Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
443024 | 2kdx RC | 16126 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kdx
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 1969
_Distance_constraint_stats_list.Viol_count 3954
_Distance_constraint_stats_list.Viol_total 4656.516
_Distance_constraint_stats_list.Viol_max 1.251
_Distance_constraint_stats_list.Viol_rms 0.0320
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0059
_Distance_constraint_stats_list.Viol_average_violations_only 0.0589
_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 3 MET 0.162 0.029 17 0 "[ . 1 . 2]"
1 4 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 GLU 2.019 0.603 11 1 "[ . 1+ . 2]"
1 6 TYR 3.038 0.330 12 0 "[ . 1 . 2]"
1 7 SER 0.213 0.055 17 0 "[ . 1 . 2]"
1 8 VAL 8.287 0.603 11 2 "[ . 1+ . - 2]"
1 9 VAL 12.819 0.369 18 0 "[ . 1 . 2]"
1 10 SER 0.926 0.083 3 0 "[ . 1 . 2]"
1 11 SER 2.204 0.150 2 0 "[ . 1 . 2]"
1 12 LEU 3.220 0.154 20 0 "[ . 1 . 2]"
1 13 ILE 5.862 0.195 18 0 "[ . 1 . 2]"
1 14 ALA 2.372 0.340 11 0 "[ . 1 . 2]"
1 15 LEU 6.285 0.662 5 2 "[ + 1- . 2]"
1 16 CYS 0.591 0.095 12 0 "[ . 1 . 2]"
1 17 GLU 0.542 0.065 4 0 "[ . 1 . 2]"
1 18 GLU 5.829 0.662 5 2 "[ + 1- . 2]"
1 19 HIS 3.168 0.610 11 1 "[ . 1+ . 2]"
1 20 ALA 3.220 0.111 18 0 "[ . 1 . 2]"
1 21 LYS 3.452 0.179 18 0 "[ . 1 . 2]"
1 22 LYS 3.417 0.099 4 0 "[ . 1 . 2]"
1 23 ASN 4.764 0.179 18 0 "[ . 1 . 2]"
1 24 GLN 1.996 0.079 6 0 "[ . 1 . 2]"
1 25 ALA 4.006 0.111 18 0 "[ . 1 . 2]"
1 26 HIS 0.085 0.045 8 0 "[ . 1 . 2]"
1 27 LYS 1.312 0.104 16 0 "[ . 1 . 2]"
1 28 ILE 0.865 0.055 3 0 "[ . 1 . 2]"
1 29 GLU 1.268 0.089 10 0 "[ . 1 . 2]"
1 30 ARG 0.876 0.092 15 0 "[ . 1 . 2]"
1 31 VAL 2.990 0.247 16 0 "[ . 1 . 2]"
1 32 VAL 1.042 0.250 15 0 "[ . 1 . 2]"
1 33 VAL 1.988 0.527 13 1 "[ . 1 + . 2]"
1 34 GLY 1.379 0.166 5 0 "[ . 1 . 2]"
1 35 ILE 2.387 0.103 2 0 "[ . 1 . 2]"
1 36 GLY 1.365 0.103 2 0 "[ . 1 . 2]"
1 37 GLU 7.125 0.604 13 2 "[ -. 1 + . 2]"
1 38 ARG 6.486 0.729 4 1 "[ +. 1 . 2]"
1 39 SER 3.180 1.251 13 1 "[ . 1 + . 2]"
1 40 ALA 0.135 0.029 16 0 "[ . 1 . 2]"
1 41 MET 1.542 0.097 19 0 "[ . 1 . 2]"
1 42 ASP 1.031 0.074 18 0 "[ . 1 . 2]"
1 43 LYS 20.747 0.902 18 9 "[ . ***1 *.**+**]"
1 44 SER 4.211 0.309 18 0 "[ . 1 . 2]"
1 45 LEU 10.265 0.337 2 0 "[ . 1 . 2]"
1 46 PHE 17.995 0.563 17 2 "[ . 1 -. + 2]"
1 47 VAL 39.472 0.902 18 9 "[ . ***1 *.**+**]"
1 48 SER 6.232 0.182 8 0 "[ . 1 . 2]"
1 49 ALA 5.328 0.162 7 0 "[ . 1 . 2]"
1 50 PHE 3.372 0.112 12 0 "[ . 1 . 2]"
1 51 GLU 3.519 0.170 11 0 "[ . 1 . 2]"
1 52 THR 3.814 0.170 11 0 "[ . 1 . 2]"
1 53 PHE 2.338 0.119 7 0 "[ . 1 . 2]"
1 54 ARG 1.819 0.203 8 0 "[ . 1 . 2]"
1 55 GLU 4.910 0.218 3 0 "[ . 1 . 2]"
1 56 GLU 1.830 0.218 3 0 "[ . 1 . 2]"
1 57 SER 0.611 0.077 8 0 "[ . 1 . 2]"
1 58 LEU 3.689 0.274 1 0 "[ . 1 . 2]"
1 59 VAL 3.558 0.150 20 0 "[ . 1 . 2]"
1 60 CYS 4.126 0.176 1 0 "[ . 1 . 2]"
1 61 LYS 7.907 0.274 1 0 "[ . 1 . 2]"
1 64 ILE 2.303 0.111 10 0 "[ . 1 . 2]"
1 65 LEU 7.921 0.556 14 1 "[ . 1 +. 2]"
1 66 ASP 2.918 0.255 7 0 "[ . 1 . 2]"
1 67 ILE 3.069 0.470 6 0 "[ . 1 . 2]"
1 68 VAL 2.373 0.411 13 0 "[ . 1 . 2]"
1 69 ASP 1.569 0.271 4 0 "[ . 1 . 2]"
1 70 GLU 1.507 0.128 10 0 "[ . 1 . 2]"
1 71 LYS 2.850 0.145 19 0 "[ . 1 . 2]"
1 72 VAL 8.007 1.251 13 2 "[ -. 1 + . 2]"
1 73 GLU 1.640 0.126 13 0 "[ . 1 . 2]"
1 74 LEU 10.454 0.718 2 6 "[ +* . ***1- . 2]"
1 75 GLU 6.146 0.276 11 0 "[ . 1 . 2]"
1 76 CYS 6.868 0.464 5 0 "[ . 1 . 2]"
1 77 LYS 7.594 0.128 13 0 "[ . 1 . 2]"
1 78 ASP 1.300 0.078 6 0 "[ . 1 . 2]"
1 79 CYS 2.858 0.104 13 0 "[ . 1 . 2]"
1 80 SER 2.886 0.153 1 0 "[ . 1 . 2]"
1 81 HIS 1.381 0.105 6 0 "[ . 1 . 2]"
1 82 VAL 6.052 0.464 5 0 "[ . 1 . 2]"
1 83 PHE 5.473 0.172 16 0 "[ . 1 . 2]"
1 84 LYS 1.124 0.134 17 0 "[ . 1 . 2]"
1 85 PRO 1.729 0.393 3 0 "[ . 1 . 2]"
1 86 ASN 1.068 0.158 16 0 "[ . 1 . 2]"
1 87 ALA 1.785 0.268 12 0 "[ . 1 . 2]"
1 88 LEU 1.485 0.268 12 0 "[ . 1 . 2]"
1 89 ASP 0.502 0.049 15 0 "[ . 1 . 2]"
1 90 TYR 2.406 0.159 13 0 "[ . 1 . 2]"
1 91 GLY 1.130 0.109 16 0 "[ . 1 . 2]"
1 92 VAL 2.440 0.102 9 0 "[ . 1 . 2]"
1 93 CYS 2.237 0.109 13 0 "[ . 1 . 2]"
1 94 GLU 4.329 0.152 6 0 "[ . 1 . 2]"
1 95 LYS 6.692 0.164 6 0 "[ . 1 . 2]"
1 96 CYS 3.359 0.164 6 0 "[ . 1 . 2]"
1 97 HIS 2.986 0.137 17 0 "[ . 1 . 2]"
1 98 SER 2.541 0.215 10 0 "[ . 1 . 2]"
1 99 LYS 1.475 0.109 16 0 "[ . 1 . 2]"
1 100 ASN 2.689 0.128 13 0 "[ . 1 . 2]"
1 101 VAL 2.661 0.215 10 0 "[ . 1 . 2]"
1 102 ILE 5.141 0.114 12 0 "[ . 1 . 2]"
1 103 ILE 4.405 0.222 7 0 "[ . 1 . 2]"
1 104 THR 4.392 0.486 11 0 "[ . 1 . 2]"
1 105 GLN 10.402 0.718 2 6 "[ +* . ***1- . 2]"
1 106 GLY 2.890 0.147 20 0 "[ . 1 . 2]"
1 107 ASN 1.048 0.098 15 0 "[ . 1 . 2]"
1 108 GLU 1.108 0.062 16 0 "[ . 1 . 2]"
1 109 MET 2.384 0.115 10 0 "[ . 1 . 2]"
1 110 ARG 0.625 0.058 19 0 "[ . 1 . 2]"
1 111 LEU 0.653 0.127 17 0 "[ . 1 . 2]"
1 112 LEU 2.031 0.527 13 1 "[ . 1 + . 2]"
1 113 SER 0.423 0.082 7 0 "[ . 1 . 2]"
1 114 LEU 5.063 0.610 11 1 "[ . 1+ . 2]"
1 115 GLU 0.925 0.136 20 0 "[ . 1 . 2]"
1 116 MET 3.137 0.279 11 0 "[ . 1 . 2]"
1 117 LEU 5.222 0.692 11 1 "[ . 1+ . 2]"
1 118 ALA 0.945 0.145 3 0 "[ . 1 . 2]"
1 119 GLU 2.729 0.692 11 1 "[ . 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 3 MET ME 1 6 TYR QD . . 3.810 3.158 2.328 3.839 0.029 17 0 "[ . 1 . 2]" 1
2 1 3 MET ME 1 6 TYR QE . . 3.790 3.291 2.322 3.810 0.020 3 0 "[ . 1 . 2]" 1
3 1 4 HIS QB 1 5 GLU H . . 4.450 2.940 2.180 3.897 . 0 0 "[ . 1 . 2]" 1
4 1 4 HIS HB2 1 5 GLU H . . 5.090 3.817 2.275 4.366 . 0 0 "[ . 1 . 2]" 1
5 1 4 HIS HB3 1 5 GLU H . . 5.090 3.254 2.196 4.428 . 0 0 "[ . 1 . 2]" 1
6 1 5 GLU H 1 6 TYR H . . 4.290 2.807 2.098 3.225 . 0 0 "[ . 1 . 2]" 1
7 1 5 GLU H 1 6 TYR QB . . 5.500 4.903 4.082 5.337 . 0 0 "[ . 1 . 2]" 1
8 1 5 GLU HA 1 7 SER H . . 4.690 3.969 3.648 4.707 0.017 9 0 "[ . 1 . 2]" 1
9 1 5 GLU HA 1 8 VAL QG . . 4.160 3.979 3.218 4.763 0.603 11 1 "[ . 1+ . 2]" 1
10 1 5 GLU QB 1 6 TYR H . . 4.240 3.296 2.294 3.790 . 0 0 "[ . 1 . 2]" 1
11 1 5 GLU QG 1 6 TYR QD . . 4.590 3.459 2.984 4.229 . 0 0 "[ . 1 . 2]" 1
12 1 5 GLU HG2 1 6 TYR QD . . 5.370 4.020 3.364 5.120 . 0 0 "[ . 1 . 2]" 1
13 1 5 GLU HG3 1 6 TYR QD . . 5.370 3.990 3.334 5.383 0.013 15 0 "[ . 1 . 2]" 1
14 1 6 TYR H 1 6 TYR QB . . 3.370 2.467 2.394 2.558 . 0 0 "[ . 1 . 2]" 1
15 1 6 TYR H 1 6 TYR QD . . 3.970 3.287 2.872 3.714 . 0 0 "[ . 1 . 2]" 1
16 1 6 TYR H 1 6 TYR QE . . 5.380 4.847 4.375 5.275 . 0 0 "[ . 1 . 2]" 1
17 1 6 TYR H 1 7 SER H . . 3.970 2.505 2.067 2.809 . 0 0 "[ . 1 . 2]" 1
18 1 6 TYR HA 1 6 TYR QD . . 3.540 2.255 2.137 2.421 . 0 0 "[ . 1 . 2]" 1
19 1 6 TYR HA 1 9 VAL H . . 3.880 3.143 2.952 3.411 . 0 0 "[ . 1 . 2]" 1
20 1 6 TYR HA 1 9 VAL HB . . 4.690 2.473 2.251 2.797 . 0 0 "[ . 1 . 2]" 1
21 1 6 TYR HA 1 9 VAL QG . . 4.310 2.393 2.274 2.567 . 0 0 "[ . 1 . 2]" 1
22 1 6 TYR HA 1 10 SER H . . 4.140 3.783 3.644 3.982 . 0 0 "[ . 1 . 2]" 1
23 1 6 TYR HA 1 49 ALA MB . . 4.280 4.071 3.785 4.307 0.027 20 0 "[ . 1 . 2]" 1
24 1 6 TYR QB 1 7 SER H . . 4.040 3.416 3.150 3.566 . 0 0 "[ . 1 . 2]" 1
25 1 6 TYR QB 1 9 VAL QG . . 4.560 3.439 3.139 3.670 . 0 0 "[ . 1 . 2]" 1
26 1 6 TYR QD 1 7 SER H . . 4.900 4.854 4.755 4.924 0.024 8 0 "[ . 1 . 2]" 1
27 1 6 TYR QD 1 9 VAL H . . 5.500 4.759 4.485 5.122 . 0 0 "[ . 1 . 2]" 1
28 1 6 TYR QD 1 9 VAL MG1 . . 3.560 3.128 2.947 3.355 . 0 0 "[ . 1 . 2]" 1
29 1 6 TYR QD 1 9 VAL QG . . 2.870 2.325 2.137 2.569 . 0 0 "[ . 1 . 2]" 1
30 1 6 TYR QD 1 9 VAL MG2 . . 3.560 2.411 2.172 2.829 . 0 0 "[ . 1 . 2]" 1
31 1 6 TYR QD 1 49 ALA HA . . 5.060 4.789 4.420 5.048 . 0 0 "[ . 1 . 2]" 1
32 1 6 TYR QD 1 49 ALA MB . . 3.420 2.723 2.393 3.143 . 0 0 "[ . 1 . 2]" 1
33 1 6 TYR QE 1 9 VAL MG1 . . 4.330 4.360 4.337 4.394 0.064 9 0 "[ . 1 . 2]" 1
34 1 6 TYR QE 1 9 VAL QG . . 3.510 3.609 3.435 3.840 0.330 12 0 "[ . 1 . 2]" 1
35 1 6 TYR QE 1 9 VAL MG2 . . 4.330 3.860 3.587 4.268 . 0 0 "[ . 1 . 2]" 1
36 1 6 TYR QE 1 49 ALA HA . . 5.130 3.855 3.289 4.293 . 0 0 "[ . 1 . 2]" 1
37 1 6 TYR QE 1 49 ALA MB . . 4.070 2.645 2.117 3.271 . 0 0 "[ . 1 . 2]" 1
38 1 7 SER H 1 7 SER QB . . 3.570 2.319 2.244 2.587 . 0 0 "[ . 1 . 2]" 1
39 1 7 SER H 1 8 VAL H . . 3.950 2.893 2.763 3.032 . 0 0 "[ . 1 . 2]" 1
40 1 7 SER H 1 8 VAL HB . . 5.500 5.345 5.056 5.555 0.055 17 0 "[ . 1 . 2]" 1
41 1 7 SER H 1 8 VAL QG . . 4.450 3.994 3.689 4.356 . 0 0 "[ . 1 . 2]" 1
42 1 7 SER H 1 9 VAL H . . 4.960 4.202 4.080 4.351 . 0 0 "[ . 1 . 2]" 1
43 1 7 SER HA 1 9 VAL H . . 5.410 4.654 4.593 4.743 . 0 0 "[ . 1 . 2]" 1
44 1 7 SER HA 1 10 SER H . . 4.260 4.070 3.865 4.295 0.035 3 0 "[ . 1 . 2]" 1
45 1 7 SER HA 1 10 SER QB . . 3.760 3.242 2.894 3.670 . 0 0 "[ . 1 . 2]" 1
46 1 7 SER QB 1 8 VAL H . . 3.630 2.487 2.251 3.145 . 0 0 "[ . 1 . 2]" 1
47 1 8 VAL H 1 8 VAL HB . . 3.580 2.771 2.407 3.177 . 0 0 "[ . 1 . 2]" 1
48 1 8 VAL H 1 8 VAL MG1 . . 3.900 3.173 2.237 3.867 . 0 0 "[ . 1 . 2]" 1
49 1 8 VAL H 1 8 VAL QG . . 3.020 2.076 1.876 2.324 . 0 0 "[ . 1 . 2]" 1
50 1 8 VAL H 1 8 VAL MG2 . . 3.900 2.691 1.882 3.804 . 0 0 "[ . 1 . 2]" 1
51 1 8 VAL H 1 9 VAL H . . 3.690 2.831 2.557 2.937 . 0 0 "[ . 1 . 2]" 1
52 1 8 VAL H 1 9 VAL QG . . 4.690 3.952 3.557 4.108 . 0 0 "[ . 1 . 2]" 1
53 1 8 VAL HA 1 8 VAL MG1 . . 3.210 2.658 2.144 3.272 0.062 16 0 "[ . 1 . 2]" 1
54 1 8 VAL HA 1 8 VAL QG . . 2.800 2.179 2.088 2.281 . 0 0 "[ . 1 . 2]" 1
55 1 8 VAL HA 1 8 VAL MG2 . . 3.210 2.525 2.256 2.875 . 0 0 "[ . 1 . 2]" 1
56 1 8 VAL HA 1 11 SER H . . 3.980 3.834 3.481 4.001 0.021 11 0 "[ . 1 . 2]" 1
57 1 8 VAL HA 1 11 SER QB . . 3.780 2.626 2.279 2.834 . 0 0 "[ . 1 . 2]" 1
58 1 8 VAL HA 1 12 LEU H . . 4.680 3.988 3.779 4.217 . 0 0 "[ . 1 . 2]" 1
59 1 8 VAL HA 1 109 MET ME . . 5.230 5.040 4.723 5.260 0.030 13 0 "[ . 1 . 2]" 1
60 1 8 VAL HB 1 9 VAL H . . 4.160 3.008 2.307 3.935 . 0 0 "[ . 1 . 2]" 1
61 1 8 VAL HB 1 46 PHE QD . . 5.130 4.382 3.561 5.250 0.120 1 0 "[ . 1 . 2]" 1
62 1 8 VAL HB 1 46 PHE QE . . 5.500 3.369 2.187 4.943 . 0 0 "[ . 1 . 2]" 1
63 1 8 VAL QG 1 9 VAL H . . 3.350 2.727 2.102 3.176 . 0 0 "[ . 1 . 2]" 1
64 1 8 VAL QG 1 9 VAL HA . . 3.790 3.530 3.119 4.159 0.369 18 0 "[ . 1 . 2]" 1
65 1 8 VAL QG 1 11 SER QB . . 4.170 3.623 3.241 3.874 . 0 0 "[ . 1 . 2]" 1
66 1 8 VAL QG 1 46 PHE QD . . 3.710 3.189 2.242 4.273 0.563 17 1 "[ . 1 . + 2]" 1
67 1 8 VAL QG 1 46 PHE QE . . 3.050 2.328 1.921 3.165 0.115 18 0 "[ . 1 . 2]" 1
68 1 8 VAL QG 1 109 MET ME . . 2.400 2.039 1.927 2.187 . 0 0 "[ . 1 . 2]" 1
69 1 8 VAL QG 1 109 MET QG . . 5.110 3.286 2.442 4.195 . 0 0 "[ . 1 . 2]" 1
70 1 8 VAL MG1 1 9 VAL H . . 3.890 3.092 2.116 3.936 0.046 18 0 "[ . 1 . 2]" 1
71 1 8 VAL MG1 1 9 VAL HA . . 4.920 3.681 3.338 4.440 . 0 0 "[ . 1 . 2]" 1
72 1 8 VAL MG1 1 46 PHE QE . . 4.050 2.464 2.152 3.456 . 0 0 "[ . 1 . 2]" 1
73 1 8 VAL MG1 1 109 MET ME . . 3.190 2.492 1.942 3.212 0.022 9 0 "[ . 1 . 2]" 1
74 1 8 VAL MG2 1 9 VAL H . . 3.890 3.496 3.107 3.750 . 0 0 "[ . 1 . 2]" 1
75 1 8 VAL MG2 1 9 VAL HA . . 4.920 4.634 3.742 5.101 0.181 20 0 "[ . 1 . 2]" 1
76 1 8 VAL MG2 1 46 PHE QE . . 4.050 3.196 2.161 4.063 0.013 5 0 "[ . 1 . 2]" 1
77 1 8 VAL MG2 1 109 MET ME . . 3.190 2.770 1.949 3.243 0.053 3 0 "[ . 1 . 2]" 1
78 1 9 VAL H 1 9 VAL HB . . 3.500 2.514 2.348 2.655 . 0 0 "[ . 1 . 2]" 1
79 1 9 VAL H 1 9 VAL MG1 . . 3.840 3.725 3.678 3.767 . 0 0 "[ . 1 . 2]" 1
80 1 9 VAL H 1 9 VAL QG . . 3.040 1.934 1.852 2.059 . 0 0 "[ . 1 . 2]" 1
81 1 9 VAL H 1 9 VAL MG2 . . 3.840 1.940 1.856 2.070 . 0 0 "[ . 1 . 2]" 1
82 1 9 VAL H 1 11 SER H . . 5.300 4.139 4.079 4.292 . 0 0 "[ . 1 . 2]" 1
83 1 9 VAL H 1 46 PHE QD . . 5.500 4.629 3.933 5.118 . 0 0 "[ . 1 . 2]" 1
84 1 9 VAL H 1 46 PHE QE . . 5.500 3.780 3.057 4.339 . 0 0 "[ . 1 . 2]" 1
85 1 9 VAL H 1 49 ALA MB . . 4.780 4.867 4.833 4.926 0.146 14 0 "[ . 1 . 2]" 1
86 1 9 VAL HA 1 9 VAL MG1 . . 3.750 2.422 2.344 2.513 . 0 0 "[ . 1 . 2]" 1
87 1 9 VAL HA 1 9 VAL MG2 . . 3.750 2.441 2.380 2.500 . 0 0 "[ . 1 . 2]" 1
88 1 9 VAL HA 1 12 LEU H . . 4.390 3.804 3.549 3.995 . 0 0 "[ . 1 . 2]" 1
89 1 9 VAL HA 1 12 LEU QB . . 4.140 3.030 2.732 3.348 . 0 0 "[ . 1 . 2]" 1
90 1 9 VAL HA 1 12 LEU QD . . 5.180 3.672 2.958 4.744 . 0 0 "[ . 1 . 2]" 1
91 1 9 VAL HA 1 46 PHE QE . . 4.300 3.127 2.519 3.653 . 0 0 "[ . 1 . 2]" 1
92 1 9 VAL HB 1 10 SER H . . 4.020 2.153 2.094 2.222 . 0 0 "[ . 1 . 2]" 1
93 1 9 VAL HB 1 11 SER H . . 4.590 4.698 4.654 4.740 0.150 2 0 "[ . 1 . 2]" 1
94 1 9 VAL HB 1 49 ALA MB . . 4.310 3.834 3.530 4.167 . 0 0 "[ . 1 . 2]" 1
95 1 9 VAL QG 1 10 SER H . . 3.440 2.919 2.647 3.066 . 0 0 "[ . 1 . 2]" 1
96 1 9 VAL QG 1 10 SER QB . . 4.810 3.819 3.547 4.377 . 0 0 "[ . 1 . 2]" 1
97 1 9 VAL QG 1 11 SER H . . 4.900 4.570 4.507 4.649 . 0 0 "[ . 1 . 2]" 1
98 1 9 VAL QG 1 12 LEU H . . 4.660 4.655 4.458 4.814 0.154 20 0 "[ . 1 . 2]" 1
99 1 9 VAL QG 1 13 ILE H . . 4.230 4.327 4.155 4.425 0.195 18 0 "[ . 1 . 2]" 1
100 1 9 VAL QG 1 46 PHE HA . . 4.230 3.460 2.732 3.991 . 0 0 "[ . 1 . 2]" 1
101 1 9 VAL QG 1 49 ALA MB . . 3.110 1.877 1.816 1.952 . 0 0 "[ . 1 . 2]" 1
102 1 9 VAL QG 1 50 PHE H . . 3.700 2.871 2.638 3.148 . 0 0 "[ . 1 . 2]" 1
103 1 9 VAL QG 1 50 PHE HA . . 3.330 2.162 1.972 2.414 . 0 0 "[ . 1 . 2]" 1
104 1 9 VAL QG 1 50 PHE QB . . 3.950 2.859 2.536 3.219 . 0 0 "[ . 1 . 2]" 1
105 1 9 VAL QG 1 51 GLU H . . 4.730 4.596 4.452 4.715 . 0 0 "[ . 1 . 2]" 1
106 1 9 VAL QG 1 52 THR H . . 4.820 4.721 4.515 4.975 0.155 13 0 "[ . 1 . 2]" 1
107 1 9 VAL QG 1 53 PHE H . . 4.280 3.611 3.303 3.908 . 0 0 "[ . 1 . 2]" 1
108 1 9 VAL QG 1 53 PHE QB . . 4.450 2.406 2.048 2.932 . 0 0 "[ . 1 . 2]" 1
109 1 9 VAL QG 1 53 PHE QD . . 3.290 2.232 1.997 2.651 . 0 0 "[ . 1 . 2]" 1
110 1 9 VAL MG1 1 10 SER H . . 3.970 3.064 2.707 3.287 . 0 0 "[ . 1 . 2]" 1
111 1 9 VAL MG1 1 50 PHE H . . 4.510 3.153 2.777 3.810 . 0 0 "[ . 1 . 2]" 1
112 1 9 VAL MG1 1 53 PHE QD . . 4.030 2.247 2.003 2.684 . 0 0 "[ . 1 . 2]" 1
113 1 9 VAL MG2 1 10 SER H . . 3.970 3.705 3.614 3.786 . 0 0 "[ . 1 . 2]" 1
114 1 9 VAL MG2 1 50 PHE H . . 4.510 3.460 2.924 3.859 . 0 0 "[ . 1 . 2]" 1
115 1 9 VAL MG2 1 53 PHE QD . . 4.030 3.962 3.751 4.149 0.119 7 0 "[ . 1 . 2]" 1
116 1 10 SER H 1 10 SER QB . . 3.660 2.223 2.197 2.526 . 0 0 "[ . 1 . 2]" 1
117 1 10 SER H 1 11 SER H . . 3.460 2.805 2.747 2.932 . 0 0 "[ . 1 . 2]" 1
118 1 10 SER H 1 13 ILE MD . . 5.500 4.526 3.991 5.519 0.019 14 0 "[ . 1 . 2]" 1
119 1 10 SER H 1 53 PHE QB . . 5.340 4.962 4.581 5.357 0.017 12 0 "[ . 1 . 2]" 1
120 1 10 SER H 1 53 PHE QD . . 4.780 4.755 4.049 4.863 0.083 3 0 "[ . 1 . 2]" 1
121 1 10 SER H 1 53 PHE QE . . 5.500 5.373 4.600 5.525 0.025 12 0 "[ . 1 . 2]" 1
122 1 10 SER QB 1 11 SER H . . 3.310 2.575 2.493 2.721 . 0 0 "[ . 1 . 2]" 1
123 1 11 SER H 1 11 SER QB . . 3.240 2.326 2.269 2.533 . 0 0 "[ . 1 . 2]" 1
124 1 11 SER H 1 12 LEU H . . 3.640 2.843 2.709 2.981 . 0 0 "[ . 1 . 2]" 1
125 1 11 SER H 1 13 ILE H . . 4.850 4.407 4.189 4.520 . 0 0 "[ . 1 . 2]" 1
126 1 11 SER H 1 14 ALA MB . . 4.840 4.715 4.532 4.853 0.013 14 0 "[ . 1 . 2]" 1
127 1 11 SER HA 1 14 ALA H . . 3.980 3.677 3.455 3.897 . 0 0 "[ . 1 . 2]" 1
128 1 11 SER HA 1 14 ALA MB . . 3.620 2.691 2.374 2.919 . 0 0 "[ . 1 . 2]" 1
129 1 11 SER QB 1 12 LEU H . . 4.060 2.536 2.369 2.725 . 0 0 "[ . 1 . 2]" 1
130 1 12 LEU H 1 12 LEU QB . . 3.750 2.179 2.065 2.296 . 0 0 "[ . 1 . 2]" 1
131 1 12 LEU H 1 12 LEU MD1 . . 4.370 3.815 2.540 4.337 . 0 0 "[ . 1 . 2]" 1
132 1 12 LEU H 1 12 LEU QD . . 3.840 3.285 2.515 3.729 . 0 0 "[ . 1 . 2]" 1
133 1 12 LEU H 1 12 LEU MD2 . . 4.370 3.795 2.689 4.231 . 0 0 "[ . 1 . 2]" 1
134 1 12 LEU H 1 13 ILE H . . 3.890 2.849 2.775 2.934 . 0 0 "[ . 1 . 2]" 1
135 1 12 LEU H 1 13 ILE HA . . 5.500 5.488 5.445 5.521 0.021 14 0 "[ . 1 . 2]" 1
136 1 12 LEU H 1 13 ILE MD . . 5.190 5.081 4.765 5.216 0.026 9 0 "[ . 1 . 2]" 1
137 1 12 LEU H 1 14 ALA H . . 4.370 4.371 4.218 4.414 0.044 17 0 "[ . 1 . 2]" 1
138 1 12 LEU H 1 46 PHE QE . . 5.500 5.357 4.709 5.585 0.085 7 0 "[ . 1 . 2]" 1
139 1 12 LEU HA 1 12 LEU MD1 . . 3.810 3.072 2.092 3.833 0.023 5 0 "[ . 1 . 2]" 1
140 1 12 LEU HA 1 12 LEU QD . . 3.250 2.196 1.922 3.171 . 0 0 "[ . 1 . 2]" 1
141 1 12 LEU HA 1 12 LEU MD2 . . 3.810 2.576 2.044 3.831 0.021 18 0 "[ . 1 . 2]" 1
142 1 12 LEU QB 1 13 ILE H . . 3.370 2.467 2.201 2.756 . 0 0 "[ . 1 . 2]" 1
143 1 12 LEU QD 1 13 ILE H . . 3.950 3.734 2.855 4.075 0.125 1 0 "[ . 1 . 2]" 1
144 1 12 LEU MD1 1 13 ILE H . . 4.540 4.209 3.037 4.557 0.017 11 0 "[ . 1 . 2]" 1
145 1 12 LEU MD2 1 13 ILE H . . 4.540 4.391 2.886 4.641 0.101 13 0 "[ . 1 . 2]" 1
146 1 13 ILE H 1 13 ILE HB . . 3.660 2.559 2.327 2.880 . 0 0 "[ . 1 . 2]" 1
147 1 13 ILE H 1 13 ILE MD . . 3.900 3.205 2.598 3.455 . 0 0 "[ . 1 . 2]" 1
148 1 13 ILE H 1 13 ILE HG12 . . 4.100 3.220 2.071 3.688 . 0 0 "[ . 1 . 2]" 1
149 1 13 ILE H 1 13 ILE HG13 . . 4.100 2.562 2.078 3.709 . 0 0 "[ . 1 . 2]" 1
150 1 13 ILE H 1 13 ILE MG . . 3.880 3.809 3.755 3.854 . 0 0 "[ . 1 . 2]" 1
151 1 13 ILE H 1 14 ALA H . . 3.740 2.893 2.801 2.986 . 0 0 "[ . 1 . 2]" 1
152 1 13 ILE HA 1 13 ILE MD . . 3.940 3.481 2.315 3.945 0.005 1 0 "[ . 1 . 2]" 1
153 1 13 ILE HA 1 13 ILE MG . . 3.440 2.455 2.256 2.598 . 0 0 "[ . 1 . 2]" 1
154 1 13 ILE HA 1 16 CYS H . . 4.520 3.713 3.217 3.933 . 0 0 "[ . 1 . 2]" 1
155 1 13 ILE HA 1 16 CYS QB . . 4.820 2.862 2.247 4.356 . 0 0 "[ . 1 . 2]" 1
156 1 13 ILE HA 1 17 GLU H . . 4.950 4.008 3.814 4.238 . 0 0 "[ . 1 . 2]" 1
157 1 13 ILE HB 1 13 ILE MD . . 3.540 2.570 2.298 3.278 . 0 0 "[ . 1 . 2]" 1
158 1 13 ILE HB 1 14 ALA H . . 3.610 2.589 2.410 2.734 . 0 0 "[ . 1 . 2]" 1
159 1 13 ILE HB 1 14 ALA MB . . 4.160 4.026 3.741 4.190 0.030 16 0 "[ . 1 . 2]" 1
160 1 13 ILE HB 1 60 CYS QB . . 5.340 5.328 4.980 5.433 0.093 10 0 "[ . 1 . 2]" 1
161 1 13 ILE MD 1 13 ILE MG . . 2.930 2.128 2.090 2.195 . 0 0 "[ . 1 . 2]" 1
162 1 13 ILE MD 1 14 ALA H . . 4.520 4.532 4.402 4.570 0.050 4 0 "[ . 1 . 2]" 1
163 1 13 ILE MD 1 50 PHE HA . . 4.080 2.403 2.085 2.890 . 0 0 "[ . 1 . 2]" 1
164 1 13 ILE MD 1 50 PHE QD . . 3.640 2.854 2.147 3.380 . 0 0 "[ . 1 . 2]" 1
165 1 13 ILE MD 1 50 PHE QE . . 4.490 3.750 2.481 4.521 0.031 9 0 "[ . 1 . 2]" 1
166 1 13 ILE MD 1 51 GLU H . . 5.500 5.132 4.910 5.524 0.024 2 0 "[ . 1 . 2]" 1
167 1 13 ILE MD 1 53 PHE H . . 4.610 3.761 3.426 4.207 . 0 0 "[ . 1 . 2]" 1
168 1 13 ILE MD 1 53 PHE HA . . 5.410 4.179 3.851 4.826 . 0 0 "[ . 1 . 2]" 1
169 1 13 ILE MD 1 53 PHE HB2 . . 3.840 2.545 2.211 3.237 . 0 0 "[ . 1 . 2]" 1
170 1 13 ILE MD 1 53 PHE HB3 . . 3.840 2.610 2.138 3.841 0.001 8 0 "[ . 1 . 2]" 1
171 1 13 ILE MD 1 54 ARG H . . 4.150 3.466 2.928 4.172 0.022 13 0 "[ . 1 . 2]" 1
172 1 13 ILE MD 1 54 ARG HA . . 3.990 2.767 2.227 3.705 . 0 0 "[ . 1 . 2]" 1
173 1 13 ILE MD 1 55 GLU H . . 5.500 4.860 4.481 5.142 . 0 0 "[ . 1 . 2]" 1
174 1 13 ILE QG 1 14 ALA H . . 4.490 4.089 3.676 4.264 . 0 0 "[ . 1 . 2]" 1
175 1 13 ILE QG 1 54 ARG HA . . 5.300 3.523 2.835 4.237 . 0 0 "[ . 1 . 2]" 1
176 1 13 ILE HG12 1 13 ILE MG . . 3.590 2.566 2.274 3.200 . 0 0 "[ . 1 . 2]" 1
177 1 13 ILE HG13 1 13 ILE MG . . 3.590 2.989 2.222 3.251 . 0 0 "[ . 1 . 2]" 1
178 1 13 ILE MG 1 14 ALA H . . 3.630 3.335 3.039 3.633 0.003 14 0 "[ . 1 . 2]" 1
179 1 13 ILE MG 1 14 ALA HA . . 4.400 3.563 3.283 3.835 . 0 0 "[ . 1 . 2]" 1
180 1 13 ILE MG 1 14 ALA MB . . 4.310 4.039 3.653 4.332 0.022 1 0 "[ . 1 . 2]" 1
181 1 13 ILE MG 1 17 GLU H . . 4.310 4.137 3.863 4.357 0.047 13 0 "[ . 1 . 2]" 1
182 1 13 ILE MG 1 17 GLU QG . . 4.880 4.605 4.143 4.915 0.035 17 0 "[ . 1 . 2]" 1
183 1 13 ILE MG 1 50 PHE QD . . 4.900 4.894 4.537 4.962 0.062 1 0 "[ . 1 . 2]" 1
184 1 13 ILE MG 1 54 ARG HA . . 4.360 3.112 2.270 4.052 . 0 0 "[ . 1 . 2]" 1
185 1 13 ILE MG 1 56 GLU H . . 4.960 3.849 3.290 4.315 . 0 0 "[ . 1 . 2]" 1
186 1 13 ILE MG 1 56 GLU QB . . 4.870 2.521 2.150 3.378 . 0 0 "[ . 1 . 2]" 1
187 1 13 ILE MG 1 56 GLU QG . . 5.280 3.693 2.707 4.894 . 0 0 "[ . 1 . 2]" 1
188 1 13 ILE MG 1 57 SER H . . 4.190 3.513 2.979 4.129 . 0 0 "[ . 1 . 2]" 1
189 1 13 ILE MG 1 57 SER QB . . 3.710 2.448 2.041 3.382 . 0 0 "[ . 1 . 2]" 1
190 1 13 ILE MG 1 60 CYS QB . . 4.350 2.668 2.274 2.997 . 0 0 "[ . 1 . 2]" 1
191 1 14 ALA H 1 14 ALA MB . . 2.880 2.215 2.194 2.243 . 0 0 "[ . 1 . 2]" 1
192 1 14 ALA H 1 15 LEU H . . 3.550 2.861 2.771 2.943 . 0 0 "[ . 1 . 2]" 1
193 1 14 ALA H 1 16 CYS H . . 4.620 4.406 4.277 4.532 . 0 0 "[ . 1 . 2]" 1
194 1 14 ALA H 1 17 GLU QB . . 5.340 4.805 4.662 4.953 . 0 0 "[ . 1 . 2]" 1
195 1 14 ALA HA 1 17 GLU H . . 3.920 3.667 3.426 3.893 . 0 0 "[ . 1 . 2]" 1
196 1 14 ALA HA 1 17 GLU QG . . 4.860 4.425 3.971 4.685 . 0 0 "[ . 1 . 2]" 1
197 1 14 ALA MB 1 15 LEU H . . 3.210 2.472 2.356 2.670 . 0 0 "[ . 1 . 2]" 1
198 1 14 ALA MB 1 15 LEU QB . . 4.090 4.013 3.679 4.143 0.053 16 0 "[ . 1 . 2]" 1
199 1 14 ALA MB 1 15 LEU QD . . 4.470 3.821 2.792 4.810 0.340 11 0 "[ . 1 . 2]" 1
200 1 14 ALA MB 1 16 CYS H . . 4.910 4.689 4.569 4.835 . 0 0 "[ . 1 . 2]" 1
201 1 14 ALA MB 1 17 GLU H . . 4.960 4.801 4.643 4.932 . 0 0 "[ . 1 . 2]" 1
202 1 14 ALA MB 1 17 GLU QG . . 5.500 5.395 4.940 5.565 0.065 4 0 "[ . 1 . 2]" 1
203 1 15 LEU H 1 15 LEU HB2 . . 3.520 2.268 2.130 2.473 . 0 0 "[ . 1 . 2]" 1
204 1 15 LEU H 1 15 LEU HB3 . . 3.520 3.223 2.427 3.548 0.028 12 0 "[ . 1 . 2]" 1
205 1 15 LEU H 1 15 LEU QD . . 3.960 3.183 2.453 3.723 . 0 0 "[ . 1 . 2]" 1
206 1 15 LEU H 1 15 LEU HG . . 4.720 3.479 2.524 4.505 . 0 0 "[ . 1 . 2]" 1
207 1 15 LEU H 1 16 CYS H . . 3.500 2.845 2.741 2.972 . 0 0 "[ . 1 . 2]" 1
208 1 15 LEU H 1 18 GLU QB . . 5.010 4.779 4.644 4.940 . 0 0 "[ . 1 . 2]" 1
209 1 15 LEU HA 1 15 LEU QD . . 3.220 2.186 1.983 3.117 . 0 0 "[ . 1 . 2]" 1
210 1 15 LEU HA 1 18 GLU H . . 3.770 3.535 3.303 3.660 . 0 0 "[ . 1 . 2]" 1
211 1 15 LEU HA 1 18 GLU QB . . 3.590 2.638 2.428 2.820 . 0 0 "[ . 1 . 2]" 1
212 1 15 LEU QB 1 16 CYS H . . 3.300 2.536 2.444 2.710 . 0 0 "[ . 1 . 2]" 1
213 1 15 LEU HB2 1 16 CYS H . . 3.930 3.016 2.549 3.891 . 0 0 "[ . 1 . 2]" 1
214 1 15 LEU HB3 1 16 CYS H . . 3.930 3.031 2.471 3.512 . 0 0 "[ . 1 . 2]" 1
215 1 15 LEU QD 1 18 GLU H . . 4.960 4.759 4.342 5.059 0.099 15 0 "[ . 1 . 2]" 1
216 1 15 LEU QD 1 18 GLU QB . . 3.750 3.354 2.908 4.218 0.468 5 0 "[ . 1 . 2]" 1
217 1 15 LEU QD 1 18 GLU QG . . 4.310 4.227 3.502 4.972 0.662 5 2 "[ + 1- . 2]" 1
218 1 15 LEU QD 1 19 HIS H . . 4.700 4.334 3.659 4.830 0.130 12 0 "[ . 1 . 2]" 1
219 1 15 LEU HG 1 16 CYS H . . 4.950 4.634 3.598 5.028 0.078 1 0 "[ . 1 . 2]" 1
220 1 16 CYS H 1 114 LEU QD . . 4.380 3.916 3.373 4.403 0.023 13 0 "[ . 1 . 2]" 1
221 1 16 CYS HA 1 19 HIS H . . 4.330 3.650 3.185 3.912 . 0 0 "[ . 1 . 2]" 1
222 1 16 CYS HA 1 19 HIS QB . . 4.170 2.940 2.498 3.931 . 0 0 "[ . 1 . 2]" 1
223 1 16 CYS HA 1 114 LEU QD . . 3.460 2.502 2.090 3.259 . 0 0 "[ . 1 . 2]" 1
224 1 16 CYS QB 1 18 GLU H . . 5.140 4.896 4.704 5.235 0.095 12 0 "[ . 1 . 2]" 1
225 1 16 CYS QB 1 114 LEU QD . . 3.900 3.180 1.989 3.962 0.062 1 0 "[ . 1 . 2]" 1
226 1 16 CYS QB 1 116 MET ME . . 5.340 4.708 3.880 5.392 0.052 11 0 "[ . 1 . 2]" 1
227 1 16 CYS HB2 1 17 GLU H . . 4.110 2.966 2.422 4.036 . 0 0 "[ . 1 . 2]" 1
228 1 16 CYS HB3 1 17 GLU H . . 4.110 3.312 2.434 4.108 . 0 0 "[ . 1 . 2]" 1
229 1 17 GLU H 1 17 GLU HB2 . . 3.850 2.383 2.253 2.544 . 0 0 "[ . 1 . 2]" 1
230 1 17 GLU H 1 17 GLU QB . . 3.370 2.197 2.139 2.235 . 0 0 "[ . 1 . 2]" 1
231 1 17 GLU H 1 17 GLU HB3 . . 3.850 2.605 2.351 2.756 . 0 0 "[ . 1 . 2]" 1
232 1 17 GLU H 1 17 GLU QG . . 4.180 3.959 3.892 4.052 . 0 0 "[ . 1 . 2]" 1
233 1 17 GLU H 1 18 GLU H . . 3.320 2.886 2.761 2.999 . 0 0 "[ . 1 . 2]" 1
234 1 17 GLU H 1 18 GLU QB . . 5.210 4.608 4.512 4.813 . 0 0 "[ . 1 . 2]" 1
235 1 17 GLU H 1 59 VAL MG2 . . 4.690 3.633 3.134 4.278 . 0 0 "[ . 1 . 2]" 1
236 1 17 GLU HA 1 19 HIS H . . 5.060 4.756 4.573 4.975 . 0 0 "[ . 1 . 2]" 1
237 1 17 GLU HA 1 20 ALA H . . 4.530 3.633 3.362 3.946 . 0 0 "[ . 1 . 2]" 1
238 1 17 GLU HA 1 20 ALA MB . . 3.480 2.760 2.349 3.091 . 0 0 "[ . 1 . 2]" 1
239 1 17 GLU HA 1 59 VAL MG1 . . 4.090 3.309 2.567 4.097 0.007 7 0 "[ . 1 . 2]" 1
240 1 17 GLU HA 1 59 VAL MG2 . . 3.690 2.116 1.992 2.607 . 0 0 "[ . 1 . 2]" 1
241 1 17 GLU QB 1 18 GLU H . . 3.300 2.468 2.263 2.685 . 0 0 "[ . 1 . 2]" 1
242 1 17 GLU QG 1 18 GLU H . . 4.470 3.947 3.242 4.432 . 0 0 "[ . 1 . 2]" 1
243 1 17 GLU QG 1 20 ALA H . . 5.490 5.297 4.899 5.531 0.041 18 0 "[ . 1 . 2]" 1
244 1 17 GLU QG 1 59 VAL MG1 . . 4.300 3.199 2.148 4.312 0.012 15 0 "[ . 1 . 2]" 1
245 1 17 GLU QG 1 59 VAL MG2 . . 3.970 2.926 2.181 3.953 . 0 0 "[ . 1 . 2]" 1
246 1 18 GLU H 1 18 GLU QB . . 2.850 2.235 2.135 2.375 . 0 0 "[ . 1 . 2]" 1
247 1 18 GLU H 1 18 GLU QG . . 4.200 3.772 2.442 4.061 . 0 0 "[ . 1 . 2]" 1
248 1 18 GLU H 1 19 HIS H . . 3.430 2.903 2.766 3.000 . 0 0 "[ . 1 . 2]" 1
249 1 18 GLU H 1 19 HIS QB . . 5.090 4.858 4.714 5.155 0.065 11 0 "[ . 1 . 2]" 1
250 1 18 GLU HA 1 18 GLU QG . . 3.470 2.566 2.347 3.037 . 0 0 "[ . 1 . 2]" 1
251 1 18 GLU HA 1 20 ALA H . . 4.410 4.459 4.416 4.481 0.071 18 0 "[ . 1 . 2]" 1
252 1 18 GLU HA 1 21 LYS QD . . 3.400 2.710 2.411 3.474 0.074 18 0 "[ . 1 . 2]" 1
253 1 18 GLU HA 1 21 LYS QE . . 4.490 3.654 1.894 4.527 0.037 14 0 "[ . 1 . 2]" 1
254 1 18 GLU HA 1 21 LYS HG2 . . 3.430 2.297 2.178 2.482 . 0 0 "[ . 1 . 2]" 1
255 1 18 GLU HA 1 21 LYS HG3 . . 3.730 3.392 2.975 3.750 0.020 1 0 "[ . 1 . 2]" 1
256 1 18 GLU QB 1 19 HIS H . . 3.470 2.584 2.461 2.741 . 0 0 "[ . 1 . 2]" 1
257 1 18 GLU QB 1 19 HIS HA . . 4.700 4.266 3.867 4.473 . 0 0 "[ . 1 . 2]" 1
258 1 18 GLU QB 1 20 ALA H . . 5.180 4.785 4.638 4.903 . 0 0 "[ . 1 . 2]" 1
259 1 18 GLU QG 1 19 HIS H . . 4.430 3.842 3.599 4.335 . 0 0 "[ . 1 . 2]" 1
260 1 19 HIS H 1 19 HIS HB2 . . 3.670 2.497 2.325 3.682 0.012 11 0 "[ . 1 . 2]" 1
261 1 19 HIS H 1 19 HIS HB3 . . 3.670 3.556 2.584 3.623 . 0 0 "[ . 1 . 2]" 1
262 1 19 HIS H 1 19 HIS HD2 . . 4.120 3.735 3.425 4.137 0.017 20 0 "[ . 1 . 2]" 1
263 1 19 HIS H 1 20 ALA H . . 3.560 2.754 2.653 2.785 . 0 0 "[ . 1 . 2]" 1
264 1 19 HIS H 1 20 ALA MB . . 4.440 4.447 4.330 4.478 0.038 18 0 "[ . 1 . 2]" 1
265 1 19 HIS H 1 21 LYS H . . 5.070 4.565 4.485 4.720 . 0 0 "[ . 1 . 2]" 1
266 1 19 HIS H 1 21 LYS HG2 . . 5.320 4.783 4.626 4.877 . 0 0 "[ . 1 . 2]" 1
267 1 19 HIS H 1 22 LYS QB . . 4.820 4.667 4.554 4.822 0.002 5 0 "[ . 1 . 2]" 1
268 1 19 HIS H 1 114 LEU QD . . 5.110 4.482 4.029 5.156 0.046 13 0 "[ . 1 . 2]" 1
269 1 19 HIS H 1 116 MET ME . . 4.980 4.569 4.283 5.012 0.032 12 0 "[ . 1 . 2]" 1
270 1 19 HIS HA 1 22 LYS H . . 3.980 3.540 3.250 3.659 . 0 0 "[ . 1 . 2]" 1
271 1 19 HIS HA 1 22 LYS QB . . 3.590 2.536 2.267 2.670 . 0 0 "[ . 1 . 2]" 1
272 1 19 HIS QB 1 20 ALA H . . 3.660 2.694 2.561 3.652 . 0 0 "[ . 1 . 2]" 1
273 1 19 HIS QB 1 20 ALA HA . . 5.030 3.905 3.760 4.511 . 0 0 "[ . 1 . 2]" 1
274 1 19 HIS QB 1 114 LEU QD . . 3.610 2.772 2.152 3.445 . 0 0 "[ . 1 . 2]" 1
275 1 19 HIS QB 1 116 MET ME . . 2.910 2.289 2.094 2.530 . 0 0 "[ . 1 . 2]" 1
276 1 19 HIS HB2 1 20 ALA H . . 4.170 2.782 2.613 4.063 . 0 0 "[ . 1 . 2]" 1
277 1 19 HIS HB2 1 22 LYS H . . 5.500 5.553 5.135 5.599 0.099 4 0 "[ . 1 . 2]" 1
278 1 19 HIS HB2 1 116 MET ME . . 3.540 2.789 2.421 3.122 . 0 0 "[ . 1 . 2]" 1
279 1 19 HIS HB3 1 20 ALA H . . 4.170 3.673 3.514 4.137 . 0 0 "[ . 1 . 2]" 1
280 1 19 HIS HB3 1 22 LYS H . . 5.500 5.361 5.178 5.549 0.049 11 0 "[ . 1 . 2]" 1
281 1 19 HIS HB3 1 116 MET ME . . 3.540 2.487 2.184 3.606 0.066 11 0 "[ . 1 . 2]" 1
282 1 19 HIS HD2 1 20 ALA H . . 5.490 5.038 2.557 5.554 0.064 20 0 "[ . 1 . 2]" 1
283 1 19 HIS HD2 1 114 LEU QD . . 4.230 2.422 2.031 4.840 0.610 11 1 "[ . 1+ . 2]" 1
284 1 19 HIS HD2 1 116 MET ME . . 4.670 4.298 2.237 4.700 0.030 20 0 "[ . 1 . 2]" 1
285 1 20 ALA H 1 20 ALA MB . . 2.980 2.249 2.220 2.277 . 0 0 "[ . 1 . 2]" 1
286 1 20 ALA H 1 21 LYS H . . 3.420 2.844 2.786 2.962 . 0 0 "[ . 1 . 2]" 1
287 1 20 ALA H 1 21 LYS HG2 . . 4.330 4.306 4.196 4.367 0.037 12 0 "[ . 1 . 2]" 1
288 1 20 ALA H 1 116 MET ME . . 4.100 3.208 2.930 4.146 0.046 11 0 "[ . 1 . 2]" 1
289 1 20 ALA HA 1 22 LYS H . . 5.200 4.260 4.159 4.337 . 0 0 "[ . 1 . 2]" 1
290 1 20 ALA HA 1 23 ASN H . . 3.910 3.662 3.543 3.833 . 0 0 "[ . 1 . 2]" 1
291 1 20 ALA HA 1 23 ASN HB2 . . 4.810 4.215 3.949 4.750 . 0 0 "[ . 1 . 2]" 1
292 1 20 ALA HA 1 23 ASN QB . . 4.170 2.956 2.737 3.321 . 0 0 "[ . 1 . 2]" 1
293 1 20 ALA HA 1 23 ASN HB3 . . 4.810 3.020 2.791 3.391 . 0 0 "[ . 1 . 2]" 1
294 1 20 ALA HA 1 25 ALA H . . 3.570 3.289 2.880 3.393 . 0 0 "[ . 1 . 2]" 1
295 1 20 ALA HA 1 25 ALA MB . . 3.230 2.351 2.177 2.440 . 0 0 "[ . 1 . 2]" 1
296 1 20 ALA HA 1 26 HIS H . . 4.400 3.733 3.096 4.381 . 0 0 "[ . 1 . 2]" 1
297 1 20 ALA HA 1 116 MET ME . . 3.400 2.469 2.291 3.375 . 0 0 "[ . 1 . 2]" 1
298 1 20 ALA MB 1 21 LYS H . . 3.290 2.554 2.328 2.824 . 0 0 "[ . 1 . 2]" 1
299 1 20 ALA MB 1 23 ASN H . . 5.120 4.812 4.688 5.026 . 0 0 "[ . 1 . 2]" 1
300 1 20 ALA MB 1 24 GLN H . . 5.120 5.130 5.063 5.148 0.028 16 0 "[ . 1 . 2]" 1
301 1 20 ALA MB 1 25 ALA H . . 3.710 3.775 3.734 3.821 0.111 18 0 "[ . 1 . 2]" 1
302 1 20 ALA MB 1 26 HIS H . . 3.800 2.718 2.464 3.171 . 0 0 "[ . 1 . 2]" 1
303 1 20 ALA MB 1 27 LYS H . . 4.070 2.923 2.337 3.371 . 0 0 "[ . 1 . 2]" 1
304 1 20 ALA MB 1 59 VAL H . . 5.500 5.076 4.730 5.401 . 0 0 "[ . 1 . 2]" 1
305 1 20 ALA MB 1 59 VAL HB . . 4.340 3.018 2.754 3.527 . 0 0 "[ . 1 . 2]" 1
306 1 20 ALA MB 1 59 VAL MG1 . . 2.950 2.353 2.002 2.960 0.010 14 0 "[ . 1 . 2]" 1
307 1 20 ALA MB 1 59 VAL MG2 . . 2.790 2.319 2.078 2.794 0.004 2 0 "[ . 1 . 2]" 1
308 1 20 ALA MB 1 116 MET ME . . 4.090 2.663 2.289 3.990 . 0 0 "[ . 1 . 2]" 1
309 1 21 LYS H 1 21 LYS QB . . 2.990 2.584 2.485 2.784 . 0 0 "[ . 1 . 2]" 1
310 1 21 LYS H 1 21 LYS QD . . 4.240 4.005 3.777 4.287 0.047 5 0 "[ . 1 . 2]" 1
311 1 21 LYS H 1 21 LYS HG2 . . 3.670 2.215 2.031 2.321 . 0 0 "[ . 1 . 2]" 1
312 1 21 LYS H 1 21 LYS HG3 . . 3.560 3.301 2.925 3.475 . 0 0 "[ . 1 . 2]" 1
313 1 21 LYS H 1 25 ALA H . . 5.050 5.001 4.899 5.090 0.040 5 0 "[ . 1 . 2]" 1
314 1 21 LYS H 1 26 HIS H . . 5.020 4.666 4.450 5.044 0.024 4 0 "[ . 1 . 2]" 1
315 1 21 LYS H 1 59 VAL MG1 . . 5.230 4.244 3.557 4.727 . 0 0 "[ . 1 . 2]" 1
316 1 21 LYS HA 1 21 LYS QE . . 5.150 4.642 4.278 5.322 0.172 18 0 "[ . 1 . 2]" 1
317 1 21 LYS HA 1 24 GLN H . . 3.690 3.384 3.255 3.629 . 0 0 "[ . 1 . 2]" 1
318 1 21 LYS HA 1 24 GLN QG . . 5.500 4.490 3.887 5.522 0.022 7 0 "[ . 1 . 2]" 1
319 1 21 LYS HA 1 26 HIS H . . 5.020 3.694 3.385 4.201 . 0 0 "[ . 1 . 2]" 1
320 1 21 LYS QB 1 21 LYS QD . . 3.240 2.344 2.125 2.414 . 0 0 "[ . 1 . 2]" 1
321 1 21 LYS QB 1 22 LYS H . . 3.880 3.627 3.581 3.738 . 0 0 "[ . 1 . 2]" 1
322 1 21 LYS QD 1 22 LYS H . . 4.670 4.423 4.232 4.676 0.006 7 0 "[ . 1 . 2]" 1
323 1 21 LYS QE 1 21 LYS HG2 . . 3.620 2.996 2.164 3.542 . 0 0 "[ . 1 . 2]" 1
324 1 21 LYS QE 1 21 LYS HG3 . . 3.530 2.727 2.127 3.548 0.018 4 0 "[ . 1 . 2]" 1
325 1 21 LYS HG2 1 22 LYS H . . 3.540 2.935 2.627 3.296 . 0 0 "[ . 1 . 2]" 1
326 1 21 LYS HG3 1 22 LYS H . . 3.550 2.571 2.438 2.720 . 0 0 "[ . 1 . 2]" 1
327 1 21 LYS HG3 1 22 LYS QB . . 3.470 3.162 2.882 3.439 . 0 0 "[ . 1 . 2]" 1
328 1 21 LYS HG3 1 23 ASN H . . 4.830 4.957 4.906 5.009 0.179 18 0 "[ . 1 . 2]" 1
329 1 21 LYS HG3 1 24 GLN H . . 5.500 5.281 5.185 5.477 . 0 0 "[ . 1 . 2]" 1
330 1 22 LYS H 1 22 LYS QB . . 3.030 2.261 2.230 2.285 . 0 0 "[ . 1 . 2]" 1
331 1 22 LYS H 1 22 LYS QD . . 4.540 4.361 4.164 4.590 0.050 6 0 "[ . 1 . 2]" 1
332 1 22 LYS H 1 23 ASN H . . 3.510 2.494 2.392 2.553 . 0 0 "[ . 1 . 2]" 1
333 1 22 LYS H 1 23 ASN HB2 . . 5.500 4.862 4.740 4.998 . 0 0 "[ . 1 . 2]" 1
334 1 22 LYS H 1 23 ASN QB . . 4.680 4.278 4.169 4.370 . 0 0 "[ . 1 . 2]" 1
335 1 22 LYS H 1 23 ASN HB3 . . 5.500 4.749 4.624 4.852 . 0 0 "[ . 1 . 2]" 1
336 1 22 LYS H 1 24 GLN H . . 4.000 3.624 3.517 3.729 . 0 0 "[ . 1 . 2]" 1
337 1 22 LYS H 1 25 ALA H . . 4.970 5.031 4.987 5.051 0.081 6 0 "[ . 1 . 2]" 1
338 1 22 LYS H 1 25 ALA MB . . 5.500 5.525 5.490 5.554 0.054 11 0 "[ . 1 . 2]" 1
339 1 22 LYS H 1 116 MET ME . . 5.490 5.242 5.048 5.495 0.005 11 0 "[ . 1 . 2]" 1
340 1 22 LYS HA 1 22 LYS QD . . 3.440 2.462 2.159 3.466 0.026 20 0 "[ . 1 . 2]" 1
341 1 22 LYS HA 1 22 LYS HG2 . . 4.250 3.600 2.411 3.857 . 0 0 "[ . 1 . 2]" 1
342 1 22 LYS HA 1 22 LYS QG . . 3.670 2.863 2.378 3.034 . 0 0 "[ . 1 . 2]" 1
343 1 22 LYS HA 1 22 LYS HG3 . . 4.250 3.150 2.808 3.630 . 0 0 "[ . 1 . 2]" 1
344 1 22 LYS HA 1 24 GLN QG . . 5.500 4.077 3.802 4.837 . 0 0 "[ . 1 . 2]" 1
345 1 22 LYS QB 1 23 ASN H . . 3.510 2.542 2.448 2.611 . 0 0 "[ . 1 . 2]" 1
346 1 22 LYS QB 1 24 GLN H . . 4.490 4.403 4.333 4.464 . 0 0 "[ . 1 . 2]" 1
347 1 22 LYS QG 1 23 ASN H . . 5.340 3.847 3.607 4.294 . 0 0 "[ . 1 . 2]" 1
348 1 23 ASN H 1 23 ASN HB2 . . 3.650 2.525 2.485 2.586 . 0 0 "[ . 1 . 2]" 1
349 1 23 ASN H 1 23 ASN HB3 . . 3.650 2.564 2.489 2.612 . 0 0 "[ . 1 . 2]" 1
350 1 23 ASN H 1 24 GLN H . . 3.320 2.561 2.496 2.594 . 0 0 "[ . 1 . 2]" 1
351 1 23 ASN H 1 24 GLN HA . . 4.720 4.707 4.630 4.736 0.016 6 0 "[ . 1 . 2]" 1
352 1 23 ASN H 1 24 GLN QG . . 4.700 4.595 4.495 4.779 0.079 6 0 "[ . 1 . 2]" 1
353 1 23 ASN H 1 25 ALA H . . 3.910 3.857 3.796 3.907 . 0 0 "[ . 1 . 2]" 1
354 1 23 ASN H 1 25 ALA MB . . 4.380 4.392 4.336 4.410 0.030 5 0 "[ . 1 . 2]" 1
355 1 23 ASN H 1 116 MET ME . . 4.440 4.358 4.075 4.481 0.041 10 0 "[ . 1 . 2]" 1
356 1 23 ASN HA 1 24 GLN HA . . 5.160 5.190 5.173 5.213 0.053 19 0 "[ . 1 . 2]" 1
357 1 23 ASN HA 1 24 GLN QE . . 3.920 3.954 3.943 3.958 0.038 11 0 "[ . 1 . 2]" 1
358 1 23 ASN HA 1 24 GLN QG . . 4.260 3.967 3.479 4.138 . 0 0 "[ . 1 . 2]" 1
359 1 23 ASN HA 1 25 ALA H . . 5.160 4.638 4.592 4.692 . 0 0 "[ . 1 . 2]" 1
360 1 23 ASN QB 1 25 ALA H . . 4.010 2.995 2.914 3.040 . 0 0 "[ . 1 . 2]" 1
361 1 23 ASN QB 1 25 ALA MB . . 3.980 2.646 2.531 2.690 . 0 0 "[ . 1 . 2]" 1
362 1 23 ASN HB2 1 24 GLN H . . 4.290 4.296 4.268 4.314 0.024 20 0 "[ . 1 . 2]" 1
363 1 23 ASN HB2 1 25 ALA H . . 4.660 4.653 4.598 4.688 0.028 4 0 "[ . 1 . 2]" 1
364 1 23 ASN HB2 1 25 ALA MB . . 4.600 4.126 4.011 4.193 . 0 0 "[ . 1 . 2]" 1
365 1 23 ASN HB2 1 116 MET ME . . 4.380 3.637 2.997 4.021 . 0 0 "[ . 1 . 2]" 1
366 1 23 ASN HB3 1 24 GLN H . . 4.290 3.526 3.433 3.589 . 0 0 "[ . 1 . 2]" 1
367 1 23 ASN HB3 1 25 ALA H . . 4.660 3.032 2.947 3.080 . 0 0 "[ . 1 . 2]" 1
368 1 23 ASN HB3 1 25 ALA MB . . 4.600 2.678 2.559 2.725 . 0 0 "[ . 1 . 2]" 1
369 1 23 ASN HB3 1 116 MET ME . . 4.380 3.312 2.705 3.669 . 0 0 "[ . 1 . 2]" 1
370 1 24 GLN H 1 24 GLN QB . . 3.470 3.372 3.339 3.476 0.006 7 0 "[ . 1 . 2]" 1
371 1 24 GLN H 1 24 GLN QG . . 3.180 2.652 2.547 3.052 . 0 0 "[ . 1 . 2]" 1
372 1 24 GLN H 1 25 ALA H . . 3.360 2.690 2.621 2.747 . 0 0 "[ . 1 . 2]" 1
373 1 24 GLN H 1 25 ALA MB . . 4.280 4.240 4.196 4.274 . 0 0 "[ . 1 . 2]" 1
374 1 24 GLN HA 1 24 GLN QG . . 3.230 2.552 2.463 3.191 . 0 0 "[ . 1 . 2]" 1
375 1 24 GLN HA 1 25 ALA H . . 3.280 2.854 2.788 2.936 . 0 0 "[ . 1 . 2]" 1
376 1 24 GLN HA 1 25 ALA MB . . 4.620 4.551 4.512 4.626 0.006 6 0 "[ . 1 . 2]" 1
377 1 24 GLN QB 1 25 ALA H . . 3.990 3.893 3.867 3.919 . 0 0 "[ . 1 . 2]" 1
378 1 24 GLN HE22 1 24 GLN QG . . 3.760 3.339 3.270 3.354 . 0 0 "[ . 1 . 2]" 1
379 1 24 GLN QG 1 25 ALA H . . 4.790 4.518 4.482 4.695 . 0 0 "[ . 1 . 2]" 1
380 1 25 ALA H 1 25 ALA MB . . 2.970 2.202 2.183 2.228 . 0 0 "[ . 1 . 2]" 1
381 1 25 ALA H 1 26 HIS HA . . 5.430 4.634 4.492 4.855 . 0 0 "[ . 1 . 2]" 1
382 1 25 ALA H 1 116 MET ME . . 4.870 4.825 4.547 4.891 0.021 6 0 "[ . 1 . 2]" 1
383 1 25 ALA HA 1 27 LYS H . . 4.560 4.107 3.984 4.329 . 0 0 "[ . 1 . 2]" 1
384 1 25 ALA MB 1 26 HIS H . . 3.490 2.616 2.521 2.757 . 0 0 "[ . 1 . 2]" 1
385 1 25 ALA MB 1 26 HIS QB . . 4.620 4.589 4.406 4.628 0.008 11 0 "[ . 1 . 2]" 1
386 1 25 ALA MB 1 27 LYS H . . 3.630 2.677 2.536 2.846 . 0 0 "[ . 1 . 2]" 1
387 1 25 ALA MB 1 116 MET QB . . 4.010 2.463 2.130 2.726 . 0 0 "[ . 1 . 2]" 1
388 1 25 ALA MB 1 116 MET ME . . 3.160 3.152 2.821 3.197 0.037 20 0 "[ . 1 . 2]" 1
389 1 25 ALA MB 1 116 MET QG . . 3.480 3.122 2.193 3.524 0.044 12 0 "[ . 1 . 2]" 1
390 1 26 HIS H 1 26 HIS QB . . 3.530 3.280 2.808 3.345 . 0 0 "[ . 1 . 2]" 1
391 1 26 HIS H 1 26 HIS HD2 . . 4.440 3.782 3.006 4.448 0.008 7 0 "[ . 1 . 2]" 1
392 1 26 HIS H 1 27 LYS H . . 3.570 3.002 2.842 3.170 . 0 0 "[ . 1 . 2]" 1
393 1 26 HIS QB 1 27 LYS H . . 4.260 3.704 3.551 3.887 . 0 0 "[ . 1 . 2]" 1
394 1 26 HIS QB 1 27 LYS QG . . 4.690 4.026 3.454 4.735 0.045 8 0 "[ . 1 . 2]" 1
395 1 27 LYS H 1 27 LYS QB . . 3.670 3.031 2.704 3.406 . 0 0 "[ . 1 . 2]" 1
396 1 27 LYS H 1 27 LYS HG2 . . 5.110 3.632 2.481 4.959 . 0 0 "[ . 1 . 2]" 1
397 1 27 LYS H 1 27 LYS QG . . 4.400 3.231 2.450 4.175 . 0 0 "[ . 1 . 2]" 1
398 1 27 LYS H 1 27 LYS HG3 . . 5.110 3.959 3.550 5.034 . 0 0 "[ . 1 . 2]" 1
399 1 27 LYS H 1 28 ILE HA . . 5.170 4.779 4.673 4.875 . 0 0 "[ . 1 . 2]" 1
400 1 27 LYS H 1 28 ILE QG . . 5.080 4.546 3.909 5.091 0.011 5 0 "[ . 1 . 2]" 1
401 1 27 LYS H 1 59 VAL HA . . 5.500 4.946 4.319 5.471 . 0 0 "[ . 1 . 2]" 1
402 1 27 LYS HA 1 27 LYS QG . . 3.680 2.867 2.165 3.485 . 0 0 "[ . 1 . 2]" 1
403 1 27 LYS HA 1 59 VAL HA . . 3.750 2.590 2.061 3.206 . 0 0 "[ . 1 . 2]" 1
404 1 27 LYS HA 1 59 VAL HB . . 4.060 2.396 2.123 2.624 . 0 0 "[ . 1 . 2]" 1
405 1 27 LYS HA 1 59 VAL MG2 . . 4.000 3.949 3.655 4.091 0.091 12 0 "[ . 1 . 2]" 1
406 1 27 LYS QB 1 27 LYS QE . . 4.230 2.912 2.054 3.880 . 0 0 "[ . 1 . 2]" 1
407 1 27 LYS QB 1 28 ILE H . . 3.870 2.421 2.144 3.042 . 0 0 "[ . 1 . 2]" 1
408 1 27 LYS QB 1 28 ILE HA . . 4.820 4.253 3.846 4.628 . 0 0 "[ . 1 . 2]" 1
409 1 27 LYS QB 1 59 VAL HA . . 5.350 4.163 3.112 5.374 0.024 12 0 "[ . 1 . 2]" 1
410 1 27 LYS QD 1 27 LYS QE . . 2.360 2.066 2.011 2.126 . 0 0 "[ . 1 . 2]" 1
411 1 27 LYS QD 1 59 VAL HA . . 5.500 5.146 3.056 5.604 0.104 16 0 "[ . 1 . 2]" 1
412 1 27 LYS QE 1 27 LYS QG . . 3.320 2.358 2.108 2.897 . 0 0 "[ . 1 . 2]" 1
413 1 27 LYS QG 1 28 ILE H . . 4.190 3.431 2.157 4.221 0.031 14 0 "[ . 1 . 2]" 1
414 1 27 LYS QG 1 59 VAL HA . . 5.040 4.388 3.186 5.113 0.073 4 0 "[ . 1 . 2]" 1
415 1 27 LYS HG2 1 28 ILE H . . 4.810 4.007 2.178 4.771 . 0 0 "[ . 1 . 2]" 1
416 1 27 LYS HG3 1 28 ILE H . . 4.810 4.049 3.158 4.824 0.014 9 0 "[ . 1 . 2]" 1
417 1 28 ILE H 1 28 ILE HB . . 3.840 2.680 2.473 2.961 . 0 0 "[ . 1 . 2]" 1
418 1 28 ILE H 1 28 ILE HG12 . . 5.140 3.400 2.337 4.328 . 0 0 "[ . 1 . 2]" 1
419 1 28 ILE H 1 28 ILE QG . . 4.350 2.838 2.312 3.198 . 0 0 "[ . 1 . 2]" 1
420 1 28 ILE H 1 28 ILE HG13 . . 5.140 3.604 2.346 4.366 . 0 0 "[ . 1 . 2]" 1
421 1 28 ILE H 1 28 ILE MG . . 4.070 3.906 3.825 3.985 . 0 0 "[ . 1 . 2]" 1
422 1 28 ILE H 1 59 VAL HA . . 4.490 4.129 3.367 4.541 0.051 3 0 "[ . 1 . 2]" 1
423 1 28 ILE H 1 59 VAL HB . . 4.610 3.760 3.124 4.429 . 0 0 "[ . 1 . 2]" 1
424 1 28 ILE H 1 59 VAL MG2 . . 4.840 4.521 3.886 4.861 0.021 7 0 "[ . 1 . 2]" 1
425 1 28 ILE HA 1 30 ARG H . . 4.820 4.435 4.073 4.728 . 0 0 "[ . 1 . 2]" 1
426 1 28 ILE QG 1 29 GLU H . . 5.330 4.340 3.862 4.698 . 0 0 "[ . 1 . 2]" 1
427 1 28 ILE QG 1 59 VAL HA . . 5.340 4.280 3.775 4.784 . 0 0 "[ . 1 . 2]" 1
428 1 28 ILE MG 1 29 GLU H . . 3.680 2.204 1.908 2.520 . 0 0 "[ . 1 . 2]" 1
429 1 28 ILE MG 1 29 GLU HA . . 4.130 3.807 3.631 4.139 0.009 5 0 "[ . 1 . 2]" 1
430 1 28 ILE MG 1 30 ARG H . . 3.530 2.630 2.356 2.860 . 0 0 "[ . 1 . 2]" 1
431 1 28 ILE MG 1 30 ARG HA . . 3.940 3.233 2.698 3.709 . 0 0 "[ . 1 . 2]" 1
432 1 28 ILE MG 1 64 ILE H . . 4.330 3.512 2.935 4.336 0.006 2 0 "[ . 1 . 2]" 1
433 1 28 ILE MG 1 115 GLU H . . 3.900 3.477 2.805 3.955 0.055 3 0 "[ . 1 . 2]" 1
434 1 28 ILE MG 1 116 MET H . . 5.170 5.105 4.366 5.223 0.053 18 0 "[ . 1 . 2]" 1
435 1 29 GLU H 1 29 GLU HB2 . . 3.860 2.944 2.687 3.185 . 0 0 "[ . 1 . 2]" 1
436 1 29 GLU H 1 29 GLU HB3 . . 3.860 2.631 2.433 2.788 . 0 0 "[ . 1 . 2]" 1
437 1 29 GLU H 1 29 GLU QG . . 4.470 4.093 4.012 4.281 . 0 0 "[ . 1 . 2]" 1
438 1 29 GLU H 1 30 ARG H . . 3.680 2.301 2.046 2.552 . 0 0 "[ . 1 . 2]" 1
439 1 29 GLU H 1 64 ILE H . . 5.500 5.459 5.067 5.586 0.086 8 0 "[ . 1 . 2]" 1
440 1 29 GLU H 1 115 GLU H . . 4.610 4.235 3.941 4.651 0.041 5 0 "[ . 1 . 2]" 1
441 1 29 GLU H 1 115 GLU QB . . 4.980 3.874 3.632 4.225 . 0 0 "[ . 1 . 2]" 1
442 1 29 GLU H 1 116 MET HA . . 4.240 2.389 2.090 2.712 . 0 0 "[ . 1 . 2]" 1
443 1 29 GLU H 1 117 LEU H . . 4.070 3.795 3.179 4.133 0.063 11 0 "[ . 1 . 2]" 1
444 1 29 GLU H 1 117 LEU QB . . 5.340 4.793 3.854 5.311 . 0 0 "[ . 1 . 2]" 1
445 1 29 GLU HA 1 29 GLU QG . . 3.820 2.633 2.277 3.086 . 0 0 "[ . 1 . 2]" 1
446 1 29 GLU HA 1 64 ILE H . . 5.070 4.832 4.370 5.104 0.034 13 0 "[ . 1 . 2]" 1
447 1 29 GLU HA 1 117 LEU H . . 5.030 4.539 4.028 5.037 0.007 6 0 "[ . 1 . 2]" 1
448 1 29 GLU HA 1 117 LEU QB . . 4.270 4.139 3.451 4.359 0.089 10 0 "[ . 1 . 2]" 1
449 1 29 GLU QB 1 30 ARG H . . 3.430 2.296 2.098 2.538 . 0 0 "[ . 1 . 2]" 1
450 1 29 GLU HB2 1 30 ARG H . . 3.920 3.712 3.511 3.920 0.000 15 0 "[ . 1 . 2]" 1
451 1 29 GLU HB3 1 30 ARG H . . 3.920 2.319 2.112 2.577 . 0 0 "[ . 1 . 2]" 1
452 1 29 GLU QG 1 30 ARG H . . 4.760 3.495 2.985 4.364 . 0 0 "[ . 1 . 2]" 1
453 1 29 GLU QG 1 30 ARG HA . . 5.500 4.548 4.105 5.547 0.047 12 0 "[ . 1 . 2]" 1
454 1 30 ARG H 1 30 ARG QB . . 3.660 2.863 2.622 3.352 . 0 0 "[ . 1 . 2]" 1
455 1 30 ARG H 1 30 ARG HG2 . . 5.100 4.307 2.647 5.181 0.081 3 0 "[ . 1 . 2]" 1
456 1 30 ARG H 1 30 ARG QG . . 4.370 3.710 2.593 4.410 0.040 11 0 "[ . 1 . 2]" 1
457 1 30 ARG H 1 30 ARG HG3 . . 5.100 4.159 3.199 4.875 . 0 0 "[ . 1 . 2]" 1
458 1 30 ARG H 1 31 VAL H . . 4.830 4.261 3.880 4.427 . 0 0 "[ . 1 . 2]" 1
459 1 30 ARG H 1 114 LEU HA . . 5.430 4.876 4.338 5.122 . 0 0 "[ . 1 . 2]" 1
460 1 30 ARG H 1 114 LEU HB3 . . 5.200 5.001 4.498 5.292 0.092 15 0 "[ . 1 . 2]" 1
461 1 30 ARG H 1 115 GLU H . . 4.110 3.023 2.868 3.235 . 0 0 "[ . 1 . 2]" 1
462 1 30 ARG H 1 115 GLU HA . . 5.190 4.536 4.397 4.712 . 0 0 "[ . 1 . 2]" 1
463 1 30 ARG H 1 115 GLU QB . . 4.620 2.403 2.118 2.848 . 0 0 "[ . 1 . 2]" 1
464 1 30 ARG H 1 116 MET HA . . 4.900 4.145 3.866 4.573 . 0 0 "[ . 1 . 2]" 1
465 1 30 ARG HA 1 30 ARG QD . . 4.560 3.706 2.060 4.527 . 0 0 "[ . 1 . 2]" 1
466 1 30 ARG HA 1 30 ARG HG2 . . 4.240 3.161 2.329 3.788 . 0 0 "[ . 1 . 2]" 1
467 1 30 ARG HA 1 30 ARG QG . . 3.680 2.624 2.218 3.395 . 0 0 "[ . 1 . 2]" 1
468 1 30 ARG HA 1 30 ARG HG3 . . 4.240 2.951 2.303 3.869 . 0 0 "[ . 1 . 2]" 1
469 1 30 ARG HA 1 64 ILE H . . 3.880 2.474 1.928 3.184 . 0 0 "[ . 1 . 2]" 1
470 1 30 ARG HA 1 64 ILE HB . . 4.510 3.114 2.419 3.767 . 0 0 "[ . 1 . 2]" 1
471 1 30 ARG HA 1 115 GLU QB . . 5.340 4.451 4.155 5.018 . 0 0 "[ . 1 . 2]" 1
472 1 30 ARG QB 1 30 ARG QD . . 3.190 2.337 2.065 2.871 . 0 0 "[ . 1 . 2]" 1
473 1 30 ARG QB 1 31 VAL H . . 4.330 3.125 2.287 3.957 . 0 0 "[ . 1 . 2]" 1
474 1 30 ARG QB 1 115 GLU H . . 4.730 3.912 3.259 4.800 0.070 13 0 "[ . 1 . 2]" 1
475 1 30 ARG QD 1 64 ILE HB . . 4.570 3.452 2.066 4.555 . 0 0 "[ . 1 . 2]" 1
476 1 30 ARG QD 1 64 ILE MG . . 3.900 3.265 2.305 3.926 0.026 18 0 "[ . 1 . 2]" 1
477 1 30 ARG QG 1 31 VAL H . . 4.130 3.217 2.106 4.168 0.038 5 0 "[ . 1 . 2]" 1
478 1 31 VAL H 1 31 VAL HB . . 4.150 3.338 2.464 3.957 . 0 0 "[ . 1 . 2]" 1
479 1 31 VAL H 1 31 VAL MG1 . . 4.010 2.844 2.249 3.916 . 0 0 "[ . 1 . 2]" 1
480 1 31 VAL H 1 31 VAL QG . . 3.520 2.303 2.073 2.858 . 0 0 "[ . 1 . 2]" 1
481 1 31 VAL H 1 31 VAL MG2 . . 4.010 2.948 2.106 4.014 0.004 11 0 "[ . 1 . 2]" 1
482 1 31 VAL H 1 64 ILE H . . 4.280 3.591 3.105 3.939 . 0 0 "[ . 1 . 2]" 1
483 1 31 VAL H 1 64 ILE HB . . 4.920 4.394 3.961 4.928 0.008 12 0 "[ . 1 . 2]" 1
484 1 31 VAL H 1 65 LEU HA . . 4.760 3.018 2.778 3.308 . 0 0 "[ . 1 . 2]" 1
485 1 31 VAL H 1 66 ASP H . . 4.530 3.632 3.069 4.329 . 0 0 "[ . 1 . 2]" 1
486 1 31 VAL H 1 114 LEU HB3 . . 5.500 5.527 5.139 5.621 0.121 10 0 "[ . 1 . 2]" 1
487 1 31 VAL HA 1 31 VAL MG1 . . 3.630 2.705 2.307 3.278 . 0 0 "[ . 1 . 2]" 1
488 1 31 VAL HA 1 31 VAL QG . . 3.130 2.294 2.125 2.407 . 0 0 "[ . 1 . 2]" 1
489 1 31 VAL HA 1 31 VAL MG2 . . 3.630 2.759 2.323 3.283 . 0 0 "[ . 1 . 2]" 1
490 1 31 VAL HA 1 32 VAL H . . 3.480 2.187 2.075 2.302 . 0 0 "[ . 1 . 2]" 1
491 1 31 VAL HA 1 114 LEU HB2 . . 5.300 4.702 3.560 4.887 . 0 0 "[ . 1 . 2]" 1
492 1 31 VAL HA 1 114 LEU HB3 . . 5.410 3.409 2.606 3.718 . 0 0 "[ . 1 . 2]" 1
493 1 31 VAL HA 1 114 LEU QD . . 4.320 3.031 2.327 3.888 . 0 0 "[ . 1 . 2]" 1
494 1 31 VAL HA 1 115 GLU H . . 4.520 3.462 3.102 3.696 . 0 0 "[ . 1 . 2]" 1
495 1 31 VAL HB 1 32 VAL H . . 4.520 3.676 2.739 4.359 . 0 0 "[ . 1 . 2]" 1
496 1 31 VAL HB 1 66 ASP H . . 5.440 5.005 3.554 5.623 0.183 2 0 "[ . 1 . 2]" 1
497 1 31 VAL HB 1 114 LEU HA . . 4.910 4.279 3.838 5.157 0.247 16 0 "[ . 1 . 2]" 1
498 1 31 VAL QG 1 32 VAL H . . 4.090 2.934 2.266 3.707 . 0 0 "[ . 1 . 2]" 1
499 1 31 VAL QG 1 66 ASP H . . 4.510 3.422 3.062 4.254 . 0 0 "[ . 1 . 2]" 1
500 1 31 VAL QG 1 115 GLU H . . 5.130 4.217 3.550 4.856 . 0 0 "[ . 1 . 2]" 1
501 1 32 VAL H 1 32 VAL HB . . 4.160 2.676 2.563 2.808 . 0 0 "[ . 1 . 2]" 1
502 1 32 VAL H 1 32 VAL MG2 . . 3.150 2.551 2.231 2.779 . 0 0 "[ . 1 . 2]" 1
503 1 32 VAL H 1 33 VAL H . . 4.670 4.372 4.160 4.521 . 0 0 "[ . 1 . 2]" 1
504 1 32 VAL H 1 112 LEU QB . . 5.340 4.582 4.415 4.787 . 0 0 "[ . 1 . 2]" 1
505 1 32 VAL H 1 113 SER H . . 4.220 3.204 3.022 3.329 . 0 0 "[ . 1 . 2]" 1
506 1 32 VAL H 1 114 LEU H . . 4.930 4.775 4.555 4.953 0.023 7 0 "[ . 1 . 2]" 1
507 1 32 VAL H 1 114 LEU HA . . 3.940 3.053 2.707 3.345 . 0 0 "[ . 1 . 2]" 1
508 1 32 VAL H 1 114 LEU QD . . 4.130 3.510 2.725 4.380 0.250 15 0 "[ . 1 . 2]" 1
509 1 32 VAL HA 1 32 VAL MG1 . . 3.040 2.332 2.310 2.354 . 0 0 "[ . 1 . 2]" 1
510 1 32 VAL HA 1 66 ASP H . . 4.420 3.063 2.748 3.303 . 0 0 "[ . 1 . 2]" 1
511 1 32 VAL HA 1 66 ASP QB . . 3.690 2.415 2.071 2.930 . 0 0 "[ . 1 . 2]" 1
512 1 32 VAL HA 1 113 SER H . . 5.110 4.668 4.527 4.763 . 0 0 "[ . 1 . 2]" 1
513 1 32 VAL HB 1 112 LEU QD . . 4.810 3.983 3.654 4.742 . 0 0 "[ . 1 . 2]" 1
514 1 32 VAL HB 1 113 SER H . . 4.010 2.315 2.139 2.539 . 0 0 "[ . 1 . 2]" 1
515 1 32 VAL HB 1 113 SER HB2 . . 4.260 3.591 2.255 4.299 0.039 17 0 "[ . 1 . 2]" 1
516 1 32 VAL HB 1 113 SER QB . . 3.710 2.981 2.243 3.792 0.082 7 0 "[ . 1 . 2]" 1
517 1 32 VAL HB 1 113 SER HB3 . . 4.260 3.616 2.407 4.275 0.015 14 0 "[ . 1 . 2]" 1
518 1 32 VAL MG1 1 33 VAL H . . 3.130 2.791 2.642 3.133 0.003 11 0 "[ . 1 . 2]" 1
519 1 32 VAL MG1 1 113 SER H . . 3.930 3.593 3.415 3.796 . 0 0 "[ . 1 . 2]" 1
520 1 32 VAL MG2 1 66 ASP QB . . 3.410 2.437 2.312 2.597 . 0 0 "[ . 1 . 2]" 1
521 1 32 VAL MG2 1 113 SER QB . . 3.970 3.086 2.481 3.864 . 0 0 "[ . 1 . 2]" 1
522 1 32 VAL MG2 1 114 LEU H . . 5.060 4.632 3.854 5.060 . 0 0 "[ . 1 . 2]" 1
523 1 32 VAL MG2 1 115 GLU H . . 5.500 4.166 3.217 4.805 . 0 0 "[ . 1 . 2]" 1
524 1 33 VAL H 1 33 VAL QG . . 3.610 2.651 2.260 2.872 . 0 0 "[ . 1 . 2]" 1
525 1 33 VAL H 1 34 GLY H . . 4.910 4.428 4.269 4.589 . 0 0 "[ . 1 . 2]" 1
526 1 33 VAL H 1 65 LEU QD . . 4.580 3.634 2.905 4.372 . 0 0 "[ . 1 . 2]" 1
527 1 33 VAL H 1 66 ASP H . . 4.760 3.950 3.581 4.179 . 0 0 "[ . 1 . 2]" 1
528 1 33 VAL H 1 66 ASP HB2 . . 5.170 4.815 3.624 5.273 0.103 13 0 "[ . 1 . 2]" 1
529 1 33 VAL H 1 66 ASP QB . . 4.360 3.678 3.386 4.056 . 0 0 "[ . 1 . 2]" 1
530 1 33 VAL H 1 66 ASP HB3 . . 5.170 3.938 3.480 4.760 . 0 0 "[ . 1 . 2]" 1
531 1 33 VAL H 1 67 ILE HA . . 4.950 3.248 3.074 3.591 . 0 0 "[ . 1 . 2]" 1
532 1 33 VAL H 1 68 VAL H . . 4.840 3.549 3.184 4.023 . 0 0 "[ . 1 . 2]" 1
533 1 33 VAL H 1 68 VAL QG . . 3.930 3.514 3.111 4.096 0.166 2 0 "[ . 1 . 2]" 1
534 1 33 VAL H 1 112 LEU QD . . 4.650 3.991 3.652 5.177 0.527 13 1 "[ . 1 + . 2]" 1
535 1 33 VAL HA 1 112 LEU QD . . 4.180 3.383 2.820 4.104 . 0 0 "[ . 1 . 2]" 1
536 1 33 VAL HA 1 113 SER H . . 4.890 4.474 4.226 4.702 . 0 0 "[ . 1 . 2]" 1
537 1 33 VAL HB 1 34 GLY H . . 4.290 4.172 4.062 4.292 0.002 7 0 "[ . 1 . 2]" 1
538 1 33 VAL HB 1 65 LEU MD1 . . 4.590 3.133 2.180 4.361 . 0 0 "[ . 1 . 2]" 1
539 1 33 VAL HB 1 65 LEU QD . . 3.550 2.610 2.168 3.347 . 0 0 "[ . 1 . 2]" 1
540 1 33 VAL HB 1 65 LEU MD2 . . 4.590 3.716 2.426 4.657 0.067 10 0 "[ . 1 . 2]" 1
541 1 33 VAL HB 1 66 ASP H . . 5.500 5.061 4.324 5.528 0.028 2 0 "[ . 1 . 2]" 1
542 1 33 VAL QG 1 34 GLY H . . 3.540 2.538 2.192 2.826 . 0 0 "[ . 1 . 2]" 1
543 1 33 VAL QG 1 46 PHE QE . . 3.010 2.152 1.977 2.814 . 0 0 "[ . 1 . 2]" 1
544 1 33 VAL QG 1 65 LEU QD . . 2.680 2.149 1.944 2.660 . 0 0 "[ . 1 . 2]" 1
545 1 33 VAL QG 1 66 ASP H . . 4.820 4.022 3.528 4.583 . 0 0 "[ . 1 . 2]" 1
546 1 33 VAL QG 1 109 MET ME . . 2.750 2.087 1.900 2.664 . 0 0 "[ . 1 . 2]" 1
547 1 33 VAL QG 1 110 ARG H . . 4.040 3.369 3.157 3.617 . 0 0 "[ . 1 . 2]" 1
548 1 33 VAL QG 1 111 LEU H . . 4.040 3.694 3.274 4.167 0.127 17 0 "[ . 1 . 2]" 1
549 1 33 VAL QG 1 111 LEU HA . . 3.510 2.333 2.081 2.658 . 0 0 "[ . 1 . 2]" 1
550 1 33 VAL MG1 1 46 PHE QE . . 3.520 2.355 2.107 3.013 . 0 0 "[ . 1 . 2]" 1
551 1 33 VAL MG2 1 46 PHE QE . . 3.520 2.572 2.164 3.375 . 0 0 "[ . 1 . 2]" 1
552 1 34 GLY H 1 35 ILE H . . 4.510 4.400 4.036 4.537 0.027 7 0 "[ . 1 . 2]" 1
553 1 34 GLY H 1 68 VAL HB . . 5.500 4.545 4.017 4.805 . 0 0 "[ . 1 . 2]" 1
554 1 34 GLY H 1 109 MET QB . . 5.340 4.849 4.255 5.455 0.115 10 0 "[ . 1 . 2]" 1
555 1 34 GLY H 1 110 ARG H . . 4.370 3.352 3.083 3.594 . 0 0 "[ . 1 . 2]" 1
556 1 34 GLY H 1 111 LEU H . . 5.500 4.824 4.657 4.923 . 0 0 "[ . 1 . 2]" 1
557 1 34 GLY H 1 111 LEU HA . . 4.490 3.248 2.983 3.576 . 0 0 "[ . 1 . 2]" 1
558 1 34 GLY H 1 112 LEU HA . . 5.120 5.106 4.498 5.286 0.166 5 0 "[ . 1 . 2]" 1
559 1 34 GLY H 1 112 LEU QB . . 5.340 4.035 2.477 4.609 . 0 0 "[ . 1 . 2]" 1
560 1 34 GLY H 1 112 LEU QD . . 3.870 2.763 1.942 3.328 . 0 0 "[ . 1 . 2]" 1
561 1 34 GLY H 1 112 LEU HG . . 5.500 3.477 2.211 5.502 0.002 4 0 "[ . 1 . 2]" 1
562 1 34 GLY HA2 1 35 ILE HB . . 5.040 4.708 4.545 4.808 . 0 0 "[ . 1 . 2]" 1
563 1 34 GLY HA2 1 35 ILE MD . . 5.500 5.336 5.090 5.518 0.018 3 0 "[ . 1 . 2]" 1
564 1 34 GLY HA2 1 68 VAL H . . 4.760 3.127 2.670 3.349 . 0 0 "[ . 1 . 2]" 1
565 1 34 GLY HA2 1 68 VAL HB . . 3.700 2.357 2.173 2.631 . 0 0 "[ . 1 . 2]" 1
566 1 34 GLY HA2 1 68 VAL QG . . 4.020 3.243 3.039 3.414 . 0 0 "[ . 1 . 2]" 1
567 1 34 GLY HA2 1 112 LEU QD . . 3.990 2.834 2.475 3.379 . 0 0 "[ . 1 . 2]" 1
568 1 34 GLY HA3 1 68 VAL H . . 5.110 4.752 4.364 4.958 . 0 0 "[ . 1 . 2]" 1
569 1 34 GLY HA3 1 68 VAL HB . . 4.500 3.582 3.172 3.949 . 0 0 "[ . 1 . 2]" 1
570 1 34 GLY HA3 1 70 GLU QB . . 4.950 4.128 3.322 4.737 . 0 0 "[ . 1 . 2]" 1
571 1 34 GLY HA3 1 70 GLU QG . . 4.990 2.626 2.173 3.785 . 0 0 "[ . 1 . 2]" 1
572 1 34 GLY HA3 1 110 ARG H . . 5.050 3.875 3.713 4.118 . 0 0 "[ . 1 . 2]" 1
573 1 34 GLY HA3 1 112 LEU MD1 . . 3.990 2.685 2.212 4.014 0.024 13 0 "[ . 1 . 2]" 1
574 1 34 GLY HA3 1 112 LEU MD2 . . 3.990 2.900 2.137 3.429 . 0 0 "[ . 1 . 2]" 1
575 1 34 GLY HA3 1 112 LEU HG . . 5.290 3.654 2.474 5.325 0.035 4 0 "[ . 1 . 2]" 1
576 1 35 ILE H 1 35 ILE HB . . 3.790 2.743 2.556 2.833 . 0 0 "[ . 1 . 2]" 1
577 1 35 ILE H 1 35 ILE MD . . 4.470 4.273 4.069 4.396 . 0 0 "[ . 1 . 2]" 1
578 1 35 ILE H 1 35 ILE QG . . 3.570 2.846 2.681 2.968 . 0 0 "[ . 1 . 2]" 1
579 1 35 ILE H 1 35 ILE MG . . 3.930 3.927 3.867 3.954 0.024 20 0 "[ . 1 . 2]" 1
580 1 35 ILE H 1 36 GLY H . . 4.930 4.316 4.205 4.483 . 0 0 "[ . 1 . 2]" 1
581 1 35 ILE H 1 67 ILE MG . . 4.210 3.595 2.858 4.059 . 0 0 "[ . 1 . 2]" 1
582 1 35 ILE H 1 68 VAL H . . 4.360 3.835 3.401 4.362 0.002 10 0 "[ . 1 . 2]" 1
583 1 35 ILE H 1 69 ASP H . . 5.500 4.998 4.896 5.144 . 0 0 "[ . 1 . 2]" 1
584 1 35 ILE H 1 69 ASP HA . . 4.280 3.590 3.307 3.757 . 0 0 "[ . 1 . 2]" 1
585 1 35 ILE H 1 70 GLU H . . 3.910 3.083 2.676 3.579 . 0 0 "[ . 1 . 2]" 1
586 1 35 ILE H 1 70 GLU QB . . 4.010 3.538 2.553 4.019 0.009 9 0 "[ . 1 . 2]" 1
587 1 35 ILE H 1 70 GLU QG . . 4.320 3.189 2.676 4.368 0.048 10 0 "[ . 1 . 2]" 1
588 1 35 ILE H 1 112 LEU QD . . 5.230 4.441 4.077 4.835 . 0 0 "[ . 1 . 2]" 1
589 1 35 ILE HA 1 35 ILE MD . . 4.150 3.803 3.740 3.854 . 0 0 "[ . 1 . 2]" 1
590 1 35 ILE HA 1 35 ILE MG . . 3.520 2.388 2.340 2.461 . 0 0 "[ . 1 . 2]" 1
591 1 35 ILE HA 1 36 GLY H . . 3.540 2.129 2.044 2.224 . 0 0 "[ . 1 . 2]" 1
592 1 35 ILE HA 1 41 MET ME . . 5.500 4.583 3.676 5.267 . 0 0 "[ . 1 . 2]" 1
593 1 35 ILE HA 1 67 ILE MG . . 5.500 4.899 4.394 5.299 . 0 0 "[ . 1 . 2]" 1
594 1 35 ILE HA 1 109 MET HA . . 4.310 2.590 2.310 2.973 . 0 0 "[ . 1 . 2]" 1
595 1 35 ILE HA 1 109 MET ME . . 5.500 4.778 4.064 5.567 0.067 5 0 "[ . 1 . 2]" 1
596 1 35 ILE HA 1 110 ARG H . . 4.800 3.841 3.581 4.030 . 0 0 "[ . 1 . 2]" 1
597 1 35 ILE HB 1 35 ILE MD . . 3.500 2.537 2.475 2.618 . 0 0 "[ . 1 . 2]" 1
598 1 35 ILE HB 1 67 ILE MG . . 3.300 2.858 2.349 3.186 . 0 0 "[ . 1 . 2]" 1
599 1 35 ILE HB 1 70 GLU H . . 4.610 4.290 4.065 4.519 . 0 0 "[ . 1 . 2]" 1
600 1 35 ILE MD 1 35 ILE MG . . 2.730 2.056 2.028 2.079 . 0 0 "[ . 1 . 2]" 1
601 1 35 ILE MD 1 36 GLY H . . 5.020 5.082 5.031 5.123 0.103 2 0 "[ . 1 . 2]" 1
602 1 35 ILE MD 1 41 MET H . . 5.500 5.342 4.747 5.527 0.027 14 0 "[ . 1 . 2]" 1
603 1 35 ILE MD 1 43 LYS HA . . 4.620 2.842 2.257 3.583 . 0 0 "[ . 1 . 2]" 1
604 1 35 ILE MD 1 43 LYS HB3 . . 3.530 2.647 2.177 2.904 . 0 0 "[ . 1 . 2]" 1
605 1 35 ILE MD 1 43 LYS QE . . 4.130 3.471 2.405 4.105 . 0 0 "[ . 1 . 2]" 1
606 1 35 ILE MD 1 43 LYS QG . . 4.570 4.336 3.938 4.611 0.041 20 0 "[ . 1 . 2]" 1
607 1 35 ILE MD 1 46 PHE QD . . 3.790 2.918 2.376 3.532 . 0 0 "[ . 1 . 2]" 1
608 1 35 ILE MD 1 67 ILE HA . . 4.410 4.266 3.860 4.461 0.051 5 0 "[ . 1 . 2]" 1
609 1 35 ILE MD 1 67 ILE HB . . 4.980 4.561 4.251 4.983 0.003 8 0 "[ . 1 . 2]" 1
610 1 35 ILE MD 1 67 ILE MD . . 4.470 3.265 2.337 3.986 . 0 0 "[ . 1 . 2]" 1
611 1 35 ILE MD 1 67 ILE MG . . 3.290 2.195 2.034 2.457 . 0 0 "[ . 1 . 2]" 1
612 1 35 ILE MD 1 109 MET HA . . 5.500 5.184 4.838 5.468 . 0 0 "[ . 1 . 2]" 1
613 1 35 ILE MD 1 109 MET ME . . 3.600 3.061 2.415 3.606 0.006 5 0 "[ . 1 . 2]" 1
614 1 35 ILE MD 1 109 MET QG . . 4.530 3.913 2.655 4.560 0.030 13 0 "[ . 1 . 2]" 1
615 1 35 ILE QG 1 67 ILE MG . . 4.450 2.426 2.158 2.871 . 0 0 "[ . 1 . 2]" 1
616 1 35 ILE QG 1 109 MET HA . . 4.260 3.725 3.387 4.034 . 0 0 "[ . 1 . 2]" 1
617 1 35 ILE QG 1 109 MET ME . . 4.400 2.931 2.122 3.829 . 0 0 "[ . 1 . 2]" 1
618 1 35 ILE QG 1 110 ARG H . . 5.160 3.995 3.682 4.324 . 0 0 "[ . 1 . 2]" 1
619 1 35 ILE MG 1 36 GLY H . . 3.810 2.691 2.540 2.916 . 0 0 "[ . 1 . 2]" 1
620 1 35 ILE MG 1 36 GLY HA2 . . 4.820 4.315 4.254 4.437 . 0 0 "[ . 1 . 2]" 1
621 1 35 ILE MG 1 39 SER H . . 4.520 4.077 3.845 4.410 . 0 0 "[ . 1 . 2]" 1
622 1 35 ILE MG 1 39 SER QB . . 4.090 2.581 2.223 3.323 . 0 0 "[ . 1 . 2]" 1
623 1 35 ILE MG 1 41 MET H . . 4.310 3.706 3.275 4.004 . 0 0 "[ . 1 . 2]" 1
624 1 35 ILE MG 1 41 MET QB . . 4.300 2.932 2.146 4.030 . 0 0 "[ . 1 . 2]" 1
625 1 35 ILE MG 1 41 MET ME . . 3.540 3.054 2.111 3.582 0.042 14 0 "[ . 1 . 2]" 1
626 1 35 ILE MG 1 41 MET QG . . 4.540 3.510 2.133 4.586 0.046 15 0 "[ . 1 . 2]" 1
627 1 35 ILE MG 1 43 LYS HA . . 4.900 4.357 3.707 4.906 0.006 4 0 "[ . 1 . 2]" 1
628 1 35 ILE MG 1 70 GLU H . . 5.230 4.663 4.452 4.860 . 0 0 "[ . 1 . 2]" 1
629 1 35 ILE MG 1 109 MET HA . . 4.260 3.982 3.555 4.226 . 0 0 "[ . 1 . 2]" 1
630 1 35 ILE MG 1 109 MET QB . . 4.490 2.462 2.262 2.956 . 0 0 "[ . 1 . 2]" 1
631 1 35 ILE MG 1 109 MET HG2 . . 5.100 4.254 3.052 5.100 . 0 0 "[ . 1 . 2]" 1
632 1 35 ILE MG 1 109 MET HG3 . . 5.100 4.681 3.609 5.132 0.032 20 0 "[ . 1 . 2]" 1
633 1 36 GLY H 1 37 GLU H . . 5.370 4.682 4.563 4.748 . 0 0 "[ . 1 . 2]" 1
634 1 36 GLY H 1 39 SER HB2 . . 4.850 3.498 2.768 4.721 . 0 0 "[ . 1 . 2]" 1
635 1 36 GLY H 1 39 SER QB . . 4.270 3.078 2.704 3.401 . 0 0 "[ . 1 . 2]" 1
636 1 36 GLY H 1 39 SER HB3 . . 4.850 3.785 2.847 4.653 . 0 0 "[ . 1 . 2]" 1
637 1 36 GLY H 1 109 MET HA . . 4.330 3.273 2.804 3.698 . 0 0 "[ . 1 . 2]" 1
638 1 36 GLY H 1 110 ARG H . . 5.390 5.188 4.790 5.443 0.053 6 0 "[ . 1 . 2]" 1
639 1 36 GLY HA2 1 37 GLU HB3 . . 4.980 4.481 4.195 4.646 . 0 0 "[ . 1 . 2]" 1
640 1 36 GLY HA2 1 38 ARG H . . 4.680 3.962 3.871 4.277 . 0 0 "[ . 1 . 2]" 1
641 1 36 GLY HA2 1 39 SER H . . 4.990 4.510 4.209 4.733 . 0 0 "[ . 1 . 2]" 1
642 1 36 GLY HA2 1 70 GLU H . . 4.520 3.256 2.906 3.614 . 0 0 "[ . 1 . 2]" 1
643 1 36 GLY HA2 1 70 GLU QB . . 4.360 2.258 2.103 2.546 . 0 0 "[ . 1 . 2]" 1
644 1 36 GLY HA2 1 106 GLY QA . . 3.990 3.214 2.677 3.727 . 0 0 "[ . 1 . 2]" 1
645 1 36 GLY HA3 1 70 GLU H . . 5.440 4.843 4.543 5.148 . 0 0 "[ . 1 . 2]" 1
646 1 36 GLY HA3 1 106 GLY HA2 . . 4.510 3.160 2.449 4.013 . 0 0 "[ . 1 . 2]" 1
647 1 36 GLY HA3 1 106 GLY HA3 . . 4.510 3.484 2.899 4.098 . 0 0 "[ . 1 . 2]" 1
648 1 37 GLU H 1 37 GLU HB2 . . 3.990 3.612 3.546 3.672 . 0 0 "[ . 1 . 2]" 1
649 1 37 GLU H 1 37 GLU HB3 . . 3.580 2.573 2.351 2.772 . 0 0 "[ . 1 . 2]" 1
650 1 37 GLU H 1 37 GLU HG2 . . 3.840 2.342 1.955 3.860 0.020 4 0 "[ . 1 . 2]" 1
651 1 37 GLU H 1 37 GLU QG . . 3.320 2.265 1.925 3.433 0.113 4 0 "[ . 1 . 2]" 1
652 1 37 GLU H 1 37 GLU HG3 . . 3.840 3.264 2.861 3.847 0.007 4 0 "[ . 1 . 2]" 1
653 1 37 GLU H 1 38 ARG H . . 3.780 2.727 2.540 2.801 . 0 0 "[ . 1 . 2]" 1
654 1 37 GLU H 1 38 ARG HA . . 5.310 5.423 5.321 5.462 0.152 6 0 "[ . 1 . 2]" 1
655 1 37 GLU H 1 38 ARG QB . . 4.880 4.813 4.320 4.929 0.049 10 0 "[ . 1 . 2]" 1
656 1 37 GLU H 1 38 ARG QG . . 5.500 4.696 4.378 5.646 0.146 11 0 "[ . 1 . 2]" 1
657 1 37 GLU H 1 39 SER H . . 4.240 4.158 3.869 4.320 0.080 15 0 "[ . 1 . 2]" 1
658 1 37 GLU H 1 70 GLU H . . 4.520 3.979 3.694 4.269 . 0 0 "[ . 1 . 2]" 1
659 1 37 GLU H 1 70 GLU QB . . 4.300 3.757 3.199 4.012 . 0 0 "[ . 1 . 2]" 1
660 1 37 GLU H 1 72 VAL H . . 5.500 4.666 3.602 5.218 . 0 0 "[ . 1 . 2]" 1
661 1 37 GLU H 1 72 VAL QG . . 4.410 2.912 2.047 5.014 0.604 13 1 "[ . 1 + . 2]" 1
662 1 37 GLU H 1 106 GLY QA . . 4.440 4.178 3.230 4.521 0.081 4 0 "[ . 1 . 2]" 1
663 1 37 GLU HA 1 37 GLU HG2 . . 4.030 3.816 3.690 3.946 . 0 0 "[ . 1 . 2]" 1
664 1 37 GLU HA 1 37 GLU QG . . 3.460 3.390 3.354 3.549 0.089 13 0 "[ . 1 . 2]" 1
665 1 37 GLU HA 1 37 GLU HG3 . . 4.030 3.804 3.698 4.180 0.150 13 0 "[ . 1 . 2]" 1
666 1 37 GLU HA 1 38 ARG QD . . 5.250 4.834 4.223 5.113 . 0 0 "[ . 1 . 2]" 1
667 1 37 GLU HA 1 39 SER H . . 4.130 3.914 3.641 4.145 0.015 13 0 "[ . 1 . 2]" 1
668 1 37 GLU HA 1 70 GLU H . . 4.800 4.844 4.732 4.903 0.103 16 0 "[ . 1 . 2]" 1
669 1 37 GLU HB2 1 38 ARG H . . 4.410 4.207 4.074 4.346 . 0 0 "[ . 1 . 2]" 1
670 1 37 GLU HB2 1 72 VAL QG . . 4.910 4.445 4.076 5.465 0.555 4 1 "[ +. 1 . 2]" 1
671 1 37 GLU HB3 1 70 GLU H . . 4.610 4.469 4.106 4.625 0.015 9 0 "[ . 1 . 2]" 1
672 1 37 GLU QG 1 38 ARG H . . 3.530 2.921 2.662 3.233 . 0 0 "[ . 1 . 2]" 1
673 1 37 GLU QG 1 38 ARG QB . . 5.060 3.844 3.630 4.342 . 0 0 "[ . 1 . 2]" 1
674 1 37 GLU QG 1 38 ARG QG . . 5.340 2.547 2.137 4.030 . 0 0 "[ . 1 . 2]" 1
675 1 37 GLU QG 1 39 SER H . . 5.340 4.829 4.568 5.116 . 0 0 "[ . 1 . 2]" 1
676 1 37 GLU QG 1 71 LYS H . . 4.940 4.902 4.617 5.035 0.095 4 0 "[ . 1 . 2]" 1
677 1 37 GLU QG 1 71 LYS HA . . 3.530 2.604 2.233 3.002 . 0 0 "[ . 1 . 2]" 1
678 1 37 GLU QG 1 71 LYS QD . . 5.340 4.171 2.471 5.422 0.082 9 0 "[ . 1 . 2]" 1
679 1 37 GLU QG 1 72 VAL H . . 4.050 3.079 2.303 3.763 . 0 0 "[ . 1 . 2]" 1
680 1 37 GLU QG 1 72 VAL QG . . 4.030 2.294 1.927 4.313 0.283 4 0 "[ . 1 . 2]" 1
681 1 37 GLU HG2 1 38 ARG H . . 4.260 3.443 3.049 3.877 . 0 0 "[ . 1 . 2]" 1
682 1 37 GLU HG2 1 72 VAL H . . 4.880 3.259 2.342 4.475 . 0 0 "[ . 1 . 2]" 1
683 1 37 GLU HG3 1 38 ARG H . . 4.260 3.242 2.721 4.289 0.029 13 0 "[ . 1 . 2]" 1
684 1 37 GLU HG3 1 72 VAL H . . 4.880 4.073 2.891 4.793 . 0 0 "[ . 1 . 2]" 1
685 1 38 ARG H 1 38 ARG HB2 . . 3.710 2.591 2.385 2.735 . 0 0 "[ . 1 . 2]" 1
686 1 38 ARG H 1 38 ARG QB . . 3.050 2.545 2.351 2.677 . 0 0 "[ . 1 . 2]" 1
687 1 38 ARG H 1 38 ARG HB3 . . 3.710 3.739 3.554 3.798 0.088 18 0 "[ . 1 . 2]" 1
688 1 38 ARG H 1 38 ARG QD . . 3.900 3.685 2.997 3.955 0.055 19 0 "[ . 1 . 2]" 1
689 1 38 ARG H 1 39 SER H . . 3.280 2.316 2.122 2.619 . 0 0 "[ . 1 . 2]" 1
690 1 38 ARG H 1 39 SER QB . . 4.370 4.290 3.788 4.433 0.063 13 0 "[ . 1 . 2]" 1
691 1 38 ARG H 1 40 ALA H . . 4.940 4.502 4.179 4.870 . 0 0 "[ . 1 . 2]" 1
692 1 38 ARG H 1 72 VAL QG . . 3.960 2.677 1.947 4.382 0.422 13 0 "[ . 1 . 2]" 1
693 1 38 ARG HA 1 38 ARG QD . . 3.330 2.244 2.085 3.309 . 0 0 "[ . 1 . 2]" 1
694 1 38 ARG HA 1 38 ARG QG . . 3.660 2.985 2.262 3.162 . 0 0 "[ . 1 . 2]" 1
695 1 38 ARG HA 1 39 SER H . . 3.520 3.231 3.136 3.369 . 0 0 "[ . 1 . 2]" 1
696 1 38 ARG HA 1 40 ALA MB . . 4.640 4.209 3.704 4.650 0.010 11 0 "[ . 1 . 2]" 1
697 1 38 ARG QB 1 38 ARG QD . . 3.370 2.656 2.295 3.013 . 0 0 "[ . 1 . 2]" 1
698 1 38 ARG QB 1 39 SER H . . 3.780 3.575 3.394 3.703 . 0 0 "[ . 1 . 2]" 1
699 1 38 ARG QB 1 72 VAL QG . . 2.940 2.269 2.032 3.399 0.459 13 0 "[ . 1 . 2]" 1
700 1 38 ARG HB2 1 39 SER H . . 4.520 3.799 3.565 3.995 . 0 0 "[ . 1 . 2]" 1
701 1 38 ARG HB3 1 39 SER H . . 4.520 4.361 4.048 4.461 . 0 0 "[ . 1 . 2]" 1
702 1 38 ARG QD 1 39 SER H . . 4.890 4.851 4.513 4.930 0.040 7 0 "[ . 1 . 2]" 1
703 1 38 ARG QD 1 72 VAL QG . . 3.840 3.444 2.090 4.569 0.729 4 1 "[ +. 1 . 2]" 1
704 1 39 SER H 1 39 SER HB2 . . 3.770 2.752 2.327 3.636 . 0 0 "[ . 1 . 2]" 1
705 1 39 SER H 1 39 SER QB . . 3.180 2.406 2.200 2.498 . 0 0 "[ . 1 . 2]" 1
706 1 39 SER H 1 39 SER HB3 . . 3.770 3.227 2.416 3.640 . 0 0 "[ . 1 . 2]" 1
707 1 39 SER H 1 40 ALA H . . 4.240 2.653 2.468 2.799 . 0 0 "[ . 1 . 2]" 1
708 1 39 SER H 1 40 ALA MB . . 4.840 4.729 4.494 4.858 0.018 15 0 "[ . 1 . 2]" 1
709 1 39 SER H 1 41 MET H . . 4.720 4.581 4.307 4.768 0.048 7 0 "[ . 1 . 2]" 1
710 1 39 SER H 1 41 MET ME . . 5.500 5.344 5.029 5.574 0.074 12 0 "[ . 1 . 2]" 1
711 1 39 SER H 1 72 VAL QG . . 4.670 4.196 3.349 5.921 1.251 13 1 "[ . 1 + . 2]" 1
712 1 39 SER HA 1 41 MET H . . 4.590 4.335 4.123 4.638 0.048 3 0 "[ . 1 . 2]" 1
713 1 39 SER QB 1 41 MET H . . 3.750 2.977 2.628 3.293 . 0 0 "[ . 1 . 2]" 1
714 1 39 SER QB 1 41 MET ME . . 3.360 2.327 2.081 3.337 . 0 0 "[ . 1 . 2]" 1
715 1 39 SER QB 1 41 MET QG . . 4.610 2.795 2.190 3.812 . 0 0 "[ . 1 . 2]" 1
716 1 39 SER HB2 1 40 ALA H . . 4.720 3.519 2.926 4.111 . 0 0 "[ . 1 . 2]" 1
717 1 39 SER HB2 1 41 MET H . . 4.310 3.351 2.981 4.407 0.097 19 0 "[ . 1 . 2]" 1
718 1 39 SER HB3 1 40 ALA H . . 4.720 3.944 2.645 4.241 . 0 0 "[ . 1 . 2]" 1
719 1 39 SER HB3 1 41 MET H . . 4.310 3.530 2.763 4.301 . 0 0 "[ . 1 . 2]" 1
720 1 40 ALA H 1 40 ALA MB . . 3.510 2.788 2.698 2.879 . 0 0 "[ . 1 . 2]" 1
721 1 40 ALA H 1 41 MET H . . 3.730 2.989 2.755 3.165 . 0 0 "[ . 1 . 2]" 1
722 1 40 ALA HA 1 41 MET H . . 3.300 3.153 2.951 3.329 0.029 16 0 "[ . 1 . 2]" 1
723 1 40 ALA MB 1 41 MET H . . 3.650 3.565 3.336 3.668 0.018 4 0 "[ . 1 . 2]" 1
724 1 41 MET H 1 41 MET HB2 . . 3.840 2.684 2.349 3.828 . 0 0 "[ . 1 . 2]" 1
725 1 41 MET H 1 41 MET QB . . 3.070 2.454 2.319 3.022 . 0 0 "[ . 1 . 2]" 1
726 1 41 MET H 1 41 MET HB3 . . 3.840 3.447 2.589 3.724 . 0 0 "[ . 1 . 2]" 1
727 1 41 MET H 1 41 MET ME . . 4.460 3.794 3.284 4.342 . 0 0 "[ . 1 . 2]" 1
728 1 41 MET H 1 41 MET HG2 . . 3.830 3.181 2.091 3.750 . 0 0 "[ . 1 . 2]" 1
729 1 41 MET H 1 41 MET QG . . 3.280 2.363 2.068 2.727 . 0 0 "[ . 1 . 2]" 1
730 1 41 MET H 1 41 MET HG3 . . 3.830 2.749 2.297 3.663 . 0 0 "[ . 1 . 2]" 1
731 1 41 MET H 1 42 ASP H . . 4.580 4.588 4.416 4.653 0.073 9 0 "[ . 1 . 2]" 1
732 1 41 MET HA 1 41 MET QG . . 3.670 2.594 2.265 3.383 . 0 0 "[ . 1 . 2]" 1
733 1 41 MET QB 1 42 ASP H . . 4.250 2.915 2.247 3.494 . 0 0 "[ . 1 . 2]" 1
734 1 41 MET HB2 1 42 ASP H . . 4.950 3.833 2.598 4.467 . 0 0 "[ . 1 . 2]" 1
735 1 41 MET HB3 1 42 ASP H . . 4.950 3.225 2.278 4.146 . 0 0 "[ . 1 . 2]" 1
736 1 41 MET ME 1 41 MET QG . . 3.370 2.317 2.135 2.453 . 0 0 "[ . 1 . 2]" 1
737 1 41 MET ME 1 108 GLU HA . . 4.050 3.263 2.323 4.010 . 0 0 "[ . 1 . 2]" 1
738 1 41 MET ME 1 109 MET H . . 3.840 2.620 1.939 3.391 . 0 0 "[ . 1 . 2]" 1
739 1 41 MET ME 1 109 MET HA . . 5.240 4.374 3.801 5.242 0.002 3 0 "[ . 1 . 2]" 1
740 1 41 MET QG 1 42 ASP H . . 4.960 3.969 3.661 4.648 . 0 0 "[ . 1 . 2]" 1
741 1 42 ASP H 1 43 LYS H . . 4.840 4.185 3.602 4.438 . 0 0 "[ . 1 . 2]" 1
742 1 42 ASP H 1 45 LEU QB . . 5.340 4.250 3.553 5.354 0.014 4 0 "[ . 1 . 2]" 1
743 1 42 ASP H 1 45 LEU QD . . 5.160 4.150 3.144 5.148 . 0 0 "[ . 1 . 2]" 1
744 1 42 ASP H 1 45 LEU HG . . 5.500 5.155 3.904 5.574 0.074 18 0 "[ . 1 . 2]" 1
745 1 42 ASP HA 1 43 LYS H . . 3.550 2.201 2.106 2.429 . 0 0 "[ . 1 . 2]" 1
746 1 42 ASP HA 1 44 SER H . . 4.020 3.674 3.475 3.871 . 0 0 "[ . 1 . 2]" 1
747 1 42 ASP HA 1 45 LEU H . . 4.780 4.310 4.060 4.685 . 0 0 "[ . 1 . 2]" 1
748 1 42 ASP QB 1 44 SER H . . 4.280 3.608 3.071 4.300 0.020 17 0 "[ . 1 . 2]" 1
749 1 42 ASP QB 1 45 LEU H . . 3.970 2.680 2.289 3.193 . 0 0 "[ . 1 . 2]" 1
750 1 42 ASP QB 1 45 LEU HA . . 4.980 4.579 4.198 5.048 0.068 2 0 "[ . 1 . 2]" 1
751 1 42 ASP QB 1 45 LEU QB . . 4.260 2.552 1.998 3.746 . 0 0 "[ . 1 . 2]" 1
752 1 42 ASP QB 1 45 LEU QD . . 4.040 2.805 2.170 3.846 . 0 0 "[ . 1 . 2]" 1
753 1 42 ASP HB2 1 43 LYS H . . 4.780 4.528 4.396 4.612 . 0 0 "[ . 1 . 2]" 1
754 1 42 ASP HB2 1 45 LEU H . . 4.750 3.642 3.019 4.626 . 0 0 "[ . 1 . 2]" 1
755 1 42 ASP HB3 1 43 LYS H . . 4.780 4.032 3.681 4.445 . 0 0 "[ . 1 . 2]" 1
756 1 42 ASP HB3 1 45 LEU H . . 4.750 2.768 2.324 3.303 . 0 0 "[ . 1 . 2]" 1
757 1 43 LYS H 1 43 LYS HB2 . . 3.630 3.574 3.548 3.616 . 0 0 "[ . 1 . 2]" 1
758 1 43 LYS H 1 43 LYS HB3 . . 3.740 2.467 2.353 2.625 . 0 0 "[ . 1 . 2]" 1
759 1 43 LYS H 1 43 LYS HD2 . . 4.650 4.023 1.968 4.630 . 0 0 "[ . 1 . 2]" 1
760 1 43 LYS H 1 43 LYS HD3 . . 4.650 4.554 3.488 4.758 0.108 10 0 "[ . 1 . 2]" 1
761 1 43 LYS H 1 43 LYS QE . . 4.920 4.081 3.269 4.789 . 0 0 "[ . 1 . 2]" 1
762 1 43 LYS H 1 43 LYS HG2 . . 4.330 2.265 2.062 2.830 . 0 0 "[ . 1 . 2]" 1
763 1 43 LYS H 1 43 LYS QG . . 3.640 2.238 2.044 2.766 . 0 0 "[ . 1 . 2]" 1
764 1 43 LYS H 1 43 LYS HG3 . . 4.330 3.512 3.154 3.892 . 0 0 "[ . 1 . 2]" 1
765 1 43 LYS H 1 44 SER H . . 3.450 2.866 2.794 2.954 . 0 0 "[ . 1 . 2]" 1
766 1 43 LYS H 1 44 SER QB . . 4.660 4.589 4.524 4.698 0.038 18 0 "[ . 1 . 2]" 1
767 1 43 LYS H 1 45 LEU H . . 4.490 4.456 4.242 4.543 0.053 5 0 "[ . 1 . 2]" 1
768 1 43 LYS HA 1 43 LYS QE . . 4.870 4.341 4.208 4.465 . 0 0 "[ . 1 . 2]" 1
769 1 43 LYS HA 1 43 LYS QG . . 3.730 3.389 3.373 3.483 . 0 0 "[ . 1 . 2]" 1
770 1 43 LYS HA 1 45 LEU H . . 4.720 4.376 4.016 4.624 . 0 0 "[ . 1 . 2]" 1
771 1 43 LYS HA 1 46 PHE H . . 4.000 3.360 2.963 3.634 . 0 0 "[ . 1 . 2]" 1
772 1 43 LYS HA 1 46 PHE HB2 . . 4.300 3.506 2.995 4.109 . 0 0 "[ . 1 . 2]" 1
773 1 43 LYS HA 1 46 PHE HB3 . . 4.300 2.568 2.176 2.988 . 0 0 "[ . 1 . 2]" 1
774 1 43 LYS HA 1 46 PHE QD . . 4.480 3.789 2.953 4.506 0.026 18 0 "[ . 1 . 2]" 1
775 1 43 LYS HA 1 47 VAL H . . 4.520 3.974 3.713 4.261 . 0 0 "[ . 1 . 2]" 1
776 1 43 LYS HA 1 47 VAL QG . . 4.340 4.710 4.560 4.987 0.647 7 2 "[ . + 1 . - 2]" 1
777 1 43 LYS HA 1 67 ILE MD . . 4.540 3.432 2.625 3.988 . 0 0 "[ . 1 . 2]" 1
778 1 43 LYS HB2 1 43 LYS QE . . 4.850 2.645 2.144 3.134 . 0 0 "[ . 1 . 2]" 1
779 1 43 LYS HB2 1 44 SER H . . 3.760 3.802 3.758 3.845 0.085 17 0 "[ . 1 . 2]" 1
780 1 43 LYS HB2 1 47 VAL H . . 5.270 4.819 4.410 5.274 0.004 18 0 "[ . 1 . 2]" 1
781 1 43 LYS HB2 1 47 VAL QG . . 4.030 4.526 4.281 4.932 0.902 18 9 "[ . ***1 *.**+*-]" 1
782 1 43 LYS HB3 1 46 PHE QB . . 5.340 4.604 4.105 5.066 . 0 0 "[ . 1 . 2]" 1
783 1 43 LYS QE 1 43 LYS QG . . 3.460 2.467 2.287 2.902 . 0 0 "[ . 1 . 2]" 1
784 1 43 LYS QE 1 67 ILE MD . . 3.690 3.301 2.526 3.759 0.069 11 0 "[ . 1 . 2]" 1
785 1 43 LYS QE 1 67 ILE MG . . 3.920 2.155 1.922 2.885 . 0 0 "[ . 1 . 2]" 1
786 1 43 LYS QG 1 44 SER H . . 3.550 2.244 1.909 2.371 . 0 0 "[ . 1 . 2]" 1
787 1 43 LYS QG 1 44 SER HA . . 4.220 3.610 3.496 3.828 . 0 0 "[ . 1 . 2]" 1
788 1 43 LYS QG 1 44 SER QB . . 4.450 3.259 3.061 3.716 . 0 0 "[ . 1 . 2]" 1
789 1 43 LYS QG 1 47 VAL H . . 5.340 5.357 5.238 5.400 0.060 15 0 "[ . 1 . 2]" 1
790 1 43 LYS QG 1 67 ILE MD . . 3.720 3.251 2.716 3.776 0.056 2 0 "[ . 1 . 2]" 1
791 1 43 LYS QG 1 67 ILE MG . . 4.920 3.727 2.656 4.236 . 0 0 "[ . 1 . 2]" 1
792 1 43 LYS HG2 1 67 ILE MD . . 4.500 4.419 4.028 4.618 0.118 2 0 "[ . 1 . 2]" 1
793 1 43 LYS HG3 1 67 ILE MD . . 4.500 3.358 2.761 4.006 . 0 0 "[ . 1 . 2]" 1
794 1 44 SER H 1 44 SER QB . . 2.980 2.264 2.233 2.464 . 0 0 "[ . 1 . 2]" 1
795 1 44 SER H 1 45 LEU H . . 3.140 2.781 2.582 2.882 . 0 0 "[ . 1 . 2]" 1
796 1 44 SER H 1 45 LEU QD . . 5.440 5.296 4.488 5.749 0.309 18 0 "[ . 1 . 2]" 1
797 1 44 SER H 1 47 VAL QG . . 4.530 4.338 4.119 4.528 . 0 0 "[ . 1 . 2]" 1
798 1 44 SER HA 1 46 PHE H . . 4.810 4.617 4.442 4.793 . 0 0 "[ . 1 . 2]" 1
799 1 44 SER HA 1 47 VAL H . . 4.020 3.896 3.680 4.029 0.009 6 0 "[ . 1 . 2]" 1
800 1 44 SER HA 1 47 VAL HB . . 4.950 4.513 4.374 4.806 . 0 0 "[ . 1 . 2]" 1
801 1 44 SER HA 1 47 VAL QG . . 4.070 2.268 2.113 2.518 . 0 0 "[ . 1 . 2]" 1
802 1 44 SER QB 1 45 LEU H . . 3.500 2.590 2.468 2.755 . 0 0 "[ . 1 . 2]" 1
803 1 44 SER QB 1 46 PHE H . . 5.310 4.808 4.667 4.924 . 0 0 "[ . 1 . 2]" 1
804 1 45 LEU H 1 45 LEU HB2 . . 3.680 2.612 2.336 2.867 . 0 0 "[ . 1 . 2]" 1
805 1 45 LEU H 1 45 LEU QB . . 3.070 2.399 2.185 2.776 . 0 0 "[ . 1 . 2]" 1
806 1 45 LEU H 1 45 LEU HB3 . . 3.680 2.920 2.354 3.712 0.032 2 0 "[ . 1 . 2]" 1
807 1 45 LEU H 1 45 LEU MD1 . . 4.420 4.073 3.693 4.389 . 0 0 "[ . 1 . 2]" 1
808 1 45 LEU H 1 45 LEU QD . . 3.490 3.409 2.731 3.778 0.288 9 0 "[ . 1 . 2]" 1
809 1 45 LEU H 1 45 LEU MD2 . . 4.420 3.708 2.811 4.248 . 0 0 "[ . 1 . 2]" 1
810 1 45 LEU H 1 46 PHE H . . 3.470 2.653 2.375 2.854 . 0 0 "[ . 1 . 2]" 1
811 1 45 LEU H 1 46 PHE QB . . 5.010 4.388 4.026 4.646 . 0 0 "[ . 1 . 2]" 1
812 1 45 LEU H 1 47 VAL QG . . 4.670 4.483 4.312 4.640 . 0 0 "[ . 1 . 2]" 1
813 1 45 LEU HA 1 45 LEU QD . . 2.980 2.233 2.116 2.413 . 0 0 "[ . 1 . 2]" 1
814 1 45 LEU HA 1 45 LEU HG . . 3.740 3.466 3.218 3.772 0.032 14 0 "[ . 1 . 2]" 1
815 1 45 LEU HA 1 47 VAL H . . 4.990 4.945 4.761 5.029 0.039 14 0 "[ . 1 . 2]" 1
816 1 45 LEU QB 1 45 LEU QD . . 2.520 2.007 1.961 2.091 . 0 0 "[ . 1 . 2]" 1
817 1 45 LEU QB 1 46 PHE H . . 3.530 2.508 2.348 2.685 . 0 0 "[ . 1 . 2]" 1
818 1 45 LEU QB 1 47 VAL H . . 5.340 5.099 4.956 5.231 . 0 0 "[ . 1 . 2]" 1
819 1 45 LEU HB2 1 46 PHE H . . 4.140 3.396 2.478 4.045 . 0 0 "[ . 1 . 2]" 1
820 1 45 LEU HB3 1 46 PHE H . . 4.140 2.991 2.376 3.950 . 0 0 "[ . 1 . 2]" 1
821 1 45 LEU QD 1 46 PHE H . . 4.870 3.709 3.072 3.992 . 0 0 "[ . 1 . 2]" 1
822 1 45 LEU HG 1 46 PHE HA . . 5.500 5.016 3.684 5.837 0.337 2 0 "[ . 1 . 2]" 1
823 1 46 PHE H 1 46 PHE HB2 . . 3.780 2.624 2.494 2.784 . 0 0 "[ . 1 . 2]" 1
824 1 46 PHE H 1 46 PHE HB3 . . 3.780 2.472 2.227 2.662 . 0 0 "[ . 1 . 2]" 1
825 1 46 PHE H 1 46 PHE QD . . 4.250 4.215 4.064 4.283 0.033 16 0 "[ . 1 . 2]" 1
826 1 46 PHE H 1 47 VAL HB . . 5.500 5.442 5.236 5.544 0.044 14 0 "[ . 1 . 2]" 1
827 1 46 PHE H 1 47 VAL QG . . 4.240 4.279 4.060 4.441 0.201 10 0 "[ . 1 . 2]" 1
828 1 46 PHE HA 1 46 PHE QD . . 4.030 2.481 2.296 2.739 . 0 0 "[ . 1 . 2]" 1
829 1 46 PHE HA 1 49 ALA MB . . 3.240 2.828 2.700 2.948 . 0 0 "[ . 1 . 2]" 1
830 1 46 PHE HA 1 65 LEU QD . . 5.200 5.040 4.799 5.756 0.556 14 1 "[ . 1 +. 2]" 1
831 1 46 PHE QB 1 47 VAL QG . . 5.170 4.098 3.945 4.323 . 0 0 "[ . 1 . 2]" 1
832 1 46 PHE QB 1 67 ILE MD . . 5.010 3.719 2.885 4.572 . 0 0 "[ . 1 . 2]" 1
833 1 46 PHE QB 1 109 MET ME . . 5.340 4.000 3.272 4.975 . 0 0 "[ . 1 . 2]" 1
834 1 46 PHE HB2 1 47 VAL H . . 4.100 3.919 3.803 4.045 . 0 0 "[ . 1 . 2]" 1
835 1 46 PHE HB3 1 47 VAL H . . 4.100 2.522 2.416 2.698 . 0 0 "[ . 1 . 2]" 1
836 1 46 PHE QD 1 47 VAL H . . 4.240 3.299 2.754 3.533 . 0 0 "[ . 1 . 2]" 1
837 1 46 PHE QD 1 47 VAL HA . . 4.750 3.992 3.748 4.224 . 0 0 "[ . 1 . 2]" 1
838 1 46 PHE QD 1 47 VAL MG1 . . 4.770 4.692 4.166 4.815 0.045 20 0 "[ . 1 . 2]" 1
839 1 46 PHE QD 1 47 VAL QG . . 3.870 4.222 3.926 4.284 0.414 20 0 "[ . 1 . 2]" 1
840 1 46 PHE QD 1 47 VAL MG2 . . 4.770 4.800 4.774 4.840 0.070 4 0 "[ . 1 . 2]" 1
841 1 46 PHE QD 1 49 ALA H . . 5.500 5.301 5.162 5.526 0.026 14 0 "[ . 1 . 2]" 1
842 1 46 PHE QD 1 50 PHE H . . 4.760 4.785 4.459 4.849 0.089 9 0 "[ . 1 . 2]" 1
843 1 46 PHE QD 1 50 PHE QB . . 4.820 4.408 4.108 4.613 . 0 0 "[ . 1 . 2]" 1
844 1 46 PHE QD 1 65 LEU HG . . 4.440 4.329 3.317 4.615 0.175 6 0 "[ . 1 . 2]" 1
845 1 46 PHE QD 1 67 ILE MD . . 3.910 3.072 2.089 3.927 0.017 8 0 "[ . 1 . 2]" 1
846 1 46 PHE QD 1 67 ILE MG . . 4.400 4.249 3.410 4.452 0.052 6 0 "[ . 1 . 2]" 1
847 1 46 PHE QE 1 47 VAL HA . . 5.390 4.785 4.334 5.093 . 0 0 "[ . 1 . 2]" 1
848 1 46 PHE QE 1 50 PHE QB . . 4.480 4.102 3.516 4.465 . 0 0 "[ . 1 . 2]" 1
849 1 46 PHE QE 1 65 LEU QD . . 3.450 2.033 1.913 2.136 . 0 0 "[ . 1 . 2]" 1
850 1 46 PHE QE 1 65 LEU HG . . 4.590 3.672 2.655 4.167 . 0 0 "[ . 1 . 2]" 1
851 1 46 PHE QE 1 109 MET ME . . 3.100 2.819 2.594 3.056 . 0 0 "[ . 1 . 2]" 1
852 1 47 VAL H 1 47 VAL HB . . 3.480 2.444 2.331 2.556 . 0 0 "[ . 1 . 2]" 1
853 1 47 VAL H 1 47 VAL MG1 . . 3.890 2.346 2.211 2.515 . 0 0 "[ . 1 . 2]" 1
854 1 47 VAL H 1 47 VAL QG . . 3.000 2.325 2.198 2.482 . 0 0 "[ . 1 . 2]" 1
855 1 47 VAL H 1 47 VAL MG2 . . 3.890 3.816 3.750 3.856 . 0 0 "[ . 1 . 2]" 1
856 1 47 VAL H 1 48 SER H . . 3.270 2.823 2.730 2.947 . 0 0 "[ . 1 . 2]" 1
857 1 47 VAL H 1 49 ALA H . . 4.280 4.196 4.099 4.287 0.007 14 0 "[ . 1 . 2]" 1
858 1 47 VAL H 1 65 LEU MD1 . . 5.160 4.934 3.901 5.286 0.126 14 0 "[ . 1 . 2]" 1
859 1 47 VAL H 1 65 LEU QD . . 4.450 3.760 3.211 4.665 0.215 14 0 "[ . 1 . 2]" 1
860 1 47 VAL H 1 65 LEU MD2 . . 5.160 3.954 3.241 5.190 0.030 14 0 "[ . 1 . 2]" 1
861 1 47 VAL H 1 67 ILE MD . . 4.340 3.347 2.943 3.712 . 0 0 "[ . 1 . 2]" 1
862 1 47 VAL H 1 67 ILE QG . . 5.340 4.701 4.328 5.248 . 0 0 "[ . 1 . 2]" 1
863 1 47 VAL HA 1 47 VAL MG1 . . 3.470 3.291 3.281 3.301 . 0 0 "[ . 1 . 2]" 1
864 1 47 VAL HA 1 47 VAL QG . . 3.040 2.198 2.155 2.236 . 0 0 "[ . 1 . 2]" 1
865 1 47 VAL HA 1 47 VAL MG2 . . 3.470 2.233 2.184 2.275 . 0 0 "[ . 1 . 2]" 1
866 1 47 VAL HA 1 48 SER HA . . 5.010 4.722 4.675 4.749 . 0 0 "[ . 1 . 2]" 1
867 1 47 VAL HA 1 48 SER QB . . 5.460 5.205 5.135 5.384 . 0 0 "[ . 1 . 2]" 1
868 1 47 VAL HA 1 50 PHE H . . 4.180 3.264 3.197 3.347 . 0 0 "[ . 1 . 2]" 1
869 1 47 VAL HA 1 50 PHE HB2 . . 4.720 3.546 3.337 3.862 . 0 0 "[ . 1 . 2]" 1
870 1 47 VAL HA 1 50 PHE QB . . 4.130 2.349 2.251 2.479 . 0 0 "[ . 1 . 2]" 1
871 1 47 VAL HA 1 50 PHE HB3 . . 4.720 2.387 2.270 2.529 . 0 0 "[ . 1 . 2]" 1
872 1 47 VAL HA 1 51 GLU H . . 4.670 3.863 3.711 4.032 . 0 0 "[ . 1 . 2]" 1
873 1 47 VAL HA 1 65 LEU QD . . 3.720 2.272 2.034 3.157 . 0 0 "[ . 1 . 2]" 1
874 1 47 VAL HA 1 67 ILE MD . . 4.680 4.190 3.506 4.565 . 0 0 "[ . 1 . 2]" 1
875 1 47 VAL HB 1 48 SER H . . 3.830 3.859 3.776 3.892 0.062 8 0 "[ . 1 . 2]" 1
876 1 47 VAL HB 1 48 SER HA . . 5.430 5.573 5.516 5.612 0.182 8 0 "[ . 1 . 2]" 1
877 1 47 VAL HB 1 48 SER QB . . 5.390 5.462 5.399 5.530 0.140 19 0 "[ . 1 . 2]" 1
878 1 47 VAL HB 1 49 ALA H . . 5.500 5.643 5.615 5.662 0.162 7 0 "[ . 1 . 2]" 1
879 1 47 VAL HB 1 50 PHE H . . 5.500 5.538 5.501 5.590 0.090 12 0 "[ . 1 . 2]" 1
880 1 47 VAL HB 1 65 LEU QD . . 4.730 2.765 2.047 3.687 . 0 0 "[ . 1 . 2]" 1
881 1 47 VAL HB 1 67 ILE MD . . 5.280 2.366 2.074 2.797 . 0 0 "[ . 1 . 2]" 1
882 1 47 VAL QG 1 48 SER H . . 3.160 2.241 2.179 2.303 . 0 0 "[ . 1 . 2]" 1
883 1 47 VAL QG 1 48 SER HA . . 3.270 3.134 3.072 3.201 . 0 0 "[ . 1 . 2]" 1
884 1 47 VAL QG 1 49 ALA H . . 4.620 4.172 4.105 4.210 . 0 0 "[ . 1 . 2]" 1
885 1 47 VAL QG 1 50 PHE H . . 5.010 4.297 4.207 4.387 . 0 0 "[ . 1 . 2]" 1
886 1 47 VAL QG 1 50 PHE QB . . 5.230 3.142 2.969 3.450 . 0 0 "[ . 1 . 2]" 1
887 1 47 VAL QG 1 50 PHE QD . . 3.610 2.881 2.214 3.224 . 0 0 "[ . 1 . 2]" 1
888 1 47 VAL QG 1 50 PHE QE . . 4.950 4.168 3.184 4.623 . 0 0 "[ . 1 . 2]" 1
889 1 47 VAL QG 1 51 GLU H . . 4.560 3.600 3.474 3.689 . 0 0 "[ . 1 . 2]" 1
890 1 47 VAL QG 1 51 GLU QG . . 3.770 2.521 2.179 3.061 . 0 0 "[ . 1 . 2]" 1
891 1 47 VAL QG 1 65 LEU H . . 3.970 3.278 3.109 3.419 . 0 0 "[ . 1 . 2]" 1
892 1 47 VAL QG 1 65 LEU QB . . 4.520 2.072 1.899 2.176 . 0 0 "[ . 1 . 2]" 1
893 1 47 VAL QG 1 65 LEU QD . . 3.350 2.343 2.088 3.101 . 0 0 "[ . 1 . 2]" 1
894 1 47 VAL QG 1 67 ILE MD . . 2.900 2.733 2.352 3.370 0.470 6 0 "[ . 1 . 2]" 1
895 1 47 VAL MG1 1 48 SER H . . 3.970 2.259 2.194 2.322 . 0 0 "[ . 1 . 2]" 1
896 1 47 VAL MG1 1 48 SER HA . . 3.850 3.353 3.256 3.462 . 0 0 "[ . 1 . 2]" 1
897 1 47 VAL MG1 1 65 LEU H . . 5.500 5.570 5.530 5.617 0.117 13 0 "[ . 1 . 2]" 1
898 1 47 VAL MG2 1 48 SER H . . 3.970 3.722 3.574 3.818 . 0 0 "[ . 1 . 2]" 1
899 1 47 VAL MG2 1 48 SER HA . . 3.850 3.774 3.522 3.872 0.022 10 0 "[ . 1 . 2]" 1
900 1 47 VAL MG2 1 65 LEU H . . 5.500 3.301 3.125 3.450 . 0 0 "[ . 1 . 2]" 1
901 1 48 SER H 1 48 SER QB . . 3.000 2.243 2.207 2.435 . 0 0 "[ . 1 . 2]" 1
902 1 48 SER H 1 49 ALA H . . 3.220 2.724 2.610 2.780 . 0 0 "[ . 1 . 2]" 1
903 1 48 SER H 1 49 ALA MB . . 4.830 4.444 4.360 4.507 . 0 0 "[ . 1 . 2]" 1
904 1 48 SER H 1 50 PHE H . . 4.990 4.373 4.292 4.435 . 0 0 "[ . 1 . 2]" 1
905 1 48 SER H 1 67 ILE MD . . 5.500 5.245 4.954 5.556 0.056 12 0 "[ . 1 . 2]" 1
906 1 48 SER HA 1 48 SER QB . . 2.710 2.332 2.142 2.392 . 0 0 "[ . 1 . 2]" 1
907 1 48 SER HA 1 51 GLU H . . 4.260 3.463 3.317 3.588 . 0 0 "[ . 1 . 2]" 1
908 1 48 SER HA 1 51 GLU QB . . 3.910 2.878 2.302 4.031 0.121 16 0 "[ . 1 . 2]" 1
909 1 48 SER HA 1 51 GLU QG . . 3.710 2.829 1.989 3.330 . 0 0 "[ . 1 . 2]" 1
910 1 48 SER QB 1 49 ALA H . . 3.410 2.913 2.767 3.549 0.139 19 0 "[ . 1 . 2]" 1
911 1 48 SER QB 1 51 GLU H . . 5.500 5.109 4.915 5.211 . 0 0 "[ . 1 . 2]" 1
912 1 48 SER QB 1 51 GLU HG2 . . 5.500 5.152 3.805 5.541 0.041 18 0 "[ . 1 . 2]" 1
913 1 48 SER QB 1 51 GLU HG3 . . 5.500 4.869 4.093 5.403 . 0 0 "[ . 1 . 2]" 1
914 1 49 ALA H 1 49 ALA MB . . 3.070 2.286 2.250 2.323 . 0 0 "[ . 1 . 2]" 1
915 1 49 ALA H 1 52 THR H . . 5.000 4.659 4.536 4.866 . 0 0 "[ . 1 . 2]" 1
916 1 49 ALA HA 1 52 THR H . . 3.550 3.445 3.293 3.642 0.092 14 0 "[ . 1 . 2]" 1
917 1 49 ALA HA 1 52 THR MG . . 4.360 3.956 3.805 4.192 . 0 0 "[ . 1 . 2]" 1
918 1 49 ALA HA 1 53 PHE QD . . 5.120 3.980 3.402 4.853 . 0 0 "[ . 1 . 2]" 1
919 1 49 ALA MB 1 50 PHE H . . 3.550 2.477 2.399 2.579 . 0 0 "[ . 1 . 2]" 1
920 1 49 ALA MB 1 50 PHE HA . . 4.630 4.038 3.985 4.154 . 0 0 "[ . 1 . 2]" 1
921 1 49 ALA MB 1 50 PHE QB . . 4.140 3.881 3.811 3.999 . 0 0 "[ . 1 . 2]" 1
922 1 49 ALA MB 1 51 GLU H . . 4.720 4.701 4.622 4.748 0.028 6 0 "[ . 1 . 2]" 1
923 1 49 ALA MB 1 52 THR H . . 4.720 4.630 4.497 4.731 0.011 3 0 "[ . 1 . 2]" 1
924 1 49 ALA MB 1 53 PHE H . . 5.320 4.634 4.428 5.321 0.001 12 0 "[ . 1 . 2]" 1
925 1 49 ALA MB 1 53 PHE QD . . 4.440 3.452 2.808 4.417 . 0 0 "[ . 1 . 2]" 1
926 1 50 PHE H 1 50 PHE HB2 . . 3.770 2.653 2.516 2.951 . 0 0 "[ . 1 . 2]" 1
927 1 50 PHE H 1 50 PHE HB3 . . 3.770 2.335 2.131 2.486 . 0 0 "[ . 1 . 2]" 1
928 1 50 PHE H 1 50 PHE QD . . 5.010 4.130 3.896 4.228 . 0 0 "[ . 1 . 2]" 1
929 1 50 PHE H 1 51 GLU QG . . 5.340 4.629 4.525 4.789 . 0 0 "[ . 1 . 2]" 1
930 1 50 PHE H 1 65 LEU QD . . 4.400 4.005 3.798 4.508 0.108 14 0 "[ . 1 . 2]" 1
931 1 50 PHE HA 1 50 PHE QE . . 5.200 4.849 4.644 5.093 . 0 0 "[ . 1 . 2]" 1
932 1 50 PHE HA 1 53 PHE H . . 4.470 3.703 3.390 4.251 . 0 0 "[ . 1 . 2]" 1
933 1 50 PHE HA 1 53 PHE QB . . 5.030 3.273 2.929 4.063 . 0 0 "[ . 1 . 2]" 1
934 1 50 PHE QB 1 51 GLU H . . 3.850 2.602 2.420 2.858 . 0 0 "[ . 1 . 2]" 1
935 1 50 PHE QB 1 52 THR H . . 5.340 4.807 4.630 5.042 . 0 0 "[ . 1 . 2]" 1
936 1 50 PHE QB 1 65 LEU QD . . 3.960 2.238 2.079 2.730 . 0 0 "[ . 1 . 2]" 1
937 1 50 PHE HB2 1 51 GLU H . . 4.480 3.969 3.844 4.137 . 0 0 "[ . 1 . 2]" 1
938 1 50 PHE HB3 1 51 GLU H . . 4.480 2.639 2.446 2.913 . 0 0 "[ . 1 . 2]" 1
939 1 50 PHE QD 1 51 GLU H . . 4.670 2.946 2.311 3.198 . 0 0 "[ . 1 . 2]" 1
940 1 50 PHE QD 1 51 GLU HA . . 5.140 3.566 3.317 3.966 . 0 0 "[ . 1 . 2]" 1
941 1 50 PHE QD 1 51 GLU QG . . 4.970 2.926 2.521 3.957 . 0 0 "[ . 1 . 2]" 1
942 1 50 PHE QD 1 65 LEU H . . 4.750 4.534 3.951 4.790 0.040 18 0 "[ . 1 . 2]" 1
943 1 50 PHE QD 1 65 LEU QD . . 4.930 2.730 2.573 2.883 . 0 0 "[ . 1 . 2]" 1
944 1 50 PHE QD 1 65 LEU HG . . 4.950 4.824 4.218 5.062 0.112 12 0 "[ . 1 . 2]" 1
945 1 50 PHE QE 1 51 GLU H . . 5.270 4.984 4.195 5.266 . 0 0 "[ . 1 . 2]" 1
946 1 50 PHE QE 1 51 GLU HA . . 4.540 4.405 3.582 4.575 0.035 20 0 "[ . 1 . 2]" 1
947 1 50 PHE QE 1 51 GLU QG . . 4.520 4.464 4.182 4.587 0.067 14 0 "[ . 1 . 2]" 1
948 1 50 PHE QE 1 65 LEU H . . 4.660 3.936 2.679 4.655 . 0 0 "[ . 1 . 2]" 1
949 1 50 PHE QE 1 65 LEU QB . . 4.980 3.160 2.605 4.839 . 0 0 "[ . 1 . 2]" 1
950 1 50 PHE QE 1 65 LEU QD . . 4.890 3.531 3.137 3.850 . 0 0 "[ . 1 . 2]" 1
951 1 51 GLU H 1 51 GLU QB . . 3.560 2.445 2.371 2.674 . 0 0 "[ . 1 . 2]" 1
952 1 51 GLU H 1 51 GLU HG2 . . 3.770 2.364 2.212 3.205 . 0 0 "[ . 1 . 2]" 1
953 1 51 GLU H 1 51 GLU QG . . 3.180 2.289 2.190 2.451 . 0 0 "[ . 1 . 2]" 1
954 1 51 GLU H 1 51 GLU HG3 . . 3.770 3.399 2.543 3.671 . 0 0 "[ . 1 . 2]" 1
955 1 51 GLU H 1 52 THR H . . 3.490 2.789 2.661 2.948 . 0 0 "[ . 1 . 2]" 1
956 1 51 GLU H 1 52 THR HB . . 5.110 4.998 4.895 5.089 . 0 0 "[ . 1 . 2]" 1
957 1 51 GLU H 1 65 LEU QD . . 5.440 4.400 4.102 4.781 . 0 0 "[ . 1 . 2]" 1
958 1 51 GLU HA 1 51 GLU QG . . 3.730 2.958 2.678 3.457 . 0 0 "[ . 1 . 2]" 1
959 1 51 GLU HA 1 54 ARG QD . . 4.930 2.977 2.108 4.782 . 0 0 "[ . 1 . 2]" 1
960 1 51 GLU HA 1 54 ARG HE . . 5.500 4.116 2.397 5.187 . 0 0 "[ . 1 . 2]" 1
961 1 51 GLU QB 1 52 THR H . . 3.670 2.893 2.418 3.787 0.117 9 0 "[ . 1 . 2]" 1
962 1 51 GLU HB2 1 52 THR H . . 4.300 3.048 2.485 4.207 . 0 0 "[ . 1 . 2]" 1
963 1 51 GLU HB3 1 52 THR H . . 4.300 3.748 3.312 4.339 0.039 16 0 "[ . 1 . 2]" 1
964 1 51 GLU QG 1 52 THR H . . 4.060 3.798 2.460 4.230 0.170 11 0 "[ . 1 . 2]" 1
965 1 52 THR H 1 52 THR HB . . 3.250 2.525 2.450 2.572 . 0 0 "[ . 1 . 2]" 1
966 1 52 THR H 1 52 THR MG . . 3.800 3.829 3.809 3.849 0.049 9 0 "[ . 1 . 2]" 1
967 1 52 THR H 1 53 PHE H . . 3.510 2.820 2.601 2.949 . 0 0 "[ . 1 . 2]" 1
968 1 52 THR H 1 53 PHE HA . . 5.470 5.435 5.231 5.542 0.072 13 0 "[ . 1 . 2]" 1
969 1 52 THR H 1 54 ARG H . . 4.710 4.111 3.829 4.393 . 0 0 "[ . 1 . 2]" 1
970 1 52 THR H 1 54 ARG QD . . 5.340 5.180 4.819 5.432 0.092 14 0 "[ . 1 . 2]" 1
971 1 52 THR HA 1 52 THR MG . . 3.280 2.448 2.372 2.539 . 0 0 "[ . 1 . 2]" 1
972 1 52 THR HA 1 54 ARG H . . 4.610 4.152 3.824 4.640 0.030 7 0 "[ . 1 . 2]" 1
973 1 52 THR HB 1 53 PHE H . . 3.700 2.533 2.331 2.796 . 0 0 "[ . 1 . 2]" 1
974 1 52 THR HB 1 53 PHE QD . . 4.620 3.555 2.324 4.199 . 0 0 "[ . 1 . 2]" 1
975 1 52 THR HB 1 54 ARG H . . 5.500 4.932 4.705 5.162 . 0 0 "[ . 1 . 2]" 1
976 1 52 THR MG 1 53 PHE H . . 3.780 3.266 3.075 3.512 . 0 0 "[ . 1 . 2]" 1
977 1 52 THR MG 1 54 ARG H . . 5.360 4.800 4.655 5.200 . 0 0 "[ . 1 . 2]" 1
978 1 52 THR MG 1 55 GLU H . . 5.500 5.403 4.981 5.547 0.047 20 0 "[ . 1 . 2]" 1
979 1 53 PHE H 1 53 PHE HB2 . . 3.920 2.281 2.074 2.495 . 0 0 "[ . 1 . 2]" 1
980 1 53 PHE H 1 53 PHE HB3 . . 3.920 3.540 3.340 3.629 . 0 0 "[ . 1 . 2]" 1
981 1 53 PHE H 1 53 PHE QD . . 4.010 3.072 2.445 3.549 . 0 0 "[ . 1 . 2]" 1
982 1 53 PHE H 1 54 ARG H . . 3.660 2.798 2.616 2.917 . 0 0 "[ . 1 . 2]" 1
983 1 53 PHE H 1 55 GLU H . . 4.940 4.943 4.656 5.051 0.111 5 0 "[ . 1 . 2]" 1
984 1 53 PHE HA 1 53 PHE QD . . 3.950 2.556 2.153 3.137 . 0 0 "[ . 1 . 2]" 1
985 1 53 PHE HA 1 55 GLU H . . 4.390 3.584 3.227 3.838 . 0 0 "[ . 1 . 2]" 1
986 1 53 PHE HA 1 56 GLU HB2 . . 5.500 4.293 3.885 4.643 . 0 0 "[ . 1 . 2]" 1
987 1 53 PHE HA 1 56 GLU HB3 . . 5.500 5.252 4.689 5.570 0.070 4 0 "[ . 1 . 2]" 1
988 1 53 PHE QB 1 54 ARG H . . 4.120 3.463 3.019 3.792 . 0 0 "[ . 1 . 2]" 1
989 1 53 PHE QB 1 54 ARG HA . . 5.160 4.263 3.880 4.531 . 0 0 "[ . 1 . 2]" 1
990 1 54 ARG H 1 54 ARG QD . . 4.830 3.511 2.192 4.237 . 0 0 "[ . 1 . 2]" 1
991 1 54 ARG H 1 54 ARG HE . . 4.980 4.617 3.235 5.183 0.203 8 0 "[ . 1 . 2]" 1
992 1 54 ARG H 1 55 GLU H . . 3.860 2.858 2.745 2.956 . 0 0 "[ . 1 . 2]" 1
993 1 54 ARG H 1 55 GLU HA . . 5.500 5.487 5.400 5.558 0.058 6 0 "[ . 1 . 2]" 1
994 1 54 ARG H 1 55 GLU HG2 . . 5.020 4.897 4.350 5.097 0.077 5 0 "[ . 1 . 2]" 1
995 1 54 ARG H 1 56 GLU H . . 4.750 4.546 4.429 4.658 . 0 0 "[ . 1 . 2]" 1
996 1 54 ARG HA 1 56 GLU H . . 4.110 3.797 3.325 3.997 . 0 0 "[ . 1 . 2]" 1
997 1 54 ARG HA 1 57 SER H . . 4.960 4.037 3.549 4.469 . 0 0 "[ . 1 . 2]" 1
998 1 54 ARG HA 1 60 CYS HB2 . . 4.980 3.499 2.976 4.095 . 0 0 "[ . 1 . 2]" 1
999 1 54 ARG HA 1 60 CYS QB . . 4.230 2.565 2.255 3.096 . 0 0 "[ . 1 . 2]" 1
1000 1 54 ARG HA 1 60 CYS HB3 . . 4.980 2.657 2.314 3.226 . 0 0 "[ . 1 . 2]" 1
1001 1 54 ARG HA 1 61 LYS QG . . 4.650 4.314 3.902 4.675 0.025 11 0 "[ . 1 . 2]" 1
1002 1 55 GLU H 1 55 GLU HB2 . . 3.760 2.583 2.375 2.751 . 0 0 "[ . 1 . 2]" 1
1003 1 55 GLU H 1 55 GLU QB . . 3.210 2.526 2.342 2.671 . 0 0 "[ . 1 . 2]" 1
1004 1 55 GLU H 1 55 GLU HB3 . . 3.760 3.600 3.562 3.640 . 0 0 "[ . 1 . 2]" 1
1005 1 55 GLU H 1 55 GLU HG2 . . 3.730 2.596 2.075 2.889 . 0 0 "[ . 1 . 2]" 1
1006 1 55 GLU H 1 55 GLU HG3 . . 3.600 2.530 2.047 3.310 . 0 0 "[ . 1 . 2]" 1
1007 1 55 GLU H 1 56 GLU H . . 3.530 2.808 2.644 2.930 . 0 0 "[ . 1 . 2]" 1
1008 1 55 GLU H 1 56 GLU QB . . 4.920 4.538 4.341 4.839 . 0 0 "[ . 1 . 2]" 1
1009 1 55 GLU H 1 57 SER H . . 4.720 4.493 4.244 4.701 . 0 0 "[ . 1 . 2]" 1
1010 1 55 GLU H 1 61 LYS HA . . 5.500 5.461 5.141 5.573 0.073 9 0 "[ . 1 . 2]" 1
1011 1 55 GLU H 1 61 LYS QD . . 4.510 4.425 4.029 4.573 0.063 13 0 "[ . 1 . 2]" 1
1012 1 55 GLU H 1 61 LYS QG . . 4.210 4.000 3.742 4.282 0.072 1 0 "[ . 1 . 2]" 1
1013 1 55 GLU HA 1 55 GLU HG2 . . 3.740 2.587 2.420 2.937 . 0 0 "[ . 1 . 2]" 1
1014 1 55 GLU HA 1 55 GLU HG3 . . 3.790 3.553 3.391 3.831 0.041 10 0 "[ . 1 . 2]" 1
1015 1 55 GLU HA 1 57 SER H . . 4.420 3.703 3.288 3.988 . 0 0 "[ . 1 . 2]" 1
1016 1 55 GLU HA 1 61 LYS H . . 5.500 5.420 5.035 5.641 0.141 8 0 "[ . 1 . 2]" 1
1017 1 55 GLU HA 1 61 LYS QD . . 3.770 2.130 1.980 2.311 . 0 0 "[ . 1 . 2]" 1
1018 1 55 GLU HA 1 61 LYS QE . . 4.900 4.037 2.902 4.428 . 0 0 "[ . 1 . 2]" 1
1019 1 55 GLU HA 1 61 LYS QG . . 3.940 2.797 2.413 3.132 . 0 0 "[ . 1 . 2]" 1
1020 1 55 GLU QB 1 56 GLU H . . 3.260 3.016 2.684 3.286 0.026 14 0 "[ . 1 . 2]" 1
1021 1 55 GLU HG2 1 56 GLU H . . 4.900 4.782 4.438 4.950 0.050 1 0 "[ . 1 . 2]" 1
1022 1 55 GLU HG2 1 61 LYS QD . . 4.300 3.739 2.491 4.346 0.046 11 0 "[ . 1 . 2]" 1
1023 1 55 GLU HG2 1 61 LYS QG . . 4.930 3.565 2.388 4.364 . 0 0 "[ . 1 . 2]" 1
1024 1 55 GLU HG3 1 56 GLU H . . 4.760 4.656 4.397 4.978 0.218 3 0 "[ . 1 . 2]" 1
1025 1 56 GLU H 1 56 GLU HB2 . . 3.720 2.378 2.113 2.525 . 0 0 "[ . 1 . 2]" 1
1026 1 56 GLU H 1 56 GLU QB . . 3.170 2.225 2.073 2.482 . 0 0 "[ . 1 . 2]" 1
1027 1 56 GLU H 1 56 GLU HB3 . . 3.720 2.780 2.498 3.659 . 0 0 "[ . 1 . 2]" 1
1028 1 56 GLU H 1 56 GLU QG . . 4.180 3.750 2.383 4.094 . 0 0 "[ . 1 . 2]" 1
1029 1 56 GLU H 1 57 SER H . . 3.290 2.729 2.542 2.924 . 0 0 "[ . 1 . 2]" 1
1030 1 56 GLU HA 1 56 GLU QG . . 3.200 2.585 2.292 3.060 . 0 0 "[ . 1 . 2]" 1
1031 1 56 GLU QB 1 57 SER QB . . 5.190 3.919 3.627 4.318 . 0 0 "[ . 1 . 2]" 1
1032 1 56 GLU HB2 1 57 SER H . . 4.200 4.010 3.281 4.220 0.020 3 0 "[ . 1 . 2]" 1
1033 1 56 GLU HB3 1 57 SER H . . 4.200 3.335 2.874 4.218 0.018 20 0 "[ . 1 . 2]" 1
1034 1 57 SER H 1 57 SER QB . . 3.410 2.661 2.272 2.931 . 0 0 "[ . 1 . 2]" 1
1035 1 57 SER H 1 58 LEU H . . 4.620 4.326 4.146 4.502 . 0 0 "[ . 1 . 2]" 1
1036 1 57 SER H 1 60 CYS H . . 4.770 4.588 4.287 4.847 0.077 8 0 "[ . 1 . 2]" 1
1037 1 57 SER H 1 60 CYS HB2 . . 4.820 3.714 3.229 4.856 0.036 3 0 "[ . 1 . 2]" 1
1038 1 57 SER H 1 60 CYS HB3 . . 4.820 4.367 3.162 4.876 0.056 4 0 "[ . 1 . 2]" 1
1039 1 57 SER H 1 61 LYS QD . . 4.580 3.871 3.492 4.297 . 0 0 "[ . 1 . 2]" 1
1040 1 57 SER HA 1 59 VAL H . . 4.630 4.177 3.870 4.688 0.058 20 0 "[ . 1 . 2]" 1
1041 1 57 SER QB 1 58 LEU H . . 4.240 3.111 2.180 3.764 . 0 0 "[ . 1 . 2]" 1
1042 1 57 SER QB 1 59 VAL H . . 4.810 3.248 2.680 3.945 . 0 0 "[ . 1 . 2]" 1
1043 1 57 SER QB 1 60 CYS H . . 4.150 2.855 2.236 3.071 . 0 0 "[ . 1 . 2]" 1
1044 1 57 SER QB 1 60 CYS QB . . 4.290 2.281 1.992 2.893 . 0 0 "[ . 1 . 2]" 1
1045 1 57 SER QB 1 61 LYS H . . 4.670 4.501 3.222 4.734 0.064 3 0 "[ . 1 . 2]" 1
1046 1 58 LEU H 1 58 LEU HB2 . . 3.600 2.360 2.056 3.028 . 0 0 "[ . 1 . 2]" 1
1047 1 58 LEU H 1 58 LEU HB3 . . 3.600 3.290 2.548 3.654 0.054 11 0 "[ . 1 . 2]" 1
1048 1 58 LEU H 1 58 LEU MD1 . . 4.500 3.853 2.220 4.501 0.001 3 0 "[ . 1 . 2]" 1
1049 1 58 LEU H 1 58 LEU QD . . 3.860 2.971 2.154 3.985 0.125 3 0 "[ . 1 . 2]" 1
1050 1 58 LEU H 1 58 LEU MD2 . . 4.500 3.373 2.167 4.520 0.020 8 0 "[ . 1 . 2]" 1
1051 1 58 LEU H 1 59 VAL H . . 3.800 2.600 1.975 2.848 . 0 0 "[ . 1 . 2]" 1
1052 1 58 LEU H 1 59 VAL HA . . 5.400 5.276 4.751 5.492 0.092 4 0 "[ . 1 . 2]" 1
1053 1 58 LEU H 1 59 VAL MG1 . . 4.660 3.823 3.322 4.131 . 0 0 "[ . 1 . 2]" 1
1054 1 58 LEU H 1 59 VAL MG2 . . 4.870 4.207 3.533 4.845 . 0 0 "[ . 1 . 2]" 1
1055 1 58 LEU H 1 60 CYS H . . 4.550 4.060 3.383 4.424 . 0 0 "[ . 1 . 2]" 1
1056 1 58 LEU H 1 61 LYS H . . 5.370 5.241 4.804 5.458 0.088 4 0 "[ . 1 . 2]" 1
1057 1 58 LEU HA 1 58 LEU QD . . 2.920 2.151 1.938 2.583 . 0 0 "[ . 1 . 2]" 1
1058 1 58 LEU HA 1 61 LYS H . . 4.240 3.755 3.223 4.355 0.115 11 0 "[ . 1 . 2]" 1
1059 1 58 LEU QB 1 59 VAL H . . 3.240 2.739 2.296 3.019 . 0 0 "[ . 1 . 2]" 1
1060 1 58 LEU QB 1 59 VAL HA . . 4.270 3.994 3.708 4.264 . 0 0 "[ . 1 . 2]" 1
1061 1 58 LEU QB 1 60 CYS H . . 4.760 4.654 4.476 4.769 0.009 2 0 "[ . 1 . 2]" 1
1062 1 58 LEU HB2 1 59 VAL H . . 3.760 3.218 2.627 3.845 0.085 8 0 "[ . 1 . 2]" 1
1063 1 58 LEU HB2 1 60 CYS H . . 5.500 5.308 4.975 5.632 0.132 3 0 "[ . 1 . 2]" 1
1064 1 58 LEU HB3 1 59 VAL H . . 3.760 3.219 2.323 3.806 0.046 12 0 "[ . 1 . 2]" 1
1065 1 58 LEU HB3 1 60 CYS H . . 5.500 5.193 4.730 5.487 . 0 0 "[ . 1 . 2]" 1
1066 1 58 LEU QD 1 61 LYS H . . 5.070 4.681 3.949 5.320 0.250 11 0 "[ . 1 . 2]" 1
1067 1 58 LEU QD 1 61 LYS QD . . 3.500 2.992 2.311 3.718 0.218 20 0 "[ . 1 . 2]" 1
1068 1 58 LEU QD 1 61 LYS QE . . 3.180 2.398 1.896 3.454 0.274 1 0 "[ . 1 . 2]" 1
1069 1 58 LEU MD1 1 61 LYS QE . . 3.850 2.963 1.900 3.910 0.060 3 0 "[ . 1 . 2]" 1
1070 1 58 LEU MD2 1 61 LYS QE . . 3.850 3.294 1.953 3.926 0.076 8 0 "[ . 1 . 2]" 1
1071 1 59 VAL H 1 59 VAL HB . . 3.720 3.662 3.611 3.728 0.008 12 0 "[ . 1 . 2]" 1
1072 1 59 VAL H 1 59 VAL MG1 . . 3.230 2.064 1.936 2.274 . 0 0 "[ . 1 . 2]" 1
1073 1 59 VAL H 1 59 VAL MG2 . . 3.430 2.480 2.238 2.790 . 0 0 "[ . 1 . 2]" 1
1074 1 59 VAL H 1 60 CYS H . . 3.510 2.634 2.504 2.850 . 0 0 "[ . 1 . 2]" 1
1075 1 59 VAL H 1 61 LYS H . . 4.260 4.306 4.081 4.410 0.150 20 0 "[ . 1 . 2]" 1
1076 1 59 VAL HA 1 59 VAL MG1 . . 3.100 2.497 2.393 2.643 . 0 0 "[ . 1 . 2]" 1
1077 1 59 VAL HA 1 59 VAL MG2 . . 3.310 3.262 3.229 3.288 . 0 0 "[ . 1 . 2]" 1
1078 1 59 VAL HA 1 61 LYS H . . 4.820 4.165 3.804 4.627 . 0 0 "[ . 1 . 2]" 1
1079 1 59 VAL HB 1 60 CYS H . . 4.800 4.176 4.041 4.302 . 0 0 "[ . 1 . 2]" 1
1080 1 59 VAL MG1 1 60 CYS H . . 4.270 3.898 3.647 4.062 . 0 0 "[ . 1 . 2]" 1
1081 1 59 VAL MG2 1 60 CYS H . . 3.860 2.617 2.447 2.833 . 0 0 "[ . 1 . 2]" 1
1082 1 59 VAL MG2 1 60 CYS QB . . 4.590 3.439 2.832 3.818 . 0 0 "[ . 1 . 2]" 1
1083 1 59 VAL MG2 1 61 LYS H . . 5.380 4.560 4.463 4.694 . 0 0 "[ . 1 . 2]" 1
1084 1 60 CYS H 1 60 CYS HB2 . . 4.130 2.270 2.123 2.479 . 0 0 "[ . 1 . 2]" 1
1085 1 60 CYS H 1 60 CYS QB . . 3.630 2.210 2.102 2.328 . 0 0 "[ . 1 . 2]" 1
1086 1 60 CYS H 1 60 CYS HB3 . . 4.130 3.265 2.613 3.583 . 0 0 "[ . 1 . 2]" 1
1087 1 60 CYS H 1 61 LYS H . . 3.530 2.475 2.328 2.677 . 0 0 "[ . 1 . 2]" 1
1088 1 60 CYS H 1 61 LYS HA . . 5.050 5.091 4.995 5.172 0.122 13 0 "[ . 1 . 2]" 1
1089 1 60 CYS H 1 61 LYS HB2 . . 5.210 4.687 4.253 5.141 . 0 0 "[ . 1 . 2]" 1
1090 1 60 CYS QB 1 61 LYS H . . 4.040 2.993 2.762 3.233 . 0 0 "[ . 1 . 2]" 1
1091 1 60 CYS QB 1 61 LYS HB2 . . 5.340 5.032 4.646 5.344 0.004 4 0 "[ . 1 . 2]" 1
1092 1 60 CYS QB 1 61 LYS QG . . 4.720 3.680 3.081 4.639 . 0 0 "[ . 1 . 2]" 1
1093 1 60 CYS HB2 1 61 LYS H . . 4.820 3.379 2.866 4.168 . 0 0 "[ . 1 . 2]" 1
1094 1 60 CYS HB2 1 61 LYS QD . . 5.500 4.923 4.054 5.622 0.122 9 0 "[ . 1 . 2]" 1
1095 1 60 CYS HB3 1 61 LYS H . . 4.820 3.592 2.884 4.107 . 0 0 "[ . 1 . 2]" 1
1096 1 60 CYS HB3 1 61 LYS QD . . 5.500 5.207 3.807 5.676 0.176 1 0 "[ . 1 . 2]" 1
1097 1 61 LYS H 1 61 LYS HB2 . . 3.500 2.449 2.279 2.756 . 0 0 "[ . 1 . 2]" 1
1098 1 61 LYS H 1 61 LYS HB3 . . 3.710 3.622 3.564 3.710 0.000 20 0 "[ . 1 . 2]" 1
1099 1 61 LYS H 1 61 LYS QD . . 4.200 3.231 2.173 4.139 . 0 0 "[ . 1 . 2]" 1
1100 1 61 LYS H 1 61 LYS HG2 . . 4.500 3.718 2.619 4.312 . 0 0 "[ . 1 . 2]" 1
1101 1 61 LYS H 1 61 LYS QG . . 3.640 2.576 1.966 3.347 . 0 0 "[ . 1 . 2]" 1
1102 1 61 LYS H 1 61 LYS HG3 . . 4.500 2.636 2.028 3.487 . 0 0 "[ . 1 . 2]" 1
1103 1 61 LYS HA 1 61 LYS QD . . 4.050 3.843 3.406 4.080 0.030 2 0 "[ . 1 . 2]" 1
1104 1 61 LYS HB2 1 61 LYS QD . . 3.500 2.689 2.301 3.348 . 0 0 "[ . 1 . 2]" 1
1105 1 61 LYS QE 1 61 LYS QG . . 3.040 2.664 2.291 2.963 . 0 0 "[ . 1 . 2]" 1
1106 1 64 ILE H 1 64 ILE HB . . 3.400 2.707 2.523 2.830 . 0 0 "[ . 1 . 2]" 1
1107 1 64 ILE H 1 64 ILE MD . . 4.200 3.987 2.492 4.229 0.029 18 0 "[ . 1 . 2]" 1
1108 1 64 ILE H 1 64 ILE QG . . 3.320 3.096 2.892 3.410 0.090 2 0 "[ . 1 . 2]" 1
1109 1 64 ILE H 1 64 ILE MG . . 4.090 3.910 3.831 3.970 . 0 0 "[ . 1 . 2]" 1
1110 1 64 ILE H 1 65 LEU H . . 4.640 4.424 4.317 4.533 . 0 0 "[ . 1 . 2]" 1
1111 1 64 ILE HA 1 64 ILE MD . . 3.900 3.358 2.191 3.920 0.020 15 0 "[ . 1 . 2]" 1
1112 1 64 ILE HA 1 64 ILE QG . . 3.600 2.606 2.354 3.053 . 0 0 "[ . 1 . 2]" 1
1113 1 64 ILE HA 1 64 ILE MG . . 3.220 2.494 2.378 2.574 . 0 0 "[ . 1 . 2]" 1
1114 1 64 ILE HA 1 65 LEU H . . 3.210 2.297 2.162 2.375 . 0 0 "[ . 1 . 2]" 1
1115 1 64 ILE HB 1 64 ILE MD . . 3.140 2.651 2.249 3.251 0.111 10 0 "[ . 1 . 2]" 1
1116 1 64 ILE HB 1 65 LEU H . . 4.000 3.995 3.837 4.094 0.094 18 0 "[ . 1 . 2]" 1
1117 1 64 ILE MD 1 65 LEU H . . 5.020 4.578 3.571 5.082 0.062 2 0 "[ . 1 . 2]" 1
1118 1 64 ILE QG 1 65 LEU H . . 4.890 4.231 3.878 4.695 . 0 0 "[ . 1 . 2]" 1
1119 1 64 ILE MG 1 65 LEU H . . 3.340 2.334 2.149 2.565 . 0 0 "[ . 1 . 2]" 1
1120 1 64 ILE MG 1 65 LEU HA . . 4.020 3.822 3.640 4.063 0.043 15 0 "[ . 1 . 2]" 1
1121 1 65 LEU H 1 65 LEU QB . . 3.730 2.332 2.040 2.479 . 0 0 "[ . 1 . 2]" 1
1122 1 65 LEU H 1 65 LEU MD1 . . 4.560 4.410 4.092 4.572 0.012 20 0 "[ . 1 . 2]" 1
1123 1 65 LEU H 1 65 LEU QD . . 3.970 3.808 3.248 3.952 . 0 0 "[ . 1 . 2]" 1
1124 1 65 LEU H 1 65 LEU MD2 . . 4.560 4.183 3.363 4.462 . 0 0 "[ . 1 . 2]" 1
1125 1 65 LEU H 1 66 ASP H . . 4.570 4.270 4.042 4.630 0.060 15 0 "[ . 1 . 2]" 1
1126 1 65 LEU HA 1 65 LEU QD . . 3.390 2.671 2.033 3.144 . 0 0 "[ . 1 . 2]" 1
1127 1 65 LEU QB 1 66 ASP H . . 4.840 3.818 3.190 3.988 . 0 0 "[ . 1 . 2]" 1
1128 1 65 LEU QD 1 66 ASP H . . 3.620 2.882 2.038 3.875 0.255 7 0 "[ . 1 . 2]" 1
1129 1 65 LEU QD 1 66 ASP QB . . 4.540 4.218 3.737 4.785 0.245 7 0 "[ . 1 . 2]" 1
1130 1 65 LEU QD 1 68 VAL H . . 5.440 5.059 4.586 5.434 . 0 0 "[ . 1 . 2]" 1
1131 1 65 LEU HG 1 66 ASP H . . 4.470 3.898 2.797 4.609 0.139 14 0 "[ . 1 . 2]" 1
1132 1 65 LEU HG 1 67 ILE H . . 5.500 5.076 3.554 5.526 0.026 17 0 "[ . 1 . 2]" 1
1133 1 66 ASP H 1 66 ASP HB2 . . 4.060 2.582 2.321 3.177 . 0 0 "[ . 1 . 2]" 1
1134 1 66 ASP H 1 66 ASP QB . . 3.540 2.358 2.229 2.796 . 0 0 "[ . 1 . 2]" 1
1135 1 66 ASP H 1 66 ASP HB3 . . 4.060 2.996 2.453 3.649 . 0 0 "[ . 1 . 2]" 1
1136 1 66 ASP H 1 67 ILE H . . 4.560 4.223 3.641 4.575 0.015 2 0 "[ . 1 . 2]" 1
1137 1 66 ASP HA 1 67 ILE H . . 3.050 2.181 2.090 2.257 . 0 0 "[ . 1 . 2]" 1
1138 1 66 ASP HA 1 67 ILE HB . . 4.900 4.675 4.476 4.810 . 0 0 "[ . 1 . 2]" 1
1139 1 66 ASP QB 1 67 ILE H . . 4.140 3.780 2.867 4.064 . 0 0 "[ . 1 . 2]" 1
1140 1 66 ASP HB2 1 67 ILE H . . 4.730 4.504 4.129 4.644 . 0 0 "[ . 1 . 2]" 1
1141 1 66 ASP HB3 1 67 ILE H . . 4.730 4.105 2.925 4.538 . 0 0 "[ . 1 . 2]" 1
1142 1 67 ILE H 1 67 ILE HB . . 3.570 2.574 2.447 2.726 . 0 0 "[ . 1 . 2]" 1
1143 1 67 ILE H 1 67 ILE MD . . 3.540 3.135 2.018 3.620 0.080 5 0 "[ . 1 . 2]" 1
1144 1 67 ILE H 1 67 ILE HG12 . . 4.050 3.540 2.074 4.100 0.050 13 0 "[ . 1 . 2]" 1
1145 1 67 ILE H 1 67 ILE HG13 . . 4.050 2.696 2.050 3.711 . 0 0 "[ . 1 . 2]" 1
1146 1 67 ILE H 1 67 ILE MG . . 3.990 3.823 3.767 3.881 . 0 0 "[ . 1 . 2]" 1
1147 1 67 ILE H 1 68 VAL H . . 4.640 4.393 4.097 4.617 . 0 0 "[ . 1 . 2]" 1
1148 1 67 ILE HA 1 67 ILE MG . . 3.430 2.325 2.215 2.404 . 0 0 "[ . 1 . 2]" 1
1149 1 67 ILE HA 1 68 VAL HA . . 4.700 4.517 4.493 4.546 . 0 0 "[ . 1 . 2]" 1
1150 1 67 ILE HB 1 67 ILE MD . . 3.480 2.465 2.217 3.275 . 0 0 "[ . 1 . 2]" 1
1151 1 67 ILE MG 1 68 VAL H . . 3.780 2.905 2.382 3.254 . 0 0 "[ . 1 . 2]" 1
1152 1 67 ILE MG 1 68 VAL HA . . 4.840 3.955 3.552 4.356 . 0 0 "[ . 1 . 2]" 1
1153 1 67 ILE MG 1 70 GLU H . . 5.420 5.165 4.747 5.422 0.002 16 0 "[ . 1 . 2]" 1
1154 1 68 VAL H 1 68 VAL HB . . 3.920 2.527 2.436 2.669 . 0 0 "[ . 1 . 2]" 1
1155 1 68 VAL H 1 68 VAL MG1 . . 3.960 3.839 3.792 3.898 . 0 0 "[ . 1 . 2]" 1
1156 1 68 VAL H 1 68 VAL QG . . 3.250 2.564 2.235 2.897 . 0 0 "[ . 1 . 2]" 1
1157 1 68 VAL H 1 68 VAL MG2 . . 3.960 2.610 2.251 2.987 . 0 0 "[ . 1 . 2]" 1
1158 1 68 VAL H 1 69 ASP H . . 4.760 4.400 4.216 4.541 . 0 0 "[ . 1 . 2]" 1
1159 1 68 VAL H 1 112 LEU QD . . 5.030 4.054 3.488 5.183 0.153 13 0 "[ . 1 . 2]" 1
1160 1 68 VAL HA 1 68 VAL MG1 . . 3.220 2.443 2.409 2.472 . 0 0 "[ . 1 . 2]" 1
1161 1 68 VAL HA 1 68 VAL MG2 . . 3.220 2.348 2.326 2.385 . 0 0 "[ . 1 . 2]" 1
1162 1 68 VAL HA 1 69 ASP H . . 2.940 2.103 2.067 2.157 . 0 0 "[ . 1 . 2]" 1
1163 1 68 VAL HA 1 69 ASP QB . . 4.560 4.238 3.995 4.519 . 0 0 "[ . 1 . 2]" 1
1164 1 68 VAL HB 1 69 ASP H . . 4.280 4.270 4.171 4.321 0.041 17 0 "[ . 1 . 2]" 1
1165 1 68 VAL HB 1 112 LEU QD . . 3.580 2.606 2.181 3.991 0.411 13 0 "[ . 1 . 2]" 1
1166 1 68 VAL QG 1 69 ASP H . . 3.110 2.766 2.593 2.906 . 0 0 "[ . 1 . 2]" 1
1167 1 68 VAL QG 1 69 ASP QB . . 4.180 3.968 3.720 4.451 0.271 4 0 "[ . 1 . 2]" 1
1168 1 68 VAL QG 1 70 GLU H . . 5.400 3.831 3.537 4.186 . 0 0 "[ . 1 . 2]" 1
1169 1 68 VAL MG1 1 69 ASP H . . 3.950 2.822 2.628 2.984 . 0 0 "[ . 1 . 2]" 1
1170 1 68 VAL MG2 1 69 ASP H . . 3.950 3.981 3.952 4.000 0.050 17 0 "[ . 1 . 2]" 1
1171 1 69 ASP H 1 69 ASP QB . . 3.110 2.385 2.230 2.708 . 0 0 "[ . 1 . 2]" 1
1172 1 69 ASP H 1 70 GLU H . . 4.440 4.338 4.213 4.460 0.020 16 0 "[ . 1 . 2]" 1
1173 1 69 ASP HA 1 70 GLU H . . 3.230 2.175 2.132 2.196 . 0 0 "[ . 1 . 2]" 1
1174 1 69 ASP QB 1 70 GLU H . . 3.990 3.752 3.499 4.021 0.031 7 0 "[ . 1 . 2]" 1
1175 1 70 GLU H 1 70 GLU QB . . 3.360 2.288 2.118 2.492 . 0 0 "[ . 1 . 2]" 1
1176 1 70 GLU H 1 70 GLU QG . . 3.870 3.013 2.659 3.998 0.128 10 0 "[ . 1 . 2]" 1
1177 1 70 GLU H 1 71 LYS H . . 4.610 4.590 4.467 4.642 0.032 3 0 "[ . 1 . 2]" 1
1178 1 70 GLU HA 1 71 LYS H . . 3.300 2.211 2.128 2.490 . 0 0 "[ . 1 . 2]" 1
1179 1 70 GLU HA 1 105 GLN QE . . 4.780 4.184 3.838 4.520 . 0 0 "[ . 1 . 2]" 1
1180 1 70 GLU QB 1 71 LYS H . . 3.500 3.027 2.273 3.561 0.061 10 0 "[ . 1 . 2]" 1
1181 1 70 GLU QB 1 105 GLN HE21 . . 3.930 2.757 2.386 3.772 . 0 0 "[ . 1 . 2]" 1
1182 1 70 GLU QB 1 105 GLN HE22 . . 3.930 2.797 2.222 3.809 . 0 0 "[ . 1 . 2]" 1
1183 1 70 GLU QB 1 106 GLY QA . . 4.710 3.436 3.072 4.114 . 0 0 "[ . 1 . 2]" 1
1184 1 70 GLU QG 1 71 LYS H . . 4.640 3.939 2.523 4.504 . 0 0 "[ . 1 . 2]" 1
1185 1 70 GLU QG 1 112 LEU MD1 . . 5.000 3.412 2.676 4.500 . 0 0 "[ . 1 . 2]" 1
1186 1 70 GLU QG 1 112 LEU QD . . 4.020 3.057 2.524 3.812 . 0 0 "[ . 1 . 2]" 1
1187 1 70 GLU QG 1 112 LEU MD2 . . 5.000 3.593 3.048 4.376 . 0 0 "[ . 1 . 2]" 1
1188 1 71 LYS H 1 71 LYS HB2 . . 3.850 2.683 2.128 3.783 . 0 0 "[ . 1 . 2]" 1
1189 1 71 LYS H 1 71 LYS QB . . 3.350 2.472 2.108 2.901 . 0 0 "[ . 1 . 2]" 1
1190 1 71 LYS H 1 71 LYS HB3 . . 3.850 3.454 2.740 3.837 . 0 0 "[ . 1 . 2]" 1
1191 1 71 LYS H 1 71 LYS QD . . 3.810 3.126 1.990 3.921 0.111 10 0 "[ . 1 . 2]" 1
1192 1 71 LYS H 1 71 LYS QG . . 3.450 2.610 1.951 3.595 0.145 19 0 "[ . 1 . 2]" 1
1193 1 71 LYS H 1 72 VAL HA . . 5.500 5.504 4.914 5.611 0.111 4 0 "[ . 1 . 2]" 1
1194 1 71 LYS H 1 105 GLN QE . . 4.190 3.542 3.118 3.976 . 0 0 "[ . 1 . 2]" 1
1195 1 71 LYS H 1 105 GLN QG . . 5.500 4.780 3.934 5.180 . 0 0 "[ . 1 . 2]" 1
1196 1 71 LYS HA 1 71 LYS QD . . 3.720 2.626 2.050 3.829 0.109 6 0 "[ . 1 . 2]" 1
1197 1 71 LYS HA 1 72 VAL H . . 3.300 2.321 2.105 2.548 . 0 0 "[ . 1 . 2]" 1
1198 1 71 LYS QB 1 72 VAL H . . 3.640 2.502 2.134 3.164 . 0 0 "[ . 1 . 2]" 1
1199 1 71 LYS QB 1 72 VAL HA . . 4.480 4.291 4.071 4.555 0.075 18 0 "[ . 1 . 2]" 1
1200 1 71 LYS QD 1 72 VAL H . . 4.240 3.921 3.303 4.315 0.075 18 0 "[ . 1 . 2]" 1
1201 1 71 LYS QE 1 71 LYS QG . . 3.230 2.408 2.117 2.871 . 0 0 "[ . 1 . 2]" 1
1202 1 71 LYS HE2 1 71 LYS QG . . 3.860 3.094 2.382 3.574 . 0 0 "[ . 1 . 2]" 1
1203 1 71 LYS HE3 1 71 LYS QG . . 3.860 2.631 2.244 3.591 . 0 0 "[ . 1 . 2]" 1
1204 1 72 VAL H 1 72 VAL HB . . 3.870 3.089 2.271 3.874 0.004 6 0 "[ . 1 . 2]" 1
1205 1 72 VAL H 1 72 VAL MG1 . . 3.870 3.276 2.150 3.945 0.075 18 0 "[ . 1 . 2]" 1
1206 1 72 VAL H 1 72 VAL QG . . 3.110 2.437 2.131 2.941 . 0 0 "[ . 1 . 2]" 1
1207 1 72 VAL H 1 72 VAL MG2 . . 3.870 2.740 2.168 3.866 . 0 0 "[ . 1 . 2]" 1
1208 1 72 VAL H 1 73 GLU H . . 4.650 4.538 4.374 4.667 0.017 13 0 "[ . 1 . 2]" 1
1209 1 72 VAL H 1 85 PRO QD . . 5.350 4.485 4.027 5.368 0.018 13 0 "[ . 1 . 2]" 1
1210 1 72 VAL H 1 105 GLN QG . . 5.220 4.452 4.005 4.957 . 0 0 "[ . 1 . 2]" 1
1211 1 72 VAL HA 1 72 VAL MG1 . . 3.320 2.539 2.287 3.271 . 0 0 "[ . 1 . 2]" 1
1212 1 72 VAL HA 1 72 VAL QG . . 2.740 2.241 2.143 2.363 . 0 0 "[ . 1 . 2]" 1
1213 1 72 VAL HA 1 72 VAL MG2 . . 3.320 2.743 2.328 3.255 . 0 0 "[ . 1 . 2]" 1
1214 1 72 VAL HA 1 73 GLU H . . 3.200 2.285 2.179 2.376 . 0 0 "[ . 1 . 2]" 1
1215 1 72 VAL HA 1 73 GLU HA . . 5.210 4.526 4.478 4.578 . 0 0 "[ . 1 . 2]" 1
1216 1 72 VAL HA 1 73 GLU HB2 . . 4.100 4.080 3.862 4.203 0.103 13 0 "[ . 1 . 2]" 1
1217 1 72 VAL HA 1 103 ILE MG . . 4.630 3.860 3.629 4.086 . 0 0 "[ . 1 . 2]" 1
1218 1 72 VAL HA 1 105 GLN HB2 . . 5.500 5.214 4.870 5.556 0.056 5 0 "[ . 1 . 2]" 1
1219 1 72 VAL HA 1 105 GLN QE . . 5.020 3.549 3.205 5.053 0.033 13 0 "[ . 1 . 2]" 1
1220 1 72 VAL HA 1 105 GLN QG . . 4.100 2.587 2.257 3.086 . 0 0 "[ . 1 . 2]" 1
1221 1 72 VAL HA 1 106 GLY QA . . 4.330 2.700 2.330 3.172 . 0 0 "[ . 1 . 2]" 1
1222 1 72 VAL HA 1 107 ASN H . . 5.500 5.312 5.015 5.541 0.041 6 0 "[ . 1 . 2]" 1
1223 1 72 VAL HB 1 73 GLU H . . 3.990 3.423 2.437 4.044 0.054 5 0 "[ . 1 . 2]" 1
1224 1 72 VAL QG 1 73 GLU H . . 3.430 2.671 2.041 3.307 . 0 0 "[ . 1 . 2]" 1
1225 1 72 VAL QG 1 85 PRO QB . . 4.370 3.669 3.260 4.063 . 0 0 "[ . 1 . 2]" 1
1226 1 72 VAL QG 1 85 PRO QD . . 3.520 2.451 2.018 3.091 . 0 0 "[ . 1 . 2]" 1
1227 1 72 VAL QG 1 85 PRO QG . . 3.210 2.220 2.049 2.492 . 0 0 "[ . 1 . 2]" 1
1228 1 72 VAL QG 1 105 GLN H . . 5.230 4.333 3.855 5.021 . 0 0 "[ . 1 . 2]" 1
1229 1 72 VAL QG 1 105 GLN QG . . 4.890 3.866 3.633 4.265 . 0 0 "[ . 1 . 2]" 1
1230 1 72 VAL QG 1 106 GLY H . . 4.740 4.430 4.232 4.823 0.083 13 0 "[ . 1 . 2]" 1
1231 1 72 VAL QG 1 106 GLY QA . . 3.690 2.159 1.987 2.609 . 0 0 "[ . 1 . 2]" 1
1232 1 72 VAL QG 1 107 ASN H . . 4.820 4.223 3.828 4.714 . 0 0 "[ . 1 . 2]" 1
1233 1 72 VAL MG1 1 73 GLU H . . 3.970 3.045 2.240 3.936 . 0 0 "[ . 1 . 2]" 1
1234 1 72 VAL MG2 1 73 GLU H . . 3.970 3.520 2.059 4.026 0.056 1 0 "[ . 1 . 2]" 1
1235 1 73 GLU H 1 73 GLU HB2 . . 3.690 3.056 2.809 3.225 . 0 0 "[ . 1 . 2]" 1
1236 1 73 GLU H 1 73 GLU HB3 . . 4.080 3.118 2.902 3.401 . 0 0 "[ . 1 . 2]" 1
1237 1 73 GLU H 1 73 GLU QG . . 4.760 4.285 4.186 4.402 . 0 0 "[ . 1 . 2]" 1
1238 1 73 GLU H 1 74 LEU H . . 4.450 4.338 4.209 4.438 . 0 0 "[ . 1 . 2]" 1
1239 1 73 GLU H 1 85 PRO QG . . 5.200 5.013 4.649 5.261 0.061 13 0 "[ . 1 . 2]" 1
1240 1 73 GLU H 1 103 ILE MG . . 3.720 2.907 2.737 3.186 . 0 0 "[ . 1 . 2]" 1
1241 1 73 GLU H 1 104 THR H . . 4.490 4.040 3.896 4.230 . 0 0 "[ . 1 . 2]" 1
1242 1 73 GLU H 1 105 GLN HB3 . . 4.210 2.966 2.601 3.257 . 0 0 "[ . 1 . 2]" 1
1243 1 73 GLU H 1 105 GLN QG . . 3.880 3.190 2.945 3.708 . 0 0 "[ . 1 . 2]" 1
1244 1 73 GLU H 1 106 GLY QA . . 5.270 4.083 3.527 4.528 . 0 0 "[ . 1 . 2]" 1
1245 1 73 GLU HA 1 73 GLU HG2 . . 4.200 3.316 2.658 3.747 . 0 0 "[ . 1 . 2]" 1
1246 1 73 GLU HA 1 73 GLU QG . . 3.510 2.361 2.155 2.653 . 0 0 "[ . 1 . 2]" 1
1247 1 73 GLU HA 1 73 GLU HG3 . . 4.200 2.423 2.246 2.716 . 0 0 "[ . 1 . 2]" 1
1248 1 73 GLU HA 1 74 LEU H . . 3.390 2.180 2.088 2.281 . 0 0 "[ . 1 . 2]" 1
1249 1 73 GLU HA 1 74 LEU HG . . 5.500 4.759 3.572 5.626 0.126 13 0 "[ . 1 . 2]" 1
1250 1 73 GLU HA 1 84 LYS HA . . 4.780 2.904 2.478 3.402 . 0 0 "[ . 1 . 2]" 1
1251 1 73 GLU HA 1 85 PRO QD . . 4.340 3.121 2.672 3.584 . 0 0 "[ . 1 . 2]" 1
1252 1 73 GLU HB2 1 104 THR H . . 5.430 5.319 4.974 5.466 0.036 4 0 "[ . 1 . 2]" 1
1253 1 73 GLU HB2 1 105 GLN H . . 5.210 4.812 4.378 5.122 . 0 0 "[ . 1 . 2]" 1
1254 1 73 GLU HB2 1 105 GLN HB2 . . 4.180 4.061 3.698 4.218 0.038 15 0 "[ . 1 . 2]" 1
1255 1 73 GLU HB3 1 74 LEU H . . 4.820 3.779 3.534 4.059 . 0 0 "[ . 1 . 2]" 1
1256 1 73 GLU HB3 1 75 GLU H . . 5.500 5.107 4.763 5.514 0.014 6 0 "[ . 1 . 2]" 1
1257 1 73 GLU HB3 1 104 THR H . . 5.200 3.845 3.385 4.105 . 0 0 "[ . 1 . 2]" 1
1258 1 73 GLU HB3 1 105 GLN H . . 4.740 3.785 3.290 4.105 . 0 0 "[ . 1 . 2]" 1
1259 1 73 GLU HB3 1 105 GLN HB2 . . 4.380 3.605 3.375 3.862 . 0 0 "[ . 1 . 2]" 1
1260 1 73 GLU HB3 1 105 GLN QG . . 4.450 3.523 3.309 3.719 . 0 0 "[ . 1 . 2]" 1
1261 1 73 GLU QG 1 74 LEU H . . 3.390 2.526 2.216 2.820 . 0 0 "[ . 1 . 2]" 1
1262 1 73 GLU QG 1 75 GLU HA . . 5.340 4.857 4.435 5.378 0.038 12 0 "[ . 1 . 2]" 1
1263 1 73 GLU QG 1 82 VAL QG . . 3.640 2.117 1.898 2.354 . 0 0 "[ . 1 . 2]" 1
1264 1 73 GLU QG 1 83 PHE H . . 4.100 3.639 3.353 3.957 . 0 0 "[ . 1 . 2]" 1
1265 1 73 GLU HG2 1 74 LEU H . . 4.230 3.475 2.465 4.259 0.029 3 0 "[ . 1 . 2]" 1
1266 1 73 GLU HG3 1 74 LEU H . . 4.230 2.780 2.229 3.489 . 0 0 "[ . 1 . 2]" 1
1267 1 74 LEU H 1 74 LEU HB2 . . 3.700 2.418 2.299 2.607 . 0 0 "[ . 1 . 2]" 1
1268 1 74 LEU H 1 74 LEU QD . . 3.490 3.108 2.715 3.581 0.091 3 0 "[ . 1 . 2]" 1
1269 1 74 LEU H 1 74 LEU HG . . 4.640 3.701 2.693 4.379 . 0 0 "[ . 1 . 2]" 1
1270 1 74 LEU H 1 75 GLU H . . 4.580 4.185 3.947 4.370 . 0 0 "[ . 1 . 2]" 1
1271 1 74 LEU H 1 82 VAL QG . . 4.230 3.609 2.583 4.180 . 0 0 "[ . 1 . 2]" 1
1272 1 74 LEU H 1 83 PHE H . . 3.710 3.213 3.079 3.361 . 0 0 "[ . 1 . 2]" 1
1273 1 74 LEU H 1 83 PHE HA . . 4.870 4.691 4.548 4.824 . 0 0 "[ . 1 . 2]" 1
1274 1 74 LEU H 1 83 PHE QD . . 4.860 4.488 3.460 4.868 0.008 13 0 "[ . 1 . 2]" 1
1275 1 74 LEU H 1 84 LYS HA . . 4.220 3.301 3.009 3.787 . 0 0 "[ . 1 . 2]" 1
1276 1 74 LEU H 1 85 PRO QD . . 3.510 3.528 3.321 3.570 0.060 6 0 "[ . 1 . 2]" 1
1277 1 74 LEU HA 1 74 LEU QD . . 3.280 2.230 2.073 2.938 . 0 0 "[ . 1 . 2]" 1
1278 1 74 LEU HA 1 75 GLU H . . 3.270 2.121 2.005 2.215 . 0 0 "[ . 1 . 2]" 1
1279 1 74 LEU HA 1 75 GLU QB . . 4.750 4.270 3.750 4.622 . 0 0 "[ . 1 . 2]" 1
1280 1 74 LEU HA 1 75 GLU QG . . 5.340 4.729 4.008 5.577 0.237 5 0 "[ . 1 . 2]" 1
1281 1 74 LEU HA 1 101 VAL HB . . 4.820 3.935 3.604 4.464 . 0 0 "[ . 1 . 2]" 1
1282 1 74 LEU HA 1 102 ILE H . . 4.830 4.195 4.016 4.405 . 0 0 "[ . 1 . 2]" 1
1283 1 74 LEU HA 1 103 ILE HA . . 4.390 2.632 2.347 3.009 . 0 0 "[ . 1 . 2]" 1
1284 1 74 LEU HA 1 103 ILE MG . . 4.260 4.152 3.968 4.302 0.042 1 0 "[ . 1 . 2]" 1
1285 1 74 LEU HA 1 104 THR H . . 3.900 2.986 2.478 3.295 . 0 0 "[ . 1 . 2]" 1
1286 1 74 LEU HA 1 104 THR MG . . 3.660 3.428 2.857 3.666 0.006 15 0 "[ . 1 . 2]" 1
1287 1 74 LEU HA 1 105 GLN H . . 5.220 4.900 4.383 5.242 0.022 7 0 "[ . 1 . 2]" 1
1288 1 74 LEU HB2 1 75 GLU H . . 4.950 4.484 4.345 4.593 . 0 0 "[ . 1 . 2]" 1
1289 1 74 LEU HB2 1 83 PHE H . . 4.220 3.440 3.126 3.792 . 0 0 "[ . 1 . 2]" 1
1290 1 74 LEU HB2 1 83 PHE QE . . 4.150 3.452 2.742 4.047 . 0 0 "[ . 1 . 2]" 1
1291 1 74 LEU HB2 1 101 VAL HB . . 4.760 4.028 3.489 4.370 . 0 0 "[ . 1 . 2]" 1
1292 1 74 LEU HB3 1 75 GLU H . . 3.830 3.733 3.323 3.911 0.081 12 0 "[ . 1 . 2]" 1
1293 1 74 LEU HB3 1 83 PHE QD . . 4.970 4.457 3.361 5.017 0.047 11 0 "[ . 1 . 2]" 1
1294 1 74 LEU HB3 1 83 PHE QE . . 5.070 3.794 2.879 4.553 . 0 0 "[ . 1 . 2]" 1
1295 1 74 LEU HB3 1 85 PRO QD . . 5.200 4.949 4.091 5.245 0.045 19 0 "[ . 1 . 2]" 1
1296 1 74 LEU HB3 1 101 VAL HB . . 4.780 2.393 2.242 2.632 . 0 0 "[ . 1 . 2]" 1
1297 1 74 LEU QD 1 75 GLU H . . 4.010 3.690 3.286 4.286 0.276 11 0 "[ . 1 . 2]" 1
1298 1 74 LEU QD 1 83 PHE QD . . 5.200 3.806 3.176 4.539 . 0 0 "[ . 1 . 2]" 1
1299 1 74 LEU QD 1 85 PRO QB . . 3.710 2.215 2.061 2.816 . 0 0 "[ . 1 . 2]" 1
1300 1 74 LEU QD 1 85 PRO QD . . 3.730 2.373 1.908 3.230 . 0 0 "[ . 1 . 2]" 1
1301 1 74 LEU QD 1 85 PRO QG . . 3.140 2.775 2.061 3.533 0.393 3 0 "[ . 1 . 2]" 1
1302 1 74 LEU QD 1 102 ILE H . . 5.260 3.717 3.349 4.481 . 0 0 "[ . 1 . 2]" 1
1303 1 74 LEU QD 1 103 ILE H . . 4.040 3.357 3.067 3.970 . 0 0 "[ . 1 . 2]" 1
1304 1 74 LEU QD 1 103 ILE HA . . 3.250 2.269 2.123 3.072 . 0 0 "[ . 1 . 2]" 1
1305 1 74 LEU QD 1 104 THR H . . 3.640 3.605 3.340 4.126 0.486 11 0 "[ . 1 . 2]" 1
1306 1 74 LEU QD 1 105 GLN H . . 4.400 4.552 3.920 5.118 0.718 2 6 "[ +* . ***1- . 2]" 1
1307 1 74 LEU HG 1 85 PRO QD . . 4.480 3.289 2.234 4.546 0.066 6 0 "[ . 1 . 2]" 1
1308 1 74 LEU HG 1 85 PRO QG . . 5.350 3.989 3.349 4.900 . 0 0 "[ . 1 . 2]" 1
1309 1 74 LEU HG 1 103 ILE HA . . 5.500 4.263 2.189 5.382 . 0 0 "[ . 1 . 2]" 1
1310 1 75 GLU H 1 75 GLU HB2 . . 3.860 3.217 2.110 3.812 . 0 0 "[ . 1 . 2]" 1
1311 1 75 GLU H 1 75 GLU QB . . 3.380 2.467 1.994 2.871 . 0 0 "[ . 1 . 2]" 1
1312 1 75 GLU H 1 75 GLU HB3 . . 3.860 2.692 2.066 3.430 . 0 0 "[ . 1 . 2]" 1
1313 1 75 GLU H 1 75 GLU HG2 . . 4.590 3.187 2.244 4.558 . 0 0 "[ . 1 . 2]" 1
1314 1 75 GLU H 1 75 GLU QG . . 3.960 2.930 2.216 3.862 . 0 0 "[ . 1 . 2]" 1
1315 1 75 GLU H 1 75 GLU HG3 . . 4.590 3.771 3.300 4.491 . 0 0 "[ . 1 . 2]" 1
1316 1 75 GLU H 1 76 CYS H . . 4.560 4.591 4.559 4.632 0.072 15 0 "[ . 1 . 2]" 1
1317 1 75 GLU H 1 76 CYS HA . . 5.470 5.390 5.226 5.495 0.025 12 0 "[ . 1 . 2]" 1
1318 1 75 GLU H 1 82 VAL MG1 . . 5.020 4.186 3.427 5.198 0.178 12 0 "[ . 1 . 2]" 1
1319 1 75 GLU H 1 82 VAL QG . . 4.070 3.757 3.063 4.123 0.053 15 0 "[ . 1 . 2]" 1
1320 1 75 GLU H 1 82 VAL MG2 . . 5.020 4.722 3.086 5.115 0.095 15 0 "[ . 1 . 2]" 1
1321 1 75 GLU H 1 101 VAL HA . . 5.380 5.142 4.855 5.345 . 0 0 "[ . 1 . 2]" 1
1322 1 75 GLU H 1 102 ILE H . . 3.670 3.485 3.167 3.714 0.044 12 0 "[ . 1 . 2]" 1
1323 1 75 GLU H 1 102 ILE HA . . 5.500 5.158 4.897 5.389 . 0 0 "[ . 1 . 2]" 1
1324 1 75 GLU H 1 102 ILE MD . . 4.190 4.183 3.978 4.246 0.056 2 0 "[ . 1 . 2]" 1
1325 1 75 GLU H 1 102 ILE HG12 . . 4.070 3.756 3.426 3.970 . 0 0 "[ . 1 . 2]" 1
1326 1 75 GLU H 1 103 ILE HA . . 4.000 3.781 3.613 3.985 . 0 0 "[ . 1 . 2]" 1
1327 1 75 GLU H 1 104 THR HA . . 5.380 4.978 4.420 5.268 . 0 0 "[ . 1 . 2]" 1
1328 1 75 GLU H 1 104 THR HB . . 5.500 3.100 2.414 3.562 . 0 0 "[ . 1 . 2]" 1
1329 1 75 GLU H 1 104 THR MG . . 3.540 2.857 2.497 3.109 . 0 0 "[ . 1 . 2]" 1
1330 1 75 GLU H 1 105 GLN H . . 5.500 5.375 5.158 5.523 0.023 4 0 "[ . 1 . 2]" 1
1331 1 75 GLU HA 1 76 CYS H . . 3.370 2.267 2.199 2.345 . 0 0 "[ . 1 . 2]" 1
1332 1 75 GLU HA 1 76 CYS HB2 . . 4.660 4.271 4.051 4.622 . 0 0 "[ . 1 . 2]" 1
1333 1 75 GLU HA 1 82 VAL HA . . 3.630 2.348 2.155 2.564 . 0 0 "[ . 1 . 2]" 1
1334 1 75 GLU HA 1 82 VAL QG . . 3.940 2.265 2.076 2.891 . 0 0 "[ . 1 . 2]" 1
1335 1 75 GLU HA 1 83 PHE H . . 3.910 3.777 3.609 3.952 0.042 15 0 "[ . 1 . 2]" 1
1336 1 75 GLU HA 1 104 THR MG . . 3.970 3.970 3.876 4.004 0.034 10 0 "[ . 1 . 2]" 1
1337 1 75 GLU QB 1 76 CYS H . . 3.650 3.012 2.621 3.596 . 0 0 "[ . 1 . 2]" 1
1338 1 75 GLU QB 1 76 CYS HA . . 5.000 4.678 4.167 5.002 0.002 2 0 "[ . 1 . 2]" 1
1339 1 75 GLU QB 1 76 CYS HB2 . . 5.340 5.103 4.820 5.491 0.151 3 0 "[ . 1 . 2]" 1
1340 1 75 GLU QB 1 104 THR HB . . 4.200 2.489 2.077 3.279 . 0 0 "[ . 1 . 2]" 1
1341 1 75 GLU QB 1 104 THR MG . . 3.110 2.378 2.159 2.902 . 0 0 "[ . 1 . 2]" 1
1342 1 75 GLU QG 1 76 CYS H . . 3.830 3.115 2.290 3.693 . 0 0 "[ . 1 . 2]" 1
1343 1 76 CYS H 1 76 CYS HB2 . . 3.700 2.366 2.221 2.526 . 0 0 "[ . 1 . 2]" 1
1344 1 76 CYS H 1 76 CYS HB3 . . 3.670 2.573 2.530 2.650 . 0 0 "[ . 1 . 2]" 1
1345 1 76 CYS H 1 80 SER H . . 5.500 5.521 5.414 5.558 0.058 12 0 "[ . 1 . 2]" 1
1346 1 76 CYS H 1 81 HIS H . . 4.210 4.004 3.595 4.235 0.025 15 0 "[ . 1 . 2]" 1
1347 1 76 CYS H 1 82 VAL H . . 5.500 5.244 5.083 5.509 0.009 14 0 "[ . 1 . 2]" 1
1348 1 76 CYS H 1 82 VAL HA . . 3.860 3.458 3.203 3.888 0.028 14 0 "[ . 1 . 2]" 1
1349 1 76 CYS H 1 82 VAL QG . . 3.880 3.286 2.859 4.344 0.464 5 0 "[ . 1 . 2]" 1
1350 1 76 CYS H 1 101 VAL QG . . 3.810 3.604 3.398 3.942 0.132 14 0 "[ . 1 . 2]" 1
1351 1 76 CYS H 1 102 ILE H . . 5.350 4.992 4.807 5.076 . 0 0 "[ . 1 . 2]" 1
1352 1 76 CYS HA 1 78 ASP H . . 5.180 4.890 4.707 5.172 . 0 0 "[ . 1 . 2]" 1
1353 1 76 CYS HA 1 100 ASN HD22 . . 4.630 3.108 3.051 3.189 . 0 0 "[ . 1 . 2]" 1
1354 1 76 CYS HA 1 101 VAL H . . 4.660 4.331 4.210 4.421 . 0 0 "[ . 1 . 2]" 1
1355 1 76 CYS HA 1 101 VAL HA . . 3.880 2.351 2.244 2.430 . 0 0 "[ . 1 . 2]" 1
1356 1 76 CYS HA 1 101 VAL QG . . 3.210 2.127 2.058 2.374 . 0 0 "[ . 1 . 2]" 1
1357 1 76 CYS HA 1 102 ILE MD . . 4.140 3.436 2.997 3.632 . 0 0 "[ . 1 . 2]" 1
1358 1 76 CYS HB2 1 77 LYS H . . 4.760 4.051 3.902 4.240 . 0 0 "[ . 1 . 2]" 1
1359 1 76 CYS HB2 1 79 CYS H . . 5.290 5.353 5.333 5.394 0.104 13 0 "[ . 1 . 2]" 1
1360 1 76 CYS HB2 1 80 SER H . . 4.690 4.786 4.741 4.843 0.153 1 0 "[ . 1 . 2]" 1
1361 1 76 CYS HB2 1 81 HIS H . . 3.920 3.917 3.857 3.942 0.022 6 0 "[ . 1 . 2]" 1
1362 1 76 CYS HB2 1 101 VAL QG . . 4.340 2.976 2.637 3.130 . 0 0 "[ . 1 . 2]" 1
1363 1 76 CYS HB3 1 77 LYS H . . 4.850 3.502 3.325 3.840 . 0 0 "[ . 1 . 2]" 1
1364 1 76 CYS HB3 1 79 CYS H . . 4.310 3.638 3.609 3.732 . 0 0 "[ . 1 . 2]" 1
1365 1 76 CYS HB3 1 79 CYS HA . . 4.870 4.603 4.567 4.786 . 0 0 "[ . 1 . 2]" 1
1366 1 76 CYS HB3 1 80 SER H . . 4.140 3.934 3.582 4.041 . 0 0 "[ . 1 . 2]" 1
1367 1 76 CYS HB3 1 81 HIS H . . 4.310 3.458 3.021 3.586 . 0 0 "[ . 1 . 2]" 1
1368 1 76 CYS HB3 1 101 VAL QG . . 4.160 4.093 3.843 4.234 0.074 15 0 "[ . 1 . 2]" 1
1369 1 77 LYS H 1 77 LYS HB2 . . 3.620 2.357 2.281 2.398 . 0 0 "[ . 1 . 2]" 1
1370 1 77 LYS H 1 77 LYS HB3 . . 3.770 3.596 3.535 3.622 . 0 0 "[ . 1 . 2]" 1
1371 1 77 LYS H 1 77 LYS QD . . 4.210 4.038 3.823 4.311 0.101 6 0 "[ . 1 . 2]" 1
1372 1 77 LYS H 1 77 LYS HG2 . . 3.790 2.573 2.378 2.732 . 0 0 "[ . 1 . 2]" 1
1373 1 77 LYS H 1 77 LYS QG . . 3.280 2.524 2.319 2.673 . 0 0 "[ . 1 . 2]" 1
1374 1 77 LYS H 1 77 LYS HG3 . . 3.790 3.658 3.222 3.802 0.012 12 0 "[ . 1 . 2]" 1
1375 1 77 LYS H 1 78 ASP H . . 3.260 3.022 2.924 3.227 . 0 0 "[ . 1 . 2]" 1
1376 1 77 LYS H 1 78 ASP QB . . 5.340 5.091 4.944 5.396 0.056 1 0 "[ . 1 . 2]" 1
1377 1 77 LYS H 1 100 ASN QB . . 4.340 4.323 4.207 4.366 0.026 15 0 "[ . 1 . 2]" 1
1378 1 77 LYS H 1 100 ASN HD22 . . 4.770 2.075 1.997 2.171 . 0 0 "[ . 1 . 2]" 1
1379 1 77 LYS H 1 101 VAL H . . 4.980 5.014 4.960 5.054 0.074 15 0 "[ . 1 . 2]" 1
1380 1 77 LYS H 1 101 VAL HA . . 3.950 3.389 3.293 3.498 . 0 0 "[ . 1 . 2]" 1
1381 1 77 LYS H 1 101 VAL QG . . 4.120 3.813 3.704 3.987 . 0 0 "[ . 1 . 2]" 1
1382 1 77 LYS H 1 102 ILE H . . 4.700 4.773 4.743 4.794 0.094 11 0 "[ . 1 . 2]" 1
1383 1 77 LYS H 1 102 ILE MD . . 4.350 3.459 3.286 3.598 . 0 0 "[ . 1 . 2]" 1
1384 1 77 LYS HA 1 77 LYS QD . . 3.470 2.337 2.101 3.476 0.006 1 0 "[ . 1 . 2]" 1
1385 1 77 LYS HA 1 77 LYS QE . . 4.090 3.137 2.023 3.962 . 0 0 "[ . 1 . 2]" 1
1386 1 77 LYS HA 1 77 LYS HG2 . . 3.790 2.762 2.591 2.849 . 0 0 "[ . 1 . 2]" 1
1387 1 77 LYS HA 1 77 LYS QG . . 3.300 2.693 2.545 2.767 . 0 0 "[ . 1 . 2]" 1
1388 1 77 LYS HA 1 77 LYS HG3 . . 3.790 3.737 3.696 3.760 . 0 0 "[ . 1 . 2]" 1
1389 1 77 LYS HA 1 79 CYS H . . 4.850 4.844 4.470 4.932 0.082 15 0 "[ . 1 . 2]" 1
1390 1 77 LYS HA 1 100 ASN HD21 . . 4.600 4.169 4.073 4.340 . 0 0 "[ . 1 . 2]" 1
1391 1 77 LYS HA 1 100 ASN HD22 . . 4.760 4.750 4.719 4.782 0.022 2 0 "[ . 1 . 2]" 1
1392 1 77 LYS HA 1 102 ILE MD . . 3.930 2.708 2.423 3.045 . 0 0 "[ . 1 . 2]" 1
1393 1 77 LYS HB2 1 78 ASP H . . 4.000 2.305 2.092 2.400 . 0 0 "[ . 1 . 2]" 1
1394 1 77 LYS HB2 1 100 ASN QB . . 4.000 3.600 3.480 3.747 . 0 0 "[ . 1 . 2]" 1
1395 1 77 LYS HB2 1 100 ASN HD21 . . 3.950 2.428 2.220 2.627 . 0 0 "[ . 1 . 2]" 1
1396 1 77 LYS HB2 1 100 ASN HD22 . . 3.860 2.763 2.737 2.795 . 0 0 "[ . 1 . 2]" 1
1397 1 77 LYS HB3 1 77 LYS QE . . 3.480 2.228 2.076 3.225 . 0 0 "[ . 1 . 2]" 1
1398 1 77 LYS HB3 1 78 ASP H . . 4.350 2.886 2.566 3.056 . 0 0 "[ . 1 . 2]" 1
1399 1 77 LYS HB3 1 100 ASN HD21 . . 4.040 3.875 3.679 4.047 0.007 6 0 "[ . 1 . 2]" 1
1400 1 77 LYS HB3 1 100 ASN HD22 . . 4.380 4.479 4.458 4.508 0.128 13 0 "[ . 1 . 2]" 1
1401 1 77 LYS QD 1 78 ASP H . . 4.880 4.922 4.790 4.958 0.078 6 0 "[ . 1 . 2]" 1
1402 1 77 LYS QD 1 100 ASN HD21 . . 4.330 3.959 3.883 4.007 . 0 0 "[ . 1 . 2]" 1
1403 1 77 LYS QD 1 100 ASN HD22 . . 5.210 5.217 5.145 5.239 0.029 4 0 "[ . 1 . 2]" 1
1404 1 77 LYS QD 1 102 ILE MD . . 2.690 2.126 1.966 2.700 0.010 9 0 "[ . 1 . 2]" 1
1405 1 77 LYS QD 1 102 ILE MG . . 2.940 2.690 2.440 2.957 0.017 6 0 "[ . 1 . 2]" 1
1406 1 77 LYS QE 1 78 ASP H . . 5.070 4.772 4.450 5.117 0.047 15 0 "[ . 1 . 2]" 1
1407 1 77 LYS QE 1 102 ILE MD . . 3.730 3.525 2.002 3.844 0.114 12 0 "[ . 1 . 2]" 1
1408 1 77 LYS QE 1 102 ILE MG . . 4.430 4.194 3.349 4.436 0.006 10 0 "[ . 1 . 2]" 1
1409 1 77 LYS QG 1 78 ASP H . . 4.310 4.056 3.894 4.117 . 0 0 "[ . 1 . 2]" 1
1410 1 77 LYS QG 1 100 ASN QB . . 4.260 2.563 2.344 2.727 . 0 0 "[ . 1 . 2]" 1
1411 1 77 LYS QG 1 100 ASN HD21 . . 4.660 2.041 1.957 2.137 . 0 0 "[ . 1 . 2]" 1
1412 1 77 LYS QG 1 100 ASN HD22 . . 4.450 3.377 3.331 3.408 . 0 0 "[ . 1 . 2]" 1
1413 1 77 LYS QG 1 101 VAL HA . . 4.530 3.537 3.376 3.785 . 0 0 "[ . 1 . 2]" 1
1414 1 77 LYS QG 1 102 ILE MG . . 3.670 3.161 2.909 3.394 . 0 0 "[ . 1 . 2]" 1
1415 1 78 ASP H 1 78 ASP HB2 . . 3.660 2.961 2.485 3.673 0.013 1 0 "[ . 1 . 2]" 1
1416 1 78 ASP H 1 78 ASP QB . . 3.000 2.514 2.420 2.652 . 0 0 "[ . 1 . 2]" 1
1417 1 78 ASP H 1 78 ASP HB3 . . 3.660 2.935 2.585 3.720 0.060 20 0 "[ . 1 . 2]" 1
1418 1 78 ASP H 1 79 CYS H . . 3.710 3.189 2.749 3.353 . 0 0 "[ . 1 . 2]" 1
1419 1 78 ASP H 1 79 CYS HA . . 5.430 4.828 4.681 5.110 . 0 0 "[ . 1 . 2]" 1
1420 1 78 ASP H 1 100 ASN HD21 . . 4.780 4.209 4.067 4.333 . 0 0 "[ . 1 . 2]" 1
1421 1 78 ASP QB 1 79 CYS H . . 4.380 3.989 3.912 4.025 . 0 0 "[ . 1 . 2]" 1
1422 1 79 CYS H 1 79 CYS HB2 . . 3.930 2.505 2.288 2.554 . 0 0 "[ . 1 . 2]" 1
1423 1 79 CYS H 1 79 CYS QB . . 3.350 2.375 2.067 2.435 . 0 0 "[ . 1 . 2]" 1
1424 1 79 CYS H 1 79 CYS HB3 . . 3.930 2.971 2.357 3.164 . 0 0 "[ . 1 . 2]" 1
1425 1 79 CYS H 1 80 SER HA . . 4.750 4.737 4.536 4.792 0.042 15 0 "[ . 1 . 2]" 1
1426 1 79 CYS H 1 80 SER QB . . 5.340 5.290 5.142 5.403 0.063 15 0 "[ . 1 . 2]" 1
1427 1 79 CYS H 1 81 HIS H . . 5.250 4.902 4.696 5.091 . 0 0 "[ . 1 . 2]" 1
1428 1 79 CYS HA 1 81 HIS H . . 5.350 4.722 4.572 5.100 . 0 0 "[ . 1 . 2]" 1
1429 1 79 CYS QB 1 80 SER H . . 3.720 2.067 2.004 2.229 . 0 0 "[ . 1 . 2]" 1
1430 1 79 CYS QB 1 81 HIS H . . 4.450 2.480 2.350 2.803 . 0 0 "[ . 1 . 2]" 1
1431 1 79 CYS QB 1 96 CYS H . . 5.300 5.290 4.890 5.369 0.069 15 0 "[ . 1 . 2]" 1
1432 1 79 CYS HB2 1 80 SER H . . 4.260 3.471 3.413 3.538 . 0 0 "[ . 1 . 2]" 1
1433 1 79 CYS HB3 1 80 SER H . . 4.260 2.084 2.016 2.259 . 0 0 "[ . 1 . 2]" 1
1434 1 80 SER H 1 80 SER HB2 . . 4.090 3.553 3.057 4.059 . 0 0 "[ . 1 . 2]" 1
1435 1 80 SER H 1 80 SER QB . . 3.490 3.024 2.680 3.313 . 0 0 "[ . 1 . 2]" 1
1436 1 80 SER H 1 80 SER HB3 . . 4.090 3.295 2.964 3.524 . 0 0 "[ . 1 . 2]" 1
1437 1 80 SER H 1 81 HIS H . . 3.680 2.159 1.922 2.751 . 0 0 "[ . 1 . 2]" 1
1438 1 80 SER QB 1 81 HIS H . . 4.140 3.935 3.455 4.093 . 0 0 "[ . 1 . 2]" 1
1439 1 80 SER HB2 1 81 HIS H . . 4.790 4.553 4.337 4.698 . 0 0 "[ . 1 . 2]" 1
1440 1 80 SER HB3 1 81 HIS H . . 4.790 4.331 3.629 4.646 . 0 0 "[ . 1 . 2]" 1
1441 1 81 HIS H 1 81 HIS HB2 . . 3.740 3.209 2.809 3.399 . 0 0 "[ . 1 . 2]" 1
1442 1 81 HIS H 1 81 HIS QB . . 3.090 2.541 2.243 2.783 . 0 0 "[ . 1 . 2]" 1
1443 1 81 HIS H 1 81 HIS HB3 . . 3.740 2.665 2.358 2.954 . 0 0 "[ . 1 . 2]" 1
1444 1 81 HIS H 1 81 HIS HD2 . . 5.170 4.888 4.677 5.236 0.066 12 0 "[ . 1 . 2]" 1
1445 1 81 HIS H 1 82 VAL H . . 4.490 4.451 4.359 4.527 0.037 20 0 "[ . 1 . 2]" 1
1446 1 81 HIS H 1 82 VAL QG . . 4.720 4.095 3.814 4.702 . 0 0 "[ . 1 . 2]" 1
1447 1 81 HIS H 1 95 LYS QD . . 4.410 3.879 2.873 4.497 0.087 15 0 "[ . 1 . 2]" 1
1448 1 81 HIS HA 1 82 VAL H . . 2.960 2.250 2.107 2.309 . 0 0 "[ . 1 . 2]" 1
1449 1 81 HIS QB 1 95 LYS H . . 5.250 3.756 3.459 4.235 . 0 0 "[ . 1 . 2]" 1
1450 1 81 HIS QB 1 95 LYS QB . . 4.850 3.490 3.285 3.738 . 0 0 "[ . 1 . 2]" 1
1451 1 81 HIS QB 1 95 LYS QD . . 3.630 2.236 2.030 2.685 . 0 0 "[ . 1 . 2]" 1
1452 1 81 HIS QB 1 95 LYS QG . . 4.180 2.496 2.010 2.884 . 0 0 "[ . 1 . 2]" 1
1453 1 81 HIS QB 1 96 CYS H . . 5.340 5.001 4.703 5.222 . 0 0 "[ . 1 . 2]" 1
1454 1 81 HIS HB2 1 82 VAL H . . 4.320 3.935 3.794 4.031 . 0 0 "[ . 1 . 2]" 1
1455 1 81 HIS HB2 1 95 LYS HD2 . . 4.840 2.737 2.252 4.104 . 0 0 "[ . 1 . 2]" 1
1456 1 81 HIS HB2 1 95 LYS HD3 . . 4.840 2.794 2.218 3.508 . 0 0 "[ . 1 . 2]" 1
1457 1 81 HIS HB3 1 82 VAL H . . 4.320 3.928 3.728 4.076 . 0 0 "[ . 1 . 2]" 1
1458 1 81 HIS HB3 1 95 LYS HD2 . . 4.840 3.709 2.907 4.730 . 0 0 "[ . 1 . 2]" 1
1459 1 81 HIS HB3 1 95 LYS HD3 . . 4.840 3.143 2.422 3.637 . 0 0 "[ . 1 . 2]" 1
1460 1 81 HIS HD2 1 83 PHE H . . 5.500 4.990 4.629 5.526 0.026 6 0 "[ . 1 . 2]" 1
1461 1 81 HIS HD2 1 83 PHE QD . . 3.690 2.559 2.207 3.302 . 0 0 "[ . 1 . 2]" 1
1462 1 81 HIS HD2 1 83 PHE QE . . 4.600 3.662 3.092 3.985 . 0 0 "[ . 1 . 2]" 1
1463 1 81 HIS HD2 1 93 CYS HA . . 5.310 3.792 3.171 4.952 . 0 0 "[ . 1 . 2]" 1
1464 1 81 HIS HD2 1 94 GLU H . . 5.040 2.711 2.441 3.120 . 0 0 "[ . 1 . 2]" 1
1465 1 81 HIS HD2 1 94 GLU HA . . 5.330 5.263 5.014 5.435 0.105 9 0 "[ . 1 . 2]" 1
1466 1 81 HIS HD2 1 94 GLU QB . . 4.050 3.180 2.230 4.058 0.008 12 0 "[ . 1 . 2]" 1
1467 1 81 HIS HD2 1 94 GLU HG2 . . 4.800 3.810 2.391 4.850 0.050 19 0 "[ . 1 . 2]" 1
1468 1 81 HIS HD2 1 94 GLU QG . . 3.970 3.318 2.359 3.767 . 0 0 "[ . 1 . 2]" 1
1469 1 81 HIS HD2 1 94 GLU HG3 . . 4.800 3.935 2.419 4.760 . 0 0 "[ . 1 . 2]" 1
1470 1 81 HIS HD2 1 95 LYS H . . 4.000 3.607 3.300 3.808 . 0 0 "[ . 1 . 2]" 1
1471 1 81 HIS HD2 1 96 CYS H . . 5.500 5.421 5.100 5.605 0.105 6 0 "[ . 1 . 2]" 1
1472 1 81 HIS HD2 1 101 VAL QG . . 5.350 4.634 4.156 5.282 . 0 0 "[ . 1 . 2]" 1
1473 1 81 HIS HE1 1 82 VAL H . . 5.090 3.935 3.669 4.157 . 0 0 "[ . 1 . 2]" 1
1474 1 82 VAL H 1 82 VAL HB . . 3.850 3.630 2.830 3.963 0.113 3 0 "[ . 1 . 2]" 1
1475 1 82 VAL H 1 82 VAL MG1 . . 3.910 3.090 2.351 3.973 0.063 20 0 "[ . 1 . 2]" 1
1476 1 82 VAL H 1 82 VAL QG . . 3.090 2.592 2.330 2.918 . 0 0 "[ . 1 . 2]" 1
1477 1 82 VAL H 1 82 VAL MG2 . . 3.910 2.973 2.689 3.931 0.021 12 0 "[ . 1 . 2]" 1
1478 1 82 VAL H 1 83 PHE H . . 4.650 4.333 4.191 4.393 . 0 0 "[ . 1 . 2]" 1
1479 1 82 VAL HA 1 82 VAL MG1 . . 3.510 2.682 2.316 3.273 . 0 0 "[ . 1 . 2]" 1
1480 1 82 VAL HA 1 82 VAL QG . . 2.830 2.449 2.158 2.568 . 0 0 "[ . 1 . 2]" 1
1481 1 82 VAL HA 1 82 VAL MG2 . . 3.510 2.972 2.514 3.245 . 0 0 "[ . 1 . 2]" 1
1482 1 82 VAL HA 1 83 PHE H . . 3.060 2.271 2.127 2.347 . 0 0 "[ . 1 . 2]" 1
1483 1 82 VAL HA 1 83 PHE QD . . 4.390 3.961 3.566 4.468 0.078 12 0 "[ . 1 . 2]" 1
1484 1 82 VAL HB 1 83 PHE H . . 4.030 3.282 2.791 4.057 0.027 8 0 "[ . 1 . 2]" 1
1485 1 82 VAL QG 1 83 PHE H . . 3.020 2.870 2.350 3.192 0.172 16 0 "[ . 1 . 2]" 1
1486 1 82 VAL QG 1 83 PHE QD . . 5.420 4.720 4.246 4.942 . 0 0 "[ . 1 . 2]" 1
1487 1 82 VAL MG1 1 83 PHE H . . 4.260 3.766 2.515 4.202 . 0 0 "[ . 1 . 2]" 1
1488 1 82 VAL MG2 1 83 PHE H . . 4.260 3.358 2.363 4.266 0.006 1 0 "[ . 1 . 2]" 1
1489 1 83 PHE H 1 83 PHE QB . . 3.770 3.201 3.113 3.261 . 0 0 "[ . 1 . 2]" 1
1490 1 83 PHE H 1 83 PHE QD . . 3.430 3.297 2.858 3.437 0.007 20 0 "[ . 1 . 2]" 1
1491 1 83 PHE H 1 83 PHE QE . . 4.730 4.500 4.369 4.647 . 0 0 "[ . 1 . 2]" 1
1492 1 83 PHE H 1 84 LYS H . . 4.430 4.425 4.355 4.442 0.012 16 0 "[ . 1 . 2]" 1
1493 1 83 PHE HA 1 83 PHE QD . . 4.060 3.783 3.738 3.806 . 0 0 "[ . 1 . 2]" 1
1494 1 83 PHE HA 1 84 LYS H . . 3.160 2.607 2.506 2.691 . 0 0 "[ . 1 . 2]" 1
1495 1 83 PHE QB 1 84 LYS H . . 3.160 2.079 1.972 2.195 . 0 0 "[ . 1 . 2]" 1
1496 1 83 PHE QD 1 84 LYS H . . 3.610 2.846 2.638 3.200 . 0 0 "[ . 1 . 2]" 1
1497 1 83 PHE QD 1 94 GLU H . . 4.880 3.287 3.124 3.630 . 0 0 "[ . 1 . 2]" 1
1498 1 83 PHE QD 1 94 GLU HA . . 5.500 5.541 5.042 5.619 0.119 9 0 "[ . 1 . 2]" 1
1499 1 83 PHE QD 1 95 LYS H . . 5.400 5.379 5.103 5.486 0.086 12 0 "[ . 1 . 2]" 1
1500 1 83 PHE QE 1 84 LYS H . . 5.100 5.120 4.963 5.178 0.078 12 0 "[ . 1 . 2]" 1
1501 1 83 PHE QE 1 85 PRO QB . . 4.570 4.429 3.435 4.615 0.045 16 0 "[ . 1 . 2]" 1
1502 1 83 PHE QE 1 93 CYS HA . . 4.340 2.031 1.960 2.252 . 0 0 "[ . 1 . 2]" 1
1503 1 83 PHE QE 1 94 GLU H . . 4.160 3.231 2.071 3.575 . 0 0 "[ . 1 . 2]" 1
1504 1 83 PHE QE 1 94 GLU QG . . 4.480 4.287 3.968 4.560 0.080 6 0 "[ . 1 . 2]" 1
1505 1 83 PHE QE 1 95 LYS H . . 5.500 5.384 4.174 5.610 0.110 19 0 "[ . 1 . 2]" 1
1506 1 83 PHE QE 1 101 VAL QG . . 4.200 2.318 2.168 2.806 . 0 0 "[ . 1 . 2]" 1
1507 1 84 LYS H 1 84 LYS QB . . 3.280 2.741 2.296 3.027 . 0 0 "[ . 1 . 2]" 1
1508 1 84 LYS H 1 84 LYS QD . . 4.770 3.454 1.881 4.698 . 0 0 "[ . 1 . 2]" 1
1509 1 84 LYS H 1 84 LYS QG . . 4.010 2.727 2.054 3.766 . 0 0 "[ . 1 . 2]" 1
1510 1 84 LYS HA 1 85 PRO HD2 . . 4.070 2.420 2.101 2.606 . 0 0 "[ . 1 . 2]" 1
1511 1 84 LYS HA 1 85 PRO HD3 . . 4.070 2.319 2.214 2.533 . 0 0 "[ . 1 . 2]" 1
1512 1 84 LYS QB 1 84 LYS QE . . 3.620 3.169 1.999 3.754 0.134 17 0 "[ . 1 . 2]" 1
1513 1 85 PRO HA 1 86 ASN H . . 3.520 2.215 2.105 2.564 . 0 0 "[ . 1 . 2]" 1
1514 1 85 PRO QB 1 86 ASN H . . 4.120 3.234 2.157 3.705 . 0 0 "[ . 1 . 2]" 1
1515 1 86 ASN H 1 86 ASN QB . . 3.570 2.766 2.582 3.169 . 0 0 "[ . 1 . 2]" 1
1516 1 86 ASN H 1 87 ALA H . . 4.070 2.893 2.302 4.228 0.158 16 0 "[ . 1 . 2]" 1
1517 1 86 ASN HA 1 86 ASN HD21 . . 4.140 2.837 2.253 3.928 . 0 0 "[ . 1 . 2]" 1
1518 1 86 ASN HA 1 86 ASN QD . . 3.630 2.754 2.235 3.609 . 0 0 "[ . 1 . 2]" 1
1519 1 86 ASN HA 1 86 ASN HD22 . . 4.140 3.833 3.667 4.207 0.067 1 0 "[ . 1 . 2]" 1
1520 1 86 ASN QB 1 86 ASN QD . . 3.060 2.352 2.275 2.582 . 0 0 "[ . 1 . 2]" 1
1521 1 86 ASN QB 1 86 ASN HD22 . . 3.560 3.368 3.344 3.443 . 0 0 "[ . 1 . 2]" 1
1522 1 86 ASN QB 1 87 ALA H . . 3.920 2.509 1.900 3.995 0.075 12 0 "[ . 1 . 2]" 1
1523 1 86 ASN QB 1 87 ALA HA . . 4.500 4.391 3.935 4.622 0.122 12 0 "[ . 1 . 2]" 1
1524 1 86 ASN QB 1 87 ALA MB . . 4.450 3.762 3.128 4.515 0.065 12 0 "[ . 1 . 2]" 1
1525 1 87 ALA H 1 87 ALA MB . . 3.110 2.296 2.178 2.861 . 0 0 "[ . 1 . 2]" 1
1526 1 87 ALA HA 1 88 LEU H . . 3.190 2.319 2.077 2.538 . 0 0 "[ . 1 . 2]" 1
1527 1 87 ALA HA 1 88 LEU QD . . 4.320 2.961 2.653 4.266 . 0 0 "[ . 1 . 2]" 1
1528 1 87 ALA HA 1 89 ASP H . . 4.770 4.553 3.935 4.819 0.049 15 0 "[ . 1 . 2]" 1
1529 1 87 ALA HA 1 90 TYR H . . 5.450 4.827 4.305 5.315 . 0 0 "[ . 1 . 2]" 1
1530 1 87 ALA MB 1 88 LEU H . . 3.190 2.563 2.087 3.289 0.099 18 0 "[ . 1 . 2]" 1
1531 1 87 ALA MB 1 88 LEU QD . . 4.150 3.794 2.616 4.418 0.268 12 0 "[ . 1 . 2]" 1
1532 1 87 ALA MB 1 89 ASP H . . 4.100 3.877 3.077 4.140 0.040 9 0 "[ . 1 . 2]" 1
1533 1 87 ALA MB 1 90 TYR H . . 4.210 3.081 2.673 3.852 . 0 0 "[ . 1 . 2]" 1
1534 1 87 ALA MB 1 90 TYR QD . . 4.130 2.890 2.352 3.533 . 0 0 "[ . 1 . 2]" 1
1535 1 88 LEU H 1 88 LEU HB2 . . 3.890 3.783 3.555 3.862 . 0 0 "[ . 1 . 2]" 1
1536 1 88 LEU H 1 88 LEU QB . . 3.390 3.029 2.322 3.258 . 0 0 "[ . 1 . 2]" 1
1537 1 88 LEU H 1 88 LEU HB3 . . 3.890 3.212 2.353 3.519 . 0 0 "[ . 1 . 2]" 1
1538 1 88 LEU H 1 88 LEU MD1 . . 4.070 4.043 3.673 4.123 0.053 4 0 "[ . 1 . 2]" 1
1539 1 88 LEU H 1 88 LEU QD . . 3.510 2.299 1.687 3.081 . 0 0 "[ . 1 . 2]" 1
1540 1 88 LEU H 1 88 LEU MD2 . . 4.070 2.326 1.689 3.309 . 0 0 "[ . 1 . 2]" 1
1541 1 88 LEU H 1 88 LEU HG . . 3.060 2.692 2.167 3.141 0.081 13 0 "[ . 1 . 2]" 1
1542 1 88 LEU H 1 89 ASP H . . 3.190 2.468 2.155 2.996 . 0 0 "[ . 1 . 2]" 1
1543 1 88 LEU HA 1 88 LEU QD . . 3.690 3.432 3.408 3.470 . 0 0 "[ . 1 . 2]" 1
1544 1 88 LEU HA 1 90 TYR H . . 4.820 4.366 3.613 4.858 0.038 15 0 "[ . 1 . 2]" 1
1545 1 88 LEU QB 1 89 ASP H . . 3.690 3.268 2.968 3.696 0.006 12 0 "[ . 1 . 2]" 1
1546 1 88 LEU QB 1 89 ASP QB . . 5.080 4.411 4.095 4.871 . 0 0 "[ . 1 . 2]" 1
1547 1 88 LEU QD 1 89 ASP H . . 3.780 2.855 2.445 3.079 . 0 0 "[ . 1 . 2]" 1
1548 1 88 LEU QD 1 90 TYR H . . 5.370 4.546 4.229 4.809 . 0 0 "[ . 1 . 2]" 1
1549 1 88 LEU MD1 1 89 ASP H . . 4.440 3.397 2.916 4.104 . 0 0 "[ . 1 . 2]" 1
1550 1 88 LEU MD2 1 89 ASP H . . 4.440 3.307 2.474 4.225 . 0 0 "[ . 1 . 2]" 1
1551 1 88 LEU HG 1 89 ASP H . . 3.350 2.023 1.782 2.573 . 0 0 "[ . 1 . 2]" 1
1552 1 88 LEU HG 1 89 ASP HA . . 4.850 4.212 3.738 4.778 . 0 0 "[ . 1 . 2]" 1
1553 1 88 LEU HG 1 89 ASP HB2 . . 5.020 3.383 2.860 3.661 . 0 0 "[ . 1 . 2]" 1
1554 1 88 LEU HG 1 89 ASP QB . . 4.400 3.202 2.785 3.486 . 0 0 "[ . 1 . 2]" 1
1555 1 88 LEU HG 1 89 ASP HB3 . . 5.020 4.028 3.730 4.570 . 0 0 "[ . 1 . 2]" 1
1556 1 88 LEU HG 1 90 TYR H . . 4.680 4.443 4.079 4.755 0.075 14 0 "[ . 1 . 2]" 1
1557 1 89 ASP H 1 89 ASP HB2 . . 3.180 2.473 2.373 2.685 . 0 0 "[ . 1 . 2]" 1
1558 1 89 ASP H 1 89 ASP QB . . 2.740 2.219 2.170 2.359 . 0 0 "[ . 1 . 2]" 1
1559 1 89 ASP H 1 89 ASP HB3 . . 3.180 2.518 2.416 2.614 . 0 0 "[ . 1 . 2]" 1
1560 1 89 ASP H 1 90 TYR QD . . 4.190 3.976 3.516 4.196 0.006 1 0 "[ . 1 . 2]" 1
1561 1 89 ASP H 1 90 TYR QE . . 5.260 4.714 4.197 5.283 0.023 11 0 "[ . 1 . 2]" 1
1562 1 89 ASP QB 1 90 TYR H . . 3.510 2.834 2.470 3.151 . 0 0 "[ . 1 . 2]" 1
1563 1 89 ASP HB2 1 90 TYR H . . 4.300 4.000 3.795 4.146 . 0 0 "[ . 1 . 2]" 1
1564 1 89 ASP HB3 1 90 TYR H . . 4.300 2.903 2.503 3.265 . 0 0 "[ . 1 . 2]" 1
1565 1 90 TYR H 1 90 TYR QB . . 3.160 2.846 2.500 3.175 0.015 20 0 "[ . 1 . 2]" 1
1566 1 90 TYR H 1 90 TYR QD . . 3.220 2.695 2.450 2.972 . 0 0 "[ . 1 . 2]" 1
1567 1 90 TYR H 1 90 TYR QE . . 4.620 4.269 3.797 4.690 0.070 18 0 "[ . 1 . 2]" 1
1568 1 90 TYR H 1 91 GLY H . . 3.440 2.662 2.340 3.109 . 0 0 "[ . 1 . 2]" 1
1569 1 90 TYR H 1 91 GLY HA2 . . 5.100 4.578 4.254 5.022 . 0 0 "[ . 1 . 2]" 1
1570 1 90 TYR H 1 91 GLY QA . . 4.320 4.054 3.803 4.337 0.017 15 0 "[ . 1 . 2]" 1
1571 1 90 TYR H 1 91 GLY HA3 . . 5.100 4.531 4.280 4.977 . 0 0 "[ . 1 . 2]" 1
1572 1 90 TYR HA 1 90 TYR QD . . 3.540 3.292 2.723 3.699 0.159 13 0 "[ . 1 . 2]" 1
1573 1 90 TYR HA 1 92 VAL H . . 3.810 3.435 3.224 3.832 0.022 11 0 "[ . 1 . 2]" 1
1574 1 90 TYR QB 1 91 GLY H . . 4.260 3.848 1.996 4.084 . 0 0 "[ . 1 . 2]" 1
1575 1 90 TYR QB 1 92 VAL H . . 4.660 4.225 2.921 4.580 . 0 0 "[ . 1 . 2]" 1
1576 1 90 TYR QB 1 92 VAL MG2 . . 4.180 3.685 2.601 4.222 0.042 14 0 "[ . 1 . 2]" 1
1577 1 90 TYR HB2 1 91 GLY H . . 4.980 4.209 2.042 4.518 . 0 0 "[ . 1 . 2]" 1
1578 1 90 TYR HB3 1 91 GLY H . . 4.980 4.488 2.812 4.657 . 0 0 "[ . 1 . 2]" 1
1579 1 91 GLY H 1 92 VAL H . . 3.110 2.961 2.555 3.132 0.022 7 0 "[ . 1 . 2]" 1
1580 1 91 GLY H 1 92 VAL MG2 . . 4.110 4.045 3.547 4.212 0.102 9 0 "[ . 1 . 2]" 1
1581 1 91 GLY H 1 99 LYS QD . . 5.500 4.706 3.634 5.520 0.020 14 0 "[ . 1 . 2]" 1
1582 1 91 GLY H 1 99 LYS QE . . 5.280 3.403 2.441 5.044 . 0 0 "[ . 1 . 2]" 1
1583 1 91 GLY H 1 99 LYS QG . . 5.340 4.791 3.380 5.449 0.109 16 0 "[ . 1 . 2]" 1
1584 1 91 GLY QA 1 92 VAL MG1 . . 5.340 4.320 3.930 4.476 . 0 0 "[ . 1 . 2]" 1
1585 1 91 GLY QA 1 92 VAL MG2 . . 4.270 4.099 3.930 4.285 0.015 16 0 "[ . 1 . 2]" 1
1586 1 91 GLY QA 1 101 VAL QG . . 5.280 4.579 3.760 5.010 . 0 0 "[ . 1 . 2]" 1
1587 1 91 GLY HA2 1 92 VAL MG2 . . 5.100 4.470 4.134 4.996 . 0 0 "[ . 1 . 2]" 1
1588 1 91 GLY HA3 1 92 VAL MG2 . . 5.100 4.835 4.407 4.985 . 0 0 "[ . 1 . 2]" 1
1589 1 92 VAL H 1 92 VAL HB . . 3.740 3.623 3.596 3.655 . 0 0 "[ . 1 . 2]" 1
1590 1 92 VAL H 1 92 VAL MG1 . . 2.800 2.565 2.425 2.695 . 0 0 "[ . 1 . 2]" 1
1591 1 92 VAL H 1 92 VAL MG2 . . 3.050 1.912 1.859 1.999 . 0 0 "[ . 1 . 2]" 1
1592 1 92 VAL H 1 93 CYS H . . 4.660 4.645 4.608 4.672 0.012 11 0 "[ . 1 . 2]" 1
1593 1 92 VAL H 1 99 LYS QE . . 4.970 3.464 3.064 3.978 . 0 0 "[ . 1 . 2]" 1
1594 1 92 VAL HA 1 92 VAL MG1 . . 3.260 2.315 2.284 2.352 . 0 0 "[ . 1 . 2]" 1
1595 1 92 VAL HA 1 92 VAL MG2 . . 3.230 3.256 3.248 3.264 0.034 12 0 "[ . 1 . 2]" 1
1596 1 92 VAL HA 1 93 CYS H . . 3.290 2.371 2.261 2.506 . 0 0 "[ . 1 . 2]" 1
1597 1 92 VAL HA 1 93 CYS HA . . 5.020 4.436 4.356 4.516 . 0 0 "[ . 1 . 2]" 1
1598 1 92 VAL HA 1 98 SER H . . 4.390 3.980 3.697 4.268 . 0 0 "[ . 1 . 2]" 1
1599 1 92 VAL HB 1 93 CYS H . . 3.400 2.424 2.200 2.705 . 0 0 "[ . 1 . 2]" 1
1600 1 92 VAL HB 1 93 CYS QB . . 4.660 3.965 3.609 4.189 . 0 0 "[ . 1 . 2]" 1
1601 1 92 VAL HB 1 97 HIS H . . 5.500 4.969 4.759 5.104 . 0 0 "[ . 1 . 2]" 1
1602 1 92 VAL HB 1 97 HIS HA . . 4.270 2.255 2.140 2.498 . 0 0 "[ . 1 . 2]" 1
1603 1 92 VAL HB 1 98 SER H . . 4.620 2.772 2.473 3.062 . 0 0 "[ . 1 . 2]" 1
1604 1 92 VAL MG1 1 93 CYS H . . 3.570 3.533 3.435 3.583 0.013 12 0 "[ . 1 . 2]" 1
1605 1 92 VAL MG1 1 97 HIS HA . . 3.400 3.154 3.002 3.400 . 0 0 "[ . 1 . 2]" 1
1606 1 92 VAL MG1 1 97 HIS HB2 . . 4.300 3.963 3.100 4.385 0.085 13 0 "[ . 1 . 2]" 1
1607 1 92 VAL MG1 1 97 HIS QB . . 3.670 3.079 2.846 3.380 . 0 0 "[ . 1 . 2]" 1
1608 1 92 VAL MG1 1 97 HIS HB3 . . 4.300 3.507 2.898 4.349 0.049 15 0 "[ . 1 . 2]" 1
1609 1 92 VAL MG1 1 98 SER QB . . 5.500 4.181 4.109 4.306 . 0 0 "[ . 1 . 2]" 1
1610 1 92 VAL MG1 1 99 LYS QE . . 4.050 2.411 2.074 2.955 . 0 0 "[ . 1 . 2]" 1
1611 1 92 VAL MG1 1 99 LYS QG . . 4.210 2.454 2.048 4.114 . 0 0 "[ . 1 . 2]" 1
1612 1 92 VAL MG2 1 93 CYS H . . 3.930 3.676 3.485 3.900 . 0 0 "[ . 1 . 2]" 1
1613 1 92 VAL MG2 1 94 GLU H . . 5.500 5.100 4.612 5.514 0.014 9 0 "[ . 1 . 2]" 1
1614 1 92 VAL MG2 1 97 HIS QB . . 3.820 3.088 2.573 3.581 . 0 0 "[ . 1 . 2]" 1
1615 1 92 VAL MG2 1 98 SER H . . 4.510 4.298 3.925 4.551 0.041 9 0 "[ . 1 . 2]" 1
1616 1 92 VAL MG2 1 99 LYS QE . . 4.040 4.009 3.757 4.099 0.059 18 0 "[ . 1 . 2]" 1
1617 1 93 CYS H 1 93 CYS QB . . 3.620 2.101 2.033 2.180 . 0 0 "[ . 1 . 2]" 1
1618 1 93 CYS H 1 94 GLU H . . 4.640 4.603 4.544 4.638 . 0 0 "[ . 1 . 2]" 1
1619 1 93 CYS H 1 97 HIS HA . . 4.280 3.709 3.637 3.782 . 0 0 "[ . 1 . 2]" 1
1620 1 93 CYS H 1 97 HIS QB . . 5.340 5.403 5.335 5.449 0.109 13 0 "[ . 1 . 2]" 1
1621 1 93 CYS H 1 98 SER H . . 3.590 2.698 2.597 2.860 . 0 0 "[ . 1 . 2]" 1
1622 1 93 CYS H 1 98 SER HA . . 4.820 4.600 4.361 4.857 0.037 15 0 "[ . 1 . 2]" 1
1623 1 93 CYS H 1 98 SER QB . . 4.610 4.375 4.276 4.492 . 0 0 "[ . 1 . 2]" 1
1624 1 93 CYS H 1 99 LYS H . . 5.380 4.981 4.807 5.253 . 0 0 "[ . 1 . 2]" 1
1625 1 93 CYS H 1 99 LYS HA . . 4.240 3.758 3.499 4.146 . 0 0 "[ . 1 . 2]" 1
1626 1 93 CYS H 1 100 ASN H . . 4.860 4.709 4.471 4.893 0.033 1 0 "[ . 1 . 2]" 1
1627 1 93 CYS H 1 101 VAL H . . 5.500 5.226 4.674 5.508 0.008 13 0 "[ . 1 . 2]" 1
1628 1 93 CYS H 1 101 VAL QG . . 4.020 3.666 3.077 4.031 0.011 13 0 "[ . 1 . 2]" 1
1629 1 93 CYS HA 1 98 SER H . . 5.210 5.239 5.124 5.311 0.101 17 0 "[ . 1 . 2]" 1
1630 1 93 CYS HA 1 101 VAL QG . . 3.830 3.350 2.967 3.516 . 0 0 "[ . 1 . 2]" 1
1631 1 93 CYS QB 1 95 LYS H . . 4.960 4.052 3.456 4.262 . 0 0 "[ . 1 . 2]" 1
1632 1 93 CYS QB 1 96 CYS H . . 4.180 3.225 2.322 3.481 . 0 0 "[ . 1 . 2]" 1
1633 1 93 CYS QB 1 97 HIS H . . 5.270 5.058 3.955 5.287 0.017 1 0 "[ . 1 . 2]" 1
1634 1 93 CYS QB 1 98 SER H . . 3.700 2.990 2.614 3.161 . 0 0 "[ . 1 . 2]" 1
1635 1 94 GLU H 1 94 GLU HB2 . . 4.030 2.682 2.395 3.848 . 0 0 "[ . 1 . 2]" 1
1636 1 94 GLU H 1 94 GLU HB3 . . 4.030 3.393 2.027 3.670 . 0 0 "[ . 1 . 2]" 1
1637 1 94 GLU H 1 94 GLU HG2 . . 4.130 2.723 2.336 4.282 0.152 6 0 "[ . 1 . 2]" 1
1638 1 94 GLU H 1 94 GLU QG . . 3.570 2.474 2.154 3.575 0.005 6 0 "[ . 1 . 2]" 1
1639 1 94 GLU H 1 94 GLU HG3 . . 4.130 3.407 2.199 3.907 . 0 0 "[ . 1 . 2]" 1
1640 1 94 GLU H 1 95 LYS H . . 3.830 2.576 2.268 2.691 . 0 0 "[ . 1 . 2]" 1
1641 1 94 GLU H 1 95 LYS QG . . 5.340 4.363 3.977 4.730 . 0 0 "[ . 1 . 2]" 1
1642 1 94 GLU H 1 96 CYS H . . 5.300 4.299 4.043 4.557 . 0 0 "[ . 1 . 2]" 1
1643 1 94 GLU H 1 101 VAL QG . . 4.840 4.761 4.492 4.944 0.104 19 0 "[ . 1 . 2]" 1
1644 1 94 GLU HA 1 94 GLU HG2 . . 4.130 3.023 2.310 4.191 0.061 14 0 "[ . 1 . 2]" 1
1645 1 94 GLU HA 1 94 GLU QG . . 3.580 2.836 2.262 3.460 . 0 0 "[ . 1 . 2]" 1
1646 1 94 GLU HA 1 94 GLU HG3 . . 4.130 3.646 3.222 3.762 . 0 0 "[ . 1 . 2]" 1
1647 1 94 GLU QB 1 95 LYS H . . 3.750 2.765 2.456 3.766 0.016 14 0 "[ . 1 . 2]" 1
1648 1 94 GLU HB2 1 95 LYS H . . 4.330 2.965 2.515 4.309 . 0 0 "[ . 1 . 2]" 1
1649 1 94 GLU HB3 1 95 LYS H . . 4.330 3.617 2.907 4.156 . 0 0 "[ . 1 . 2]" 1
1650 1 94 GLU QG 1 95 LYS H . . 4.080 3.809 2.645 4.098 0.018 20 0 "[ . 1 . 2]" 1
1651 1 94 GLU HG2 1 95 LYS H . . 4.730 4.312 2.867 4.848 0.118 19 0 "[ . 1 . 2]" 1
1652 1 94 GLU HG3 1 95 LYS H . . 4.730 4.390 2.693 4.857 0.127 20 0 "[ . 1 . 2]" 1
1653 1 95 LYS H 1 95 LYS HB2 . . 3.720 2.543 2.389 2.829 . 0 0 "[ . 1 . 2]" 1
1654 1 95 LYS H 1 95 LYS QB . . 3.160 2.499 2.358 2.749 . 0 0 "[ . 1 . 2]" 1
1655 1 95 LYS H 1 95 LYS HB3 . . 3.720 3.685 3.624 3.772 0.052 15 0 "[ . 1 . 2]" 1
1656 1 95 LYS H 1 95 LYS HD2 . . 4.810 4.574 2.849 4.884 0.074 19 0 "[ . 1 . 2]" 1
1657 1 95 LYS H 1 95 LYS QD . . 4.170 3.861 2.789 4.267 0.097 6 0 "[ . 1 . 2]" 1
1658 1 95 LYS H 1 95 LYS HD3 . . 4.810 4.270 3.974 4.756 . 0 0 "[ . 1 . 2]" 1
1659 1 95 LYS H 1 95 LYS QE . . 5.220 4.804 4.141 4.985 . 0 0 "[ . 1 . 2]" 1
1660 1 95 LYS H 1 95 LYS HG2 . . 3.920 3.419 2.232 3.892 . 0 0 "[ . 1 . 2]" 1
1661 1 95 LYS H 1 95 LYS QG . . 3.380 2.475 2.217 2.634 . 0 0 "[ . 1 . 2]" 1
1662 1 95 LYS H 1 95 LYS HG3 . . 3.920 2.752 2.383 3.857 . 0 0 "[ . 1 . 2]" 1
1663 1 95 LYS HA 1 95 LYS HD2 . . 4.920 4.416 2.443 4.828 . 0 0 "[ . 1 . 2]" 1
1664 1 95 LYS HA 1 95 LYS QD . . 4.160 3.904 2.422 4.198 0.038 19 0 "[ . 1 . 2]" 1
1665 1 95 LYS HA 1 95 LYS HD3 . . 4.920 4.521 3.995 4.785 . 0 0 "[ . 1 . 2]" 1
1666 1 95 LYS HA 1 95 LYS QE . . 4.400 3.634 2.354 4.378 . 0 0 "[ . 1 . 2]" 1
1667 1 95 LYS HA 1 95 LYS HG2 . . 3.980 2.627 2.440 3.532 . 0 0 "[ . 1 . 2]" 1
1668 1 95 LYS HA 1 95 LYS QG . . 3.390 2.518 2.354 3.281 . 0 0 "[ . 1 . 2]" 1
1669 1 95 LYS HA 1 95 LYS HG3 . . 3.980 3.263 2.949 3.898 . 0 0 "[ . 1 . 2]" 1
1670 1 95 LYS QB 1 95 LYS QE . . 4.170 2.033 1.909 2.207 . 0 0 "[ . 1 . 2]" 1
1671 1 95 LYS QB 1 96 CYS QB . . 4.780 3.283 3.044 4.290 . 0 0 "[ . 1 . 2]" 1
1672 1 95 LYS HB2 1 95 LYS QE . . 4.870 3.141 2.075 3.619 . 0 0 "[ . 1 . 2]" 1
1673 1 95 LYS HB2 1 96 CYS H . . 3.810 2.287 1.796 2.495 . 0 0 "[ . 1 . 2]" 1
1674 1 95 LYS HB3 1 95 LYS QE . . 4.870 2.077 1.930 2.384 . 0 0 "[ . 1 . 2]" 1
1675 1 95 LYS HB3 1 96 CYS H . . 3.810 3.308 2.956 3.753 . 0 0 "[ . 1 . 2]" 1
1676 1 95 LYS QD 1 96 CYS H . . 4.490 4.564 4.496 4.654 0.164 6 0 "[ . 1 . 2]" 1
1677 1 95 LYS QE 1 95 LYS HG2 . . 3.420 2.627 2.294 3.474 0.054 8 0 "[ . 1 . 2]" 1
1678 1 95 LYS QE 1 95 LYS QG . . 2.770 2.407 2.254 2.808 0.038 8 0 "[ . 1 . 2]" 1
1679 1 95 LYS QE 1 95 LYS HG3 . . 3.420 3.206 2.424 3.502 0.082 16 0 "[ . 1 . 2]" 1
1680 1 95 LYS QE 1 96 CYS H . . 5.500 4.884 3.504 5.155 . 0 0 "[ . 1 . 2]" 1
1681 1 95 LYS QG 1 96 CYS H . . 4.040 3.908 3.578 4.057 0.017 4 0 "[ . 1 . 2]" 1
1682 1 95 LYS HG2 1 96 CYS H . . 4.810 4.648 3.736 4.884 0.074 19 0 "[ . 1 . 2]" 1
1683 1 95 LYS HG3 1 96 CYS H . . 4.810 4.283 3.784 4.742 . 0 0 "[ . 1 . 2]" 1
1684 1 96 CYS H 1 96 CYS HB2 . . 3.900 3.781 2.852 3.928 0.028 20 0 "[ . 1 . 2]" 1
1685 1 96 CYS H 1 96 CYS QB . . 3.420 2.861 2.565 3.051 . 0 0 "[ . 1 . 2]" 1
1686 1 96 CYS H 1 96 CYS HB3 . . 3.900 2.995 2.615 3.642 . 0 0 "[ . 1 . 2]" 1
1687 1 96 CYS H 1 97 HIS HD2 . . 5.500 5.421 5.091 5.637 0.137 17 0 "[ . 1 . 2]" 1
1688 1 96 CYS QB 1 97 HIS H . . 4.300 3.201 2.324 3.626 . 0 0 "[ . 1 . 2]" 1
1689 1 97 HIS H 1 97 HIS HB2 . . 3.960 2.936 2.604 3.581 . 0 0 "[ . 1 . 2]" 1
1690 1 97 HIS H 1 97 HIS QB . . 3.470 2.561 2.412 2.810 . 0 0 "[ . 1 . 2]" 1
1691 1 97 HIS H 1 97 HIS HB3 . . 3.960 3.319 2.454 3.880 . 0 0 "[ . 1 . 2]" 1
1692 1 97 HIS H 1 97 HIS HD2 . . 4.080 3.277 1.716 4.126 0.046 9 0 "[ . 1 . 2]" 1
1693 1 97 HIS H 1 98 SER H . . 4.160 3.618 2.678 3.843 . 0 0 "[ . 1 . 2]" 1
1694 1 97 HIS HB2 1 98 SER H . . 4.590 4.391 4.194 4.471 . 0 0 "[ . 1 . 2]" 1
1695 1 97 HIS HB3 1 98 SER H . . 4.590 4.419 4.252 4.604 0.014 3 0 "[ . 1 . 2]" 1
1696 1 97 HIS HD2 1 98 SER H . . 5.050 5.004 4.838 5.152 0.102 17 0 "[ . 1 . 2]" 1
1697 1 98 SER H 1 98 SER QB . . 3.500 2.666 2.570 2.767 . 0 0 "[ . 1 . 2]" 1
1698 1 98 SER H 1 99 LYS H . . 4.410 4.417 4.360 4.451 0.041 6 0 "[ . 1 . 2]" 1
1699 1 98 SER H 1 100 ASN H . . 5.010 4.649 4.408 4.885 . 0 0 "[ . 1 . 2]" 1
1700 1 98 SER H 1 101 VAL QG . . 5.220 5.193 4.888 5.435 0.215 10 0 "[ . 1 . 2]" 1
1701 1 98 SER HA 1 99 LYS H . . 2.950 2.287 2.229 2.373 . 0 0 "[ . 1 . 2]" 1
1702 1 98 SER HA 1 100 ASN QB . . 5.340 5.301 5.056 5.356 0.016 15 0 "[ . 1 . 2]" 1
1703 1 98 SER QB 1 99 LYS H . . 3.920 2.720 2.453 3.376 . 0 0 "[ . 1 . 2]" 1
1704 1 98 SER QB 1 100 ASN H . . 4.250 2.722 2.541 3.228 . 0 0 "[ . 1 . 2]" 1
1705 1 98 SER QB 1 100 ASN HB2 . . 5.500 4.520 4.149 4.982 . 0 0 "[ . 1 . 2]" 1
1706 1 98 SER QB 1 100 ASN QB . . 4.850 3.037 2.632 3.562 . 0 0 "[ . 1 . 2]" 1
1707 1 98 SER QB 1 100 ASN HB3 . . 5.500 3.087 2.661 3.648 . 0 0 "[ . 1 . 2]" 1
1708 1 99 LYS H 1 99 LYS HB2 . . 4.040 2.680 2.225 3.806 . 0 0 "[ . 1 . 2]" 1
1709 1 99 LYS H 1 99 LYS QB . . 3.280 2.514 2.203 3.004 . 0 0 "[ . 1 . 2]" 1
1710 1 99 LYS H 1 99 LYS HB3 . . 4.040 3.557 2.904 3.777 . 0 0 "[ . 1 . 2]" 1
1711 1 99 LYS H 1 99 LYS QD . . 4.340 3.892 1.983 4.374 0.034 15 0 "[ . 1 . 2]" 1
1712 1 99 LYS H 1 99 LYS QE . . 4.730 4.391 3.126 4.819 0.089 8 0 "[ . 1 . 2]" 1
1713 1 99 LYS H 1 99 LYS QG . . 3.240 2.512 2.076 3.255 0.015 3 0 "[ . 1 . 2]" 1
1714 1 99 LYS H 1 100 ASN H . . 3.690 2.806 2.581 2.996 . 0 0 "[ . 1 . 2]" 1
1715 1 99 LYS H 1 100 ASN QB . . 4.770 4.294 4.086 4.513 . 0 0 "[ . 1 . 2]" 1
1716 1 99 LYS H 1 101 VAL H . . 5.500 5.157 4.949 5.282 . 0 0 "[ . 1 . 2]" 1
1717 1 99 LYS HA 1 99 LYS QG . . 3.590 2.597 2.251 3.495 . 0 0 "[ . 1 . 2]" 1
1718 1 99 LYS HA 1 101 VAL H . . 3.470 3.331 3.108 3.498 0.028 15 0 "[ . 1 . 2]" 1
1719 1 99 LYS HA 1 101 VAL QG . . 3.530 2.976 2.739 3.102 . 0 0 "[ . 1 . 2]" 1
1720 1 99 LYS HB2 1 100 ASN H . . 4.580 4.089 3.773 4.494 . 0 0 "[ . 1 . 2]" 1
1721 1 99 LYS HB3 1 100 ASN H . . 4.580 4.458 4.334 4.583 0.003 17 0 "[ . 1 . 2]" 1
1722 1 99 LYS QG 1 100 ASN H . . 4.830 4.386 3.792 4.747 . 0 0 "[ . 1 . 2]" 1
1723 1 100 ASN H 1 100 ASN HB2 . . 3.860 3.560 3.544 3.578 . 0 0 "[ . 1 . 2]" 1
1724 1 100 ASN H 1 100 ASN QB . . 3.070 2.428 2.364 2.470 . 0 0 "[ . 1 . 2]" 1
1725 1 100 ASN H 1 100 ASN HB3 . . 3.860 2.472 2.401 2.521 . 0 0 "[ . 1 . 2]" 1
1726 1 100 ASN H 1 100 ASN HD21 . . 4.430 4.183 3.982 4.383 . 0 0 "[ . 1 . 2]" 1
1727 1 100 ASN H 1 100 ASN HD22 . . 4.620 4.249 4.018 4.452 . 0 0 "[ . 1 . 2]" 1
1728 1 100 ASN H 1 101 VAL H . . 3.720 2.923 2.780 2.992 . 0 0 "[ . 1 . 2]" 1
1729 1 100 ASN H 1 101 VAL MG1 . . 4.310 3.984 3.832 4.092 . 0 0 "[ . 1 . 2]" 1
1730 1 100 ASN H 1 101 VAL QG . . 3.780 3.663 3.562 3.725 . 0 0 "[ . 1 . 2]" 1
1731 1 100 ASN H 1 101 VAL MG2 . . 4.310 4.281 4.103 4.332 0.022 5 0 "[ . 1 . 2]" 1
1732 1 100 ASN HA 1 100 ASN HD21 . . 4.220 3.926 3.816 4.012 . 0 0 "[ . 1 . 2]" 1
1733 1 100 ASN HA 1 100 ASN HD22 . . 5.170 5.075 5.025 5.111 . 0 0 "[ . 1 . 2]" 1
1734 1 100 ASN QB 1 100 ASN HD21 . . 3.080 2.376 2.276 2.463 . 0 0 "[ . 1 . 2]" 1
1735 1 100 ASN QB 1 100 ASN HD22 . . 3.460 3.389 3.354 3.424 . 0 0 "[ . 1 . 2]" 1
1736 1 100 ASN HB2 1 101 VAL H . . 4.530 4.350 4.290 4.417 . 0 0 "[ . 1 . 2]" 1
1737 1 100 ASN HB3 1 101 VAL H . . 4.530 4.434 4.345 4.503 . 0 0 "[ . 1 . 2]" 1
1738 1 101 VAL H 1 101 VAL HB . . 3.800 3.611 3.586 3.631 . 0 0 "[ . 1 . 2]" 1
1739 1 101 VAL H 1 101 VAL MG1 . . 3.220 2.205 2.137 2.277 . 0 0 "[ . 1 . 2]" 1
1740 1 101 VAL H 1 101 VAL QG . . 2.630 1.906 1.882 1.924 . 0 0 "[ . 1 . 2]" 1
1741 1 101 VAL H 1 101 VAL MG2 . . 3.220 2.088 2.031 2.132 . 0 0 "[ . 1 . 2]" 1
1742 1 101 VAL H 1 102 ILE H . . 4.830 4.647 4.624 4.669 . 0 0 "[ . 1 . 2]" 1
1743 1 101 VAL H 1 102 ILE MD . . 5.160 5.178 5.139 5.208 0.048 13 0 "[ . 1 . 2]" 1
1744 1 101 VAL HA 1 101 VAL QG . . 3.120 2.272 2.246 2.309 . 0 0 "[ . 1 . 2]" 1
1745 1 101 VAL HA 1 102 ILE H . . 3.230 2.228 2.204 2.271 . 0 0 "[ . 1 . 2]" 1
1746 1 101 VAL HA 1 102 ILE MD . . 4.830 2.888 2.820 2.932 . 0 0 "[ . 1 . 2]" 1
1747 1 101 VAL HA 1 102 ILE HG12 . . 5.210 4.932 4.840 5.019 . 0 0 "[ . 1 . 2]" 1
1748 1 101 VAL HA 1 102 ILE MG . . 4.040 3.712 3.611 3.819 . 0 0 "[ . 1 . 2]" 1
1749 1 101 VAL HB 1 102 ILE H . . 3.320 2.630 2.489 2.799 . 0 0 "[ . 1 . 2]" 1
1750 1 101 VAL QG 1 102 ILE H . . 3.810 3.291 3.231 3.362 . 0 0 "[ . 1 . 2]" 1
1751 1 101 VAL QG 1 102 ILE HA . . 4.120 3.976 3.826 4.147 0.027 14 0 "[ . 1 . 2]" 1
1752 1 101 VAL MG1 1 102 ILE H . . 4.460 3.614 3.550 3.703 . 0 0 "[ . 1 . 2]" 1
1753 1 101 VAL MG2 1 102 ILE H . . 4.460 3.794 3.657 3.945 . 0 0 "[ . 1 . 2]" 1
1754 1 102 ILE H 1 102 ILE MD . . 3.450 2.063 1.978 2.140 . 0 0 "[ . 1 . 2]" 1
1755 1 102 ILE H 1 102 ILE HG12 . . 3.760 2.954 2.865 3.053 . 0 0 "[ . 1 . 2]" 1
1756 1 102 ILE H 1 102 ILE HG13 . . 4.090 4.109 4.075 4.134 0.044 1 0 "[ . 1 . 2]" 1
1757 1 102 ILE H 1 102 ILE MG . . 3.450 3.121 3.058 3.152 . 0 0 "[ . 1 . 2]" 1
1758 1 102 ILE H 1 103 ILE H . . 4.520 4.506 4.488 4.526 0.006 17 0 "[ . 1 . 2]" 1
1759 1 102 ILE HA 1 102 ILE MD . . 4.710 3.791 3.780 3.804 . 0 0 "[ . 1 . 2]" 1
1760 1 102 ILE HA 1 102 ILE MG . . 3.130 2.320 2.303 2.341 . 0 0 "[ . 1 . 2]" 1
1761 1 102 ILE HA 1 103 ILE H . . 3.000 2.298 2.236 2.329 . 0 0 "[ . 1 . 2]" 1
1762 1 102 ILE HA 1 103 ILE HB . . 5.500 4.871 4.747 5.130 . 0 0 "[ . 1 . 2]" 1
1763 1 102 ILE HA 1 103 ILE MD . . 4.530 2.961 2.547 4.319 . 0 0 "[ . 1 . 2]" 1
1764 1 102 ILE HA 1 103 ILE QG . . 5.180 4.219 3.365 4.608 . 0 0 "[ . 1 . 2]" 1
1765 1 102 ILE HB 1 102 ILE MD . . 3.310 3.269 3.251 3.280 . 0 0 "[ . 1 . 2]" 1
1766 1 102 ILE HB 1 103 ILE H . . 3.180 2.494 2.452 2.534 . 0 0 "[ . 1 . 2]" 1
1767 1 102 ILE MD 1 104 THR HB . . 4.770 4.663 4.466 4.795 0.025 19 0 "[ . 1 . 2]" 1
1768 1 102 ILE HG12 1 104 THR H . . 5.500 4.630 4.368 4.879 . 0 0 "[ . 1 . 2]" 1
1769 1 102 ILE HG12 1 104 THR HB . . 4.570 3.742 3.425 4.009 . 0 0 "[ . 1 . 2]" 1
1770 1 102 ILE HG13 1 103 ILE H . . 4.460 4.493 4.463 4.520 0.060 12 0 "[ . 1 . 2]" 1
1771 1 102 ILE HG13 1 104 THR HA . . 5.170 5.187 5.012 5.228 0.058 11 0 "[ . 1 . 2]" 1
1772 1 102 ILE MG 1 103 ILE H . . 3.800 3.614 3.561 3.663 . 0 0 "[ . 1 . 2]" 1
1773 1 103 ILE H 1 103 ILE HB . . 2.930 2.611 2.479 2.852 . 0 0 "[ . 1 . 2]" 1
1774 1 103 ILE H 1 103 ILE MD . . 2.900 2.195 1.838 2.978 0.078 8 0 "[ . 1 . 2]" 1
1775 1 103 ILE H 1 103 ILE HG12 . . 4.710 3.622 2.041 3.968 . 0 0 "[ . 1 . 2]" 1
1776 1 103 ILE H 1 103 ILE QG . . 3.920 2.939 2.029 3.315 . 0 0 "[ . 1 . 2]" 1
1777 1 103 ILE H 1 103 ILE HG13 . . 4.710 3.324 2.303 3.631 . 0 0 "[ . 1 . 2]" 1
1778 1 103 ILE H 1 103 ILE MG . . 4.010 3.796 3.766 3.826 . 0 0 "[ . 1 . 2]" 1
1779 1 103 ILE H 1 104 THR H . . 4.580 4.398 4.312 4.498 . 0 0 "[ . 1 . 2]" 1
1780 1 103 ILE H 1 105 GLN H . . 5.500 5.597 5.562 5.641 0.141 13 0 "[ . 1 . 2]" 1
1781 1 103 ILE HA 1 103 ILE MG . . 3.280 2.284 2.171 2.351 . 0 0 "[ . 1 . 2]" 1
1782 1 103 ILE HA 1 104 THR H . . 3.340 2.146 2.117 2.195 . 0 0 "[ . 1 . 2]" 1
1783 1 103 ILE HA 1 104 THR HB . . 4.700 4.546 4.366 4.714 0.014 1 0 "[ . 1 . 2]" 1
1784 1 103 ILE HA 1 104 THR MG . . 4.070 3.931 3.846 4.076 0.006 18 0 "[ . 1 . 2]" 1
1785 1 103 ILE HA 1 105 GLN H . . 3.820 3.411 3.240 3.513 . 0 0 "[ . 1 . 2]" 1
1786 1 103 ILE HB 1 103 ILE MD . . 2.970 2.493 2.211 3.192 0.222 7 0 "[ . 1 . 2]" 1
1787 1 103 ILE HB 1 104 THR H . . 4.360 4.325 4.195 4.383 0.023 12 0 "[ . 1 . 2]" 1
1788 1 103 ILE HB 1 105 GLN H . . 4.400 4.354 4.040 4.424 0.024 14 0 "[ . 1 . 2]" 1
1789 1 103 ILE HB 1 107 ASN H . . 5.150 4.388 3.926 4.707 . 0 0 "[ . 1 . 2]" 1
1790 1 103 ILE HB 1 107 ASN HA . . 5.500 3.705 2.967 5.557 0.057 1 0 "[ . 1 . 2]" 1
1791 1 103 ILE HB 1 107 ASN HB2 . . 5.090 3.123 2.305 5.188 0.098 15 0 "[ . 1 . 2]" 1
1792 1 103 ILE HB 1 107 ASN QB . . 4.310 2.821 2.208 4.360 0.050 5 0 "[ . 1 . 2]" 1
1793 1 103 ILE HB 1 107 ASN HB3 . . 5.090 4.064 2.222 4.829 . 0 0 "[ . 1 . 2]" 1
1794 1 103 ILE HB 1 107 ASN HD21 . . 4.350 3.120 2.292 4.331 . 0 0 "[ . 1 . 2]" 1
1795 1 103 ILE HB 1 107 ASN QD . . 3.810 2.809 2.271 3.781 . 0 0 "[ . 1 . 2]" 1
1796 1 103 ILE HB 1 107 ASN HD22 . . 4.350 3.570 2.398 4.375 0.025 9 0 "[ . 1 . 2]" 1
1797 1 103 ILE MD 1 107 ASN QD . . 4.300 3.676 2.589 4.333 0.033 3 0 "[ . 1 . 2]" 1
1798 1 103 ILE QG 1 103 ILE MG . . 3.000 2.082 2.022 2.277 . 0 0 "[ . 1 . 2]" 1
1799 1 103 ILE MG 1 104 THR H . . 3.330 3.003 2.803 3.133 . 0 0 "[ . 1 . 2]" 1
1800 1 103 ILE MG 1 104 THR HA . . 5.140 4.177 3.991 4.488 . 0 0 "[ . 1 . 2]" 1
1801 1 103 ILE MG 1 105 GLN H . . 3.120 2.241 2.162 2.334 . 0 0 "[ . 1 . 2]" 1
1802 1 103 ILE MG 1 105 GLN QG . . 4.590 4.547 4.479 4.607 0.017 13 0 "[ . 1 . 2]" 1
1803 1 103 ILE MG 1 106 GLY H . . 4.800 3.993 3.674 4.258 . 0 0 "[ . 1 . 2]" 1
1804 1 103 ILE MG 1 106 GLY QA . . 5.150 3.442 2.841 3.731 . 0 0 "[ . 1 . 2]" 1
1805 1 103 ILE MG 1 107 ASN H . . 3.780 2.629 2.254 2.850 . 0 0 "[ . 1 . 2]" 1
1806 1 103 ILE MG 1 107 ASN HB2 . . 4.320 2.776 2.145 4.340 0.020 15 0 "[ . 1 . 2]" 1
1807 1 103 ILE MG 1 107 ASN HB3 . . 4.320 3.649 2.316 4.324 0.004 5 0 "[ . 1 . 2]" 1
1808 1 103 ILE MG 1 107 ASN QD . . 3.890 3.399 2.528 3.929 0.039 11 0 "[ . 1 . 2]" 1
1809 1 103 ILE MG 1 108 GLU H . . 5.080 4.624 4.168 5.002 . 0 0 "[ . 1 . 2]" 1
1810 1 104 THR H 1 104 THR HB . . 4.070 2.784 2.631 2.910 . 0 0 "[ . 1 . 2]" 1
1811 1 104 THR H 1 104 THR MG . . 3.350 2.176 2.103 2.257 . 0 0 "[ . 1 . 2]" 1
1812 1 104 THR H 1 105 GLN H . . 3.250 2.264 1.991 2.381 . 0 0 "[ . 1 . 2]" 1
1813 1 104 THR H 1 105 GLN HB3 . . 4.300 4.096 3.975 4.218 . 0 0 "[ . 1 . 2]" 1
1814 1 104 THR H 1 105 GLN QG . . 5.500 5.553 5.505 5.611 0.111 13 0 "[ . 1 . 2]" 1
1815 1 104 THR HA 1 104 THR MG . . 3.230 3.261 3.253 3.267 0.037 10 0 "[ . 1 . 2]" 1
1816 1 104 THR HA 1 105 GLN H . . 3.520 3.341 3.285 3.380 . 0 0 "[ . 1 . 2]" 1
1817 1 104 THR HA 1 105 GLN HA . . 5.500 4.680 4.609 4.740 . 0 0 "[ . 1 . 2]" 1
1818 1 104 THR HB 1 105 GLN H . . 5.100 4.287 4.212 4.378 . 0 0 "[ . 1 . 2]" 1
1819 1 104 THR MG 1 105 GLN H . . 3.890 3.026 2.912 3.158 . 0 0 "[ . 1 . 2]" 1
1820 1 104 THR MG 1 105 GLN HB3 . . 3.070 2.742 2.514 3.016 . 0 0 "[ . 1 . 2]" 1
1821 1 104 THR MG 1 105 GLN QG . . 4.630 4.132 3.928 4.386 . 0 0 "[ . 1 . 2]" 1
1822 1 105 GLN H 1 105 GLN HB2 . . 3.790 3.555 3.448 3.650 . 0 0 "[ . 1 . 2]" 1
1823 1 105 GLN H 1 105 GLN HB3 . . 3.760 2.772 2.654 2.868 . 0 0 "[ . 1 . 2]" 1
1824 1 105 GLN H 1 105 GLN QG . . 4.290 4.021 3.963 4.115 . 0 0 "[ . 1 . 2]" 1
1825 1 105 GLN H 1 106 GLY H . . 4.430 4.094 4.020 4.146 . 0 0 "[ . 1 . 2]" 1
1826 1 105 GLN H 1 106 GLY HA2 . . 5.500 5.611 5.530 5.647 0.147 20 0 "[ . 1 . 2]" 1
1827 1 105 GLN H 1 106 GLY HA3 . . 5.500 4.855 4.564 5.015 . 0 0 "[ . 1 . 2]" 1
1828 1 105 GLN H 1 107 ASN H . . 4.570 3.948 3.724 4.301 . 0 0 "[ . 1 . 2]" 1
1829 1 105 GLN HA 1 105 GLN QG . . 3.760 3.271 3.112 3.317 . 0 0 "[ . 1 . 2]" 1
1830 1 105 GLN HA 1 106 GLY H . . 3.400 2.182 2.135 2.219 . 0 0 "[ . 1 . 2]" 1
1831 1 105 GLN HA 1 106 GLY QA . . 5.340 3.964 3.910 4.010 . 0 0 "[ . 1 . 2]" 1
1832 1 105 GLN HA 1 107 ASN H . . 3.850 3.660 3.350 3.875 0.025 1 0 "[ . 1 . 2]" 1
1833 1 105 GLN HB2 1 106 GLY H . . 4.420 4.181 4.043 4.289 . 0 0 "[ . 1 . 2]" 1
1834 1 105 GLN HB3 1 106 GLY H . . 4.480 4.402 4.246 4.468 . 0 0 "[ . 1 . 2]" 1
1835 1 105 GLN QE 1 105 GLN QG . . 3.060 2.187 2.155 2.316 . 0 0 "[ . 1 . 2]" 1
1836 1 105 GLN QE 1 106 GLY H . . 4.900 3.209 2.675 3.894 . 0 0 "[ . 1 . 2]" 1
1837 1 105 GLN QE 1 106 GLY QA . . 5.170 3.001 2.571 4.174 . 0 0 "[ . 1 . 2]" 1
1838 1 105 GLN HE22 1 105 GLN QG . . 3.520 3.290 3.262 3.310 . 0 0 "[ . 1 . 2]" 1
1839 1 105 GLN QG 1 106 GLY H . . 4.550 3.559 3.124 3.753 . 0 0 "[ . 1 . 2]" 1
1840 1 105 GLN QG 1 106 GLY QA . . 4.750 3.471 3.310 3.674 . 0 0 "[ . 1 . 2]" 1
1841 1 105 GLN QG 1 107 ASN H . . 5.500 5.264 4.977 5.439 . 0 0 "[ . 1 . 2]" 1
1842 1 106 GLY H 1 107 ASN H . . 3.480 2.581 2.365 2.725 . 0 0 "[ . 1 . 2]" 1
1843 1 106 GLY H 1 108 GLU H . . 4.150 3.961 2.863 4.204 0.054 7 0 "[ . 1 . 2]" 1
1844 1 107 ASN H 1 107 ASN HB2 . . 3.900 2.503 2.259 3.587 . 0 0 "[ . 1 . 2]" 1
1845 1 107 ASN H 1 107 ASN QB . . 3.410 2.283 2.126 2.820 . 0 0 "[ . 1 . 2]" 1
1846 1 107 ASN H 1 107 ASN HB3 . . 3.900 2.807 2.344 3.589 . 0 0 "[ . 1 . 2]" 1
1847 1 107 ASN H 1 107 ASN QD . . 4.770 4.199 2.699 4.537 . 0 0 "[ . 1 . 2]" 1
1848 1 107 ASN H 1 108 GLU H . . 3.280 2.683 2.445 2.921 . 0 0 "[ . 1 . 2]" 1
1849 1 107 ASN H 1 108 GLU QB . . 5.340 5.149 4.393 5.380 0.040 16 0 "[ . 1 . 2]" 1
1850 1 107 ASN HA 1 107 ASN QD . . 4.350 3.536 2.389 4.395 0.045 13 0 "[ . 1 . 2]" 1
1851 1 107 ASN QB 1 108 GLU H . . 3.870 2.761 2.406 3.319 . 0 0 "[ . 1 . 2]" 1
1852 1 107 ASN QB 1 108 GLU QG . . 4.170 3.014 2.301 3.529 . 0 0 "[ . 1 . 2]" 1
1853 1 107 ASN HB2 1 108 GLU H . . 4.420 3.623 2.457 4.074 . 0 0 "[ . 1 . 2]" 1
1854 1 107 ASN HB2 1 108 GLU QG . . 4.780 4.114 2.365 4.787 0.007 12 0 "[ . 1 . 2]" 1
1855 1 107 ASN HB3 1 108 GLU H . . 4.420 3.073 2.440 4.066 . 0 0 "[ . 1 . 2]" 1
1856 1 107 ASN HB3 1 108 GLU QG . . 4.780 3.318 2.888 4.818 0.038 3 0 "[ . 1 . 2]" 1
1857 1 107 ASN QD 1 108 GLU QG . . 4.600 4.400 3.674 4.662 0.062 16 0 "[ . 1 . 2]" 1
1858 1 108 GLU H 1 108 GLU HB2 . . 3.940 3.345 2.540 3.959 0.019 7 0 "[ . 1 . 2]" 1
1859 1 108 GLU H 1 108 GLU QB . . 3.150 2.944 2.500 3.207 0.057 16 0 "[ . 1 . 2]" 1
1860 1 108 GLU H 1 108 GLU HB3 . . 3.940 3.611 3.314 3.920 . 0 0 "[ . 1 . 2]" 1
1861 1 108 GLU H 1 108 GLU QG . . 3.320 2.810 2.338 3.308 . 0 0 "[ . 1 . 2]" 1
1862 1 108 GLU H 1 109 MET H . . 5.320 4.421 4.376 4.488 . 0 0 "[ . 1 . 2]" 1
1863 1 108 GLU HA 1 109 MET H . . 3.560 2.388 2.133 2.546 . 0 0 "[ . 1 . 2]" 1
1864 1 108 GLU QB 1 109 MET H . . 3.580 2.425 2.058 2.962 . 0 0 "[ . 1 . 2]" 1
1865 1 108 GLU QG 1 109 MET H . . 4.910 3.748 3.396 4.569 . 0 0 "[ . 1 . 2]" 1
1866 1 109 MET H 1 109 MET HB2 . . 4.050 3.468 2.760 3.788 . 0 0 "[ . 1 . 2]" 1
1867 1 109 MET H 1 109 MET HB3 . . 4.050 2.573 2.131 3.161 . 0 0 "[ . 1 . 2]" 1
1868 1 109 MET H 1 109 MET HG2 . . 5.100 2.999 1.956 4.584 . 0 0 "[ . 1 . 2]" 1
1869 1 109 MET H 1 109 MET QG . . 4.300 2.587 1.937 4.090 . 0 0 "[ . 1 . 2]" 1
1870 1 109 MET H 1 109 MET HG3 . . 5.100 3.249 2.161 4.597 . 0 0 "[ . 1 . 2]" 1
1871 1 109 MET H 1 110 ARG H . . 4.700 4.607 4.464 4.645 . 0 0 "[ . 1 . 2]" 1
1872 1 109 MET HA 1 109 MET ME . . 5.500 4.536 4.264 5.059 . 0 0 "[ . 1 . 2]" 1
1873 1 109 MET HA 1 109 MET HG2 . . 4.200 3.714 2.750 4.240 0.040 16 0 "[ . 1 . 2]" 1
1874 1 109 MET HA 1 109 MET QG . . 3.660 3.258 2.687 3.510 . 0 0 "[ . 1 . 2]" 1
1875 1 109 MET HA 1 109 MET HG3 . . 4.200 3.724 2.904 3.927 . 0 0 "[ . 1 . 2]" 1
1876 1 109 MET HA 1 110 ARG H . . 3.460 2.283 2.209 2.399 . 0 0 "[ . 1 . 2]" 1
1877 1 109 MET HA 1 110 ARG HA . . 4.720 4.579 4.538 4.633 . 0 0 "[ . 1 . 2]" 1
1878 1 109 MET HA 1 110 ARG QG . . 4.310 3.817 3.507 4.230 . 0 0 "[ . 1 . 2]" 1
1879 1 109 MET ME 1 110 ARG H . . 4.360 3.976 3.494 4.410 0.050 4 0 "[ . 1 . 2]" 1
1880 1 109 MET ME 1 110 ARG HA . . 4.310 4.114 3.711 4.346 0.036 1 0 "[ . 1 . 2]" 1
1881 1 109 MET ME 1 111 LEU H . . 4.860 4.757 4.332 4.918 0.058 12 0 "[ . 1 . 2]" 1
1882 1 109 MET QG 1 110 ARG H . . 3.900 3.478 2.273 3.958 0.058 19 0 "[ . 1 . 2]" 1
1883 1 109 MET QG 1 110 ARG HA . . 5.340 3.948 3.260 4.440 . 0 0 "[ . 1 . 2]" 1
1884 1 110 ARG H 1 110 ARG QD . . 5.280 4.671 4.318 5.212 . 0 0 "[ . 1 . 2]" 1
1885 1 110 ARG H 1 110 ARG QG . . 3.940 3.016 2.558 3.637 . 0 0 "[ . 1 . 2]" 1
1886 1 110 ARG H 1 111 LEU H . . 4.570 4.385 4.295 4.445 . 0 0 "[ . 1 . 2]" 1
1887 1 110 ARG QB 1 111 LEU H . . 4.390 2.634 2.397 2.898 . 0 0 "[ . 1 . 2]" 1
1888 1 110 ARG QG 1 111 LEU H . . 4.860 3.943 3.604 4.385 . 0 0 "[ . 1 . 2]" 1
1889 1 111 LEU H 1 111 LEU MD1 . . 4.470 3.626 1.861 4.198 . 0 0 "[ . 1 . 2]" 1
1890 1 111 LEU H 1 111 LEU QD . . 3.890 2.459 1.854 3.765 . 0 0 "[ . 1 . 2]" 1
1891 1 111 LEU H 1 111 LEU MD2 . . 4.470 2.813 1.920 4.254 . 0 0 "[ . 1 . 2]" 1
1892 1 111 LEU H 1 111 LEU HG . . 4.610 3.393 2.262 4.458 . 0 0 "[ . 1 . 2]" 1
1893 1 111 LEU HA 1 111 LEU QD . . 3.650 3.192 2.150 3.446 . 0 0 "[ . 1 . 2]" 1
1894 1 112 LEU HA 1 112 LEU MD1 . . 3.880 3.212 2.096 3.890 0.010 15 0 "[ . 1 . 2]" 1
1895 1 112 LEU HA 1 112 LEU QD . . 3.340 2.141 1.982 2.369 . 0 0 "[ . 1 . 2]" 1
1896 1 112 LEU HA 1 112 LEU MD2 . . 3.880 2.649 2.120 3.869 . 0 0 "[ . 1 . 2]" 1
1897 1 112 LEU QB 1 112 LEU QD . . 2.840 1.980 1.945 2.091 . 0 0 "[ . 1 . 2]" 1
1898 1 112 LEU QB 1 113 SER H . . 3.480 2.434 2.258 2.769 . 0 0 "[ . 1 . 2]" 1
1899 1 112 LEU QB 1 113 SER QB . . 4.430 3.492 3.210 4.228 . 0 0 "[ . 1 . 2]" 1
1900 1 112 LEU HB2 1 113 SER H . . 3.960 2.600 2.315 3.730 . 0 0 "[ . 1 . 2]" 1
1901 1 112 LEU HB3 1 113 SER H . . 3.960 3.210 2.484 3.599 . 0 0 "[ . 1 . 2]" 1
1902 1 112 LEU QD 1 113 SER H . . 4.540 4.002 3.735 4.162 . 0 0 "[ . 1 . 2]" 1
1903 1 113 SER H 1 113 SER HB2 . . 4.150 3.378 2.847 4.062 . 0 0 "[ . 1 . 2]" 1
1904 1 113 SER H 1 113 SER HB3 . . 4.150 3.488 3.124 3.972 . 0 0 "[ . 1 . 2]" 1
1905 1 113 SER H 1 114 LEU H . . 4.520 4.404 4.365 4.475 . 0 0 "[ . 1 . 2]" 1
1906 1 113 SER H 1 114 LEU QD . . 4.520 4.109 3.899 4.442 . 0 0 "[ . 1 . 2]" 1
1907 1 113 SER QB 1 114 LEU H . . 3.550 2.640 2.124 3.121 . 0 0 "[ . 1 . 2]" 1
1908 1 113 SER QB 1 114 LEU HG . . 5.340 5.074 4.655 5.353 0.013 12 0 "[ . 1 . 2]" 1
1909 1 113 SER HB2 1 114 LEU H . . 4.110 3.353 2.139 3.876 . 0 0 "[ . 1 . 2]" 1
1910 1 113 SER HB3 1 114 LEU H . . 4.110 3.074 2.245 3.775 . 0 0 "[ . 1 . 2]" 1
1911 1 114 LEU H 1 114 LEU MD1 . . 4.860 3.673 2.533 4.367 . 0 0 "[ . 1 . 2]" 1
1912 1 114 LEU H 1 114 LEU QD . . 4.260 3.141 2.520 3.545 . 0 0 "[ . 1 . 2]" 1
1913 1 114 LEU H 1 114 LEU MD2 . . 4.860 3.946 2.617 4.727 . 0 0 "[ . 1 . 2]" 1
1914 1 114 LEU H 1 114 LEU HG . . 4.410 3.232 2.746 4.059 . 0 0 "[ . 1 . 2]" 1
1915 1 114 LEU H 1 115 GLU H . . 4.660 4.292 3.674 4.454 . 0 0 "[ . 1 . 2]" 1
1916 1 114 LEU HA 1 114 LEU MD1 . . 4.180 3.858 3.471 4.096 . 0 0 "[ . 1 . 2]" 1
1917 1 114 LEU HA 1 114 LEU QD . . 3.410 2.815 2.268 3.368 . 0 0 "[ . 1 . 2]" 1
1918 1 114 LEU HA 1 114 LEU MD2 . . 4.180 3.002 2.282 3.750 . 0 0 "[ . 1 . 2]" 1
1919 1 114 LEU HA 1 115 GLU H . . 3.420 2.302 2.050 2.415 . 0 0 "[ . 1 . 2]" 1
1920 1 114 LEU HA 1 115 GLU QB . . 5.300 4.285 3.926 4.468 . 0 0 "[ . 1 . 2]" 1
1921 1 114 LEU HB2 1 114 LEU QD . . 3.130 2.200 2.118 2.306 . 0 0 "[ . 1 . 2]" 1
1922 1 114 LEU HB2 1 115 GLU H . . 4.190 3.534 3.034 4.326 0.136 20 0 "[ . 1 . 2]" 1
1923 1 114 LEU HB2 1 116 MET ME . . 4.500 3.206 2.762 3.866 . 0 0 "[ . 1 . 2]" 1
1924 1 114 LEU HB2 1 116 MET QG . . 4.930 3.887 3.308 4.950 0.020 2 0 "[ . 1 . 2]" 1
1925 1 114 LEU HB3 1 115 GLU H . . 4.230 2.859 2.314 3.941 . 0 0 "[ . 1 . 2]" 1
1926 1 114 LEU HB3 1 116 MET ME . . 4.950 3.749 2.990 4.584 . 0 0 "[ . 1 . 2]" 1
1927 1 114 LEU HB3 1 116 MET QG . . 5.010 4.163 3.338 5.065 0.055 15 0 "[ . 1 . 2]" 1
1928 1 114 LEU QD 1 115 GLU H . . 4.480 3.999 3.588 4.568 0.088 3 0 "[ . 1 . 2]" 1
1929 1 114 LEU QD 1 116 MET ME . . 3.200 2.751 2.021 3.479 0.279 11 0 "[ . 1 . 2]" 1
1930 1 114 LEU MD1 1 115 GLU H . . 5.500 4.798 4.299 5.443 . 0 0 "[ . 1 . 2]" 1
1931 1 114 LEU MD2 1 115 GLU H . . 5.500 4.314 3.791 5.148 . 0 0 "[ . 1 . 2]" 1
1932 1 115 GLU H 1 115 GLU HB2 . . 3.930 2.795 2.442 3.237 . 0 0 "[ . 1 . 2]" 1
1933 1 115 GLU H 1 115 GLU QB . . 3.390 2.591 2.406 2.728 . 0 0 "[ . 1 . 2]" 1
1934 1 115 GLU H 1 115 GLU HB3 . . 3.930 3.467 2.740 3.868 . 0 0 "[ . 1 . 2]" 1
1935 1 115 GLU H 1 115 GLU QG . . 4.270 3.325 2.447 4.246 . 0 0 "[ . 1 . 2]" 1
1936 1 115 GLU H 1 116 MET H . . 4.840 4.403 4.176 4.632 . 0 0 "[ . 1 . 2]" 1
1937 1 115 GLU QB 1 116 MET H . . 4.400 3.165 2.724 3.878 . 0 0 "[ . 1 . 2]" 1
1938 1 116 MET H 1 116 MET ME . . 5.010 4.876 4.204 5.081 0.071 7 0 "[ . 1 . 2]" 1
1939 1 116 MET H 1 116 MET QG . . 4.240 2.985 2.391 3.712 . 0 0 "[ . 1 . 2]" 1
1940 1 116 MET H 1 117 LEU H . . 4.750 4.381 3.949 4.665 . 0 0 "[ . 1 . 2]" 1
1941 1 116 MET H 1 117 LEU HA . . 5.500 4.980 4.636 5.522 0.022 5 0 "[ . 1 . 2]" 1
1942 1 116 MET HA 1 116 MET ME . . 4.900 4.570 4.010 4.902 0.002 11 0 "[ . 1 . 2]" 1
1943 1 116 MET HA 1 117 LEU H . . 3.490 2.231 2.023 2.425 . 0 0 "[ . 1 . 2]" 1
1944 1 116 MET HA 1 117 LEU HB2 . . 5.500 4.465 3.971 5.592 0.092 11 0 "[ . 1 . 2]" 1
1945 1 116 MET HA 1 117 LEU QB . . 4.690 4.040 3.830 4.225 . 0 0 "[ . 1 . 2]" 1
1946 1 116 MET HA 1 117 LEU HB3 . . 5.500 5.050 4.163 5.618 0.118 18 0 "[ . 1 . 2]" 1
1947 1 116 MET QB 1 117 LEU H . . 3.680 2.893 2.291 3.614 . 0 0 "[ . 1 . 2]" 1
1948 1 116 MET HB2 1 117 LEU H . . 4.450 3.913 3.137 4.481 0.031 12 0 "[ . 1 . 2]" 1
1949 1 116 MET HB3 1 117 LEU H . . 4.450 3.054 2.345 4.187 . 0 0 "[ . 1 . 2]" 1
1950 1 116 MET ME 1 116 MET QG . . 2.820 2.243 2.154 2.473 . 0 0 "[ . 1 . 2]" 1
1951 1 116 MET QG 1 117 LEU H . . 4.340 4.076 3.783 4.402 0.062 10 0 "[ . 1 . 2]" 1
1952 1 117 LEU H 1 117 LEU QB . . 3.330 2.298 1.970 3.103 . 0 0 "[ . 1 . 2]" 1
1953 1 117 LEU H 1 117 LEU QD . . 4.160 3.569 2.800 3.783 . 0 0 "[ . 1 . 2]" 1
1954 1 117 LEU H 1 117 LEU HG . . 3.720 3.439 2.259 3.996 0.276 17 0 "[ . 1 . 2]" 1
1955 1 117 LEU H 1 118 ALA H . . 4.600 4.301 3.808 4.636 0.036 10 0 "[ . 1 . 2]" 1
1956 1 117 LEU HA 1 118 ALA H . . 3.360 2.255 2.100 2.408 . 0 0 "[ . 1 . 2]" 1
1957 1 117 LEU QB 1 117 LEU QD . . 2.580 1.957 1.901 1.979 . 0 0 "[ . 1 . 2]" 1
1958 1 117 LEU QB 1 118 ALA H . . 3.980 3.297 2.274 4.024 0.044 2 0 "[ . 1 . 2]" 1
1959 1 117 LEU QD 1 118 ALA H . . 3.580 3.027 1.957 3.642 0.062 6 0 "[ . 1 . 2]" 1
1960 1 117 LEU QD 1 119 GLU H . . 4.130 3.645 2.052 4.822 0.692 11 1 "[ . 1+ . 2]" 1
1961 1 118 ALA H 1 118 ALA MB . . 3.190 2.444 2.184 2.863 . 0 0 "[ . 1 . 2]" 1
1962 1 118 ALA H 1 119 GLU H . . 3.810 2.620 1.838 3.955 0.145 3 0 "[ . 1 . 2]" 1
1963 1 118 ALA MB 1 119 GLU H . . 3.110 2.715 2.147 3.164 0.054 8 0 "[ . 1 . 2]" 1
1964 1 118 ALA MB 1 119 GLU HA . . 4.050 4.027 3.898 4.118 0.068 14 0 "[ . 1 . 2]" 1
1965 1 119 GLU H 1 119 GLU HB2 . . 3.700 2.612 2.318 3.600 . 0 0 "[ . 1 . 2]" 1
1966 1 119 GLU H 1 119 GLU QB . . 3.060 2.348 2.190 2.618 . 0 0 "[ . 1 . 2]" 1
1967 1 119 GLU H 1 119 GLU HB3 . . 3.700 2.947 2.385 3.734 0.034 4 0 "[ . 1 . 2]" 1
1968 1 119 GLU H 1 119 GLU QG . . 4.080 3.436 2.208 4.143 0.063 3 0 "[ . 1 . 2]" 1
1969 1 119 GLU HA 1 119 GLU QG . . 3.510 2.713 2.341 3.366 . 0 0 "[ . 1 . 2]" 1
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