . 2]" 1
1955 1 93 LYS HB2 1 116 ILE MG . . 3.640 2.299 2.171 2.520 . 0 0 "[ . 1 . 2]" 1
1956 1 93 LYS HB3 1 94 LYS H . . 3.480 2.571 2.374 2.712 . 0 0 "[ . 1 . 2]" 1
1957 1 93 LYS HB3 1 95 ASP H . . 4.950 4.932 4.868 4.977 0.027 8 0 "[ . 1 . 2]" 1
1958 1 93 LYS HB3 1 116 ILE MG . . 4.020 3.730 3.452 4.023 0.003 11 0 "[ . 1 . 2]" 1
1959 1 93 LYS QD 1 116 ILE MG . . 3.890 2.997 2.764 3.305 . 0 0 "[ . 1 . 2]" 1
1960 1 93 LYS QD 1 117 SER H . . 5.420 5.186 4.777 5.436 0.016 18 0 "[ . 1 . 2]" 1
1961 1 93 LYS QD 1 117 SER HA . . 4.600 4.348 3.795 4.622 0.022 17 0 "[ . 1 . 2]" 1
1962 1 93 LYS QD 1 120 LEU MD1 . . 4.170 2.701 2.282 3.210 . 0 0 "[ . 1 . 2]" 1
1963 1 93 LYS HD2 1 116 ILE MG . . 4.470 3.072 2.822 3.404 . 0 0 "[ . 1 . 2]" 1
1964 1 93 LYS HD2 1 120 LEU MD1 . . 4.970 2.870 2.325 3.446 . 0 0 "[ . 1 . 2]" 1
1965 1 93 LYS HD3 1 116 ILE MG . . 4.470 4.201 3.772 4.477 0.007 10 0 "[ . 1 . 2]" 1
1966 1 93 LYS HD3 1 120 LEU MD1 . . 4.970 3.403 2.998 3.831 . 0 0 "[ . 1 . 2]" 1
1967 1 93 LYS QG 1 94 LYS H . . 4.050 3.583 3.343 3.977 . 0 0 "[ . 1 . 2]" 1
1968 1 93 LYS QG 1 97 GLU H . . 4.260 4.142 3.919 4.266 0.006 16 0 "[ . 1 . 2]" 1
1969 1 93 LYS QG 1 116 ILE MG . . 3.360 3.506 2.952 3.865 0.505 12 1 "[ . 1 + . 2]" 1
1970 1 94 LYS H 1 94 LYS QB . . 3.010 2.433 2.130 2.783 . 0 0 "[ . 1 . 2]" 1
1971 1 94 LYS H 1 94 LYS QD . . 3.110 2.623 2.238 3.134 0.024 13 0 "[ . 1 . 2]" 1
1972 1 94 LYS H 1 94 LYS QE . . 4.210 4.041 3.282 4.262 0.052 3 0 "[ . 1 . 2]" 1
1973 1 94 LYS H 1 94 LYS QG . . 3.940 2.914 2.142 3.639 . 0 0 "[ . 1 . 2]" 1
1974 1 94 LYS H 1 95 ASP H . . 3.300 2.753 2.568 2.865 . 0 0 "[ . 1 . 2]" 1
1975 1 94 LYS H 1 96 TYR H . . 4.770 4.676 4.451 4.775 0.005 11 0 "[ . 1 . 2]" 1
1976 1 94 LYS H 1 97 GLU H . . 4.840 4.786 4.716 4.852 0.012 1 0 "[ . 1 . 2]" 1
1977 1 94 LYS H 1 97 GLU QG . . 5.070 4.951 4.747 5.081 0.011 9 0 "[ . 1 . 2]" 1
1978 1 94 LYS HA 1 94 LYS QD . . 3.610 2.510 2.014 3.147 . 0 0 "[ . 1 . 2]" 1
1979 1 94 LYS HA 1 96 TYR H . . 5.130 4.887 4.645 5.082 . 0 0 "[ . 1 . 2]" 1
1980 1 94 LYS HA 1 97 GLU H . . 3.920 3.599 3.266 3.908 . 0 0 "[ . 1 . 2]" 1
1981 1 94 LYS HA 1 98 ARG H . . 4.890 4.396 4.161 4.591 . 0 0 "[ . 1 . 2]" 1
1982 1 94 LYS QB 1 95 ASP H . . 3.290 3.026 2.738 3.291 0.001 20 0 "[ . 1 . 2]" 1
1983 1 94 LYS QD 1 95 ASP H . . 4.740 4.646 4.442 4.783 0.043 12 0 "[ . 1 . 2]" 1
1984 1 94 LYS QG 1 95 ASP H . . 5.290 4.518 4.060 4.891 . 0 0 "[ . 1 . 2]" 1
1985 1 95 ASP H 1 95 ASP HB2 . . 3.490 2.308 2.247 2.385 . 0 0 "[ . 1 . 2]" 1
1986 1 95 ASP H 1 95 ASP HB3 . . 3.730 3.591 3.552 3.637 . 0 0 "[ . 1 . 2]" 1
1987 1 95 ASP H 1 96 TYR H . . 3.410 2.731 2.604 2.824 . 0 0 "[ . 1 . 2]" 1
1988 1 95 ASP H 1 96 TYR HB2 . . 5.240 4.790 4.636 4.897 . 0 0 "[ . 1 . 2]" 1
1989 1 95 ASP H 1 97 GLU H . . 4.030 3.897 3.783 4.013 . 0 0 "[ . 1 . 2]" 1
1990 1 95 ASP H 1 97 GLU QG . . 5.410 5.404 5.244 5.439 0.029 19 0 "[ . 1 . 2]" 1
1991 1 95 ASP H 1 98 ARG H . . 5.150 4.699 4.552 4.818 . 0 0 "[ . 1 . 2]" 1
1992 1 95 ASP H 1 99 VAL MG2 . . 6.000 5.902 5.832 6.006 0.006 4 0 "[ . 1 . 2]" 1
1993 1 95 ASP H 1 113 LEU MD2 . . 5.020 4.947 4.784 5.027 0.007 6 0 "[ . 1 . 2]" 1
1994 1 95 ASP HA 1 97 GLU H . . 5.110 4.501 4.373 4.639 . 0 0 "[ . 1 . 2]" 1
1995 1 95 ASP HA 1 98 ARG H . . 3.990 3.430 3.277 3.647 . 0 0 "[ . 1 . 2]" 1
1996 1 95 ASP HA 1 98 ARG QB . . 4.090 2.720 2.464 2.948 . 0 0 "[ . 1 . 2]" 1
1997 1 95 ASP HB2 1 96 TYR H . . 3.890 2.716 2.504 2.888 . 0 0 "[ . 1 . 2]" 1
1998 1 95 ASP HB3 1 96 TYR H . . 3.970 3.343 3.200 3.451 . 0 0 "[ . 1 . 2]" 1
1999 1 96 TYR H 1 96 TYR HB2 . . 3.640 2.350 2.303 2.384 . 0 0 "[ . 1 . 2]" 1
2000 1 96 TYR H 1 96 TYR HB3 . . 3.730 3.583 3.557 3.597 . 0 0 "[ . 1 . 2]" 1
2001 1 96 TYR H 1 96 TYR QD . . 3.720 2.957 2.855 3.058 . 0 0 "[ . 1 . 2]" 1
2002 1 96 TYR H 1 96 TYR QE . . 4.990 4.887 4.726 4.991 0.001 19 0 "[ . 1 . 2]" 1
2003 1 96 TYR H 1 97 GLU H . . 3.410 2.778 2.747 2.812 . 0 0 "[ . 1 . 2]" 1
2004 1 96 TYR H 1 97 GLU HA . . 5.380 5.395 5.385 5.411 0.031 2 0 "[ . 1 . 2]" 1
2005 1 96 TYR H 1 98 ARG H . . 4.300 4.067 3.966 4.178 . 0 0 "[ . 1 . 2]" 1
2006 1 96 TYR H 1 99 VAL MG2 . . 4.350 4.281 4.155 4.355 0.005 4 0 "[ . 1 . 2]" 1
2007 1 96 TYR H 1 113 LEU MD2 . . 4.060 3.643 3.524 3.706 . 0 0 "[ . 1 . 2]" 1
2008 1 96 TYR H 1 113 LEU HG . . 5.360 4.866 4.758 4.975 . 0 0 "[ . 1 . 2]" 1
2009 1 96 TYR H 1 116 ILE MD . . 4.630 4.137 4.074 4.249 . 0 0 "[ . 1 . 2]" 1
2010 1 96 TYR HA 1 96 TYR QD . . 4.100 2.487 2.426 2.557 . 0 0 "[ . 1 . 2]" 1
2011 1 96 TYR HA 1 96 TYR QE . . 4.640 4.470 4.417 4.545 . 0 0 "[ . 1 . 2]" 1
2012 1 96 TYR HA 1 98 ARG H . . 4.790 3.742 3.619 3.842 . 0 0 "[ . 1 . 2]" 1
2013 1 96 TYR HA 1 99 VAL H . . 4.010 2.932 2.842 3.005 . 0 0 "[ . 1 . 2]" 1
2014 1 96 TYR HA 1 99 VAL HB . . 4.470 2.651 2.550 2.788 . 0 0 "[ . 1 . 2]" 1
2015 1 96 TYR HA 1 99 VAL MG1 . . 4.440 3.925 3.839 4.010 . 0 0 "[ . 1 . 2]" 1
2016 1 96 TYR HA 1 99 VAL MG2 . . 3.700 2.242 2.151 2.297 . 0 0 "[ . 1 . 2]" 1
2017 1 96 TYR HA 1 100 LEU H . . 5.230 4.402 4.231 4.536 . 0 0 "[ . 1 . 2]" 1
2018 1 96 TYR HA 1 109 ALA MB . . 4.200 3.496 3.369 3.667 . 0 0 "[ . 1 . 2]" 1
2019 1 96 TYR HA 1 113 LEU MD1 . . 4.930 4.105 4.031 4.202 . 0 0 "[ . 1 . 2]" 1
2020 1 96 TYR HB2 1 97 GLU H . . 3.940 3.043 2.955 3.106 . 0 0 "[ . 1 . 2]" 1
2021 1 96 TYR HB2 1 98 ARG H . . 5.230 5.109 4.955 5.228 . 0 0 "[ . 1 . 2]" 1
2022 1 96 TYR HB2 1 113 LEU H . . 5.010 4.759 4.587 4.943 . 0 0 "[ . 1 . 2]" 1
2023 1 96 TYR HB2 1 113 LEU MD1 . . 4.580 3.236 3.077 3.333 . 0 0 "[ . 1 . 2]" 1
2024 1 96 TYR HB2 1 113 LEU MD2 . . 3.390 2.304 2.229 2.417 . 0 0 "[ . 1 . 2]" 1
2025 1 96 TYR HB2 1 113 LEU HG . . 5.180 2.565 2.433 2.701 . 0 0 "[ . 1 . 2]" 1
2026 1 96 TYR HB3 1 97 GLU H . . 3.680 3.695 3.681 3.708 0.028 16 0 "[ . 1 . 2]" 1
2027 1 96 TYR HB3 1 97 GLU HA . . 4.460 4.479 4.460 4.501 0.041 8 0 "[ . 1 . 2]" 1
2028 1 96 TYR HB3 1 113 LEU H . . 4.280 4.098 3.953 4.214 . 0 0 "[ . 1 . 2]" 1
2029 1 96 TYR HB3 1 113 LEU MD1 . . 4.410 2.634 2.512 2.785 . 0 0 "[ . 1 . 2]" 1
2030 1 96 TYR HB3 1 113 LEU MD2 . . 3.290 2.999 2.861 3.097 . 0 0 "[ . 1 . 2]" 1
2031 1 96 TYR HB3 1 113 LEU HG . . 4.770 2.173 2.130 2.226 . 0 0 "[ . 1 . 2]" 1
2032 1 96 TYR QD 1 99 VAL MG1 . . 4.890 3.304 3.103 3.438 . 0 0 "[ . 1 . 2]" 1
2033 1 96 TYR QD 1 99 VAL MG2 . . 4.060 2.595 2.522 2.669 . 0 0 "[ . 1 . 2]" 1
2034 1 96 TYR QD 1 109 ALA H . . 5.130 4.488 4.350 4.687 . 0 0 "[ . 1 . 2]" 1
2035 1 96 TYR QD 1 109 ALA HA . . 4.040 2.296 2.200 2.474 . 0 0 "[ . 1 . 2]" 1
2036 1 96 TYR QD 1 109 ALA MB . . 3.780 2.665 2.504 2.958 . 0 0 "[ . 1 . 2]" 1
2037 1 96 TYR QD 1 113 LEU H . . 4.880 4.834 4.722 4.888 0.008 4 0 "[ . 1 . 2]" 1
2038 1 96 TYR QD 1 116 ILE MD . . 3.530 2.196 2.114 2.274 . 0 0 "[ . 1 . 2]" 1
2039 1 96 TYR QE 1 99 VAL MG1 . . 4.380 4.258 3.975 4.392 0.012 17 0 "[ . 1 . 2]" 1
2040 1 96 TYR QE 1 99 VAL MG2 . . 4.330 3.681 3.554 3.808 . 0 0 "[ . 1 . 2]" 1
2041 1 96 TYR QE 1 108 GLU QG . . 4.160 3.362 2.762 4.082 . 0 0 "[ . 1 . 2]" 1
2042 1 96 TYR QE 1 109 ALA H . . 5.520 4.905 4.619 5.167 . 0 0 "[ . 1 . 2]" 1
2043 1 96 TYR QE 1 109 ALA HA . . 4.200 3.387 3.042 3.719 . 0 0 "[ . 1 . 2]" 1
2044 1 96 TYR QE 1 112 GLU H . . 5.450 5.261 5.070 5.323 . 0 0 "[ . 1 . 2]" 1
2045 1 96 TYR QE 1 112 GLU HB3 . . 4.220 3.227 3.063 3.376 . 0 0 "[ . 1 . 2]" 1
2046 1 96 TYR QE 1 112 GLU HG2 . . 4.320 4.293 4.105 4.344 0.024 17 0 "[ . 1 . 2]" 1
2047 1 96 TYR QE 1 112 GLU HG3 . . 4.430 3.114 2.842 3.282 . 0 0 "[ . 1 . 2]" 1
2048 1 96 TYR QE 1 116 ILE MD . . 3.540 2.821 2.563 3.049 . 0 0 "[ . 1 . 2]" 1
2049 1 97 GLU H 1 97 GLU QB . . 3.470 2.400 2.275 2.475 . 0 0 "[ . 1 . 2]" 1
2050 1 97 GLU H 1 97 GLU QG . . 2.920 2.613 2.468 2.737 . 0 0 "[ . 1 . 2]" 1
2051 1 97 GLU H 1 98 ARG H . . 3.430 2.750 2.689 2.846 . 0 0 "[ . 1 . 2]" 1
2052 1 97 GLU H 1 99 VAL H . . 4.630 4.237 4.155 4.328 . 0 0 "[ . 1 . 2]" 1
2053 1 97 GLU H 1 113 LEU MD1 . . 3.490 3.133 3.055 3.207 . 0 0 "[ . 1 . 2]" 1
2054 1 97 GLU H 1 113 LEU MD2 . . 3.600 2.576 2.478 2.665 . 0 0 "[ . 1 . 2]" 1
2055 1 97 GLU H 1 113 LEU HG . . 4.840 4.423 4.290 4.582 . 0 0 "[ . 1 . 2]" 1
2056 1 97 GLU H 1 116 ILE MD . . 5.240 5.143 5.011 5.254 0.014 10 0 "[ . 1 . 2]" 1
2057 1 97 GLU HA 1 97 GLU QG . . 3.870 2.283 2.231 2.392 . 0 0 "[ . 1 . 2]" 1
2058 1 97 GLU HA 1 100 LEU H . . 4.010 3.390 3.219 3.536 . 0 0 "[ . 1 . 2]" 1
2059 1 97 GLU HA 1 113 LEU MD1 . . 3.330 2.370 2.275 2.489 . 0 0 "[ . 1 . 2]" 1
2060 1 97 GLU HA 1 113 LEU MD2 . . 3.640 3.542 3.332 3.649 0.009 12 0 "[ . 1 . 2]" 1
2061 1 97 GLU QG 1 113 LEU MD1 . . 3.680 2.445 2.212 2.853 . 0 0 "[ . 1 . 2]" 1
2062 1 98 ARG H 1 98 ARG HB2 . . 3.360 2.671 2.545 2.731 . 0 0 "[ . 1 . 2]" 1
2063 1 98 ARG H 1 98 ARG HB3 . . 3.360 2.496 2.378 2.674 . 0 0 "[ . 1 . 2]" 1
2064 1 98 ARG H 1 98 ARG HD2 . . 5.360 4.878 4.797 5.007 . 0 0 "[ . 1 . 2]" 1
2065 1 98 ARG H 1 98 ARG HD3 . . 4.730 4.770 4.555 4.823 0.093 10 0 "[ . 1 . 2]" 1
2066 1 98 ARG H 1 98 ARG HG2 . . 4.700 4.644 4.564 4.707 0.007 11 0 "[ . 1 . 2]" 1
2067 1 98 ARG H 1 98 ARG QG . . 4.120 4.064 3.985 4.133 0.013 17 0 "[ . 1 . 2]" 1
2068 1 98 ARG H 1 98 ARG HG3 . . 4.700 4.489 4.386 4.617 . 0 0 "[ . 1 . 2]" 1
2069 1 98 ARG H 1 99 VAL HA . . 5.020 5.047 5.029 5.063 0.043 15 0 "[ . 1 . 2]" 1
2070 1 98 ARG H 1 99 VAL HB . . 4.660 4.498 4.341 4.640 . 0 0 "[ . 1 . 2]" 1
2071 1 98 ARG H 1 99 VAL MG2 . . 4.090 3.872 3.789 3.980 . 0 0 "[ . 1 . 2]" 1
2072 1 98 ARG H 1 100 LEU H . . 4.470 3.883 3.659 4.047 . 0 0 "[ . 1 . 2]" 1
2073 1 98 ARG H 1 101 GLU HG3 . . 4.740 4.590 4.467 4.726 . 0 0 "[ . 1 . 2]" 1
2074 1 98 ARG H 1 113 LEU MD1 . . 4.660 4.714 4.695 4.734 0.074 10 0 "[ . 1 . 2]" 1
2075 1 98 ARG H 1 113 LEU MD2 . . 4.960 4.978 4.916 4.997 0.037 2 0 "[ . 1 . 2]" 1
2076 1 98 ARG HA 1 98 ARG HD2 . . 3.990 2.247 2.120 2.382 . 0 0 "[ . 1 . 2]" 1
2077 1 98 ARG HA 1 98 ARG HD3 . . 3.870 2.747 2.652 2.818 . 0 0 "[ . 1 . 2]" 1
2078 1 98 ARG HA 1 98 ARG HE . . 5.050 4.777 4.431 4.859 . 0 0 "[ . 1 . 2]" 1
2079 1 98 ARG HA 1 100 LEU H . . 4.610 4.012 3.866 4.110 . 0 0 "[ . 1 . 2]" 1
2080 1 98 ARG HA 1 101 GLU H . . 3.390 2.838 2.691 2.969 . 0 0 "[ . 1 . 2]" 1
2081 1 98 ARG HA 1 101 GLU HG2 . . 3.900 3.854 3.709 3.924 0.024 13 0 "[ . 1 . 2]" 1
2082 1 98 ARG HA 1 101 GLU HG3 . . 3.680 2.163 2.089 2.224 . 0 0 "[ . 1 . 2]" 1
2083 1 98 ARG QB 1 98 ARG HD3 . . 3.680 2.436 2.375 2.484 . 0 0 "[ . 1 . 2]" 1
2084 1 98 ARG QB 1 99 VAL H . . 3.510 2.846 2.750 2.906 . 0 0 "[ . 1 . 2]" 1
2085 1 98 ARG HB2 1 99 VAL H . . 4.070 4.034 3.909 4.082 0.012 14 0 "[ . 1 . 2]" 1
2086 1 98 ARG HB3 1 99 VAL H . . 4.070 2.909 2.806 2.977 . 0 0 "[ . 1 . 2]" 1
2087 1 98 ARG HD2 1 99 VAL H . . 5.980 5.086 4.867 5.522 . 0 0 "[ . 1 . 2]" 1
2088 1 98 ARG HD2 1 101 GLU H . . 4.910 3.907 3.736 4.297 . 0 0 "[ . 1 . 2]" 1
2089 1 98 ARG HD2 1 101 GLU HG2 . . 4.330 4.333 4.162 4.398 0.068 7 0 "[ . 1 . 2]" 1
2090 1 98 ARG HD2 1 102 LEU HG . . 4.960 3.266 2.818 3.772 . 0 0 "[ . 1 . 2]" 1
2091 1 98 ARG HD3 1 101 GLU H . . 5.460 5.194 5.032 5.340 . 0 0 "[ . 1 . 2]" 1
2092 1 98 ARG HD3 1 101 GLU HG2 . . 5.000 5.004 4.818 5.040 0.040 18 0 "[ . 1 . 2]" 1
2093 1 98 ARG HE 1 102 LEU MD2 . . 5.080 4.396 3.495 5.092 0.012 5 0 "[ . 1 . 2]" 1
2094 1 98 ARG HE 1 102 LEU HG . . 5.720 4.339 3.118 5.253 . 0 0 "[ . 1 . 2]" 1
2095 1 98 ARG QG 1 99 VAL H . . 4.900 3.960 3.821 4.196 . 0 0 "[ . 1 . 2]" 1
2096 1 99 VAL H 1 99 VAL HB . . 3.530 2.570 2.505 2.620 . 0 0 "[ . 1 . 2]" 1
2097 1 99 VAL H 1 99 VAL MG1 . . 3.800 3.818 3.807 3.827 0.027 18 0 "[ . 1 . 2]" 1
2098 1 99 VAL H 1 99 VAL MG2 . . 3.100 2.157 2.106 2.248 . 0 0 "[ . 1 . 2]" 1
2099 1 99 VAL H 1 100 LEU H . . 3.590 2.791 2.739 2.837 . 0 0 "[ . 1 . 2]" 1
2100 1 99 VAL H 1 101 GLU H . . 4.230 4.075 4.032 4.130 . 0 0 "[ . 1 . 2]" 1
2101 1 99 VAL H 1 101 GLU HB2 . . 5.370 5.387 5.318 5.411 0.041 3 0 "[ . 1 . 2]" 1
2102 1 99 VAL H 1 102 LEU H . . 5.630 5.058 4.976 5.205 . 0 0 "[ . 1 . 2]" 1
2103 1 99 VAL H 1 109 ALA MB . . 4.480 4.371 4.237 4.485 0.005 19 0 "[ . 1 . 2]" 1
2104 1 99 VAL HA 1 99 VAL MG1 . . 3.490 2.474 2.419 2.555 . 0 0 "[ . 1 . 2]" 1
2105 1 99 VAL HA 1 99 VAL MG2 . . 3.600 2.424 2.361 2.465 . 0 0 "[ . 1 . 2]" 1
2106 1 99 VAL HA 1 101 GLU H . . 4.400 4.176 4.063 4.291 . 0 0 "[ . 1 . 2]" 1
2107 1 99 VAL HA 1 102 LEU H . . 4.250 3.735 3.628 3.825 . 0 0 "[ . 1 . 2]" 1
2108 1 99 VAL HA 1 102 LEU HB2 . . 5.100 3.214 3.037 3.417 . 0 0 "[ . 1 . 2]" 1
2109 1 99 VAL HA 1 102 LEU HG . . 5.400 4.946 4.587 5.144 . 0 0 "[ . 1 . 2]" 1
2110 1 99 VAL HA 1 103 GLU H . . 4.240 3.965 3.799 4.137 . 0 0 "[ . 1 . 2]" 1
2111 1 99 VAL HA 1 106 ASN HD22 . . 6.000 5.941 5.467 6.034 0.034 1 0 "[ . 1 . 2]" 1
2112 1 99 VAL HB 1 100 LEU H . . 3.850 2.761 2.618 2.858 . 0 0 "[ . 1 . 2]" 1
2113 1 99 VAL HB 1 109 ALA MB . . 4.470 2.348 2.231 2.448 . 0 0 "[ . 1 . 2]" 1
2114 1 99 VAL MG1 1 100 LEU H . . 3.700 3.557 3.269 3.702 0.002 16 0 "[ . 1 . 2]" 1
2115 1 99 VAL MG1 1 100 LEU HA . . 3.920 3.699 3.429 3.829 . 0 0 "[ . 1 . 2]" 1
2116 1 99 VAL MG1 1 103 GLU H . . 4.160 4.092 3.916 4.171 0.011 14 0 "[ . 1 . 2]" 1
2117 1 99 VAL MG1 1 103 GLU QG . . 4.590 4.515 4.312 4.708 0.118 14 0 "[ . 1 . 2]" 1
2118 1 99 VAL MG1 1 106 ASN H . . 4.680 4.338 4.180 4.486 . 0 0 "[ . 1 . 2]" 1
2119 1 99 VAL MG1 1 106 ASN HB2 . . 4.220 2.778 2.657 2.951 . 0 0 "[ . 1 . 2]" 1
2120 1 99 VAL MG1 1 106 ASN HB3 . . 4.220 2.575 2.395 2.759 . 0 0 "[ . 1 . 2]" 1
2121 1 99 VAL MG1 1 106 ASN HD21 . . 3.970 3.246 2.437 3.646 . 0 0 "[ . 1 . 2]" 1
2122 1 99 VAL MG1 1 106 ASN HD22 . . 3.780 2.936 2.565 3.115 . 0 0 "[ . 1 . 2]" 1
2123 1 99 VAL MG1 1 107 PHE H . . 5.950 5.727 5.427 5.962 0.012 13 0 "[ . 1 . 2]" 1
2124 1 99 VAL MG1 1 109 ALA H . . 3.890 3.644 3.460 3.864 . 0 0 "[ . 1 . 2]" 1
2125 1 99 VAL MG1 1 109 ALA HA . . 4.440 3.856 3.664 4.047 . 0 0 "[ . 1 . 2]" 1
2126 1 99 VAL MG1 1 109 ALA MB . . 2.900 1.960 1.884 2.044 . 0 0 "[ . 1 . 2]" 1
2127 1 99 VAL MG2 1 100 LEU H . . 4.020 3.982 3.934 4.027 0.007 14 0 "[ . 1 . 2]" 1
2128 1 99 VAL MG2 1 101 GLU H . . 5.470 5.338 5.292 5.412 . 0 0 "[ . 1 . 2]" 1
2129 1 99 VAL MG2 1 102 LEU H . . 5.690 5.497 5.430 5.564 . 0 0 "[ . 1 . 2]" 1
2130 1 99 VAL MG2 1 109 ALA MB . . 3.670 3.157 3.029 3.237 . 0 0 "[ . 1 . 2]" 1
2131 1 100 LEU H 1 100 LEU HB2 . . 3.550 2.332 2.233 2.380 . 0 0 "[ . 1 . 2]" 1
2132 1 100 LEU H 1 100 LEU QB . . 3.020 2.302 2.210 2.347 . 0 0 "[ . 1 . 2]" 1
2133 1 100 LEU H 1 100 LEU HB3 . . 3.550 3.561 3.521 3.577 0.027 6 0 "[ . 1 . 2]" 1
2134 1 100 LEU H 1 100 LEU HG . . 3.440 2.604 2.464 2.683 . 0 0 "[ . 1 . 2]" 1
2135 1 100 LEU H 1 101 GLU H . . 3.340 2.693 2.640 2.756 . 0 0 "[ . 1 . 2]" 1
2136 1 100 LEU H 1 102 LEU H . . 4.480 4.318 4.227 4.427 . 0 0 "[ . 1 . 2]" 1
2137 1 100 LEU H 1 103 GLU H . . 4.490 4.521 4.500 4.553 0.063 4 0 "[ . 1 . 2]" 1
2138 1 100 LEU H 1 104 PRO HA . . 5.500 5.340 5.104 5.509 0.009 13 0 "[ . 1 . 2]" 1
2139 1 100 LEU H 1 109 ALA MB . . 4.080 3.549 3.335 3.697 . 0 0 "[ . 1 . 2]" 1
2140 1 100 LEU HA 1 100 LEU MD1 . . 4.330 3.867 3.835 3.885 . 0 0 "[ . 1 . 2]" 1
2141 1 100 LEU HA 1 100 LEU MD2 . . 2.880 2.121 2.092 2.221 . 0 0 "[ . 1 . 2]" 1
2142 1 100 LEU HA 1 103 GLU H . . 3.580 3.017 2.907 3.182 . 0 0 "[ . 1 . 2]" 1
2143 1 100 LEU HA 1 103 GLU HB3 . . 3.880 3.921 3.903 3.953 0.073 3 0 "[ . 1 . 2]" 1
2144 1 100 LEU HA 1 105 ASN H . . 4.790 4.523 4.382 4.687 . 0 0 "[ . 1 . 2]" 1
2145 1 100 LEU HA 1 106 ASN H . . 4.490 4.004 3.844 4.197 . 0 0 "[ . 1 . 2]" 1
2146 1 100 LEU QB 1 101 GLU H . . 3.410 3.219 3.160 3.282 . 0 0 "[ . 1 . 2]" 1
2147 1 100 LEU QB 1 103 GLU H . . 5.170 4.798 4.692 4.937 . 0 0 "[ . 1 . 2]" 1
2148 1 100 LEU HB2 1 101 GLU H . . 4.030 3.377 3.297 3.460 . 0 0 "[ . 1 . 2]" 1
2149 1 100 LEU HB3 1 101 GLU H . . 4.030 4.058 4.034 4.086 0.056 3 0 "[ . 1 . 2]" 1
2150 1 100 LEU MD1 1 110 THR H . . 4.680 3.770 3.259 4.057 . 0 0 "[ . 1 . 2]" 1
2151 1 100 LEU MD1 1 110 THR HA . . 3.650 2.708 2.571 2.882 . 0 0 "[ . 1 . 2]" 1
2152 1 100 LEU MD1 1 110 THR MG . . 3.660 3.636 3.251 3.683 0.023 9 0 "[ . 1 . 2]" 1
2153 1 100 LEU MD2 1 101 GLU H . . 5.430 4.921 4.862 5.021 . 0 0 "[ . 1 . 2]" 1
2154 1 100 LEU MD2 1 104 PRO HA . . 3.820 2.575 2.324 2.792 . 0 0 "[ . 1 . 2]" 1
2155 1 100 LEU MD2 1 105 ASN H . . 4.300 3.819 3.665 4.027 . 0 0 "[ . 1 . 2]" 1
2156 1 100 LEU MD2 1 105 ASN HA . . 4.900 4.136 3.891 4.406 . 0 0 "[ . 1 . 2]" 1
2157 1 100 LEU MD2 1 106 ASN H . . 3.510 2.718 2.505 2.965 . 0 0 "[ . 1 . 2]" 1
2158 1 100 LEU MD2 1 107 PHE H . . 5.820 5.038 4.952 5.136 . 0 0 "[ . 1 . 2]" 1
2159 1 100 LEU MD2 1 109 ALA H . . 4.320 4.236 4.101 4.334 0.014 19 0 "[ . 1 . 2]" 1
2160 1 100 LEU MD2 1 109 ALA MB . . 3.910 2.332 2.219 2.419 . 0 0 "[ . 1 . 2]" 1
2161 1 100 LEU MD2 1 110 THR H . . 3.680 3.243 3.061 3.454 . 0 0 "[ . 1 . 2]" 1
2162 1 100 LEU MD2 1 110 THR HA . . 4.060 3.805 3.576 4.070 0.010 9 0 "[ . 1 . 2]" 1
2163 1 100 LEU HG 1 101 GLU H . . 5.080 4.894 4.796 4.963 . 0 0 "[ . 1 . 2]" 1
2164 1 100 LEU HG 1 109 ALA MB . . 3.800 2.259 2.059 2.425 . 0 0 "[ . 1 . 2]" 1
2165 1 101 GLU H 1 101 GLU HG2 . . 3.360 3.374 3.254 3.429 0.069 14 0 "[ . 1 . 2]" 1
2166 1 101 GLU H 1 101 GLU HG3 . . 3.290 2.556 2.238 2.922 . 0 0 "[ . 1 . 2]" 1
2167 1 101 GLU H 1 102 LEU H . . 3.180 2.414 2.306 2.500 . 0 0 "[ . 1 . 2]" 1
2168 1 101 GLU H 1 103 GLU H . . 3.840 3.699 3.542 3.804 . 0 0 "[ . 1 . 2]" 1
2169 1 101 GLU HA 1 101 GLU HG2 . . 2.970 2.447 2.341 2.571 . 0 0 "[ . 1 . 2]" 1
2170 1 101 GLU HA 1 101 GLU HG3 . . 3.530 3.317 3.115 3.533 0.003 12 0 "[ . 1 . 2]" 1
2171 1 101 GLU HA 1 103 GLU H . . 4.520 4.546 4.524 4.575 0.055 14 0 "[ . 1 . 2]" 1
2172 1 101 GLU HB2 1 102 LEU H . . 3.500 2.598 2.435 2.716 . 0 0 "[ . 1 . 2]" 1
2173 1 101 GLU HB3 1 102 LEU H . . 3.630 3.626 3.465 3.665 0.035 17 0 "[ . 1 . 2]" 1
2174 1 101 GLU HG3 1 102 LEU H . . 4.380 4.289 4.125 4.424 0.044 12 0 "[ . 1 . 2]" 1
2175 1 102 LEU H 1 102 LEU HB2 . . 3.620 2.254 2.189 2.344 . 0 0 "[ . 1 . 2]" 1
2176 1 102 LEU H 1 102 LEU MD1 . . 3.460 3.445 3.293 3.474 0.014 5 0 "[ . 1 . 2]" 1
2177 1 102 LEU H 1 102 LEU MD2 . . 3.880 3.817 3.669 3.892 0.012 6 0 "[ . 1 . 2]" 1
2178 1 102 LEU H 1 102 LEU HG . . 3.320 2.603 2.461 2.708 . 0 0 "[ . 1 . 2]" 1
2179 1 102 LEU H 1 103 GLU H . . 3.240 2.361 2.299 2.402 . 0 0 "[ . 1 . 2]" 1
2180 1 102 LEU H 1 103 GLU HA . . 5.060 5.074 5.038 5.096 0.036 11 0 "[ . 1 . 2]" 1
2181 1 102 LEU H 1 104 PRO QD . . 5.080 4.254 3.966 4.457 . 0 0 "[ . 1 . 2]" 1
2182 1 102 LEU HA 1 102 LEU MD2 . . 2.630 2.199 2.164 2.277 . 0 0 "[ . 1 . 2]" 1
2183 1 102 LEU HB3 1 103 GLU H . . 4.510 3.875 3.651 4.010 . 0 0 "[ . 1 . 2]" 1
2184 1 102 LEU HG 1 103 GLU H . . 4.930 4.602 4.412 4.699 . 0 0 "[ . 1 . 2]" 1
2185 1 103 GLU H 1 103 GLU HB2 . . 3.320 3.161 3.081 3.243 . 0 0 "[ . 1 . 2]" 1
2186 1 103 GLU H 1 103 GLU HB3 . . 3.430 2.978 2.935 3.021 . 0 0 "[ . 1 . 2]" 1
2187 1 103 GLU H 1 103 GLU QG . . 4.220 4.173 4.131 4.214 . 0 0 "[ . 1 . 2]" 1
2188 1 103 GLU H 1 104 PRO QD . . 4.080 3.129 2.961 3.240 . 0 0 "[ . 1 . 2]" 1
2189 1 103 GLU H 1 105 ASN H . . 5.140 4.943 4.840 5.061 . 0 0 "[ . 1 . 2]" 1
2190 1 103 GLU HA 1 103 GLU QG . . 3.630 2.213 2.144 2.286 . 0 0 "[ . 1 . 2]" 1
2191 1 103 GLU HA 1 104 PRO QD . . 3.700 2.087 2.042 2.128 . 0 0 "[ . 1 . 2]" 1
2192 1 103 GLU HA 1 104 PRO QG . . 3.950 3.893 3.809 3.937 . 0 0 "[ . 1 . 2]" 1
2193 1 103 GLU HA 1 105 ASN H . . 3.390 3.383 3.273 3.425 0.035 4 0 "[ . 1 . 2]" 1
2194 1 103 GLU HB2 1 106 ASN H . . 4.950 4.823 4.677 4.963 0.013 19 0 "[ . 1 . 2]" 1
2195 1 103 GLU HB2 1 106 ASN HD21 . . 4.670 3.683 3.276 4.030 . 0 0 "[ . 1 . 2]" 1
2196 1 103 GLU HB2 1 106 ASN HD22 . . 4.710 4.783 4.752 4.804 0.094 11 0 "[ . 1 . 2]" 1
2197 1 103 GLU HB3 1 105 ASN H . . 4.510 4.110 3.919 4.237 . 0 0 "[ . 1 . 2]" 1
2198 1 103 GLU HB3 1 106 ASN H . . 3.750 3.375 3.218 3.550 . 0 0 "[ . 1 . 2]" 1
2199 1 103 GLU HB3 1 106 ASN HD21 . . 4.160 2.775 2.179 3.160 . 0 0 "[ . 1 . 2]" 1
2200 1 103 GLU HB3 1 106 ASN HD22 . . 4.360 3.992 3.874 4.076 . 0 0 "[ . 1 . 2]" 1
2201 1 103 GLU QG 1 105 ASN H . . 4.290 2.614 2.347 2.779 . 0 0 "[ . 1 . 2]" 1
2202 1 103 GLU QG 1 106 ASN H . . 3.820 2.606 2.373 2.858 . 0 0 "[ . 1 . 2]" 1
2203 1 103 GLU QG 1 106 ASN HD21 . . 5.070 3.106 2.774 3.389 . 0 0 "[ . 1 . 2]" 1
2204 1 104 PRO HA 1 106 ASN H . . 4.320 3.947 3.865 4.033 . 0 0 "[ . 1 . 2]" 1
2205 1 104 PRO HB2 1 105 ASN H . . 3.800 3.837 3.777 3.875 0.075 20 0 "[ . 1 . 2]" 1
2206 1 104 PRO HB3 1 105 ASN H . . 4.650 4.511 4.465 4.578 . 0 0 "[ . 1 . 2]" 1
2207 1 104 PRO QD 1 105 ASN H . . 4.210 3.317 3.191 3.503 . 0 0 "[ . 1 . 2]" 1
2208 1 104 PRO QG 1 105 ASN H . . 3.840 3.291 3.027 3.570 . 0 0 "[ . 1 . 2]" 1
2209 1 105 ASN H 1 105 ASN HB2 . . 3.770 2.490 2.361 2.644 . 0 0 "[ . 1 . 2]" 1
2210 1 105 ASN H 1 105 ASN QB . . 3.130 2.452 2.331 2.593 . 0 0 "[ . 1 . 2]" 1
2211 1 105 ASN H 1 105 ASN HB3 . . 3.770 3.688 3.599 3.776 0.006 9 0 "[ . 1 . 2]" 1
2212 1 105 ASN H 1 105 ASN HD21 . . 3.980 3.205 2.676 3.990 0.010 3 0 "[ . 1 . 2]" 1
2213 1 105 ASN H 1 105 ASN HD22 . . 4.880 4.335 4.084 4.718 . 0 0 "[ . 1 . 2]" 1
2214 1 105 ASN H 1 106 ASN H . . 3.250 2.314 2.229 2.441 . 0 0 "[ . 1 . 2]" 1
2215 1 105 ASN H 1 106 ASN HD21 . . 5.600 5.395 5.219 5.558 . 0 0 "[ . 1 . 2]" 1
2216 1 105 ASN H 1 109 ALA MB . . 6.000 6.045 6.024 6.069 0.069 9 0 "[ . 1 . 2]" 1
2217 1 105 ASN HA 1 105 ASN HD22 . . 4.780 4.456 4.115 4.788 0.008 3 0 "[ . 1 . 2]" 1
2218 1 105 ASN HA 1 106 ASN H . . 3.390 3.402 3.312 3.455 0.065 11 0 "[ . 1 . 2]" 1
2219 1 105 ASN QB 1 105 ASN HD21 . . 2.920 2.178 2.135 2.211 . 0 0 "[ . 1 . 2]" 1
2220 1 105 ASN QB 1 105 ASN HD22 . . 3.280 3.286 3.238 3.309 0.029 12 0 "[ . 1 . 2]" 1
2221 1 105 ASN HB2 1 105 ASN HD21 . . 3.340 2.212 2.166 2.276 . 0 0 "[ . 1 . 2]" 1
2222 1 105 ASN HB2 1 105 ASN HD22 . . 4.040 3.512 3.480 3.542 . 0 0 "[ . 1 . 2]" 1
2223 1 105 ASN HB3 1 105 ASN HD21 . . 3.340 3.300 2.850 3.408 0.068 19 0 "[ . 1 . 2]" 1
2224 1 105 ASN HB3 1 105 ASN HD22 . . 4.040 3.958 3.764 4.043 0.003 10 0 "[ . 1 . 2]" 1
2225 1 106 ASN H 1 106 ASN HB2 . . 3.310 2.052 2.003 2.087 . 0 0 "[ . 1 . 2]" 1
2226 1 106 ASN H 1 106 ASN HB3 . . 3.310 2.708 2.631 2.767 . 0 0 "[ . 1 . 2]" 1
2227 1 106 ASN H 1 106 ASN HD21 . . 4.000 3.844 3.775 3.993 . 0 0 "[ . 1 . 2]" 1
2228 1 106 ASN H 1 106 ASN HD22 . . 5.180 5.239 5.205 5.275 0.095 13 0 "[ . 1 . 2]" 1
2229 1 106 ASN H 1 107 PHE H . . 4.690 4.479 4.370 4.625 . 0 0 "[ . 1 . 2]" 1
2230 1 106 ASN H 1 109 ALA MB . . 4.560 4.265 4.178 4.347 . 0 0 "[ . 1 . 2]" 1
2231 1 106 ASN HA 1 106 ASN HD21 . . 4.240 2.907 2.595 3.724 . 0 0 "[ . 1 . 2]" 1
2232 1 106 ASN HA 1 106 ASN HD22 . . 4.300 3.880 3.759 4.043 . 0 0 "[ . 1 . 2]" 1
2233 1 106 ASN HA 1 107 PHE H . . 3.250 2.145 2.110 2.216 . 0 0 "[ . 1 . 2]" 1
2234 1 106 ASN HA 1 107 PHE HB2 . . 4.690 4.504 4.350 4.600 . 0 0 "[ . 1 . 2]" 1
2235 1 106 ASN HA 1 107 PHE HB3 . . 4.920 4.483 4.308 4.646 . 0 0 "[ . 1 . 2]" 1
2236 1 106 ASN HA 1 108 GLU H . . 4.160 3.796 3.593 4.035 . 0 0 "[ . 1 . 2]" 1
2237 1 106 ASN QB 1 107 PHE H . . 4.210 3.894 3.729 3.962 . 0 0 "[ . 1 . 2]" 1
2238 1 106 ASN QB 1 109 ALA H . . 4.520 3.160 3.032 3.291 . 0 0 "[ . 1 . 2]" 1
2239 1 106 ASN HD21 1 107 PHE H . . 5.610 4.715 4.179 5.540 . 0 0 "[ . 1 . 2]" 1
2240 1 106 ASN HD21 1 108 GLU H . . 6.000 5.296 4.920 5.944 . 0 0 "[ . 1 . 2]" 1
2241 1 106 ASN HD21 1 109 ALA H . . 5.060 5.079 5.004 5.127 0.067 10 0 "[ . 1 . 2]" 1
2242 1 106 ASN HD22 1 107 PHE H . . 5.530 5.155 4.580 5.545 0.015 10 0 "[ . 1 . 2]" 1
2243 1 106 ASN HD22 1 108 GLU H . . 5.300 4.925 4.474 5.295 . 0 0 "[ . 1 . 2]" 1
2244 1 106 ASN HD22 1 109 ALA MB . . 4.980 4.114 3.834 4.322 . 0 0 "[ . 1 . 2]" 1
2245 1 107 PHE H 1 107 PHE HB2 . . 3.450 2.592 2.410 2.822 . 0 0 "[ . 1 . 2]" 1
2246 1 107 PHE H 1 107 PHE HB3 . . 3.480 2.374 2.221 2.502 . 0 0 "[ . 1 . 2]" 1
2247 1 107 PHE H 1 107 PHE QD . . 4.300 4.198 4.110 4.260 . 0 0 "[ . 1 . 2]" 1
2248 1 107 PHE H 1 108 GLU H . . 3.500 2.508 2.213 2.734 . 0 0 "[ . 1 . 2]" 1
2249 1 107 PHE H 1 108 GLU QB . . 4.520 4.245 3.887 4.517 . 0 0 "[ . 1 . 2]" 1
2250 1 107 PHE H 1 109 ALA H . . 4.210 4.137 3.901 4.240 0.030 4 0 "[ . 1 . 2]" 1
2251 1 107 PHE HA 1 107 PHE QD . . 3.750 2.493 2.191 2.907 . 0 0 "[ . 1 . 2]" 1
2252 1 107 PHE HA 1 108 GLU QB . . 5.260 5.174 5.092 5.232 . 0 0 "[ . 1 . 2]" 1
2253 1 107 PHE HA 1 109 ALA H . . 4.460 4.485 4.399 4.515 0.055 1 0 "[ . 1 . 2]" 1
2254 1 107 PHE HA 1 110 THR H . . 3.810 3.452 3.248 3.546 . 0 0 "[ . 1 . 2]" 1
2255 1 107 PHE HA 1 110 THR MG . . 4.690 4.042 3.734 4.261 . 0 0 "[ . 1 . 2]" 1
2256 1 107 PHE HA 1 111 ASN H . . 4.670 4.143 3.965 4.403 . 0 0 "[ . 1 . 2]" 1
2257 1 107 PHE HA 1 111 ASN HD21 . . 5.440 5.069 3.762 5.446 0.006 17 0 "[ . 1 . 2]" 1
2258 1 107 PHE HA 1 111 ASN HD22 . . 5.440 4.618 4.305 4.769 . 0 0 "[ . 1 . 2]" 1
2259 1 107 PHE HB2 1 108 GLU H . . 4.080 4.043 3.920 4.086 0.006 10 0 "[ . 1 . 2]" 1
2260 1 107 PHE HB2 1 108 GLU QB . . 5.670 5.523 5.317 5.619 . 0 0 "[ . 1 . 2]" 1
2261 1 107 PHE HB3 1 108 GLU H . . 3.330 2.833 2.726 2.928 . 0 0 "[ . 1 . 2]" 1
2262 1 107 PHE HB3 1 109 ALA H . . 5.290 5.201 5.086 5.300 0.010 3 0 "[ . 1 . 2]" 1
2263 1 107 PHE QD 1 108 GLU H . . 4.400 4.063 3.573 4.410 0.010 3 0 "[ . 1 . 2]" 1
2264 1 108 GLU H 1 108 GLU QB . . 2.660 2.218 2.134 2.293 . 0 0 "[ . 1 . 2]" 1
2265 1 108 GLU H 1 109 ALA H . . 3.190 2.576 2.530 2.637 . 0 0 "[ . 1 . 2]" 1
2266 1 108 GLU H 1 109 ALA MB . . 4.090 4.139 4.127 4.151 0.061 4 0 "[ . 1 . 2]" 1
2267 1 108 GLU H 1 110 THR H . . 4.140 4.018 3.892 4.137 . 0 0 "[ . 1 . 2]" 1
2268 1 108 GLU H 1 111 ASN H . . 5.020 4.723 4.643 4.807 . 0 0 "[ . 1 . 2]" 1
2269 1 108 GLU HA 1 108 GLU QG . . 3.330 2.358 2.227 2.525 . 0 0 "[ . 1 . 2]" 1
2270 1 108 GLU HA 1 111 ASN H . . 3.820 3.392 3.232 3.569 . 0 0 "[ . 1 . 2]" 1
2271 1 108 GLU HA 1 111 ASN HB2 . . 3.830 2.604 2.482 2.717 . 0 0 "[ . 1 . 2]" 1
2272 1 108 GLU HA 1 111 ASN HB3 . . 4.330 4.238 4.121 4.345 0.015 6 0 "[ . 1 . 2]" 1
2273 1 108 GLU HA 1 111 ASN HD21 . . 4.340 2.967 2.643 3.342 . 0 0 "[ . 1 . 2]" 1
2274 1 108 GLU HA 1 111 ASN HD22 . . 4.940 4.254 3.949 4.584 . 0 0 "[ . 1 . 2]" 1
2275 1 108 GLU HA 1 112 GLU H . . 4.100 3.911 3.751 4.078 . 0 0 "[ . 1 . 2]" 1
2276 1 108 GLU QB 1 109 ALA H . . 3.010 2.550 2.442 2.674 . 0 0 "[ . 1 . 2]" 1
2277 1 108 GLU QB 1 109 ALA HA . . 4.670 4.203 4.090 4.396 . 0 0 "[ . 1 . 2]" 1
2278 1 108 GLU QB 1 110 THR H . . 4.670 4.698 4.678 4.721 0.051 11 0 "[ . 1 . 2]" 1
2279 1 108 GLU QB 1 111 ASN H . . 5.490 4.986 4.911 5.066 . 0 0 "[ . 1 . 2]" 1
2280 1 108 GLU QB 1 111 ASN HD21 . . 5.480 4.673 4.338 5.103 . 0 0 "[ . 1 . 2]" 1
2281 1 108 GLU QG 1 109 ALA HA . . 5.250 3.944 3.391 4.415 . 0 0 "[ . 1 . 2]" 1
2282 1 108 GLU QG 1 111 ASN H . . 5.860 4.834 4.590 4.992 . 0 0 "[ . 1 . 2]" 1
2283 1 108 GLU QG 1 111 ASN HB2 . . 4.830 3.862 3.571 4.051 . 0 0 "[ . 1 . 2]" 1
2284 1 108 GLU QG 1 111 ASN HB3 . . 5.120 5.044 4.691 5.158 0.038 12 0 "[ . 1 . 2]" 1
2285 1 108 GLU QG 1 111 ASN HD21 . . 5.700 4.484 4.105 4.875 . 0 0 "[ . 1 . 2]" 1
2286 1 108 GLU QG 1 111 ASN HD22 . . 6.000 5.891 5.518 6.021 0.021 10 0 "[ . 1 . 2]" 1
2287 1 108 GLU QG 1 112 GLU H . . 4.300 4.054 3.778 4.313 0.013 20 0 "[ . 1 . 2]" 1
2288 1 109 ALA H 1 109 ALA MB . . 2.940 2.131 2.053 2.172 . 0 0 "[ . 1 . 2]" 1
2289 1 109 ALA H 1 110 THR H . . 3.300 2.677 2.628 2.730 . 0 0 "[ . 1 . 2]" 1
2290 1 109 ALA H 1 110 THR HB . . 5.060 4.880 4.778 4.977 . 0 0 "[ . 1 . 2]" 1
2291 1 109 ALA H 1 110 THR MG . . 5.930 5.931 5.869 5.968 0.038 9 0 "[ . 1 . 2]" 1
2292 1 109 ALA H 1 111 ASN H . . 4.210 4.208 4.144 4.239 0.029 20 0 "[ . 1 . 2]" 1
2293 1 109 ALA HA 1 111 ASN H . . 4.540 4.512 4.372 4.551 0.011 9 0 "[ . 1 . 2]" 1
2294 1 109 ALA HA 1 112 GLU H . . 4.500 3.601 3.398 3.733 . 0 0 "[ . 1 . 2]" 1
2295 1 109 ALA HA 1 112 GLU HB2 . . 4.320 2.977 2.789 3.242 . 0 0 "[ . 1 . 2]" 1
2296 1 109 ALA HA 1 113 LEU MD1 . . 5.030 4.131 3.978 4.263 . 0 0 "[ . 1 . 2]" 1
2297 1 109 ALA MB 1 110 THR H . . 3.340 2.473 2.404 2.541 . 0 0 "[ . 1 . 2]" 1
2298 1 109 ALA MB 1 110 THR HA . . 3.980 3.907 3.781 3.981 0.001 7 0 "[ . 1 . 2]" 1
2299 1 109 ALA MB 1 111 ASN H . . 4.730 4.532 4.468 4.624 . 0 0 "[ . 1 . 2]" 1
2300 1 109 ALA MB 1 112 GLU H . . 4.760 4.741 4.626 4.787 0.027 19 0 "[ . 1 . 2]" 1
2301 1 110 THR H 1 110 THR HB . . 3.210 2.506 2.399 2.623 . 0 0 "[ . 1 . 2]" 1
2302 1 110 THR H 1 110 THR MG . . 3.770 3.771 3.743 3.787 0.017 18 0 "[ . 1 . 2]" 1
2303 1 110 THR H 1 111 ASN H . . 3.290 2.648 2.534 2.730 . 0 0 "[ . 1 . 2]" 1
2304 1 110 THR H 1 112 GLU H . . 4.220 4.168 4.047 4.228 0.008 1 0 "[ . 1 . 2]" 1
2305 1 110 THR H 1 113 LEU H . . 4.940 4.788 4.655 4.876 . 0 0 "[ . 1 . 2]" 1
2306 1 110 THR H 1 113 LEU HB2 . . 5.480 5.148 4.931 5.315 . 0 0 "[ . 1 . 2]" 1
2307 1 110 THR H 1 113 LEU MD1 . . 5.100 4.412 4.286 4.536 . 0 0 "[ . 1 . 2]" 1
2308 1 110 THR HA 1 110 THR MG . . 3.130 2.370 2.304 2.472 . 0 0 "[ . 1 . 2]" 1
2309 1 110 THR HA 1 113 LEU H . . 3.930 3.757 3.426 3.937 0.007 16 0 "[ . 1 . 2]" 1
2310 1 110 THR HA 1 113 LEU HB2 . . 4.200 2.898 2.499 3.162 . 0 0 "[ . 1 . 2]" 1
2311 1 110 THR HA 1 113 LEU HB3 . . 4.930 4.463 4.077 4.739 . 0 0 "[ . 1 . 2]" 1
2312 1 110 THR HA 1 113 LEU MD1 . . 4.070 2.926 2.614 3.145 . 0 0 "[ . 1 . 2]" 1
2313 1 110 THR HA 1 114 ARG H . . 5.100 4.291 3.983 4.455 . 0 0 "[ . 1 . 2]" 1
2314 1 110 THR HB 1 111 ASN H . . 3.310 2.624 2.475 2.818 . 0 0 "[ . 1 . 2]" 1
2315 1 110 THR MG 1 111 ASN H . . 3.710 3.451 3.329 3.624 . 0 0 "[ . 1 . 2]" 1
2316 1 110 THR MG 1 112 GLU H . . 5.140 5.172 5.146 5.190 0.050 16 0 "[ . 1 . 2]" 1
2317 1 110 THR MG 1 113 LEU H . . 5.080 4.964 4.766 5.070 . 0 0 "[ . 1 . 2]" 1
2318 1 110 THR MG 1 114 ARG H . . 4.460 4.364 4.098 4.477 0.017 10 0 "[ . 1 . 2]" 1
2319 1 110 THR MG 1 114 ARG QD . . 4.910 4.496 3.688 5.139 0.229 12 0 "[ . 1 . 2]" 1
2320 1 111 ASN H 1 111 ASN HB2 . . 3.110 2.347 2.271 2.434 . 0 0 "[ . 1 . 2]" 1
2321 1 111 ASN H 1 111 ASN HB3 . . 3.590 3.546 3.492 3.593 0.003 2 0 "[ . 1 . 2]" 1
2322 1 111 ASN H 1 111 ASN HD21 . . 4.630 3.741 2.434 4.075 . 0 0 "[ . 1 . 2]" 1
2323 1 111 ASN H 1 111 ASN HD22 . . 4.770 4.241 4.013 4.371 . 0 0 "[ . 1 . 2]" 1
2324 1 111 ASN H 1 112 GLU H . . 3.420 2.663 2.594 2.704 . 0 0 "[ . 1 . 2]" 1
2325 1 111 ASN H 1 112 GLU HB2 . . 4.920 4.892 4.823 4.929 0.009 9 0 "[ . 1 . 2]" 1
2326 1 111 ASN H 1 112 GLU HG2 . . 4.600 4.531 4.413 4.616 0.016 5 0 "[ . 1 . 2]" 1
2327 1 111 ASN H 1 113 LEU H . . 4.150 4.140 4.088 4.169 0.019 16 0 "[ . 1 . 2]" 1
2328 1 111 ASN H 1 113 LEU MD1 . . 5.470 5.454 5.307 5.491 0.021 2 0 "[ . 1 . 2]" 1
2329 1 111 ASN H 1 114 ARG H . . 4.790 4.724 4.600 4.801 0.011 10 0 "[ . 1 . 2]" 1
2330 1 111 ASN HA 1 113 LEU H . . 4.500 4.475 4.382 4.515 0.015 14 0 "[ . 1 . 2]" 1
2331 1 111 ASN HA 1 114 ARG H . . 3.790 3.434 3.309 3.522 . 0 0 "[ . 1 . 2]" 1
2332 1 111 ASN HA 1 114 ARG QD . . 4.190 3.392 2.751 3.775 . 0 0 "[ . 1 . 2]" 1
2333 1 111 ASN HB2 1 111 ASN HD22 . . 3.780 3.532 3.492 3.589 . 0 0 "[ . 1 . 2]" 1
2334 1 111 ASN HB2 1 112 GLU H . . 3.400 2.745 2.602 2.927 . 0 0 "[ . 1 . 2]" 1
2335 1 111 ASN HB2 1 113 LEU H . . 5.440 5.137 5.035 5.307 . 0 0 "[ . 1 . 2]" 1
2336 1 111 ASN HB2 1 114 ARG H . . 5.780 5.563 5.475 5.679 . 0 0 "[ . 1 . 2]" 1
2337 1 111 ASN HB3 1 111 ASN HD22 . . 4.090 3.797 3.683 4.067 . 0 0 "[ . 1 . 2]" 1
2338 1 111 ASN HB3 1 112 GLU H . . 3.720 3.628 3.511 3.728 0.008 14 0 "[ . 1 . 2]" 1
2339 1 111 ASN HB3 1 112 GLU HA . . 4.850 4.425 4.196 4.576 . 0 0 "[ . 1 . 2]" 1
2340 1 111 ASN HB3 1 114 ARG H . . 5.330 5.355 5.304 5.392 0.062 5 0 "[ . 1 . 2]" 1
2341 1 111 ASN HD21 1 112 GLU H . . 5.090 4.989 4.586 5.122 0.032 12 0 "[ . 1 . 2]" 1
2342 1 112 GLU H 1 112 GLU HB2 . . 3.610 2.456 2.413 2.505 . 0 0 "[ . 1 . 2]" 1
2343 1 112 GLU H 1 112 GLU HB3 . . 3.740 3.636 3.609 3.659 . 0 0 "[ . 1 . 2]" 1
2344 1 112 GLU H 1 112 GLU HG2 . . 3.430 2.430 2.350 2.500 . 0 0 "[ . 1 . 2]" 1
2345 1 112 GLU H 1 112 GLU HG3 . . 3.690 3.704 3.616 3.738 0.048 18 0 "[ . 1 . 2]" 1
2346 1 112 GLU H 1 113 LEU H . . 3.390 2.641 2.544 2.690 . 0 0 "[ . 1 . 2]" 1
2347 1 112 GLU H 1 113 LEU HB2 . . 4.670 4.661 4.594 4.686 0.016 1 0 "[ . 1 . 2]" 1
2348 1 112 GLU H 1 113 LEU MD1 . . 5.280 5.224 5.135 5.279 . 0 0 "[ . 1 . 2]" 1
2349 1 112 GLU H 1 114 ARG H . . 4.110 4.035 3.952 4.121 0.011 10 0 "[ . 1 . 2]" 1
2350 1 112 GLU HA 1 112 GLU HG2 . . 4.250 3.040 2.937 3.137 . 0 0 "[ . 1 . 2]" 1
2351 1 112 GLU HA 1 115 LYS H . . 3.760 3.171 3.002 3.329 . 0 0 "[ . 1 . 2]" 1
2352 1 112 GLU HA 1 115 LYS QB . . 3.530 2.675 2.398 2.998 . 0 0 "[ . 1 . 2]" 1
2353 1 112 GLU HA 1 115 LYS QE . . 4.670 3.696 2.141 4.515 . 0 0 "[ . 1 . 2]" 1
2354 1 112 GLU HB2 1 113 LEU H . . 3.630 2.925 2.856 3.008 . 0 0 "[ . 1 . 2]" 1
2355 1 112 GLU HB2 1 114 ARG H . . 5.490 5.181 5.098 5.245 . 0 0 "[ . 1 . 2]" 1
2356 1 112 GLU HB3 1 113 LEU H . . 3.970 3.848 3.770 3.949 . 0 0 "[ . 1 . 2]" 1
2357 1 112 GLU HG2 1 113 LEU H . . 4.660 4.588 4.524 4.638 . 0 0 "[ . 1 . 2]" 1
2358 1 113 LEU H 1 113 LEU HB2 . . 3.150 2.307 2.267 2.340 . 0 0 "[ . 1 . 2]" 1
2359 1 113 LEU H 1 113 LEU HB3 . . 4.000 3.581 3.557 3.605 . 0 0 "[ . 1 . 2]" 1
2360 1 113 LEU H 1 113 LEU MD1 . . 3.640 3.517 3.477 3.569 . 0 0 "[ . 1 . 2]" 1
2361 1 113 LEU H 1 113 LEU MD2 . . 4.290 3.887 3.817 3.967 . 0 0 "[ . 1 . 2]" 1
2362 1 113 LEU H 1 113 LEU HG . . 3.140 2.643 2.558 2.761 . 0 0 "[ . 1 . 2]" 1
2363 1 113 LEU H 1 114 ARG H . . 3.290 2.619 2.580 2.664 . 0 0 "[ . 1 . 2]" 1
2364 1 113 LEU H 1 114 ARG HA . . 5.330 5.299 5.264 5.338 0.008 3 0 "[ . 1 . 2]" 1
2365 1 113 LEU H 1 114 ARG QB . . 4.240 4.275 4.259 4.297 0.057 4 0 "[ . 1 . 2]" 1
2366 1 113 LEU H 1 116 ILE H . . 5.090 4.741 4.680 4.809 . 0 0 "[ . 1 . 2]" 1
2367 1 113 LEU HA 1 113 LEU MD1 . . 4.030 3.866 3.844 3.891 . 0 0 "[ . 1 . 2]" 1
2368 1 113 LEU HA 1 113 LEU MD2 . . 3.440 2.146 2.111 2.209 . 0 0 "[ . 1 . 2]" 1
2369 1 113 LEU HA 1 115 LYS H . . 4.620 4.191 4.004 4.330 . 0 0 "[ . 1 . 2]" 1
2370 1 113 LEU HA 1 116 ILE H . . 3.740 3.343 3.192 3.502 . 0 0 "[ . 1 . 2]" 1
2371 1 113 LEU HA 1 116 ILE HA . . 5.650 5.245 5.096 5.442 . 0 0 "[ . 1 . 2]" 1
2372 1 113 LEU HA 1 116 ILE HB . . 4.310 2.489 2.360 2.649 . 0 0 "[ . 1 . 2]" 1
2373 1 113 LEU HA 1 116 ILE MD . . 3.630 2.292 2.151 2.478 . 0 0 "[ . 1 . 2]" 1
2374 1 113 LEU HA 1 117 SER H . . 4.120 3.881 3.573 4.126 0.006 2 0 "[ . 1 . 2]" 1
2375 1 113 LEU HB2 1 113 LEU MD1 . . 3.670 2.303 2.247 2.336 . 0 0 "[ . 1 . 2]" 1
2376 1 113 LEU HB2 1 114 ARG H . . 4.430 2.851 2.678 2.947 . 0 0 "[ . 1 . 2]" 1
2377 1 113 LEU HB3 1 113 LEU MD1 . . 3.620 2.524 2.482 2.571 . 0 0 "[ . 1 . 2]" 1
2378 1 113 LEU HB3 1 113 LEU MD2 . . 2.940 2.329 2.284 2.348 . 0 0 "[ . 1 . 2]" 1
2379 1 113 LEU HB3 1 114 ARG H . . 3.790 3.617 3.486 3.723 . 0 0 "[ . 1 . 2]" 1
2380 1 113 LEU MD1 1 114 ARG H . . 4.740 4.699 4.554 4.761 0.021 12 0 "[ . 1 . 2]" 1
2381 1 113 LEU MD2 1 114 ARG H . . 5.080 4.867 4.790 4.952 . 0 0 "[ . 1 . 2]" 1
2382 1 113 LEU MD2 1 116 ILE H . . 5.180 4.866 4.737 5.015 . 0 0 "[ . 1 . 2]" 1
2383 1 113 LEU MD2 1 116 ILE HB . . 4.740 3.256 3.008 3.466 . 0 0 "[ . 1 . 2]" 1
2384 1 113 LEU MD2 1 116 ILE MD . . 3.450 2.504 2.329 2.831 . 0 0 "[ . 1 . 2]" 1
2385 1 113 LEU MD2 1 117 SER H . . 5.070 4.835 4.428 5.094 0.024 2 0 "[ . 1 . 2]" 1
2386 1 114 ARG H 1 114 ARG QB . . 2.870 2.161 2.126 2.210 . 0 0 "[ . 1 . 2]" 1
2387 1 114 ARG H 1 114 ARG QD . . 4.600 4.511 4.220 4.651 0.051 11 0 "[ . 1 . 2]" 1
2388 1 114 ARG H 1 116 ILE HB . . 6.000 5.291 5.154 5.400 . 0 0 "[ . 1 . 2]" 1
2389 1 114 ARG H 1 116 ILE MD . . 5.910 5.097 4.989 5.212 . 0 0 "[ . 1 . 2]" 1
2390 1 114 ARG HA 1 114 ARG QD . . 4.350 4.159 3.975 4.252 . 0 0 "[ . 1 . 2]" 1
2391 1 114 ARG HA 1 114 ARG QG . . 3.100 2.432 2.234 2.575 . 0 0 "[ . 1 . 2]" 1
2392 1 114 ARG HA 1 117 SER H . . 4.030 3.895 3.659 4.060 0.030 8 0 "[ . 1 . 2]" 1
2393 1 114 ARG QD 1 115 LYS H . . 4.860 4.772 4.514 4.907 0.047 1 0 "[ . 1 . 2]" 1
2394 1 114 ARG QG 1 117 SER QB . . 5.310 4.319 3.869 4.765 . 0 0 "[ . 1 . 2]" 1
2395 1 115 LYS H 1 115 LYS QB . . 2.990 2.410 2.262 2.473 . 0 0 "[ . 1 . 2]" 1
2396 1 115 LYS H 1 115 LYS QE . . 4.680 4.254 3.561 4.694 0.014 17 0 "[ . 1 . 2]" 1
2397 1 115 LYS H 1 116 ILE H . . 3.570 2.592 2.501 2.650 . 0 0 "[ . 1 . 2]" 1
2398 1 115 LYS H 1 116 ILE HA . . 5.750 5.238 5.148 5.298 . 0 0 "[ . 1 . 2]" 1
2399 1 115 LYS H 1 116 ILE HB . . 6.000 4.676 4.641 4.716 . 0 0 "[ . 1 . 2]" 1
2400 1 115 LYS H 1 116 ILE MG . . 5.810 5.826 5.786 5.847 0.037 4 0 "[ . 1 . 2]" 1
2401 1 115 LYS H 1 117 SER H . . 4.150 4.097 3.958 4.169 0.019 3 0 "[ . 1 . 2]" 1
2402 1 115 LYS H 1 119 ALA H . . 6.000 6.028 6.002 6.051 0.051 2 0 "[ . 1 . 2]" 1
2403 1 115 LYS HA 1 116 ILE HA . . 5.050 4.860 4.815 4.902 . 0 0 "[ . 1 . 2]" 1
2404 1 115 LYS HA 1 118 GLN HG3 . . 4.150 2.682 2.200 3.489 . 0 0 "[ . 1 . 2]" 1
2405 1 115 LYS HA 1 119 ALA H . . 4.130 4.035 3.961 4.130 0.000 7 0 "[ . 1 . 2]" 1
2406 1 115 LYS QB 1 116 ILE H . . 3.580 2.478 2.210 2.679 . 0 0 "[ . 1 . 2]" 1
2407 1 115 LYS QB 1 116 ILE HA . . 4.980 3.906 3.642 4.080 . 0 0 "[ . 1 . 2]" 1
2408 1 115 LYS QB 1 116 ILE MD . . 5.090 4.408 4.126 4.612 . 0 0 "[ . 1 . 2]" 1
2409 1 115 LYS QB 1 117 SER H . . 4.790 4.713 4.590 4.818 0.028 17 0 "[ . 1 . 2]" 1
2410 1 115 LYS QB 1 119 ALA H . . 4.300 4.332 4.297 4.354 0.054 10 0 "[ . 1 . 2]" 1
2411 1 115 LYS QD 1 116 ILE H . . 4.920 4.530 4.209 4.970 0.050 8 0 "[ . 1 . 2]" 1
2412 1 116 ILE H 1 116 ILE HB . . 3.320 2.514 2.452 2.625 . 0 0 "[ . 1 . 2]" 1
2413 1 116 ILE H 1 116 ILE MD . . 3.560 3.280 3.226 3.357 . 0 0 "[ . 1 . 2]" 1
2414 1 116 ILE H 1 116 ILE HG12 . . 3.990 3.690 3.571 3.757 . 0 0 "[ . 1 . 2]" 1
2415 1 116 ILE H 1 116 ILE HG13 . . 3.680 2.254 2.116 2.341 . 0 0 "[ . 1 . 2]" 1
2416 1 116 ILE H 1 116 ILE MG . . 3.870 3.812 3.790 3.863 . 0 0 "[ . 1 . 2]" 1
2417 1 116 ILE H 1 117 SER H . . 3.350 2.878 2.788 3.061 . 0 0 "[ . 1 . 2]" 1
2418 1 116 ILE H 1 117 SER HA . . 5.600 5.493 5.419 5.618 0.018 8 0 "[ . 1 . 2]" 1
2419 1 116 ILE H 1 118 GLN H . . 4.710 4.305 4.181 4.428 . 0 0 "[ . 1 . 2]" 1
2420 1 116 ILE H 1 119 ALA H . . 5.040 4.670 4.602 4.719 . 0 0 "[ . 1 . 2]" 1
2421 1 116 ILE H 1 119 ALA MB . . 5.330 4.297 4.139 4.394 . 0 0 "[ . 1 . 2]" 1
2422 1 116 ILE HA 1 116 ILE MD . . 4.090 3.861 3.811 3.891 . 0 0 "[ . 1 . 2]" 1
2423 1 116 ILE HA 1 116 ILE HG12 . . 4.200 2.672 2.600 2.727 . 0 0 "[ . 1 . 2]" 1
2424 1 116 ILE HA 1 116 ILE HG13 . . 4.140 2.710 2.598 2.781 . 0 0 "[ . 1 . 2]" 1
2425 1 116 ILE HA 1 116 ILE MG . . 3.470 2.409 2.361 2.494 . 0 0 "[ . 1 . 2]" 1
2426 1 116 ILE HA 1 118 GLN H . . 4.740 4.084 3.959 4.309 . 0 0 "[ . 1 . 2]" 1
2427 1 116 ILE HA 1 119 ALA H . . 3.740 3.248 3.138 3.318 . 0 0 "[ . 1 . 2]" 1
2428 1 116 ILE HA 1 119 ALA HA . . 5.300 5.043 4.945 5.136 . 0 0 "[ . 1 . 2]" 1
2429 1 116 ILE HA 1 119 ALA MB . . 3.500 2.165 2.067 2.244 . 0 0 "[ . 1 . 2]" 1
2430 1 116 ILE HA 1 120 LEU H . . 4.440 3.624 3.558 3.741 . 0 0 "[ . 1 . 2]" 1
2431 1 116 ILE HB 1 116 ILE MD . . 3.330 2.276 2.255 2.309 . 0 0 "[ . 1 . 2]" 1
2432 1 116 ILE HB 1 117 SER H . . 3.400 2.729 2.678 2.778 . 0 0 "[ . 1 . 2]" 1
2433 1 116 ILE HB 1 117 SER HA . . 5.270 4.524 4.458 4.590 . 0 0 "[ . 1 . 2]" 1
2434 1 116 ILE HB 1 117 SER QB . . 5.000 4.871 4.338 4.999 . 0 0 "[ . 1 . 2]" 1
2435 1 116 ILE MD 1 116 ILE MG . . 2.860 2.151 2.134 2.174 . 0 0 "[ . 1 . 2]" 1
2436 1 116 ILE MD 1 117 SER H . . 4.480 4.513 4.498 4.529 0.049 3 0 "[ . 1 . 2]" 1
2437 1 116 ILE HG12 1 117 SER H . . 5.320 5.197 5.135 5.236 . 0 0 "[ . 1 . 2]" 1
2438 1 116 ILE HG13 1 117 SER H . . 4.500 4.509 4.473 4.533 0.033 8 0 "[ . 1 . 2]" 1
2439 1 116 ILE HG13 1 119 ALA H . . 5.770 5.653 5.530 5.737 . 0 0 "[ . 1 . 2]" 1
2440 1 116 ILE MG 1 117 SER H . . 3.610 3.367 3.244 3.489 . 0 0 "[ . 1 . 2]" 1
2441 1 116 ILE MG 1 117 SER HA . . 4.020 3.459 3.359 3.559 . 0 0 "[ . 1 . 2]" 1
2442 1 116 ILE MG 1 119 ALA H . . 4.790 4.626 4.522 4.692 . 0 0 "[ . 1 . 2]" 1
2443 1 116 ILE MG 1 119 ALA MB . . 3.520 3.405 3.281 3.535 0.015 17 0 "[ . 1 . 2]" 1
2444 1 116 ILE MG 1 120 LEU H . . 3.620 3.620 3.592 3.645 0.025 12 0 "[ . 1 . 2]" 1
2445 1 116 ILE MG 1 120 LEU HA . . 4.460 4.484 4.451 4.520 0.060 18 0 "[ . 1 . 2]" 1
2446 1 117 SER H 1 117 SER QB . . 3.010 2.487 2.248 2.602 . 0 0 "[ . 1 . 2]" 1
2447 1 117 SER H 1 118 GLN H . . 3.210 2.858 2.759 2.899 . 0 0 "[ . 1 . 2]" 1
2448 1 117 SER H 1 118 GLN HB2 . . 5.290 5.309 5.280 5.326 0.036 2 0 "[ . 1 . 2]" 1
2449 1 117 SER H 1 118 GLN HG2 . . 5.170 5.128 4.857 5.200 0.030 14 0 "[ . 1 . 2]" 1
2450 1 117 SER H 1 118 GLN HG3 . . 4.800 4.533 4.031 4.825 0.025 5 0 "[ . 1 . 2]" 1
2451 1 117 SER H 1 119 ALA H . . 4.540 4.308 4.212 4.426 . 0 0 "[ . 1 . 2]" 1
2452 1 117 SER HA 1 120 LEU H . . 4.300 3.922 3.570 4.194 . 0 0 "[ . 1 . 2]" 1
2453 1 117 SER HA 1 120 LEU HB2 . . 4.240 3.028 2.575 3.284 . 0 0 "[ . 1 . 2]" 1
2454 1 117 SER HA 1 120 LEU HB3 . . 5.420 4.461 4.033 4.709 . 0 0 "[ . 1 . 2]" 1
2455 1 117 SER HA 1 120 LEU MD1 . . 4.470 3.039 2.738 3.341 . 0 0 "[ . 1 . 2]" 1
2456 1 117 SER QB 1 118 GLN H . . 3.040 2.879 2.671 3.039 . 0 0 "[ . 1 . 2]" 1
2457 1 117 SER QB 1 118 GLN HG2 . . 4.040 3.534 2.903 4.039 . 0 0 "[ . 1 . 2]" 1
2458 1 117 SER QB 1 120 LEU HB2 . . 4.940 4.847 4.499 4.966 0.026 15 0 "[ . 1 . 2]" 1
2459 1 118 GLN H 1 118 GLN HA . . 2.940 2.950 2.925 2.960 0.020 13 0 "[ . 1 . 2]" 1
2460 1 118 GLN H 1 118 GLN HB2 . . 3.050 2.644 2.576 2.739 . 0 0 "[ . 1 . 2]" 1
2461 1 118 GLN H 1 118 GLN HB3 . . 3.650 3.646 3.609 3.666 0.016 20 0 "[ . 1 . 2]" 1
2462 1 118 GLN H 1 118 GLN HG2 . . 3.230 2.829 2.661 2.956 . 0 0 "[ . 1 . 2]" 1
2463 1 118 GLN H 1 118 GLN HG3 . . 3.240 2.415 2.009 2.684 . 0 0 "[ . 1 . 2]" 1
2464 1 118 GLN H 1 119 ALA H . . 3.000 2.352 2.290 2.491 . 0 0 "[ . 1 . 2]" 1
2465 1 118 GLN H 1 119 ALA MB . . 4.130 3.982 3.917 4.131 0.001 18 0 "[ . 1 . 2]" 1
2466 1 118 GLN H 1 120 LEU H . . 3.970 3.890 3.783 3.975 0.005 7 0 "[ . 1 . 2]" 1
2467 1 118 GLN HA 1 118 GLN HB2 . . 3.020 3.024 3.002 3.036 0.016 12 0 "[ . 1 . 2]" 1
2468 1 118 GLN HA 1 118 GLN HG2 . . 3.460 2.633 2.481 2.757 . 0 0 "[ . 1 . 2]" 1
2469 1 118 GLN HA 1 118 GLN HG3 . . 3.750 3.620 3.492 3.752 0.002 17 0 "[ . 1 . 2]" 1
2470 1 118 GLN HA 1 120 LEU H . . 4.640 4.346 4.220 4.450 . 0 0 "[ . 1 . 2]" 1
2471 1 118 GLN HA 1 121 ALA H . . 3.710 3.580 3.289 3.711 0.001 2 0 "[ . 1 . 2]" 1
2472 1 118 GLN HA 1 121 ALA MB . . 3.080 2.996 2.491 3.117 0.037 12 0 "[ . 1 . 2]" 1
2473 1 118 GLN HB2 1 119 ALA H . . 3.280 2.393 2.265 2.541 . 0 0 "[ . 1 . 2]" 1
2474 1 118 GLN HB2 1 120 LEU H . . 5.050 4.904 4.840 4.988 . 0 0 "[ . 1 . 2]" 1
2475 1 118 GLN HB2 1 121 ALA H . . 5.360 5.391 5.333 5.417 0.057 13 0 "[ . 1 . 2]" 1
2476 1 118 GLN HB3 1 118 GLN HG2 . . 2.970 2.691 2.575 2.837 . 0 0 "[ . 1 . 2]" 1
2477 1 118 GLN HB3 1 119 ALA H . . 3.700 3.679 3.613 3.734 0.034 1 0 "[ . 1 . 2]" 1
2478 1 118 GLN HB3 1 120 LEU H . . 5.630 5.609 5.495 5.658 0.028 2 0 "[ . 1 . 2]" 1
2479 1 118 GLN HG2 1 119 ALA H . . 4.400 4.467 4.418 4.501 0.101 10 0 "[ . 1 . 2]" 1
2480 1 118 GLN HG3 1 119 ALA H . . 4.020 3.852 3.575 4.042 0.022 5 0 "[ . 1 . 2]" 1
2481 1 118 GLN HG3 1 119 ALA MB . . 5.460 5.129 4.913 5.337 . 0 0 "[ . 1 . 2]" 1
2482 1 119 ALA H 1 119 ALA MB . . 2.630 2.190 2.167 2.222 . 0 0 "[ . 1 . 2]" 1
2483 1 119 ALA H 1 120 LEU H . . 3.050 2.792 2.737 2.852 . 0 0 "[ . 1 . 2]" 1
2484 1 119 ALA H 1 120 LEU HB2 . . 4.790 4.617 4.545 4.705 . 0 0 "[ . 1 . 2]" 1
2485 1 119 ALA H 1 121 ALA H . . 4.230 4.241 4.196 4.261 0.031 5 0 "[ . 1 . 2]" 1
2486 1 119 ALA HA 1 120 LEU H . . 3.530 3.544 3.524 3.553 0.023 19 0 "[ . 1 . 2]" 1
2487 1 119 ALA HA 1 122 SER H . . 3.720 3.404 3.273 3.619 . 0 0 "[ . 1 . 2]" 1
2488 1 119 ALA HA 1 122 SER QB . . 3.470 2.857 2.329 3.471 0.001 6 0 "[ . 1 . 2]" 1
2489 1 119 ALA MB 1 120 LEU H . . 2.820 2.715 2.641 2.779 . 0 0 "[ . 1 . 2]" 1
2490 1 119 ALA MB 1 120 LEU HA . . 4.040 4.035 3.991 4.062 0.022 12 0 "[ . 1 . 2]" 1
2491 1 119 ALA MB 1 120 LEU HB2 . . 4.440 4.453 4.447 4.460 0.020 14 0 "[ . 1 . 2]" 1
2492 1 119 ALA MB 1 122 SER H . . 4.460 4.433 4.336 4.486 0.026 6 0 "[ . 1 . 2]" 1
2493 1 119 ALA MB 1 122 SER QB . . 4.260 3.895 3.658 4.119 . 0 0 "[ . 1 . 2]" 1
2494 1 120 LEU H 1 120 LEU HB2 . . 3.180 2.143 2.095 2.197 . 0 0 "[ . 1 . 2]" 1
2495 1 120 LEU H 1 120 LEU HB3 . . 3.550 3.464 3.430 3.501 . 0 0 "[ . 1 . 2]" 1
2496 1 120 LEU H 1 120 LEU MD2 . . 4.080 3.955 3.887 4.058 . 0 0 "[ . 1 . 2]" 1
2497 1 120 LEU H 1 121 ALA H . . 3.000 2.690 2.624 2.743 . 0 0 "[ . 1 . 2]" 1
2498 1 120 LEU H 1 121 ALA HA . . 5.530 5.364 5.312 5.396 . 0 0 "[ . 1 . 2]" 1
2499 1 120 LEU H 1 121 ALA MB . . 4.300 4.316 4.232 4.335 0.035 3 0 "[ . 1 . 2]" 1
2500 1 120 LEU H 1 122 SER H . . 4.320 4.054 3.774 4.260 . 0 0 "[ . 1 . 2]" 1
2501 1 120 LEU HA 1 120 LEU MD1 . . 3.780 3.783 3.771 3.793 0.013 6 0 "[ . 1 . 2]" 1
2502 1 120 LEU HA 1 120 LEU MD2 . . 2.810 1.972 1.950 1.998 . 0 0 "[ . 1 . 2]" 1
2503 1 120 LEU HA 1 121 ALA H . . 3.500 3.499 3.396 3.541 0.041 19 0 "[ . 1 . 2]" 1
2504 1 120 LEU HA 1 123 LYS HB2 . . 4.020 3.269 2.609 3.533 . 0 0 "[ . 1 . 2]" 1
2505 1 120 LEU HB2 1 120 LEU MD2 . . 3.600 3.232 3.214 3.257 . 0 0 "[ . 1 . 2]" 1
2506 1 120 LEU HB2 1 121 ALA H . . 3.400 3.041 2.724 3.316 . 0 0 "[ . 1 . 2]" 1
2507 1 120 LEU HB3 1 120 LEU MD2 . . 2.770 2.311 2.263 2.379 . 0 0 "[ . 1 . 2]" 1
2508 1 120 LEU HB3 1 121 ALA H . . 4.750 3.390 3.022 3.637 . 0 0 "[ . 1 . 2]" 1
2509 1 120 LEU HB3 1 121 ALA HA . . 4.850 4.211 4.050 4.461 . 0 0 "[ . 1 . 2]" 1
2510 1 120 LEU MD2 1 121 ALA H . . 4.610 4.635 4.527 4.683 0.073 6 0 "[ . 1 . 2]" 1
2511 1 120 LEU MD2 1 122 SER H . . 5.120 5.127 4.927 5.191 0.071 20 0 "[ . 1 . 2]" 1
2512 1 120 LEU MD2 1 123 LYS H . . 4.440 4.352 4.076 4.466 0.026 19 0 "[ . 1 . 2]" 1
2513 1 120 LEU MD2 1 123 LYS HB2 . . 3.830 3.560 2.593 3.853 0.023 18 0 "[ . 1 . 2]" 1
2514 1 120 LEU MD2 1 123 LYS HB3 . . 2.950 2.794 2.434 2.971 0.021 2 0 "[ . 1 . 2]" 1
2515 1 121 ALA H 1 121 ALA MB . . 2.470 2.187 2.110 2.229 . 0 0 "[ . 1 . 2]" 1
2516 1 121 ALA MB 1 122 SER H . . 3.120 2.915 2.760 3.045 . 0 0 "[ . 1 . 2]" 1
2517 1 121 ALA MB 1 122 SER HA . . 3.950 3.980 3.952 4.025 0.075 19 0 "[ . 1 . 2]" 1
2518 1 121 ALA MB 1 122 SER QB . . 4.170 4.083 3.624 4.207 0.037 13 0 "[ . 1 . 2]" 1
2519 1 122 SER H 1 122 SER QB . . 2.610 2.401 2.193 2.500 . 0 0 "[ . 1 . 2]" 1
2520 1 122 SER H 1 123 LYS HB2 . . 4.710 4.596 4.333 4.727 0.017 16 0 "[ . 1 . 2]" 1
2521 1 122 SER H 1 123 LYS HB3 . . 4.290 4.125 3.898 4.328 0.038 2 0 "[ . 1 . 2]" 1
2522 1 122 SER H 1 124 GLU H . . 5.060 4.267 3.887 5.040 . 0 0 "[ . 1 . 2]" 1
2523 1 122 SER HA 1 122 SER QB . . 2.600 2.400 2.322 2.531 . 0 0 "[ . 1 . 2]" 1
2524 1 122 SER HA 1 123 LYS H . . 3.430 3.456 3.294 3.509 0.079 19 0 "[ . 1 . 2]" 1
2525 1 122 SER QB 1 123 LYS H . . 3.310 2.874 2.513 3.335 0.025 6 0 "[ . 1 . 2]" 1
2526 1 123 LYS H 1 123 LYS HB2 . . 2.800 2.670 2.523 2.802 0.002 14 0 "[ . 1 . 2]" 1
2527 1 123 LYS H 1 123 LYS HB3 . . 2.910 2.322 2.193 2.505 . 0 0 "[ . 1 . 2]" 1
2528 1 123 LYS H 1 123 LYS QD . . 4.490 4.409 4.270 4.509 0.019 18 0 "[ . 1 . 2]" 1
2529 1 123 LYS H 1 124 GLU H . . 3.040 2.865 2.451 3.063 0.023 4 0 "[ . 1 . 2]" 1
2530 1 123 LYS H 1 125 ASN H . . 4.360 3.937 3.432 4.317 . 0 0 "[ . 1 . 2]" 1
2531 1 123 LYS HA 1 123 LYS QD . . 4.120 3.119 2.235 4.128 0.008 7 0 "[ . 1 . 2]" 1
2532 1 123 LYS HA 1 123 LYS HG2 . . 3.960 3.587 2.796 3.958 . 0 0 "[ . 1 . 2]" 1
2533 1 123 LYS HA 1 123 LYS QG . . 3.370 2.884 2.349 3.252 . 0 0 "[ . 1 . 2]" 1
2534 1 123 LYS HA 1 123 LYS HG3 . . 3.960 3.052 2.427 3.460 . 0 0 "[ . 1 . 2]" 1
2535 1 123 LYS HB2 1 124 GLU H . . 3.840 3.809 3.629 3.859 0.019 2 0 "[ . 1 . 2]" 1
2536 1 123 LYS HB3 1 124 GLU H . . 2.770 2.383 2.113 2.483 . 0 0 "[ . 1 . 2]" 1
2537 1 123 LYS QD 1 124 GLU H . . 4.240 4.139 3.442 4.298 0.058 1 0 "[ . 1 . 2]" 1
2538 1 123 LYS QE 1 124 GLU H . . 5.270 5.100 4.827 5.307 0.037 10 0 "[ . 1 . 2]" 1
2539 1 123 LYS QG 1 124 GLU H . . 3.440 2.939 2.722 3.416 . 0 0 "[ . 1 . 2]" 1
2540 1 123 LYS QG 1 125 ASN H . . 4.630 4.676 4.634 4.714 0.084 1 0 "[ . 1 . 2]" 1
2541 1 124 GLU H 1 124 GLU HB2 . . 3.740 2.707 2.353 3.754 0.014 20 0 "[ . 1 . 2]" 1
2542 1 124 GLU H 1 124 GLU QB . . 2.920 2.488 2.323 2.925 0.005 14 0 "[ . 1 . 2]" 1
2543 1 124 GLU H 1 124 GLU HB3 . . 3.740 3.466 2.578 3.778 0.038 2 0 "[ . 1 . 2]" 1
2544 1 124 GLU H 1 124 GLU QG . . 3.130 2.367 1.980 3.151 0.021 2 0 "[ . 1 . 2]" 1
2545 1 124 GLU H 1 125 ASN H . . 3.070 2.577 1.839 2.871 . 0 0 "[ . 1 . 2]" 1
2546 1 124 GLU HA 1 125 ASN H . . 3.540 3.351 3.150 3.525 . 0 0 "[ . 1 . 2]" 1
2547 1 124 GLU HA 1 126 SER H . . 4.360 4.000 3.371 4.428 0.068 3 0 "[ . 1 . 2]" 1
2548 1 124 GLU QB 1 125 ASN H . . 3.400 3.284 2.621 3.456 0.056 14 0 "[ . 1 . 2]" 1
2549 1 124 GLU QB 1 126 SER H . . 5.070 4.163 2.693 5.083 0.013 4 0 "[ . 1 . 2]" 1
2550 1 124 GLU HB2 1 126 SER H . . 5.810 4.619 2.901 5.820 0.010 10 0 "[ . 1 . 2]" 1
2551 1 124 GLU HB3 1 126 SER H . . 5.810 4.788 3.021 5.825 0.015 4 0 "[ . 1 . 2]" 1
2552 1 124 GLU QG 1 125 ASN H . . 4.630 3.986 2.242 4.589 . 0 0 "[ . 1 . 2]" 1
2553 1 125 ASN H 1 125 ASN QB . . 2.950 2.463 2.099 2.956 0.006 6 0 "[ . 1 . 2]" 1
2554 1 125 ASN H 1 125 ASN HD21 . . 4.580 4.384 4.020 4.682 0.102 3 0 "[ . 1 . 2]" 1
2555 1 125 ASN H 1 125 ASN HD22 . . 5.670 5.563 4.342 5.730 0.060 11 0 "[ . 1 . 2]" 1
2556 1 125 ASN H 1 126 SER H . . 3.780 2.778 2.231 3.415 . 0 0 "[ . 1 . 2]" 1
2557 1 125 ASN HA 1 125 ASN HD21 . . 2.770 2.476 2.111 2.724 . 0 0 "[ . 1 . 2]" 1
2558 1 125 ASN QB 1 125 ASN HD21 . . 2.920 2.472 2.351 2.686 . 0 0 "[ . 1 . 2]" 1
2559 1 125 ASN QB 1 125 ASN HD22 . . 3.500 3.388 3.342 3.446 . 0 0 "[ . 1 . 2]" 1
2560 1 125 ASN QB 1 126 SER H . . 3.840 3.412 2.601 3.857 0.017 3 0 "[ . 1 . 2]" 1
2561 1 125 ASN HB2 1 126 SER H . . 4.510 4.251 3.228 4.530 0.020 2 0 "[ . 1 . 2]" 1
2562 1 125 ASN HB3 1 126 SER H . . 4.510 3.669 2.639 4.386 . 0 0 "[ . 1 . 2]" 1
2563 1 126 SER H 1 126 SER QB . . 3.220 2.713 2.107 3.237 0.017 18 0 "[ . 1 . 2]" 1
2564 1 126 SER H 1 127 TYR H . . 4.070 3.452 2.078 4.182 0.112 17 0 "[ . 1 . 2]" 1
2565 1 126 SER HA 1 126 SER QB . . 2.620 2.341 2.133 2.512 . 0 0 "[ . 1 . 2]" 1
2566 1 126 SER HA 1 127 TYR H . . 3.000 2.555 2.020 3.066 0.066 9 0 "[ . 1 . 2]" 1
2567 1 126 SER QB 1 127 TYR H . . 4.120 3.654 2.679 4.072 . 0 0 "[ . 1 . 2]" 1
2568 1 127 TYR H 1 127 TYR HB2 . . 3.810 2.957 2.253 3.708 . 0 0 "[ . 1 . 2]" 1
2569 1 127 TYR H 1 127 TYR QB . . 2.930 2.465 2.116 2.858 . 0 0 "[ . 1 . 2]" 1
2570 1 127 TYR H 1 127 TYR HB3 . . 3.810 2.836 2.268 3.783 . 0 0 "[ . 1 . 2]" 1
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