NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
613572 |
5u87   |
30209 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5u87
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 2480
_Distance_constraint_stats_list.Viol_count 4629
_Distance_constraint_stats_list.Viol_total 9890.360
_Distance_constraint_stats_list.Viol_max 5.005
_Distance_constraint_stats_list.Viol_rms 0.1242
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0100
_Distance_constraint_stats_list.Viol_average_violations_only 0.1068
_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 1 GLY 0.065 0.040 17 0 "[ . 1 . 2]"
1 2 ARG 2.019 0.115 10 0 "[ . 1 . 2]"
1 3 CYS 2.956 0.164 20 0 "[ . 1 . 2]"
1 4 THR 1.485 0.164 20 0 "[ . 1 . 2]"
1 5 LYS 0.956 0.136 6 0 "[ . 1 . 2]"
1 6 SER 2.596 0.136 6 0 "[ . 1 . 2]"
1 7 ILE 1.650 0.075 1 0 "[ . 1 . 2]"
1 8 PRO 0.441 0.041 5 0 "[ . 1 . 2]"
1 9 PRO 1.135 0.057 4 0 "[ . 1 . 2]"
1 10 ILE 2.306 0.094 1 0 "[ . 1 . 2]"
1 11 CYS 0.593 0.108 11 0 "[ . 1 . 2]"
1 12 PHE 71.591 4.016 17 18 "[****** ****-****+**2]"
1 13 PRO 183.372 5.005 2 20 [*+******************]
1 14 ASP 57.088 3.388 11 20 [******-***+*********]
1 15 GLY 78.831 2.532 10 18 [****.****+-***.*****]
1 16 LEU 241.832 5.005 2 20 [*+*********-********]
1 17 ASP 6.135 1.374 6 4 "[ .+ -1* .* 2]"
1 18 ASN 0.548 0.085 11 0 "[ . 1 . 2]"
1 19 PRO 0.836 0.117 6 0 "[ . 1 . 2]"
1 20 ARG 2.839 0.141 19 0 "[ . 1 . 2]"
1 21 GLY 4.884 0.154 9 0 "[ . 1 . 2]"
1 22 CYS 3.162 0.154 9 0 "[ . 1 . 2]"
1 23 GLN 2.616 0.135 14 0 "[ . 1 . 2]"
1 24 ILE 7.637 0.141 11 0 "[ . 1 . 2]"
1 25 ARG 3.383 0.112 11 0 "[ . 1 . 2]"
1 26 ILE 2.052 0.097 7 0 "[ . 1 . 2]"
1 27 GLN 3.501 0.097 7 0 "[ . 1 . 2]"
1 28 GLN 3.058 0.129 12 0 "[ . 1 . 2]"
1 29 LEU 5.807 0.169 13 0 "[ . 1 . 2]"
1 30 ASN 0.812 0.054 10 0 "[ . 1 . 2]"
1 31 HIS 5.868 0.123 9 0 "[ . 1 . 2]"
1 32 CYS 2.074 0.148 19 0 "[ . 1 . 2]"
1 33 GLN 8.349 0.169 13 0 "[ . 1 . 2]"
1 34 MET 3.599 0.156 8 0 "[ . 1 . 2]"
1 35 HIS 4.000 0.156 8 0 "[ . 1 . 2]"
1 36 LEU 4.950 0.113 3 0 "[ . 1 . 2]"
1 37 THR 3.379 0.093 11 0 "[ . 1 . 2]"
1 38 SER 1.716 0.102 19 0 "[ . 1 . 2]"
1 39 PHE 0.596 0.066 8 0 "[ . 1 . 2]"
1 40 ASP 2.457 0.225 13 0 "[ . 1 . 2]"
1 41 TYR 6.780 0.214 19 0 "[ . 1 . 2]"
1 42 LYS 5.525 0.225 13 0 "[ . 1 . 2]"
1 43 LEU 4.529 0.214 19 0 "[ . 1 . 2]"
1 44 ARG 1.113 0.110 17 0 "[ . 1 . 2]"
1 45 MET 1.038 0.110 17 0 "[ . 1 . 2]"
1 46 ALA 1.041 0.082 13 0 "[ . 1 . 2]"
1 47 VAL 0.507 0.048 6 0 "[ . 1 . 2]"
1 48 GLU 0.039 0.026 3 0 "[ . 1 . 2]"
1 49 ASN 0.009 0.009 7 0 "[ . 1 . 2]"
1 50 PRO 0.292 0.047 1 0 "[ . 1 . 2]"
1 51 LYS 3.260 0.134 13 0 "[ . 1 . 2]"
1 52 GLN 1.905 0.091 19 0 "[ . 1 . 2]"
1 53 GLN 0.449 0.060 5 0 "[ . 1 . 2]"
1 54 GLN 2.858 0.131 16 0 "[ . 1 . 2]"
1 55 HIS 2.295 0.131 16 0 "[ . 1 . 2]"
1 56 LEU 4.415 0.133 7 0 "[ . 1 . 2]"
1 57 SER 0.839 0.068 2 0 "[ . 1 . 2]"
1 58 LEU 4.205 0.106 3 0 "[ . 1 . 2]"
1 59 CYS 2.933 0.126 3 0 "[ . 1 . 2]"
1 60 CYS 3.112 0.212 17 0 "[ . 1 . 2]"
1 61 ASN 5.930 0.128 3 0 "[ . 1 . 2]"
1 62 GLN 4.323 0.131 9 0 "[ . 1 . 2]"
1 63 LEU 8.086 0.139 7 0 "[ . 1 . 2]"
1 64 GLN 6.754 0.123 4 0 "[ . 1 . 2]"
1 65 GLU 0.707 0.074 6 0 "[ . 1 . 2]"
1 66 VAL 5.319 0.139 7 0 "[ . 1 . 2]"
1 67 GLU 3.412 0.249 9 0 "[ . 1 . 2]"
1 68 LYS 3.910 0.290 11 0 "[ . 1 . 2]"
1 69 GLN 1.379 0.098 12 0 "[ . 1 . 2]"
1 70 CYS 1.589 0.104 9 0 "[ . 1 . 2]"
1 71 GLN 3.160 0.092 19 0 "[ . 1 . 2]"
1 72 CYS 3.885 0.141 14 0 "[ . 1 . 2]"
1 73 GLU 5.649 0.141 14 0 "[ . 1 . 2]"
1 74 ALA 4.841 0.141 11 0 "[ . 1 . 2]"
1 75 ILE 2.324 0.088 8 0 "[ . 1 . 2]"
1 76 LYS 3.105 0.188 17 0 "[ . 1 . 2]"
1 77 GLN 4.905 0.188 17 0 "[ . 1 . 2]"
1 78 VAL 4.846 0.096 11 0 "[ . 1 . 2]"
1 79 VAL 2.784 0.108 8 0 "[ . 1 . 2]"
1 80 GLU 0.825 0.152 4 0 "[ . 1 . 2]"
1 81 GLN 2.223 0.113 19 0 "[ . 1 . 2]"
1 82 ALA 1.727 0.096 9 0 "[ . 1 . 2]"
1 83 GLN 3.152 0.085 12 0 "[ . 1 . 2]"
1 84 LYS 5.556 0.235 3 0 "[ . 1 . 2]"
1 85 GLN 3.358 0.111 8 0 "[ . 1 . 2]"
1 86 LEU 5.134 0.093 11 0 "[ . 1 . 2]"
1 87 GLN 0.227 0.059 4 0 "[ . 1 . 2]"
1 88 GLN 2.088 0.081 3 0 "[ . 1 . 2]"
1 89 GLY 1.463 0.103 16 0 "[ . 1 . 2]"
1 90 GLN 1.092 0.118 1 0 "[ . 1 . 2]"
1 91 GLY 1.502 0.072 17 0 "[ . 1 . 2]"
1 92 GLY 3.354 0.137 12 0 "[ . 1 . 2]"
1 93 GLN 1.293 0.080 19 0 "[ . 1 . 2]"
1 94 GLN 3.353 0.144 2 0 "[ . 1 . 2]"
1 95 GLN 4.820 0.137 12 0 "[ . 1 . 2]"
1 96 VAL 7.365 0.129 2 0 "[ . 1 . 2]"
1 97 GLN 3.617 0.144 2 0 "[ . 1 . 2]"
1 98 GLN 0.554 0.062 18 0 "[ . 1 . 2]"
1 99 MET 8.028 0.118 4 0 "[ . 1 . 2]"
1 100 VAL 5.014 0.113 3 0 "[ . 1 . 2]"
1 101 LYS 4.769 0.113 8 0 "[ . 1 . 2]"
1 102 LYS 4.044 0.144 8 0 "[ . 1 . 2]"
1 103 ALA 1.638 0.144 8 0 "[ . 1 . 2]"
1 104 GLN 1.127 0.131 6 0 "[ . 1 . 2]"
1 105 MET 3.971 0.118 6 0 "[ . 1 . 2]"
1 106 LEU 3.831 0.112 1 0 "[ . 1 . 2]"
1 107 PRO 2.036 0.086 5 0 "[ . 1 . 2]"
1 108 ASN 5.433 0.198 6 0 "[ . 1 . 2]"
1 109 GLN 0.425 0.029 16 0 "[ . 1 . 2]"
1 110 CYS 2.930 0.212 17 0 "[ . 1 . 2]"
1 111 ASN 0.876 0.062 13 0 "[ . 1 . 2]"
1 112 LEU 5.602 0.117 18 0 "[ . 1 . 2]"
1 113 GLN 3.561 0.180 20 0 "[ . 1 . 2]"
1 114 CYS 3.187 0.180 20 0 "[ . 1 . 2]"
1 115 SER 0.205 0.064 5 0 "[ . 1 . 2]"
1 116 ILE 1.790 0.168 1 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 113 GLN HA 1 113 GLN QG . . 3.340 2.735 2.324 3.168 . 0 0 "[ . 1 . 2]" 1
2 1 112 LEU HA 1 112 LEU MD2 . . 3.370 2.039 1.978 2.139 . 0 0 "[ . 1 . 2]" 1
3 1 109 GLN HA 1 109 GLN QG . . 3.410 2.706 2.400 3.071 . 0 0 "[ . 1 . 2]" 1
4 1 107 PRO HA 1 112 LEU HG . . 3.980 2.198 1.978 2.377 . 0 0 "[ . 1 . 2]" 1
5 1 107 PRO HB3 1 112 LEU HB3 . . 5.340 3.744 3.479 3.965 . 0 0 "[ . 1 . 2]" 1
6 1 104 GLN HA 1 104 GLN HG2 . . 3.940 2.623 2.517 3.050 . 0 0 "[ . 1 . 2]" 1
7 1 104 GLN HA 1 104 GLN HG3 . . 3.940 3.219 3.023 3.815 . 0 0 "[ . 1 . 2]" 1
8 1 102 LYS HA 1 105 MET HB2 . . 3.700 3.196 2.621 3.700 0.000 12 0 "[ . 1 . 2]" 1
9 1 102 LYS HA 1 102 LYS QG . . 3.700 2.456 2.383 2.545 . 0 0 "[ . 1 . 2]" 1
10 1 101 LYS HA 1 101 LYS QD . . 4.220 3.824 3.659 4.242 0.022 6 0 "[ . 1 . 2]" 1
11 1 101 LYS QB 1 101 LYS QD . . 3.080 2.235 2.083 2.607 . 0 0 "[ . 1 . 2]" 1
12 1 96 VAL HA 1 96 VAL MG2 . . 3.200 2.381 2.351 2.408 . 0 0 "[ . 1 . 2]" 1
13 1 100 VAL HA 1 100 VAL MG2 . . 3.450 2.379 2.342 2.428 . 0 0 "[ . 1 . 2]" 1
14 1 99 MET HA 1 99 MET QG . . 3.400 2.659 2.581 2.728 . 0 0 "[ . 1 . 2]" 1
15 1 98 GLN QB 1 98 GLN HG3 . . 2.610 2.332 2.292 2.382 . 0 0 "[ . 1 . 2]" 1
16 1 98 GLN HA 1 98 GLN HG3 . . 4.170 3.740 3.688 3.804 . 0 0 "[ . 1 . 2]" 1
17 1 96 VAL HA 1 96 VAL MG1 . . 3.200 2.465 2.392 2.540 . 0 0 "[ . 1 . 2]" 1
18 1 92 GLY HA3 1 95 GLN HG2 . . 4.030 3.438 3.238 3.815 . 0 0 "[ . 1 . 2]" 1
19 1 95 GLN HA 1 95 GLN HG2 . . 3.670 3.721 3.685 3.750 0.080 9 0 "[ . 1 . 2]" 1
20 1 94 GLN HA 1 94 GLN QG . . 3.500 3.302 3.279 3.318 . 0 0 "[ . 1 . 2]" 1
21 1 93 GLN HA 1 93 GLN QB . . 2.650 2.377 2.299 2.426 . 0 0 "[ . 1 . 2]" 1
22 1 93 GLN HA 1 93 GLN QG . . 2.960 2.489 2.341 2.896 . 0 0 "[ . 1 . 2]" 1
23 1 52 GLN HA 1 52 GLN QG . . 3.220 2.657 2.306 3.074 . 0 0 "[ . 1 . 2]" 1
24 1 90 GLN HA 1 90 GLN QG . . 3.590 2.903 2.433 3.554 . 0 0 "[ . 1 . 2]" 1
25 1 31 HIS HA 1 34 MET HG3 . . 4.190 3.315 3.111 3.532 . 0 0 "[ . 1 . 2]" 1
26 1 88 GLN HA 1 88 GLN HG2 . . 3.960 3.747 3.691 3.819 . 0 0 "[ . 1 . 2]" 1
27 1 87 GLN HA 1 87 GLN QG . . 3.460 2.536 2.416 3.114 . 0 0 "[ . 1 . 2]" 1
28 1 84 LYS HA 1 87 GLN QB . . 3.570 2.236 1.962 2.610 . 0 0 "[ . 1 . 2]" 1
29 1 33 GLN HG3 1 34 MET HA . . 4.580 4.508 4.387 4.592 0.012 17 0 "[ . 1 . 2]" 1
30 1 64 GLN QB 1 64 GLN QG . . 2.480 2.045 2.027 2.061 . 0 0 "[ . 1 . 2]" 1
31 1 22 CYS HB2 1 73 GLU HA . . 5.500 4.908 4.649 5.192 . 0 0 "[ . 1 . 2]" 1
32 1 81 GLN HA 1 84 LYS QE . . 4.150 3.261 2.067 4.263 0.113 19 0 "[ . 1 . 2]" 1
33 1 84 LYS QB 1 84 LYS QD . . 2.740 2.333 1.871 2.614 . 0 0 "[ . 1 . 2]" 1
34 1 84 LYS HA 1 84 LYS QD . . 3.680 3.730 3.678 3.915 0.235 3 0 "[ . 1 . 2]" 1
35 1 84 LYS HA 1 84 LYS QG . . 3.690 3.442 2.733 3.531 . 0 0 "[ . 1 . 2]" 1
36 1 81 GLN HA 1 84 LYS QG . . 3.980 2.065 1.821 3.710 . 0 0 "[ . 1 . 2]" 1
37 1 83 GLN HA 1 83 GLN QG . . 3.370 3.367 3.352 3.377 0.007 2 0 "[ . 1 . 2]" 1
38 1 81 GLN HA 1 81 GLN HG3 . . 3.960 3.800 3.739 3.854 . 0 0 "[ . 1 . 2]" 1
39 1 81 GLN HG3 1 82 ALA HA . . 4.270 3.584 3.389 3.721 . 0 0 "[ . 1 . 2]" 1
40 1 28 GLN QB 1 28 GLN HG2 . . 2.570 2.231 2.176 2.280 . 0 0 "[ . 1 . 2]" 1
41 1 80 GLU HA 1 80 GLU HG3 . . 3.240 2.861 2.481 3.392 0.152 4 0 "[ . 1 . 2]" 1
42 1 79 VAL HA 1 79 VAL MG1 . . 3.240 2.347 2.308 2.375 . 0 0 "[ . 1 . 2]" 1
43 1 32 CYS HB2 1 78 VAL MG1 . . 4.330 3.224 2.889 3.626 . 0 0 "[ . 1 . 2]" 1
44 1 98 GLN HG2 1 99 MET HB2 . . 5.500 3.794 3.441 4.181 . 0 0 "[ . 1 . 2]" 1
45 1 77 GLN HB2 1 78 VAL HA . . 3.980 4.003 3.926 4.063 0.083 13 0 "[ . 1 . 2]" 1
46 1 77 GLN HA 1 77 GLN HG2 . . 3.280 2.728 2.574 2.927 . 0 0 "[ . 1 . 2]" 1
47 1 77 GLN HA 1 77 GLN HG3 . . 3.820 3.681 3.510 3.841 0.021 10 0 "[ . 1 . 2]" 1
48 1 77 GLN HB3 1 78 VAL H . . 4.590 3.718 3.517 3.951 . 0 0 "[ . 1 . 2]" 1
49 1 76 LYS QB 1 76 LYS QD . . 3.360 2.550 2.305 2.892 . 0 0 "[ . 1 . 2]" 1
50 1 76 LYS HA 1 76 LYS QD . . 4.310 2.225 2.104 2.364 . 0 0 "[ . 1 . 2]" 1
51 1 76 LYS QB 1 77 GLN HG2 . . 3.260 3.011 2.704 3.287 0.027 18 0 "[ . 1 . 2]" 1
52 1 76 LYS HA 1 76 LYS QG . . 3.910 3.085 2.988 3.183 . 0 0 "[ . 1 . 2]" 1
53 1 71 GLN HA 1 74 ALA MB . . 3.740 2.956 2.788 3.100 . 0 0 "[ . 1 . 2]" 1
54 1 66 VAL HB 1 71 GLN HA . . 4.480 2.919 2.738 3.221 . 0 0 "[ . 1 . 2]" 1
55 1 70 CYS H 1 71 GLN HA . . 4.960 4.648 4.518 4.799 . 0 0 "[ . 1 . 2]" 1
56 1 76 LYS HA 1 79 VAL H . . 5.180 3.547 3.297 3.830 . 0 0 "[ . 1 . 2]" 1
57 1 75 ILE HA 1 75 ILE MD . . 3.900 2.191 2.112 2.298 . 0 0 "[ . 1 . 2]" 1
58 1 75 ILE HA 1 78 VAL MG1 . . 4.740 4.340 4.141 4.539 . 0 0 "[ . 1 . 2]" 1
59 1 75 ILE HA 1 75 ILE MG . . 3.480 2.359 2.266 2.434 . 0 0 "[ . 1 . 2]" 1
60 1 25 ARG HA 1 26 ILE MG . . 3.840 3.756 3.628 3.856 0.016 17 0 "[ . 1 . 2]" 1
61 1 75 ILE H 1 75 ILE MG . . 4.070 3.741 3.700 3.766 . 0 0 "[ . 1 . 2]" 1
62 1 75 ILE MG 1 76 LYS H . . 3.990 3.755 3.584 3.954 . 0 0 "[ . 1 . 2]" 1
63 1 75 ILE MG 1 76 LYS QD . . 3.750 3.568 3.149 3.765 0.015 8 0 "[ . 1 . 2]" 1
64 1 72 CYS HA 1 75 ILE HB . . 4.390 3.469 3.293 3.739 . 0 0 "[ . 1 . 2]" 1
65 1 75 ILE HA 1 78 VAL HB . . 3.960 3.384 3.130 3.621 . 0 0 "[ . 1 . 2]" 1
66 1 75 ILE HA 1 78 VAL MG2 . . 4.740 2.117 1.992 2.317 . 0 0 "[ . 1 . 2]" 1
67 1 24 ILE MG 1 74 ALA MB . . 2.640 1.869 1.838 1.904 . 0 0 "[ . 1 . 2]" 1
68 1 66 VAL MG1 1 74 ALA MB . . 3.750 3.285 3.088 3.468 . 0 0 "[ . 1 . 2]" 1
69 1 24 ILE HG12 1 74 ALA MB . . 4.420 2.020 1.893 2.114 . 0 0 "[ . 1 . 2]" 1
70 1 63 LEU HB3 1 74 ALA MB . . 5.180 3.329 3.166 3.598 . 0 0 "[ . 1 . 2]" 1
71 1 24 ILE HB 1 74 ALA MB . . 4.000 3.273 2.994 3.462 . 0 0 "[ . 1 . 2]" 1
72 1 22 CYS HB3 1 74 ALA MB . . 5.500 5.513 5.447 5.551 0.051 7 0 "[ . 1 . 2]" 1
73 1 70 CYS HB2 1 74 ALA MB . . 5.500 4.978 4.847 5.121 . 0 0 "[ . 1 . 2]" 1
74 1 84 LYS HA 1 87 GLN H . . 3.690 3.247 2.999 3.511 . 0 0 "[ . 1 . 2]" 1
75 1 81 GLN HB3 1 82 ALA H . . 4.190 4.121 4.038 4.180 . 0 0 "[ . 1 . 2]" 1
76 1 73 GLU HA 1 73 GLU HB3 . . 2.970 2.526 2.468 2.574 . 0 0 "[ . 1 . 2]" 1
77 1 81 GLN HA 1 84 LYS QD . . 3.400 3.055 1.798 3.480 0.080 6 0 "[ . 1 . 2]" 1
78 1 22 CYS HB2 1 73 GLU QG . . 4.520 2.172 1.967 2.432 . 0 0 "[ . 1 . 2]" 1
79 1 73 GLU HA 1 73 GLU QG . . 3.220 2.883 2.791 2.989 . 0 0 "[ . 1 . 2]" 1
80 1 72 CYS HB3 1 75 ILE MD . . 5.500 4.965 4.806 5.321 . 0 0 "[ . 1 . 2]" 1
81 1 59 CYS HB3 1 61 ASN H . . 4.950 4.754 4.664 4.813 . 0 0 "[ . 1 . 2]" 1
82 1 66 VAL H 1 71 GLN HG2 . . 4.870 3.505 3.301 3.721 . 0 0 "[ . 1 . 2]" 1
83 1 71 GLN HA 1 71 GLN HG3 . . 4.060 2.916 2.786 3.056 . 0 0 "[ . 1 . 2]" 1
84 1 71 GLN HA 1 71 GLN HG2 . . 4.040 2.510 2.409 2.584 . 0 0 "[ . 1 . 2]" 1
85 1 71 GLN HB2 1 112 LEU MD1 . . 4.800 3.493 3.186 3.920 . 0 0 "[ . 1 . 2]" 1
86 1 71 GLN HB2 1 112 LEU MD2 . . 5.030 2.648 2.420 2.908 . 0 0 "[ . 1 . 2]" 1
87 1 71 GLN HB3 1 112 LEU MD1 . . 4.940 2.666 2.320 2.932 . 0 0 "[ . 1 . 2]" 1
88 1 71 GLN HB3 1 112 LEU MD2 . . 5.200 2.005 1.861 2.124 . 0 0 "[ . 1 . 2]" 1
89 1 22 CYS HB3 1 70 CYS HA . . 3.950 3.207 2.964 3.451 . 0 0 "[ . 1 . 2]" 1
90 1 66 VAL HB 1 70 CYS HB2 . . 4.860 3.743 3.494 4.007 . 0 0 "[ . 1 . 2]" 1
91 1 67 GLU QG 1 70 CYS HB2 . . 5.170 4.194 3.793 4.409 . 0 0 "[ . 1 . 2]" 1
92 1 66 VAL HB 1 70 CYS HB3 . . 4.950 4.589 4.345 4.821 . 0 0 "[ . 1 . 2]" 1
93 1 70 CYS HB3 1 73 GLU QG . . 5.200 3.871 3.471 4.081 . 0 0 "[ . 1 . 2]" 1
94 1 24 ILE MG 1 70 CYS HB2 . . 5.000 4.936 4.804 5.035 0.035 7 0 "[ . 1 . 2]" 1
95 1 24 ILE MD 1 70 CYS HB2 . . 5.270 4.094 3.934 4.256 . 0 0 "[ . 1 . 2]" 1
96 1 67 GLU HB3 1 70 CYS HB3 . . 5.240 5.093 4.451 5.275 0.035 10 0 "[ . 1 . 2]" 1
97 1 67 GLU HB2 1 70 CYS HB3 . . 4.760 3.728 3.441 4.078 . 0 0 "[ . 1 . 2]" 1
98 1 70 CYS HA 1 73 GLU QG . . 4.190 2.155 1.893 2.327 . 0 0 "[ . 1 . 2]" 1
99 1 70 CYS HA 1 73 GLU HB3 . . 4.210 3.678 3.561 3.834 . 0 0 "[ . 1 . 2]" 1
100 1 70 CYS HA 1 73 GLU HB2 . . 4.140 2.238 2.010 2.480 . 0 0 "[ . 1 . 2]" 1
101 1 69 GLN HA 1 69 GLN HG2 . . 4.120 3.757 3.651 3.839 . 0 0 "[ . 1 . 2]" 1
102 1 69 GLN HA 1 69 GLN HG3 . . 4.120 3.753 3.696 3.841 . 0 0 "[ . 1 . 2]" 1
103 1 7 ILE MG 1 8 PRO HB3 . . 4.220 3.867 3.463 4.238 0.018 9 0 "[ . 1 . 2]" 1
104 1 68 LYS HB2 1 69 GLN HA . . 4.540 4.486 4.383 4.569 0.029 18 0 "[ . 1 . 2]" 1
105 1 68 LYS HB2 1 68 LYS QD . . 3.810 2.522 2.239 3.130 . 0 0 "[ . 1 . 2]" 1
106 1 68 LYS HB3 1 68 LYS QD . . 2.660 2.580 2.313 2.764 0.104 16 0 "[ . 1 . 2]" 1
107 1 68 LYS HA 1 68 LYS QD . . 4.380 4.398 4.205 4.433 0.053 8 0 "[ . 1 . 2]" 1
108 1 68 LYS HB2 1 69 GLN H . . 3.930 3.831 3.691 3.946 0.016 15 0 "[ . 1 . 2]" 1
109 1 68 LYS HB3 1 69 GLN H . . 4.130 4.106 4.013 4.165 0.035 3 0 "[ . 1 . 2]" 1
110 1 83 GLN QG 1 84 LYS QB . . 3.150 3.073 2.902 3.206 0.056 3 0 "[ . 1 . 2]" 1
111 1 68 LYS HB2 1 68 LYS QE . . 4.720 2.787 1.961 3.791 . 0 0 "[ . 1 . 2]" 1
112 1 68 LYS HB3 1 68 LYS QE . . 4.630 2.449 1.924 3.754 . 0 0 "[ . 1 . 2]" 1
113 1 68 LYS HA 1 68 LYS QE . . 4.820 4.357 4.141 5.110 0.290 11 0 "[ . 1 . 2]" 1
114 1 67 GLU HA 1 67 GLU QG . . 3.320 2.322 2.254 2.709 . 0 0 "[ . 1 . 2]" 1
115 1 66 VAL MG2 1 67 GLU HB2 . . 5.500 5.491 5.341 5.542 0.042 7 0 "[ . 1 . 2]" 1
116 1 66 VAL HA 1 67 GLU HB2 . . 4.730 4.718 4.257 4.770 0.040 12 0 "[ . 1 . 2]" 1
117 1 66 VAL HA 1 67 GLU QG . . 4.650 4.235 3.927 4.749 0.099 11 0 "[ . 1 . 2]" 1
118 1 66 VAL HA 1 66 VAL MG1 . . 3.390 2.383 2.334 2.449 . 0 0 "[ . 1 . 2]" 1
119 1 65 GLU HB2 1 66 VAL HA . . 4.720 4.552 4.295 4.740 0.020 5 0 "[ . 1 . 2]" 1
120 1 66 VAL HB 1 71 GLN HG3 . . 4.930 3.309 2.940 3.618 . 0 0 "[ . 1 . 2]" 1
121 1 48 GLU HA 1 48 GLU QG . . 3.470 2.699 2.352 3.351 . 0 0 "[ . 1 . 2]" 1
122 1 65 GLU HA 1 65 GLU HG3 . . 4.020 3.480 3.130 3.790 . 0 0 "[ . 1 . 2]" 1
123 1 65 GLU HA 1 65 GLU HG2 . . 4.020 2.744 2.384 3.187 . 0 0 "[ . 1 . 2]" 1
124 1 64 GLN HA 1 64 GLN QG . . 3.400 3.296 3.274 3.317 . 0 0 "[ . 1 . 2]" 1
125 1 64 GLN HA 1 66 VAL H . . 4.460 3.575 3.390 3.768 . 0 0 "[ . 1 . 2]" 1
126 1 28 GLN QB 1 29 LEU H . . 3.690 3.632 3.513 3.757 0.067 12 0 "[ . 1 . 2]" 1
127 1 63 LEU HB3 1 75 ILE MD . . 4.970 3.595 3.397 3.789 . 0 0 "[ . 1 . 2]" 1
128 1 81 GLN HA 1 84 LYS QB . . 3.710 3.642 1.916 3.770 0.060 1 0 "[ . 1 . 2]" 1
129 1 63 LEU HB3 1 112 LEU MD1 . . 4.610 4.668 4.524 4.714 0.104 15 0 "[ . 1 . 2]" 1
130 1 60 CYS HA 1 63 LEU HB3 . . 4.500 3.918 3.834 4.087 . 0 0 "[ . 1 . 2]" 1
131 1 62 GLN HA 1 62 GLN QG . . 3.730 2.964 2.471 3.095 . 0 0 "[ . 1 . 2]" 1
132 1 10 ILE HA 1 10 ILE HG13 . . 4.220 3.821 3.787 3.860 . 0 0 "[ . 1 . 2]" 1
133 1 62 GLN HA 1 66 VAL H . . 5.500 5.587 5.541 5.631 0.131 9 0 "[ . 1 . 2]" 1
134 1 62 GLN H 1 62 GLN QG . . 4.280 3.990 3.893 4.053 . 0 0 "[ . 1 . 2]" 1
135 1 58 LEU HB3 1 62 GLN HB2 . . 4.810 4.759 4.480 4.853 0.043 13 0 "[ . 1 . 2]" 1
136 1 58 LEU HA 1 61 ASN HB3 . . 3.980 2.937 2.692 3.160 . 0 0 "[ . 1 . 2]" 1
137 1 41 TYR H 1 41 TYR HB3 . . 3.560 2.815 2.627 3.308 . 0 0 "[ . 1 . 2]" 1
138 1 61 ASN HB3 1 62 GLN HB2 . . 4.820 4.202 4.083 4.361 . 0 0 "[ . 1 . 2]" 1
139 1 61 ASN HB3 1 64 GLN QG . . 5.410 4.548 4.413 4.666 . 0 0 "[ . 1 . 2]" 1
140 1 58 LEU HB3 1 61 ASN HB3 . . 5.190 4.952 4.666 5.200 0.010 3 0 "[ . 1 . 2]" 1
141 1 61 ASN HA 1 64 GLN QG . . 3.490 2.052 1.910 2.202 . 0 0 "[ . 1 . 2]" 1
142 1 61 ASN HA 1 63 LEU H . . 5.160 4.566 4.286 4.704 . 0 0 "[ . 1 . 2]" 1
143 1 60 CYS HA 1 63 LEU MD1 . . 4.540 3.109 2.977 3.249 . 0 0 "[ . 1 . 2]" 1
144 1 59 CYS HA 1 62 GLN HB2 . . 4.280 3.503 3.177 3.739 . 0 0 "[ . 1 . 2]" 1
145 1 59 CYS HA 1 62 GLN HB3 . . 4.380 2.660 2.484 2.802 . 0 0 "[ . 1 . 2]" 1
146 1 59 CYS HB2 1 60 CYS H . . 4.010 3.813 3.682 3.926 . 0 0 "[ . 1 . 2]" 1
147 1 55 HIS HA 1 58 LEU HB2 . . 4.280 2.774 2.432 3.046 . 0 0 "[ . 1 . 2]" 1
148 1 55 HIS HA 1 58 LEU HB3 . . 4.910 4.331 4.056 4.523 . 0 0 "[ . 1 . 2]" 1
149 1 55 HIS HA 1 58 LEU MD1 . . 4.740 2.357 2.042 2.745 . 0 0 "[ . 1 . 2]" 1
150 1 54 GLN HA 1 54 GLN QG . . 3.460 3.347 3.313 3.403 . 0 0 "[ . 1 . 2]" 1
151 1 33 GLN HG2 1 82 ALA HA . . 4.740 3.514 3.221 4.052 . 0 0 "[ . 1 . 2]" 1
152 1 53 GLN HA 1 53 GLN QG . . 3.360 2.800 2.327 3.369 0.009 13 0 "[ . 1 . 2]" 1
153 1 53 GLN HA 1 55 HIS H . . 4.670 3.693 3.368 4.262 . 0 0 "[ . 1 . 2]" 1
154 1 52 GLN HB3 1 52 GLN QG . . 2.580 2.336 2.289 2.409 . 0 0 "[ . 1 . 2]" 1
155 1 52 GLN HB2 1 52 GLN QG . . 2.620 2.243 2.143 2.374 . 0 0 "[ . 1 . 2]" 1
156 1 87 GLN HA 1 88 GLN HA . . 5.500 4.699 4.607 4.779 . 0 0 "[ . 1 . 2]" 1
157 1 90 GLN HA 1 91 GLY HA3 . . 5.500 4.668 4.485 4.954 . 0 0 "[ . 1 . 2]" 1
158 1 52 GLN HA 1 55 HIS HE1 . . 5.160 4.826 3.594 5.233 0.073 16 0 "[ . 1 . 2]" 1
159 1 24 ILE MD 1 77 GLN HG2 . . 4.140 3.195 2.863 3.470 . 0 0 "[ . 1 . 2]" 1
160 1 77 GLN H 1 77 GLN HG2 . . 3.600 2.193 1.767 2.650 . 0 0 "[ . 1 . 2]" 1
161 1 52 GLN HB2 1 54 GLN H . . 4.990 4.890 4.727 5.015 0.025 19 0 "[ . 1 . 2]" 1
162 1 42 LYS HA 1 42 LYS QD . . 4.050 3.709 3.644 3.762 . 0 0 "[ . 1 . 2]" 1
163 1 51 LYS HA 1 51 LYS HG2 . . 4.000 2.663 2.392 3.096 . 0 0 "[ . 1 . 2]" 1
164 1 51 LYS HA 1 51 LYS HG3 . . 4.000 3.276 2.942 3.758 . 0 0 "[ . 1 . 2]" 1
165 1 51 LYS QD 1 51 LYS HG2 . . 2.520 2.231 2.136 2.341 . 0 0 "[ . 1 . 2]" 1
166 1 51 LYS QD 1 51 LYS HG3 . . 2.520 2.261 2.152 2.363 . 0 0 "[ . 1 . 2]" 1
167 1 51 LYS HA 1 52 GLN H . . 3.560 3.377 3.274 3.503 . 0 0 "[ . 1 . 2]" 1
168 1 51 LYS QD 1 52 GLN H . . 5.500 5.254 4.883 5.584 0.084 1 0 "[ . 1 . 2]" 1
169 1 50 PRO HA 1 51 LYS H . . 3.570 3.502 3.375 3.591 0.021 17 0 "[ . 1 . 2]" 1
170 1 50 PRO HA 1 52 GLN H . . 5.160 3.854 3.567 4.301 . 0 0 "[ . 1 . 2]" 1
171 1 12 PHE HA 1 13 PRO QB . . 4.980 4.622 4.407 4.899 . 0 0 "[ . 1 . 2]" 1
172 1 49 ASN HA 1 50 PRO HG2 . . 4.890 4.335 4.069 4.680 . 0 0 "[ . 1 . 2]" 1
173 1 50 PRO HG2 1 51 LYS H . . 4.050 2.592 2.334 2.748 . 0 0 "[ . 1 . 2]" 1
174 1 19 PRO HG2 1 20 ARG H . . 4.540 3.751 2.798 4.113 . 0 0 "[ . 1 . 2]" 1
175 1 47 VAL HA 1 48 GLU QG . . 4.800 4.396 4.067 4.826 0.026 3 0 "[ . 1 . 2]" 1
176 1 48 GLU HA 1 49 ASN H . . 3.230 2.312 2.097 2.944 . 0 0 "[ . 1 . 2]" 1
177 1 47 VAL HA 1 47 VAL QG . . 3.230 2.166 2.143 2.187 . 0 0 "[ . 1 . 2]" 1
178 1 46 ALA MB 1 47 VAL HB . . 5.500 5.480 5.098 5.543 0.043 18 0 "[ . 1 . 2]" 1
179 1 46 ALA MB 1 47 VAL QG . . 4.310 4.056 3.836 4.358 0.048 6 0 "[ . 1 . 2]" 1
180 1 43 LEU QD 1 46 ALA HA . . 4.990 4.404 3.134 5.035 0.045 6 0 "[ . 1 . 2]" 1
181 1 46 ALA HA 1 47 VAL QG . . 5.270 4.005 3.471 4.505 . 0 0 "[ . 1 . 2]" 1
182 1 46 ALA HA 1 47 VAL H . . 3.120 2.410 2.084 3.085 . 0 0 "[ . 1 . 2]" 1
183 1 43 LEU QD 1 46 ALA MB . . 3.630 2.255 1.910 2.724 . 0 0 "[ . 1 . 2]" 1
184 1 46 ALA MB 1 47 VAL HA . . 4.700 4.145 3.981 4.321 . 0 0 "[ . 1 . 2]" 1
185 1 46 ALA H 1 46 ALA MB . . 2.970 2.441 2.243 2.616 . 0 0 "[ . 1 . 2]" 1
186 1 44 ARG HA 1 44 ARG QD . . 4.390 3.703 2.060 4.418 0.028 6 0 "[ . 1 . 2]" 1
187 1 44 ARG HA 1 44 ARG HG2 . . 4.030 2.907 2.451 3.789 . 0 0 "[ . 1 . 2]" 1
188 1 18 ASN HA 1 20 ARG QD . . 5.500 4.709 2.705 5.544 0.044 13 0 "[ . 1 . 2]" 1
189 1 19 PRO QD 1 20 ARG QD . . 5.500 2.913 2.099 3.780 . 0 0 "[ . 1 . 2]" 1
190 1 25 ARG QD 1 28 GLN H . . 5.070 4.232 3.962 4.459 . 0 0 "[ . 1 . 2]" 1
191 1 20 ARG QD 1 22 CYS H . . 5.070 4.541 3.730 5.151 0.081 1 0 "[ . 1 . 2]" 1
192 1 43 LEU HG 1 46 ALA MB . . 4.620 4.385 4.055 4.651 0.031 7 0 "[ . 1 . 2]" 1
193 1 25 ARG HG2 1 28 GLN HA . . 5.500 5.501 5.270 5.564 0.064 9 0 "[ . 1 . 2]" 1
194 1 41 TYR HA 1 43 LEU HG . . 5.500 4.500 3.834 5.156 . 0 0 "[ . 1 . 2]" 1
195 1 25 ARG HG3 1 28 GLN HA . . 5.500 4.133 4.030 4.217 . 0 0 "[ . 1 . 2]" 1
196 1 25 ARG HG2 1 28 GLN H . . 5.020 3.982 3.721 4.086 . 0 0 "[ . 1 . 2]" 1
197 1 2 ARG HG3 1 3 CYS H . . 5.230 5.059 4.770 5.257 0.027 8 0 "[ . 1 . 2]" 1
198 1 16 LEU QB 1 16 LEU MD2 . . 3.040 2.219 2.045 2.358 . 0 0 "[ . 1 . 2]" 1
199 1 43 LEU HA 1 43 LEU QD . . 4.200 2.140 2.069 2.209 . 0 0 "[ . 1 . 2]" 1
200 1 43 LEU HA 1 44 ARG H . . 3.210 2.370 2.070 3.247 0.037 6 0 "[ . 1 . 2]" 1
201 1 42 LYS QG 1 43 LEU HG . . 5.500 4.487 3.604 5.355 . 0 0 "[ . 1 . 2]" 1
202 1 2 ARG HG2 1 3 CYS H . . 5.230 4.545 3.892 5.025 . 0 0 "[ . 1 . 2]" 1
203 1 43 LEU HB2 1 46 ALA MB . . 4.710 4.110 3.327 4.781 0.071 17 0 "[ . 1 . 2]" 1
204 1 43 LEU HB3 1 46 ALA MB . . 4.710 2.759 1.979 4.119 . 0 0 "[ . 1 . 2]" 1
205 1 43 LEU H 1 43 LEU HB3 . . 3.780 3.583 3.545 3.621 . 0 0 "[ . 1 . 2]" 1
206 1 16 LEU HA 1 16 LEU MD2 . . 4.210 3.337 1.949 4.126 . 0 0 "[ . 1 . 2]" 1
207 1 42 LYS HB3 1 42 LYS QD . . 2.880 2.357 2.287 2.428 . 0 0 "[ . 1 . 2]" 1
208 1 44 ARG HA 1 44 ARG HG3 . . 4.030 3.366 2.905 3.870 . 0 0 "[ . 1 . 2]" 1
209 1 51 LYS HA 1 51 LYS QD . . 4.100 3.370 2.016 4.160 0.060 8 0 "[ . 1 . 2]" 1
210 1 42 LYS HA 1 42 LYS QG . . 3.730 3.498 3.465 3.573 . 0 0 "[ . 1 . 2]" 1
211 1 51 LYS HA 1 51 LYS QE . . 4.130 3.525 2.500 4.264 0.134 13 0 "[ . 1 . 2]" 1
212 1 42 LYS HB3 1 42 LYS QE . . 4.360 3.971 3.855 4.219 . 0 0 "[ . 1 . 2]" 1
213 1 42 LYS HA 1 43 LEU H . . 3.540 3.090 2.980 3.211 . 0 0 "[ . 1 . 2]" 1
214 1 107 PRO HG2 1 116 ILE MD . . 4.450 3.548 2.702 4.098 . 0 0 "[ . 1 . 2]" 1
215 1 50 PRO HG2 1 51 LYS QD . . 4.480 4.401 3.912 4.527 0.047 1 0 "[ . 1 . 2]" 1
216 1 42 LYS QD 1 43 LEU HA . . 4.190 4.096 3.781 4.285 0.095 9 0 "[ . 1 . 2]" 1
217 1 40 ASP HA 1 42 LYS QD . . 5.060 4.556 2.695 4.901 . 0 0 "[ . 1 . 2]" 1
218 1 40 ASP H 1 42 LYS QD . . 5.500 5.436 4.907 5.725 0.225 13 0 "[ . 1 . 2]" 1
219 1 41 TYR HA 1 42 LYS HB3 . . 5.500 5.490 5.423 5.533 0.033 2 0 "[ . 1 . 2]" 1
220 1 61 ASN HB2 1 64 GLN QB . . 5.500 5.572 5.539 5.614 0.114 18 0 "[ . 1 . 2]" 1
221 1 58 LEU HA 1 61 ASN HB2 . . 4.050 3.959 3.751 4.086 0.036 13 0 "[ . 1 . 2]" 1
222 1 41 TYR HB3 1 42 LYS HA . . 5.500 5.495 5.435 5.521 0.021 16 0 "[ . 1 . 2]" 1
223 1 61 ASN HB2 1 62 GLN HA . . 5.500 5.578 5.547 5.618 0.118 10 0 "[ . 1 . 2]" 1
224 1 40 ASP H 1 40 ASP HB2 . . 3.830 2.528 2.207 3.518 . 0 0 "[ . 1 . 2]" 1
225 1 40 ASP HB3 1 42 LYS QD . . 4.490 3.081 2.524 4.256 . 0 0 "[ . 1 . 2]" 1
226 1 40 ASP HB2 1 42 LYS QD . . 4.490 4.073 2.432 4.506 0.016 13 0 "[ . 1 . 2]" 1
227 1 40 ASP HB3 1 43 LEU QD . . 4.600 2.210 1.938 3.406 . 0 0 "[ . 1 . 2]" 1
228 1 40 ASP HB2 1 43 LEU QD . . 4.600 2.733 2.327 3.091 . 0 0 "[ . 1 . 2]" 1
229 1 39 PHE HA 1 99 MET QG . . 5.500 4.635 3.678 5.507 0.007 14 0 "[ . 1 . 2]" 1
230 1 39 PHE HB3 1 40 ASP H . . 4.520 3.370 1.889 3.979 . 0 0 "[ . 1 . 2]" 1
231 1 37 THR H 1 38 SER QB . . 4.930 4.350 3.888 4.752 . 0 0 "[ . 1 . 2]" 1
232 1 37 THR H 1 38 SER HA . . 5.260 4.972 4.797 5.087 . 0 0 "[ . 1 . 2]" 1
233 1 37 THR HA 1 37 THR MG . . 3.190 2.303 2.232 2.373 . 0 0 "[ . 1 . 2]" 1
234 1 37 THR MG 1 86 LEU MD2 . . 3.810 2.170 2.054 2.313 . 0 0 "[ . 1 . 2]" 1
235 1 37 THR MG 1 86 LEU HG . . 3.770 3.340 2.961 3.742 . 0 0 "[ . 1 . 2]" 1
236 1 37 THR MG 1 82 ALA MB . . 2.980 1.901 1.828 1.997 . 0 0 "[ . 1 . 2]" 1
237 1 36 LEU HB2 1 37 THR MG . . 3.690 3.175 2.835 3.380 . 0 0 "[ . 1 . 2]" 1
238 1 37 THR MG 1 96 VAL HB . . 4.480 4.168 4.047 4.306 . 0 0 "[ . 1 . 2]" 1
239 1 37 THR MG 1 99 MET QG . . 5.350 5.249 5.135 5.365 0.015 3 0 "[ . 1 . 2]" 1
240 1 33 GLN HG3 1 37 THR MG . . 4.110 3.391 3.098 3.636 . 0 0 "[ . 1 . 2]" 1
241 1 37 THR MG 1 82 ALA HA . . 3.430 2.689 2.534 2.823 . 0 0 "[ . 1 . 2]" 1
242 1 37 THR MG 1 38 SER H . . 4.410 4.045 3.963 4.149 . 0 0 "[ . 1 . 2]" 1
243 1 37 THR H 1 37 THR MG . . 3.550 2.367 2.271 2.526 . 0 0 "[ . 1 . 2]" 1
244 1 37 THR MG 1 86 LEU H . . 4.310 4.163 3.979 4.325 0.015 11 0 "[ . 1 . 2]" 1
245 1 33 GLN QB 1 36 LEU HB2 . . 5.230 5.242 5.119 5.303 0.073 7 0 "[ . 1 . 2]" 1
246 1 36 LEU HA 1 99 MET QG . . 4.660 2.049 1.881 2.456 . 0 0 "[ . 1 . 2]" 1
247 1 36 LEU HB2 1 99 MET QG . . 4.600 4.244 4.071 4.526 . 0 0 "[ . 1 . 2]" 1
248 1 85 GLN HA 1 88 GLN HG3 . . 4.600 3.663 3.060 4.394 . 0 0 "[ . 1 . 2]" 1
249 1 87 GLN QB 1 93 GLN QG . . 3.560 3.196 2.777 3.578 0.018 10 0 "[ . 1 . 2]" 1
250 1 24 ILE HA 1 74 ALA MB . . 4.780 4.817 4.777 4.859 0.079 2 0 "[ . 1 . 2]" 1
251 1 93 GLN H 1 94 GLN HA . . 5.500 5.454 5.324 5.512 0.012 8 0 "[ . 1 . 2]" 1
252 1 86 LEU MD1 1 93 GLN QB . . 5.500 5.408 4.815 5.580 0.080 19 0 "[ . 1 . 2]" 1
253 1 93 GLN QB 1 96 VAL MG2 . . 5.500 5.135 4.971 5.406 . 0 0 "[ . 1 . 2]" 1
254 1 93 GLN QB 1 96 VAL MG1 . . 5.500 5.206 4.809 5.510 0.010 4 0 "[ . 1 . 2]" 1
255 1 94 GLN QB 1 97 GLN HB2 . . 5.500 4.628 4.244 5.166 . 0 0 "[ . 1 . 2]" 1
256 1 87 GLN QB 1 88 GLN H . . 4.140 2.626 2.405 2.963 . 0 0 "[ . 1 . 2]" 1
257 1 34 MET HB2 1 35 HIS H . . 3.980 3.800 3.707 3.909 . 0 0 "[ . 1 . 2]" 1
258 1 110 CYS HB3 1 112 LEU MD2 . . 3.870 2.528 2.236 2.739 . 0 0 "[ . 1 . 2]" 1
259 1 33 GLN HA 1 33 GLN HG3 . . 3.530 2.743 2.676 2.827 . 0 0 "[ . 1 . 2]" 1
260 1 33 GLN HA 1 37 THR MG . . 4.510 3.598 3.346 3.888 . 0 0 "[ . 1 . 2]" 1
261 1 33 GLN HG3 1 82 ALA HA . . 4.250 2.214 1.973 2.457 . 0 0 "[ . 1 . 2]" 1
262 1 82 ALA HA 1 85 GLN HG3 . . 4.430 3.782 3.430 4.125 . 0 0 "[ . 1 . 2]" 1
263 1 105 MET HB3 1 106 LEU H . . 4.400 4.130 4.040 4.254 . 0 0 "[ . 1 . 2]" 1
264 1 105 MET HB3 1 108 ASN H . . 5.440 4.572 4.378 4.721 . 0 0 "[ . 1 . 2]" 1
265 1 29 LEU HA 1 32 CYS HB2 . . 3.730 3.056 2.810 3.258 . 0 0 "[ . 1 . 2]" 1
266 1 32 CYS HA 1 35 HIS HB3 . . 4.630 3.715 2.587 4.663 0.033 6 0 "[ . 1 . 2]" 1
267 1 114 CYS HB3 1 115 SER HA . . 5.290 4.178 3.976 4.415 . 0 0 "[ . 1 . 2]" 1
268 1 32 CYS HA 1 33 GLN QB . . 5.310 5.067 4.969 5.121 . 0 0 "[ . 1 . 2]" 1
269 1 32 CYS HA 1 36 LEU QD . . 4.690 3.728 3.435 4.119 . 0 0 "[ . 1 . 2]" 1
270 1 32 CYS HB3 1 36 LEU QD . . 4.380 3.455 2.945 4.156 . 0 0 "[ . 1 . 2]" 1
271 1 32 CYS HB3 1 78 VAL MG1 . . 4.740 1.983 1.843 2.180 . 0 0 "[ . 1 . 2]" 1
272 1 29 LEU QB 1 32 CYS HB3 . . 4.120 3.603 2.820 4.087 . 0 0 "[ . 1 . 2]" 1
273 1 29 LEU QB 1 32 CYS HB2 . . 4.340 3.526 3.219 3.904 . 0 0 "[ . 1 . 2]" 1
274 1 32 CYS HB2 1 33 GLN QB . . 5.200 4.563 4.307 4.912 . 0 0 "[ . 1 . 2]" 1
275 1 32 CYS HB3 1 33 GLN HA . . 5.160 3.919 3.824 4.054 . 0 0 "[ . 1 . 2]" 1
276 1 30 ASN H 1 32 CYS HB2 . . 5.500 5.473 5.390 5.533 0.033 5 0 "[ . 1 . 2]" 1
277 1 108 ASN HB2 1 109 GLN H . . 4.080 2.536 2.297 3.015 . 0 0 "[ . 1 . 2]" 1
278 1 31 HIS HA 1 32 CYS HA . . 5.150 4.843 4.792 4.932 . 0 0 "[ . 1 . 2]" 1
279 1 31 HIS HA 1 35 HIS H . . 5.280 3.811 3.673 3.945 . 0 0 "[ . 1 . 2]" 1
280 1 31 HIS HB2 1 32 CYS H . . 5.200 3.490 3.320 3.655 . 0 0 "[ . 1 . 2]" 1
281 1 31 HIS HB2 1 59 CYS HA . . 5.330 5.252 5.014 5.410 0.080 13 0 "[ . 1 . 2]" 1
282 1 30 ASN HA 1 33 GLN HG2 . . 4.230 4.162 3.895 4.267 0.037 4 0 "[ . 1 . 2]" 1
283 1 30 ASN HA 1 33 GLN HA . . 5.500 5.251 5.061 5.400 . 0 0 "[ . 1 . 2]" 1
284 1 29 LEU H 1 30 ASN HA . . 5.170 4.596 4.427 4.808 . 0 0 "[ . 1 . 2]" 1
285 1 28 GLN HG3 1 29 LEU HA . . 4.480 3.383 3.127 4.027 . 0 0 "[ . 1 . 2]" 1
286 1 29 LEU QB 1 78 VAL HA . . 4.290 2.794 2.625 2.938 . 0 0 "[ . 1 . 2]" 1
287 1 28 GLN HA 1 28 GLN HG3 . . 3.730 3.612 3.567 3.747 0.017 12 0 "[ . 1 . 2]" 1
288 1 28 GLN HA 1 30 ASN H . . 4.380 3.582 3.347 3.764 . 0 0 "[ . 1 . 2]" 1
289 1 25 ARG QB 1 28 GLN HG2 . . 4.780 4.236 4.033 4.467 . 0 0 "[ . 1 . 2]" 1
290 1 28 GLN HG3 1 29 LEU QB . . 5.270 4.064 3.792 4.537 . 0 0 "[ . 1 . 2]" 1
291 1 24 ILE MG 1 28 GLN HG2 . . 3.960 2.597 2.473 2.722 . 0 0 "[ . 1 . 2]" 1
292 1 24 ILE MG 1 28 GLN HG3 . . 5.390 3.427 3.029 3.611 . 0 0 "[ . 1 . 2]" 1
293 1 28 GLN H 1 28 GLN HG3 . . 4.080 3.372 3.081 3.572 . 0 0 "[ . 1 . 2]" 1
294 1 63 LEU MD1 1 64 GLN QB . . 4.350 2.819 2.711 2.892 . 0 0 "[ . 1 . 2]" 1
295 1 25 ARG HG2 1 28 GLN QB . . 4.460 2.999 2.771 3.098 . 0 0 "[ . 1 . 2]" 1
296 1 83 GLN QB 1 84 LYS H . . 3.650 3.534 3.464 3.576 . 0 0 "[ . 1 . 2]" 1
297 1 64 GLN QB 1 65 GLU H . . 3.780 3.755 3.669 3.802 0.022 3 0 "[ . 1 . 2]" 1
298 1 27 GLN HA 1 27 GLN QG . . 3.400 3.350 3.317 3.433 0.033 1 0 "[ . 1 . 2]" 1
299 1 27 GLN HA 1 30 ASN H . . 4.080 3.459 3.114 3.642 . 0 0 "[ . 1 . 2]" 1
300 1 25 ARG HG3 1 27 GLN QG . . 4.960 2.588 2.321 3.213 . 0 0 "[ . 1 . 2]" 1
301 1 27 GLN QG 1 28 GLN HA . . 4.020 3.513 3.298 4.020 . 5 0 "[ . 1 . 2]" 1
302 1 25 ARG HA 1 27 GLN QG . . 5.230 4.092 3.741 4.954 . 0 0 "[ . 1 . 2]" 1
303 1 27 GLN QG 1 28 GLN H . . 3.830 2.698 2.508 2.911 . 0 0 "[ . 1 . 2]" 1
304 1 29 LEU H 1 33 GLN QB . . 5.500 5.345 5.175 5.506 0.006 3 0 "[ . 1 . 2]" 1
305 1 33 GLN QB 1 82 ALA H . . 4.660 4.214 4.035 4.450 . 0 0 "[ . 1 . 2]" 1
306 1 75 ILE MG 1 106 LEU HB2 . . 3.260 2.423 2.177 2.575 . 0 0 "[ . 1 . 2]" 1
307 1 26 ILE HA 1 26 ILE MG . . 3.340 2.265 2.200 2.340 . 0 0 "[ . 1 . 2]" 1
308 1 26 ILE MD 1 26 ILE MG . . 3.300 3.221 3.187 3.241 . 0 0 "[ . 1 . 2]" 1
309 1 26 ILE HB 1 26 ILE MD . . 3.490 2.402 2.352 2.440 . 0 0 "[ . 1 . 2]" 1
310 1 26 ILE HA 1 26 ILE MD . . 3.810 3.696 3.676 3.711 . 0 0 "[ . 1 . 2]" 1
311 1 25 ARG HA 1 26 ILE HA . . 4.590 4.269 4.222 4.329 . 0 0 "[ . 1 . 2]" 1
312 1 24 ILE HB 1 25 ARG HA . . 5.120 5.018 4.762 5.177 0.057 16 0 "[ . 1 . 2]" 1
313 1 26 ILE H 1 26 ILE HB . . 3.720 3.657 3.622 3.689 . 0 0 "[ . 1 . 2]" 1
314 1 26 ILE HB 1 27 GLN H . . 4.370 4.102 4.034 4.185 . 0 0 "[ . 1 . 2]" 1
315 1 26 ILE MG 1 27 GLN H . . 4.210 4.168 4.120 4.228 0.018 17 0 "[ . 1 . 2]" 1
316 1 26 ILE MD 1 27 GLN HA . . 4.180 2.718 2.577 2.827 . 0 0 "[ . 1 . 2]" 1
317 1 26 ILE MD 1 29 LEU H . . 5.500 4.850 4.686 5.054 . 0 0 "[ . 1 . 2]" 1
318 1 25 ARG HA 1 25 ARG QD . . 4.590 4.267 4.145 4.486 . 0 0 "[ . 1 . 2]" 1
319 1 2 ARG HA 1 2 ARG QD . . 4.680 3.192 1.978 4.241 . 0 0 "[ . 1 . 2]" 1
320 1 25 ARG QB 1 25 ARG QD . . 3.470 2.124 2.024 2.323 . 0 0 "[ . 1 . 2]" 1
321 1 25 ARG HA 1 25 ARG HG2 . . 4.180 3.751 3.666 3.804 . 0 0 "[ . 1 . 2]" 1
322 1 25 ARG HA 1 25 ARG HG3 . . 4.180 3.822 3.766 3.879 . 0 0 "[ . 1 . 2]" 1
323 1 25 ARG QB 1 27 GLN H . . 4.960 2.836 2.725 2.941 . 0 0 "[ . 1 . 2]" 1
324 1 34 MET HA 1 37 THR MG . . 4.960 3.748 3.472 3.999 . 0 0 "[ . 1 . 2]" 1
325 1 24 ILE HG12 1 24 ILE MG . . 3.290 2.111 2.062 2.158 . 0 0 "[ . 1 . 2]" 1
326 1 24 ILE HG13 1 24 ILE MG . . 3.290 2.530 2.481 2.574 . 0 0 "[ . 1 . 2]" 1
327 1 24 ILE HA 1 25 ARG HA . . 4.770 4.255 4.145 4.315 . 0 0 "[ . 1 . 2]" 1
328 1 24 ILE H 1 24 ILE HB . . 3.400 2.742 2.632 2.847 . 0 0 "[ . 1 . 2]" 1
329 1 22 CYS HB3 1 24 ILE HG12 . . 4.680 4.092 3.955 4.182 . 0 0 "[ . 1 . 2]" 1
330 1 24 ILE MG 1 28 GLN QB . . 4.020 4.048 3.948 4.149 0.129 12 0 "[ . 1 . 2]" 1
331 1 24 ILE MG 1 77 GLN HG3 . . 5.210 3.972 3.253 4.449 . 0 0 "[ . 1 . 2]" 1
332 1 22 CYS HB3 1 24 ILE MG . . 5.310 5.161 5.034 5.310 . 1 0 "[ . 1 . 2]" 1
333 1 24 ILE MG 1 26 ILE HA . . 5.280 4.298 3.985 4.597 . 0 0 "[ . 1 . 2]" 1
334 1 24 ILE MG 1 74 ALA HA . . 3.500 2.865 2.671 3.146 . 0 0 "[ . 1 . 2]" 1
335 1 24 ILE MG 1 25 ARG HA . . 5.150 4.232 4.074 4.380 . 0 0 "[ . 1 . 2]" 1
336 1 24 ILE MG 1 28 GLN H . . 5.500 4.490 4.376 4.610 . 0 0 "[ . 1 . 2]" 1
337 1 24 ILE H 1 24 ILE MG . . 4.120 3.884 3.833 3.926 . 0 0 "[ . 1 . 2]" 1
338 1 24 ILE HB 1 24 ILE MD . . 3.700 2.345 2.301 2.399 . 0 0 "[ . 1 . 2]" 1
339 1 24 ILE HA 1 24 ILE MD . . 3.830 3.387 3.265 3.489 . 0 0 "[ . 1 . 2]" 1
340 1 24 ILE HA 1 24 ILE MG . . 3.140 2.354 2.288 2.408 . 0 0 "[ . 1 . 2]" 1
341 1 24 ILE MD 1 74 ALA MB . . 3.300 3.221 2.929 3.344 0.044 6 0 "[ . 1 . 2]" 1
342 1 24 ILE MD 1 73 GLU QG . . 3.680 3.349 3.142 3.480 . 0 0 "[ . 1 . 2]" 1
343 1 22 CYS HB3 1 24 ILE MD . . 3.390 2.157 1.989 2.356 . 0 0 "[ . 1 . 2]" 1
344 1 22 CYS HB2 1 24 ILE MD . . 3.900 2.428 2.095 2.924 . 0 0 "[ . 1 . 2]" 1
345 1 24 ILE MD 1 70 CYS HB3 . . 3.670 2.568 2.405 2.736 . 0 0 "[ . 1 . 2]" 1
346 1 24 ILE MD 1 71 GLN HA . . 5.500 5.216 5.032 5.401 . 0 0 "[ . 1 . 2]" 1
347 1 24 ILE MD 1 74 ALA HA . . 3.530 2.494 2.162 2.754 . 0 0 "[ . 1 . 2]" 1
348 1 24 ILE MD 1 70 CYS HA . . 4.430 3.326 3.184 3.447 . 0 0 "[ . 1 . 2]" 1
349 1 24 ILE MD 1 74 ALA H . . 4.050 3.113 2.803 3.300 . 0 0 "[ . 1 . 2]" 1
350 1 23 GLN HA 1 23 GLN HG3 . . 3.900 3.773 3.697 3.835 . 0 0 "[ . 1 . 2]" 1
351 1 23 GLN QB 1 23 GLN HG2 . . 2.650 2.330 2.271 2.408 . 0 0 "[ . 1 . 2]" 1
352 1 23 GLN HA 1 24 ILE MD . . 4.210 2.787 2.522 3.051 . 0 0 "[ . 1 . 2]" 1
353 1 113 GLN HA 1 114 CYS HA . . 4.520 4.426 4.367 4.514 . 0 0 "[ . 1 . 2]" 1
354 1 53 GLN QG 1 56 LEU H . . 5.210 4.911 4.549 5.270 0.060 5 0 "[ . 1 . 2]" 1
355 1 23 GLN HG2 1 24 ILE H . . 5.030 5.075 5.030 5.116 0.086 19 0 "[ . 1 . 2]" 1
356 1 23 GLN QB 1 24 ILE HA . . 4.530 4.550 4.434 4.608 0.078 18 0 "[ . 1 . 2]" 1
357 1 22 CYS HA 1 73 GLU QG . . 4.850 4.650 4.308 4.866 0.016 13 0 "[ . 1 . 2]" 1
358 1 22 CYS HA 1 23 GLN HG2 . . 4.900 3.925 3.552 4.316 . 0 0 "[ . 1 . 2]" 1
359 1 22 CYS HA 1 23 GLN QB . . 4.640 4.408 4.198 4.507 . 0 0 "[ . 1 . 2]" 1
360 1 22 CYS HA 1 24 ILE MD . . 4.600 3.909 3.837 3.989 . 0 0 "[ . 1 . 2]" 1
361 1 22 CYS HA 1 70 CYS HB3 . . 5.360 4.381 3.932 4.706 . 0 0 "[ . 1 . 2]" 1
362 1 21 GLY HA3 1 22 CYS HA . . 5.020 4.414 4.215 4.712 . 0 0 "[ . 1 . 2]" 1
363 1 21 GLY H 1 22 CYS HA . . 5.060 4.528 4.119 5.072 0.012 15 0 "[ . 1 . 2]" 1
364 1 22 CYS HB3 1 73 GLU HB2 . . 5.120 3.228 2.842 3.464 . 0 0 "[ . 1 . 2]" 1
365 1 20 ARG HA 1 20 ARG QD . . 4.290 3.343 3.017 3.724 . 0 0 "[ . 1 . 2]" 1
366 1 20 ARG HA 1 20 ARG QG . . 3.520 2.591 2.344 2.815 . 0 0 "[ . 1 . 2]" 1
367 1 20 ARG H 1 20 ARG HB2 . . 3.940 2.795 2.606 3.012 . 0 0 "[ . 1 . 2]" 1
368 1 64 GLN QG 1 65 GLU HA . . 3.370 3.386 3.219 3.444 0.074 6 0 "[ . 1 . 2]" 1
369 1 19 PRO QD 1 20 ARG HA . . 5.380 5.092 4.720 5.409 0.029 13 0 "[ . 1 . 2]" 1
370 1 19 PRO HA 1 20 ARG QG . . 5.500 5.222 4.777 5.530 0.030 17 0 "[ . 1 . 2]" 1
371 1 18 ASN HB2 1 19 PRO QD . . 4.430 4.155 3.233 4.438 0.008 8 0 "[ . 1 . 2]" 1
372 1 18 ASN HB3 1 19 PRO QD . . 4.430 3.999 3.287 4.436 0.006 15 0 "[ . 1 . 2]" 1
373 1 19 PRO QD 1 20 ARG H . . 4.160 2.501 2.052 2.952 . 0 0 "[ . 1 . 2]" 1
374 1 18 ASN H 1 19 PRO QD . . 4.280 3.489 2.797 4.121 . 0 0 "[ . 1 . 2]" 1
375 1 16 LEU QB 1 17 ASP HA . . 4.830 4.396 3.931 4.841 0.011 3 0 "[ . 1 . 2]" 1
376 1 16 LEU HA 1 17 ASP H . . 3.380 3.183 2.121 3.474 0.094 12 0 "[ . 1 . 2]" 1
377 1 60 CYS HA 1 63 LEU MD2 . . 4.540 1.851 1.789 1.941 . 0 0 "[ . 1 . 2]" 1
378 1 13 PRO QG 1 15 GLY QA . . 5.500 6.610 5.175 8.032 2.532 10 17 "[** *.***-+****.*****]" 1
379 1 91 GLY HA3 1 93 GLN QB . . 5.500 5.232 4.834 5.534 0.034 16 0 "[ . 1 . 2]" 1
380 1 14 ASP HB3 1 15 GLY QA . . 5.500 4.185 3.792 4.834 . 0 0 "[ . 1 . 2]" 1
381 1 14 ASP H 1 15 GLY QA . . 5.070 4.253 3.629 4.800 . 0 0 "[ . 1 . 2]" 1
382 1 91 GLY HA3 1 94 GLN H . . 5.500 5.189 4.831 5.522 0.022 4 0 "[ . 1 . 2]" 1
383 1 11 CYS QB 1 13 PRO HA . . 5.490 5.372 5.076 5.556 0.066 11 0 "[ . 1 . 2]" 1
384 1 12 PHE QB 1 13 PRO QB . . 5.040 4.567 3.981 4.835 . 0 0 "[ . 1 . 2]" 1
385 1 63 LEU HA 1 66 VAL HB . . 4.730 3.824 3.551 4.171 . 0 0 "[ . 1 . 2]" 1
386 1 12 PHE QD 1 13 PRO QB . . 5.300 5.390 5.124 5.556 0.256 2 0 "[ . 1 . 2]" 1
387 1 12 PHE QB 1 13 PRO QD . . 4.040 2.224 1.980 2.801 . 0 0 "[ . 1 . 2]" 1
388 1 12 PHE HA 1 13 PRO QD . . 3.260 2.054 1.879 2.203 . 0 0 "[ . 1 . 2]" 1
389 1 3 CYS HB3 1 11 CYS HA . . 5.220 3.575 3.202 4.087 . 0 0 "[ . 1 . 2]" 1
390 1 11 CYS HA 1 12 PHE QD . . 4.880 3.712 3.353 4.357 . 0 0 "[ . 1 . 2]" 1
391 1 3 CYS HA 1 11 CYS QB . . 4.730 3.648 2.863 3.884 . 0 0 "[ . 1 . 2]" 1
392 1 11 CYS QB 1 12 PHE H . . 4.000 2.946 2.623 3.574 . 0 0 "[ . 1 . 2]" 1
393 1 9 PRO HG2 1 10 ILE HA . . 5.100 5.043 4.831 5.133 0.033 2 0 "[ . 1 . 2]" 1
394 1 8 PRO HB3 1 9 PRO HD3 . . 4.410 4.051 3.783 4.389 . 0 0 "[ . 1 . 2]" 1
395 1 4 THR H 1 9 PRO HA . . 4.890 4.068 3.839 4.413 . 0 0 "[ . 1 . 2]" 1
396 1 3 CYS HB2 1 9 PRO QB . . 4.280 3.504 3.058 4.109 . 0 0 "[ . 1 . 2]" 1
397 1 13 PRO QG 1 14 ASP H . . 4.100 3.661 2.649 4.772 0.672 10 1 "[ . + . 2]" 1
398 1 6 SER HA 1 7 ILE HB . . 4.820 4.602 4.541 4.732 . 0 0 "[ . 1 . 2]" 1
399 1 6 SER HA 1 7 ILE MD . . 5.000 4.333 2.500 4.992 . 0 0 "[ . 1 . 2]" 1
400 1 6 SER HB3 1 7 ILE H . . 3.850 3.436 2.404 3.873 0.023 7 0 "[ . 1 . 2]" 1
401 1 5 LYS HA 1 5 LYS QE . . 5.500 4.151 2.468 4.924 . 0 0 "[ . 1 . 2]" 1
402 1 5 LYS HA 1 5 LYS HD2 . . 4.310 3.146 2.141 4.333 0.023 12 0 "[ . 1 . 2]" 1
403 1 5 LYS HA 1 5 LYS HD3 . . 4.310 3.064 1.999 4.224 . 0 0 "[ . 1 . 2]" 1
404 1 4 THR MG 1 9 PRO HA . . 5.370 4.761 4.609 4.875 . 0 0 "[ . 1 . 2]" 1
405 1 4 THR MG 1 10 ILE MD . . 4.270 4.294 4.229 4.342 0.072 9 0 "[ . 1 . 2]" 1
406 1 3 CYS HA 1 4 THR MG . . 4.530 3.541 3.399 3.712 . 0 0 "[ . 1 . 2]" 1
407 1 4 THR MG 1 12 PHE QE . . 3.880 2.739 2.190 3.806 . 0 0 "[ . 1 . 2]" 1
408 1 4 THR MG 1 10 ILE H . . 4.200 3.210 3.085 3.289 . 0 0 "[ . 1 . 2]" 1
409 1 4 THR MG 1 5 LYS H . . 3.980 3.794 3.646 3.948 . 0 0 "[ . 1 . 2]" 1
410 1 3 CYS HA 1 11 CYS HA . . 3.120 1.972 1.836 2.163 . 0 0 "[ . 1 . 2]" 1
411 1 3 CYS HB3 1 9 PRO QB . . 4.730 2.258 1.891 3.325 . 0 0 "[ . 1 . 2]" 1
412 1 3 CYS HB3 1 9 PRO HG3 . . 5.060 4.426 3.809 5.100 0.040 20 0 "[ . 1 . 2]" 1
413 1 3 CYS HB2 1 11 CYS HA . . 4.890 4.325 3.023 4.602 . 0 0 "[ . 1 . 2]" 1
414 1 3 CYS H 1 3 CYS HB3 . . 3.920 3.719 3.046 3.896 . 0 0 "[ . 1 . 2]" 1
415 1 25 ARG HG2 1 27 GLN QG . . 4.960 3.998 3.777 4.700 . 0 0 "[ . 1 . 2]" 1
416 1 107 PRO HB2 1 115 SER HA . . 4.710 2.736 2.244 3.278 . 0 0 "[ . 1 . 2]" 1
417 1 115 SER H 1 115 SER HB3 . . 4.140 3.658 3.297 3.897 . 0 0 "[ . 1 . 2]" 1
418 1 114 CYS HA 1 115 SER HA . . 4.580 4.493 4.421 4.566 . 0 0 "[ . 1 . 2]" 1
419 1 113 GLN HA 1 114 CYS HB2 . . 4.810 4.865 4.813 4.990 0.180 20 0 "[ . 1 . 2]" 1
420 1 102 LYS HA 1 105 MET HB3 . . 5.070 4.478 3.969 4.910 . 0 0 "[ . 1 . 2]" 1
421 1 66 VAL MG2 1 74 ALA MB . . 3.750 3.018 2.822 3.180 . 0 0 "[ . 1 . 2]" 1
422 1 66 VAL HA 1 66 VAL MG2 . . 3.390 2.554 2.493 2.633 . 0 0 "[ . 1 . 2]" 1
423 1 16 LEU HA 1 16 LEU MD1 . . 4.210 3.369 1.998 4.149 . 0 0 "[ . 1 . 2]" 1
424 1 16 LEU QB 1 16 LEU MD1 . . 3.040 2.207 2.031 2.381 . 0 0 "[ . 1 . 2]" 1
425 1 78 VAL HA 1 78 VAL MG2 . . 3.400 2.537 2.486 2.612 . 0 0 "[ . 1 . 2]" 1
426 1 78 VAL HA 1 78 VAL MG1 . . 3.400 2.329 2.289 2.364 . 0 0 "[ . 1 . 2]" 1
427 1 78 VAL HA 1 81 GLN HG2 . . 4.600 2.329 2.223 2.462 . 0 0 "[ . 1 . 2]" 1
428 1 36 LEU HB3 1 99 MET HB2 . . 4.630 4.657 4.628 4.689 0.059 1 0 "[ . 1 . 2]" 1
429 1 32 CYS HB3 1 78 VAL HB . . 5.050 4.243 3.981 4.546 . 0 0 "[ . 1 . 2]" 1
430 1 29 LEU HG 1 78 VAL MG2 . . 3.970 1.982 1.865 2.062 . 0 0 "[ . 1 . 2]" 1
431 1 32 CYS HB2 1 78 VAL MG2 . . 4.330 3.217 2.851 3.562 . 0 0 "[ . 1 . 2]" 1
432 1 32 CYS HB3 1 78 VAL MG2 . . 4.740 2.728 2.384 2.993 . 0 0 "[ . 1 . 2]" 1
433 1 97 GLN HA 1 100 VAL MG1 . . 3.760 1.957 1.842 2.080 . 0 0 "[ . 1 . 2]" 1
434 1 29 LEU HA 1 78 VAL MG2 . . 5.170 3.506 3.251 3.701 . 0 0 "[ . 1 . 2]" 1
435 1 78 VAL MG2 1 79 VAL H . . 3.920 3.575 3.464 3.688 . 0 0 "[ . 1 . 2]" 1
436 1 100 VAL MG1 1 103 ALA H . . 5.340 4.922 4.822 5.084 . 0 0 "[ . 1 . 2]" 1
437 1 79 VAL HA 1 79 VAL MG2 . . 3.240 2.481 2.445 2.534 . 0 0 "[ . 1 . 2]" 1
438 1 79 VAL HA 1 82 ALA MB . . 3.610 2.763 2.611 2.895 . 0 0 "[ . 1 . 2]" 1
439 1 79 VAL HA 1 80 GLU HA . . 4.860 4.804 4.693 4.870 0.010 9 0 "[ . 1 . 2]" 1
440 1 79 VAL MG1 1 103 ALA MB . . 4.050 3.806 3.284 4.040 . 0 0 "[ . 1 . 2]" 1
441 1 79 VAL MG1 1 82 ALA H . . 5.500 4.797 4.679 4.848 . 0 0 "[ . 1 . 2]" 1
442 1 79 VAL MG2 1 103 ALA MB . . 4.050 2.289 1.994 2.529 . 0 0 "[ . 1 . 2]" 1
443 1 79 VAL H 1 79 VAL MG2 . . 4.070 1.978 1.924 2.023 . 0 0 "[ . 1 . 2]" 1
444 1 93 GLN H 1 96 VAL MG2 . . 4.700 4.169 4.004 4.245 . 0 0 "[ . 1 . 2]" 1
445 1 86 LEU HB3 1 86 LEU MD2 . . 3.610 3.195 3.179 3.207 . 0 0 "[ . 1 . 2]" 1
446 1 86 LEU HA 1 86 LEU MD2 . . 3.490 2.234 2.063 2.418 . 0 0 "[ . 1 . 2]" 1
447 1 86 LEU MD1 1 96 VAL MG2 . . 4.220 2.702 2.344 2.892 . 0 0 "[ . 1 . 2]" 1
448 1 86 LEU HA 1 87 GLN QB . . 5.500 5.101 5.045 5.142 . 0 0 "[ . 1 . 2]" 1
449 1 86 LEU HA 1 87 GLN HA . . 5.210 4.832 4.740 4.913 . 0 0 "[ . 1 . 2]" 1
450 1 86 LEU HA 1 92 GLY HA3 . . 5.500 4.977 4.568 5.277 . 0 0 "[ . 1 . 2]" 1
451 1 86 LEU HB2 1 96 VAL MG1 . . 4.630 3.992 3.673 4.240 . 0 0 "[ . 1 . 2]" 1
452 1 85 GLN QB 1 86 LEU HB2 . . 5.500 5.188 5.036 5.357 . 0 0 "[ . 1 . 2]" 1
453 1 86 LEU HB2 1 96 VAL HB . . 5.500 4.692 4.410 5.052 . 0 0 "[ . 1 . 2]" 1
454 1 36 LEU QD 1 99 MET QG . . 4.090 2.105 1.929 2.389 . 0 0 "[ . 1 . 2]" 1
455 1 36 LEU H 1 36 LEU QD . . 4.010 3.230 3.127 3.275 . 0 0 "[ . 1 . 2]" 1
456 1 36 LEU QD 1 102 LYS H . . 4.430 3.377 3.144 3.564 . 0 0 "[ . 1 . 2]" 1
457 1 36 LEU HB3 1 100 VAL HA . . 3.580 2.352 2.104 2.538 . 0 0 "[ . 1 . 2]" 1
458 1 99 MET HA 1 100 VAL HA . . 5.500 4.643 4.611 4.668 . 0 0 "[ . 1 . 2]" 1
459 1 96 VAL HB 1 97 GLN H . . 4.290 3.119 3.065 3.169 . 0 0 "[ . 1 . 2]" 1
460 1 100 VAL MG2 1 104 GLN HG2 . . 4.910 4.857 3.919 4.969 0.059 9 0 "[ . 1 . 2]" 1
461 1 100 VAL MG2 1 104 GLN HG3 . . 4.910 4.128 3.789 4.936 0.026 19 0 "[ . 1 . 2]" 1
462 1 100 VAL MG2 1 103 ALA MB . . 3.750 2.767 2.636 2.875 . 0 0 "[ . 1 . 2]" 1
463 1 96 VAL MG2 1 97 GLN H . . 4.010 4.025 3.996 4.041 0.031 14 0 "[ . 1 . 2]" 1
464 1 100 VAL H 1 100 VAL MG2 . . 3.770 3.807 3.793 3.817 0.047 1 0 "[ . 1 . 2]" 1
465 1 100 VAL MG2 1 103 ALA H . . 5.130 3.913 3.817 4.064 . 0 0 "[ . 1 . 2]" 1
466 1 100 VAL HA 1 100 VAL MG1 . . 3.330 3.209 3.190 3.226 . 0 0 "[ . 1 . 2]" 1
467 1 96 VAL HA 1 99 MET HB3 . . 4.330 3.668 3.389 3.927 . 0 0 "[ . 1 . 2]" 1
468 1 99 MET HB3 1 100 VAL HA . . 4.540 3.804 3.756 3.845 . 0 0 "[ . 1 . 2]" 1
469 1 96 VAL HA 1 99 MET HB2 . . 3.420 3.308 3.077 3.441 0.021 19 0 "[ . 1 . 2]" 1
470 1 95 GLN HA 1 96 VAL HA . . 5.160 4.830 4.767 4.897 . 0 0 "[ . 1 . 2]" 1
471 1 96 VAL HA 1 99 MET H . . 3.640 3.489 3.384 3.585 . 0 0 "[ . 1 . 2]" 1
472 1 96 VAL HB 1 99 MET H . . 5.360 5.383 5.349 5.417 0.057 4 0 "[ . 1 . 2]" 1
473 1 100 VAL HB 1 101 LYS H . . 5.500 4.209 4.161 4.264 . 0 0 "[ . 1 . 2]" 1
474 1 86 LEU HB2 1 96 VAL MG2 . . 4.630 3.914 3.783 4.047 . 0 0 "[ . 1 . 2]" 1
475 1 100 VAL MG2 1 104 GLN H . . 4.800 4.652 4.424 4.812 0.012 4 0 "[ . 1 . 2]" 1
476 1 112 LEU HA 1 113 GLN QG . . 4.490 3.396 3.085 3.656 . 0 0 "[ . 1 . 2]" 1
477 1 16 LEU QB 1 17 ASP H . . 4.260 3.026 1.986 3.808 . 0 0 "[ . 1 . 2]" 1
478 1 14 ASP H 1 16 LEU QB . . 5.210 6.897 4.080 8.598 3.388 11 17 "[****** * 1+-********]" 1
479 1 71 GLN HG2 1 112 LEU MD2 . . 3.850 3.749 3.461 3.895 0.045 14 0 "[ . 1 . 2]" 1
480 1 64 GLN QB 1 112 LEU MD2 . . 5.370 3.648 3.473 3.846 . 0 0 "[ . 1 . 2]" 1
481 1 72 CYS HB3 1 112 LEU MD1 . . 4.880 2.882 2.767 3.164 . 0 0 "[ . 1 . 2]" 1
482 1 71 GLN HA 1 112 LEU MD1 . . 5.500 3.947 3.742 4.238 . 0 0 "[ . 1 . 2]" 1
483 1 71 GLN HA 1 112 LEU MD2 . . 5.500 4.232 4.106 4.332 . 0 0 "[ . 1 . 2]" 1
484 1 107 PRO HD2 1 112 LEU MD1 . . 5.500 4.494 4.346 4.673 . 0 0 "[ . 1 . 2]" 1
485 1 106 LEU H 1 112 LEU MD1 . . 5.500 5.565 5.511 5.612 0.112 1 0 "[ . 1 . 2]" 1
486 1 111 ASN HA 1 112 LEU HG . . 4.960 4.383 4.170 4.709 . 0 0 "[ . 1 . 2]" 1
487 1 110 CYS HA 1 111 ASN HB3 . . 4.710 4.553 4.356 4.721 0.011 14 0 "[ . 1 . 2]" 1
488 1 110 CYS HA 1 112 LEU HG . . 4.750 4.571 4.449 4.727 . 0 0 "[ . 1 . 2]" 1
489 1 110 CYS HA 1 112 LEU MD2 . . 4.530 4.299 4.131 4.464 . 0 0 "[ . 1 . 2]" 1
490 1 110 CYS HB2 1 112 LEU MD2 . . 3.870 3.645 2.826 3.880 0.010 14 0 "[ . 1 . 2]" 1
491 1 110 CYS HB2 1 112 LEU HG . . 4.030 3.517 2.256 3.749 . 0 0 "[ . 1 . 2]" 1
492 1 110 CYS HB3 1 112 LEU HG . . 4.030 2.101 1.919 3.353 . 0 0 "[ . 1 . 2]" 1
493 1 83 GLN HA 1 84 LYS HA . . 5.080 4.659 4.521 4.898 . 0 0 "[ . 1 . 2]" 1
494 1 101 LYS HA 1 102 LYS H . . 3.550 3.461 3.410 3.527 . 0 0 "[ . 1 . 2]" 1
495 1 105 MET HA 1 109 GLN QG . . 5.310 4.073 3.789 4.385 . 0 0 "[ . 1 . 2]" 1
496 1 106 LEU HA 1 109 GLN QG . . 5.500 3.486 3.131 3.897 . 0 0 "[ . 1 . 2]" 1
497 1 25 ARG QB 1 26 ILE MG . . 5.140 4.924 4.819 5.019 . 0 0 "[ . 1 . 2]" 1
498 1 24 ILE MG 1 25 ARG QB . . 5.020 4.240 3.963 4.420 . 0 0 "[ . 1 . 2]" 1
499 1 106 LEU H 1 109 GLN HB2 . . 5.130 4.973 4.703 5.137 0.007 7 0 "[ . 1 . 2]" 1
500 1 107 PRO HA 1 108 ASN HA . . 4.850 4.603 4.472 4.712 . 0 0 "[ . 1 . 2]" 1
501 1 107 PRO HA 1 112 LEU HA . . 4.860 4.564 4.492 4.631 . 0 0 "[ . 1 . 2]" 1
502 1 107 PRO HA 1 112 LEU MD1 . . 3.530 1.942 1.889 2.011 . 0 0 "[ . 1 . 2]" 1
503 1 107 PRO HA 1 109 GLN H . . 5.250 4.575 4.243 4.696 . 0 0 "[ . 1 . 2]" 1
504 1 107 PRO HA 1 110 CYS H . . 5.490 3.819 3.647 3.974 . 0 0 "[ . 1 . 2]" 1
505 1 107 PRO HB3 1 112 LEU MD1 . . 5.020 2.785 2.444 3.239 . 0 0 "[ . 1 . 2]" 1
506 1 107 PRO HB3 1 108 ASN H . . 4.640 4.383 4.302 4.444 . 0 0 "[ . 1 . 2]" 1
507 1 42 LYS QD 1 43 LEU QD . . 5.500 3.062 2.341 3.944 . 0 0 "[ . 1 . 2]" 1
508 1 105 MET HB2 1 107 PRO HD2 . . 4.850 4.846 4.762 4.915 0.065 15 0 "[ . 1 . 2]" 1
509 1 33 GLN HG2 1 34 MET HA . . 4.120 2.964 2.793 3.086 . 0 0 "[ . 1 . 2]" 1
510 1 105 MET HB2 1 108 ASN H . . 5.000 5.091 5.061 5.118 0.118 6 0 "[ . 1 . 2]" 1
511 1 60 CYS H 1 60 CYS HB3 . . 3.910 2.440 2.341 2.673 . 0 0 "[ . 1 . 2]" 1
512 1 103 ALA MB 1 104 GLN HA . . 4.160 3.845 3.792 3.942 . 0 0 "[ . 1 . 2]" 1
513 1 104 GLN HA 1 116 ILE HG13 . . 4.580 3.320 2.120 4.525 . 0 0 "[ . 1 . 2]" 1
514 1 104 GLN HA 1 105 MET HA . . 5.160 4.680 4.621 4.730 . 0 0 "[ . 1 . 2]" 1
515 1 104 GLN HA 1 106 LEU H . . 4.770 3.833 3.684 3.974 . 0 0 "[ . 1 . 2]" 1
516 1 25 ARG QB 1 28 GLN QB . . 4.280 3.976 3.791 4.124 . 0 0 "[ . 1 . 2]" 1
517 1 63 LEU MD2 1 64 GLN QB . . 4.350 4.393 4.367 4.445 0.095 14 0 "[ . 1 . 2]" 1
518 1 73 GLU HB3 1 74 ALA H . . 3.860 3.782 3.698 3.870 0.010 17 0 "[ . 1 . 2]" 1
519 1 103 ALA MB 1 104 GLN HG2 . . 4.840 3.899 3.221 4.369 . 0 0 "[ . 1 . 2]" 1
520 1 103 ALA MB 1 104 GLN HG3 . . 4.840 3.348 2.888 4.779 . 0 0 "[ . 1 . 2]" 1
521 1 103 ALA HA 1 106 LEU HG . . 4.620 3.071 1.856 4.510 . 0 0 "[ . 1 . 2]" 1
522 1 36 LEU QD 1 103 ALA HA . . 3.930 2.987 2.739 3.233 . 0 0 "[ . 1 . 2]" 1
523 1 103 ALA HA 1 106 LEU H . . 4.600 3.295 2.967 3.540 . 0 0 "[ . 1 . 2]" 1
524 1 100 VAL HA 1 103 ALA MB . . 3.290 3.232 3.148 3.298 0.008 6 0 "[ . 1 . 2]" 1
525 1 82 ALA MB 1 83 GLN QB . . 3.930 3.877 3.789 3.942 0.012 9 0 "[ . 1 . 2]" 1
526 1 36 LEU QD 1 103 ALA MB . . 2.640 1.919 1.814 2.025 . 0 0 "[ . 1 . 2]" 1
527 1 102 LYS H 1 103 ALA MB . . 4.600 4.261 4.207 4.311 . 0 0 "[ . 1 . 2]" 1
528 1 37 THR H 1 82 ALA MB . . 4.450 4.075 3.878 4.303 . 0 0 "[ . 1 . 2]" 1
529 1 103 ALA MB 1 104 GLN H . . 3.410 2.711 2.473 2.893 . 0 0 "[ . 1 . 2]" 1
530 1 103 ALA H 1 103 ALA MB . . 2.720 2.280 2.260 2.311 . 0 0 "[ . 1 . 2]" 1
531 1 77 GLN HA 1 80 GLU H . . 4.210 3.520 3.272 3.733 . 0 0 "[ . 1 . 2]" 1
532 1 84 LYS HA 1 84 LYS QE . . 5.500 4.785 3.964 5.543 0.043 9 0 "[ . 1 . 2]" 1
533 1 101 LYS HA 1 101 LYS QE . . 5.500 5.141 4.184 5.519 0.019 9 0 "[ . 1 . 2]" 1
534 1 80 GLU HA 1 80 GLU QB . . 2.730 2.355 2.308 2.396 . 0 0 "[ . 1 . 2]" 1
535 1 80 GLU HA 1 80 GLU HG2 . . 3.240 2.825 2.212 3.265 0.025 13 0 "[ . 1 . 2]" 1
536 1 24 ILE MD 1 76 LYS QB . . 5.500 4.583 4.389 4.809 . 0 0 "[ . 1 . 2]" 1
537 1 99 MET HA 1 101 LYS QB . . 5.500 5.550 5.428 5.613 0.113 8 0 "[ . 1 . 2]" 1
538 1 99 MET HA 1 102 LYS QD . . 4.070 2.197 1.979 3.292 . 0 0 "[ . 1 . 2]" 1
539 1 99 MET HA 1 102 LYS H . . 4.430 3.591 3.517 3.751 . 0 0 "[ . 1 . 2]" 1
540 1 99 MET HA 1 103 ALA H . . 5.500 5.561 5.515 5.618 0.118 4 0 "[ . 1 . 2]" 1
541 1 99 MET QG 1 102 LYS QD . . 4.970 2.712 2.497 3.113 . 0 0 "[ . 1 . 2]" 1
542 1 96 VAL HA 1 99 MET QG . . 4.720 4.702 4.526 4.772 0.052 19 0 "[ . 1 . 2]" 1
543 1 78 VAL HB 1 79 VAL H . . 4.080 2.507 2.419 2.631 . 0 0 "[ . 1 . 2]" 1
544 1 99 MET H 1 99 MET HB2 . . 3.990 2.426 2.352 2.516 . 0 0 "[ . 1 . 2]" 1
545 1 73 GLU HB3 1 76 LYS QG . . 5.170 3.897 3.520 4.441 . 0 0 "[ . 1 . 2]" 1
546 1 98 GLN QB 1 99 MET H . . 3.770 3.717 3.593 3.758 . 0 0 "[ . 1 . 2]" 1
547 1 106 LEU H 1 109 GLN QG . . 5.150 4.577 4.210 4.961 . 0 0 "[ . 1 . 2]" 1
548 1 98 GLN HG3 1 99 MET H . . 3.580 2.987 2.604 3.237 . 0 0 "[ . 1 . 2]" 1
549 1 94 GLN QG 1 95 GLN HA . . 3.770 3.410 3.267 3.581 . 0 0 "[ . 1 . 2]" 1
550 1 54 GLN QB 1 58 LEU HG . . 5.110 3.969 3.473 4.529 . 0 0 "[ . 1 . 2]" 1
551 1 92 GLY HA2 1 95 GLN HB3 . . 4.630 4.200 3.970 4.512 . 0 0 "[ . 1 . 2]" 1
552 1 30 ASN HA 1 33 GLN QB . . 3.710 2.280 2.092 2.429 . 0 0 "[ . 1 . 2]" 1
553 1 54 GLN QB 1 55 HIS H . . 3.980 3.355 3.188 3.498 . 0 0 "[ . 1 . 2]" 1
554 1 94 GLN QB 1 97 GLN HB3 . . 5.500 4.914 4.584 5.503 0.003 2 0 "[ . 1 . 2]" 1
555 1 94 GLN QG 1 95 GLN H . . 3.420 2.086 1.829 2.203 . 0 0 "[ . 1 . 2]" 1
556 1 92 GLY H 1 94 GLN QG . . 4.000 3.379 3.149 3.664 . 0 0 "[ . 1 . 2]" 1
557 1 73 GLU HA 1 76 LYS QG . . 4.470 2.181 1.921 2.656 . 0 0 "[ . 1 . 2]" 1
558 1 93 GLN HA 1 96 VAL MG1 . . 4.320 3.751 3.427 4.048 . 0 0 "[ . 1 . 2]" 1
559 1 94 GLN QB 1 95 GLN H . . 3.470 3.437 3.309 3.503 0.033 3 0 "[ . 1 . 2]" 1
560 1 63 LEU MD1 1 64 GLN QG . . 5.010 4.030 3.881 4.113 . 0 0 "[ . 1 . 2]" 1
561 1 92 GLY HA2 1 95 GLN H . . 4.990 3.253 3.151 3.430 . 0 0 "[ . 1 . 2]" 1
562 1 92 GLY HA3 1 95 GLN H . . 4.940 4.462 4.347 4.641 . 0 0 "[ . 1 . 2]" 1
563 1 92 GLY HA2 1 94 GLN QG . . 5.000 3.657 3.223 3.878 . 0 0 "[ . 1 . 2]" 1
564 1 92 GLY HA2 1 95 GLN HG2 . . 4.890 2.005 1.857 2.229 . 0 0 "[ . 1 . 2]" 1
565 1 15 GLY QA 1 16 LEU MD2 . . 5.500 4.042 2.808 5.207 . 0 0 "[ . 1 . 2]" 1
566 1 92 GLY HA3 1 95 GLN HG3 . . 4.280 4.015 3.672 4.225 . 0 0 "[ . 1 . 2]" 1
567 1 91 GLY HA2 1 93 GLN QB . . 4.440 4.444 4.353 4.505 0.065 7 0 "[ . 1 . 2]" 1
568 1 78 VAL MG1 1 81 GLN HG2 . . 4.630 3.851 3.607 3.961 . 0 0 "[ . 1 . 2]" 1
569 1 78 VAL H 1 81 GLN HG2 . . 4.930 4.301 4.106 4.469 . 0 0 "[ . 1 . 2]" 1
570 1 73 GLU HB2 1 75 ILE H . . 5.350 4.845 4.788 4.943 . 0 0 "[ . 1 . 2]" 1
571 1 71 GLN H 1 73 GLU HB2 . . 4.910 4.774 4.678 4.897 . 0 0 "[ . 1 . 2]" 1
572 1 84 LYS H 1 85 GLN QB . . 4.530 4.556 4.535 4.581 0.051 4 0 "[ . 1 . 2]" 1
573 1 89 GLY HA3 1 90 GLN H . . 3.550 2.253 2.047 3.487 . 0 0 "[ . 1 . 2]" 1
574 1 86 LEU MD1 1 93 GLN QG . . 5.180 4.233 3.815 4.498 . 0 0 "[ . 1 . 2]" 1
575 1 85 GLN HA 1 88 GLN HG2 . . 2.910 2.395 1.971 2.919 0.009 4 0 "[ . 1 . 2]" 1
576 1 98 GLN HA 1 98 GLN HG2 . . 3.710 3.730 3.688 3.758 0.048 12 0 "[ . 1 . 2]" 1
577 1 97 GLN H 1 98 GLN HG2 . . 4.610 4.334 4.049 4.618 0.008 7 0 "[ . 1 . 2]" 1
578 1 86 LEU HB3 1 87 GLN HA . . 5.210 4.193 4.028 4.338 . 0 0 "[ . 1 . 2]" 1
579 1 87 GLN QG 1 88 GLN H . . 3.760 3.720 3.425 3.819 0.059 4 0 "[ . 1 . 2]" 1
580 1 84 LYS QG 1 85 GLN HA . . 4.590 4.074 2.850 4.280 . 0 0 "[ . 1 . 2]" 1
581 1 84 LYS QB 1 85 GLN HA . . 4.590 4.408 4.243 4.600 0.010 9 0 "[ . 1 . 2]" 1
582 1 31 HIS HA 1 34 MET HG2 . . 4.190 2.142 1.943 2.365 . 0 0 "[ . 1 . 2]" 1
583 1 83 GLN QG 1 84 LYS H . . 3.520 2.353 2.217 2.431 . 0 0 "[ . 1 . 2]" 1
584 1 85 GLN QB 1 86 LEU MD2 . . 3.570 3.562 3.447 3.616 0.046 1 0 "[ . 1 . 2]" 1
585 1 37 THR MG 1 85 GLN QB . . 4.520 4.439 4.291 4.588 0.068 1 0 "[ . 1 . 2]" 1
586 1 85 GLN HA 1 85 GLN QB . . 2.800 2.176 2.139 2.190 . 0 0 "[ . 1 . 2]" 1
587 1 100 VAL HA 1 101 LYS HA . . 5.130 4.751 4.700 4.841 . 0 0 "[ . 1 . 2]" 1
588 1 24 ILE MD 1 73 GLU HA . . 4.510 4.020 3.915 4.130 . 0 0 "[ . 1 . 2]" 1
589 1 72 CYS HA 1 73 GLU HA . . 4.920 4.641 4.551 4.739 . 0 0 "[ . 1 . 2]" 1
590 1 80 GLU HA 1 82 ALA H . . 4.690 4.503 4.358 4.678 . 0 0 "[ . 1 . 2]" 1
591 1 98 GLN HA 1 101 LYS QE . . 3.850 3.222 2.161 3.912 0.062 18 0 "[ . 1 . 2]" 1
592 1 84 LYS H 1 84 LYS QE . . 5.200 4.665 4.259 5.319 0.119 3 0 "[ . 1 . 2]" 1
593 1 84 LYS QE 1 85 GLN H . . 5.060 4.238 3.516 4.884 . 0 0 "[ . 1 . 2]" 1
594 1 101 LYS QB 1 102 LYS QG . . 5.500 4.519 4.275 4.738 . 0 0 "[ . 1 . 2]" 1
595 1 84 LYS QB 1 87 GLN H . . 5.240 4.837 4.668 5.082 . 0 0 "[ . 1 . 2]" 1
596 1 83 GLN H 1 84 LYS QB . . 4.760 4.648 3.896 4.768 0.008 9 0 "[ . 1 . 2]" 1
597 1 100 VAL H 1 101 LYS QB . . 4.980 4.847 4.750 4.987 0.007 15 0 "[ . 1 . 2]" 1
598 1 83 GLN HA 1 86 LEU HB2 . . 4.390 3.151 2.890 3.380 . 0 0 "[ . 1 . 2]" 1
599 1 82 ALA MB 1 83 GLN HA . . 4.250 3.812 3.728 3.877 . 0 0 "[ . 1 . 2]" 1
600 1 82 ALA HA 1 83 GLN HA . . 5.060 4.621 4.530 4.688 . 0 0 "[ . 1 . 2]" 1
601 1 83 GLN HA 1 87 GLN H . . 4.980 4.006 3.797 4.233 . 0 0 "[ . 1 . 2]" 1
602 1 80 GLU HA 1 83 GLN QG . . 4.090 2.379 2.181 2.622 . 0 0 "[ . 1 . 2]" 1
603 1 23 GLN HG3 1 24 ILE H . . 4.680 4.542 4.274 4.711 0.031 6 0 "[ . 1 . 2]" 1
604 1 82 ALA HA 1 84 LYS H . . 5.160 4.358 4.075 4.525 . 0 0 "[ . 1 . 2]" 1
605 1 82 ALA HA 1 85 GLN H . . 4.170 3.578 3.391 3.693 . 0 0 "[ . 1 . 2]" 1
606 1 33 GLN QB 1 82 ALA MB . . 3.110 3.111 2.966 3.156 0.046 19 0 "[ . 1 . 2]" 1
607 1 78 VAL HA 1 82 ALA MB . . 4.480 4.041 3.960 4.160 . 0 0 "[ . 1 . 2]" 1
608 1 82 ALA MB 1 84 LYS H . . 4.750 4.494 4.220 4.683 . 0 0 "[ . 1 . 2]" 1
609 1 81 GLN H 1 82 ALA MB . . 4.340 4.238 4.079 4.345 0.005 4 0 "[ . 1 . 2]" 1
610 1 82 ALA H 1 82 ALA MB . . 2.920 2.244 2.196 2.270 . 0 0 "[ . 1 . 2]" 1
611 1 62 GLN QG 1 63 LEU HA . . 4.770 3.640 3.390 3.844 . 0 0 "[ . 1 . 2]" 1
612 1 78 VAL HA 1 81 GLN HG3 . . 4.260 3.241 3.039 3.463 . 0 0 "[ . 1 . 2]" 1
613 1 81 GLN H 1 81 GLN HG3 . . 3.560 3.320 3.190 3.476 . 0 0 "[ . 1 . 2]" 1
614 1 80 GLU H 1 81 GLN HG2 . . 5.120 4.233 4.096 4.609 . 0 0 "[ . 1 . 2]" 1
615 1 93 GLN QG 1 94 GLN H . . 5.400 4.193 3.735 4.491 . 0 0 "[ . 1 . 2]" 1
616 1 25 ARG HG3 1 28 GLN QB . . 4.460 2.057 1.909 2.183 . 0 0 "[ . 1 . 2]" 1
617 1 24 ILE MD 1 73 GLU HB3 . . 3.540 2.388 2.185 2.595 . 0 0 "[ . 1 . 2]" 1
618 1 26 ILE MD 1 27 GLN QB . . 4.090 2.726 2.519 3.037 . 0 0 "[ . 1 . 2]" 1
619 1 74 ALA HA 1 77 GLN HB3 . . 5.290 4.300 3.985 4.640 . 0 0 "[ . 1 . 2]" 1
620 1 77 GLN H 1 77 GLN HB3 . . 3.640 3.563 3.492 3.629 . 0 0 "[ . 1 . 2]" 1
621 1 101 LYS HA 1 103 ALA H . . 4.890 3.799 3.658 3.985 . 0 0 "[ . 1 . 2]" 1
622 1 80 GLU HG3 1 81 GLN H . . 4.970 4.470 4.024 4.974 0.004 3 0 "[ . 1 . 2]" 1
623 1 80 GLU HG2 1 81 GLN H . . 4.970 4.249 3.194 4.990 0.020 5 0 "[ . 1 . 2]" 1
624 1 80 GLU H 1 80 GLU HG2 . . 4.770 3.922 3.077 4.479 . 0 0 "[ . 1 . 2]" 1
625 1 80 GLU H 1 80 GLU HG3 . . 4.770 3.406 2.051 4.452 . 0 0 "[ . 1 . 2]" 1
626 1 80 GLU QB 1 82 ALA H . . 4.790 4.560 4.432 4.735 . 0 0 "[ . 1 . 2]" 1
627 1 7 ILE HA 1 9 PRO HD3 . . 4.090 2.493 2.325 2.731 . 0 0 "[ . 1 . 2]" 1
628 1 7 ILE HA 1 9 PRO HD2 . . 4.090 3.614 3.438 3.890 . 0 0 "[ . 1 . 2]" 1
629 1 10 ILE HB 1 11 CYS HA . . 5.500 4.641 4.467 4.748 . 0 0 "[ . 1 . 2]" 1
630 1 4 THR MG 1 11 CYS HA . . 5.350 4.283 4.032 4.529 . 0 0 "[ . 1 . 2]" 1
631 1 12 PHE H 1 13 PRO QD . . 5.490 4.375 4.228 4.433 . 0 0 "[ . 1 . 2]" 1
632 1 38 SER H 1 86 LEU MD2 . . 5.500 5.206 4.975 5.524 0.024 14 0 "[ . 1 . 2]" 1
633 1 41 TYR QD 1 43 LEU QD . . 5.500 5.359 5.145 5.507 0.007 16 0 "[ . 1 . 2]" 1
634 1 14 ASP HB2 1 15 GLY QA . . 5.500 5.147 4.991 5.406 . 0 0 "[ . 1 . 2]" 1
635 1 24 ILE HG13 1 66 VAL HB . . 5.500 4.728 4.467 5.078 . 0 0 "[ . 1 . 2]" 1
636 1 24 ILE HG12 1 66 VAL HB . . 5.500 4.489 4.216 4.663 . 0 0 "[ . 1 . 2]" 1
637 1 24 ILE HG12 1 77 GLN HG2 . . 5.500 5.281 4.643 5.570 0.070 7 0 "[ . 1 . 2]" 1
638 1 22 CYS HB2 1 24 ILE HG12 . . 5.500 4.839 4.466 5.408 . 0 0 "[ . 1 . 2]" 1
639 1 23 GLN HA 1 24 ILE HG13 . . 5.500 4.601 4.395 4.834 . 0 0 "[ . 1 . 2]" 1
640 1 24 ILE HB 1 28 GLN HG2 . . 5.090 4.875 4.710 5.000 . 0 0 "[ . 1 . 2]" 1
641 1 25 ARG HA 1 26 ILE HG12 . . 5.500 5.439 5.302 5.508 0.008 9 0 "[ . 1 . 2]" 1
642 1 25 ARG HA 1 26 ILE HG13 . . 5.500 3.876 3.721 4.051 . 0 0 "[ . 1 . 2]" 1
643 1 29 LEU QB 1 30 ASN HA . . 5.500 4.023 3.908 4.137 . 0 0 "[ . 1 . 2]" 1
644 1 31 HIS HB2 1 58 LEU HB2 . . 5.500 5.215 4.930 5.500 . 0 0 "[ . 1 . 2]" 1
645 1 32 CYS HB3 1 33 GLN QB . . 5.430 4.078 3.612 4.404 . 0 0 "[ . 1 . 2]" 1
646 1 4 THR HA 1 4 THR MG . . 3.310 2.377 2.315 2.412 . 0 0 "[ . 1 . 2]" 1
647 1 40 ASP HA 1 41 TYR H . . 3.150 2.485 1.838 2.702 . 0 0 "[ . 1 . 2]" 1
648 1 40 ASP HA 1 43 LEU QD . . 4.960 3.856 3.637 4.278 . 0 0 "[ . 1 . 2]" 1
649 1 41 TYR HA 1 42 LYS HA . . 5.430 4.531 4.479 4.661 . 0 0 "[ . 1 . 2]" 1
650 1 44 ARG HA 1 45 MET HA . . 5.310 4.515 4.430 4.620 . 0 0 "[ . 1 . 2]" 1
651 1 47 VAL H 1 47 VAL HB . . 3.870 2.641 2.517 2.809 . 0 0 "[ . 1 . 2]" 1
652 1 27 GLN QB 1 29 LEU H . . 5.500 4.938 4.810 5.206 . 0 0 "[ . 1 . 2]" 1
653 1 48 GLU HA 1 49 ASN HA . . 4.810 4.447 4.292 4.819 0.009 7 0 "[ . 1 . 2]" 1
654 1 54 GLN QG 1 55 HIS HA . . 3.540 3.237 2.968 3.451 . 0 0 "[ . 1 . 2]" 1
655 1 31 HIS HB3 1 58 LEU HB2 . . 4.460 4.455 4.293 4.560 0.100 16 0 "[ . 1 . 2]" 1
656 1 58 LEU HB3 1 58 LEU MD1 . . 3.470 2.399 2.346 2.457 . 0 0 "[ . 1 . 2]" 1
657 1 58 LEU HA 1 58 LEU MD1 . . 4.790 3.870 3.836 3.892 . 0 0 "[ . 1 . 2]" 1
658 1 58 LEU HB3 1 59 CYS HA . . 5.000 4.453 4.390 4.526 . 0 0 "[ . 1 . 2]" 1
659 1 59 CYS HA 1 62 GLN HA . . 5.350 5.358 5.250 5.424 0.074 6 0 "[ . 1 . 2]" 1
660 1 10 ILE HA 1 10 ILE HG12 . . 4.220 3.209 3.139 3.290 . 0 0 "[ . 1 . 2]" 1
661 1 62 GLN HA 1 65 GLU HB2 . . 4.380 3.789 3.465 4.061 . 0 0 "[ . 1 . 2]" 1
662 1 24 ILE MG 1 66 VAL HA . . 4.860 4.865 4.737 4.916 0.056 4 0 "[ . 1 . 2]" 1
663 1 67 GLU QG 1 70 CYS HB3 . . 5.500 5.367 4.866 5.513 0.013 3 0 "[ . 1 . 2]" 1
664 1 68 LYS HA 1 71 GLN HG3 . . 4.100 2.382 2.003 2.732 . 0 0 "[ . 1 . 2]" 1
665 1 81 GLN HG3 1 82 ALA MB . . 4.660 3.307 3.135 3.468 . 0 0 "[ . 1 . 2]" 1
666 1 70 CYS HA 1 71 GLN HB2 . . 5.450 5.419 5.307 5.474 0.024 13 0 "[ . 1 . 2]" 1
667 1 24 ILE MG 1 71 GLN HA . . 4.710 4.577 4.459 4.727 0.017 12 0 "[ . 1 . 2]" 1
668 1 71 GLN HG3 1 112 LEU MD1 . . 5.500 5.206 4.971 5.484 . 0 0 "[ . 1 . 2]" 1
669 1 71 GLN HG3 1 112 LEU MD2 . . 5.500 4.221 3.921 4.427 . 0 0 "[ . 1 . 2]" 1
670 1 72 CYS HB2 1 75 ILE HB . . 5.380 4.097 3.895 4.422 . 0 0 "[ . 1 . 2]" 1
671 1 72 CYS HB2 1 73 GLU HA . . 4.940 4.424 4.242 4.747 . 0 0 "[ . 1 . 2]" 1
672 1 72 CYS HB3 1 73 GLU HA . . 5.500 5.597 5.549 5.641 0.141 14 0 "[ . 1 . 2]" 1
673 1 32 CYS H 1 59 CYS HB3 . . 5.500 5.385 5.134 5.553 0.053 3 0 "[ . 1 . 2]" 1
674 1 70 CYS HA 1 73 GLU HA . . 5.270 4.661 4.510 4.859 . 0 0 "[ . 1 . 2]" 1
675 1 73 GLU HA 1 76 LYS H . . 3.600 3.327 3.130 3.551 . 0 0 "[ . 1 . 2]" 1
676 1 22 CYS HA 1 73 GLU HB2 . . 5.500 5.427 5.288 5.533 0.033 8 0 "[ . 1 . 2]" 1
677 1 74 ALA HA 1 77 GLN HG2 . . 4.650 3.377 2.730 3.989 . 0 0 "[ . 1 . 2]" 1
678 1 73 GLU HB3 1 74 ALA HA . . 4.530 4.551 4.485 4.590 0.060 19 0 "[ . 1 . 2]" 1
679 1 74 ALA HA 1 77 GLN HB2 . . 4.070 3.062 2.717 3.389 . 0 0 "[ . 1 . 2]" 1
680 1 74 ALA HA 1 76 LYS H . . 5.290 3.972 3.734 4.142 . 0 0 "[ . 1 . 2]" 1
681 1 74 ALA MB 1 77 GLN HG3 . . 4.490 3.745 3.428 3.982 . 0 0 "[ . 1 . 2]" 1
682 1 70 CYS HB3 1 74 ALA MB . . 4.650 4.448 4.328 4.566 . 0 0 "[ . 1 . 2]" 1
683 1 74 ALA MB 1 75 ILE HA . . 4.420 3.852 3.753 3.940 . 0 0 "[ . 1 . 2]" 1
684 1 72 CYS HA 1 74 ALA MB . . 4.850 4.231 4.081 4.409 . 0 0 "[ . 1 . 2]" 1
685 1 70 CYS HA 1 74 ALA MB . . 5.120 5.023 4.935 5.124 0.004 8 0 "[ . 1 . 2]" 1
686 1 74 ALA MB 1 76 LYS H . . 4.580 4.413 4.341 4.496 . 0 0 "[ . 1 . 2]" 1
687 1 24 ILE H 1 74 ALA MB . . 5.500 5.360 5.105 5.517 0.017 20 0 "[ . 1 . 2]" 1
688 1 75 ILE HA 1 77 GLN H . . 5.150 4.277 4.184 4.346 . 0 0 "[ . 1 . 2]" 1
689 1 75 ILE HG12 1 107 PRO HD3 . . 4.900 3.973 3.773 4.648 . 0 0 "[ . 1 . 2]" 1
690 1 76 LYS QB 1 77 GLN HG3 . . 4.570 4.017 3.542 4.477 . 0 0 "[ . 1 . 2]" 1
691 1 72 CYS HB2 1 76 LYS QG . . 4.800 4.570 4.336 4.807 0.007 17 0 "[ . 1 . 2]" 1
692 1 102 LYS HA 1 105 MET HG2 . . 4.510 3.974 3.630 4.480 . 0 0 "[ . 1 . 2]" 1
693 1 76 LYS QG 1 77 GLN HG3 . . 5.500 5.060 4.540 5.544 0.044 1 0 "[ . 1 . 2]" 1
694 1 24 ILE MD 1 77 GLN HG3 . . 4.100 2.452 2.052 2.798 . 0 0 "[ . 1 . 2]" 1
695 1 112 LEU MD2 1 113 GLN QG . . 5.130 4.345 4.070 4.608 . 0 0 "[ . 1 . 2]" 1
696 1 76 LYS H 1 77 GLN HG3 . . 4.250 4.112 3.699 4.438 0.188 17 0 "[ . 1 . 2]" 1
697 1 76 LYS H 1 77 GLN HG2 . . 4.370 3.897 3.119 4.473 0.103 3 0 "[ . 1 . 2]" 1
698 1 33 GLN H 1 78 VAL HB . . 5.480 5.556 5.530 5.576 0.096 11 0 "[ . 1 . 2]" 1
699 1 29 LEU HA 1 78 VAL MG1 . . 5.170 4.410 4.176 4.642 . 0 0 "[ . 1 . 2]" 1
700 1 82 ALA HA 1 86 LEU H . . 5.240 4.483 4.283 4.677 . 0 0 "[ . 1 . 2]" 1
701 1 37 THR MG 1 83 GLN HA . . 4.460 4.099 3.847 4.328 . 0 0 "[ . 1 . 2]" 1
702 1 94 GLN H 1 95 GLN HG3 . . 5.500 5.297 4.952 5.521 0.021 9 0 "[ . 1 . 2]" 1
703 1 39 PHE QE 1 96 VAL MG1 . . 5.020 3.730 3.445 4.149 . 0 0 "[ . 1 . 2]" 1
704 1 36 LEU HB3 1 99 MET QG . . 3.650 3.056 2.829 3.299 . 0 0 "[ . 1 . 2]" 1
705 1 36 LEU QD 1 100 VAL MG2 . . 3.640 2.897 2.293 3.235 . 0 0 "[ . 1 . 2]" 1
706 1 22 CYS HA 1 73 GLU HB3 . . 5.500 5.416 5.020 5.558 0.058 17 0 "[ . 1 . 2]" 1
707 1 25 ARG HA 1 28 GLN QB . . 5.500 5.521 5.454 5.573 0.073 12 0 "[ . 1 . 2]" 1
708 1 84 LYS QG 1 85 GLN QB . . 3.490 3.547 3.466 3.601 0.111 8 0 "[ . 1 . 2]" 1
709 1 107 PRO HB3 1 115 SER HA . . 5.400 4.228 3.406 4.966 . 0 0 "[ . 1 . 2]" 1
710 1 107 PRO HB3 1 112 LEU HB2 . . 5.340 2.494 2.259 2.661 . 0 0 "[ . 1 . 2]" 1
711 1 57 SER QB 1 58 LEU MD1 . . 5.460 4.384 4.204 4.576 . 0 0 "[ . 1 . 2]" 1
712 1 22 CYS HB2 1 24 ILE HG13 . . 5.500 4.416 4.022 4.940 . 0 0 "[ . 1 . 2]" 1
713 1 22 CYS HB3 1 24 ILE HG13 . . 4.680 3.165 2.991 3.362 . 0 0 "[ . 1 . 2]" 1
714 1 106 LEU HB3 1 107 PRO HD3 . . 4.310 3.126 2.393 3.582 . 0 0 "[ . 1 . 2]" 1
715 1 17 ASP HA 1 19 PRO QD . . 4.920 4.272 3.264 5.001 0.081 12 0 "[ . 1 . 2]" 1
716 1 106 LEU HA 1 109 GLN HB3 . . 4.850 4.298 4.014 4.651 . 0 0 "[ . 1 . 2]" 1
717 1 116 ILE HA 1 116 ILE MD . . 3.910 3.136 2.122 4.078 0.168 1 0 "[ . 1 . 2]" 1
718 1 114 CYS HB3 1 116 ILE MD . . 4.420 4.059 3.320 4.477 0.057 8 0 "[ . 1 . 2]" 1
719 1 116 ILE HB 1 116 ILE MD . . 3.250 2.808 2.393 3.259 0.009 17 0 "[ . 1 . 2]" 1
720 1 18 ASN HA 1 19 PRO QB . . 5.220 4.727 4.544 4.939 . 0 0 "[ . 1 . 2]" 1
721 1 7 ILE HA 1 7 ILE MG . . 3.690 2.467 2.405 2.511 . 0 0 "[ . 1 . 2]" 1
722 1 20 ARG HB3 1 20 ARG QG . . 2.730 2.158 2.139 2.172 . 0 0 "[ . 1 . 2]" 1
723 1 89 GLY HA3 1 91 GLY H . . 5.500 3.900 3.254 5.512 0.012 4 0 "[ . 1 . 2]" 1
724 1 89 GLY HA2 1 91 GLY H . . 5.500 4.888 4.374 5.430 . 0 0 "[ . 1 . 2]" 1
725 1 97 GLN HA 1 97 GLN HG2 . . 3.990 3.115 3.039 3.201 . 0 0 "[ . 1 . 2]" 1
726 1 97 GLN HA 1 97 GLN HG3 . . 3.990 2.562 2.452 2.646 . 0 0 "[ . 1 . 2]" 1
727 1 97 GLN HB3 1 99 MET H . . 4.760 4.771 4.662 4.806 0.046 14 0 "[ . 1 . 2]" 1
728 1 97 GLN HA 1 99 MET H . . 4.440 3.919 3.798 4.027 . 0 0 "[ . 1 . 2]" 1
729 1 75 ILE HG13 1 107 PRO HD3 . . 4.900 2.270 2.049 2.938 . 0 0 "[ . 1 . 2]" 1
730 1 1 GLY QA 1 2 ARG HB3 . . 5.500 5.297 5.215 5.406 . 0 0 "[ . 1 . 2]" 1
731 1 1 GLY QA 1 2 ARG HB2 . . 5.500 4.432 4.297 4.523 . 0 0 "[ . 1 . 2]" 1
732 1 2 ARG HB3 1 12 PHE QB . . 5.500 4.119 3.325 4.688 . 0 0 "[ . 1 . 2]" 1
733 1 2 ARG HA 1 3 CYS HB3 . . 5.500 5.457 4.793 5.571 0.071 2 0 "[ . 1 . 2]" 1
734 1 4 THR HA 1 5 LYS HA . . 4.750 4.337 4.232 4.383 . 0 0 "[ . 1 . 2]" 1
735 1 5 LYS HA 1 6 SER HA . . 5.080 4.287 4.229 4.331 . 0 0 "[ . 1 . 2]" 1
736 1 36 LEU HA 1 37 THR HA . . 5.500 4.515 4.438 4.576 . 0 0 "[ . 1 . 2]" 1
737 1 72 CYS HB3 1 113 GLN HA . . 5.500 5.530 5.390 5.612 0.112 4 0 "[ . 1 . 2]" 1
738 1 26 ILE MG 1 27 GLN QB . . 5.500 5.558 5.524 5.597 0.097 7 0 "[ . 1 . 2]" 1
739 1 23 GLN HA 1 24 ILE HB . . 5.500 4.696 4.491 4.901 . 0 0 "[ . 1 . 2]" 1
740 1 102 LYS HB3 1 102 LYS HE3 . . 5.500 2.290 2.053 4.738 . 0 0 "[ . 1 . 2]" 1
741 1 102 LYS HB3 1 102 LYS HE2 . . 5.500 3.784 3.642 4.463 . 0 0 "[ . 1 . 2]" 1
742 1 99 MET HA 1 102 LYS HE3 . . 5.060 4.578 3.443 4.983 . 0 0 "[ . 1 . 2]" 1
743 1 99 MET HA 1 102 LYS HE2 . . 5.060 4.179 2.031 4.684 . 0 0 "[ . 1 . 2]" 1
744 1 102 LYS H 1 102 LYS HE2 . . 5.500 5.522 4.181 5.626 0.126 14 0 "[ . 1 . 2]" 1
745 1 7 ILE HG12 1 7 ILE MG . . 3.750 2.769 2.192 3.218 . 0 0 "[ . 1 . 2]" 1
746 1 7 ILE HG13 1 7 ILE MG . . 3.750 2.724 2.390 3.215 . 0 0 "[ . 1 . 2]" 1
747 1 11 CYS HA 1 12 PHE HA . . 5.500 4.276 4.230 4.345 . 0 0 "[ . 1 . 2]" 1
748 1 10 ILE HA 1 11 CYS QB . . 5.010 4.395 3.979 4.552 . 0 0 "[ . 1 . 2]" 1
749 1 2 ARG HA 1 11 CYS QB . . 5.500 5.427 4.993 5.608 0.108 11 0 "[ . 1 . 2]" 1
750 1 12 PHE HA 1 12 PHE QD . . 4.350 2.654 2.107 2.993 . 0 0 "[ . 1 . 2]" 1
751 1 13 PRO HA 1 14 ASP HB2 . . 5.500 5.068 4.528 5.441 . 0 0 "[ . 1 . 2]" 1
752 1 13 PRO HA 1 14 ASP HB3 . . 5.500 5.382 4.732 5.596 0.096 12 0 "[ . 1 . 2]" 1
753 1 14 ASP HA 1 15 GLY QA . . 4.380 4.062 3.826 4.423 0.043 12 0 "[ . 1 . 2]" 1
754 1 60 CYS H 1 63 LEU MD2 . . 5.500 3.515 3.426 3.645 . 0 0 "[ . 1 . 2]" 1
755 1 26 ILE HB 1 28 GLN H . . 5.390 5.220 5.064 5.306 . 0 0 "[ . 1 . 2]" 1
756 1 26 ILE HA 1 27 GLN HA . . 4.750 4.637 4.505 4.695 . 0 0 "[ . 1 . 2]" 1
757 1 31 HIS HB3 1 35 HIS HD2 . . 5.500 5.022 3.436 5.568 0.068 4 0 "[ . 1 . 2]" 1
758 1 31 HIS HB3 1 58 LEU HB3 . . 5.360 4.835 4.225 5.252 . 0 0 "[ . 1 . 2]" 1
759 1 31 HIS HB2 1 58 LEU HB3 . . 5.500 5.072 4.588 5.363 . 0 0 "[ . 1 . 2]" 1
760 1 4 THR HB 1 6 SER H . . 4.570 4.063 3.812 4.354 . 0 0 "[ . 1 . 2]" 1
761 1 7 ILE HB 1 7 ILE MD . . 3.590 2.836 2.345 3.262 . 0 0 "[ . 1 . 2]" 1
762 1 7 ILE HA 1 7 ILE MD . . 3.880 2.896 2.103 3.852 . 0 0 "[ . 1 . 2]" 1
763 1 10 ILE HG13 1 10 ILE MG . . 3.450 2.362 2.317 2.396 . 0 0 "[ . 1 . 2]" 1
764 1 10 ILE HG12 1 10 ILE MG . . 3.450 3.210 3.205 3.215 . 0 0 "[ . 1 . 2]" 1
765 1 10 ILE HA 1 10 ILE MG . . 3.310 2.390 2.330 2.444 . 0 0 "[ . 1 . 2]" 1
766 1 10 ILE MG 1 11 CYS HA . . 4.780 3.957 3.851 4.084 . 0 0 "[ . 1 . 2]" 1
767 1 10 ILE MG 1 12 PHE QE . . 4.820 3.393 2.497 4.445 . 0 0 "[ . 1 . 2]" 1
768 1 10 ILE MG 1 12 PHE HA . . 5.500 4.490 4.060 4.906 . 0 0 "[ . 1 . 2]" 1
769 1 10 ILE MG 1 11 CYS H . . 3.650 3.042 2.803 3.250 . 0 0 "[ . 1 . 2]" 1
770 1 3 CYS HA 1 10 ILE MG . . 5.470 4.712 4.514 4.888 . 0 0 "[ . 1 . 2]" 1
771 1 10 ILE MG 1 11 CYS QB . . 4.830 4.669 4.530 4.804 . 0 0 "[ . 1 . 2]" 1
772 1 10 ILE MD 1 10 ILE MG . . 3.270 2.043 2.006 2.112 . 0 0 "[ . 1 . 2]" 1
773 1 10 ILE HB 1 10 ILE MD . . 3.600 3.243 3.219 3.258 . 0 0 "[ . 1 . 2]" 1
774 1 10 ILE HA 1 10 ILE MD . . 3.910 2.158 2.096 2.248 . 0 0 "[ . 1 . 2]" 1
775 1 10 ILE MD 1 11 CYS H . . 4.850 3.970 3.862 4.122 . 0 0 "[ . 1 . 2]" 1
776 1 16 LEU H 1 16 LEU HG . . 4.670 3.770 2.034 5.272 0.602 17 1 "[ . 1 . + 2]" 1
777 1 74 ALA HA 1 76 LYS QG . . 5.500 5.183 4.870 5.497 . 0 0 "[ . 1 . 2]" 1
778 1 24 ILE HB 1 74 ALA HA . . 5.460 2.756 2.470 2.997 . 0 0 "[ . 1 . 2]" 1
779 1 37 THR HB 1 38 SER QB . . 5.500 5.158 4.733 5.517 0.017 9 0 "[ . 1 . 2]" 1
780 1 37 THR HB 1 86 LEU MD2 . . 4.260 1.898 1.824 1.966 . 0 0 "[ . 1 . 2]" 1
781 1 37 THR HB 1 82 ALA MB . . 4.930 4.368 4.224 4.473 . 0 0 "[ . 1 . 2]" 1
782 1 37 THR HB 1 86 LEU HB3 . . 5.490 5.372 4.863 5.583 0.093 11 0 "[ . 1 . 2]" 1
783 1 37 THR HB 1 96 VAL HB . . 5.150 5.191 5.143 5.232 0.082 6 0 "[ . 1 . 2]" 1
784 1 37 THR HB 1 38 SER H . . 5.040 4.034 3.921 4.299 . 0 0 "[ . 1 . 2]" 1
785 1 37 THR HB 1 86 LEU H . . 5.500 5.481 5.321 5.552 0.052 2 0 "[ . 1 . 2]" 1
786 1 39 PHE HA 1 39 PHE QE . . 4.970 4.488 4.332 4.610 . 0 0 "[ . 1 . 2]" 1
787 1 40 ASP HB2 1 41 TYR QD . . 5.500 5.272 5.053 5.503 0.003 6 0 "[ . 1 . 2]" 1
788 1 41 TYR QE 1 42 LYS QE . . 5.180 4.950 3.976 5.255 0.075 1 0 "[ . 1 . 2]" 1
789 1 60 CYS HA 1 110 CYS HA . . 5.500 5.411 5.229 5.535 0.035 20 0 "[ . 1 . 2]" 1
790 1 41 TYR HB3 1 43 LEU QD . . 5.500 5.621 5.529 5.714 0.214 19 0 "[ . 1 . 2]" 1
791 1 61 ASN H 1 62 GLN HB3 . . 5.500 4.571 4.306 4.819 . 0 0 "[ . 1 . 2]" 1
792 1 66 VAL HA 1 70 CYS HB2 . . 5.500 4.893 4.751 5.102 . 0 0 "[ . 1 . 2]" 1
793 1 66 VAL HA 1 71 GLN HG3 . . 5.500 5.272 4.971 5.528 0.028 12 0 "[ . 1 . 2]" 1
794 1 67 GLU HB3 1 69 GLN H . . 5.070 2.773 2.527 2.943 . 0 0 "[ . 1 . 2]" 1
795 1 67 GLU HA 1 68 LYS HA . . 4.550 4.244 4.117 4.317 . 0 0 "[ . 1 . 2]" 1
796 1 67 GLU HA 1 68 LYS HB3 . . 4.880 4.590 4.399 4.753 . 0 0 "[ . 1 . 2]" 1
797 1 22 CYS HB2 1 70 CYS HA . . 5.270 3.147 2.740 3.562 . 0 0 "[ . 1 . 2]" 1
798 1 67 GLU HB3 1 70 CYS HB2 . . 5.420 3.609 2.902 3.779 . 0 0 "[ . 1 . 2]" 1
799 1 67 GLU HB2 1 70 CYS HB2 . . 5.290 2.294 2.044 2.609 . 0 0 "[ . 1 . 2]" 1
800 1 63 LEU HA 1 71 GLN HA . . 4.940 4.303 4.116 4.529 . 0 0 "[ . 1 . 2]" 1
801 1 76 LYS HA 1 77 GLN HA . . 5.500 4.850 4.778 4.925 . 0 0 "[ . 1 . 2]" 1
802 1 72 CYS HB3 1 114 CYS H . . 4.720 3.806 3.579 3.990 . 0 0 "[ . 1 . 2]" 1
803 1 72 CYS HB2 1 114 CYS H . . 5.500 4.606 4.342 4.750 . 0 0 "[ . 1 . 2]" 1
804 1 77 GLN HA 1 78 VAL HA . . 5.010 4.844 4.757 4.918 . 0 0 "[ . 1 . 2]" 1
805 1 98 GLN HA 1 99 MET HB2 . . 5.500 5.383 5.291 5.458 . 0 0 "[ . 1 . 2]" 1
806 1 107 PRO HA 1 111 ASN HA . . 5.300 5.001 4.800 5.281 . 0 0 "[ . 1 . 2]" 1
807 1 36 LEU HA 1 36 LEU QD . . 3.450 2.027 1.982 2.097 . 0 0 "[ . 1 . 2]" 1
808 1 36 LEU HG 1 100 VAL HA . . 4.670 4.544 4.283 4.672 0.002 9 0 "[ . 1 . 2]" 1
809 1 36 LEU HG 1 99 MET HB3 . . 5.500 5.534 5.458 5.591 0.091 6 0 "[ . 1 . 2]" 1
810 1 86 LEU HG 1 96 VAL HB . . 3.920 3.542 3.091 3.968 0.048 18 0 "[ . 1 . 2]" 1
811 1 86 LEU HG 1 92 GLY HA3 . . 4.600 3.279 2.582 3.881 . 0 0 "[ . 1 . 2]" 1
812 1 86 LEU HG 1 93 GLN HA . . 5.300 4.332 3.590 5.034 . 0 0 "[ . 1 . 2]" 1
813 1 36 LEU HG 1 37 THR H . . 5.200 4.538 4.382 4.647 . 0 0 "[ . 1 . 2]" 1
814 1 36 LEU HB3 1 99 MET HA . . 4.970 4.689 4.442 4.932 . 0 0 "[ . 1 . 2]" 1
815 1 34 MET H 1 36 LEU HB2 . . 5.500 5.469 5.348 5.519 0.019 16 0 "[ . 1 . 2]" 1
816 1 63 LEU HB2 1 112 LEU MD1 . . 4.310 3.934 3.820 4.036 . 0 0 "[ . 1 . 2]" 1
817 1 63 LEU HB3 1 71 GLN HG2 . . 5.500 5.505 5.254 5.592 0.092 19 0 "[ . 1 . 2]" 1
818 1 63 LEU HB2 1 71 GLN HG2 . . 5.230 4.083 3.794 4.174 . 0 0 "[ . 1 . 2]" 1
819 1 60 CYS HA 1 63 LEU HB2 . . 5.500 4.734 4.645 4.877 . 0 0 "[ . 1 . 2]" 1
820 1 60 CYS HA 1 63 LEU HG . . 4.240 2.166 2.039 2.296 . 0 0 "[ . 1 . 2]" 1
821 1 63 LEU H 1 63 LEU HG . . 4.240 2.362 2.313 2.436 . 0 0 "[ . 1 . 2]" 1
822 1 86 LEU HG 1 96 VAL MG2 . . 4.010 1.928 1.842 2.117 . 0 0 "[ . 1 . 2]" 1
823 1 86 LEU HA 1 86 LEU MD1 . . 4.320 2.039 1.969 2.173 . 0 0 "[ . 1 . 2]" 1
824 1 86 LEU HB3 1 93 GLN QB . . 5.500 4.521 4.125 4.977 . 0 0 "[ . 1 . 2]" 1
825 1 86 LEU HB3 1 96 VAL HB . . 5.500 4.595 4.273 4.874 . 0 0 "[ . 1 . 2]" 1
826 1 83 GLN HA 1 86 LEU HB3 . . 5.310 4.479 4.140 4.632 . 0 0 "[ . 1 . 2]" 1
827 1 102 LYS HB2 1 102 LYS HE2 . . 5.500 3.760 3.672 3.948 . 0 0 "[ . 1 . 2]" 1
828 1 102 LYS HA 1 105 MET HG3 . . 4.510 2.379 2.000 2.783 . 0 0 "[ . 1 . 2]" 1
829 1 102 LYS HB2 1 102 LYS HE3 . . 5.500 2.610 2.363 4.458 . 0 0 "[ . 1 . 2]" 1
830 1 58 LEU HA 1 58 LEU HG . . 4.040 3.161 3.015 3.257 . 0 0 "[ . 1 . 2]" 1
831 1 31 HIS HE1 1 58 LEU HG . . 5.430 5.031 4.702 5.431 0.001 3 0 "[ . 1 . 2]" 1
832 1 58 LEU HB3 1 58 LEU MD2 . . 3.470 2.372 2.318 2.420 . 0 0 "[ . 1 . 2]" 1
833 1 58 LEU HA 1 58 LEU MD2 . . 4.790 2.107 2.009 2.161 . 0 0 "[ . 1 . 2]" 1
834 1 55 HIS HA 1 58 LEU MD2 . . 4.740 4.472 4.064 4.767 0.027 16 0 "[ . 1 . 2]" 1
835 1 58 LEU H 1 58 LEU MD2 . . 4.150 3.231 3.045 3.471 . 0 0 "[ . 1 . 2]" 1
836 1 7 ILE HA 1 8 PRO HA . . 2.900 2.020 1.947 2.088 . 0 0 "[ . 1 . 2]" 1
837 1 7 ILE HG13 1 8 PRO HA . . 5.370 4.898 3.782 5.359 . 0 0 "[ . 1 . 2]" 1
838 1 7 ILE HG12 1 8 PRO HA . . 5.370 4.493 3.754 4.973 . 0 0 "[ . 1 . 2]" 1
839 1 8 PRO HA 1 9 PRO HG2 . . 4.950 4.460 4.386 4.577 . 0 0 "[ . 1 . 2]" 1
840 1 8 PRO HA 1 9 PRO HD2 . . 3.130 2.335 2.219 2.508 . 0 0 "[ . 1 . 2]" 1
841 1 8 PRO HA 1 9 PRO HD3 . . 3.130 2.304 2.162 2.434 . 0 0 "[ . 1 . 2]" 1
842 1 75 ILE HB 1 106 LEU HB2 . . 5.050 4.944 4.654 5.088 0.038 8 0 "[ . 1 . 2]" 1
843 1 106 LEU HA 1 106 LEU HG . . 3.820 3.056 2.525 3.696 . 0 0 "[ . 1 . 2]" 1
844 1 106 LEU HA 1 109 GLN HB2 . . 3.950 2.601 2.320 2.921 . 0 0 "[ . 1 . 2]" 1
845 1 106 LEU H 1 106 LEU HG . . 4.430 3.468 2.253 4.434 0.004 1 0 "[ . 1 . 2]" 1
846 1 106 LEU HA 1 110 CYS H . . 5.230 3.474 3.162 3.744 . 0 0 "[ . 1 . 2]" 1
847 1 12 PHE QB 1 16 LEU QB . . 5.500 7.155 3.170 9.299 3.799 17 17 "[****** * **-****+**2]" 1
848 1 2 ARG HB2 1 12 PHE QB . . 5.500 2.666 1.953 3.174 . 0 0 "[ . 1 . 2]" 1
849 1 1 GLY QA 1 12 PHE QB . . 5.230 4.289 3.254 4.953 . 0 0 "[ . 1 . 2]" 1
850 1 41 TYR HB2 1 42 LYS HA . . 5.500 4.459 4.293 4.795 . 0 0 "[ . 1 . 2]" 1
851 1 95 GLN HB2 1 95 GLN HG3 . . 2.400 2.389 2.349 2.421 0.021 6 0 "[ . 1 . 2]" 1
852 1 33 GLN QB 1 33 GLN HG2 . . 2.660 2.321 2.258 2.382 . 0 0 "[ . 1 . 2]" 1
853 1 41 TYR HB3 1 42 LYS HB3 . . 5.500 5.572 5.506 5.625 0.125 1 0 "[ . 1 . 2]" 1
854 1 104 GLN HA 1 116 ILE HG12 . . 4.580 4.158 3.016 4.711 0.131 6 0 "[ . 1 . 2]" 1
855 1 104 GLN HA 1 116 ILE MD . . 4.470 2.885 1.942 4.401 . 0 0 "[ . 1 . 2]" 1
856 1 104 GLN HA 1 116 ILE HB . . 4.620 3.390 2.411 4.281 . 0 0 "[ . 1 . 2]" 1
857 1 116 ILE H 1 116 ILE MD . . 4.190 3.711 3.259 4.043 . 0 0 "[ . 1 . 2]" 1
858 1 111 ASN HA 1 112 LEU MD2 . . 4.960 4.513 4.291 4.812 . 0 0 "[ . 1 . 2]" 1
859 1 111 ASN HB2 1 112 LEU MD2 . . 5.500 5.339 5.110 5.513 0.013 14 0 "[ . 1 . 2]" 1
860 1 111 ASN HB3 1 112 LEU MD2 . . 5.500 4.304 3.977 4.528 . 0 0 "[ . 1 . 2]" 1
861 1 108 ASN HA 1 109 GLN HA . . 4.810 4.745 4.660 4.839 0.029 1 0 "[ . 1 . 2]" 1
862 1 104 GLN H 1 104 GLN HB3 . . 3.750 3.585 3.536 3.611 . 0 0 "[ . 1 . 2]" 1
863 1 36 LEU HA 1 102 LYS HE2 . . 5.500 5.187 4.977 5.518 0.018 8 0 "[ . 1 . 2]" 1
864 1 36 LEU HA 1 102 LYS HE3 . . 5.500 5.464 5.294 5.539 0.039 12 0 "[ . 1 . 2]" 1
865 1 95 GLN HA 1 95 GLN HB2 . . 2.790 2.465 2.422 2.516 . 0 0 "[ . 1 . 2]" 1
866 1 98 GLN HA 1 101 LYS HG2 . . 4.320 2.371 2.131 2.639 . 0 0 "[ . 1 . 2]" 1
867 1 98 GLN HA 1 101 LYS HG3 . . 4.320 3.018 2.538 4.123 . 0 0 "[ . 1 . 2]" 1
868 1 101 LYS QD 1 102 LYS HA . . 4.010 2.987 2.576 4.064 0.054 14 0 "[ . 1 . 2]" 1
869 1 36 LEU HB3 1 99 MET HB3 . . 5.500 2.968 2.912 3.014 . 0 0 "[ . 1 . 2]" 1
870 1 92 GLY HA2 1 95 GLN HG3 . . 4.260 3.152 2.599 3.415 . 0 0 "[ . 1 . 2]" 1
871 1 91 GLY HA3 1 94 GLN QG . . 5.270 4.821 4.321 5.232 . 0 0 "[ . 1 . 2]" 1
872 1 92 GLY HA3 1 94 GLN QG . . 5.500 4.865 4.437 5.079 . 0 0 "[ . 1 . 2]" 1
873 1 91 GLY HA2 1 93 GLN QG . . 5.500 3.809 2.708 4.640 . 0 0 "[ . 1 . 2]" 1
874 1 91 GLY HA2 1 94 GLN QG . . 5.500 5.468 5.308 5.561 0.061 18 0 "[ . 1 . 2]" 1
875 1 82 ALA HA 1 85 GLN HG2 . . 4.430 2.189 1.955 2.489 . 0 0 "[ . 1 . 2]" 1
876 1 86 LEU HB3 1 87 GLN H . . 4.330 3.404 3.236 3.562 . 0 0 "[ . 1 . 2]" 1
877 1 81 GLN HA 1 81 GLN HG2 . . 3.980 3.740 3.688 3.808 . 0 0 "[ . 1 . 2]" 1
878 1 53 GLN H 1 53 GLN QG . . 3.850 2.426 2.053 3.531 . 0 0 "[ . 1 . 2]" 1
879 1 75 ILE HB 1 75 ILE MD . . 3.610 3.230 3.213 3.251 . 0 0 "[ . 1 . 2]" 1
880 1 75 ILE MD 1 107 PRO HD3 . . 4.220 3.249 2.754 3.723 . 0 0 "[ . 1 . 2]" 1
881 1 72 CYS HA 1 75 ILE MD . . 3.750 3.323 3.167 3.445 . 0 0 "[ . 1 . 2]" 1
882 1 73 GLU HB2 1 74 ALA MB . . 4.640 4.095 3.937 4.180 . 0 0 "[ . 1 . 2]" 1
883 1 74 ALA MB 1 77 GLN HB2 . . 5.090 4.002 3.741 4.287 . 0 0 "[ . 1 . 2]" 1
884 1 74 ALA MB 1 75 ILE MD . . 3.080 2.891 2.708 3.043 . 0 0 "[ . 1 . 2]" 1
885 1 58 LEU MD2 1 59 CYS H . . 4.710 4.553 4.490 4.614 . 0 0 "[ . 1 . 2]" 1
886 1 56 LEU HA 1 57 SER QB . . 5.450 5.400 5.127 5.454 0.004 3 0 "[ . 1 . 2]" 1
887 1 53 GLN H 1 54 GLN QB . . 5.350 4.423 3.850 4.668 . 0 0 "[ . 1 . 2]" 1
888 1 48 GLU H 1 48 GLU HB3 . . 4.050 3.699 3.304 3.892 . 0 0 "[ . 1 . 2]" 1
889 1 86 LEU HB3 1 96 VAL MG2 . . 4.010 3.736 3.679 3.794 . 0 0 "[ . 1 . 2]" 1
890 1 20 ARG QD 1 21 GLY H . . 5.120 3.234 3.041 3.486 . 0 0 "[ . 1 . 2]" 1
891 1 51 LYS H 1 51 LYS QE . . 5.500 4.344 3.317 4.714 . 0 0 "[ . 1 . 2]" 1
892 1 42 LYS QE 1 43 LEU HA . . 5.370 4.689 4.315 5.118 . 0 0 "[ . 1 . 2]" 1
893 1 42 LYS QG 1 43 LEU HA . . 5.180 3.798 3.542 4.098 . 0 0 "[ . 1 . 2]" 1
894 1 37 THR HA 1 38 SER QB . . 5.500 5.238 4.961 5.411 . 0 0 "[ . 1 . 2]" 1
895 1 37 THR MG 1 38 SER QB . . 5.500 5.360 5.070 5.575 0.075 19 0 "[ . 1 . 2]" 1
896 1 36 LEU QD 1 37 THR MG . . 4.340 4.207 3.906 4.397 0.057 6 0 "[ . 1 . 2]" 1
897 1 35 HIS HA 1 36 LEU QD . . 5.490 4.957 4.809 5.103 . 0 0 "[ . 1 . 2]" 1
898 1 35 HIS HB3 1 36 LEU HG . . 5.500 4.008 3.167 5.269 . 0 0 "[ . 1 . 2]" 1
899 1 35 HIS HB3 1 36 LEU QD . . 5.500 3.965 3.395 5.196 . 0 0 "[ . 1 . 2]" 1
900 1 35 HIS HB2 1 36 LEU HG . . 5.500 4.748 3.902 5.337 . 0 0 "[ . 1 . 2]" 1
901 1 35 HIS HB2 1 36 LEU QD . . 5.500 4.664 4.091 4.971 . 0 0 "[ . 1 . 2]" 1
902 1 87 GLN H 1 87 GLN QB . . 3.310 2.195 2.139 2.235 . 0 0 "[ . 1 . 2]" 1
903 1 32 CYS H 1 32 CYS HB3 . . 3.810 3.226 2.790 3.461 . 0 0 "[ . 1 . 2]" 1
904 1 32 CYS H 1 32 CYS HB2 . . 3.320 2.073 2.003 2.144 . 0 0 "[ . 1 . 2]" 1
905 1 39 PHE QE 1 95 GLN HB3 . . 5.240 4.706 4.256 5.195 . 0 0 "[ . 1 . 2]" 1
906 1 39 PHE QE 1 95 GLN HA . . 5.180 4.658 4.273 5.000 . 0 0 "[ . 1 . 2]" 1
907 1 39 PHE QE 1 95 GLN HG2 . . 4.400 4.000 3.674 4.276 . 0 0 "[ . 1 . 2]" 1
908 1 39 PHE QE 1 95 GLN HG3 . . 4.320 2.285 1.985 2.623 . 0 0 "[ . 1 . 2]" 1
909 1 85 GLN QB 1 88 GLN H . . 5.430 5.213 5.008 5.453 0.023 18 0 "[ . 1 . 2]" 1
910 1 86 LEU HB3 1 92 GLY HA3 . . 5.040 3.269 2.597 4.065 . 0 0 "[ . 1 . 2]" 1
911 1 86 LEU MD1 1 92 GLY HA3 . . 4.220 1.975 1.825 2.138 . 0 0 "[ . 1 . 2]" 1
912 1 81 GLN HG2 1 82 ALA HA . . 4.840 4.785 4.493 4.876 0.036 10 0 "[ . 1 . 2]" 1
913 1 82 ALA HA 1 85 GLN QB . . 3.550 3.598 3.501 3.646 0.096 9 0 "[ . 1 . 2]" 1
914 1 33 GLN HG3 1 82 ALA MB . . 3.890 2.245 2.109 2.539 . 0 0 "[ . 1 . 2]" 1
915 1 81 GLN HG2 1 82 ALA MB . . 4.000 3.900 3.530 4.011 0.011 9 0 "[ . 1 . 2]" 1
916 1 33 GLN QB 1 78 VAL HA . . 3.760 3.213 3.099 3.361 . 0 0 "[ . 1 . 2]" 1
917 1 29 LEU HG 1 78 VAL MG1 . . 3.970 4.001 3.921 4.031 0.061 20 0 "[ . 1 . 2]" 1
918 1 78 VAL MG2 1 81 GLN HG2 . . 4.630 4.452 4.368 4.540 . 0 0 "[ . 1 . 2]" 1
919 1 76 LYS QB 1 77 GLN HA . . 4.050 3.720 3.594 3.810 . 0 0 "[ . 1 . 2]" 1
920 1 75 ILE HB 1 76 LYS HA . . 4.470 4.024 3.877 4.152 . 0 0 "[ . 1 . 2]" 1
921 1 75 ILE MD 1 106 LEU HB3 . . 3.620 2.318 2.101 2.541 . 0 0 "[ . 1 . 2]" 1
922 1 75 ILE MG 1 106 LEU HB3 . . 3.660 3.206 2.316 3.673 0.013 20 0 "[ . 1 . 2]" 1
923 1 75 ILE HA 1 76 LYS HA . . 5.240 4.771 4.715 4.851 . 0 0 "[ . 1 . 2]" 1
924 1 71 GLN HA 1 75 ILE MD . . 4.730 4.766 4.684 4.818 0.088 8 0 "[ . 1 . 2]" 1
925 1 24 ILE HG13 1 74 ALA MB . . 4.420 3.532 3.409 3.659 . 0 0 "[ . 1 . 2]" 1
926 1 63 LEU HB2 1 74 ALA MB . . 4.290 2.522 2.388 2.727 . 0 0 "[ . 1 . 2]" 1
927 1 59 CYS HB3 1 62 GLN HB3 . . 5.500 5.427 5.237 5.537 0.037 2 0 "[ . 1 . 2]" 1
928 1 70 CYS HB2 1 71 GLN HA . . 4.520 4.445 4.349 4.525 0.005 10 0 "[ . 1 . 2]" 1
929 1 70 CYS HB2 1 71 GLN HB2 . . 5.500 5.515 5.479 5.552 0.052 10 0 "[ . 1 . 2]" 1
930 1 70 CYS HB2 1 71 GLN HG3 . . 4.810 4.271 4.170 4.447 . 0 0 "[ . 1 . 2]" 1
931 1 69 GLN HA 1 70 CYS HA . . 5.230 4.599 4.503 4.654 . 0 0 "[ . 1 . 2]" 1
932 1 68 LYS HA 1 71 GLN HG2 . . 4.450 3.827 3.505 4.206 . 0 0 "[ . 1 . 2]" 1
933 1 68 LYS H 1 68 LYS HG3 . . 4.170 3.333 3.084 3.636 . 0 0 "[ . 1 . 2]" 1
934 1 66 VAL MG1 1 67 GLU HA . . 5.500 4.082 4.031 4.170 . 0 0 "[ . 1 . 2]" 1
935 1 66 VAL MG1 1 67 GLU HB2 . . 5.500 2.811 2.670 2.900 . 0 0 "[ . 1 . 2]" 1
936 1 66 VAL MG1 1 67 GLU HB3 . . 5.500 4.225 3.700 4.342 . 0 0 "[ . 1 . 2]" 1
937 1 65 GLU HB3 1 66 VAL HA . . 4.980 4.732 4.525 4.892 . 0 0 "[ . 1 . 2]" 1
938 1 63 LEU H 1 64 GLN QG . . 5.500 4.019 3.947 4.177 . 0 0 "[ . 1 . 2]" 1
939 1 64 GLN HA 1 71 GLN HB3 . . 4.200 3.598 3.408 3.923 . 0 0 "[ . 1 . 2]" 1
940 1 64 GLN HA 1 64 GLN QB . . 2.760 2.173 2.159 2.185 . 0 0 "[ . 1 . 2]" 1
941 1 63 LEU MD2 1 64 GLN QG . . 5.010 5.092 5.040 5.133 0.123 4 0 "[ . 1 . 2]" 1
942 1 63 LEU HB3 1 64 GLN QB . . 5.500 5.533 5.521 5.545 0.045 19 0 "[ . 1 . 2]" 1
943 1 63 LEU HG 1 64 GLN QB . . 3.950 3.348 3.297 3.459 . 0 0 "[ . 1 . 2]" 1
944 1 62 GLN HB3 1 63 LEU HA . . 4.910 4.276 4.096 4.416 . 0 0 "[ . 1 . 2]" 1
945 1 58 LEU HB2 1 59 CYS HA . . 5.500 4.109 3.996 4.334 . 0 0 "[ . 1 . 2]" 1
946 1 58 LEU HB2 1 59 CYS HB3 . . 5.500 4.656 4.465 4.845 . 0 0 "[ . 1 . 2]" 1
947 1 57 SER QB 1 58 LEU HA . . 4.180 4.039 3.915 4.207 0.027 17 0 "[ . 1 . 2]" 1
948 1 57 SER QB 1 58 LEU MD2 . . 5.460 3.254 2.943 3.631 . 0 0 "[ . 1 . 2]" 1
949 1 57 SER QB 1 58 LEU HB2 . . 5.500 4.807 4.650 4.967 . 0 0 "[ . 1 . 2]" 1
950 1 57 SER QB 1 58 LEU HG . . 4.800 3.069 2.842 3.281 . 0 0 "[ . 1 . 2]" 1
951 1 57 SER H 1 58 LEU HB2 . . 5.500 5.020 4.825 5.145 . 0 0 "[ . 1 . 2]" 1
952 1 55 HIS HA 1 56 LEU HA . . 5.290 4.643 4.607 4.700 . 0 0 "[ . 1 . 2]" 1
953 1 55 HIS HA 1 59 CYS HB2 . . 5.500 4.635 4.347 5.509 0.009 2 0 "[ . 1 . 2]" 1
954 1 23 GLN HA 1 23 GLN HG2 . . 3.760 3.719 3.653 3.778 0.018 10 0 "[ . 1 . 2]" 1
955 1 51 LYS QB 1 52 GLN QG . . 3.940 3.566 3.199 3.940 0.000 12 0 "[ . 1 . 2]" 1
956 1 51 LYS QE 1 52 GLN HA . . 5.500 5.523 5.200 5.591 0.091 19 0 "[ . 1 . 2]" 1
957 1 51 LYS HA 1 54 GLN QB . . 3.890 3.285 2.110 3.922 0.032 12 0 "[ . 1 . 2]" 1
958 1 51 LYS QB 1 54 GLN QB . . 4.000 3.975 3.734 4.095 0.095 8 0 "[ . 1 . 2]" 1
959 1 47 VAL HB 1 48 GLU QG . . 4.410 3.272 2.435 3.982 . 0 0 "[ . 1 . 2]" 1
960 1 46 ALA HA 1 47 VAL HB . . 5.500 4.950 4.643 5.512 0.012 8 0 "[ . 1 . 2]" 1
961 1 33 GLN QB 1 34 MET HA . . 4.580 4.250 4.152 4.394 . 0 0 "[ . 1 . 2]" 1
962 1 33 GLN HA 1 33 GLN HG2 . . 3.850 3.109 2.984 3.245 . 0 0 "[ . 1 . 2]" 1
963 1 30 ASN HA 1 31 HIS HA . . 4.990 4.726 4.673 4.765 . 0 0 "[ . 1 . 2]" 1
964 1 28 GLN HG2 1 29 LEU HA . . 5.500 4.726 4.446 4.983 . 0 0 "[ . 1 . 2]" 1
965 1 26 ILE HA 1 27 GLN QG . . 5.310 4.969 4.755 5.360 0.050 1 0 "[ . 1 . 2]" 1
966 1 26 ILE MD 1 27 GLN QG . . 4.420 3.865 3.562 4.157 . 0 0 "[ . 1 . 2]" 1
967 1 25 ARG QB 1 26 ILE MD . . 5.490 4.641 4.334 4.976 . 0 0 "[ . 1 . 2]" 1
968 1 25 ARG HA 1 26 ILE MD . . 5.500 4.846 4.544 5.152 . 0 0 "[ . 1 . 2]" 1
969 1 20 ARG HB2 1 20 ARG QG . . 2.730 2.409 2.366 2.471 . 0 0 "[ . 1 . 2]" 1
970 1 24 ILE HA 1 25 ARG QB . . 4.800 4.354 4.141 4.438 . 0 0 "[ . 1 . 2]" 1
971 1 24 ILE HA 1 25 ARG QD . . 5.500 5.479 5.233 5.612 0.112 11 0 "[ . 1 . 2]" 1
972 1 23 GLN H 1 24 ILE MD . . 4.420 3.627 3.408 3.810 . 0 0 "[ . 1 . 2]" 1
973 1 24 ILE HG13 1 25 ARG H . . 5.460 4.566 4.349 4.708 . 0 0 "[ . 1 . 2]" 1
974 1 23 GLN HA 1 24 ILE MG . . 5.500 5.405 5.331 5.500 . 0 0 "[ . 1 . 2]" 1
975 1 24 ILE MD 1 73 GLU HB2 . . 3.860 2.032 1.900 2.139 . 0 0 "[ . 1 . 2]" 1
976 1 24 ILE MG 1 73 GLU HB2 . . 5.020 5.052 4.924 5.116 0.096 19 0 "[ . 1 . 2]" 1
977 1 23 GLN HA 1 24 ILE HA . . 4.550 4.310 4.281 4.363 . 0 0 "[ . 1 . 2]" 1
978 1 23 GLN HG3 1 24 ILE HA . . 4.720 4.384 4.047 4.619 . 0 0 "[ . 1 . 2]" 1
979 1 23 GLN QB 1 24 ILE MD . . 5.010 4.248 4.049 4.450 . 0 0 "[ . 1 . 2]" 1
980 1 21 GLY HA2 1 22 CYS HA . . 5.020 4.563 4.339 4.665 . 0 0 "[ . 1 . 2]" 1
981 1 22 CYS HB2 1 73 GLU H . . 5.500 4.917 4.566 5.345 . 0 0 "[ . 1 . 2]" 1
982 1 22 CYS HB3 1 73 GLU H . . 5.500 5.420 5.060 5.569 0.069 11 0 "[ . 1 . 2]" 1
983 1 1 GLY QA 1 2 ARG QD . . 5.500 4.871 3.794 5.540 0.040 17 0 "[ . 1 . 2]" 1
984 1 20 ARG QD 1 21 GLY HA2 . . 5.500 5.441 5.188 5.626 0.126 6 0 "[ . 1 . 2]" 1
985 1 20 ARG QD 1 21 GLY HA3 . . 5.500 5.494 4.983 5.641 0.141 19 0 "[ . 1 . 2]" 1
986 1 19 PRO QD 1 21 GLY H . . 4.600 3.692 2.728 4.552 . 0 0 "[ . 1 . 2]" 1
987 1 19 PRO HA 1 21 GLY H . . 5.460 5.065 4.117 5.577 0.117 6 0 "[ . 1 . 2]" 1
988 1 15 GLY H 1 16 LEU HA . . 5.000 4.489 3.903 5.278 0.278 12 0 "[ . 1 . 2]" 1
989 1 15 GLY H 1 16 LEU QB . . 4.720 4.734 3.569 5.355 0.635 20 2 "[ . 1- . +]" 1
990 1 15 GLY QA 1 16 LEU MD1 . . 5.500 4.967 2.573 5.596 0.096 10 0 "[ . 1 . 2]" 1
991 1 15 GLY QA 1 16 LEU QB . . 4.590 3.947 3.355 4.522 . 0 0 "[ . 1 . 2]" 1
992 1 49 ASN HA 1 50 PRO QB . . 5.500 4.746 4.598 4.877 . 0 0 "[ . 1 . 2]" 1
993 1 12 PHE QD 1 13 PRO QD . . 4.720 2.444 2.278 2.568 . 0 0 "[ . 1 . 2]" 1
994 1 9 PRO HA 1 10 ILE HB . . 5.010 4.649 4.532 4.828 . 0 0 "[ . 1 . 2]" 1
995 1 9 PRO HA 1 10 ILE MD . . 4.340 4.122 3.926 4.265 . 0 0 "[ . 1 . 2]" 1
996 1 61 ASN HB3 1 62 GLN HA . . 5.320 4.322 4.201 4.412 . 0 0 "[ . 1 . 2]" 1
997 1 9 PRO QB 1 10 ILE MG . . 5.500 5.444 5.326 5.551 0.051 17 0 "[ . 1 . 2]" 1
998 1 9 PRO HG2 1 10 ILE MD . . 5.500 5.470 5.202 5.535 0.035 4 0 "[ . 1 . 2]" 1
999 1 8 PRO HA 1 9 PRO QB . . 4.680 4.572 4.483 4.659 . 0 0 "[ . 1 . 2]" 1
1000 1 8 PRO HB3 1 9 PRO HD2 . . 4.410 2.974 2.579 3.338 . 0 0 "[ . 1 . 2]" 1
1001 1 7 ILE HA 1 8 PRO HB2 . . 5.280 4.428 4.355 4.537 . 0 0 "[ . 1 . 2]" 1
1002 1 7 ILE HA 1 8 PRO HB3 . . 4.210 4.230 4.210 4.251 0.041 5 0 "[ . 1 . 2]" 1
1003 1 7 ILE MG 1 8 PRO HA . . 3.580 2.541 2.242 2.840 . 0 0 "[ . 1 . 2]" 1
1004 1 7 ILE MG 1 8 PRO HD2 . . 4.870 4.379 4.168 4.542 . 0 0 "[ . 1 . 2]" 1
1005 1 7 ILE MG 1 8 PRO HD3 . . 4.870 3.434 3.243 3.571 . 0 0 "[ . 1 . 2]" 1
1006 1 7 ILE MG 1 8 PRO HG2 . . 5.300 4.985 4.723 5.249 . 0 0 "[ . 1 . 2]" 1
1007 1 7 ILE MG 1 8 PRO HG3 . . 5.300 4.178 3.446 4.979 . 0 0 "[ . 1 . 2]" 1
1008 1 3 CYS H 1 4 THR MG . . 5.500 5.161 4.880 5.369 . 0 0 "[ . 1 . 2]" 1
1009 1 1 GLY QA 1 12 PHE H . . 4.940 4.260 3.764 4.849 . 0 0 "[ . 1 . 2]" 1
1010 1 1 GLY QA 1 2 ARG HA . . 4.190 3.947 3.891 4.045 . 0 0 "[ . 1 . 2]" 1
1011 1 32 CYS HB2 1 59 CYS HA . . 4.800 4.413 3.521 4.853 0.053 6 0 "[ . 1 . 2]" 1
1012 1 32 CYS HA 1 35 HIS HB2 . . 4.630 3.916 3.185 4.778 0.148 19 0 "[ . 1 . 2]" 1
1013 1 32 CYS HB2 1 59 CYS HB2 . . 3.840 3.524 2.660 3.900 0.060 6 0 "[ . 1 . 2]" 1
1014 1 31 HIS HB3 1 59 CYS HA . . 4.540 4.127 3.842 4.377 . 0 0 "[ . 1 . 2]" 1
1015 1 56 LEU HA 1 59 CYS HB3 . . 3.570 2.563 2.297 2.959 . 0 0 "[ . 1 . 2]" 1
1016 1 31 HIS HB3 1 59 CYS HB2 . . 4.250 3.704 3.279 4.070 . 0 0 "[ . 1 . 2]" 1
1017 1 56 LEU HA 1 59 CYS HB2 . . 4.600 3.741 3.371 4.380 . 0 0 "[ . 1 . 2]" 1
1018 1 32 CYS HA 1 59 CYS HB2 . . 4.360 3.555 2.927 4.150 . 0 0 "[ . 1 . 2]" 1
1019 1 60 CYS HA 1 110 CYS HB2 . . 4.700 3.863 3.597 4.375 . 0 0 "[ . 1 . 2]" 1
1020 1 60 CYS HA 1 110 CYS HB3 . . 4.700 4.504 3.826 4.671 . 0 0 "[ . 1 . 2]" 1
1021 1 72 CYS HB3 1 114 CYS HB2 . . 4.270 2.100 1.959 2.293 . 0 0 "[ . 1 . 2]" 1
1022 1 113 GLN QG 1 114 CYS HB2 . . 5.500 5.582 5.500 5.633 0.133 1 0 "[ . 1 . 2]" 1
1023 1 33 GLN QB 1 33 GLN HG3 . . 2.760 2.304 2.248 2.360 . 0 0 "[ . 1 . 2]" 1
1024 1 81 GLN HA 1 83 GLN QG . . 4.640 4.503 4.121 4.694 0.054 4 0 "[ . 1 . 2]" 1
1025 1 33 GLN QB 1 81 GLN HG3 . . 3.250 2.519 2.315 2.887 . 0 0 "[ . 1 . 2]" 1
1026 1 33 GLN HG3 1 81 GLN HG3 . . 3.860 2.640 2.415 3.129 . 0 0 "[ . 1 . 2]" 1
1027 1 49 ASN HA 1 50 PRO QD . . 2.940 2.074 1.894 2.360 . 0 0 "[ . 1 . 2]" 1
1028 1 29 LEU H 1 29 LEU HG . . 4.400 4.275 4.178 4.417 0.017 12 0 "[ . 1 . 2]" 1
1029 1 29 LEU HG 1 78 VAL HA . . 3.490 3.478 3.313 3.533 0.043 19 0 "[ . 1 . 2]" 1
1030 1 107 PRO HG3 1 116 ILE MD . . 4.450 2.696 2.102 3.308 . 0 0 "[ . 1 . 2]" 1
1031 1 106 LEU HB3 1 107 PRO HD2 . . 3.900 3.759 3.089 3.976 0.076 5 0 "[ . 1 . 2]" 1
1032 1 107 PRO HD3 1 108 ASN H . . 5.190 4.153 4.040 4.254 . 0 0 "[ . 1 . 2]" 1
1033 1 57 SER HA 1 60 CYS HB3 . . 5.360 3.338 2.878 3.566 . 0 0 "[ . 1 . 2]" 1
1034 1 57 SER HA 1 60 CYS HB2 . . 5.360 4.692 4.034 5.138 . 0 0 "[ . 1 . 2]" 1
1035 1 57 SER HA 1 58 LEU HG . . 5.100 5.127 5.068 5.168 0.068 2 0 "[ . 1 . 2]" 1
1036 1 32 CYS HA 1 36 LEU HG . . 4.970 3.440 3.108 3.919 . 0 0 "[ . 1 . 2]" 1
1037 1 102 LYS H 1 103 ALA HA . . 5.440 5.153 5.113 5.199 . 0 0 "[ . 1 . 2]" 1
1038 1 92 GLY HA3 1 96 VAL MG2 . . 3.720 2.707 2.447 2.835 . 0 0 "[ . 1 . 2]" 1
1039 1 97 GLN HG3 1 101 LYS H . . 4.820 4.848 4.768 4.901 0.081 9 0 "[ . 1 . 2]" 1
1040 1 97 GLN HG2 1 101 LYS H . . 4.820 4.576 4.422 4.729 . 0 0 "[ . 1 . 2]" 1
1041 1 68 LYS HG2 1 70 CYS H . . 5.500 5.046 4.570 5.285 . 0 0 "[ . 1 . 2]" 1
1042 1 4 THR MG 1 10 ILE MG . . 3.680 3.058 2.895 3.297 . 0 0 "[ . 1 . 2]" 1
1043 1 4 THR MG 1 10 ILE HG12 . . 3.550 3.464 3.364 3.552 0.002 19 0 "[ . 1 . 2]" 1
1044 1 4 THR MG 1 10 ILE HG13 . . 3.550 3.366 3.201 3.494 . 0 0 "[ . 1 . 2]" 1
1045 1 4 THR MG 1 10 ILE HB . . 3.920 2.069 1.974 2.186 . 0 0 "[ . 1 . 2]" 1
1046 1 24 ILE HG13 1 74 ALA H . . 5.500 4.486 4.315 4.692 . 0 0 "[ . 1 . 2]" 1
1047 1 24 ILE HG12 1 74 ALA H . . 5.500 2.941 2.788 3.169 . 0 0 "[ . 1 . 2]" 1
1048 1 106 LEU HB2 1 107 PRO HD3 . . 4.520 2.625 2.157 3.262 . 0 0 "[ . 1 . 2]" 1
1049 1 106 LEU HB2 1 107 PRO HD2 . . 4.560 2.926 2.613 3.580 . 0 0 "[ . 1 . 2]" 1
1050 1 75 ILE MG 1 107 PRO HD3 . . 4.180 1.953 1.826 2.206 . 0 0 "[ . 1 . 2]" 1
1051 1 75 ILE MG 1 107 PRO HD2 . . 4.210 2.970 2.728 3.412 . 0 0 "[ . 1 . 2]" 1
1052 1 107 PRO HD2 1 116 ILE MD . . 4.730 3.912 2.953 4.816 0.086 5 0 "[ . 1 . 2]" 1
1053 1 38 SER H 1 99 MET HB3 . . 5.500 5.503 5.048 5.602 0.102 19 0 "[ . 1 . 2]" 1
1054 1 38 SER H 1 99 MET QG . . 5.500 4.447 3.941 4.834 . 0 0 "[ . 1 . 2]" 1
1055 1 36 LEU HB3 1 100 VAL HB . . 5.500 3.314 2.954 3.519 . 0 0 "[ . 1 . 2]" 1
1056 1 36 LEU QD 1 100 VAL HA . . 3.310 2.069 1.870 2.209 . 0 0 "[ . 1 . 2]" 1
1057 1 36 LEU HB3 1 100 VAL MG1 . . 4.450 4.489 4.289 4.563 0.113 3 0 "[ . 1 . 2]" 1
1058 1 86 LEU MD1 1 96 VAL MG1 . . 4.220 4.145 3.753 4.294 0.074 8 0 "[ . 1 . 2]" 1
1059 1 86 LEU HG 1 96 VAL MG1 . . 4.010 2.966 2.467 3.158 . 0 0 "[ . 1 . 2]" 1
1060 1 115 SER HA 1 116 ILE H . . 2.950 2.220 2.119 2.313 . 0 0 "[ . 1 . 2]" 1
1061 1 107 PRO HB2 1 116 ILE H . . 4.750 3.955 3.385 4.332 . 0 0 "[ . 1 . 2]" 1
1062 1 107 PRO HG3 1 116 ILE H . . 4.990 3.786 3.324 4.384 . 0 0 "[ . 1 . 2]" 1
1063 1 116 ILE H 1 116 ILE HB . . 3.570 2.685 2.527 3.641 0.071 1 0 "[ . 1 . 2]" 1
1064 1 116 ILE H 1 116 ILE HG13 . . 3.920 3.248 2.539 3.965 0.045 19 0 "[ . 1 . 2]" 1
1065 1 116 ILE H 1 116 ILE HG12 . . 3.920 3.183 2.187 3.942 0.022 10 0 "[ . 1 . 2]" 1
1066 1 114 CYS HA 1 115 SER H . . 3.040 2.369 2.253 2.460 . 0 0 "[ . 1 . 2]" 1
1067 1 115 SER H 1 115 SER HB2 . . 4.140 3.252 2.724 3.828 . 0 0 "[ . 1 . 2]" 1
1068 1 114 CYS HB2 1 115 SER H . . 3.970 3.920 3.740 4.034 0.064 5 0 "[ . 1 . 2]" 1
1069 1 72 CYS H 1 72 CYS HB3 . . 3.450 2.814 2.560 2.922 . 0 0 "[ . 1 . 2]" 1
1070 1 114 CYS HB3 1 115 SER H . . 3.690 2.802 2.550 3.061 . 0 0 "[ . 1 . 2]" 1
1071 1 113 GLN HA 1 114 CYS H . . 2.980 2.736 2.579 2.969 . 0 0 "[ . 1 . 2]" 1
1072 1 113 GLN QG 1 114 CYS H . . 5.030 4.485 4.178 4.707 . 0 0 "[ . 1 . 2]" 1
1073 1 113 GLN HB2 1 114 CYS H . . 4.890 4.139 3.879 4.246 . 0 0 "[ . 1 . 2]" 1
1074 1 113 GLN HB3 1 114 CYS H . . 4.890 4.401 4.361 4.466 . 0 0 "[ . 1 . 2]" 1
1075 1 114 CYS H 1 114 CYS HB2 . . 3.870 2.617 2.465 2.727 . 0 0 "[ . 1 . 2]" 1
1076 1 114 CYS H 1 114 CYS HB3 . . 4.150 3.783 3.752 3.835 . 0 0 "[ . 1 . 2]" 1
1077 1 112 LEU MD1 1 114 CYS H . . 5.500 5.132 4.902 5.314 . 0 0 "[ . 1 . 2]" 1
1078 1 112 LEU MD2 1 114 CYS H . . 5.500 5.303 5.121 5.481 . 0 0 "[ . 1 . 2]" 1
1079 1 112 LEU HA 1 114 CYS H . . 4.750 4.275 4.125 4.436 . 0 0 "[ . 1 . 2]" 1
1080 1 112 LEU HA 1 113 GLN H . . 2.860 2.348 2.297 2.385 . 0 0 "[ . 1 . 2]" 1
1081 1 113 GLN H 1 113 GLN QG . . 3.220 2.006 1.847 2.148 . 0 0 "[ . 1 . 2]" 1
1082 1 113 GLN H 1 113 GLN HB2 . . 3.640 2.529 2.377 2.732 . 0 0 "[ . 1 . 2]" 1
1083 1 113 GLN H 1 113 GLN HB3 . . 3.640 3.577 3.537 3.615 . 0 0 "[ . 1 . 2]" 1
1084 1 112 LEU HB2 1 113 GLN H . . 3.700 3.539 3.483 3.600 . 0 0 "[ . 1 . 2]" 1
1085 1 112 LEU HB3 1 113 GLN H . . 3.700 2.525 2.420 2.665 . 0 0 "[ . 1 . 2]" 1
1086 1 112 LEU MD2 1 113 GLN H . . 3.840 3.606 3.443 3.783 . 0 0 "[ . 1 . 2]" 1
1087 1 111 ASN HA 1 112 LEU H . . 3.320 2.351 2.214 2.648 . 0 0 "[ . 1 . 2]" 1
1088 1 111 ASN HB3 1 112 LEU H . . 4.340 4.338 4.207 4.362 0.022 18 0 "[ . 1 . 2]" 1
1089 1 111 ASN HB2 1 112 LEU H . . 4.730 4.519 4.456 4.592 . 0 0 "[ . 1 . 2]" 1
1090 1 107 PRO HA 1 112 LEU H . . 3.880 2.939 2.813 3.043 . 0 0 "[ . 1 . 2]" 1
1091 1 110 CYS HB3 1 112 LEU H . . 5.170 3.890 3.655 5.163 . 0 0 "[ . 1 . 2]" 1
1092 1 112 LEU H 1 112 LEU HB2 . . 3.830 2.581 2.534 2.631 . 0 0 "[ . 1 . 2]" 1
1093 1 112 LEU H 1 112 LEU HB3 . . 3.830 3.661 3.616 3.688 . 0 0 "[ . 1 . 2]" 1
1094 1 112 LEU H 1 112 LEU HG . . 3.830 2.415 2.239 2.610 . 0 0 "[ . 1 . 2]" 1
1095 1 108 ASN HA 1 111 ASN H . . 3.940 3.797 3.437 3.973 0.033 12 0 "[ . 1 . 2]" 1
1096 1 111 ASN H 1 111 ASN HA . . 2.840 2.228 2.199 2.263 . 0 0 "[ . 1 . 2]" 1
1097 1 111 ASN H 1 111 ASN HB3 . . 3.740 3.632 3.527 3.697 . 0 0 "[ . 1 . 2]" 1
1098 1 111 ASN H 1 111 ASN HB2 . . 3.630 3.115 3.001 3.218 . 0 0 "[ . 1 . 2]" 1
1099 1 111 ASN H 1 112 LEU MD2 . . 4.720 4.268 4.064 4.508 . 0 0 "[ . 1 . 2]" 1
1100 1 109 GLN QG 1 110 CYS H . . 4.230 4.081 3.922 4.214 . 0 0 "[ . 1 . 2]" 1
1101 1 109 GLN HB3 1 110 CYS H . . 4.020 3.686 3.442 3.971 . 0 0 "[ . 1 . 2]" 1
1102 1 110 CYS H 1 111 ASN HA . . 4.930 4.498 4.278 4.736 . 0 0 "[ . 1 . 2]" 1
1103 1 110 CYS H 1 110 CYS HB2 . . 3.630 2.497 2.391 2.591 . 0 0 "[ . 1 . 2]" 1
1104 1 110 CYS H 1 112 LEU HG . . 4.220 3.597 3.460 3.712 . 0 0 "[ . 1 . 2]" 1
1105 1 110 CYS H 1 112 LEU MD1 . . 4.900 4.225 4.055 4.364 . 0 0 "[ . 1 . 2]" 1
1106 1 110 CYS H 1 112 LEU MD2 . . 5.340 4.552 4.311 4.735 . 0 0 "[ . 1 . 2]" 1
1107 1 108 ASN HB3 1 109 GLN H . . 4.080 3.526 3.346 3.795 . 0 0 "[ . 1 . 2]" 1
1108 1 106 LEU HA 1 109 GLN H . . 4.070 3.263 3.078 3.408 . 0 0 "[ . 1 . 2]" 1
1109 1 109 GLN H 1 109 GLN QG . . 3.660 2.294 2.131 2.517 . 0 0 "[ . 1 . 2]" 1
1110 1 109 GLN H 1 109 GLN HB2 . . 3.470 2.486 2.392 2.579 . 0 0 "[ . 1 . 2]" 1
1111 1 109 GLN H 1 109 GLN HB3 . . 4.020 3.613 3.582 3.640 . 0 0 "[ . 1 . 2]" 1
1112 1 108 ASN H 1 109 GLN QG . . 5.080 3.907 3.719 4.171 . 0 0 "[ . 1 . 2]" 1
1113 1 105 MET HA 1 108 ASN H . . 4.000 3.457 3.234 3.579 . 0 0 "[ . 1 . 2]" 1
1114 1 107 PRO HD2 1 108 ASN H . . 3.900 3.113 2.824 3.259 . 0 0 "[ . 1 . 2]" 1
1115 1 108 ASN H 1 108 ASN HB3 . . 3.290 3.454 3.403 3.488 0.198 6 0 "[ . 1 . 2]" 1
1116 1 108 ASN H 1 108 ASN HB2 . . 3.290 2.264 2.138 2.394 . 0 0 "[ . 1 . 2]" 1
1117 1 105 MET HG2 1 106 LEU H . . 4.820 4.889 4.859 4.919 0.099 20 0 "[ . 1 . 2]" 1
1118 1 105 MET HG3 1 106 LEU H . . 4.820 4.153 4.010 4.379 . 0 0 "[ . 1 . 2]" 1
1119 1 105 MET HB2 1 106 LEU H . . 3.730 3.089 2.912 3.258 . 0 0 "[ . 1 . 2]" 1
1120 1 106 LEU H 1 107 PRO HD3 . . 3.420 3.411 2.843 3.463 0.043 7 0 "[ . 1 . 2]" 1
1121 1 106 LEU H 1 106 LEU HB3 . . 3.690 3.504 3.128 3.640 . 0 0 "[ . 1 . 2]" 1
1122 1 106 LEU H 1 106 LEU HB2 . . 3.570 2.329 2.083 2.553 . 0 0 "[ . 1 . 2]" 1
1123 1 103 ALA HA 1 105 MET H . . 4.370 3.767 3.665 3.963 . 0 0 "[ . 1 . 2]" 1
1124 1 103 ALA MB 1 105 MET H . . 4.540 4.269 4.196 4.320 . 0 0 "[ . 1 . 2]" 1
1125 1 105 MET H 1 105 MET HG2 . . 3.580 3.306 3.144 3.396 . 0 0 "[ . 1 . 2]" 1
1126 1 105 MET H 1 105 MET HB2 . . 3.360 2.587 2.493 2.685 . 0 0 "[ . 1 . 2]" 1
1127 1 102 LYS HA 1 105 MET H . . 4.030 3.298 2.950 3.583 . 0 0 "[ . 1 . 2]" 1
1128 1 105 MET H 1 105 MET HG3 . . 3.580 2.232 2.054 2.430 . 0 0 "[ . 1 . 2]" 1
1129 1 104 GLN H 1 104 GLN HB2 . . 3.750 2.515 2.433 2.607 . 0 0 "[ . 1 . 2]" 1
1130 1 104 GLN H 1 104 GLN HG3 . . 3.970 2.214 1.950 3.514 . 0 0 "[ . 1 . 2]" 1
1131 1 104 GLN H 1 104 GLN HG2 . . 3.970 3.232 2.113 3.476 . 0 0 "[ . 1 . 2]" 1
1132 1 102 LYS HB3 1 103 ALA H . . 3.780 3.775 3.575 3.819 0.039 1 0 "[ . 1 . 2]" 1
1133 1 102 LYS HB2 1 103 ALA H . . 3.780 2.814 2.413 2.960 . 0 0 "[ . 1 . 2]" 1
1134 1 102 LYS QG 1 103 ALA H . . 4.330 4.150 3.803 4.303 . 0 0 "[ . 1 . 2]" 1
1135 1 100 VAL HA 1 103 ALA H . . 3.850 3.256 3.133 3.385 . 0 0 "[ . 1 . 2]" 1
1136 1 36 LEU QD 1 103 ALA H . . 3.470 2.622 2.255 2.911 . 0 0 "[ . 1 . 2]" 1
1137 1 101 LYS QB 1 102 LYS H . . 3.630 3.682 3.615 3.726 0.096 5 0 "[ . 1 . 2]" 1
1138 1 101 LYS QD 1 102 LYS H . . 4.430 3.150 2.567 4.204 . 0 0 "[ . 1 . 2]" 1
1139 1 100 VAL HA 1 102 LYS H . . 4.380 3.623 3.542 3.725 . 0 0 "[ . 1 . 2]" 1
1140 1 102 LYS H 1 102 LYS QG . . 3.790 2.249 2.097 2.451 . 0 0 "[ . 1 . 2]" 1
1141 1 100 VAL MG2 1 102 LYS H . . 4.930 4.732 4.668 4.788 . 0 0 "[ . 1 . 2]" 1
1142 1 99 MET QG 1 100 VAL H . . 4.400 3.937 3.801 4.157 . 0 0 "[ . 1 . 2]" 1
1143 1 99 MET HB3 1 100 VAL H . . 3.570 2.372 2.269 2.559 . 0 0 "[ . 1 . 2]" 1
1144 1 99 MET HB2 1 100 VAL H . . 3.210 3.295 3.247 3.322 0.112 19 0 "[ . 1 . 2]" 1
1145 1 100 VAL H 1 100 VAL HB . . 2.900 2.625 2.566 2.698 . 0 0 "[ . 1 . 2]" 1
1146 1 36 LEU HB3 1 100 VAL H . . 4.300 3.581 3.394 3.749 . 0 0 "[ . 1 . 2]" 1
1147 1 100 VAL H 1 100 VAL MG1 . . 2.800 2.104 1.955 2.227 . 0 0 "[ . 1 . 2]" 1
1148 1 98 GLN HG2 1 99 MET H . . 3.610 3.091 2.897 3.264 . 0 0 "[ . 1 . 2]" 1
1149 1 99 MET H 1 99 MET HB3 . . 4.020 2.831 2.740 2.983 . 0 0 "[ . 1 . 2]" 1
1150 1 99 MET H 1 100 VAL MG1 . . 4.330 3.312 3.235 3.387 . 0 0 "[ . 1 . 2]" 1
1151 1 36 LEU QD 1 99 MET H . . 5.170 4.882 4.750 4.969 . 0 0 "[ . 1 . 2]" 1
1152 1 96 VAL MG1 1 97 GLN H . . 4.010 3.750 3.695 3.811 . 0 0 "[ . 1 . 2]" 1
1153 1 94 GLN HA 1 97 GLN H . . 4.280 3.779 3.533 4.122 . 0 0 "[ . 1 . 2]" 1
1154 1 92 GLY HA3 1 96 VAL H . . 4.060 4.090 3.949 4.143 0.083 20 0 "[ . 1 . 2]" 1
1155 1 95 GLN HG2 1 96 VAL H . . 2.840 2.482 2.272 2.710 . 0 0 "[ . 1 . 2]" 1
1156 1 95 GLN HG3 1 96 VAL H . . 3.400 2.141 1.956 2.315 . 0 0 "[ . 1 . 2]" 1
1157 1 95 GLN HB2 1 96 VAL H . . 3.470 3.563 3.524 3.599 0.129 2 0 "[ . 1 . 2]" 1
1158 1 95 GLN HB3 1 96 VAL H . . 4.090 3.799 3.703 3.888 . 0 0 "[ . 1 . 2]" 1
1159 1 94 GLN QG 1 96 VAL H . . 4.160 4.093 3.867 4.189 0.029 9 0 "[ . 1 . 2]" 1
1160 1 96 VAL H 1 96 VAL MG2 . . 3.500 2.126 2.077 2.190 . 0 0 "[ . 1 . 2]" 1
1161 1 95 GLN H 1 95 GLN HG2 . . 3.460 2.085 1.937 2.245 . 0 0 "[ . 1 . 2]" 1
1162 1 95 GLN H 1 95 GLN HB3 . . 3.370 2.790 2.714 2.854 . 0 0 "[ . 1 . 2]" 1
1163 1 29 LEU QB 1 32 CYS H . . 4.310 4.261 4.049 4.344 0.034 3 0 "[ . 1 . 2]" 1
1164 1 92 GLY HA2 1 94 GLN H . . 3.870 3.900 3.848 3.931 0.061 12 0 "[ . 1 . 2]" 1
1165 1 92 GLY HA3 1 93 GLN H . . 3.370 2.940 2.728 3.048 . 0 0 "[ . 1 . 2]" 1
1166 1 93 GLN H 1 93 GLN QG . . 3.130 2.186 1.775 3.003 . 0 0 "[ . 1 . 2]" 1
1167 1 93 GLN H 1 93 GLN QB . . 2.600 2.481 2.355 2.632 0.032 5 0 "[ . 1 . 2]" 1
1168 1 91 GLY HA3 1 92 GLY H . . 2.700 2.235 2.143 2.468 . 0 0 "[ . 1 . 2]" 1
1169 1 91 GLY HA2 1 92 GLY H . . 3.470 3.231 2.632 3.491 0.021 12 0 "[ . 1 . 2]" 1
1170 1 90 GLN QG 1 91 GLY H . . 4.140 3.554 2.496 4.189 0.049 7 0 "[ . 1 . 2]" 1
1171 1 90 GLN HB2 1 91 GLY H . . 4.160 3.197 2.139 4.103 . 0 0 "[ . 1 . 2]" 1
1172 1 90 GLN HB3 1 91 GLY H . . 4.160 3.885 3.162 4.216 0.056 17 0 "[ . 1 . 2]" 1
1173 1 91 GLY H 1 91 GLY HA3 . . 2.930 2.873 2.674 2.949 0.019 7 0 "[ . 1 . 2]" 1
1174 1 91 GLY H 1 91 GLY HA2 . . 2.890 2.617 2.429 2.891 0.001 3 0 "[ . 1 . 2]" 1
1175 1 89 GLY HA2 1 90 GLN H . . 3.550 3.233 2.393 3.549 . 0 0 "[ . 1 . 2]" 1
1176 1 90 GLN H 1 90 GLN QG . . 3.330 2.512 1.917 3.353 0.023 19 0 "[ . 1 . 2]" 1
1177 1 88 GLN HG2 1 89 GLY H . . 4.270 3.241 2.936 3.581 . 0 0 "[ . 1 . 2]" 1
1178 1 88 GLN HB2 1 89 GLY H . . 4.200 4.218 4.151 4.258 0.058 3 0 "[ . 1 . 2]" 1
1179 1 88 GLN HB3 1 89 GLY H . . 4.200 4.226 4.125 4.272 0.072 16 0 "[ . 1 . 2]" 1
1180 1 84 LYS HA 1 88 GLN H . . 4.090 3.913 3.561 4.061 . 0 0 "[ . 1 . 2]" 1
1181 1 88 GLN H 1 88 GLN HG2 . . 3.510 2.104 1.953 2.308 . 0 0 "[ . 1 . 2]" 1
1182 1 85 GLN HA 1 88 GLN H . . 4.020 3.728 3.473 4.039 0.019 18 0 "[ . 1 . 2]" 1
1183 1 86 LEU MD1 1 87 GLN H . . 4.890 4.660 4.560 4.731 . 0 0 "[ . 1 . 2]" 1
1184 1 86 LEU MD2 1 87 GLN H . . 4.450 4.356 4.269 4.453 0.003 6 0 "[ . 1 . 2]" 1
1185 1 86 LEU HB2 1 87 GLN H . . 4.110 3.069 2.913 3.227 . 0 0 "[ . 1 . 2]" 1
1186 1 85 GLN QB 1 86 LEU H . . 3.540 3.526 3.438 3.577 0.037 13 0 "[ . 1 . 2]" 1
1187 1 83 GLN HA 1 86 LEU H . . 4.040 3.558 3.400 3.688 . 0 0 "[ . 1 . 2]" 1
1188 1 86 LEU H 1 86 LEU HB2 . . 3.370 2.203 2.136 2.313 . 0 0 "[ . 1 . 2]" 1
1189 1 86 LEU H 1 86 LEU HB3 . . 3.710 3.474 3.396 3.575 . 0 0 "[ . 1 . 2]" 1
1190 1 86 LEU H 1 86 LEU HG . . 4.610 4.230 4.122 4.299 . 0 0 "[ . 1 . 2]" 1
1191 1 86 LEU H 1 86 LEU MD1 . . 4.940 4.117 3.998 4.240 . 0 0 "[ . 1 . 2]" 1
1192 1 84 LYS QD 1 85 GLN H . . 4.160 2.646 2.385 3.033 . 0 0 "[ . 1 . 2]" 1
1193 1 84 LYS QB 1 85 GLN H . . 3.850 3.568 2.482 3.681 . 0 0 "[ . 1 . 2]" 1
1194 1 85 GLN H 1 85 GLN QB . . 2.780 2.369 2.270 2.441 . 0 0 "[ . 1 . 2]" 1
1195 1 85 GLN H 1 85 GLN HG3 . . 3.780 3.415 3.090 3.682 . 0 0 "[ . 1 . 2]" 1
1196 1 83 GLN HA 1 85 GLN H . . 4.950 4.201 4.052 4.336 . 0 0 "[ . 1 . 2]" 1
1197 1 78 VAL MG1 1 81 GLN H . . 5.500 4.900 4.766 5.017 . 0 0 "[ . 1 . 2]" 1
1198 1 84 LYS H 1 84 LYS QB . . 2.910 2.521 1.902 2.607 . 0 0 "[ . 1 . 2]" 1
1199 1 84 LYS H 1 84 LYS QD . . 3.940 3.659 2.381 3.841 . 0 0 "[ . 1 . 2]" 1
1200 1 84 LYS H 1 84 LYS QG . . 3.850 2.348 2.078 3.767 . 0 0 "[ . 1 . 2]" 1
1201 1 80 GLU HA 1 83 GLN H . . 4.030 3.911 3.745 4.062 0.032 9 0 "[ . 1 . 2]" 1
1202 1 82 ALA MB 1 83 GLN H . . 3.240 2.633 2.423 2.758 . 0 0 "[ . 1 . 2]" 1
1203 1 79 VAL HA 1 83 GLN H . . 4.540 3.890 3.814 3.993 . 0 0 "[ . 1 . 2]" 1
1204 1 83 GLN H 1 83 GLN QB . . 2.710 2.592 2.514 2.664 . 0 0 "[ . 1 . 2]" 1
1205 1 79 VAL HA 1 82 ALA H . . 4.100 3.641 3.537 3.767 . 0 0 "[ . 1 . 2]" 1
1206 1 81 GLN HG3 1 82 ALA H . . 4.670 2.743 2.458 2.945 . 0 0 "[ . 1 . 2]" 1
1207 1 81 GLN HG2 1 82 ALA H . . 4.600 2.781 2.550 2.947 . 0 0 "[ . 1 . 2]" 1
1208 1 81 GLN HB2 1 82 ALA H . . 4.190 3.943 3.825 4.059 . 0 0 "[ . 1 . 2]" 1
1209 1 79 VAL MG2 1 82 ALA H . . 5.500 5.339 5.265 5.423 . 0 0 "[ . 1 . 2]" 1
1210 1 78 VAL HA 1 82 ALA H . . 4.510 4.011 3.873 4.155 . 0 0 "[ . 1 . 2]" 1
1211 1 78 VAL HA 1 81 GLN H . . 3.810 3.795 3.693 3.836 0.026 15 0 "[ . 1 . 2]" 1
1212 1 85 GLN H 1 85 GLN HG2 . . 3.780 2.468 2.288 2.652 . 0 0 "[ . 1 . 2]" 1
1213 1 85 GLN H 1 87 GLN QB . . 5.500 4.599 4.409 4.779 . 0 0 "[ . 1 . 2]" 1
1214 1 80 GLU QB 1 81 GLN H . . 2.810 2.435 2.230 2.712 . 0 0 "[ . 1 . 2]" 1
1215 1 84 LYS QG 1 85 GLN H . . 3.870 2.562 2.283 3.032 . 0 0 "[ . 1 . 2]" 1
1216 1 76 LYS HA 1 80 GLU H . . 5.120 4.287 4.115 4.520 . 0 0 "[ . 1 . 2]" 1
1217 1 52 GLN H 1 52 GLN QG . . 3.330 2.438 2.123 2.807 . 0 0 "[ . 1 . 2]" 1
1218 1 80 GLU H 1 80 GLU QB . . 2.810 2.308 2.141 2.539 . 0 0 "[ . 1 . 2]" 1
1219 1 80 GLU H 1 82 ALA MB . . 5.010 4.838 4.712 4.964 . 0 0 "[ . 1 . 2]" 1
1220 1 79 VAL MG1 1 80 GLU H . . 3.910 3.487 3.349 3.605 . 0 0 "[ . 1 . 2]" 1
1221 1 79 VAL MG2 1 80 GLU H . . 3.910 3.527 3.413 3.655 . 0 0 "[ . 1 . 2]" 1
1222 1 79 VAL H 1 79 VAL MG1 . . 4.070 3.771 3.741 3.791 . 0 0 "[ . 1 . 2]" 1
1223 1 75 ILE HA 1 79 VAL H . . 4.750 4.556 4.426 4.749 . 0 0 "[ . 1 . 2]" 1
1224 1 79 VAL H 1 79 VAL HB . . 3.080 2.628 2.545 2.674 . 0 0 "[ . 1 . 2]" 1
1225 1 77 GLN HB2 1 79 VAL H . . 5.350 4.906 4.762 5.036 . 0 0 "[ . 1 . 2]" 1
1226 1 79 VAL H 1 82 ALA MB . . 4.960 4.606 4.504 4.698 . 0 0 "[ . 1 . 2]" 1
1227 1 79 VAL H 1 103 ALA MB . . 5.240 4.064 3.662 4.294 . 0 0 "[ . 1 . 2]" 1
1228 1 77 GLN HG2 1 78 VAL H . . 4.700 4.280 3.921 4.646 . 0 0 "[ . 1 . 2]" 1
1229 1 77 GLN HB2 1 78 VAL H . . 3.610 2.480 2.261 2.736 . 0 0 "[ . 1 . 2]" 1
1230 1 29 LEU HG 1 78 VAL H . . 4.070 3.132 2.855 3.346 . 0 0 "[ . 1 . 2]" 1
1231 1 76 LYS QB 1 77 GLN H . . 3.420 2.364 2.272 2.447 . 0 0 "[ . 1 . 2]" 1
1232 1 74 ALA HA 1 77 GLN H . . 4.210 3.497 3.411 3.626 . 0 0 "[ . 1 . 2]" 1
1233 1 77 GLN H 1 77 GLN HG3 . . 3.570 2.681 2.143 3.213 . 0 0 "[ . 1 . 2]" 1
1234 1 76 LYS QD 1 77 GLN H . . 4.680 4.576 4.469 4.692 0.012 7 0 "[ . 1 . 2]" 1
1235 1 76 LYS H 1 76 LYS QG . . 4.170 2.096 1.950 2.324 . 0 0 "[ . 1 . 2]" 1
1236 1 75 ILE HB 1 76 LYS H . . 3.220 2.835 2.633 3.108 . 0 0 "[ . 1 . 2]" 1
1237 1 72 CYS HA 1 75 ILE H . . 3.830 3.221 3.097 3.352 . 0 0 "[ . 1 . 2]" 1
1238 1 73 GLU HA 1 75 ILE H . . 4.720 3.776 3.608 3.953 . 0 0 "[ . 1 . 2]" 1
1239 1 74 ALA MB 1 75 ILE H . . 3.360 2.765 2.621 2.875 . 0 0 "[ . 1 . 2]" 1
1240 1 75 ILE H 1 75 ILE MD . . 3.170 2.847 2.779 2.921 . 0 0 "[ . 1 . 2]" 1
1241 1 70 CYS HA 1 74 ALA H . . 4.480 4.125 4.015 4.285 . 0 0 "[ . 1 . 2]" 1
1242 1 71 GLN HA 1 74 ALA H . . 4.310 3.574 3.449 3.746 . 0 0 "[ . 1 . 2]" 1
1243 1 22 CYS HB3 1 74 ALA H . . 5.500 5.403 5.226 5.513 0.013 16 0 "[ . 1 . 2]" 1
1244 1 70 CYS HB2 1 74 ALA H . . 5.500 5.302 5.183 5.430 . 0 0 "[ . 1 . 2]" 1
1245 1 73 GLU QG 1 74 ALA H . . 4.420 4.077 3.932 4.216 . 0 0 "[ . 1 . 2]" 1
1246 1 73 GLU HB2 1 74 ALA H . . 3.480 2.751 2.594 2.897 . 0 0 "[ . 1 . 2]" 1
1247 1 74 ALA H 1 74 ALA MB . . 2.830 2.169 2.142 2.184 . 0 0 "[ . 1 . 2]" 1
1248 1 74 ALA H 1 75 ILE MD . . 4.340 4.387 4.359 4.420 0.080 7 0 "[ . 1 . 2]" 1
1249 1 24 ILE MG 1 74 ALA H . . 3.910 3.986 3.942 4.051 0.141 11 0 "[ . 1 . 2]" 1
1250 1 70 CYS HA 1 73 GLU H . . 4.020 2.926 2.775 3.148 . 0 0 "[ . 1 . 2]" 1
1251 1 72 CYS HB3 1 73 GLU H . . 4.130 4.161 3.948 4.213 0.083 14 0 "[ . 1 . 2]" 1
1252 1 72 CYS HB2 1 73 GLU H . . 4.240 3.897 3.713 4.081 . 0 0 "[ . 1 . 2]" 1
1253 1 73 GLU H 1 73 GLU QG . . 3.530 2.249 2.111 2.414 . 0 0 "[ . 1 . 2]" 1
1254 1 73 GLU H 1 73 GLU HB3 . . 3.600 3.586 3.555 3.614 0.014 17 0 "[ . 1 . 2]" 1
1255 1 73 GLU H 1 73 GLU HB2 . . 3.450 2.443 2.385 2.505 . 0 0 "[ . 1 . 2]" 1
1256 1 73 GLU H 1 74 ALA MB . . 4.420 4.107 4.047 4.188 . 0 0 "[ . 1 . 2]" 1
1257 1 75 ILE HA 1 78 VAL H . . 4.010 3.313 3.218 3.455 . 0 0 "[ . 1 . 2]" 1
1258 1 77 GLN HG3 1 78 VAL H . . 4.620 4.198 3.725 4.587 . 0 0 "[ . 1 . 2]" 1
1259 1 71 GLN HG3 1 72 CYS H . . 4.750 4.438 4.272 4.611 . 0 0 "[ . 1 . 2]" 1
1260 1 71 GLN HG2 1 72 CYS H . . 5.330 5.004 4.898 5.112 . 0 0 "[ . 1 . 2]" 1
1261 1 71 GLN HB3 1 72 CYS H . . 3.770 3.468 3.302 3.621 . 0 0 "[ . 1 . 2]" 1
1262 1 71 GLN HB2 1 72 CYS H . . 4.220 2.586 2.375 2.820 . 0 0 "[ . 1 . 2]" 1
1263 1 72 CYS H 1 72 CYS HB2 . . 3.660 3.607 3.508 3.660 0.000 18 0 "[ . 1 . 2]" 1
1264 1 72 CYS H 1 73 GLU HB2 . . 5.050 4.572 4.434 4.777 . 0 0 "[ . 1 . 2]" 1
1265 1 115 SER H 1 116 ILE MD . . 5.500 4.726 3.793 5.517 0.017 6 0 "[ . 1 . 2]" 1
1266 1 70 CYS HB3 1 71 GLN H . . 4.310 4.173 4.109 4.209 . 0 0 "[ . 1 . 2]" 1
1267 1 70 CYS HB2 1 71 GLN H . . 3.450 3.244 3.172 3.324 . 0 0 "[ . 1 . 2]" 1
1268 1 69 GLN HA 1 71 GLN H . . 4.230 4.106 3.939 4.255 0.025 8 0 "[ . 1 . 2]" 1
1269 1 68 LYS HA 1 71 GLN H . . 3.830 3.361 3.105 3.884 0.054 12 0 "[ . 1 . 2]" 1
1270 1 71 GLN H 1 71 GLN HG2 . . 4.140 3.578 3.464 3.705 . 0 0 "[ . 1 . 2]" 1
1271 1 71 GLN H 1 71 GLN HB3 . . 3.610 3.565 3.539 3.588 . 0 0 "[ . 1 . 2]" 1
1272 1 71 GLN H 1 71 GLN HB2 . . 3.460 2.364 2.309 2.400 . 0 0 "[ . 1 . 2]" 1
1273 1 71 GLN H 1 74 ALA MB . . 5.500 4.844 4.723 4.944 . 0 0 "[ . 1 . 2]" 1
1274 1 69 GLN QB 1 70 CYS H . . 3.990 3.703 3.597 3.823 . 0 0 "[ . 1 . 2]" 1
1275 1 70 CYS H 1 70 CYS HB3 . . 3.860 3.655 3.599 3.755 . 0 0 "[ . 1 . 2]" 1
1276 1 70 CYS H 1 70 CYS HB2 . . 3.240 2.482 2.409 2.591 . 0 0 "[ . 1 . 2]" 1
1277 1 70 CYS H 1 73 GLU QG . . 4.400 4.396 4.215 4.504 0.104 9 0 "[ . 1 . 2]" 1
1278 1 67 GLU HB2 1 70 CYS H . . 4.050 3.175 2.855 3.709 . 0 0 "[ . 1 . 2]" 1
1279 1 70 CYS H 1 71 GLN HB2 . . 4.290 4.206 3.979 4.314 0.024 12 0 "[ . 1 . 2]" 1
1280 1 67 GLU HA 1 69 GLN H . . 4.340 4.142 4.011 4.306 . 0 0 "[ . 1 . 2]" 1
1281 1 69 GLN H 1 70 CYS HB2 . . 4.540 4.480 4.355 4.565 0.025 7 0 "[ . 1 . 2]" 1
1282 1 69 GLN H 1 69 GLN HG2 . . 3.650 2.057 1.819 2.245 . 0 0 "[ . 1 . 2]" 1
1283 1 67 GLU QG 1 69 GLN H . . 4.600 4.601 4.100 4.698 0.098 12 0 "[ . 1 . 2]" 1
1284 1 69 GLN H 1 69 GLN QB . . 2.950 2.623 2.508 2.743 . 0 0 "[ . 1 . 2]" 1
1285 1 67 GLU HB2 1 69 GLN H . . 4.270 3.907 3.666 4.270 0.000 11 0 "[ . 1 . 2]" 1
1286 1 68 LYS QD 1 69 GLN H . . 4.630 4.374 4.191 4.563 . 0 0 "[ . 1 . 2]" 1
1287 1 67 GLU HA 1 68 LYS H . . 2.610 2.206 2.130 2.278 . 0 0 "[ . 1 . 2]" 1
1288 1 67 GLU QG 1 68 LYS H . . 3.660 3.724 3.674 3.909 0.249 9 0 "[ . 1 . 2]" 1
1289 1 67 GLU HB3 1 68 LYS H . . 3.760 2.890 2.548 3.161 . 0 0 "[ . 1 . 2]" 1
1290 1 68 LYS H 1 68 LYS HG2 . . 4.170 2.156 2.036 2.297 . 0 0 "[ . 1 . 2]" 1
1291 1 68 LYS H 1 71 GLN HG3 . . 5.220 4.129 3.772 4.367 . 0 0 "[ . 1 . 2]" 1
1292 1 66 VAL HA 1 67 GLU H . . 2.680 2.397 2.280 2.460 . 0 0 "[ . 1 . 2]" 1
1293 1 67 GLU H 1 70 CYS HB2 . . 4.270 3.185 2.976 3.412 . 0 0 "[ . 1 . 2]" 1
1294 1 66 VAL HB 1 67 GLU H . . 4.220 3.511 3.410 3.624 . 0 0 "[ . 1 . 2]" 1
1295 1 67 GLU H 1 67 GLU HB3 . . 3.670 3.551 3.305 3.618 . 0 0 "[ . 1 . 2]" 1
1296 1 67 GLU H 1 67 GLU HB2 . . 3.010 2.352 2.001 2.513 . 0 0 "[ . 1 . 2]" 1
1297 1 66 VAL MG1 1 67 GLU H . . 4.140 1.932 1.820 2.065 . 0 0 "[ . 1 . 2]" 1
1298 1 66 VAL MG2 1 67 GLU H . . 4.140 3.997 3.945 4.054 . 0 0 "[ . 1 . 2]" 1
1299 1 63 LEU HA 1 66 VAL H . . 3.770 3.620 3.413 3.776 0.006 7 0 "[ . 1 . 2]" 1
1300 1 64 GLN QG 1 66 VAL H . . 4.570 4.466 4.312 4.533 . 0 0 "[ . 1 . 2]" 1
1301 1 65 GLU HB3 1 66 VAL H . . 4.120 4.011 3.876 4.135 0.015 5 0 "[ . 1 . 2]" 1
1302 1 65 GLU HB2 1 66 VAL H . . 3.770 3.118 2.898 3.319 . 0 0 "[ . 1 . 2]" 1
1303 1 65 GLU H 1 65 GLU HB2 . . 2.900 2.470 2.347 2.566 . 0 0 "[ . 1 . 2]" 1
1304 1 64 GLN QG 1 65 GLU H . . 3.420 2.775 2.567 2.927 . 0 0 "[ . 1 . 2]" 1
1305 1 107 PRO HA 1 111 ASN H . . 4.260 4.278 4.173 4.322 0.062 13 0 "[ . 1 . 2]" 1
1306 1 63 LEU HA 1 64 GLN H . . 3.540 3.473 3.444 3.509 . 0 0 "[ . 1 . 2]" 1
1307 1 61 ASN HA 1 64 GLN H . . 4.070 3.676 3.410 3.843 . 0 0 "[ . 1 . 2]" 1
1308 1 64 GLN H 1 64 GLN QG . . 4.510 2.223 2.144 2.295 . 0 0 "[ . 1 . 2]" 1
1309 1 63 LEU HB3 1 64 GLN H . . 4.120 3.918 3.853 3.952 . 0 0 "[ . 1 . 2]" 1
1310 1 63 LEU HB2 1 64 GLN H . . 4.520 3.994 3.932 4.043 . 0 0 "[ . 1 . 2]" 1
1311 1 63 LEU HG 1 64 GLN H . . 5.240 2.281 2.198 2.409 . 0 0 "[ . 1 . 2]" 1
1312 1 63 LEU MD1 1 64 GLN H . . 5.490 2.705 2.560 2.812 . 0 0 "[ . 1 . 2]" 1
1313 1 63 LEU MD2 1 64 GLN H . . 5.490 3.928 3.861 4.033 . 0 0 "[ . 1 . 2]" 1
1314 1 64 GLN H 1 112 LEU MD1 . . 5.500 5.518 5.411 5.559 0.059 9 0 "[ . 1 . 2]" 1
1315 1 64 GLN H 1 112 LEU MD2 . . 5.500 4.846 4.723 4.950 . 0 0 "[ . 1 . 2]" 1
1316 1 62 GLN QG 1 63 LEU H . . 4.340 3.589 3.348 3.757 . 0 0 "[ . 1 . 2]" 1
1317 1 62 GLN HB3 1 63 LEU H . . 4.090 2.557 2.314 2.731 . 0 0 "[ . 1 . 2]" 1
1318 1 62 GLN HB2 1 63 LEU H . . 3.950 3.844 3.635 3.956 0.006 16 0 "[ . 1 . 2]" 1
1319 1 60 CYS HA 1 63 LEU H . . 4.270 3.567 3.450 3.739 . 0 0 "[ . 1 . 2]" 1
1320 1 63 LEU H 1 63 LEU HB3 . . 3.420 2.438 2.368 2.525 . 0 0 "[ . 1 . 2]" 1
1321 1 63 LEU H 1 63 LEU HB2 . . 3.790 3.582 3.556 3.621 . 0 0 "[ . 1 . 2]" 1
1322 1 63 LEU H 1 63 LEU MD2 . . 4.640 3.105 3.005 3.216 . 0 0 "[ . 1 . 2]" 1
1323 1 59 CYS HA 1 62 GLN H . . 4.240 3.380 3.304 3.476 . 0 0 "[ . 1 . 2]" 1
1324 1 58 LEU HA 1 62 GLN H . . 4.480 4.419 4.237 4.510 0.030 10 0 "[ . 1 . 2]" 1
1325 1 61 ASN HB2 1 62 GLN H . . 4.360 3.935 3.784 4.028 . 0 0 "[ . 1 . 2]" 1
1326 1 61 ASN HB3 1 62 GLN H . . 3.760 2.897 2.555 3.027 . 0 0 "[ . 1 . 2]" 1
1327 1 62 GLN H 1 62 GLN HB3 . . 3.590 2.434 2.292 2.539 . 0 0 "[ . 1 . 2]" 1
1328 1 61 ASN H 1 61 ASN HB3 . . 2.930 2.512 2.409 2.695 . 0 0 "[ . 1 . 2]" 1
1329 1 59 CYS HB2 1 61 ASN H . . 5.500 5.550 5.515 5.626 0.126 3 0 "[ . 1 . 2]" 1
1330 1 56 LEU MD2 1 61 ASN H . . 5.500 5.030 4.774 5.628 0.128 3 0 "[ . 1 . 2]" 1
1331 1 56 LEU HA 1 60 CYS H . . 3.630 3.105 2.966 3.290 . 0 0 "[ . 1 . 2]" 1
1332 1 60 CYS H 1 60 CYS HB2 . . 3.910 2.554 2.104 2.718 . 0 0 "[ . 1 . 2]" 1
1333 1 60 CYS H 1 63 LEU MD1 . . 5.500 5.461 5.336 5.525 0.025 17 0 "[ . 1 . 2]" 1
1334 1 55 HIS HA 1 59 CYS H . . 4.570 3.728 3.467 4.114 . 0 0 "[ . 1 . 2]" 1
1335 1 59 CYS H 1 59 CYS HB2 . . 3.460 2.413 2.247 2.616 . 0 0 "[ . 1 . 2]" 1
1336 1 59 CYS H 1 59 CYS HB3 . . 3.550 2.499 2.391 2.593 . 0 0 "[ . 1 . 2]" 1
1337 1 58 LEU HB2 1 59 CYS H . . 4.260 2.334 2.175 2.448 . 0 0 "[ . 1 . 2]" 1
1338 1 58 LEU HB3 1 59 CYS H . . 4.160 3.533 3.404 3.653 . 0 0 "[ . 1 . 2]" 1
1339 1 58 LEU MD1 1 59 CYS H . . 4.710 4.232 4.117 4.364 . 0 0 "[ . 1 . 2]" 1
1340 1 57 SER QB 1 58 LEU H . . 4.010 2.742 2.595 2.892 . 0 0 "[ . 1 . 2]" 1
1341 1 55 HIS HA 1 58 LEU H . . 4.520 3.284 2.976 3.584 . 0 0 "[ . 1 . 2]" 1
1342 1 56 LEU HA 1 58 LEU H . . 4.670 3.963 3.738 4.096 . 0 0 "[ . 1 . 2]" 1
1343 1 58 LEU H 1 59 CYS HB3 . . 4.820 4.647 4.501 4.822 0.002 1 0 "[ . 1 . 2]" 1
1344 1 58 LEU H 1 58 LEU HB2 . . 3.670 2.557 2.400 2.646 . 0 0 "[ . 1 . 2]" 1
1345 1 58 LEU H 1 58 LEU HB3 . . 3.890 3.604 3.577 3.668 . 0 0 "[ . 1 . 2]" 1
1346 1 57 SER H 1 57 SER QB . . 3.610 2.478 2.201 2.592 . 0 0 "[ . 1 . 2]" 1
1347 1 56 LEU HB2 1 57 SER H . . 4.220 3.855 3.689 4.010 . 0 0 "[ . 1 . 2]" 1
1348 1 56 LEU HB3 1 57 SER H . . 4.220 2.553 2.225 2.737 . 0 0 "[ . 1 . 2]" 1
1349 1 56 LEU HG 1 57 SER H . . 4.920 4.627 3.177 4.929 0.009 16 0 "[ . 1 . 2]" 1
1350 1 57 SER H 1 58 LEU HG . . 4.430 4.123 4.036 4.256 . 0 0 "[ . 1 . 2]" 1
1351 1 57 SER H 1 58 LEU MD1 . . 5.500 5.210 5.089 5.314 . 0 0 "[ . 1 . 2]" 1
1352 1 57 SER H 1 58 LEU MD2 . . 5.500 4.985 4.771 5.218 . 0 0 "[ . 1 . 2]" 1
1353 1 56 LEU H 1 57 SER QB . . 5.500 4.330 3.822 4.464 . 0 0 "[ . 1 . 2]" 1
1354 1 54 GLN QG 1 56 LEU H . . 4.620 4.142 3.921 4.414 . 0 0 "[ . 1 . 2]" 1
1355 1 56 LEU H 1 56 LEU HB2 . . 3.650 2.733 2.660 2.873 . 0 0 "[ . 1 . 2]" 1
1356 1 56 LEU H 1 56 LEU HG . . 4.850 4.635 4.202 4.738 . 0 0 "[ . 1 . 2]" 1
1357 1 56 LEU H 1 56 LEU HB3 . . 3.650 2.455 2.359 2.538 . 0 0 "[ . 1 . 2]" 1
1358 1 56 LEU H 1 58 LEU HG . . 4.730 4.778 4.743 4.806 0.076 17 0 "[ . 1 . 2]" 1
1359 1 54 GLN QG 1 55 HIS H . . 4.700 2.000 1.775 2.268 . 0 0 "[ . 1 . 2]" 1
1360 1 53 GLN HA 1 54 GLN H . . 3.410 3.162 3.062 3.328 . 0 0 "[ . 1 . 2]" 1
1361 1 53 GLN QG 1 54 GLN H . . 4.900 3.979 3.028 4.936 0.036 2 0 "[ . 1 . 2]" 1
1362 1 52 GLN QG 1 53 GLN H . . 4.330 4.223 3.927 4.383 0.053 10 0 "[ . 1 . 2]" 1
1363 1 52 GLN HB2 1 53 GLN H . . 3.230 3.089 2.591 3.259 0.029 12 0 "[ . 1 . 2]" 1
1364 1 52 GLN H 1 52 GLN HB2 . . 3.570 2.441 2.294 2.650 . 0 0 "[ . 1 . 2]" 1
1365 1 51 LYS QB 1 52 GLN H . . 3.960 3.085 2.739 3.264 . 0 0 "[ . 1 . 2]" 1
1366 1 50 PRO QD 1 51 LYS H . . 4.690 3.081 2.649 3.484 . 0 0 "[ . 1 . 2]" 1
1367 1 50 PRO QB 1 51 LYS H . . 4.510 3.074 2.604 3.423 . 0 0 "[ . 1 . 2]" 1
1368 1 50 PRO HG3 1 51 LYS H . . 4.570 4.102 3.851 4.218 . 0 0 "[ . 1 . 2]" 1
1369 1 51 LYS H 1 51 LYS QB . . 3.650 2.428 2.324 2.510 . 0 0 "[ . 1 . 2]" 1
1370 1 51 LYS H 1 51 LYS HG2 . . 4.520 3.118 2.316 3.694 . 0 0 "[ . 1 . 2]" 1
1371 1 51 LYS H 1 51 LYS HG3 . . 4.520 2.840 2.092 3.910 . 0 0 "[ . 1 . 2]" 1
1372 1 49 ASN H 1 50 PRO QD . . 4.630 4.305 4.033 4.505 . 0 0 "[ . 1 . 2]" 1
1373 1 48 GLU HB2 1 49 ASN H . . 4.750 4.283 3.681 4.523 . 0 0 "[ . 1 . 2]" 1
1374 1 48 GLU HB3 1 49 ASN H . . 4.750 4.004 3.036 4.511 . 0 0 "[ . 1 . 2]" 1
1375 1 48 GLU H 1 48 GLU QG . . 3.930 2.926 2.195 3.468 . 0 0 "[ . 1 . 2]" 1
1376 1 47 VAL HB 1 48 GLU H . . 4.130 2.064 1.892 2.517 . 0 0 "[ . 1 . 2]" 1
1377 1 47 VAL QG 1 48 GLU H . . 3.900 2.921 2.753 3.147 . 0 0 "[ . 1 . 2]" 1
1378 1 46 ALA MB 1 47 VAL H . . 3.730 3.471 2.903 3.597 . 0 0 "[ . 1 . 2]" 1
1379 1 47 VAL H 1 47 VAL QG . . 3.270 2.421 1.963 2.742 . 0 0 "[ . 1 . 2]" 1
1380 1 45 MET HA 1 46 ALA H . . 3.230 2.845 2.125 3.300 0.070 15 0 "[ . 1 . 2]" 1
1381 1 45 MET HB2 1 46 ALA H . . 4.870 3.973 3.044 4.450 . 0 0 "[ . 1 . 2]" 1
1382 1 45 MET HB3 1 46 ALA H . . 4.870 4.338 4.011 4.602 . 0 0 "[ . 1 . 2]" 1
1383 1 44 ARG HA 1 45 MET H . . 3.540 3.424 3.201 3.565 0.025 16 0 "[ . 1 . 2]" 1
1384 1 45 MET H 1 45 MET HB2 . . 4.030 2.958 2.461 3.950 . 0 0 "[ . 1 . 2]" 1
1385 1 45 MET H 1 45 MET HB3 . . 4.030 3.637 3.339 3.794 . 0 0 "[ . 1 . 2]" 1
1386 1 44 ARG HB3 1 45 MET H . . 4.560 3.767 2.791 4.312 . 0 0 "[ . 1 . 2]" 1
1387 1 44 ARG HG2 1 45 MET H . . 5.500 4.477 2.921 5.122 . 0 0 "[ . 1 . 2]" 1
1388 1 44 ARG H 1 44 ARG HB2 . . 4.160 2.720 2.420 3.762 . 0 0 "[ . 1 . 2]" 1
1389 1 41 TYR HA 1 43 LEU H . . 4.370 3.591 3.347 3.709 . 0 0 "[ . 1 . 2]" 1
1390 1 42 LYS HB2 1 43 LEU H . . 4.770 4.494 4.407 4.548 . 0 0 "[ . 1 . 2]" 1
1391 1 42 LYS HB3 1 43 LEU H . . 5.040 4.241 4.024 4.373 . 0 0 "[ . 1 . 2]" 1
1392 1 43 LEU H 1 43 LEU HB2 . . 3.780 2.533 2.386 2.649 . 0 0 "[ . 1 . 2]" 1
1393 1 42 LYS QG 1 43 LEU H . . 4.470 3.791 3.447 4.070 . 0 0 "[ . 1 . 2]" 1
1394 1 43 LEU H 1 43 LEU QD . . 4.030 2.976 2.800 3.136 . 0 0 "[ . 1 . 2]" 1
1395 1 41 TYR HB2 1 42 LYS H . . 4.520 3.929 3.806 4.168 . 0 0 "[ . 1 . 2]" 1
1396 1 40 ASP HB2 1 41 TYR H . . 3.790 3.740 3.536 3.888 0.098 9 0 "[ . 1 . 2]" 1
1397 1 40 ASP HB3 1 41 TYR H . . 3.790 3.042 2.771 3.839 0.049 16 0 "[ . 1 . 2]" 1
1398 1 41 TYR H 1 42 LYS QD . . 4.750 3.076 2.372 3.290 . 0 0 "[ . 1 . 2]" 1
1399 1 41 TYR H 1 42 LYS HA . . 4.890 4.753 4.369 4.901 0.011 1 0 "[ . 1 . 2]" 1
1400 1 39 PHE HB2 1 40 ASP H . . 4.520 4.205 3.293 4.457 . 0 0 "[ . 1 . 2]" 1
1401 1 40 ASP H 1 40 ASP HB3 . . 3.830 2.758 2.520 3.027 . 0 0 "[ . 1 . 2]" 1
1402 1 38 SER HA 1 39 PHE H . . 2.990 2.162 2.049 2.344 . 0 0 "[ . 1 . 2]" 1
1403 1 38 SER QB 1 39 PHE H . . 3.770 3.310 2.652 3.808 0.038 12 0 "[ . 1 . 2]" 1
1404 1 39 PHE H 1 39 PHE HB2 . . 3.940 2.529 2.413 2.657 . 0 0 "[ . 1 . 2]" 1
1405 1 39 PHE H 1 39 PHE HB3 . . 3.940 3.688 3.623 3.761 . 0 0 "[ . 1 . 2]" 1
1406 1 66 VAL H 1 66 VAL MG1 . . 4.020 3.786 3.756 3.816 . 0 0 "[ . 1 . 2]" 1
1407 1 66 VAL H 1 66 VAL MG2 . . 4.020 1.983 1.911 2.084 . 0 0 "[ . 1 . 2]" 1
1408 1 24 ILE MG 1 66 VAL H . . 5.440 5.183 4.941 5.343 . 0 0 "[ . 1 . 2]" 1
1409 1 66 VAL H 1 66 VAL HB . . 2.970 2.625 2.525 2.703 . 0 0 "[ . 1 . 2]" 1
1410 1 24 ILE MD 1 73 GLU H . . 4.650 4.034 3.922 4.117 . 0 0 "[ . 1 . 2]" 1
1411 1 38 SER H 1 38 SER QB . . 3.490 2.515 2.236 2.864 . 0 0 "[ . 1 . 2]" 1
1412 1 33 GLN QB 1 37 THR H . . 5.500 5.499 5.366 5.554 0.054 18 0 "[ . 1 . 2]" 1
1413 1 36 LEU HB2 1 37 THR H . . 4.200 2.933 2.692 3.102 . 0 0 "[ . 1 . 2]" 1
1414 1 36 LEU HB3 1 37 THR H . . 4.500 3.839 3.704 3.961 . 0 0 "[ . 1 . 2]" 1
1415 1 36 LEU QD 1 37 THR H . . 4.370 4.253 4.128 4.323 . 0 0 "[ . 1 . 2]" 1
1416 1 35 HIS HB2 1 36 LEU H . . 4.310 3.777 3.270 4.294 . 0 0 "[ . 1 . 2]" 1
1417 1 35 HIS HB3 1 36 LEU H . . 4.310 3.361 2.760 4.078 . 0 0 "[ . 1 . 2]" 1
1418 1 36 LEU H 1 36 LEU HB2 . . 3.530 2.462 2.373 2.540 . 0 0 "[ . 1 . 2]" 1
1419 1 36 LEU H 1 36 LEU HB3 . . 3.620 3.634 3.614 3.649 0.029 20 0 "[ . 1 . 2]" 1
1420 1 36 LEU H 1 37 THR MG . . 4.720 4.030 3.905 4.171 . 0 0 "[ . 1 . 2]" 1
1421 1 34 MET HG2 1 35 HIS H . . 3.530 2.716 2.535 3.012 . 0 0 "[ . 1 . 2]" 1
1422 1 34 MET HB3 1 35 HIS H . . 3.980 3.946 3.846 4.009 0.029 18 0 "[ . 1 . 2]" 1
1423 1 33 GLN QB 1 34 MET H . . 3.470 2.360 2.262 2.566 . 0 0 "[ . 1 . 2]" 1
1424 1 30 ASN HA 1 33 GLN H . . 3.790 3.727 3.609 3.823 0.033 4 0 "[ . 1 . 2]" 1
1425 1 32 CYS HB3 1 33 GLN H . . 3.760 2.645 2.106 3.048 . 0 0 "[ . 1 . 2]" 1
1426 1 32 CYS HB2 1 33 GLN H . . 3.900 2.999 2.761 3.326 . 0 0 "[ . 1 . 2]" 1
1427 1 33 GLN H 1 33 GLN QB . . 3.310 2.089 2.024 2.126 . 0 0 "[ . 1 . 2]" 1
1428 1 29 LEU QB 1 33 GLN H . . 4.500 3.348 3.164 3.467 . 0 0 "[ . 1 . 2]" 1
1429 1 29 LEU HA 1 32 CYS H . . 4.250 3.292 2.996 3.498 . 0 0 "[ . 1 . 2]" 1
1430 1 95 GLN H 1 96 VAL MG2 . . 4.550 3.783 3.669 3.863 . 0 0 "[ . 1 . 2]" 1
1431 1 29 LEU HA 1 31 HIS H . . 4.140 3.528 3.464 3.593 . 0 0 "[ . 1 . 2]" 1
1432 1 31 HIS H 1 31 HIS HB3 . . 3.780 2.804 2.686 2.936 . 0 0 "[ . 1 . 2]" 1
1433 1 31 HIS H 1 31 HIS HB2 . . 3.460 2.461 2.369 2.575 . 0 0 "[ . 1 . 2]" 1
1434 1 30 ASN HB2 1 31 HIS H . . 4.600 4.044 3.840 4.191 . 0 0 "[ . 1 . 2]" 1
1435 1 30 ASN HB3 1 31 HIS H . . 4.600 2.953 2.721 4.215 . 0 0 "[ . 1 . 2]" 1
1436 1 29 LEU HA 1 30 ASN H . . 3.470 3.171 3.053 3.245 . 0 0 "[ . 1 . 2]" 1
1437 1 30 ASN H 1 30 ASN HB2 . . 3.760 2.575 2.253 3.653 . 0 0 "[ . 1 . 2]" 1
1438 1 30 ASN H 1 30 ASN HB3 . . 3.760 2.590 2.440 2.761 . 0 0 "[ . 1 . 2]" 1
1439 1 30 ASN H 1 33 GLN QB . . 4.740 4.274 4.101 4.395 . 0 0 "[ . 1 . 2]" 1
1440 1 29 LEU QB 1 30 ASN H . . 3.980 3.322 3.218 3.464 . 0 0 "[ . 1 . 2]" 1
1441 1 27 GLN HA 1 29 LEU H . . 4.460 3.881 3.628 4.308 . 0 0 "[ . 1 . 2]" 1
1442 1 26 ILE HA 1 29 LEU H . . 4.100 3.189 3.062 3.331 . 0 0 "[ . 1 . 2]" 1
1443 1 28 GLN HG3 1 29 LEU H . . 4.610 2.928 2.413 3.633 . 0 0 "[ . 1 . 2]" 1
1444 1 28 GLN HG2 1 29 LEU H . . 4.290 3.114 2.765 3.414 . 0 0 "[ . 1 . 2]" 1
1445 1 29 LEU H 1 29 LEU QB . . 3.470 2.461 2.404 2.543 . 0 0 "[ . 1 . 2]" 1
1446 1 26 ILE HA 1 28 GLN H . . 4.700 3.542 3.356 3.622 . 0 0 "[ . 1 . 2]" 1
1447 1 28 GLN H 1 28 GLN HG2 . . 3.480 2.540 2.404 2.695 . 0 0 "[ . 1 . 2]" 1
1448 1 28 GLN H 1 28 GLN QB . . 3.310 2.475 2.387 2.564 . 0 0 "[ . 1 . 2]" 1
1449 1 27 GLN QB 1 28 GLN H . . 4.030 3.729 3.640 3.829 . 0 0 "[ . 1 . 2]" 1
1450 1 25 ARG QB 1 28 GLN H . . 3.910 3.661 3.505 3.761 . 0 0 "[ . 1 . 2]" 1
1451 1 25 ARG HG3 1 28 GLN H . . 5.020 2.507 2.336 2.635 . 0 0 "[ . 1 . 2]" 1
1452 1 25 ARG HA 1 27 GLN H . . 3.730 3.604 3.525 3.726 . 0 0 "[ . 1 . 2]" 1
1453 1 27 GLN H 1 27 GLN QG . . 3.170 2.129 1.904 2.651 . 0 0 "[ . 1 . 2]" 1
1454 1 27 GLN H 1 28 GLN HG2 . . 5.280 4.448 4.256 4.654 . 0 0 "[ . 1 . 2]" 1
1455 1 27 GLN H 1 27 GLN QB . . 2.860 2.561 2.456 2.814 . 0 0 "[ . 1 . 2]" 1
1456 1 26 ILE HG12 1 27 GLN H . . 4.740 4.664 4.573 4.745 0.005 20 0 "[ . 1 . 2]" 1
1457 1 26 ILE MD 1 27 GLN H . . 4.450 2.623 2.391 2.897 . 0 0 "[ . 1 . 2]" 1
1458 1 25 ARG HA 1 26 ILE H . . 2.650 2.081 2.017 2.140 . 0 0 "[ . 1 . 2]" 1
1459 1 26 ILE H 1 27 GLN QB . . 4.710 4.632 4.517 4.745 0.035 5 0 "[ . 1 . 2]" 1
1460 1 25 ARG QB 1 26 ILE H . . 3.360 3.262 3.134 3.364 0.004 18 0 "[ . 1 . 2]" 1
1461 1 26 ILE H 1 26 ILE HG12 . . 4.010 3.511 3.458 3.541 . 0 0 "[ . 1 . 2]" 1
1462 1 26 ILE H 1 26 ILE MG . . 3.210 2.367 2.211 2.534 . 0 0 "[ . 1 . 2]" 1
1463 1 26 ILE H 1 26 ILE MD . . 3.690 3.305 2.977 3.571 . 0 0 "[ . 1 . 2]" 1
1464 1 24 ILE HA 1 25 ARG H . . 2.800 2.211 2.077 2.329 . 0 0 "[ . 1 . 2]" 1
1465 1 25 ARG H 1 25 ARG QD . . 4.520 3.733 3.567 3.934 . 0 0 "[ . 1 . 2]" 1
1466 1 24 ILE HB 1 25 ARG H . . 4.120 3.904 3.755 4.029 . 0 0 "[ . 1 . 2]" 1
1467 1 25 ARG H 1 25 ARG QB . . 3.230 2.577 2.467 2.737 . 0 0 "[ . 1 . 2]" 1
1468 1 25 ARG H 1 25 ARG HG2 . . 3.820 2.086 1.962 2.226 . 0 0 "[ . 1 . 2]" 1
1469 1 24 ILE HG12 1 25 ARG H . . 5.460 5.223 5.002 5.361 . 0 0 "[ . 1 . 2]" 1
1470 1 23 GLN HA 1 24 ILE H . . 2.610 2.037 1.958 2.128 . 0 0 "[ . 1 . 2]" 1
1471 1 23 GLN QB 1 24 ILE H . . 3.550 3.371 3.147 3.575 0.025 13 0 "[ . 1 . 2]" 1
1472 1 24 ILE H 1 24 ILE HG13 . . 3.480 3.456 3.304 3.551 0.071 16 0 "[ . 1 . 2]" 1
1473 1 24 ILE H 1 24 ILE MD . . 3.270 2.037 1.824 2.262 . 0 0 "[ . 1 . 2]" 1
1474 1 22 CYS HA 1 23 GLN H . . 2.860 2.152 2.073 2.233 . 0 0 "[ . 1 . 2]" 1
1475 1 22 CYS HB2 1 23 GLN H . . 4.730 4.217 3.933 4.409 . 0 0 "[ . 1 . 2]" 1
1476 1 22 CYS HB3 1 23 GLN H . . 3.970 3.217 2.761 3.535 . 0 0 "[ . 1 . 2]" 1
1477 1 23 GLN H 1 23 GLN HG3 . . 3.820 3.061 2.707 3.305 . 0 0 "[ . 1 . 2]" 1
1478 1 23 GLN H 1 23 GLN QB . . 3.120 2.870 2.715 2.927 . 0 0 "[ . 1 . 2]" 1
1479 1 22 CYS H 1 23 GLN HA . . 5.460 5.193 4.970 5.396 . 0 0 "[ . 1 . 2]" 1
1480 1 22 CYS H 1 22 CYS HB2 . . 3.110 2.263 2.185 2.339 . 0 0 "[ . 1 . 2]" 1
1481 1 22 CYS H 1 22 CYS HB3 . . 3.510 3.507 3.477 3.533 0.023 7 0 "[ . 1 . 2]" 1
1482 1 22 CYS H 1 73 GLU QG . . 4.760 3.308 2.592 3.925 . 0 0 "[ . 1 . 2]" 1
1483 1 20 ARG HB2 1 21 GLY H . . 4.330 2.358 1.928 2.906 . 0 0 "[ . 1 . 2]" 1
1484 1 20 ARG HB3 1 21 GLY H . . 4.330 3.548 3.168 4.111 . 0 0 "[ . 1 . 2]" 1
1485 1 20 ARG QG 1 21 GLY H . . 4.190 4.160 3.957 4.321 0.131 17 0 "[ . 1 . 2]" 1
1486 1 19 PRO HG3 1 20 ARG H . . 4.540 4.443 4.241 4.583 0.043 1 0 "[ . 1 . 2]" 1
1487 1 20 ARG H 1 20 ARG HB3 . . 3.940 3.835 3.736 3.968 0.028 2 0 "[ . 1 . 2]" 1
1488 1 20 ARG H 1 20 ARG QG . . 3.800 3.449 2.903 3.762 . 0 0 "[ . 1 . 2]" 1
1489 1 17 ASP HA 1 18 ASN H . . 2.950 2.321 2.061 3.035 0.085 11 0 "[ . 1 . 2]" 1
1490 1 18 ASN H 1 18 ASN HB3 . . 3.830 3.362 2.440 3.826 . 0 0 "[ . 1 . 2]" 1
1491 1 17 ASP HB2 1 18 ASN H . . 4.850 4.246 2.642 4.513 . 0 0 "[ . 1 . 2]" 1
1492 1 17 ASP HB3 1 18 ASN H . . 4.850 4.340 3.982 4.489 . 0 0 "[ . 1 . 2]" 1
1493 1 15 GLY QA 1 17 ASP H . . 4.590 4.200 2.955 5.964 1.374 6 4 "[ .+ -1* .* 2]" 1
1494 1 16 LEU MD1 1 17 ASP H . . 4.860 3.692 2.278 4.678 . 0 0 "[ . 1 . 2]" 1
1495 1 15 GLY QA 1 16 LEU H . . 3.210 2.491 1.999 2.956 . 0 0 "[ . 1 . 2]" 1
1496 1 16 LEU H 1 16 LEU QB . . 3.110 2.914 2.394 3.393 0.283 8 0 "[ . 1 . 2]" 1
1497 1 16 LEU H 1 16 LEU MD2 . . 4.520 3.297 1.672 4.690 0.170 2 0 "[ . 1 . 2]" 1
1498 1 14 ASP HA 1 15 GLY H . . 3.150 2.751 2.050 3.514 0.364 5 0 "[ . 1 . 2]" 1
1499 1 14 ASP HB2 1 15 GLY H . . 4.790 3.824 3.470 4.455 . 0 0 "[ . 1 . 2]" 1
1500 1 14 ASP HB3 1 15 GLY H . . 4.790 3.169 1.920 4.451 . 0 0 "[ . 1 . 2]" 1
1501 1 14 ASP H 1 14 ASP HB3 . . 4.160 2.738 2.316 3.059 . 0 0 "[ . 1 . 2]" 1
1502 1 13 PRO QB 1 14 ASP H . . 4.250 3.321 2.062 3.989 . 0 0 "[ . 1 . 2]" 1
1503 1 13 PRO QD 1 14 ASP H . . 4.630 3.108 2.475 4.173 . 0 0 "[ . 1 . 2]" 1
1504 1 11 CYS HA 1 12 PHE H . . 2.800 2.066 2.003 2.196 . 0 0 "[ . 1 . 2]" 1
1505 1 3 CYS HA 1 12 PHE H . . 3.720 3.225 2.952 3.485 . 0 0 "[ . 1 . 2]" 1
1506 1 12 PHE H 1 12 PHE QB . . 2.930 2.308 2.219 2.461 . 0 0 "[ . 1 . 2]" 1
1507 1 10 ILE HA 1 11 CYS H . . 2.700 2.175 2.118 2.246 . 0 0 "[ . 1 . 2]" 1
1508 1 11 CYS H 1 11 CYS QB . . 3.130 2.517 2.442 2.578 . 0 0 "[ . 1 . 2]" 1
1509 1 10 ILE HB 1 11 CYS H . . 4.590 4.253 4.132 4.355 . 0 0 "[ . 1 . 2]" 1
1510 1 9 PRO HA 1 10 ILE H . . 2.850 2.203 2.110 2.309 . 0 0 "[ . 1 . 2]" 1
1511 1 9 PRO QB 1 10 ILE H . . 3.880 3.029 2.766 3.285 . 0 0 "[ . 1 . 2]" 1
1512 1 10 ILE H 1 10 ILE HG12 . . 4.270 2.382 2.243 2.674 . 0 0 "[ . 1 . 2]" 1
1513 1 10 ILE H 1 10 ILE HG13 . . 4.270 3.808 3.717 4.041 . 0 0 "[ . 1 . 2]" 1
1514 1 10 ILE H 1 10 ILE MD . . 4.680 3.341 3.216 3.488 . 0 0 "[ . 1 . 2]" 1
1515 1 10 ILE H 1 10 ILE MG . . 4.240 3.783 3.747 3.819 . 0 0 "[ . 1 . 2]" 1
1516 1 6 SER HA 1 7 ILE H . . 3.170 2.439 2.303 2.524 . 0 0 "[ . 1 . 2]" 1
1517 1 6 SER HB2 1 7 ILE H . . 3.850 3.652 2.546 3.892 0.042 5 0 "[ . 1 . 2]" 1
1518 1 7 ILE H 1 7 ILE HB . . 3.290 2.711 2.637 2.790 . 0 0 "[ . 1 . 2]" 1
1519 1 7 ILE H 1 7 ILE HG12 . . 4.680 3.639 2.966 4.581 . 0 0 "[ . 1 . 2]" 1
1520 1 7 ILE H 1 7 ILE HG13 . . 4.680 3.781 2.914 4.393 . 0 0 "[ . 1 . 2]" 1
1521 1 7 ILE H 1 7 ILE MG . . 4.520 3.866 3.831 3.911 . 0 0 "[ . 1 . 2]" 1
1522 1 7 ILE H 1 7 ILE MD . . 4.780 3.802 2.495 4.245 . 0 0 "[ . 1 . 2]" 1
1523 1 5 LYS HA 1 6 SER H . . 3.110 2.321 2.172 2.479 . 0 0 "[ . 1 . 2]" 1
1524 1 6 SER H 1 9 PRO HA . . 4.020 2.926 2.722 3.149 . 0 0 "[ . 1 . 2]" 1
1525 1 6 SER H 1 6 SER HB2 . . 4.110 3.275 2.648 3.790 . 0 0 "[ . 1 . 2]" 1
1526 1 6 SER H 1 6 SER HB3 . . 4.110 3.008 2.661 3.892 . 0 0 "[ . 1 . 2]" 1
1527 1 6 SER H 1 9 PRO QB . . 4.490 3.136 2.743 3.404 . 0 0 "[ . 1 . 2]" 1
1528 1 5 LYS HB2 1 6 SER H . . 4.820 4.447 4.316 4.535 . 0 0 "[ . 1 . 2]" 1
1529 1 5 LYS HB3 1 6 SER H . . 4.820 4.195 4.075 4.275 . 0 0 "[ . 1 . 2]" 1
1530 1 4 THR HB 1 5 LYS H . . 3.240 2.669 2.297 2.999 . 0 0 "[ . 1 . 2]" 1
1531 1 4 THR HA 1 5 LYS H . . 2.780 2.349 2.223 2.511 . 0 0 "[ . 1 . 2]" 1
1532 1 5 LYS H 1 5 LYS HD3 . . 4.440 3.086 1.992 4.504 0.064 13 0 "[ . 1 . 2]" 1
1533 1 5 LYS H 1 5 LYS HB3 . . 3.780 3.646 3.593 3.718 . 0 0 "[ . 1 . 2]" 1
1534 1 5 LYS H 1 5 LYS HB2 . . 3.780 2.510 2.357 2.606 . 0 0 "[ . 1 . 2]" 1
1535 1 3 CYS HA 1 4 THR H . . 2.970 2.218 2.116 2.345 . 0 0 "[ . 1 . 2]" 1
1536 1 4 THR H 1 11 CYS HA . . 3.830 3.520 3.254 3.833 0.003 1 0 "[ . 1 . 2]" 1
1537 1 4 THR H 1 10 ILE HA . . 5.360 4.504 4.369 4.591 . 0 0 "[ . 1 . 2]" 1
1538 1 3 CYS HB3 1 4 THR H . . 4.070 2.843 2.546 3.359 . 0 0 "[ . 1 . 2]" 1
1539 1 3 CYS HB2 1 4 THR H . . 3.780 3.813 3.666 3.944 0.164 20 0 "[ . 1 . 2]" 1
1540 1 4 THR H 1 10 ILE HB . . 4.090 3.218 2.981 3.368 . 0 0 "[ . 1 . 2]" 1
1541 1 4 THR H 1 4 THR MG . . 3.020 2.256 2.153 2.407 . 0 0 "[ . 1 . 2]" 1
1542 1 2 ARG HA 1 3 CYS H . . 2.820 2.147 2.026 2.420 . 0 0 "[ . 1 . 2]" 1
1543 1 2 ARG QD 1 3 CYS H . . 5.260 4.449 3.408 5.330 0.070 4 0 "[ . 1 . 2]" 1
1544 1 3 CYS H 1 3 CYS HB2 . . 3.880 2.767 2.603 3.143 . 0 0 "[ . 1 . 2]" 1
1545 1 2 ARG HB2 1 3 CYS H . . 4.520 3.950 3.633 4.192 . 0 0 "[ . 1 . 2]" 1
1546 1 2 ARG HB3 1 3 CYS H . . 4.520 2.941 2.361 3.220 . 0 0 "[ . 1 . 2]" 1
1547 1 1 GLY QA 1 2 ARG H . . 3.280 2.211 2.070 2.311 . 0 0 "[ . 1 . 2]" 1
1548 1 2 ARG H 1 2 ARG HG3 . . 4.080 3.128 2.175 3.970 . 0 0 "[ . 1 . 2]" 1
1549 1 2 ARG H 1 2 ARG HB2 . . 3.710 2.506 2.383 2.635 . 0 0 "[ . 1 . 2]" 1
1550 1 110 CYS H 1 111 ASN H . . 3.330 2.367 2.192 2.575 . 0 0 "[ . 1 . 2]" 1
1551 1 105 MET H 1 106 LEU H . . 3.240 2.195 2.105 2.354 . 0 0 "[ . 1 . 2]" 1
1552 1 103 ALA H 1 104 GLN H . . 3.460 2.592 2.495 2.830 . 0 0 "[ . 1 . 2]" 1
1553 1 100 VAL H 1 102 LYS H . . 4.630 4.202 4.130 4.322 . 0 0 "[ . 1 . 2]" 1
1554 1 100 VAL H 1 101 LYS H . . 3.740 2.732 2.631 2.819 . 0 0 "[ . 1 . 2]" 1
1555 1 95 GLN H 1 96 VAL H . . 3.100 2.288 2.206 2.392 . 0 0 "[ . 1 . 2]" 1
1556 1 94 GLN H 1 95 GLN H . . 3.200 2.544 2.462 2.666 . 0 0 "[ . 1 . 2]" 1
1557 1 93 GLN H 1 95 GLN H . . 4.680 4.371 4.199 4.547 . 0 0 "[ . 1 . 2]" 1
1558 1 89 GLY H 1 90 GLN H . . 3.800 3.330 2.415 3.903 0.103 16 0 "[ . 1 . 2]" 1
1559 1 81 GLN H 1 83 GLN H . . 4.250 4.164 3.969 4.268 0.018 4 0 "[ . 1 . 2]" 1
1560 1 83 GLN H 1 85 GLN H . . 4.560 4.008 3.922 4.185 . 0 0 "[ . 1 . 2]" 1
1561 1 80 GLU H 1 81 GLN H . . 3.230 2.805 2.662 2.930 . 0 0 "[ . 1 . 2]" 1
1562 1 79 VAL H 1 80 GLU H . . 3.310 2.468 2.356 2.604 . 0 0 "[ . 1 . 2]" 1
1563 1 78 VAL H 1 79 VAL H . . 3.160 2.710 2.624 2.778 . 0 0 "[ . 1 . 2]" 1
1564 1 75 ILE H 1 76 LYS H . . 3.630 2.449 2.375 2.541 . 0 0 "[ . 1 . 2]" 1
1565 1 74 ALA H 1 75 ILE H . . 3.420 2.589 2.524 2.673 . 0 0 "[ . 1 . 2]" 1
1566 1 71 GLN H 1 72 CYS H . . 3.620 2.774 2.643 2.958 . 0 0 "[ . 1 . 2]" 1
1567 1 70 CYS H 1 71 GLN H . . 2.930 2.069 1.889 2.187 . 0 0 "[ . 1 . 2]" 1
1568 1 69 GLN H 1 71 GLN H . . 4.390 3.903 3.754 4.056 . 0 0 "[ . 1 . 2]" 1
1569 1 58 LEU H 1 59 CYS H . . 3.600 2.534 2.445 2.695 . 0 0 "[ . 1 . 2]" 1
1570 1 57 SER H 1 58 LEU H . . 3.770 2.668 2.589 2.733 . 0 0 "[ . 1 . 2]" 1
1571 1 56 LEU H 1 57 SER H . . 3.780 2.383 2.139 2.529 . 0 0 "[ . 1 . 2]" 1
1572 1 54 GLN H 1 55 HIS H . . 3.980 2.717 2.484 2.879 . 0 0 "[ . 1 . 2]" 1
1573 1 51 LYS H 1 52 GLN H . . 3.930 2.591 2.413 2.755 . 0 0 "[ . 1 . 2]" 1
1574 1 47 VAL H 1 48 GLU H . . 3.970 2.407 2.057 2.735 . 0 0 "[ . 1 . 2]" 1
1575 1 37 THR H 1 38 SER H . . 3.460 2.361 2.240 2.514 . 0 0 "[ . 1 . 2]" 1
1576 1 102 LYS H 1 105 MET H . . 5.500 5.038 4.728 5.361 . 0 0 "[ . 1 . 2]" 1
1577 1 31 HIS H 1 32 CYS H . . 3.230 2.625 2.473 2.795 . 0 0 "[ . 1 . 2]" 1
1578 1 29 LEU H 1 30 ASN H . . 2.980 2.281 2.187 2.404 . 0 0 "[ . 1 . 2]" 1
1579 1 28 GLN H 1 30 ASN H . . 3.910 3.706 3.492 3.839 . 0 0 "[ . 1 . 2]" 1
1580 1 27 GLN H 1 29 LEU H . . 4.330 3.917 3.799 4.072 . 0 0 "[ . 1 . 2]" 1
1581 1 27 GLN H 1 28 GLN H . . 3.290 2.454 2.395 2.528 . 0 0 "[ . 1 . 2]" 1
1582 1 26 ILE H 1 27 GLN H . . 3.390 2.608 2.477 2.709 . 0 0 "[ . 1 . 2]" 1
1583 1 24 ILE H 1 25 ARG H . . 4.590 4.386 4.250 4.512 . 0 0 "[ . 1 . 2]" 1
1584 1 21 GLY H 1 22 CYS H . . 3.770 2.451 2.000 3.274 . 0 0 "[ . 1 . 2]" 1
1585 1 12 PHE H 1 12 PHE QD . . 3.750 2.858 2.487 3.348 . 0 0 "[ . 1 . 2]" 1
1586 1 4 THR H 1 10 ILE H . . 3.530 2.611 2.394 2.811 . 0 0 "[ . 1 . 2]" 1
1587 1 3 CYS H 1 4 THR H . . 4.830 4.335 4.132 4.442 . 0 0 "[ . 1 . 2]" 1
1588 1 4 THR H 1 11 CYS H . . 5.260 4.757 4.659 4.866 . 0 0 "[ . 1 . 2]" 1
1589 1 107 PRO HB3 1 116 ILE H . . 5.500 5.115 4.656 5.439 . 0 0 "[ . 1 . 2]" 1
1590 1 107 PRO HG2 1 116 ILE H . . 4.990 2.834 2.408 3.239 . 0 0 "[ . 1 . 2]" 1
1591 1 72 CYS HB3 1 113 GLN H . . 5.010 3.649 3.421 3.846 . 0 0 "[ . 1 . 2]" 1
1592 1 112 LEU H 1 113 GLN H . . 4.700 4.526 4.462 4.571 . 0 0 "[ . 1 . 2]" 1
1593 1 110 CYS HA 1 112 LEU H . . 5.270 5.259 4.995 5.320 0.050 17 0 "[ . 1 . 2]" 1
1594 1 110 CYS HB2 1 112 LEU H . . 5.170 5.164 4.217 5.287 0.117 18 0 "[ . 1 . 2]" 1
1595 1 108 ASN HA 1 110 CYS H . . 5.040 4.617 4.300 4.880 . 0 0 "[ . 1 . 2]" 1
1596 1 106 LEU HB3 1 110 CYS H . . 5.030 4.620 4.294 5.010 . 0 0 "[ . 1 . 2]" 1
1597 1 110 CYS H 1 111 ASN HB2 . . 5.410 5.299 5.168 5.456 0.046 20 0 "[ . 1 . 2]" 1
1598 1 107 PRO HD2 1 109 GLN H . . 5.470 4.629 4.491 4.765 . 0 0 "[ . 1 . 2]" 1
1599 1 106 LEU HB3 1 109 GLN H . . 5.500 5.267 5.126 5.404 . 0 0 "[ . 1 . 2]" 1
1600 1 107 PRO HB2 1 109 GLN H . . 5.500 5.466 5.197 5.529 0.029 18 0 "[ . 1 . 2]" 1
1601 1 105 MET HB2 1 109 GLN H . . 5.110 4.732 4.603 4.942 . 0 0 "[ . 1 . 2]" 1
1602 1 106 LEU H 1 108 ASN H . . 4.670 4.155 4.055 4.283 . 0 0 "[ . 1 . 2]" 1
1603 1 108 ASN H 1 112 LEU MD1 . . 5.050 4.889 4.808 4.982 . 0 0 "[ . 1 . 2]" 1
1604 1 102 LYS HA 1 106 LEU H . . 5.450 4.857 4.542 5.315 . 0 0 "[ . 1 . 2]" 1
1605 1 105 MET H 1 107 PRO HD2 . . 4.890 3.676 3.531 3.923 . 0 0 "[ . 1 . 2]" 1
1606 1 105 MET H 1 109 GLN QG . . 5.480 5.213 4.779 5.492 0.012 17 0 "[ . 1 . 2]" 1
1607 1 101 LYS QD 1 105 MET H . . 5.500 5.092 4.661 5.612 0.112 6 0 "[ . 1 . 2]" 1
1608 1 104 GLN H 1 105 MET HG3 . . 5.060 3.708 3.458 4.048 . 0 0 "[ . 1 . 2]" 1
1609 1 104 GLN H 1 105 MET HG2 . . 5.060 5.042 4.851 5.094 0.034 14 0 "[ . 1 . 2]" 1
1610 1 100 VAL HA 1 104 GLN H . . 5.500 5.339 5.111 5.508 0.008 4 0 "[ . 1 . 2]" 1
1611 1 101 LYS QB 1 103 ALA H . . 5.300 4.923 4.831 5.060 . 0 0 "[ . 1 . 2]" 1
1612 1 35 HIS H 1 37 THR MG . . 5.500 5.381 5.213 5.531 0.031 17 0 "[ . 1 . 2]" 1
1613 1 102 LYS H 1 102 LYS HE3 . . 5.500 4.737 4.565 5.516 0.016 8 0 "[ . 1 . 2]" 1
1614 1 31 HIS HB3 1 34 MET H . . 5.500 5.516 5.349 5.573 0.073 16 0 "[ . 1 . 2]" 1
1615 1 101 LYS H 1 101 LYS QD . . 4.760 3.990 3.723 4.315 . 0 0 "[ . 1 . 2]" 1
1616 1 100 VAL H 1 102 LYS QD . . 5.500 4.916 4.724 5.527 0.027 8 0 "[ . 1 . 2]" 1
1617 1 36 LEU HB3 1 99 MET H . . 5.500 5.231 5.107 5.351 . 0 0 "[ . 1 . 2]" 1
1618 1 95 GLN HG2 1 97 GLN H . . 5.300 4.834 4.657 4.964 . 0 0 "[ . 1 . 2]" 1
1619 1 94 GLN QG 1 97 GLN H . . 4.770 4.874 4.837 4.914 0.144 2 0 "[ . 1 . 2]" 1
1620 1 92 GLY HA2 1 96 VAL H . . 4.600 3.553 3.281 3.650 . 0 0 "[ . 1 . 2]" 1
1621 1 95 GLN H 1 96 VAL HA . . 5.500 4.995 4.925 5.104 . 0 0 "[ . 1 . 2]" 1
1622 1 94 GLN H 1 97 GLN HB2 . . 5.500 4.899 4.624 5.114 . 0 0 "[ . 1 . 2]" 1
1623 1 91 GLY HA2 1 93 GLN H . . 4.390 3.406 3.078 3.697 . 0 0 "[ . 1 . 2]" 1
1624 1 92 GLY H 1 95 GLN HB3 . . 5.500 5.581 5.546 5.637 0.137 12 0 "[ . 1 . 2]" 1
1625 1 86 LEU MD1 1 92 GLY H . . 5.500 4.045 3.487 4.448 . 0 0 "[ . 1 . 2]" 1
1626 1 92 GLY H 1 96 VAL MG2 . . 5.500 4.810 4.455 4.953 . 0 0 "[ . 1 . 2]" 1
1627 1 86 LEU HB3 1 92 GLY H . . 5.500 4.994 4.481 5.465 . 0 0 "[ . 1 . 2]" 1
1628 1 89 GLY H 1 91 GLY H . . 5.090 3.948 3.070 5.115 0.025 3 0 "[ . 1 . 2]" 1
1629 1 86 LEU HB3 1 91 GLY H . . 5.500 4.320 3.684 5.446 . 0 0 "[ . 1 . 2]" 1
1630 1 86 LEU MD1 1 91 GLY H . . 5.330 3.459 3.009 3.978 . 0 0 "[ . 1 . 2]" 1
1631 1 84 LYS QB 1 88 GLN H . . 5.150 4.814 4.512 5.167 0.017 3 0 "[ . 1 . 2]" 1
1632 1 86 LEU MD1 1 88 GLN H . . 5.500 5.534 5.469 5.581 0.081 3 0 "[ . 1 . 2]" 1
1633 1 84 LYS H 1 86 LEU H . . 4.540 4.119 3.912 4.196 . 0 0 "[ . 1 . 2]" 1
1634 1 84 LYS QD 1 86 LEU H . . 4.950 4.629 4.432 5.023 0.073 3 0 "[ . 1 . 2]" 1
1635 1 37 THR MG 1 85 GLN H . . 5.090 4.755 4.522 4.964 . 0 0 "[ . 1 . 2]" 1
1636 1 37 THR MG 1 83 GLN H . . 5.370 4.533 4.248 4.706 . 0 0 "[ . 1 . 2]" 1
1637 1 83 GLN H 1 84 LYS QD . . 5.500 5.455 4.064 5.585 0.085 12 0 "[ . 1 . 2]" 1
1638 1 83 GLN H 1 86 LEU HB2 . . 5.500 5.470 5.341 5.552 0.052 20 0 "[ . 1 . 2]" 1
1639 1 80 GLU H 1 82 ALA H . . 4.890 4.076 3.954 4.242 . 0 0 "[ . 1 . 2]" 1
1640 1 37 THR MG 1 82 ALA H . . 4.820 4.635 4.508 4.724 . 0 0 "[ . 1 . 2]" 1
1641 1 78 VAL MG2 1 81 GLN H . . 5.500 5.503 5.427 5.541 0.041 10 0 "[ . 1 . 2]" 1
1642 1 79 VAL HA 1 81 GLN H . . 4.910 4.611 4.399 4.859 . 0 0 "[ . 1 . 2]" 1
1643 1 56 LEU HA 1 61 ASN H . . 5.500 5.464 5.042 5.565 0.065 2 0 "[ . 1 . 2]" 1
1644 1 77 GLN HA 1 79 VAL H . . 4.680 4.335 4.227 4.470 . 0 0 "[ . 1 . 2]" 1
1645 1 76 LYS QG 1 77 GLN H . . 4.900 3.591 3.377 3.812 . 0 0 "[ . 1 . 2]" 1
1646 1 72 CYS HA 1 76 LYS H . . 5.120 5.037 4.837 5.156 0.036 17 0 "[ . 1 . 2]" 1
1647 1 71 GLN HA 1 75 ILE H . . 5.500 5.124 4.919 5.290 . 0 0 "[ . 1 . 2]" 1
1648 1 75 ILE H 1 76 LYS HA . . 5.500 5.063 4.990 5.142 . 0 0 "[ . 1 . 2]" 1
1649 1 72 CYS HB3 1 75 ILE H . . 5.500 5.406 5.295 5.532 0.032 20 0 "[ . 1 . 2]" 1
1650 1 72 CYS HB2 1 75 ILE H . . 5.380 4.803 4.687 4.943 . 0 0 "[ . 1 . 2]" 1
1651 1 75 ILE H 1 76 LYS QD . . 4.880 4.782 4.422 4.966 0.086 8 0 "[ . 1 . 2]" 1
1652 1 75 ILE H 1 76 LYS QG . . 4.980 3.661 3.455 3.882 . 0 0 "[ . 1 . 2]" 1
1653 1 24 ILE HB 1 74 ALA H . . 5.470 4.786 4.533 4.966 . 0 0 "[ . 1 . 2]" 1
1654 1 74 ALA H 1 76 LYS QG . . 4.770 4.623 4.385 4.884 0.114 16 0 "[ . 1 . 2]" 1
1655 1 74 ALA H 1 77 GLN HG3 . . 4.840 4.362 4.114 4.561 . 0 0 "[ . 1 . 2]" 1
1656 1 72 CYS HB2 1 74 ALA H . . 5.500 5.470 5.367 5.535 0.035 3 0 "[ . 1 . 2]" 1
1657 1 70 CYS HB3 1 74 ALA H . . 4.630 4.482 4.390 4.578 . 0 0 "[ . 1 . 2]" 1
1658 1 74 ALA H 1 75 ILE HA . . 5.230 5.184 5.126 5.234 0.004 11 0 "[ . 1 . 2]" 1
1659 1 73 GLU H 1 74 ALA H . . 3.300 2.507 2.430 2.588 . 0 0 "[ . 1 . 2]" 1
1660 1 72 CYS HA 1 74 ALA H . . 4.800 3.943 3.866 4.058 . 0 0 "[ . 1 . 2]" 1
1661 1 71 GLN HA 1 73 GLU H . . 4.990 4.193 4.038 4.299 . 0 0 "[ . 1 . 2]" 1
1662 1 73 GLU H 1 75 ILE MD . . 5.500 5.439 5.381 5.519 0.019 4 0 "[ . 1 . 2]" 1
1663 1 73 GLU H 1 76 LYS QG . . 5.500 4.442 4.199 4.794 . 0 0 "[ . 1 . 2]" 1
1664 1 72 CYS H 1 112 LEU MD1 . . 4.690 3.409 3.220 3.597 . 0 0 "[ . 1 . 2]" 1
1665 1 72 CYS H 1 74 ALA MB . . 5.500 4.738 4.626 4.851 . 0 0 "[ . 1 . 2]" 1
1666 1 72 CYS H 1 73 GLU HA . . 5.210 4.926 4.871 5.024 . 0 0 "[ . 1 . 2]" 1
1667 1 71 GLN H 1 72 CYS HA . . 5.500 5.303 5.215 5.399 . 0 0 "[ . 1 . 2]" 1
1668 1 67 GLU HA 1 71 GLN H . . 5.410 5.329 5.168 5.433 0.023 3 0 "[ . 1 . 2]" 1
1669 1 67 GLU HB2 1 71 GLN H . . 4.940 4.616 4.367 4.969 0.029 11 0 "[ . 1 . 2]" 1
1670 1 67 GLU HA 1 70 CYS H . . 5.290 4.477 4.402 4.549 . 0 0 "[ . 1 . 2]" 1
1671 1 68 LYS HG3 1 70 CYS H . . 5.500 4.832 4.377 5.238 . 0 0 "[ . 1 . 2]" 1
1672 1 24 ILE MD 1 70 CYS H . . 5.500 5.447 5.326 5.563 0.063 16 0 "[ . 1 . 2]" 1
1673 1 69 GLN H 1 70 CYS HA . . 5.080 5.011 4.841 5.084 0.004 16 0 "[ . 1 . 2]" 1
1674 1 68 LYS H 1 69 GLN HA . . 5.390 5.347 5.259 5.423 0.033 12 0 "[ . 1 . 2]" 1
1675 1 68 LYS H 1 71 GLN H . . 5.310 4.813 4.621 4.973 . 0 0 "[ . 1 . 2]" 1
1676 1 67 GLU H 1 70 CYS HB3 . . 4.740 4.578 4.346 4.763 0.023 2 0 "[ . 1 . 2]" 1
1677 1 24 ILE MG 1 67 GLU H . . 5.500 5.471 5.368 5.540 0.040 16 0 "[ . 1 . 2]" 1
1678 1 66 VAL H 1 74 ALA MB . . 5.460 5.423 5.251 5.508 0.048 4 0 "[ . 1 . 2]" 1
1679 1 63 LEU HB2 1 66 VAL H . . 5.420 5.093 4.925 5.223 . 0 0 "[ . 1 . 2]" 1
1680 1 111 ASN H 1 112 LEU HG . . 4.410 3.610 3.463 3.790 . 0 0 "[ . 1 . 2]" 1
1681 1 64 GLN H 1 71 GLN HA . . 5.500 5.549 5.489 5.581 0.081 17 0 "[ . 1 . 2]" 1
1682 1 60 CYS HA 1 64 GLN H . . 5.040 3.980 3.871 4.121 . 0 0 "[ . 1 . 2]" 1
1683 1 63 LEU H 1 66 VAL H . . 5.500 5.340 5.222 5.499 . 0 0 "[ . 1 . 2]" 1
1684 1 63 LEU H 1 74 ALA MB . . 5.500 5.132 4.927 5.418 . 0 0 "[ . 1 . 2]" 1
1685 1 62 GLN H 1 62 GLN HB2 . . 3.230 2.617 2.436 2.725 . 0 0 "[ . 1 . 2]" 1
1686 1 78 VAL HA 1 80 GLU H . . 4.970 4.597 4.505 4.660 . 0 0 "[ . 1 . 2]" 1
1687 1 56 LEU MD1 1 61 ASN H . . 5.500 4.794 4.677 4.975 . 0 0 "[ . 1 . 2]" 1
1688 1 60 CYS H 1 63 LEU HB3 . . 5.500 5.556 5.518 5.584 0.084 2 0 "[ . 1 . 2]" 1
1689 1 56 LEU HB2 1 60 CYS H . . 5.500 5.265 5.084 5.455 . 0 0 "[ . 1 . 2]" 1
1690 1 56 LEU HG 1 60 CYS H . . 5.500 5.265 3.510 5.633 0.133 7 0 "[ . 1 . 2]" 1
1691 1 56 LEU HB3 1 60 CYS H . . 5.500 5.272 5.210 5.333 . 0 0 "[ . 1 . 2]" 1
1692 1 58 LEU HB2 1 60 CYS H . . 5.500 5.072 4.916 5.228 . 0 0 "[ . 1 . 2]" 1
1693 1 58 LEU H 1 60 CYS H . . 4.870 4.140 3.987 4.301 . 0 0 "[ . 1 . 2]" 1
1694 1 59 CYS H 1 61 ASN H . . 4.730 3.991 3.892 4.073 . 0 0 "[ . 1 . 2]" 1
1695 1 55 HIS HA 1 57 SER H . . 5.270 4.399 4.168 4.603 . 0 0 "[ . 1 . 2]" 1
1696 1 53 GLN HA 1 57 SER H . . 5.500 4.609 3.971 5.504 0.004 8 0 "[ . 1 . 2]" 1
1697 1 54 GLN HA 1 57 SER H . . 5.110 3.473 3.250 3.730 . 0 0 "[ . 1 . 2]" 1
1698 1 54 GLN QG 1 57 SER H . . 5.270 5.181 5.002 5.296 0.026 8 0 "[ . 1 . 2]" 1
1699 1 53 GLN HA 1 56 LEU H . . 4.930 3.231 2.784 3.599 . 0 0 "[ . 1 . 2]" 1
1700 1 54 GLN HA 1 56 LEU H . . 4.740 3.976 3.770 4.258 . 0 0 "[ . 1 . 2]" 1
1701 1 56 LEU H 1 59 CYS HB3 . . 5.500 5.025 4.904 5.274 . 0 0 "[ . 1 . 2]" 1
1702 1 55 HIS H 1 56 LEU HB3 . . 5.430 4.789 4.440 5.072 . 0 0 "[ . 1 . 2]" 1
1703 1 55 HIS H 1 56 LEU HB2 . . 5.430 4.969 4.765 5.320 . 0 0 "[ . 1 . 2]" 1
1704 1 53 GLN H 1 54 GLN H . . 4.120 2.492 2.051 2.739 . 0 0 "[ . 1 . 2]" 1
1705 1 51 LYS QB 1 53 GLN H . . 5.500 4.601 4.424 4.777 . 0 0 "[ . 1 . 2]" 1
1706 1 51 LYS H 1 51 LYS QD . . 4.740 3.818 3.490 4.207 . 0 0 "[ . 1 . 2]" 1
1707 1 46 ALA MB 1 48 GLU H . . 5.500 5.040 3.866 5.504 0.004 1 0 "[ . 1 . 2]" 1
1708 1 43 LEU QD 1 46 ALA H . . 5.160 4.246 3.731 5.016 . 0 0 "[ . 1 . 2]" 1
1709 1 46 ALA H 1 47 VAL QG . . 5.500 3.417 2.714 4.526 . 0 0 "[ . 1 . 2]" 1
1710 1 44 ARG QD 1 45 MET H . . 5.500 4.731 4.177 5.342 . 0 0 "[ . 1 . 2]" 1
1711 1 43 LEU QD 1 44 ARG H . . 5.020 3.989 3.686 4.334 . 0 0 "[ . 1 . 2]" 1
1712 1 40 ASP HB2 1 43 LEU H . . 5.240 5.156 3.751 5.276 0.036 15 0 "[ . 1 . 2]" 1
1713 1 40 ASP HB3 1 43 LEU H . . 5.240 3.637 3.371 5.288 0.048 16 0 "[ . 1 . 2]" 1
1714 1 41 TYR HB2 1 43 LEU H . . 5.500 5.085 4.974 5.201 . 0 0 "[ . 1 . 2]" 1
1715 1 40 ASP HA 1 43 LEU H . . 5.270 5.248 4.839 5.355 0.085 4 0 "[ . 1 . 2]" 1
1716 1 36 LEU HB3 1 38 SER H . . 5.350 5.334 5.062 5.391 0.041 13 0 "[ . 1 . 2]" 1
1717 1 36 LEU QD 1 38 SER H . . 5.240 5.154 4.785 5.282 0.042 1 0 "[ . 1 . 2]" 1
1718 1 33 GLN HA 1 37 THR H . . 5.060 4.395 4.142 4.530 . 0 0 "[ . 1 . 2]" 1
1719 1 37 THR H 1 99 MET QG . . 5.130 4.676 4.509 5.005 . 0 0 "[ . 1 . 2]" 1
1720 1 33 GLN HG3 1 37 THR H . . 5.310 5.321 4.960 5.370 0.060 6 0 "[ . 1 . 2]" 1
1721 1 36 LEU H 1 99 MET QG . . 5.500 4.548 4.350 4.997 . 0 0 "[ . 1 . 2]" 1
1722 1 33 GLN HG2 1 36 LEU H . . 5.500 5.243 5.058 5.446 . 0 0 "[ . 1 . 2]" 1
1723 1 33 GLN HA 1 36 LEU H . . 4.760 3.966 3.858 4.052 . 0 0 "[ . 1 . 2]" 1
1724 1 32 CYS HA 1 36 LEU H . . 5.080 4.140 3.841 4.541 . 0 0 "[ . 1 . 2]" 1
1725 1 32 CYS H 1 33 GLN HA . . 5.330 5.344 5.312 5.360 0.030 9 0 "[ . 1 . 2]" 1
1726 1 26 ILE HA 1 30 ASN H . . 5.020 4.854 4.527 5.051 0.031 9 0 "[ . 1 . 2]" 1
1727 1 26 ILE HB 1 30 ASN H . . 5.500 5.454 5.146 5.554 0.054 10 0 "[ . 1 . 2]" 1
1728 1 25 ARG QB 1 29 LEU H . . 5.500 5.517 5.425 5.560 0.060 20 0 "[ . 1 . 2]" 1
1729 1 26 ILE HB 1 29 LEU H . . 5.500 4.735 4.556 4.977 . 0 0 "[ . 1 . 2]" 1
1730 1 28 GLN H 1 29 LEU HA . . 5.320 4.896 4.796 4.969 . 0 0 "[ . 1 . 2]" 1
1731 1 27 GLN H 1 28 GLN QB . . 4.360 4.416 4.389 4.441 0.081 13 0 "[ . 1 . 2]" 1
1732 1 25 ARG QD 1 27 GLN H . . 5.220 4.417 4.234 4.548 . 0 0 "[ . 1 . 2]" 1
1733 1 27 GLN H 1 28 GLN HA . . 5.150 5.004 4.935 5.062 . 0 0 "[ . 1 . 2]" 1
1734 1 26 ILE H 1 28 GLN H . . 4.780 4.275 4.219 4.341 . 0 0 "[ . 1 . 2]" 1
1735 1 26 ILE H 1 27 GLN HA . . 5.360 5.130 5.004 5.212 . 0 0 "[ . 1 . 2]" 1
1736 1 25 ARG QD 1 26 ILE H . . 5.400 5.384 5.197 5.478 0.078 10 0 "[ . 1 . 2]" 1
1737 1 26 ILE H 1 27 GLN QG . . 5.310 4.049 3.758 4.770 . 0 0 "[ . 1 . 2]" 1
1738 1 25 ARG H 1 28 GLN HG2 . . 4.790 3.752 3.441 4.066 . 0 0 "[ . 1 . 2]" 1
1739 1 25 ARG H 1 26 ILE HA . . 5.500 5.297 5.187 5.397 . 0 0 "[ . 1 . 2]" 1
1740 1 22 CYS HB3 1 24 ILE H . . 5.000 4.584 4.056 4.893 . 0 0 "[ . 1 . 2]" 1
1741 1 24 ILE H 1 77 GLN HG3 . . 5.500 4.283 3.236 5.044 . 0 0 "[ . 1 . 2]" 1
1742 1 23 GLN H 1 70 CYS HB3 . . 5.500 4.775 4.262 5.178 . 0 0 "[ . 1 . 2]" 1
1743 1 23 GLN H 1 24 ILE HA . . 5.500 4.856 4.637 5.048 . 0 0 "[ . 1 . 2]" 1
1744 1 22 CYS H 1 23 GLN H . . 4.550 4.464 4.309 4.534 . 0 0 "[ . 1 . 2]" 1
1745 1 20 ARG HA 1 22 CYS H . . 5.500 4.944 3.533 5.556 0.056 10 0 "[ . 1 . 2]" 1
1746 1 22 CYS H 1 73 GLU HB2 . . 5.500 4.732 4.006 5.460 . 0 0 "[ . 1 . 2]" 1
1747 1 22 CYS H 1 24 ILE MD . . 4.720 4.066 3.551 4.536 . 0 0 "[ . 1 . 2]" 1
1748 1 19 PRO QB 1 21 GLY H . . 5.290 4.657 4.103 5.308 0.018 15 0 "[ . 1 . 2]" 1
1749 1 21 GLY H 1 22 CYS HB2 . . 5.500 4.308 3.823 4.905 . 0 0 "[ . 1 . 2]" 1
1750 1 18 ASN HA 1 21 GLY H . . 5.180 4.132 3.246 4.586 . 0 0 "[ . 1 . 2]" 1
1751 1 20 ARG H 1 20 ARG QD . . 5.150 2.039 1.741 2.558 . 0 0 "[ . 1 . 2]" 1
1752 1 16 LEU H 1 17 ASP H . . 3.980 2.478 1.773 4.115 0.135 11 0 "[ . 1 . 2]" 1
1753 1 16 LEU H 1 17 ASP HA . . 5.500 4.493 3.664 5.122 . 0 0 "[ . 1 . 2]" 1
1754 1 13 PRO QB 1 15 GLY H . . 5.500 5.574 3.661 6.687 1.187 9 9 "[*-**. +1* .* **2]" 1
1755 1 13 PRO QD 1 15 GLY H . . 5.370 6.002 3.833 7.429 2.059 10 14 "[**-*.* **+* *.****2]" 1
1756 1 12 PHE QB 1 14 ASP H . . 5.170 2.850 2.426 3.858 . 0 0 "[ . 1 . 2]" 1
1757 1 3 CYS HB3 1 12 PHE H . . 5.500 5.279 4.937 5.457 . 0 0 "[ . 1 . 2]" 1
1758 1 10 ILE MG 1 12 PHE H . . 5.250 4.620 4.161 5.038 . 0 0 "[ . 1 . 2]" 1
1759 1 3 CYS HA 1 11 CYS H . . 5.330 4.383 4.210 4.542 . 0 0 "[ . 1 . 2]" 1
1760 1 4 THR MG 1 11 CYS H . . 5.170 5.080 4.917 5.205 0.035 3 0 "[ . 1 . 2]" 1
1761 1 3 CYS HB2 1 10 ILE H . . 5.500 5.482 5.319 5.570 0.070 6 0 "[ . 1 . 2]" 1
1762 1 3 CYS HB3 1 10 ILE H . . 5.340 4.033 3.751 4.950 . 0 0 "[ . 1 . 2]" 1
1763 1 4 THR HB 1 10 ILE H . . 4.940 3.886 3.825 3.963 . 0 0 "[ . 1 . 2]" 1
1764 1 4 THR HA 1 10 ILE H . . 5.290 4.669 4.565 4.819 . 0 0 "[ . 1 . 2]" 1
1765 1 10 ILE H 1 11 CYS HA . . 5.500 4.736 4.473 4.868 . 0 0 "[ . 1 . 2]" 1
1766 1 3 CYS HA 1 10 ILE H . . 5.060 4.319 4.026 4.513 . 0 0 "[ . 1 . 2]" 1
1767 1 6 SER H 1 7 ILE H . . 4.650 4.280 4.237 4.366 . 0 0 "[ . 1 . 2]" 1
1768 1 6 SER H 1 7 ILE MD . . 5.500 4.614 3.825 5.575 0.075 1 0 "[ . 1 . 2]" 1
1769 1 6 SER H 1 9 PRO HG3 . . 5.500 5.358 4.986 5.530 0.030 1 0 "[ . 1 . 2]" 1
1770 1 3 CYS HB3 1 6 SER H . . 5.500 5.354 5.138 5.597 0.097 6 0 "[ . 1 . 2]" 1
1771 1 4 THR H 1 12 PHE QD . . 5.500 4.662 4.119 5.413 . 0 0 "[ . 1 . 2]" 1
1772 1 4 THR H 1 9 PRO QB . . 4.770 3.511 3.183 3.837 . 0 0 "[ . 1 . 2]" 1
1773 1 4 THR H 1 10 ILE MG . . 4.520 4.294 4.071 4.431 . 0 0 "[ . 1 . 2]" 1
1774 1 3 CYS H 1 11 CYS HA . . 4.900 4.450 4.321 4.552 . 0 0 "[ . 1 . 2]" 1
1775 1 2 ARG H 1 11 CYS HA . . 5.500 4.979 4.518 5.497 . 0 0 "[ . 1 . 2]" 1
1776 1 2 ARG H 1 12 PHE QB . . 5.060 3.153 2.195 3.949 . 0 0 "[ . 1 . 2]" 1
1777 1 44 ARG HB2 1 45 MET H . . 4.560 2.896 1.917 4.049 . 0 0 "[ . 1 . 2]" 1
1778 1 44 ARG HG3 1 45 MET H . . 5.500 4.206 2.520 5.519 0.019 2 0 "[ . 1 . 2]" 1
1779 1 26 ILE HG13 1 27 GLN H . . 4.740 3.254 3.094 3.390 . 0 0 "[ . 1 . 2]" 1
1780 1 24 ILE MG 1 25 ARG H . . 3.270 2.462 2.266 2.656 . 0 0 "[ . 1 . 2]" 1
1781 1 16 LEU MD2 1 17 ASP H . . 4.860 3.585 2.033 4.861 0.001 16 0 "[ . 1 . 2]" 1
1782 1 9 PRO QB 1 11 CYS H . . 5.500 4.596 4.391 4.927 . 0 0 "[ . 1 . 2]" 1
1783 1 2 ARG HA 1 12 PHE H . . 5.500 4.714 4.554 4.952 . 0 0 "[ . 1 . 2]" 1
1784 1 41 TYR H 1 42 LYS QG . . 5.040 4.978 4.296 5.086 0.046 15 0 "[ . 1 . 2]" 1
1785 1 58 LEU HB3 1 62 GLN H . . 5.500 5.455 5.248 5.534 0.034 8 0 "[ . 1 . 2]" 1
1786 1 78 VAL H 1 79 VAL HA . . 5.500 5.303 5.223 5.358 . 0 0 "[ . 1 . 2]" 1
1787 1 82 ALA H 1 84 LYS H . . 5.180 3.965 3.646 4.161 . 0 0 "[ . 1 . 2]" 1
1788 1 102 LYS H 1 104 GLN H . . 4.900 4.072 3.950 4.203 . 0 0 "[ . 1 . 2]" 1
1789 1 104 GLN H 1 105 MET H . . 3.480 2.456 2.359 2.567 . 0 0 "[ . 1 . 2]" 1
1790 1 103 ALA H 1 105 MET H . . 4.350 3.949 3.771 4.156 . 0 0 "[ . 1 . 2]" 1
1791 1 104 GLN H 1 106 LEU H . . 4.700 3.882 3.685 4.032 . 0 0 "[ . 1 . 2]" 1
1792 1 108 ASN H 1 109 GLN H . . 3.100 2.242 2.152 2.358 . 0 0 "[ . 1 . 2]" 1
1793 1 108 ASN H 1 112 LEU H . . 5.200 4.758 4.663 4.892 . 0 0 "[ . 1 . 2]" 1
1794 1 106 LEU H 1 109 GLN H . . 4.920 4.658 4.569 4.716 . 0 0 "[ . 1 . 2]" 1
1795 1 109 GLN H 1 112 LEU MD1 . . 5.500 5.488 5.316 5.529 0.029 16 0 "[ . 1 . 2]" 1
1796 1 110 CYS H 1 112 LEU H . . 4.450 4.065 3.928 4.360 . 0 0 "[ . 1 . 2]" 1
1797 1 111 ASN H 1 112 LEU H . . 3.200 2.756 2.587 2.860 . 0 0 "[ . 1 . 2]" 1
1798 1 113 GLN H 1 114 CYS HB2 . . 5.140 4.156 4.039 4.290 . 0 0 "[ . 1 . 2]" 1
1799 1 113 GLN H 1 114 CYS H . . 3.870 3.264 3.031 3.436 . 0 0 "[ . 1 . 2]" 1
1800 1 114 CYS H 1 115 SER H . . 4.530 4.224 4.108 4.309 . 0 0 "[ . 1 . 2]" 1
1801 1 112 LEU H 1 114 CYS H . . 5.200 4.246 4.139 4.415 . 0 0 "[ . 1 . 2]" 1
1802 1 115 SER H 1 116 ILE H . . 4.700 4.182 3.982 4.327 . 0 0 "[ . 1 . 2]" 1
1803 1 108 ASN H 1 116 ILE H . . 5.340 4.819 4.340 5.297 . 0 0 "[ . 1 . 2]" 1
1804 1 5 LYS H 1 6 SER H . . 3.690 3.681 3.565 3.736 0.046 3 0 "[ . 1 . 2]" 1
1805 1 20 ARG H 1 21 GLY H . . 2.960 2.064 1.797 2.198 . 0 0 "[ . 1 . 2]" 1
1806 1 4 THR H 1 5 LYS H . . 4.650 4.581 4.547 4.632 . 0 0 "[ . 1 . 2]" 1
1807 1 2 ARG H 1 3 CYS H . . 4.850 4.483 4.343 4.602 . 0 0 "[ . 1 . 2]" 1
1808 1 10 ILE H 1 11 CYS H . . 4.600 4.258 4.154 4.403 . 0 0 "[ . 1 . 2]" 1
1809 1 14 ASP H 1 15 GLY H . . 4.230 3.698 2.292 4.331 0.101 17 0 "[ . 1 . 2]" 1
1810 1 15 GLY H 1 16 LEU H . . 3.510 2.729 1.795 3.602 0.092 7 0 "[ . 1 . 2]" 1
1811 1 17 ASP H 1 18 ASN H . . 4.430 3.596 1.831 4.447 0.017 9 0 "[ . 1 . 2]" 1
1812 1 25 ARG H 1 26 ILE H . . 4.630 4.430 4.345 4.482 . 0 0 "[ . 1 . 2]" 1
1813 1 28 GLN H 1 29 LEU H . . 3.270 2.217 2.101 2.317 . 0 0 "[ . 1 . 2]" 1
1814 1 23 GLN H 1 24 ILE H . . 4.480 4.124 3.883 4.348 . 0 0 "[ . 1 . 2]" 1
1815 1 25 ARG H 1 28 GLN H . . 5.500 4.974 4.793 5.120 . 0 0 "[ . 1 . 2]" 1
1816 1 25 ARG H 1 27 GLN H . . 5.170 5.219 5.180 5.262 0.092 7 0 "[ . 1 . 2]" 1
1817 1 27 GLN H 1 30 ASN H . . 5.180 5.010 4.704 5.193 0.013 12 0 "[ . 1 . 2]" 1
1818 1 30 ASN H 1 31 HIS H . . 3.530 2.786 2.630 2.949 . 0 0 "[ . 1 . 2]" 1
1819 1 31 HIS H 1 33 GLN H . . 4.550 4.054 3.963 4.202 . 0 0 "[ . 1 . 2]" 1
1820 1 34 MET H 1 35 HIS H . . 3.100 2.586 2.478 2.684 . 0 0 "[ . 1 . 2]" 1
1821 1 101 LYS H 1 102 LYS H . . 3.390 2.721 2.623 2.823 . 0 0 "[ . 1 . 2]" 1
1822 1 34 MET H 1 36 LEU H . . 4.410 4.072 3.970 4.146 . 0 0 "[ . 1 . 2]" 1
1823 1 36 LEU H 1 37 THR H . . 3.830 2.462 2.387 2.563 . 0 0 "[ . 1 . 2]" 1
1824 1 42 LYS H 1 43 LEU H . . 2.990 2.540 2.393 2.706 . 0 0 "[ . 1 . 2]" 1
1825 1 45 MET H 1 46 ALA H . . 3.310 2.433 1.795 3.374 0.064 8 0 "[ . 1 . 2]" 1
1826 1 46 ALA H 1 47 VAL H . . 4.360 3.412 2.130 4.301 . 0 0 "[ . 1 . 2]" 1
1827 1 55 HIS H 1 56 LEU H . . 3.530 2.554 2.374 2.778 . 0 0 "[ . 1 . 2]" 1
1828 1 60 CYS H 1 61 ASN H . . 3.370 2.637 2.460 2.765 . 0 0 "[ . 1 . 2]" 1
1829 1 62 GLN H 1 63 LEU H . . 3.270 2.436 2.338 2.630 . 0 0 "[ . 1 . 2]" 1
1830 1 63 LEU H 1 64 GLN H . . 3.240 2.547 2.457 2.616 . 0 0 "[ . 1 . 2]" 1
1831 1 64 GLN H 1 66 VAL H . . 4.430 4.086 4.018 4.169 . 0 0 "[ . 1 . 2]" 1
1832 1 66 VAL H 1 67 GLU H . . 4.630 4.583 4.527 4.627 . 0 0 "[ . 1 . 2]" 1
1833 1 65 GLU H 1 66 VAL H . . 5.500 2.263 2.186 2.478 . 0 0 "[ . 1 . 2]" 1
1834 1 68 LYS H 1 69 GLN H . . 3.550 2.726 2.618 2.842 . 0 0 "[ . 1 . 2]" 1
1835 1 69 GLN H 1 70 CYS H . . 3.270 2.398 2.262 2.468 . 0 0 "[ . 1 . 2]" 1
1836 1 71 GLN H 1 73 GLU H . . 5.280 3.802 3.698 3.950 . 0 0 "[ . 1 . 2]" 1
1837 1 72 CYS H 1 73 GLU H . . 3.120 2.367 2.293 2.490 . 0 0 "[ . 1 . 2]" 1
1838 1 73 GLU H 1 75 ILE H . . 4.650 3.902 3.821 3.976 . 0 0 "[ . 1 . 2]" 1
1839 1 75 ILE H 1 77 GLN H . . 4.940 3.944 3.852 4.037 . 0 0 "[ . 1 . 2]" 1
1840 1 72 CYS H 1 75 ILE H . . 5.210 4.999 4.907 5.174 . 0 0 "[ . 1 . 2]" 1
1841 1 76 LYS H 1 77 GLN H . . 3.310 2.194 1.989 2.390 . 0 0 "[ . 1 . 2]" 1
1842 1 84 LYS H 1 85 GLN H . . 3.230 2.544 2.462 2.616 . 0 0 "[ . 1 . 2]" 1
1843 1 83 GLN H 1 84 LYS H . . 3.330 2.479 2.360 2.622 . 0 0 "[ . 1 . 2]" 1
1844 1 85 GLN H 1 86 LEU H . . 3.100 2.515 2.442 2.608 . 0 0 "[ . 1 . 2]" 1
1845 1 83 GLN H 1 86 LEU H . . 4.930 4.965 4.907 5.000 0.070 5 0 "[ . 1 . 2]" 1
1846 1 85 GLN H 1 87 GLN H . . 4.230 3.915 3.783 4.008 . 0 0 "[ . 1 . 2]" 1
1847 1 92 GLY H 1 93 GLN H . . 3.400 2.983 2.327 3.335 . 0 0 "[ . 1 . 2]" 1
1848 1 96 VAL H 1 97 GLN H . . 5.140 2.623 2.548 2.699 . 0 0 "[ . 1 . 2]" 1
1849 1 95 GLN H 1 97 GLN H . . 3.730 3.540 3.467 3.648 . 0 0 "[ . 1 . 2]" 1
1850 1 99 MET H 1 100 VAL H . . 3.290 2.137 2.074 2.196 . 0 0 "[ . 1 . 2]" 1
1851 1 39 PHE QE 1 100 VAL H . . 5.500 5.387 5.057 5.516 0.016 15 0 "[ . 1 . 2]" 1
1852 1 102 LYS H 1 103 ALA H . . 3.270 2.527 2.486 2.576 . 0 0 "[ . 1 . 2]" 1
1853 1 31 HIS HD2 1 36 LEU H . . 5.500 5.538 5.502 5.595 0.095 15 0 "[ . 1 . 2]" 1
1854 1 59 CYS H 1 60 CYS H . . 3.630 2.850 2.760 3.036 . 0 0 "[ . 1 . 2]" 1
1855 1 73 GLU H 1 74 ALA HA . . 5.500 5.099 5.000 5.202 . 0 0 "[ . 1 . 2]" 1
1856 1 78 VAL H 1 78 VAL HB . . 2.960 2.842 2.765 2.909 . 0 0 "[ . 1 . 2]" 1
1857 1 78 VAL H 1 78 VAL MG2 . . 4.120 1.931 1.845 1.996 . 0 0 "[ . 1 . 2]" 1
1858 1 78 VAL H 1 78 VAL MG1 . . 4.120 3.795 3.771 3.821 . 0 0 "[ . 1 . 2]" 1
1859 1 81 GLN H 1 82 ALA H . . 3.100 2.534 2.404 2.638 . 0 0 "[ . 1 . 2]" 1
1860 1 79 VAL H 1 81 GLN H . . 4.900 4.164 3.924 4.336 . 0 0 "[ . 1 . 2]" 1
1861 1 90 GLN H 1 91 GLY H . . 3.140 2.128 1.778 2.783 . 0 0 "[ . 1 . 2]" 1
1862 1 20 ARG H 1 21 GLY HA2 . . 5.040 4.217 3.655 4.833 . 0 0 "[ . 1 . 2]" 1
1863 1 20 ARG H 1 21 GLY HA3 . . 5.040 4.534 4.141 4.849 . 0 0 "[ . 1 . 2]" 1
1864 1 30 ASN H 1 31 HIS HA . . 5.500 5.359 5.214 5.488 . 0 0 "[ . 1 . 2]" 1
1865 1 106 LEU H 1 107 PRO HD2 . . 3.650 2.314 2.119 2.806 . 0 0 "[ . 1 . 2]" 1
1866 1 38 SER H 1 39 PHE H . . 4.740 4.447 4.304 4.571 . 0 0 "[ . 1 . 2]" 1
1867 1 39 PHE H 1 40 ASP H . . 4.280 4.118 3.641 4.346 0.066 8 0 "[ . 1 . 2]" 1
1868 1 39 PHE HA 1 40 ASP H . . 3.260 2.170 2.026 2.614 . 0 0 "[ . 1 . 2]" 1
1869 1 42 LYS H 1 42 LYS HB3 . . 3.320 2.487 2.349 2.702 . 0 0 "[ . 1 . 2]" 1
1870 1 42 LYS H 1 42 LYS QG . . 3.580 3.362 3.165 3.545 . 0 0 "[ . 1 . 2]" 1
1871 1 92 GLY H 1 92 GLY HA2 . . 2.730 2.274 2.210 2.425 . 0 0 "[ . 1 . 2]" 1
1872 1 93 GLN H 1 93 GLN HA . . 2.850 2.747 2.704 2.786 . 0 0 "[ . 1 . 2]" 1
1873 1 34 MET H 1 37 THR H . . 4.780 4.751 4.649 4.799 0.019 18 0 "[ . 1 . 2]" 1
1874 1 31 HIS HA 1 34 MET H . . 4.130 3.608 3.441 3.717 . 0 0 "[ . 1 . 2]" 1
1875 1 41 TYR H 1 42 LYS HB3 . . 5.500 4.328 4.004 4.577 . 0 0 "[ . 1 . 2]" 1
1876 1 33 GLN H 1 34 MET H . . 3.380 3.018 2.942 3.083 . 0 0 "[ . 1 . 2]" 1
1877 1 32 CYS HA 1 34 MET H . . 5.170 4.743 4.534 4.946 . 0 0 "[ . 1 . 2]" 1
1878 1 52 GLN H 1 53 GLN H . . 3.580 2.376 2.011 2.678 . 0 0 "[ . 1 . 2]" 1
1879 1 61 ASN H 1 62 GLN H . . 3.730 2.394 2.280 2.572 . 0 0 "[ . 1 . 2]" 1
1880 1 52 GLN H 1 52 GLN HB3 . . 3.770 3.617 3.542 3.700 . 0 0 "[ . 1 . 2]" 1
1881 1 48 GLU H 1 48 GLU HB2 . . 4.050 2.915 2.444 3.891 . 0 0 "[ . 1 . 2]" 1
1882 1 44 ARG H 1 44 ARG QD . . 5.440 3.981 3.364 4.564 . 0 0 "[ . 1 . 2]" 1
1883 1 44 ARG H 1 44 ARG HB3 . . 4.160 3.560 2.542 3.805 . 0 0 "[ . 1 . 2]" 1
1884 1 42 LYS QD 1 43 LEU H . . 3.040 3.007 2.573 3.092 0.052 3 0 "[ . 1 . 2]" 1
1885 1 43 LEU H 1 43 LEU HG . . 4.010 2.175 2.017 2.411 . 0 0 "[ . 1 . 2]" 1
1886 1 42 LYS H 1 42 LYS QD . . 4.290 1.995 1.811 2.245 . 0 0 "[ . 1 . 2]" 1
1887 1 41 TYR HB3 1 42 LYS H . . 4.810 3.976 3.894 4.121 . 0 0 "[ . 1 . 2]" 1
1888 1 42 LYS H 1 42 LYS QE . . 5.190 4.048 3.726 4.343 . 0 0 "[ . 1 . 2]" 1
1889 1 41 TYR H 1 41 TYR HB2 . . 4.000 3.703 3.593 4.022 0.022 13 0 "[ . 1 . 2]" 1
1890 1 36 LEU H 1 36 LEU HG . . 3.880 2.562 2.401 2.664 . 0 0 "[ . 1 . 2]" 1
1891 1 33 GLN HG2 1 34 MET H . . 2.880 2.889 2.771 2.947 0.067 19 0 "[ . 1 . 2]" 1
1892 1 34 MET H 1 34 MET HG2 . . 3.590 2.341 2.264 2.454 . 0 0 "[ . 1 . 2]" 1
1893 1 34 MET H 1 34 MET HG3 . . 3.590 3.425 3.169 3.597 0.007 3 0 "[ . 1 . 2]" 1
1894 1 33 GLN H 1 33 GLN HG3 . . 4.700 4.390 4.337 4.439 . 0 0 "[ . 1 . 2]" 1
1895 1 33 GLN H 1 33 GLN HG2 . . 4.090 4.152 4.127 4.169 0.079 10 0 "[ . 1 . 2]" 1
1896 1 31 HIS HB3 1 32 CYS H . . 3.410 2.239 2.142 2.478 . 0 0 "[ . 1 . 2]" 1
1897 1 2 ARG H 1 2 ARG HG2 . . 4.080 3.122 2.173 3.894 . 0 0 "[ . 1 . 2]" 1
1898 1 2 ARG H 1 2 ARG HB3 . . 3.710 3.648 3.591 3.695 . 0 0 "[ . 1 . 2]" 1
1899 1 5 LYS H 1 5 LYS HD2 . . 4.440 3.730 2.194 4.498 0.058 3 0 "[ . 1 . 2]" 1
1900 1 86 LEU HB3 1 93 GLN H . . 5.070 3.144 2.817 3.603 . 0 0 "[ . 1 . 2]" 1
1901 1 10 ILE H 1 10 ILE HB . . 3.130 2.523 2.422 2.604 . 0 0 "[ . 1 . 2]" 1
1902 1 14 ASP H 1 14 ASP HB2 . . 4.160 3.215 2.581 3.474 . 0 0 "[ . 1 . 2]" 1
1903 1 16 LEU H 1 16 LEU MD1 . . 4.520 3.847 1.982 4.662 0.142 8 0 "[ . 1 . 2]" 1
1904 1 17 ASP H 1 17 ASP HB3 . . 3.940 2.863 2.420 3.804 . 0 0 "[ . 1 . 2]" 1
1905 1 17 ASP H 1 17 ASP HB2 . . 3.940 3.312 2.695 3.976 0.036 17 0 "[ . 1 . 2]" 1
1906 1 18 ASN H 1 18 ASN HB2 . . 3.830 3.122 2.491 3.868 0.038 1 0 "[ . 1 . 2]" 1
1907 1 23 GLN H 1 23 GLN HG2 . . 3.930 2.114 1.966 2.338 . 0 0 "[ . 1 . 2]" 1
1908 1 25 ARG H 1 25 ARG HG3 . . 3.820 3.351 3.236 3.486 . 0 0 "[ . 1 . 2]" 1
1909 1 26 ILE H 1 26 ILE HG13 . . 4.010 2.035 1.924 2.183 . 0 0 "[ . 1 . 2]" 1
1910 1 54 GLN H 1 54 GLN QG . . 4.100 2.162 2.039 2.342 . 0 0 "[ . 1 . 2]" 1
1911 1 54 GLN H 1 54 GLN QB . . 3.270 2.476 2.391 2.574 . 0 0 "[ . 1 . 2]" 1
1912 1 58 LEU H 1 58 LEU HG . . 4.410 2.178 1.989 2.392 . 0 0 "[ . 1 . 2]" 1
1913 1 58 LEU H 1 58 LEU MD1 . . 4.150 3.590 3.492 3.683 . 0 0 "[ . 1 . 2]" 1
1914 1 59 CYS HB3 1 60 CYS H . . 3.470 2.463 2.349 2.565 . 0 0 "[ . 1 . 2]" 1
1915 1 61 ASN H 1 61 ASN HB2 . . 3.120 2.550 2.406 2.626 . 0 0 "[ . 1 . 2]" 1
1916 1 63 LEU H 1 63 LEU MD1 . . 4.640 3.742 3.680 3.806 . 0 0 "[ . 1 . 2]" 1
1917 1 64 GLN H 1 64 GLN QB . . 3.420 2.380 2.306 2.436 . 0 0 "[ . 1 . 2]" 1
1918 1 67 GLU H 1 67 GLU QG . . 2.990 2.409 2.080 3.027 0.037 13 0 "[ . 1 . 2]" 1
1919 1 68 LYS H 1 68 LYS HB2 . . 3.600 3.627 3.568 3.682 0.082 9 0 "[ . 1 . 2]" 1
1920 1 68 LYS H 1 68 LYS HB3 . . 3.200 2.657 2.524 2.826 . 0 0 "[ . 1 . 2]" 1
1921 1 68 LYS H 1 68 LYS QD . . 4.230 3.972 3.379 4.233 0.003 9 0 "[ . 1 . 2]" 1
1922 1 69 GLN H 1 69 GLN HG3 . . 3.650 3.176 2.718 3.403 . 0 0 "[ . 1 . 2]" 1
1923 1 71 GLN H 1 71 GLN HG3 . . 3.270 2.329 2.247 2.442 . 0 0 "[ . 1 . 2]" 1
1924 1 75 ILE H 1 75 ILE HB . . 3.270 2.583 2.449 2.750 . 0 0 "[ . 1 . 2]" 1
1925 1 76 LYS H 1 76 LYS QB . . 3.490 2.513 2.395 2.610 . 0 0 "[ . 1 . 2]" 1
1926 1 76 LYS H 1 76 LYS QD . . 3.920 3.227 3.067 3.475 . 0 0 "[ . 1 . 2]" 1
1927 1 77 GLN H 1 77 GLN HB2 . . 3.390 2.649 2.423 2.813 . 0 0 "[ . 1 . 2]" 1
1928 1 78 VAL MG1 1 79 VAL H . . 3.920 3.585 3.506 3.665 . 0 0 "[ . 1 . 2]" 1
1929 1 79 VAL HB 1 80 GLU H . . 3.130 2.387 2.201 2.593 . 0 0 "[ . 1 . 2]" 1
1930 1 81 GLN H 1 81 GLN HG2 . . 3.660 2.084 2.000 2.222 . 0 0 "[ . 1 . 2]" 1
1931 1 83 GLN H 1 83 GLN QG . . 3.600 2.197 2.087 2.360 . 0 0 "[ . 1 . 2]" 1
1932 1 86 LEU H 1 86 LEU MD2 . . 3.780 2.740 2.586 2.909 . 0 0 "[ . 1 . 2]" 1
1933 1 88 GLN H 1 88 GLN HG3 . . 4.980 3.308 3.108 3.536 . 0 0 "[ . 1 . 2]" 1
1934 1 94 GLN H 1 94 GLN QB . . 2.800 2.623 2.531 2.697 . 0 0 "[ . 1 . 2]" 1
1935 1 94 GLN H 1 94 GLN QG . . 3.210 1.991 1.914 2.098 . 0 0 "[ . 1 . 2]" 1
1936 1 95 GLN H 1 95 GLN HG3 . . 3.910 3.164 2.962 3.325 . 0 0 "[ . 1 . 2]" 1
1937 1 95 GLN H 1 95 GLN HB2 . . 3.730 3.658 3.623 3.702 . 0 0 "[ . 1 . 2]" 1
1938 1 99 MET H 1 99 MET QG . . 4.070 4.106 4.094 4.119 0.049 2 0 "[ . 1 . 2]" 1
1939 1 34 MET HG3 1 35 HIS H . . 3.530 2.470 2.154 2.758 . 0 0 "[ . 1 . 2]" 1
1940 1 102 LYS H 1 102 LYS QD . . 4.210 3.421 3.320 3.701 . 0 0 "[ . 1 . 2]" 1
1941 1 105 MET H 1 105 MET HB3 . . 3.720 3.640 3.610 3.687 . 0 0 "[ . 1 . 2]" 1
1942 1 109 GLN HB2 1 110 CYS H . . 3.340 2.682 2.427 2.984 . 0 0 "[ . 1 . 2]" 1
1943 1 110 CYS H 1 110 CYS HB3 . . 3.630 2.660 2.491 3.592 . 0 0 "[ . 1 . 2]" 1
1944 1 112 LEU H 1 112 LEU MD1 . . 4.020 3.839 3.730 3.932 . 0 0 "[ . 1 . 2]" 1
1945 1 112 LEU H 1 112 LEU MD2 . . 4.180 3.205 3.065 3.382 . 0 0 "[ . 1 . 2]" 1
1946 1 97 GLN HA 1 101 LYS H . . 4.010 3.793 3.653 3.901 . 0 0 "[ . 1 . 2]" 1
1947 1 41 TYR H 1 43 LEU HG . . 5.340 3.819 3.177 4.270 . 0 0 "[ . 1 . 2]" 1
1948 1 40 ASP HA 1 42 LYS H . . 5.000 4.402 3.106 4.690 . 0 0 "[ . 1 . 2]" 1
1949 1 55 HIS HA 1 55 HIS HD2 . . 4.370 4.128 3.981 4.372 0.002 7 0 "[ . 1 . 2]" 1
1950 1 55 HIS H 1 55 HIS HD2 . . 3.580 2.960 2.608 3.436 . 0 0 "[ . 1 . 2]" 1
1951 1 35 HIS HA 1 35 HIS HD2 . . 5.240 4.257 3.288 5.002 . 0 0 "[ . 1 . 2]" 1
1952 1 31 HIS HB3 1 31 HIS HD2 . . 3.420 3.083 2.910 3.186 . 0 0 "[ . 1 . 2]" 1
1953 1 31 HIS HD2 1 35 HIS HB3 . . 3.920 3.190 2.151 3.963 0.043 5 0 "[ . 1 . 2]" 1
1954 1 31 HIS HD2 1 35 HIS H . . 3.850 3.792 3.480 3.923 0.073 6 0 "[ . 1 . 2]" 1
1955 1 54 GLN QG 1 55 HIS HD2 . . 4.390 4.489 4.419 4.521 0.131 16 0 "[ . 1 . 2]" 1
1956 1 31 HIS HE1 1 58 LEU HB2 . . 4.860 4.503 3.897 4.905 0.045 8 0 "[ . 1 . 2]" 1
1957 1 52 GLN HB3 1 55 HIS HE1 . . 5.290 4.239 3.538 5.307 0.017 13 0 "[ . 1 . 2]" 1
1958 1 41 TYR HA 1 41 TYR QD . . 3.730 3.737 3.710 3.753 0.023 6 0 "[ . 1 . 2]" 1
1959 1 41 TYR H 1 41 TYR QD . . 3.150 2.458 1.773 2.783 . 0 0 "[ . 1 . 2]" 1
1960 1 41 TYR QD 1 42 LYS H . . 3.570 3.015 2.790 3.207 . 0 0 "[ . 1 . 2]" 1
1961 1 40 ASP HA 1 41 TYR QD . . 3.980 3.441 2.803 3.808 . 0 0 "[ . 1 . 2]" 1
1962 1 40 ASP HB3 1 41 TYR QD . . 5.500 5.029 4.746 5.259 . 0 0 "[ . 1 . 2]" 1
1963 1 41 TYR QD 1 42 LYS QD . . 4.190 3.692 3.071 3.921 . 0 0 "[ . 1 . 2]" 1
1964 1 41 TYR QD 1 42 LYS QG . . 5.070 4.750 4.380 5.096 0.026 15 0 "[ . 1 . 2]" 1
1965 1 38 SER HA 1 39 PHE QD . . 4.880 4.237 3.789 4.625 . 0 0 "[ . 1 . 2]" 1
1966 1 39 PHE H 1 39 PHE QD . . 4.210 3.141 2.802 3.643 . 0 0 "[ . 1 . 2]" 1
1967 1 39 PHE QD 1 40 ASP H . . 4.700 3.941 2.971 4.467 . 0 0 "[ . 1 . 2]" 1
1968 1 39 PHE QD 1 95 GLN HG3 . . 4.340 3.767 3.313 4.101 . 0 0 "[ . 1 . 2]" 1
1969 1 41 TYR QE 1 42 LYS QD . . 3.650 3.464 2.738 3.729 0.079 4 0 "[ . 1 . 2]" 1
1970 1 41 TYR QE 1 42 LYS QG . . 4.710 4.320 3.823 4.611 . 0 0 "[ . 1 . 2]" 1
1971 1 41 TYR QE 1 42 LYS H . . 3.910 3.971 3.928 4.033 0.123 9 0 "[ . 1 . 2]" 1
1972 1 12 PHE HA 1 12 PHE QE . . 4.510 4.389 4.183 4.514 0.004 10 0 "[ . 1 . 2]" 1
1973 1 12 PHE QE 1 13 PRO QD . . 4.780 4.399 4.311 4.421 . 0 0 "[ . 1 . 2]" 1
1974 1 39 PHE QE 1 99 MET QG . . 4.410 3.693 3.161 4.283 . 0 0 "[ . 1 . 2]" 1
1975 1 39 PHE QE 1 98 GLN HG3 . . 5.150 2.805 2.225 3.497 . 0 0 "[ . 1 . 2]" 1
1976 1 39 PHE QE 1 99 MET HB3 . . 5.500 4.221 3.905 4.441 . 0 0 "[ . 1 . 2]" 1
1977 1 39 PHE QE 1 99 MET HB2 . . 4.660 2.830 2.286 3.356 . 0 0 "[ . 1 . 2]" 1
1978 1 39 PHE QE 1 95 GLN HB2 . . 4.580 3.364 2.918 3.894 . 0 0 "[ . 1 . 2]" 1
1979 1 39 PHE QE 1 96 VAL MG2 . . 5.020 2.226 1.941 2.541 . 0 0 "[ . 1 . 2]" 1
1980 1 31 HIS HE1 1 58 LEU HB3 . . 4.490 4.457 4.004 4.559 0.069 4 0 "[ . 1 . 2]" 1
1981 1 41 TYR QD 1 42 LYS HA . . 4.170 3.287 2.965 3.945 . 0 0 "[ . 1 . 2]" 1
1982 1 41 TYR QE 1 42 LYS HA . . 4.780 4.505 4.242 4.781 0.001 14 0 "[ . 1 . 2]" 1
1983 1 39 PHE HA 1 39 PHE QD . . 3.680 2.654 2.397 2.839 . 0 0 "[ . 1 . 2]" 1
1984 1 31 HIS HD2 1 35 HIS HB2 . . 3.920 2.609 2.080 3.657 . 0 0 "[ . 1 . 2]" 1
1985 1 31 HIS HB3 1 31 HIS HE1 . . 5.210 5.136 5.076 5.184 . 0 0 "[ . 1 . 2]" 1
1986 1 55 HIS HD2 1 56 LEU HA . . 4.340 3.469 3.236 3.738 . 0 0 "[ . 1 . 2]" 1
1987 1 39 PHE QD 1 95 GLN HG2 . . 5.500 5.305 4.863 5.538 0.038 20 0 "[ . 1 . 2]" 1
1988 1 39 PHE QD 1 99 MET HB2 . . 5.500 4.515 3.943 5.047 . 0 0 "[ . 1 . 2]" 1
1989 1 39 PHE QE 1 99 MET HA . . 5.500 4.635 4.000 5.308 . 0 0 "[ . 1 . 2]" 1
1990 1 39 PHE QE 1 96 VAL H . . 4.790 3.206 2.986 3.364 . 0 0 "[ . 1 . 2]" 1
1991 1 1 GLY QA 1 2 ARG QG . . 5.260 3.670 3.199 4.037 . 0 0 "[ . 1 . 2]" 1
1992 1 2 ARG H 1 2 ARG QB . . 3.220 2.464 2.352 2.576 . 0 0 "[ . 1 . 2]" 1
1993 1 2 ARG H 1 2 ARG QG . . 3.490 2.475 2.149 2.807 . 0 0 "[ . 1 . 2]" 1
1994 1 2 ARG HA 1 2 ARG QG . . 3.690 2.676 2.345 3.106 . 0 0 "[ . 1 . 2]" 1
1995 1 2 ARG QB 1 2 ARG QG . . 2.360 2.030 1.968 2.086 . 0 0 "[ . 1 . 2]" 1
1996 1 2 ARG QB 1 2 ARG QD . . 3.450 2.367 2.136 2.843 . 0 0 "[ . 1 . 2]" 1
1997 1 2 ARG QB 1 3 CYS H . . 3.970 2.863 2.333 3.114 . 0 0 "[ . 1 . 2]" 1
1998 1 2 ARG QB 1 3 CYS HB2 . . 5.340 5.227 4.754 5.383 0.043 19 0 "[ . 1 . 2]" 1
1999 1 2 ARG QB 1 12 PHE QB . . 4.780 2.633 1.940 3.121 . 0 0 "[ . 1 . 2]" 1
2000 1 2 ARG QG 1 3 CYS H . . 4.420 4.219 3.728 4.535 0.115 10 0 "[ . 1 . 2]" 1
2001 1 2 ARG QG 1 12 PHE H . . 5.340 5.085 4.739 5.388 0.048 20 0 "[ . 1 . 2]" 1
2002 1 2 ARG QG 1 12 PHE QB . . 4.590 3.986 3.356 4.349 . 0 0 "[ . 1 . 2]" 1
2003 1 4 THR MG 1 6 SER QB . . 5.340 4.273 3.974 4.601 . 0 0 "[ . 1 . 2]" 1
2004 1 5 LYS H 1 5 LYS QB . . 2.990 2.468 2.327 2.554 . 0 0 "[ . 1 . 2]" 1
2005 1 5 LYS H 1 5 LYS QD . . 3.600 2.787 1.985 3.497 . 0 0 "[ . 1 . 2]" 1
2006 1 5 LYS H 1 6 SER QB . . 5.340 4.210 3.915 4.610 . 0 0 "[ . 1 . 2]" 1
2007 1 5 LYS HA 1 5 LYS QD . . 3.770 2.561 1.946 3.184 . 0 0 "[ . 1 . 2]" 1
2008 1 5 LYS QB 1 5 LYS QD . . 2.950 2.495 2.319 2.850 . 0 0 "[ . 1 . 2]" 1
2009 1 5 LYS QB 1 6 SER QB . . 4.760 4.503 4.216 4.896 0.136 6 0 "[ . 1 . 2]" 1
2010 1 5 LYS QD 1 6 SER H . . 5.340 4.412 3.843 4.878 . 0 0 "[ . 1 . 2]" 1
2011 1 6 SER H 1 6 SER QB . . 3.560 2.736 2.535 3.138 . 0 0 "[ . 1 . 2]" 1
2012 1 6 SER H 1 7 ILE QG . . 4.560 4.326 4.067 4.600 0.040 3 0 "[ . 1 . 2]" 1
2013 1 6 SER H 1 10 ILE QG . . 5.200 5.244 5.200 5.294 0.094 1 0 "[ . 1 . 2]" 1
2014 1 6 SER HA 1 7 ILE QG . . 4.740 3.635 3.337 4.371 . 0 0 "[ . 1 . 2]" 1
2015 1 6 SER QB 1 7 ILE HA . . 5.330 4.300 3.959 4.423 . 0 0 "[ . 1 . 2]" 1
2016 1 6 SER QB 1 7 ILE QG . . 5.180 4.809 4.383 5.214 0.034 2 0 "[ . 1 . 2]" 1
2017 1 6 SER QB 1 10 ILE H . . 5.290 3.783 2.767 4.535 . 0 0 "[ . 1 . 2]" 1
2018 1 6 SER QB 1 10 ILE HB . . 5.340 5.006 4.270 5.371 0.031 7 0 "[ . 1 . 2]" 1
2019 1 6 SER QB 1 10 ILE QG . . 4.760 3.463 2.854 3.885 . 0 0 "[ . 1 . 2]" 1
2020 1 7 ILE H 1 7 ILE QG . . 3.910 3.069 2.853 3.656 . 0 0 "[ . 1 . 2]" 1
2021 1 7 ILE HA 1 9 PRO QD . . 3.450 2.450 2.290 2.680 . 0 0 "[ . 1 . 2]" 1
2022 1 7 ILE QG 1 7 ILE MG . . 3.160 2.303 2.084 2.381 . 0 0 "[ . 1 . 2]" 1
2023 1 7 ILE MG 1 8 PRO QG . . 4.620 3.935 3.367 4.545 . 0 0 "[ . 1 . 2]" 1
2024 1 7 ILE MG 1 9 PRO QD . . 4.890 3.202 2.739 3.704 . 0 0 "[ . 1 . 2]" 1
2025 1 7 ILE QG 1 8 PRO HA . . 4.560 4.091 3.629 4.510 . 0 0 "[ . 1 . 2]" 1
2026 1 7 ILE QG 1 9 PRO HA . . 5.340 5.140 4.698 5.397 0.057 4 0 "[ . 1 . 2]" 1
2027 1 7 ILE MD 1 9 PRO QD . . 4.440 3.297 2.069 4.479 0.039 6 0 "[ . 1 . 2]" 1
2028 1 8 PRO HB2 1 9 PRO QD . . 3.320 3.028 2.542 3.337 0.017 1 0 "[ . 1 . 2]" 1
2029 1 8 PRO HB3 1 9 PRO QD . . 3.710 2.899 2.538 3.210 . 0 0 "[ . 1 . 2]" 1
2030 1 9 PRO HA 1 10 ILE QG . . 4.600 3.528 3.295 3.680 . 0 0 "[ . 1 . 2]" 1
2031 1 10 ILE H 1 10 ILE QG . . 3.590 2.359 2.225 2.638 . 0 0 "[ . 1 . 2]" 1
2032 1 10 ILE QG 1 10 ILE MG . . 3.010 2.305 2.266 2.333 . 0 0 "[ . 1 . 2]" 1
2033 1 10 ILE QG 1 11 CYS H . . 5.340 4.832 4.768 4.909 . 0 0 "[ . 1 . 2]" 1
2034 1 12 PHE HA 1 13 PRO QG . . 4.550 3.988 3.783 4.159 . 0 0 "[ . 1 . 2]" 1
2035 1 12 PHE QB 1 16 LEU QD . . 4.720 6.216 2.484 8.736 4.016 17 16 "[ ***** **-** ***+**2]" 1
2036 1 12 PHE QD 1 13 PRO QG . . 4.920 4.177 3.976 4.400 . 0 0 "[ . 1 . 2]" 1
2037 1 13 PRO HA 1 14 ASP QB . . 4.660 4.615 4.333 4.898 0.238 11 0 "[ . 1 . 2]" 1
2038 1 13 PRO QG 1 14 ASP QB . . 5.180 4.188 2.980 5.571 0.391 10 0 "[ . 1 . 2]" 1
2039 1 13 PRO QG 1 15 GLY H . . 5.350 6.135 4.136 7.611 2.261 10 13 "[** *.- **+* *.****2]" 1
2040 1 13 PRO QG 1 16 LEU H . . 4.940 7.669 6.229 9.814 4.874 19 20 [*****-************+*] 1
2041 1 13 PRO QD 1 14 ASP QB . . 5.340 4.249 3.451 5.424 0.084 7 0 "[ . 1 . 2]" 1
2042 1 13 PRO QD 1 16 LEU QD . . 4.370 7.165 4.096 9.375 5.005 2 16 "[*+*-** **1** ******2]" 1
2043 1 14 ASP H 1 14 ASP QB . . 3.500 2.590 2.178 2.835 . 0 0 "[ . 1 . 2]" 1
2044 1 14 ASP QB 1 15 GLY H . . 4.180 2.943 1.911 3.967 . 0 0 "[ . 1 . 2]" 1
2045 1 14 ASP QB 1 15 GLY QA . . 4.750 4.005 3.683 4.512 . 0 0 "[ . 1 . 2]" 1
2046 1 14 ASP QB 1 16 LEU H . . 5.340 4.800 2.714 6.648 1.308 19 3 "[ - . 1* . +2]" 1
2047 1 14 ASP QB 1 16 LEU QD . . 5.280 5.594 3.608 7.335 2.055 2 9 "[ + . - *1* *.** **]" 1
2048 1 15 GLY QA 1 16 LEU QD . . 4.040 3.700 2.555 4.229 0.189 15 0 "[ . 1 . 2]" 1
2049 1 16 LEU HA 1 16 LEU QD . . 3.340 2.873 1.903 3.405 0.065 6 0 "[ . 1 . 2]" 1
2050 1 16 LEU QB 1 16 LEU QD . . 2.610 1.960 1.860 2.111 . 0 0 "[ . 1 . 2]" 1
2051 1 16 LEU QB 1 17 ASP QB . . 5.340 4.201 3.137 5.295 . 0 0 "[ . 1 . 2]" 1
2052 1 16 LEU QD 1 17 ASP H . . 4.120 2.858 2.029 4.107 . 0 0 "[ . 1 . 2]" 1
2053 1 16 LEU QD 1 17 ASP HA . . 4.430 3.801 2.652 4.536 0.106 15 0 "[ . 1 . 2]" 1
2054 1 16 LEU QD 1 17 ASP QB . . 4.030 3.329 2.346 4.143 0.113 11 0 "[ . 1 . 2]" 1
2055 1 17 ASP H 1 17 ASP QB . . 3.340 2.670 2.256 3.182 . 0 0 "[ . 1 . 2]" 1
2056 1 17 ASP H 1 18 ASN QB . . 5.340 4.529 3.247 5.363 0.023 18 0 "[ . 1 . 2]" 1
2057 1 17 ASP QB 1 18 ASN H . . 4.090 3.791 2.606 4.003 . 0 0 "[ . 1 . 2]" 1
2058 1 18 ASN H 1 18 ASN QB . . 3.120 2.741 2.283 3.178 0.058 1 0 "[ . 1 . 2]" 1
2059 1 18 ASN H 1 19 PRO QG . . 5.340 4.855 4.036 5.413 0.073 6 0 "[ . 1 . 2]" 1
2060 1 18 ASN HA 1 19 PRO QG . . 4.290 3.918 3.664 4.168 . 0 0 "[ . 1 . 2]" 1
2061 1 18 ASN QB 1 19 PRO HA . . 5.150 4.802 4.494 5.149 . 0 0 "[ . 1 . 2]" 1
2062 1 18 ASN QB 1 21 GLY H . . 5.340 3.392 2.373 5.286 . 0 0 "[ . 1 . 2]" 1
2063 1 19 PRO QB 1 20 ARG QB . . 5.330 4.399 3.862 5.339 0.009 15 0 "[ . 1 . 2]" 1
2064 1 19 PRO QG 1 20 ARG H . . 3.800 3.545 2.762 3.830 0.030 11 0 "[ . 1 . 2]" 1
2065 1 20 ARG H 1 20 ARG QB . . 3.420 2.730 2.561 2.922 . 0 0 "[ . 1 . 2]" 1
2066 1 20 ARG HA 1 21 GLY QA . . 5.340 4.226 4.112 4.400 . 0 0 "[ . 1 . 2]" 1
2067 1 20 ARG QB 1 20 ARG QD . . 3.440 2.231 2.154 2.595 . 0 0 "[ . 1 . 2]" 1
2068 1 20 ARG QB 1 21 GLY QA . . 4.760 3.576 3.382 3.767 . 0 0 "[ . 1 . 2]" 1
2069 1 20 ARG QB 1 22 CYS H . . 5.340 3.284 2.433 4.765 . 0 0 "[ . 1 . 2]" 1
2070 1 21 GLY QA 1 22 CYS H . . 2.820 2.470 2.260 2.754 . 0 0 "[ . 1 . 2]" 1
2071 1 21 GLY QA 1 22 CYS HA . . 4.330 3.990 3.888 4.156 . 0 0 "[ . 1 . 2]" 1
2072 1 21 GLY QA 1 22 CYS HB2 . . 4.610 4.466 4.323 4.617 0.007 9 0 "[ . 1 . 2]" 1
2073 1 21 GLY QA 1 22 CYS HB3 . . 5.340 5.415 5.360 5.494 0.154 9 0 "[ . 1 . 2]" 1
2074 1 21 GLY QA 1 23 GLN H . . 5.340 5.161 4.755 5.361 0.021 14 0 "[ . 1 . 2]" 1
2075 1 21 GLY QA 1 23 GLN QB . . 5.340 5.301 4.655 5.475 0.135 14 0 "[ . 1 . 2]" 1
2076 1 22 CYS HB3 1 24 ILE QG . . 4.080 3.063 2.914 3.222 . 0 0 "[ . 1 . 2]" 1
2077 1 23 GLN H 1 24 ILE QG . . 5.140 4.425 4.233 4.686 . 0 0 "[ . 1 . 2]" 1
2078 1 24 ILE H 1 66 VAL QG . . 5.440 4.923 4.681 5.257 . 0 0 "[ . 1 . 2]" 1
2079 1 24 ILE HA 1 25 ARG QG . . 4.730 3.996 3.766 4.229 . 0 0 "[ . 1 . 2]" 1
2080 1 24 ILE MG 1 25 ARG QG . . 3.680 3.072 2.623 3.436 . 0 0 "[ . 1 . 2]" 1
2081 1 24 ILE MG 1 66 VAL QG . . 3.580 1.982 1.881 2.087 . 0 0 "[ . 1 . 2]" 1
2082 1 24 ILE QG 1 25 ARG H . . 4.730 4.293 4.096 4.421 . 0 0 "[ . 1 . 2]" 1
2083 1 24 ILE QG 1 73 GLU HB3 . . 4.650 4.132 3.869 4.344 . 0 0 "[ . 1 . 2]" 1
2084 1 24 ILE QG 1 73 GLU QG . . 5.340 4.654 4.448 4.780 . 0 0 "[ . 1 . 2]" 1
2085 1 24 ILE QG 1 74 ALA HA . . 4.140 2.692 2.465 3.003 . 0 0 "[ . 1 . 2]" 1
2086 1 24 ILE QG 1 74 ALA MB . . 3.640 2.009 1.884 2.100 . 0 0 "[ . 1 . 2]" 1
2087 1 24 ILE QG 1 77 GLN HG3 . . 5.330 3.838 3.408 4.175 . 0 0 "[ . 1 . 2]" 1
2088 1 24 ILE MD 1 66 VAL QG . . 3.880 3.465 3.334 3.579 . 0 0 "[ . 1 . 2]" 1
2089 1 25 ARG H 1 25 ARG QG . . 3.340 2.066 1.947 2.202 . 0 0 "[ . 1 . 2]" 1
2090 1 25 ARG HA 1 25 ARG QG . . 3.650 3.372 3.322 3.417 . 0 0 "[ . 1 . 2]" 1
2091 1 25 ARG HA 1 29 LEU QD . . 5.440 4.653 4.528 4.803 . 0 0 "[ . 1 . 2]" 1
2092 1 25 ARG QB 1 26 ILE QG . . 5.340 4.445 4.273 4.575 . 0 0 "[ . 1 . 2]" 1
2093 1 25 ARG QG 1 26 ILE H . . 4.460 4.234 4.106 4.320 . 0 0 "[ . 1 . 2]" 1
2094 1 25 ARG QG 1 27 GLN H . . 4.070 3.335 3.149 3.466 . 0 0 "[ . 1 . 2]" 1
2095 1 25 ARG QG 1 27 GLN QG . . 4.080 2.557 2.302 3.161 . 0 0 "[ . 1 . 2]" 1
2096 1 25 ARG QG 1 28 GLN H . . 4.200 2.482 2.314 2.601 . 0 0 "[ . 1 . 2]" 1
2097 1 25 ARG QG 1 28 GLN HA . . 4.720 4.020 3.910 4.093 . 0 0 "[ . 1 . 2]" 1
2098 1 25 ARG QG 1 28 GLN QB . . 3.630 2.022 1.889 2.134 . 0 0 "[ . 1 . 2]" 1
2099 1 26 ILE H 1 26 ILE QG . . 3.310 2.022 1.915 2.163 . 0 0 "[ . 1 . 2]" 1
2100 1 26 ILE HA 1 29 LEU QD . . 3.180 2.214 2.059 2.505 . 0 0 "[ . 1 . 2]" 1
2101 1 26 ILE QG 1 26 ILE MG . . 3.120 2.068 2.051 2.085 . 0 0 "[ . 1 . 2]" 1
2102 1 26 ILE MG 1 29 LEU QD . . 3.450 3.123 2.797 3.461 0.011 12 0 "[ . 1 . 2]" 1
2103 1 26 ILE QG 1 27 GLN H . . 3.890 3.195 3.048 3.318 . 0 0 "[ . 1 . 2]" 1
2104 1 26 ILE MD 1 30 ASN QB . . 5.230 4.206 3.711 4.530 . 0 0 "[ . 1 . 2]" 1
2105 1 27 GLN HA 1 30 ASN QB . . 5.050 2.600 2.273 3.026 . 0 0 "[ . 1 . 2]" 1
2106 1 28 GLN H 1 29 LEU QD . . 4.310 3.060 2.941 3.191 . 0 0 "[ . 1 . 2]" 1
2107 1 28 GLN HA 1 29 LEU QD . . 4.870 4.154 4.013 4.233 . 0 0 "[ . 1 . 2]" 1
2108 1 28 GLN QB 1 29 LEU QD . . 4.740 3.380 3.315 3.477 . 0 0 "[ . 1 . 2]" 1
2109 1 28 GLN HG3 1 29 LEU QD . . 4.430 1.948 1.812 2.149 . 0 0 "[ . 1 . 2]" 1
2110 1 29 LEU H 1 29 LEU QD . . 3.630 2.180 2.047 2.364 . 0 0 "[ . 1 . 2]" 1
2111 1 29 LEU H 1 30 ASN QB . . 4.320 4.025 3.845 4.325 0.005 6 0 "[ . 1 . 2]" 1
2112 1 29 LEU H 1 78 VAL QG . . 5.160 4.764 4.685 4.919 . 0 0 "[ . 1 . 2]" 1
2113 1 29 LEU HA 1 29 LEU QD . . 3.530 1.937 1.906 1.980 . 0 0 "[ . 1 . 2]" 1
2114 1 29 LEU HA 1 78 VAL QG . . 4.180 3.376 3.144 3.551 . 0 0 "[ . 1 . 2]" 1
2115 1 29 LEU QB 1 78 VAL QG . . 3.150 1.892 1.831 1.977 . 0 0 "[ . 1 . 2]" 1
2116 1 29 LEU HG 1 78 VAL QG . . 3.420 1.977 1.862 2.056 . 0 0 "[ . 1 . 2]" 1
2117 1 29 LEU QD 1 30 ASN H . . 3.870 3.786 3.697 3.895 0.025 1 0 "[ . 1 . 2]" 1
2118 1 29 LEU QD 1 31 HIS H . . 4.560 4.651 4.607 4.683 0.123 9 0 "[ . 1 . 2]" 1
2119 1 29 LEU QD 1 32 CYS H . . 5.360 4.135 3.774 4.317 . 0 0 "[ . 1 . 2]" 1
2120 1 29 LEU QD 1 33 GLN H . . 4.890 4.457 4.257 4.567 . 0 0 "[ . 1 . 2]" 1
2121 1 29 LEU QD 1 33 GLN QB . . 4.480 4.594 4.552 4.649 0.169 13 0 "[ . 1 . 2]" 1
2122 1 29 LEU QD 1 78 VAL H . . 4.810 3.758 3.577 3.919 . 0 0 "[ . 1 . 2]" 1
2123 1 29 LEU QD 1 78 VAL HA . . 4.600 3.932 3.827 4.007 . 0 0 "[ . 1 . 2]" 1
2124 1 29 LEU QD 1 78 VAL QG . . 3.800 2.077 1.912 2.280 . 0 0 "[ . 1 . 2]" 1
2125 1 30 ASN H 1 30 ASN QB . . 3.210 2.285 2.158 2.670 . 0 0 "[ . 1 . 2]" 1
2126 1 30 ASN HA 1 34 MET QB . . 5.130 4.558 4.332 4.762 . 0 0 "[ . 1 . 2]" 1
2127 1 30 ASN HA 1 34 MET QG . . 4.940 4.540 4.286 4.933 . 0 0 "[ . 1 . 2]" 1
2128 1 30 ASN QB 1 31 HIS H . . 3.930 2.865 2.677 3.561 . 0 0 "[ . 1 . 2]" 1
2129 1 31 HIS H 1 34 MET QG . . 5.340 4.275 4.145 4.373 . 0 0 "[ . 1 . 2]" 1
2130 1 31 HIS HA 1 34 MET QB . . 5.020 4.140 3.823 4.406 . 0 0 "[ . 1 . 2]" 1
2131 1 31 HIS HA 1 34 MET QG . . 3.460 2.115 1.929 2.313 . 0 0 "[ . 1 . 2]" 1
2132 1 31 HIS HB2 1 58 LEU QD . . 5.090 4.737 4.381 4.990 . 0 0 "[ . 1 . 2]" 1
2133 1 31 HIS HB3 1 58 LEU QD . . 5.440 4.643 4.387 4.953 . 0 0 "[ . 1 . 2]" 1
2134 1 31 HIS HD2 1 35 HIS QB . . 3.440 2.281 2.063 2.623 . 0 0 "[ . 1 . 2]" 1
2135 1 31 HIS HD2 1 58 LEU QD . . 4.220 4.104 3.626 4.319 0.099 15 0 "[ . 1 . 2]" 1
2136 1 31 HIS HE1 1 58 LEU QD . . 3.630 2.255 2.022 2.456 . 0 0 "[ . 1 . 2]" 1
2137 1 32 CYS H 1 78 VAL QG . . 4.520 3.985 3.874 4.087 . 0 0 "[ . 1 . 2]" 1
2138 1 32 CYS HA 1 35 HIS QB . . 4.010 3.244 2.562 3.766 . 0 0 "[ . 1 . 2]" 1
2139 1 32 CYS HA 1 78 VAL QG . . 4.880 3.888 3.795 4.014 . 0 0 "[ . 1 . 2]" 1
2140 1 32 CYS HB2 1 78 VAL QG . . 3.560 2.864 2.651 3.201 . 0 0 "[ . 1 . 2]" 1
2141 1 32 CYS HB3 1 78 VAL QG . . 3.330 1.931 1.817 2.088 . 0 0 "[ . 1 . 2]" 1
2142 1 33 GLN H 1 78 VAL QG . . 3.630 2.509 2.476 2.555 . 0 0 "[ . 1 . 2]" 1
2143 1 33 GLN HA 1 78 VAL QG . . 3.230 2.396 2.279 2.552 . 0 0 "[ . 1 . 2]" 1
2144 1 33 GLN QB 1 78 VAL QG . . 4.960 2.562 2.482 2.653 . 0 0 "[ . 1 . 2]" 1
2145 1 33 GLN HG3 1 78 VAL QG . . 3.910 3.936 3.865 3.990 0.080 7 0 "[ . 1 . 2]" 1
2146 1 34 MET H 1 34 MET QB . . 2.990 2.592 2.446 2.718 . 0 0 "[ . 1 . 2]" 1
2147 1 34 MET H 1 34 MET QG . . 3.090 2.302 2.235 2.402 . 0 0 "[ . 1 . 2]" 1
2148 1 34 MET H 1 35 HIS QB . . 4.580 4.441 4.199 4.635 0.055 2 0 "[ . 1 . 2]" 1
2149 1 34 MET QB 1 35 HIS H . . 3.340 3.444 3.414 3.496 0.156 8 0 "[ . 1 . 2]" 1
2150 1 34 MET QB 1 36 LEU H . . 5.340 4.985 4.850 5.172 . 0 0 "[ . 1 . 2]" 1
2151 1 34 MET QG 1 35 HIS H . . 2.970 2.270 2.109 2.460 . 0 0 "[ . 1 . 2]" 1
2152 1 34 MET QG 1 36 LEU H . . 5.340 4.453 4.330 4.586 . 0 0 "[ . 1 . 2]" 1
2153 1 35 HIS QB 1 35 HIS HD2 . . 3.480 2.633 2.552 2.927 . 0 0 "[ . 1 . 2]" 1
2154 1 35 HIS QB 1 36 LEU H . . 3.750 3.077 2.691 3.692 . 0 0 "[ . 1 . 2]" 1
2155 1 35 HIS QB 1 37 THR H . . 5.340 4.949 4.662 5.373 0.033 19 0 "[ . 1 . 2]" 1
2156 1 36 LEU HA 1 102 LYS QE . . 4.730 4.729 4.630 4.809 0.079 8 0 "[ . 1 . 2]" 1
2157 1 36 LEU HB3 1 102 LYS QB . . 5.340 4.586 4.216 4.990 . 0 0 "[ . 1 . 2]" 1
2158 1 36 LEU QD 1 102 LYS QB . . 3.000 2.264 2.054 2.471 . 0 0 "[ . 1 . 2]" 1
2159 1 36 LEU QD 1 102 LYS QE . . 4.810 2.575 2.228 3.304 . 0 0 "[ . 1 . 2]" 1
2160 1 37 THR HA 1 96 VAL QG . . 3.940 1.820 1.781 1.883 . 0 0 "[ . 1 . 2]" 1
2161 1 37 THR HB 1 96 VAL QG . . 4.830 2.740 2.675 2.816 . 0 0 "[ . 1 . 2]" 1
2162 1 37 THR MG 1 85 GLN QG . . 4.440 2.691 2.535 2.904 . 0 0 "[ . 1 . 2]" 1
2163 1 37 THR MG 1 96 VAL QG . . 3.870 1.926 1.830 2.022 . 0 0 "[ . 1 . 2]" 1
2164 1 39 PHE H 1 39 PHE QB . . 3.200 2.487 2.380 2.605 . 0 0 "[ . 1 . 2]" 1
2165 1 39 PHE QB 1 40 ASP H . . 3.840 3.220 1.878 3.713 . 0 0 "[ . 1 . 2]" 1
2166 1 39 PHE QB 1 40 ASP HA . . 4.680 4.425 3.834 4.682 0.002 1 0 "[ . 1 . 2]" 1
2167 1 39 PHE QE 1 96 VAL QG . . 3.600 2.209 1.934 2.520 . 0 0 "[ . 1 . 2]" 1
2168 1 40 ASP QB 1 41 TYR HB3 . . 5.340 5.192 5.066 5.356 0.016 9 0 "[ . 1 . 2]" 1
2169 1 40 ASP QB 1 41 TYR QD . . 4.650 4.577 4.388 4.697 0.047 4 0 "[ . 1 . 2]" 1
2170 1 40 ASP QB 1 42 LYS QD . . 3.820 2.958 2.319 3.865 0.045 13 0 "[ . 1 . 2]" 1
2171 1 40 ASP QB 1 43 LEU H . . 4.540 3.503 3.327 3.831 . 0 0 "[ . 1 . 2]" 1
2172 1 40 ASP QB 1 43 LEU QB . . 5.180 3.855 3.491 4.295 . 0 0 "[ . 1 . 2]" 1
2173 1 40 ASP QB 1 43 LEU QD . . 4.020 2.084 1.886 2.332 . 0 0 "[ . 1 . 2]" 1
2174 1 43 LEU H 1 43 LEU QB . . 3.200 2.483 2.352 2.586 . 0 0 "[ . 1 . 2]" 1
2175 1 43 LEU HA 1 44 ARG QG . . 4.390 4.194 3.814 4.457 0.067 6 0 "[ . 1 . 2]" 1
2176 1 43 LEU QB 1 43 LEU HG . . 2.550 2.347 2.286 2.403 . 0 0 "[ . 1 . 2]" 1
2177 1 43 LEU QB 1 44 ARG H . . 3.980 3.610 3.095 3.846 . 0 0 "[ . 1 . 2]" 1
2178 1 43 LEU QB 1 45 MET H . . 5.300 4.492 3.569 5.319 0.019 15 0 "[ . 1 . 2]" 1
2179 1 43 LEU QB 1 46 ALA H . . 5.180 3.789 3.063 4.568 . 0 0 "[ . 1 . 2]" 1
2180 1 43 LEU QB 1 46 ALA MB . . 4.110 2.706 1.970 3.890 . 0 0 "[ . 1 . 2]" 1
2181 1 44 ARG H 1 44 ARG QB . . 3.450 2.535 2.386 2.921 . 0 0 "[ . 1 . 2]" 1
2182 1 44 ARG H 1 44 ARG QG . . 3.490 2.555 1.930 3.004 . 0 0 "[ . 1 . 2]" 1
2183 1 44 ARG HA 1 44 ARG QG . . 3.420 2.733 2.328 3.368 . 0 0 "[ . 1 . 2]" 1
2184 1 44 ARG HA 1 45 MET QG . . 4.620 4.617 4.380 4.730 0.110 17 0 "[ . 1 . 2]" 1
2185 1 44 ARG QB 1 44 ARG QD . . 3.360 2.293 2.046 2.737 . 0 0 "[ . 1 . 2]" 1
2186 1 44 ARG QB 1 45 MET H . . 3.850 2.785 1.885 3.663 . 0 0 "[ . 1 . 2]" 1
2187 1 44 ARG QB 1 45 MET QG . . 4.630 2.879 2.392 3.977 . 0 0 "[ . 1 . 2]" 1
2188 1 44 ARG QB 1 46 ALA H . . 5.340 4.590 3.501 5.422 0.082 13 0 "[ . 1 . 2]" 1
2189 1 44 ARG QG 1 45 MET H . . 4.700 3.784 2.379 4.359 . 0 0 "[ . 1 . 2]" 1
2190 1 45 MET H 1 45 MET QB . . 3.380 2.737 2.425 3.275 . 0 0 "[ . 1 . 2]" 1
2191 1 45 MET H 1 45 MET QG . . 3.750 2.678 2.258 3.137 . 0 0 "[ . 1 . 2]" 1
2192 1 45 MET HA 1 45 MET QG . . 3.640 2.851 2.378 3.469 . 0 0 "[ . 1 . 2]" 1
2193 1 45 MET QB 1 46 ALA H . . 4.220 3.653 2.965 4.028 . 0 0 "[ . 1 . 2]" 1
2194 1 45 MET QB 1 46 ALA HA . . 5.180 4.332 3.969 4.690 . 0 0 "[ . 1 . 2]" 1
2195 1 45 MET QB 1 46 ALA MB . . 5.340 4.244 3.596 5.023 . 0 0 "[ . 1 . 2]" 1
2196 1 45 MET QB 1 47 VAL QG . . 5.340 4.652 3.082 5.382 0.042 20 0 "[ . 1 . 2]" 1
2197 1 45 MET QG 1 46 ALA H . . 5.030 4.238 3.293 4.754 . 0 0 "[ . 1 . 2]" 1
2198 1 48 GLU H 1 48 GLU QB . . 3.420 2.740 2.408 3.219 . 0 0 "[ . 1 . 2]" 1
2199 1 48 GLU QB 1 49 ASN H . . 4.090 3.636 2.950 3.956 . 0 0 "[ . 1 . 2]" 1
2200 1 48 GLU QB 1 49 ASN HA . . 5.070 4.296 3.992 4.754 . 0 0 "[ . 1 . 2]" 1
2201 1 49 ASN QB 1 50 PRO QD . . 4.110 2.609 1.936 3.472 . 0 0 "[ . 1 . 2]" 1
2202 1 49 ASN QB 1 51 LYS H . . 4.320 2.979 2.121 3.874 . 0 0 "[ . 1 . 2]" 1
2203 1 49 ASN QB 1 51 LYS QB . . 4.440 3.381 2.426 4.381 . 0 0 "[ . 1 . 2]" 1
2204 1 50 PRO HG2 1 51 LYS QG . . 4.090 2.962 2.559 3.331 . 0 0 "[ . 1 . 2]" 1
2205 1 50 PRO HG3 1 51 LYS QG . . 4.990 4.545 4.200 4.987 . 0 0 "[ . 1 . 2]" 1
2206 1 51 LYS HA 1 51 LYS QG . . 3.470 2.552 2.303 2.954 . 0 0 "[ . 1 . 2]" 1
2207 1 51 LYS QD 1 51 LYS QG . . 2.190 1.991 1.965 2.005 . 0 0 "[ . 1 . 2]" 1
2208 1 51 LYS QG 1 52 GLN H . . 4.370 4.295 4.048 4.434 0.064 12 0 "[ . 1 . 2]" 1
2209 1 53 GLN H 1 53 GLN QB . . 3.070 2.547 2.272 2.952 . 0 0 "[ . 1 . 2]" 1
2210 1 53 GLN HA 1 56 LEU QD . . 5.440 4.521 3.733 5.322 . 0 0 "[ . 1 . 2]" 1
2211 1 53 GLN QB 1 56 LEU H . . 4.410 3.992 3.738 4.392 . 0 0 "[ . 1 . 2]" 1
2212 1 53 GLN QB 1 56 LEU QD . . 4.390 3.426 2.343 4.128 . 0 0 "[ . 1 . 2]" 1
2213 1 53 GLN QB 1 57 SER H . . 5.080 4.098 3.632 5.105 0.025 8 0 "[ . 1 . 2]" 1
2214 1 54 GLN QG 1 58 LEU QD . . 4.620 3.537 2.779 4.223 . 0 0 "[ . 1 . 2]" 1
2215 1 55 HIS H 1 56 LEU QB . . 4.700 4.339 4.113 4.586 . 0 0 "[ . 1 . 2]" 1
2216 1 55 HIS H 1 58 LEU QD . . 5.320 4.223 3.981 4.473 . 0 0 "[ . 1 . 2]" 1
2217 1 55 HIS HA 1 58 LEU QD . . 3.830 2.348 2.036 2.729 . 0 0 "[ . 1 . 2]" 1
2218 1 55 HIS QB 1 55 HIS HD2 . . 3.310 3.148 2.944 3.246 . 0 0 "[ . 1 . 2]" 1
2219 1 55 HIS QB 1 56 LEU H . . 4.210 3.672 3.582 3.730 . 0 0 "[ . 1 . 2]" 1
2220 1 55 HIS QB 1 56 LEU HA . . 5.340 4.368 4.265 4.527 . 0 0 "[ . 1 . 2]" 1
2221 1 55 HIS QB 1 58 LEU HB2 . . 5.340 4.098 3.678 4.451 . 0 0 "[ . 1 . 2]" 1
2222 1 55 HIS QB 1 58 LEU QD . . 4.630 3.480 2.820 3.920 . 0 0 "[ . 1 . 2]" 1
2223 1 55 HIS HD2 1 56 LEU QB . . 4.240 2.666 2.366 3.166 . 0 0 "[ . 1 . 2]" 1
2224 1 56 LEU H 1 56 LEU QD . . 4.560 3.731 3.673 3.807 . 0 0 "[ . 1 . 2]" 1
2225 1 56 LEU H 1 58 LEU QD . . 5.080 4.812 4.739 4.919 . 0 0 "[ . 1 . 2]" 1
2226 1 56 LEU HA 1 56 LEU QD . . 3.650 2.159 2.054 2.317 . 0 0 "[ . 1 . 2]" 1
2227 1 56 LEU HA 1 60 CYS QB . . 4.360 3.782 3.335 4.033 . 0 0 "[ . 1 . 2]" 1
2228 1 56 LEU QB 1 57 SER H . . 3.420 2.518 2.207 2.693 . 0 0 "[ . 1 . 2]" 1
2229 1 56 LEU QB 1 59 CYS HB3 . . 5.340 4.588 4.279 4.931 . 0 0 "[ . 1 . 2]" 1
2230 1 56 LEU QB 1 60 CYS H . . 4.850 4.693 4.593 4.783 . 0 0 "[ . 1 . 2]" 1
2231 1 56 LEU QD 1 57 SER H . . 4.980 3.129 2.987 3.320 . 0 0 "[ . 1 . 2]" 1
2232 1 56 LEU QD 1 57 SER HA . . 4.470 2.888 2.689 3.427 . 0 0 "[ . 1 . 2]" 1
2233 1 56 LEU QD 1 57 SER QB . . 4.190 4.117 3.987 4.225 0.035 12 0 "[ . 1 . 2]" 1
2234 1 56 LEU QD 1 58 LEU H . . 4.560 4.360 4.265 4.666 0.106 3 0 "[ . 1 . 2]" 1
2235 1 56 LEU QD 1 59 CYS H . . 5.030 4.199 3.949 4.778 . 0 0 "[ . 1 . 2]" 1
2236 1 56 LEU QD 1 59 CYS HB2 . . 5.440 4.532 4.156 5.405 . 0 0 "[ . 1 . 2]" 1
2237 1 56 LEU QD 1 59 CYS HB3 . . 5.440 3.167 2.764 3.990 . 0 0 "[ . 1 . 2]" 1
2238 1 56 LEU QD 1 60 CYS H . . 4.210 2.727 2.528 3.240 . 0 0 "[ . 1 . 2]" 1
2239 1 56 LEU QD 1 60 CYS HA . . 4.690 3.632 3.495 3.956 . 0 0 "[ . 1 . 2]" 1
2240 1 56 LEU QD 1 60 CYS QB . . 3.590 1.965 1.867 2.083 . 0 0 "[ . 1 . 2]" 1
2241 1 56 LEU QD 1 61 ASN H . . 4.460 4.355 4.264 4.540 0.080 13 0 "[ . 1 . 2]" 1
2242 1 56 LEU QD 1 61 ASN HB2 . . 5.380 5.405 5.275 5.502 0.122 8 0 "[ . 1 . 2]" 1
2243 1 57 SER HA 1 58 LEU QD . . 5.440 4.761 4.598 4.896 . 0 0 "[ . 1 . 2]" 1
2244 1 57 SER HA 1 60 CYS QB . . 4.530 3.269 2.833 3.504 . 0 0 "[ . 1 . 2]" 1
2245 1 57 SER QB 1 58 LEU QD . . 4.520 3.169 2.897 3.472 . 0 0 "[ . 1 . 2]" 1
2246 1 57 SER QB 1 60 CYS QB . . 5.190 5.005 4.644 5.227 0.037 13 0 "[ . 1 . 2]" 1
2247 1 58 LEU HA 1 58 LEU QD . . 3.870 2.098 2.002 2.151 . 0 0 "[ . 1 . 2]" 1
2248 1 58 LEU HB3 1 58 LEU QD . . 2.770 2.124 2.109 2.148 . 0 0 "[ . 1 . 2]" 1
2249 1 58 LEU QD 1 59 CYS H . . 3.910 3.895 3.809 3.966 0.056 11 0 "[ . 1 . 2]" 1
2250 1 58 LEU QD 1 59 CYS HA . . 5.440 5.120 5.073 5.158 . 0 0 "[ . 1 . 2]" 1
2251 1 58 LEU QD 1 59 CYS HB2 . . 5.440 5.022 4.814 5.331 . 0 0 "[ . 1 . 2]" 1
2252 1 58 LEU QD 1 61 ASN H . . 5.440 5.136 4.978 5.356 . 0 0 "[ . 1 . 2]" 1
2253 1 60 CYS H 1 110 CYS QB . . 5.340 5.130 4.745 5.552 0.212 17 0 "[ . 1 . 2]" 1
2254 1 60 CYS HA 1 63 LEU QD . . 3.620 1.838 1.777 1.925 . 0 0 "[ . 1 . 2]" 1
2255 1 60 CYS HA 1 110 CYS QB . . 3.870 3.628 3.451 3.744 . 0 0 "[ . 1 . 2]" 1
2256 1 60 CYS QB 1 61 ASN H . . 3.510 2.753 2.437 2.881 . 0 0 "[ . 1 . 2]" 1
2257 1 60 CYS QB 1 61 ASN HA . . 4.700 4.258 3.864 4.381 . 0 0 "[ . 1 . 2]" 1
2258 1 60 CYS QB 1 61 ASN HB2 . . 4.470 4.086 3.684 4.257 . 0 0 "[ . 1 . 2]" 1
2259 1 60 CYS QB 1 62 GLN H . . 5.340 4.671 4.449 4.855 . 0 0 "[ . 1 . 2]" 1
2260 1 60 CYS QB 1 110 CYS H . . 5.340 5.010 4.558 5.405 0.065 17 0 "[ . 1 . 2]" 1
2261 1 60 CYS QB 1 110 CYS HA . . 4.500 3.909 3.594 4.555 0.055 20 0 "[ . 1 . 2]" 1
2262 1 60 CYS QB 1 110 CYS QB . . 4.570 2.921 2.271 3.934 . 0 0 "[ . 1 . 2]" 1
2263 1 62 GLN HA 1 65 GLU QG . . 3.800 2.944 2.289 3.454 . 0 0 "[ . 1 . 2]" 1
2264 1 63 LEU H 1 63 LEU QD . . 3.850 2.961 2.892 3.024 . 0 0 "[ . 1 . 2]" 1
2265 1 63 LEU HA 1 63 LEU QD . . 3.590 3.358 3.335 3.375 . 0 0 "[ . 1 . 2]" 1
2266 1 63 LEU HA 1 66 VAL QG . . 3.690 2.319 2.079 2.570 . 0 0 "[ . 1 . 2]" 1
2267 1 63 LEU QD 1 64 GLN H . . 4.320 2.659 2.531 2.756 . 0 0 "[ . 1 . 2]" 1
2268 1 63 LEU QD 1 64 GLN QB . . 3.420 2.788 2.688 2.854 . 0 0 "[ . 1 . 2]" 1
2269 1 63 LEU QD 1 64 GLN QG . . 4.340 3.885 3.766 3.955 . 0 0 "[ . 1 . 2]" 1
2270 1 63 LEU QD 1 65 GLU H . . 4.720 4.226 4.132 4.327 . 0 0 "[ . 1 . 2]" 1
2271 1 63 LEU QD 1 66 VAL H . . 4.860 4.373 4.313 4.423 . 0 0 "[ . 1 . 2]" 1
2272 1 63 LEU QD 1 66 VAL QG . . 3.820 3.917 3.872 3.959 0.139 7 0 "[ . 1 . 2]" 1
2273 1 63 LEU QD 1 71 GLN H . . 5.080 4.619 4.488 4.855 . 0 0 "[ . 1 . 2]" 1
2274 1 63 LEU QD 1 71 GLN HA . . 3.460 2.864 2.721 3.134 . 0 0 "[ . 1 . 2]" 1
2275 1 63 LEU QD 1 71 GLN HB2 . . 3.560 3.446 3.311 3.616 0.056 17 0 "[ . 1 . 2]" 1
2276 1 63 LEU QD 1 71 GLN HB3 . . 3.790 2.036 1.899 2.197 . 0 0 "[ . 1 . 2]" 1
2277 1 63 LEU QD 1 71 GLN HG3 . . 4.110 3.856 3.649 4.001 . 0 0 "[ . 1 . 2]" 1
2278 1 63 LEU QD 1 72 CYS H . . 5.050 4.326 4.199 4.443 . 0 0 "[ . 1 . 2]" 1
2279 1 63 LEU QD 1 72 CYS HA . . 5.180 3.777 3.590 3.897 . 0 0 "[ . 1 . 2]" 1
2280 1 63 LEU QD 1 72 CYS HB3 . . 5.440 4.825 4.627 5.053 . 0 0 "[ . 1 . 2]" 1
2281 1 63 LEU QD 1 73 GLU H . . 5.440 5.274 5.133 5.446 0.006 14 0 "[ . 1 . 2]" 1
2282 1 63 LEU QD 1 74 ALA MB . . 5.440 3.146 2.960 3.346 . 0 0 "[ . 1 . 2]" 1
2283 1 63 LEU QD 1 75 ILE H . . 5.440 4.348 4.100 4.576 . 0 0 "[ . 1 . 2]" 1
2284 1 63 LEU QD 1 75 ILE MD . . 4.780 1.806 1.751 1.876 . 0 0 "[ . 1 . 2]" 1
2285 1 63 LEU QD 1 112 LEU H . . 5.440 5.210 5.135 5.348 . 0 0 "[ . 1 . 2]" 1
2286 1 63 LEU QD 1 112 LEU HG . . 5.440 3.433 3.359 3.512 . 0 0 "[ . 1 . 2]" 1
2287 1 64 GLN HA 1 66 VAL QG . . 4.870 4.415 4.319 4.514 . 0 0 "[ . 1 . 2]" 1
2288 1 64 GLN QG 1 65 GLU QG . . 3.080 2.745 2.452 3.098 0.018 3 0 "[ . 1 . 2]" 1
2289 1 65 GLU H 1 65 GLU QG . . 4.490 2.426 2.257 2.648 . 0 0 "[ . 1 . 2]" 1
2290 1 65 GLU H 1 66 VAL QG . . 5.440 3.247 3.140 3.487 . 0 0 "[ . 1 . 2]" 1
2291 1 65 GLU HB2 1 66 VAL QG . . 5.070 3.378 3.081 3.603 . 0 0 "[ . 1 . 2]" 1
2292 1 65 GLU HB3 1 66 VAL QG . . 5.440 4.352 4.093 4.531 . 0 0 "[ . 1 . 2]" 1
2293 1 65 GLU QG 1 66 VAL H . . 4.830 4.149 3.980 4.345 . 0 0 "[ . 1 . 2]" 1
2294 1 66 VAL H 1 66 VAL QG . . 2.920 1.976 1.906 2.074 . 0 0 "[ . 1 . 2]" 1
2295 1 66 VAL QG 1 67 GLU H . . 3.020 1.927 1.818 2.058 . 0 0 "[ . 1 . 2]" 1
2296 1 66 VAL QG 1 67 GLU HA . . 4.140 4.005 3.960 4.082 . 0 0 "[ . 1 . 2]" 1
2297 1 66 VAL QG 1 67 GLU HB2 . . 4.390 2.802 2.663 2.890 . 0 0 "[ . 1 . 2]" 1
2298 1 66 VAL QG 1 67 GLU HB3 . . 4.500 4.180 3.674 4.291 . 0 0 "[ . 1 . 2]" 1
2299 1 66 VAL QG 1 67 GLU QG . . 3.930 3.597 3.211 3.998 0.068 11 0 "[ . 1 . 2]" 1
2300 1 66 VAL QG 1 68 LYS H . . 5.440 5.124 5.068 5.204 . 0 0 "[ . 1 . 2]" 1
2301 1 66 VAL QG 1 69 GLN H . . 5.440 5.345 5.200 5.437 . 0 0 "[ . 1 . 2]" 1
2302 1 66 VAL QG 1 70 CYS H . . 4.280 3.869 3.788 3.973 . 0 0 "[ . 1 . 2]" 1
2303 1 66 VAL QG 1 70 CYS HA . . 4.400 4.210 4.109 4.394 . 0 0 "[ . 1 . 2]" 1
2304 1 66 VAL QG 1 70 CYS HB2 . . 3.420 2.005 1.923 2.146 . 0 0 "[ . 1 . 2]" 1
2305 1 66 VAL QG 1 70 CYS HB3 . . 3.690 2.619 2.472 2.777 . 0 0 "[ . 1 . 2]" 1
2306 1 66 VAL QG 1 71 GLN H . . 4.220 3.866 3.704 4.022 . 0 0 "[ . 1 . 2]" 1
2307 1 66 VAL QG 1 71 GLN HA . . 4.180 3.344 3.203 3.532 . 0 0 "[ . 1 . 2]" 1
2308 1 66 VAL QG 1 71 GLN HG2 . . 5.440 3.692 3.553 3.908 . 0 0 "[ . 1 . 2]" 1
2309 1 66 VAL QG 1 71 GLN HG3 . . 4.750 3.804 3.577 4.090 . 0 0 "[ . 1 . 2]" 1
2310 1 66 VAL QG 1 74 ALA H . . 5.060 4.252 4.100 4.438 . 0 0 "[ . 1 . 2]" 1
2311 1 66 VAL QG 1 74 ALA MB . . 2.950 2.788 2.615 2.927 . 0 0 "[ . 1 . 2]" 1
2312 1 67 GLU H 1 69 GLN QG . . 5.340 5.269 5.061 5.372 0.032 13 0 "[ . 1 . 2]" 1
2313 1 67 GLU HA 1 69 GLN QG . . 4.840 4.613 4.334 4.864 0.024 13 0 "[ . 1 . 2]" 1
2314 1 68 LYS H 1 68 LYS QG . . 3.370 2.130 2.022 2.273 . 0 0 "[ . 1 . 2]" 1
2315 1 68 LYS H 1 69 GLN QG . . 4.590 3.991 3.685 4.246 . 0 0 "[ . 1 . 2]" 1
2316 1 68 LYS HA 1 69 GLN QG . . 5.340 5.098 4.876 5.247 . 0 0 "[ . 1 . 2]" 1
2317 1 68 LYS QG 1 69 GLN H . . 3.850 2.422 2.117 2.598 . 0 0 "[ . 1 . 2]" 1
2318 1 68 LYS QG 1 69 GLN HA . . 4.660 3.646 3.332 3.821 . 0 0 "[ . 1 . 2]" 1
2319 1 68 LYS QG 1 69 GLN QB . . 5.340 3.203 2.833 3.460 . 0 0 "[ . 1 . 2]" 1
2320 1 68 LYS QG 1 70 CYS H . . 4.660 4.381 4.118 4.513 . 0 0 "[ . 1 . 2]" 1
2321 1 69 GLN H 1 69 GLN QG . . 3.130 2.031 1.804 2.202 . 0 0 "[ . 1 . 2]" 1
2322 1 69 GLN HA 1 69 GLN QG . . 3.390 3.344 3.319 3.371 . 0 0 "[ . 1 . 2]" 1
2323 1 69 GLN QG 1 70 CYS H . . 3.670 2.696 2.445 2.936 . 0 0 "[ . 1 . 2]" 1
2324 1 69 GLN QG 1 70 CYS HA . . 4.500 3.536 3.315 3.762 . 0 0 "[ . 1 . 2]" 1
2325 1 69 GLN QG 1 70 CYS HB3 . . 5.310 4.305 4.200 4.460 . 0 0 "[ . 1 . 2]" 1
2326 1 71 GLN HB3 1 112 LEU QB . . 4.890 3.580 3.139 3.832 . 0 0 "[ . 1 . 2]" 1
2327 1 72 CYS H 1 112 LEU QB . . 5.340 3.362 3.077 3.759 . 0 0 "[ . 1 . 2]" 1
2328 1 74 ALA H 1 75 ILE QG . . 4.760 3.755 3.691 3.815 . 0 0 "[ . 1 . 2]" 1
2329 1 74 ALA MB 1 75 ILE QG . . 3.610 3.360 3.189 3.494 . 0 0 "[ . 1 . 2]" 1
2330 1 75 ILE H 1 75 ILE QG . . 5.100 2.012 1.951 2.059 . 0 0 "[ . 1 . 2]" 1
2331 1 75 ILE H 1 78 VAL QG . . 4.640 4.034 3.863 4.160 . 0 0 "[ . 1 . 2]" 1
2332 1 75 ILE HA 1 78 VAL QG . . 3.550 2.112 1.988 2.308 . 0 0 "[ . 1 . 2]" 1
2333 1 75 ILE MG 1 79 VAL QG . . 3.310 2.849 2.611 3.059 . 0 0 "[ . 1 . 2]" 1
2334 1 75 ILE QG 1 76 LYS H . . 4.670 3.890 3.776 4.041 . 0 0 "[ . 1 . 2]" 1
2335 1 75 ILE QG 1 76 LYS QD . . 5.280 4.776 4.335 5.045 . 0 0 "[ . 1 . 2]" 1
2336 1 75 ILE QG 1 107 PRO HB3 . . 4.350 3.162 2.699 3.837 . 0 0 "[ . 1 . 2]" 1
2337 1 76 LYS H 1 78 VAL QG . . 4.610 4.189 4.089 4.310 . 0 0 "[ . 1 . 2]" 1
2338 1 76 LYS H 1 79 VAL QG . . 4.770 4.493 4.390 4.612 . 0 0 "[ . 1 . 2]" 1
2339 1 76 LYS HA 1 79 VAL QG . . 3.620 2.781 2.540 2.979 . 0 0 "[ . 1 . 2]" 1
2340 1 77 GLN H 1 78 VAL QG . . 4.220 3.873 3.773 3.971 . 0 0 "[ . 1 . 2]" 1
2341 1 77 GLN H 1 79 VAL QG . . 4.570 4.637 4.616 4.678 0.108 8 0 "[ . 1 . 2]" 1
2342 1 77 GLN HA 1 78 VAL QG . . 5.040 4.814 4.783 4.864 . 0 0 "[ . 1 . 2]" 1
2343 1 77 GLN HB2 1 78 VAL QG . . 5.200 3.326 3.142 3.526 . 0 0 "[ . 1 . 2]" 1
2344 1 78 VAL H 1 78 VAL QG . . 3.280 1.926 1.841 1.989 . 0 0 "[ . 1 . 2]" 1
2345 1 78 VAL H 1 79 VAL QG . . 4.000 3.880 3.775 3.966 . 0 0 "[ . 1 . 2]" 1
2346 1 78 VAL HA 1 78 VAL QG . . 2.970 2.153 2.134 2.175 . 0 0 "[ . 1 . 2]" 1
2347 1 78 VAL QG 1 79 VAL HA . . 3.760 3.410 3.321 3.498 . 0 0 "[ . 1 . 2]" 1
2348 1 78 VAL QG 1 80 GLU H . . 4.590 4.613 4.548 4.640 0.050 1 0 "[ . 1 . 2]" 1
2349 1 78 VAL QG 1 81 GLN H . . 4.690 4.580 4.475 4.652 . 0 0 "[ . 1 . 2]" 1
2350 1 78 VAL QG 1 81 GLN HG2 . . 3.640 3.632 3.452 3.727 0.087 9 0 "[ . 1 . 2]" 1
2351 1 78 VAL QG 1 82 ALA H . . 4.930 3.933 3.845 4.011 . 0 0 "[ . 1 . 2]" 1
2352 1 78 VAL QG 1 82 ALA MB . . 3.370 2.759 2.616 2.845 . 0 0 "[ . 1 . 2]" 1
2353 1 78 VAL QG 1 83 GLN H . . 5.440 5.424 5.342 5.469 0.029 6 0 "[ . 1 . 2]" 1
2354 1 79 VAL H 1 79 VAL QG . . 2.870 1.971 1.918 2.015 . 0 0 "[ . 1 . 2]" 1
2355 1 79 VAL QG 1 80 GLU QB . . 5.020 4.219 3.893 4.547 . 0 0 "[ . 1 . 2]" 1
2356 1 79 VAL QG 1 81 GLN H . . 5.440 4.706 4.572 4.832 . 0 0 "[ . 1 . 2]" 1
2357 1 79 VAL QG 1 82 ALA H . . 4.480 4.470 4.377 4.509 0.029 12 0 "[ . 1 . 2]" 1
2358 1 79 VAL QG 1 83 GLN H . . 3.870 3.900 3.821 3.941 0.071 5 0 "[ . 1 . 2]" 1
2359 1 79 VAL QG 1 83 GLN HA . . 5.340 5.018 4.873 5.159 . 0 0 "[ . 1 . 2]" 1
2360 1 79 VAL QG 1 83 GLN QB . . 3.180 3.116 2.959 3.253 0.073 3 0 "[ . 1 . 2]" 1
2361 1 79 VAL QG 1 83 GLN QG . . 3.880 3.337 3.112 3.517 . 0 0 "[ . 1 . 2]" 1
2362 1 79 VAL QG 1 84 LYS H . . 5.440 5.452 5.374 5.483 0.043 19 0 "[ . 1 . 2]" 1
2363 1 79 VAL QG 1 103 ALA H . . 5.440 4.499 4.075 4.730 . 0 0 "[ . 1 . 2]" 1
2364 1 79 VAL QG 1 103 ALA MB . . 2.980 2.271 1.977 2.501 . 0 0 "[ . 1 . 2]" 1
2365 1 80 GLU H 1 80 GLU QG . . 4.190 3.133 2.030 3.954 . 0 0 "[ . 1 . 2]" 1
2366 1 80 GLU QG 1 81 GLN H . . 4.260 3.762 3.115 4.135 . 0 0 "[ . 1 . 2]" 1
2367 1 81 GLN H 1 81 GLN QB . . 3.100 2.624 2.558 2.779 . 0 0 "[ . 1 . 2]" 1
2368 1 81 GLN QB 1 82 ALA H . . 3.670 3.585 3.515 3.647 . 0 0 "[ . 1 . 2]" 1
2369 1 81 GLN QB 1 84 LYS QG . . 4.340 3.469 3.250 4.440 0.100 9 0 "[ . 1 . 2]" 1
2370 1 82 ALA HA 1 85 GLN QG . . 3.720 2.176 1.944 2.469 . 0 0 "[ . 1 . 2]" 1
2371 1 84 LYS H 1 85 GLN QG . . 5.340 4.244 3.929 4.515 . 0 0 "[ . 1 . 2]" 1
2372 1 85 GLN H 1 85 GLN QG . . 3.260 2.411 2.246 2.568 . 0 0 "[ . 1 . 2]" 1
2373 1 85 GLN QG 1 86 LEU H . . 3.260 2.375 2.150 2.574 . 0 0 "[ . 1 . 2]" 1
2374 1 85 GLN QG 1 86 LEU HA . . 4.030 3.399 3.223 3.583 . 0 0 "[ . 1 . 2]" 1
2375 1 85 GLN QG 1 86 LEU HB2 . . 3.720 3.422 3.152 3.718 . 0 0 "[ . 1 . 2]" 1
2376 1 85 GLN QG 1 86 LEU HG . . 5.260 4.204 4.089 4.321 . 0 0 "[ . 1 . 2]" 1
2377 1 85 GLN QG 1 86 LEU MD1 . . 5.230 3.934 3.812 4.094 . 0 0 "[ . 1 . 2]" 1
2378 1 85 GLN QG 1 86 LEU MD2 . . 4.230 1.853 1.798 1.935 . 0 0 "[ . 1 . 2]" 1
2379 1 86 LEU HB2 1 96 VAL QG . . 4.040 3.515 3.353 3.591 . 0 0 "[ . 1 . 2]" 1
2380 1 86 LEU HB3 1 96 VAL QG . . 3.510 3.574 3.534 3.602 0.092 6 0 "[ . 1 . 2]" 1
2381 1 86 LEU HG 1 96 VAL QG . . 3.090 1.902 1.828 2.083 . 0 0 "[ . 1 . 2]" 1
2382 1 86 LEU MD1 1 96 VAL QG . . 3.260 2.669 2.321 2.848 . 0 0 "[ . 1 . 2]" 1
2383 1 88 GLN H 1 88 GLN QB . . 3.460 2.581 2.474 2.693 . 0 0 "[ . 1 . 2]" 1
2384 1 88 GLN QB 1 89 GLY QA . . 5.160 4.217 4.125 4.338 . 0 0 "[ . 1 . 2]" 1
2385 1 88 GLN HG2 1 89 GLY QA . . 5.340 4.215 3.972 4.676 . 0 0 "[ . 1 . 2]" 1
2386 1 88 GLN HG3 1 89 GLY QA . . 3.670 3.388 3.157 3.701 0.031 4 0 "[ . 1 . 2]" 1
2387 1 89 GLY QA 1 90 GLN H . . 2.930 2.167 2.007 2.457 . 0 0 "[ . 1 . 2]" 1
2388 1 89 GLY QA 1 90 GLN QB . . 4.310 4.059 3.698 4.350 0.040 4 0 "[ . 1 . 2]" 1
2389 1 89 GLY QA 1 90 GLN QG . . 4.590 3.489 3.118 4.603 0.013 19 0 "[ . 1 . 2]" 1
2390 1 90 GLN H 1 90 GLN QB . . 3.060 2.664 2.376 3.178 0.118 1 0 "[ . 1 . 2]" 1
2391 1 90 GLN QB 1 91 GLY H . . 3.610 3.013 2.107 3.682 0.072 17 0 "[ . 1 . 2]" 1
2392 1 90 GLN QB 1 91 GLY HA3 . . 5.180 4.066 3.693 4.490 . 0 0 "[ . 1 . 2]" 1
2393 1 92 GLY HA2 1 96 VAL QG . . 3.090 3.029 2.594 3.146 0.056 9 0 "[ . 1 . 2]" 1
2394 1 92 GLY HA3 1 96 VAL QG . . 3.240 2.694 2.433 2.819 . 0 0 "[ . 1 . 2]" 1
2395 1 93 GLN H 1 96 VAL QG . . 4.060 4.033 3.831 4.127 0.067 11 0 "[ . 1 . 2]" 1
2396 1 93 GLN QG 1 96 VAL QG . . 4.530 4.188 3.845 4.570 0.040 16 0 "[ . 1 . 2]" 1
2397 1 94 GLN H 1 96 VAL QG . . 5.090 4.646 4.572 4.718 . 0 0 "[ . 1 . 2]" 1
2398 1 94 GLN QG 1 96 VAL QG . . 5.440 4.825 4.532 4.950 . 0 0 "[ . 1 . 2]" 1
2399 1 95 GLN H 1 96 VAL QG . . 3.900 3.720 3.618 3.797 . 0 0 "[ . 1 . 2]" 1
2400 1 95 GLN HG2 1 96 VAL QG . . 3.230 2.943 2.719 3.216 . 0 0 "[ . 1 . 2]" 1
2401 1 95 GLN HG3 1 96 VAL QG . . 2.940 2.215 2.059 2.365 . 0 0 "[ . 1 . 2]" 1
2402 1 96 VAL H 1 96 VAL QG . . 2.760 2.114 2.068 2.176 . 0 0 "[ . 1 . 2]" 1
2403 1 96 VAL QG 1 98 GLN HG2 . . 5.440 4.882 4.660 5.078 . 0 0 "[ . 1 . 2]" 1
2404 1 96 VAL QG 1 99 MET HB3 . . 5.380 2.964 2.829 3.138 . 0 0 "[ . 1 . 2]" 1
2405 1 96 VAL QG 1 99 MET QG . . 5.270 3.946 3.793 4.103 . 0 0 "[ . 1 . 2]" 1
2406 1 96 VAL QG 1 100 VAL H . . 3.820 2.875 2.729 3.048 . 0 0 "[ . 1 . 2]" 1
2407 1 97 GLN HA 1 97 GLN QG . . 3.430 2.449 2.358 2.507 . 0 0 "[ . 1 . 2]" 1
2408 1 97 GLN QG 1 101 LYS H . . 4.210 4.184 4.073 4.257 0.047 4 0 "[ . 1 . 2]" 1
2409 1 99 MET HA 1 102 LYS QE . . 4.420 3.859 2.017 4.291 . 0 0 "[ . 1 . 2]" 1
2410 1 100 VAL H 1 101 LYS QG . . 4.960 4.219 4.022 4.429 . 0 0 "[ . 1 . 2]" 1
2411 1 100 VAL MG1 1 104 GLN QG . . 5.340 4.609 4.356 4.925 . 0 0 "[ . 1 . 2]" 1
2412 1 100 VAL MG2 1 101 LYS QG . . 5.340 5.395 5.358 5.429 0.089 2 0 "[ . 1 . 2]" 1
2413 1 100 VAL MG2 1 104 GLN QG . . 4.070 3.884 3.664 4.087 0.017 12 0 "[ . 1 . 2]" 1
2414 1 101 LYS QG 1 102 LYS H . . 3.610 2.606 2.178 2.799 . 0 0 "[ . 1 . 2]" 1
2415 1 102 LYS H 1 102 LYS QB . . 2.900 2.351 2.274 2.556 . 0 0 "[ . 1 . 2]" 1
2416 1 102 LYS H 1 102 LYS QE . . 4.830 4.446 4.062 4.546 . 0 0 "[ . 1 . 2]" 1
2417 1 102 LYS HA 1 102 LYS QE . . 5.340 4.381 4.264 4.980 . 0 0 "[ . 1 . 2]" 1
2418 1 102 LYS HA 1 105 MET QG . . 3.920 2.361 1.991 2.757 . 0 0 "[ . 1 . 2]" 1
2419 1 102 LYS QB 1 102 LYS QE . . 3.890 2.094 1.948 3.437 . 0 0 "[ . 1 . 2]" 1
2420 1 102 LYS QB 1 103 ALA H . . 3.270 2.740 2.377 2.861 . 0 0 "[ . 1 . 2]" 1
2421 1 102 LYS QB 1 104 GLN H . . 5.340 4.570 4.478 4.709 . 0 0 "[ . 1 . 2]" 1
2422 1 102 LYS QE 1 103 ALA H . . 5.340 5.035 4.858 5.484 0.144 8 0 "[ . 1 . 2]" 1
2423 1 103 ALA H 1 104 GLN QG . . 4.570 3.907 3.658 4.262 . 0 0 "[ . 1 . 2]" 1
2424 1 103 ALA MB 1 104 GLN QB . . 5.340 4.397 4.195 4.581 . 0 0 "[ . 1 . 2]" 1
2425 1 103 ALA MB 1 104 GLN QG . . 4.110 3.119 2.817 3.389 . 0 0 "[ . 1 . 2]" 1
2426 1 104 GLN H 1 104 GLN QB . . 3.240 2.468 2.394 2.549 . 0 0 "[ . 1 . 2]" 1
2427 1 104 GLN H 1 104 GLN QG . . 3.310 2.117 1.936 2.260 . 0 0 "[ . 1 . 2]" 1
2428 1 104 GLN H 1 105 MET QG . . 4.410 3.616 3.392 3.896 . 0 0 "[ . 1 . 2]" 1
2429 1 104 GLN QB 1 105 MET H . . 3.370 3.020 2.826 3.167 . 0 0 "[ . 1 . 2]" 1
2430 1 104 GLN QB 1 116 ILE HB . . 4.580 2.669 2.175 3.449 . 0 0 "[ . 1 . 2]" 1
2431 1 104 GLN QB 1 116 ILE QG . . 5.180 3.502 2.330 4.271 . 0 0 "[ . 1 . 2]" 1
2432 1 104 GLN QG 1 105 MET H . . 4.440 4.069 3.917 4.213 . 0 0 "[ . 1 . 2]" 1
2433 1 105 MET H 1 105 MET QG . . 3.060 2.197 2.032 2.377 . 0 0 "[ . 1 . 2]" 1
2434 1 105 MET H 1 106 LEU QD . . 5.430 3.876 3.127 4.369 . 0 0 "[ . 1 . 2]" 1
2435 1 105 MET HA 1 105 MET QG . . 3.300 2.495 2.391 2.568 . 0 0 "[ . 1 . 2]" 1
2436 1 105 MET HA 1 108 ASN QB . . 4.070 3.035 2.664 3.275 . 0 0 "[ . 1 . 2]" 1
2437 1 105 MET HB2 1 106 LEU QD . . 4.160 3.660 3.124 4.179 0.019 1 0 "[ . 1 . 2]" 1
2438 1 105 MET HB2 1 108 ASN QB . . 5.330 4.580 4.298 5.024 . 0 0 "[ . 1 . 2]" 1
2439 1 105 MET HB3 1 108 ASN QB . . 4.510 3.412 3.040 3.912 . 0 0 "[ . 1 . 2]" 1
2440 1 105 MET QG 1 106 LEU H . . 4.170 3.936 3.832 4.085 . 0 0 "[ . 1 . 2]" 1
2441 1 106 LEU H 1 106 LEU QD . . 3.660 2.840 2.271 3.201 . 0 0 "[ . 1 . 2]" 1
2442 1 106 LEU H 1 107 PRO QG . . 4.560 4.158 3.953 4.479 . 0 0 "[ . 1 . 2]" 1
2443 1 106 LEU H 1 108 ASN QB . . 5.250 5.035 4.817 5.272 0.022 15 0 "[ . 1 . 2]" 1
2444 1 106 LEU HA 1 106 LEU QD . . 3.140 2.064 1.894 2.252 . 0 0 "[ . 1 . 2]" 1
2445 1 106 LEU QD 1 108 ASN H . . 5.440 5.041 4.693 5.235 . 0 0 "[ . 1 . 2]" 1
2446 1 106 LEU QD 1 109 GLN H . . 5.110 4.526 3.950 4.777 . 0 0 "[ . 1 . 2]" 1
2447 1 106 LEU QD 1 109 GLN HB2 . . 5.070 3.377 2.703 3.863 . 0 0 "[ . 1 . 2]" 1
2448 1 106 LEU QD 1 109 GLN HB3 . . 5.440 4.445 3.719 4.965 . 0 0 "[ . 1 . 2]" 1
2449 1 106 LEU QD 1 110 CYS H . . 5.440 4.313 3.207 4.944 . 0 0 "[ . 1 . 2]" 1
2450 1 107 PRO HA 1 110 CYS QB . . 4.920 3.298 3.027 3.572 . 0 0 "[ . 1 . 2]" 1
2451 1 107 PRO HA 1 112 LEU QB . . 3.640 2.032 1.946 2.146 . 0 0 "[ . 1 . 2]" 1
2452 1 107 PRO HB3 1 112 LEU QB . . 4.480 2.459 2.232 2.623 . 0 0 "[ . 1 . 2]" 1
2453 1 107 PRO QG 1 108 ASN H . . 3.930 2.885 2.658 3.942 0.012 15 0 "[ . 1 . 2]" 1
2454 1 107 PRO QG 1 115 SER H . . 5.350 4.620 4.214 5.003 . 0 0 "[ . 1 . 2]" 1
2455 1 107 PRO QG 1 115 SER HA . . 4.430 2.999 2.609 3.739 . 0 0 "[ . 1 . 2]" 1
2456 1 107 PRO QG 1 116 ILE H . . 4.290 2.751 2.362 3.124 . 0 0 "[ . 1 . 2]" 1
2457 1 107 PRO QG 1 116 ILE MD . . 3.720 2.605 2.053 3.017 . 0 0 "[ . 1 . 2]" 1
2458 1 108 ASN H 1 108 ASN QB . . 2.800 2.235 2.117 2.354 . 0 0 "[ . 1 . 2]" 1
2459 1 108 ASN QB 1 109 GLN H . . 3.470 2.477 2.265 2.807 . 0 0 "[ . 1 . 2]" 1
2460 1 108 ASN QB 1 109 GLN HA . . 4.400 3.845 3.718 4.052 . 0 0 "[ . 1 . 2]" 1
2461 1 108 ASN QB 1 111 ASN H . . 5.340 4.813 4.629 5.105 . 0 0 "[ . 1 . 2]" 1
2462 1 108 ASN QB 1 116 ILE H . . 5.340 4.983 4.340 5.388 0.048 15 0 "[ . 1 . 2]" 1
2463 1 110 CYS QB 1 111 ASN HB3 . . 5.320 5.137 4.817 5.310 . 0 0 "[ . 1 . 2]" 1
2464 1 110 CYS QB 1 112 LEU H . . 4.430 3.718 3.586 4.154 . 0 0 "[ . 1 . 2]" 1
2465 1 110 CYS QB 1 112 LEU HA . . 5.070 4.748 4.586 4.888 . 0 0 "[ . 1 . 2]" 1
2466 1 110 CYS QB 1 112 LEU MD1 . . 3.950 2.511 2.351 2.652 . 0 0 "[ . 1 . 2]" 1
2467 1 112 LEU H 1 112 LEU QB . . 3.350 2.532 2.490 2.577 . 0 0 "[ . 1 . 2]" 1
2468 1 112 LEU HA 1 113 GLN QB . . 5.030 4.582 4.391 4.735 . 0 0 "[ . 1 . 2]" 1
2469 1 112 LEU QB 1 113 GLN H . . 3.240 2.473 2.381 2.594 . 0 0 "[ . 1 . 2]" 1
2470 1 112 LEU QB 1 114 CYS H . . 3.670 3.141 2.959 3.310 . 0 0 "[ . 1 . 2]" 1
2471 1 112 LEU QB 1 114 CYS HB3 . . 4.830 4.502 4.367 4.742 . 0 0 "[ . 1 . 2]" 1
2472 1 113 GLN H 1 113 GLN QB . . 3.190 2.479 2.342 2.655 . 0 0 "[ . 1 . 2]" 1
2473 1 113 GLN QB 1 114 CYS H . . 4.200 3.790 3.633 3.854 . 0 0 "[ . 1 . 2]" 1
2474 1 114 CYS H 1 115 SER QB . . 5.340 4.909 4.407 5.324 . 0 0 "[ . 1 . 2]" 1
2475 1 114 CYS HA 1 115 SER QB . . 4.540 4.378 4.291 4.486 . 0 0 "[ . 1 . 2]" 1
2476 1 115 SER H 1 115 SER QB . . 3.270 2.941 2.668 3.246 . 0 0 "[ . 1 . 2]" 1
2477 1 115 SER H 1 116 ILE QG . . 4.900 4.304 3.821 4.904 0.004 15 0 "[ . 1 . 2]" 1
2478 1 115 SER HA 1 116 ILE QG . . 5.340 3.574 3.352 3.779 . 0 0 "[ . 1 . 2]" 1
2479 1 115 SER QB 1 116 ILE H . . 3.530 3.120 2.844 3.469 . 0 0 "[ . 1 . 2]" 1
2480 1 116 ILE H 1 116 ILE QG . . 3.310 2.551 2.090 2.753 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 68
_Distance_constraint_stats_list.Viol_count 126
_Distance_constraint_stats_list.Viol_total 95.416
_Distance_constraint_stats_list.Viol_max 0.127
_Distance_constraint_stats_list.Viol_rms 0.0148
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0035
_Distance_constraint_stats_list.Viol_average_violations_only 0.0379
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 CYS 0.038 0.014 4 0 "[ . 1 . 2]"
1 33 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 0.038 0.014 4 0 "[ . 1 . 2]"
1 37 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ASN 0.005 0.005 10 0 "[ . 1 . 2]"
1 50 PRO 0.260 0.039 8 0 "[ . 1 . 2]"
1 52 GLN 0.005 0.005 10 0 "[ . 1 . 2]"
1 53 GLN 0.260 0.039 8 0 "[ . 1 . 2]"
1 54 GLN 0.570 0.096 2 0 "[ . 1 . 2]"
1 56 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 LEU 0.570 0.096 2 0 "[ . 1 . 2]"
1 59 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 CYS 0.090 0.039 16 0 "[ . 1 . 2]"
1 62 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 GLN 0.090 0.039 16 0 "[ . 1 . 2]"
1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 CYS 0.484 0.058 12 0 "[ . 1 . 2]"
1 73 GLU 1.059 0.086 16 0 "[ . 1 . 2]"
1 74 ALA 0.096 0.030 1 0 "[ . 1 . 2]"
1 75 ILE 0.484 0.058 12 0 "[ . 1 . 2]"
1 76 LYS 1.831 0.127 3 0 "[ . 1 . 2]"
1 77 GLN 1.059 0.086 16 0 "[ . 1 . 2]"
1 78 VAL 0.096 0.030 1 0 "[ . 1 . 2]"
1 79 VAL 1.831 0.127 3 0 "[ . 1 . 2]"
1 80 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 GLN 0.232 0.037 13 0 "[ . 1 . 2]"
1 82 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 GLN 0.232 0.037 13 0 "[ . 1 . 2]"
1 87 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 LYS 0.047 0.017 3 0 "[ . 1 . 2]"
1 102 LYS 0.014 0.008 1 0 "[ . 1 . 2]"
1 103 ALA 0.045 0.016 20 0 "[ . 1 . 2]"
1 104 GLN 0.047 0.017 3 0 "[ . 1 . 2]"
1 105 MET 0.014 0.008 1 0 "[ . 1 . 2]"
1 106 LEU 0.045 0.016 20 0 "[ . 1 . 2]"
1 107 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ARG O 1 12 PHE H 0.000 . 2.300 1.733 1.661 1.834 . 0 0 "[ . 1 . 2]" 2
2 1 2 ARG O 1 12 PHE N 0.000 . 3.300 2.708 2.636 2.812 . 0 0 "[ . 1 . 2]" 2
3 1 29 LEU O 1 33 GLN H 0.000 . 2.300 1.788 1.715 1.850 . 0 0 "[ . 1 . 2]" 2
4 1 29 LEU O 1 33 GLN N 0.000 . 3.300 2.763 2.692 2.822 . 0 0 "[ . 1 . 2]" 2
5 1 31 HIS O 1 35 HIS H 0.000 . 2.300 1.845 1.755 1.901 . 0 0 "[ . 1 . 2]" 2
6 1 31 HIS O 1 35 HIS N 0.000 . 3.300 2.790 2.691 2.848 . 0 0 "[ . 1 . 2]" 2
7 1 32 CYS O 1 36 LEU H 0.000 . 2.300 2.121 1.870 2.314 0.014 4 0 "[ . 1 . 2]" 2
8 1 32 CYS O 1 36 LEU N 0.000 . 3.300 2.967 2.769 3.146 . 0 0 "[ . 1 . 2]" 2
9 1 33 GLN O 1 37 THR H 0.000 . 2.300 2.111 1.963 2.213 . 0 0 "[ . 1 . 2]" 2
10 1 33 GLN O 1 37 THR N 0.000 . 3.300 2.995 2.871 3.131 . 0 0 "[ . 1 . 2]" 2
11 1 49 ASN O 1 52 GLN H 0.000 . 2.300 2.051 1.852 2.305 0.005 10 0 "[ . 1 . 2]" 2
12 1 49 ASN O 1 52 GLN N 0.000 . 3.300 2.953 2.783 3.174 . 0 0 "[ . 1 . 2]" 2
13 1 50 PRO O 1 53 GLN H 0.000 . 2.300 2.231 1.982 2.339 0.039 8 0 "[ . 1 . 2]" 2
14 1 50 PRO O 1 53 GLN N 0.000 . 3.300 3.102 2.912 3.289 . 0 0 "[ . 1 . 2]" 2
15 1 54 GLN O 1 58 LEU H 0.000 . 2.300 2.282 2.062 2.396 0.096 2 0 "[ . 1 . 2]" 2
16 1 54 GLN O 1 58 LEU N 0.000 . 3.300 3.117 2.806 3.274 . 0 0 "[ . 1 . 2]" 2
17 1 56 LEU O 1 60 CYS H 0.000 . 2.300 1.782 1.700 1.923 . 0 0 "[ . 1 . 2]" 2
18 1 56 LEU O 1 60 CYS N 0.000 . 3.300 2.705 2.649 2.825 . 0 0 "[ . 1 . 2]" 2
19 1 58 LEU O 1 62 GLN H 0.000 . 2.300 2.160 1.938 2.300 . 0 0 "[ . 1 . 2]" 2
20 1 58 LEU O 1 62 GLN N 0.000 . 3.300 2.914 2.810 3.003 . 0 0 "[ . 1 . 2]" 2
21 1 59 CYS O 1 63 LEU H 0.000 . 2.300 1.837 1.766 1.920 . 0 0 "[ . 1 . 2]" 2
22 1 59 CYS O 1 63 LEU N 0.000 . 3.300 2.799 2.722 2.881 . 0 0 "[ . 1 . 2]" 2
23 1 60 CYS O 1 64 GLN H 0.000 . 2.300 2.188 2.016 2.339 0.039 16 0 "[ . 1 . 2]" 2
24 1 60 CYS O 1 64 GLN N 0.000 . 3.300 3.047 2.903 3.203 . 0 0 "[ . 1 . 2]" 2
25 1 63 LEU O 1 66 VAL H 0.000 . 2.300 2.110 2.016 2.204 . 0 0 "[ . 1 . 2]" 2
26 1 63 LEU O 1 66 VAL N 0.000 . 3.300 2.976 2.907 3.058 . 0 0 "[ . 1 . 2]" 2
27 1 67 GLU O 1 70 CYS H 0.000 . 2.300 1.927 1.820 2.112 . 0 0 "[ . 1 . 2]" 2
28 1 67 GLU O 1 70 CYS N 0.000 . 3.300 2.769 2.721 2.873 . 0 0 "[ . 1 . 2]" 2
29 1 70 CYS O 1 74 ALA H 0.000 . 2.300 2.005 1.945 2.091 . 0 0 "[ . 1 . 2]" 2
30 1 70 CYS O 1 74 ALA N 0.000 . 3.300 2.854 2.772 2.938 . 0 0 "[ . 1 . 2]" 2
31 1 72 CYS O 1 75 ILE H 0.000 . 2.300 2.322 2.275 2.358 0.058 12 0 "[ . 1 . 2]" 2
32 1 72 CYS O 1 75 ILE N 0.000 . 3.300 3.107 3.023 3.150 . 0 0 "[ . 1 . 2]" 2
33 1 73 GLU O 1 77 GLN H 0.000 . 2.300 2.349 2.307 2.386 0.086 16 0 "[ . 1 . 2]" 2
34 1 73 GLU O 1 77 GLN N 0.000 . 3.300 3.280 3.231 3.323 0.023 14 0 "[ . 1 . 2]" 2
35 1 74 ALA O 1 78 VAL H 0.000 . 2.300 2.227 2.062 2.330 0.030 1 0 "[ . 1 . 2]" 2
36 1 74 ALA O 1 78 VAL N 0.000 . 3.300 3.105 2.957 3.235 . 0 0 "[ . 1 . 2]" 2
37 1 76 LYS O 1 79 VAL H 0.000 . 2.300 2.392 2.350 2.427 0.127 3 0 "[ . 1 . 2]" 2
38 1 76 LYS O 1 79 VAL N 0.000 . 3.300 3.024 2.951 3.100 . 0 0 "[ . 1 . 2]" 2
39 1 76 LYS O 1 80 GLU H 0.000 . 2.300 1.974 1.857 2.167 . 0 0 "[ . 1 . 2]" 2
40 1 76 LYS O 1 80 GLU N 0.000 . 3.300 2.932 2.801 3.116 . 0 0 "[ . 1 . 2]" 2
41 1 77 GLN O 1 81 GLN H 0.000 . 2.300 1.911 1.731 2.177 . 0 0 "[ . 1 . 2]" 2
42 1 77 GLN O 1 81 GLN N 0.000 . 3.300 2.871 2.716 3.114 . 0 0 "[ . 1 . 2]" 2
43 1 78 VAL O 1 82 ALA H 0.000 . 2.300 1.971 1.895 2.063 . 0 0 "[ . 1 . 2]" 2
44 1 78 VAL O 1 82 ALA N 0.000 . 3.300 2.861 2.801 2.934 . 0 0 "[ . 1 . 2]" 2
45 1 79 VAL O 1 83 GLN H 0.000 . 2.300 1.922 1.824 2.114 . 0 0 "[ . 1 . 2]" 2
46 1 79 VAL O 1 83 GLN N 0.000 . 3.300 2.851 2.753 3.023 . 0 0 "[ . 1 . 2]" 2
47 1 81 GLN O 1 85 GLN H 0.000 . 2.300 2.265 2.075 2.337 0.037 13 0 "[ . 1 . 2]" 2
48 1 81 GLN O 1 85 GLN N 0.000 . 3.300 3.107 2.940 3.187 . 0 0 "[ . 1 . 2]" 2
49 1 83 GLN O 1 87 GLN H 0.000 . 2.300 1.921 1.754 2.209 . 0 0 "[ . 1 . 2]" 2
50 1 83 GLN O 1 87 GLN N 0.000 . 3.300 2.829 2.698 3.117 . 0 0 "[ . 1 . 2]" 2
51 1 92 GLY O 1 95 GLN H 0.000 . 2.300 2.137 1.977 2.271 . 0 0 "[ . 1 . 2]" 2
52 1 92 GLY O 1 95 GLN N 0.000 . 3.300 2.816 2.712 2.899 . 0 0 "[ . 1 . 2]" 2
53 1 96 VAL O 1 100 VAL H 0.000 . 2.300 1.803 1.740 1.905 . 0 0 "[ . 1 . 2]" 2
54 1 96 VAL O 1 100 VAL N 0.000 . 3.300 2.783 2.719 2.882 . 0 0 "[ . 1 . 2]" 2
55 1 99 MET O 1 102 LYS H 0.000 . 2.300 2.050 1.916 2.153 . 0 0 "[ . 1 . 2]" 2
56 1 99 MET O 1 102 LYS N 0.000 . 3.300 2.936 2.832 3.034 . 0 0 "[ . 1 . 2]" 2
57 1 100 VAL O 1 103 ALA H 0.000 . 2.300 2.125 2.012 2.262 . 0 0 "[ . 1 . 2]" 2
58 1 100 VAL O 1 103 ALA N 0.000 . 3.300 2.930 2.831 3.012 . 0 0 "[ . 1 . 2]" 2
59 1 101 LYS O 1 104 GLN H 0.000 . 2.300 2.251 2.121 2.317 0.017 3 0 "[ . 1 . 2]" 2
60 1 101 LYS O 1 104 GLN N 0.000 . 3.300 3.021 2.906 3.156 . 0 0 "[ . 1 . 2]" 2
61 1 102 LYS O 1 105 MET H 0.000 . 2.300 2.116 1.894 2.308 0.008 1 0 "[ . 1 . 2]" 2
62 1 102 LYS O 1 105 MET N 0.000 . 3.300 2.941 2.798 3.053 . 0 0 "[ . 1 . 2]" 2
63 1 103 ALA O 1 106 LEU H 0.000 . 2.300 2.221 1.978 2.316 0.016 20 0 "[ . 1 . 2]" 2
64 1 103 ALA O 1 106 LEU N 0.000 . 3.300 3.069 2.820 3.205 . 0 0 "[ . 1 . 2]" 2
65 1 106 LEU O 1 110 CYS H 0.000 . 2.300 1.769 1.713 1.874 . 0 0 "[ . 1 . 2]" 2
66 1 106 LEU O 1 110 CYS N 0.000 . 3.300 2.719 2.663 2.787 . 0 0 "[ . 1 . 2]" 2
67 1 107 PRO O 1 112 LEU H 0.000 . 2.300 1.787 1.684 1.917 . 0 0 "[ . 1 . 2]" 2
68 1 107 PRO O 1 112 LEU N 0.000 . 3.300 2.732 2.647 2.817 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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