NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
401210 |
1vek   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1vek
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 2102
_Distance_constraint_stats_list.Viol_count 2312
_Distance_constraint_stats_list.Viol_total 2239.763
_Distance_constraint_stats_list.Viol_max 0.894
_Distance_constraint_stats_list.Viol_rms 0.0236
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0027
_Distance_constraint_stats_list.Viol_average_violations_only 0.0484
_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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 GLY 0.023 0.023 10 0 "[ . 1 . 2]"
1 9 GLU 4.905 0.421 20 0 "[ . 1 . 2]"
1 10 GLU 2.578 0.421 20 0 "[ . 1 . 2]"
1 11 LEU 4.116 0.693 17 2 "[ . 1 .-+ 2]"
1 12 LEU 4.941 0.890 2 4 "[ + - 1 .** 2]"
1 13 PRO 3.833 0.890 2 2 "[ + - 1 . 2]"
1 14 ASP 0.566 0.070 11 0 "[ . 1 . 2]"
1 15 GLY 1.069 0.192 12 0 "[ . 1 . 2]"
1 16 VAL 1.141 0.192 12 0 "[ . 1 . 2]"
1 17 PRO 0.182 0.050 18 0 "[ . 1 . 2]"
1 18 GLU 1.900 0.471 4 0 "[ . 1 . 2]"
1 19 GLU 1.044 0.275 8 0 "[ . 1 . 2]"
1 20 VAL 4.877 0.804 11 5 "[ * * 1+ . *-]"
1 21 MET 4.981 0.804 11 5 "[ * * 1+ . *-]"
1 22 GLU 3.229 0.702 5 2 "[ -+ 1 . 2]"
1 23 SER 3.473 0.702 5 2 "[ -+ 1 . 2]"
1 24 ALA 0.191 0.191 8 0 "[ . 1 . 2]"
1 25 GLN 0.009 0.004 4 0 "[ . 1 . 2]"
1 26 PRO 5.089 0.157 20 0 "[ . 1 . 2]"
1 27 VAL 2.953 0.069 14 0 "[ . 1 . 2]"
1 28 ALA 1.571 0.158 11 0 "[ . 1 . 2]"
1 29 ASN 2.072 0.092 11 0 "[ . 1 . 2]"
1 30 GLU 1.635 0.231 14 0 "[ . 1 . 2]"
1 31 GLU 5.604 0.463 13 0 "[ . 1 . 2]"
1 32 ILE 6.350 0.390 8 0 "[ . 1 . 2]"
1 33 VAL 1.450 0.048 15 0 "[ . 1 . 2]"
1 34 ALA 0.874 0.036 14 0 "[ . 1 . 2]"
1 35 GLN 13.587 0.463 13 0 "[ . 1 . 2]"
1 36 LEU 3.015 0.103 16 0 "[ . 1 . 2]"
1 37 VAL 2.271 0.096 18 0 "[ . 1 . 2]"
1 38 SER 1.469 0.881 10 1 "[ . + . 2]"
1 39 MET 1.246 0.881 10 1 "[ . + . 2]"
1 40 GLY 0.348 0.022 11 0 "[ . 1 . 2]"
1 41 PHE 2.616 0.136 10 0 "[ . 1 . 2]"
1 42 SER 1.476 0.054 17 0 "[ . 1 . 2]"
1 43 GLN 2.300 0.096 18 0 "[ . 1 . 2]"
1 44 LEU 2.085 0.287 9 0 "[ . 1 . 2]"
1 45 HIS 1.063 0.057 18 0 "[ . 1 . 2]"
1 46 CYS 4.021 0.136 10 0 "[ . 1 . 2]"
1 47 GLN 0.438 0.031 13 0 "[ . 1 . 2]"
1 48 LYS 4.839 0.138 18 0 "[ . 1 . 2]"
1 49 ALA 0.370 0.088 19 0 "[ . 1 . 2]"
1 50 ALA 2.308 0.092 11 0 "[ . 1 . 2]"
1 51 ILE 8.271 0.157 20 0 "[ . 1 . 2]"
1 52 ASN 0.967 0.211 19 0 "[ . 1 . 2]"
1 53 THR 0.697 0.094 19 0 "[ . 1 . 2]"
1 54 SER 1.426 0.094 19 0 "[ . 1 . 2]"
1 55 ASN 5.836 0.218 1 0 "[ . 1 . 2]"
1 56 ALA 0.270 0.075 19 0 "[ . 1 . 2]"
1 57 GLY 0.107 0.055 19 0 "[ . 1 . 2]"
1 58 VAL 4.495 0.429 2 0 "[ . 1 . 2]"
1 59 GLU 2.219 0.083 16 0 "[ . 1 . 2]"
1 60 GLU 3.800 0.085 15 0 "[ . 1 . 2]"
1 61 ALA 4.531 0.106 8 0 "[ . 1 . 2]"
1 62 MET 4.845 0.099 16 0 "[ . 1 . 2]"
1 63 ASN 0.089 0.024 16 0 "[ . 1 . 2]"
1 64 TRP 4.189 0.572 6 1 "[ .+ 1 . 2]"
1 65 LEU 3.003 0.106 8 0 "[ . 1 . 2]"
1 66 LEU 1.948 0.077 17 0 "[ . 1 . 2]"
1 67 SER 3.170 0.572 6 1 "[ .+ 1 . 2]"
1 68 HIS 2.385 0.124 16 0 "[ . 1 . 2]"
1 69 MET 0.389 0.024 5 0 "[ . 1 . 2]"
1 70 ASP 0.030 0.016 7 0 "[ . 1 . 2]"
1 71 ASP 7.667 0.197 9 0 "[ . 1 . 2]"
1 72 PRO 8.690 0.238 9 0 "[ . 1 . 2]"
1 73 ASP 1.515 0.238 9 0 "[ . 1 . 2]"
1 74 ILE 2.730 0.894 9 2 "[ . +1 -. 2]"
1 75 ASP 4.136 0.894 9 2 "[ . +1 -. 2]"
1 76 ALA 2.635 0.416 9 0 "[ . 1 . 2]"
1 77 PRO 1.632 0.081 15 0 "[ . 1 . 2]"
1 78 ILE 0.620 0.302 16 0 "[ . 1 . 2]"
1 79 SER 2.656 0.363 5 0 "[ . 1 . 2]"
1 80 GLY 1.814 0.363 5 0 "[ . 1 . 2]"
1 81 PRO 0.064 0.044 3 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER HB2 1 7 GLY H . . 5.500 3.982 2.282 4.731 . 0 0 "[ . 1 . 2]" 1
2 1 8 GLY HA3 1 10 GLU H . . 5.500 4.479 3.137 5.523 0.023 10 0 "[ . 1 . 2]" 1
3 1 9 GLU H 1 9 GLU HB3 . . 3.850 3.098 2.347 4.097 0.247 12 0 "[ . 1 . 2]" 1
4 1 9 GLU H 1 9 GLU HG2 . . 4.840 4.188 1.953 4.837 . 0 0 "[ . 1 . 2]" 1
5 1 9 GLU H 1 9 GLU HG3 . . 5.130 4.190 3.249 4.918 . 0 0 "[ . 1 . 2]" 1
6 1 9 GLU HA 1 10 GLU H . . 3.540 3.286 2.203 3.646 0.106 12 0 "[ . 1 . 2]" 1
7 1 9 GLU HB2 1 9 GLU HG2 . . 2.840 2.942 2.581 3.057 0.217 4 0 "[ . 1 . 2]" 1
8 1 9 GLU HB3 1 10 GLU H . . 4.160 3.237 1.947 4.581 0.421 20 0 "[ . 1 . 2]" 1
9 1 9 GLU HG2 1 10 GLU H . . 5.130 4.584 1.984 5.144 0.014 9 0 "[ . 1 . 2]" 1
10 1 10 GLU H 1 10 GLU HB3 . . 4.000 3.380 2.672 4.098 0.098 12 0 "[ . 1 . 2]" 1
11 1 10 GLU H 1 10 GLU HG3 . . 5.260 3.906 2.432 4.900 . 0 0 "[ . 1 . 2]" 1
12 1 10 GLU H 1 11 LEU H . . 4.600 3.883 1.879 4.603 0.003 8 0 "[ . 1 . 2]" 1
13 1 10 GLU HA 1 11 LEU H . . 3.390 2.441 2.207 3.553 0.163 13 0 "[ . 1 . 2]" 1
14 1 10 GLU HB2 1 11 LEU H . . 5.260 4.164 2.394 4.703 . 0 0 "[ . 1 . 2]" 1
15 1 10 GLU HB3 1 11 LEU H . . 4.690 3.755 2.747 4.530 . 0 0 "[ . 1 . 2]" 1
16 1 10 GLU HG2 1 11 LEU H . . 5.130 3.964 2.622 5.121 . 0 0 "[ . 1 . 2]" 1
17 1 10 GLU HG3 1 11 LEU H . . 5.500 4.054 2.407 5.321 . 0 0 "[ . 1 . 2]" 1
18 1 11 LEU H 1 11 LEU HB2 . . 3.830 3.009 2.138 4.020 0.190 7 0 "[ . 1 . 2]" 1
19 1 11 LEU H 1 11 LEU HB3 . . 4.020 3.311 2.288 4.024 0.004 13 0 "[ . 1 . 2]" 1
20 1 11 LEU H 1 11 LEU HG . . 4.760 3.874 2.049 4.696 . 0 0 "[ . 1 . 2]" 1
21 1 11 LEU HA 1 11 LEU MD2 . . 3.410 3.238 1.969 4.103 0.693 17 1 "[ . 1 . + 2]" 1
22 1 11 LEU HA 1 12 LEU H . . 3.330 2.374 2.177 2.657 . 0 0 "[ . 1 . 2]" 1
23 1 11 LEU HB2 1 12 LEU H . . 5.270 4.165 2.637 4.731 . 0 0 "[ . 1 . 2]" 1
24 1 11 LEU HB3 1 12 LEU H . . 5.270 3.877 2.112 4.660 . 0 0 "[ . 1 . 2]" 1
25 1 11 LEU MD2 1 12 LEU H . . 5.130 3.919 2.218 5.668 0.538 17 2 "[ . 1 .-+ 2]" 1
26 1 12 LEU H 1 12 LEU HB2 . . 3.620 3.008 2.053 3.881 0.261 16 0 "[ . 1 . 2]" 1
27 1 12 LEU H 1 12 LEU HB3 . . 3.780 3.051 2.101 3.784 0.004 18 0 "[ . 1 . 2]" 1
28 1 12 LEU H 1 12 LEU MD1 . . 5.500 3.758 2.046 4.831 . 0 0 "[ . 1 . 2]" 1
29 1 12 LEU H 1 12 LEU MD2 . . 5.420 3.857 2.097 4.933 . 0 0 "[ . 1 . 2]" 1
30 1 12 LEU H 1 12 LEU HG . . 4.470 3.761 2.106 4.478 0.008 14 0 "[ . 1 . 2]" 1
31 1 12 LEU H 1 13 PRO HD3 . . 5.500 4.315 3.174 4.815 . 0 0 "[ . 1 . 2]" 1
32 1 12 LEU HA 1 12 LEU MD2 . . 4.100 3.385 1.998 4.126 0.026 13 0 "[ . 1 . 2]" 1
33 1 12 LEU HA 1 13 PRO HD2 . . 3.560 2.518 2.178 2.865 . 0 0 "[ . 1 . 2]" 1
34 1 12 LEU HA 1 13 PRO HD3 . . 2.990 2.011 1.922 2.145 . 0 0 "[ . 1 . 2]" 1
35 1 12 LEU HB2 1 13 PRO HD2 . . 4.840 3.605 2.041 4.890 0.050 10 0 "[ . 1 . 2]" 1
36 1 12 LEU HB3 1 13 PRO HD2 . . 4.180 3.554 2.052 4.686 0.506 5 1 "[ + 1 . 2]" 1
37 1 12 LEU HB3 1 13 PRO HD3 . . 5.020 4.111 3.085 4.856 . 0 0 "[ . 1 . 2]" 1
38 1 12 LEU MD2 1 13 PRO HD2 . . 4.760 3.516 1.945 5.650 0.890 2 1 "[ + . 1 . 2]" 1
39 1 12 LEU MD2 1 13 PRO HD3 . . 5.130 4.265 2.602 5.592 0.462 2 0 "[ . 1 . 2]" 1
40 1 13 PRO HA 1 15 GLY H . . 5.500 5.221 3.868 5.507 0.007 7 0 "[ . 1 . 2]" 1
41 1 13 PRO HD2 1 14 ASP H . . 5.430 4.792 2.477 5.492 0.062 15 0 "[ . 1 . 2]" 1
42 1 13 PRO HG2 1 14 ASP H . . 5.270 4.592 2.192 5.340 0.070 11 0 "[ . 1 . 2]" 1
43 1 14 ASP HA 1 15 GLY H . . 3.620 2.521 2.252 3.654 0.034 16 0 "[ . 1 . 2]" 1
44 1 14 ASP HA 1 16 VAL H . . 5.500 4.985 4.208 5.460 . 0 0 "[ . 1 . 2]" 1
45 1 14 ASP HB2 1 15 GLY H . . 5.190 4.280 2.462 4.726 . 0 0 "[ . 1 . 2]" 1
46 1 14 ASP HB3 1 15 GLY H . . 5.500 4.140 2.182 4.674 . 0 0 "[ . 1 . 2]" 1
47 1 15 GLY H 1 16 VAL H . . 4.240 3.248 2.474 4.102 . 0 0 "[ . 1 . 2]" 1
48 1 15 GLY HA2 1 16 VAL H . . 3.450 2.839 2.333 3.642 0.192 12 0 "[ . 1 . 2]" 1
49 1 16 VAL H 1 16 VAL HB . . 3.890 2.893 2.306 3.866 . 0 0 "[ . 1 . 2]" 1
50 1 16 VAL H 1 16 VAL MG1 . . 4.000 2.559 1.912 3.866 . 0 0 "[ . 1 . 2]" 1
51 1 16 VAL H 1 17 PRO HD2 . . 5.500 4.911 4.537 5.037 . 0 0 "[ . 1 . 2]" 1
52 1 16 VAL H 1 17 PRO HD3 . . 5.500 4.318 3.544 4.699 . 0 0 "[ . 1 . 2]" 1
53 1 16 VAL HA 1 17 PRO HD2 . . 3.330 2.417 2.184 2.734 . 0 0 "[ . 1 . 2]" 1
54 1 16 VAL HA 1 17 PRO HD3 . . 3.230 1.981 1.913 2.131 . 0 0 "[ . 1 . 2]" 1
55 1 16 VAL HB 1 17 PRO HD2 . . 4.380 3.887 2.078 4.430 0.050 18 0 "[ . 1 . 2]" 1
56 1 16 VAL MG1 1 17 PRO HD2 . . 5.130 3.767 1.789 4.717 . 0 0 "[ . 1 . 2]" 1
57 1 16 VAL MG1 1 17 PRO HD3 . . 4.630 4.150 2.897 4.611 . 0 0 "[ . 1 . 2]" 1
58 1 16 VAL MG1 1 18 GLU H . . 5.270 4.000 2.295 5.189 . 0 0 "[ . 1 . 2]" 1
59 1 16 VAL MG2 1 17 PRO HD2 . . 4.150 2.582 1.794 3.630 . 0 0 "[ . 1 . 2]" 1
60 1 16 VAL MG2 1 17 PRO HD3 . . 5.020 3.442 2.581 4.297 . 0 0 "[ . 1 . 2]" 1
61 1 16 VAL MG2 1 17 PRO HG2 . . 5.430 4.378 3.476 5.440 0.010 8 0 "[ . 1 . 2]" 1
62 1 16 VAL MG2 1 18 GLU H . . 5.500 4.170 2.756 5.165 . 0 0 "[ . 1 . 2]" 1
63 1 17 PRO HA 1 18 GLU H . . 2.980 2.361 2.149 2.614 . 0 0 "[ . 1 . 2]" 1
64 1 17 PRO HB2 1 18 GLU H . . 4.470 4.117 3.166 4.454 . 0 0 "[ . 1 . 2]" 1
65 1 17 PRO HD2 1 18 GLU H . . 5.500 4.878 4.228 5.516 0.016 11 0 "[ . 1 . 2]" 1
66 1 18 GLU H 1 18 GLU HB2 . . 3.810 2.944 2.071 3.793 . 0 0 "[ . 1 . 2]" 1
67 1 18 GLU H 1 18 GLU HB3 . . 3.850 3.395 2.370 3.846 . 0 0 "[ . 1 . 2]" 1
68 1 18 GLU H 1 18 GLU HG2 . . 4.760 4.235 2.308 5.231 0.471 4 0 "[ . 1 . 2]" 1
69 1 18 GLU HA 1 19 GLU H . . 3.050 2.433 2.201 2.926 . 0 0 "[ . 1 . 2]" 1
70 1 18 GLU HG2 1 19 GLU H . . 4.920 3.726 1.950 5.195 0.275 8 0 "[ . 1 . 2]" 1
71 1 19 GLU H 1 19 GLU HB2 . . 3.890 3.077 2.181 3.862 . 0 0 "[ . 1 . 2]" 1
72 1 19 GLU H 1 19 GLU HB3 . . 3.910 3.298 2.628 3.810 . 0 0 "[ . 1 . 2]" 1
73 1 19 GLU H 1 19 GLU HG3 . . 4.960 4.168 2.724 4.882 . 0 0 "[ . 1 . 2]" 1
74 1 19 GLU H 1 20 VAL H . . 3.840 3.451 2.853 4.037 0.197 17 0 "[ . 1 . 2]" 1
75 1 19 GLU HA 1 19 GLU HG2 . . 4.180 2.984 2.046 3.802 . 0 0 "[ . 1 . 2]" 1
76 1 19 GLU HA 1 20 VAL H . . 2.940 2.440 2.202 3.127 0.187 17 0 "[ . 1 . 2]" 1
77 1 19 GLU HA 1 20 VAL HB . . 5.430 4.739 3.867 5.472 0.042 11 0 "[ . 1 . 2]" 1
78 1 19 GLU HB2 1 20 VAL H . . 4.690 4.540 3.365 4.747 0.057 3 0 "[ . 1 . 2]" 1
79 1 19 GLU HB3 1 20 VAL H . . 4.960 4.271 1.971 4.724 . 0 0 "[ . 1 . 2]" 1
80 1 19 GLU HG2 1 20 VAL H . . 5.500 4.396 1.967 5.475 . 0 0 "[ . 1 . 2]" 1
81 1 19 GLU HG3 1 20 VAL H . . 5.500 4.389 3.394 5.180 . 0 0 "[ . 1 . 2]" 1
82 1 20 VAL H 1 20 VAL HB . . 3.870 3.079 2.294 3.952 0.082 15 0 "[ . 1 . 2]" 1
83 1 20 VAL H 1 20 VAL MG1 . . 3.920 3.155 2.208 4.040 0.120 8 0 "[ . 1 . 2]" 1
84 1 20 VAL H 1 21 MET H . . 4.690 4.121 2.479 4.638 . 0 0 "[ . 1 . 2]" 1
85 1 20 VAL H 1 21 MET HA . . 5.500 4.931 4.362 5.524 0.024 15 0 "[ . 1 . 2]" 1
86 1 20 VAL HA 1 20 VAL MG2 . . 3.590 2.362 1.972 3.136 . 0 0 "[ . 1 . 2]" 1
87 1 20 VAL HA 1 21 MET H . . 3.040 2.396 2.220 2.906 . 0 0 "[ . 1 . 2]" 1
88 1 20 VAL HA 1 21 MET HA . . 4.270 4.283 4.248 4.321 0.051 11 0 "[ . 1 . 2]" 1
89 1 20 VAL HA 1 21 MET HB2 . . 5.020 4.743 4.093 5.824 0.804 11 5 "[ * * 1+ . *-]" 1
90 1 20 VAL HB 1 21 MET H . . 4.240 4.112 3.844 4.247 0.007 14 0 "[ . 1 . 2]" 1
91 1 20 VAL MG2 1 21 MET H . . 4.570 3.093 1.804 4.460 . 0 0 "[ . 1 . 2]" 1
92 1 21 MET H 1 21 MET HB2 . . 4.120 2.656 2.005 3.834 . 0 0 "[ . 1 . 2]" 1
93 1 21 MET H 1 21 MET HB3 . . 3.940 3.110 2.362 3.886 . 0 0 "[ . 1 . 2]" 1
94 1 21 MET H 1 21 MET HG2 . . 5.130 3.720 1.965 5.008 . 0 0 "[ . 1 . 2]" 1
95 1 21 MET H 1 21 MET HG3 . . 5.130 3.727 2.493 4.438 . 0 0 "[ . 1 . 2]" 1
96 1 21 MET H 1 22 GLU HA . . 5.500 5.291 4.416 5.502 0.002 14 0 "[ . 1 . 2]" 1
97 1 21 MET HA 1 22 GLU H . . 3.180 2.514 2.205 3.217 0.037 11 0 "[ . 1 . 2]" 1
98 1 21 MET HB2 1 22 GLU H . . 4.380 3.902 2.451 4.554 0.174 11 0 "[ . 1 . 2]" 1
99 1 21 MET HB3 1 22 GLU H . . 4.520 3.412 2.246 4.489 . 0 0 "[ . 1 . 2]" 1
100 1 21 MET HB3 1 22 GLU HA . . 5.500 4.762 3.830 5.815 0.315 2 0 "[ . 1 . 2]" 1
101 1 22 GLU H 1 22 GLU HB2 . . 3.910 2.769 2.061 3.547 . 0 0 "[ . 1 . 2]" 1
102 1 22 GLU H 1 22 GLU HB3 . . 4.090 3.359 2.476 3.949 . 0 0 "[ . 1 . 2]" 1
103 1 22 GLU H 1 22 GLU HG2 . . 4.920 4.224 2.005 5.236 0.316 16 0 "[ . 1 . 2]" 1
104 1 22 GLU HA 1 23 SER H . . 3.200 2.428 2.203 2.650 . 0 0 "[ . 1 . 2]" 1
105 1 22 GLU HB2 1 23 SER H . . 5.130 4.209 2.948 4.739 . 0 0 "[ . 1 . 2]" 1
106 1 22 GLU HB3 1 23 SER H . . 4.760 3.437 2.163 4.497 . 0 0 "[ . 1 . 2]" 1
107 1 22 GLU HB3 1 23 SER HB2 . . 5.430 4.893 3.956 6.132 0.702 5 2 "[ -+ 1 . 2]" 1
108 1 22 GLU HG2 1 23 SER H . . 5.500 3.655 2.305 4.683 . 0 0 "[ . 1 . 2]" 1
109 1 23 SER H 1 23 SER HB2 . . 3.410 2.871 2.026 4.050 0.640 4 2 "[ +- 1 . 2]" 1
110 1 23 SER HA 1 24 ALA H . . 3.340 2.379 2.215 2.629 . 0 0 "[ . 1 . 2]" 1
111 1 23 SER HA 1 24 ALA MB . . 5.500 4.112 3.710 4.268 . 0 0 "[ . 1 . 2]" 1
112 1 23 SER HA 1 25 GLN H . . 5.340 4.839 3.861 5.340 . 7 0 "[ . 1 . 2]" 1
113 1 23 SER HB3 1 24 ALA H . . 4.450 3.842 2.221 4.641 0.191 8 0 "[ . 1 . 2]" 1
114 1 23 SER HB3 1 24 ALA MB . . 5.500 4.628 3.126 5.432 . 0 0 "[ . 1 . 2]" 1
115 1 24 ALA H 1 24 ALA MB . . 3.550 2.612 2.018 2.983 . 0 0 "[ . 1 . 2]" 1
116 1 24 ALA H 1 25 GLN HA . . 5.500 4.894 4.193 5.494 . 0 0 "[ . 1 . 2]" 1
117 1 24 ALA H 1 25 GLN HB3 . . 5.500 4.595 3.428 5.303 . 0 0 "[ . 1 . 2]" 1
118 1 24 ALA HA 1 25 GLN H . . 3.000 2.374 2.204 2.698 . 0 0 "[ . 1 . 2]" 1
119 1 24 ALA HA 1 25 GLN HB3 . . 5.130 4.529 3.929 4.958 . 0 0 "[ . 1 . 2]" 1
120 1 24 ALA HA 1 25 GLN HG2 . . 5.270 4.581 4.046 5.096 . 0 0 "[ . 1 . 2]" 1
121 1 24 ALA MB 1 25 GLN H . . 3.920 3.687 3.504 3.792 . 0 0 "[ . 1 . 2]" 1
122 1 24 ALA MB 1 25 GLN HA . . 5.130 4.458 4.094 5.067 . 0 0 "[ . 1 . 2]" 1
123 1 24 ALA MB 1 25 GLN HG2 . . 5.430 4.807 3.949 5.355 . 0 0 "[ . 1 . 2]" 1
124 1 25 GLN H 1 25 GLN HB2 . . 3.980 3.884 3.698 3.984 0.004 4 0 "[ . 1 . 2]" 1
125 1 25 GLN H 1 25 GLN HB3 . . 3.450 3.210 2.871 3.407 . 0 0 "[ . 1 . 2]" 1
126 1 25 GLN H 1 25 GLN HG2 . . 4.190 2.888 1.955 4.114 . 0 0 "[ . 1 . 2]" 1
127 1 25 GLN H 1 26 PRO HA . . 5.190 4.988 4.681 5.193 0.003 8 0 "[ . 1 . 2]" 1
128 1 25 GLN H 1 26 PRO HD2 . . 5.430 4.925 4.762 5.009 . 0 0 "[ . 1 . 2]" 1
129 1 25 GLN H 1 26 PRO HD3 . . 5.420 4.419 3.856 4.747 . 0 0 "[ . 1 . 2]" 1
130 1 25 GLN HA 1 25 GLN HG2 . . 4.150 3.650 3.566 3.841 . 0 0 "[ . 1 . 2]" 1
131 1 25 GLN HA 1 26 PRO HD2 . . 3.020 2.715 2.627 2.775 . 0 0 "[ . 1 . 2]" 1
132 1 25 GLN HA 1 26 PRO HD3 . . 3.010 2.007 1.967 2.038 . 0 0 "[ . 1 . 2]" 1
133 1 25 GLN HA 1 26 PRO HG2 . . 4.920 4.647 4.583 4.692 . 0 0 "[ . 1 . 2]" 1
134 1 25 GLN HA 1 26 PRO HG3 . . 4.430 4.274 4.239 4.301 . 0 0 "[ . 1 . 2]" 1
135 1 25 GLN HB2 1 26 PRO HD2 . . 3.600 2.214 2.012 2.531 . 0 0 "[ . 1 . 2]" 1
136 1 25 GLN HB2 1 26 PRO HD3 . . 4.030 3.123 2.996 3.299 . 0 0 "[ . 1 . 2]" 1
137 1 25 GLN HB2 1 51 ILE MG . . 5.130 4.438 4.174 4.781 . 0 0 "[ . 1 . 2]" 1
138 1 25 GLN HB3 1 26 PRO HD2 . . 4.520 3.749 3.540 4.076 . 0 0 "[ . 1 . 2]" 1
139 1 25 GLN HB3 1 26 PRO HD3 . . 5.270 4.125 3.918 4.431 . 0 0 "[ . 1 . 2]" 1
140 1 25 GLN HG2 1 27 VAL MG1 . . 5.130 3.988 3.346 4.652 . 0 0 "[ . 1 . 2]" 1
141 1 25 GLN HG3 1 26 PRO HD2 . . 4.630 3.450 2.732 3.890 . 0 0 "[ . 1 . 2]" 1
142 1 25 GLN HG3 1 26 PRO HD3 . . 5.270 4.500 3.992 4.878 . 0 0 "[ . 1 . 2]" 1
143 1 25 GLN HG3 1 51 ILE MG . . 5.500 4.692 3.851 5.277 . 0 0 "[ . 1 . 2]" 1
144 1 26 PRO HA 1 27 VAL H . . 2.880 2.543 2.530 2.579 . 0 0 "[ . 1 . 2]" 1
145 1 26 PRO HA 1 27 VAL HA . . 5.130 4.408 4.402 4.417 . 0 0 "[ . 1 . 2]" 1
146 1 26 PRO HA 1 27 VAL HB . . 5.500 5.548 5.542 5.560 0.060 20 0 "[ . 1 . 2]" 1
147 1 26 PRO HA 1 27 VAL MG1 . . 4.470 3.540 3.418 3.640 . 0 0 "[ . 1 . 2]" 1
148 1 26 PRO HA 1 27 VAL MG2 . . 4.840 3.319 3.145 3.428 . 0 0 "[ . 1 . 2]" 1
149 1 26 PRO HA 1 51 ILE MD . . 5.500 5.535 5.517 5.559 0.059 8 0 "[ . 1 . 2]" 1
150 1 26 PRO HA 1 51 ILE MG . . 4.920 4.444 4.301 4.832 . 0 0 "[ . 1 . 2]" 1
151 1 26 PRO HB2 1 27 VAL H . . 4.210 2.456 2.375 2.488 . 0 0 "[ . 1 . 2]" 1
152 1 26 PRO HB2 1 27 VAL HA . . 4.470 4.136 4.117 4.146 . 0 0 "[ . 1 . 2]" 1
153 1 26 PRO HB2 1 28 ALA HA . . 5.500 5.150 5.048 5.242 . 0 0 "[ . 1 . 2]" 1
154 1 26 PRO HB2 1 51 ILE HA . . 5.500 2.464 2.239 2.739 . 0 0 "[ . 1 . 2]" 1
155 1 26 PRO HB2 1 51 ILE MD . . 4.630 4.265 4.110 4.335 . 0 0 "[ . 1 . 2]" 1
156 1 26 PRO HB2 1 51 ILE MG . . 4.180 2.722 2.620 3.034 . 0 0 "[ . 1 . 2]" 1
157 1 26 PRO HB2 1 55 ASN HD21 . . 5.500 4.010 3.274 4.414 . 0 0 "[ . 1 . 2]" 1
158 1 26 PRO HB2 1 55 ASN HD22 . . 5.500 2.796 2.552 2.978 . 0 0 "[ . 1 . 2]" 1
159 1 26 PRO HB3 1 27 VAL H . . 4.210 3.280 3.246 3.294 . 0 0 "[ . 1 . 2]" 1
160 1 26 PRO HB3 1 27 VAL HA . . 5.500 5.492 5.482 5.496 . 0 0 "[ . 1 . 2]" 1
161 1 26 PRO HB3 1 51 ILE HA . . 4.840 3.873 3.705 4.058 . 0 0 "[ . 1 . 2]" 1
162 1 26 PRO HB3 1 51 ILE MG . . 3.780 3.862 3.820 3.937 0.157 20 0 "[ . 1 . 2]" 1
163 1 26 PRO HB3 1 54 SER HA . . 3.910 2.439 2.105 2.963 . 0 0 "[ . 1 . 2]" 1
164 1 26 PRO HB3 1 55 ASN HD21 . . 5.430 5.053 3.687 5.448 0.018 19 0 "[ . 1 . 2]" 1
165 1 26 PRO HB3 1 55 ASN HD22 . . 5.430 3.875 3.549 4.171 . 0 0 "[ . 1 . 2]" 1
166 1 26 PRO HD2 1 27 VAL H . . 5.500 5.341 5.305 5.354 . 0 0 "[ . 1 . 2]" 1
167 1 26 PRO HD2 1 51 ILE MG . . 2.930 2.988 2.945 3.072 0.142 20 0 "[ . 1 . 2]" 1
168 1 26 PRO HD3 1 51 ILE MG . . 4.690 3.992 3.964 4.010 . 0 0 "[ . 1 . 2]" 1
169 1 26 PRO HG2 1 51 ILE HA . . 4.840 3.299 3.192 3.404 . 0 0 "[ . 1 . 2]" 1
170 1 26 PRO HG2 1 51 ILE HB . . 5.020 4.334 4.296 4.385 . 0 0 "[ . 1 . 2]" 1
171 1 26 PRO HG2 1 51 ILE MD . . 4.270 4.095 3.670 4.227 . 0 0 "[ . 1 . 2]" 1
172 1 26 PRO HG2 1 51 ILE MG . . 3.590 1.751 1.734 1.760 . 0 0 "[ . 1 . 2]" 1
173 1 26 PRO HG2 1 54 SER H . . 5.500 4.295 4.013 4.915 . 0 0 "[ . 1 . 2]" 1
174 1 26 PRO HG2 1 54 SER HA . . 4.840 3.953 3.748 4.413 . 0 0 "[ . 1 . 2]" 1
175 1 26 PRO HG3 1 27 VAL H . . 5.020 5.048 4.993 5.070 0.050 5 0 "[ . 1 . 2]" 1
176 1 26 PRO HG3 1 51 ILE HA . . 5.270 4.193 4.008 4.296 . 0 0 "[ . 1 . 2]" 1
177 1 26 PRO HG3 1 51 ILE MG . . 3.850 3.065 2.824 3.133 . 0 0 "[ . 1 . 2]" 1
178 1 26 PRO HG3 1 54 SER HA . . 3.980 3.456 3.213 3.885 . 0 0 "[ . 1 . 2]" 1
179 1 27 VAL H 1 27 VAL MG1 . . 3.440 3.283 3.194 3.363 . 0 0 "[ . 1 . 2]" 1
180 1 27 VAL H 1 27 VAL MG2 . . 3.500 1.981 1.922 2.068 . 0 0 "[ . 1 . 2]" 1
181 1 27 VAL H 1 28 ALA H . . 4.420 4.221 4.144 4.287 . 0 0 "[ . 1 . 2]" 1
182 1 27 VAL H 1 28 ALA HA . . 5.500 4.664 4.622 4.691 . 0 0 "[ . 1 . 2]" 1
183 1 27 VAL H 1 28 ALA MB . . 5.500 5.332 5.285 5.359 . 0 0 "[ . 1 . 2]" 1
184 1 27 VAL H 1 29 ASN H . . 4.490 4.525 4.509 4.556 0.066 17 0 "[ . 1 . 2]" 1
185 1 27 VAL H 1 51 ILE HG12 . . 5.500 3.436 3.340 3.611 . 0 0 "[ . 1 . 2]" 1
186 1 27 VAL H 1 51 ILE HG13 . . 5.420 4.961 4.873 5.077 . 0 0 "[ . 1 . 2]" 1
187 1 27 VAL H 1 51 ILE MG . . 4.870 4.173 4.016 4.646 . 0 0 "[ . 1 . 2]" 1
188 1 27 VAL H 1 55 ASN HD21 . . 5.420 3.893 2.918 4.399 . 0 0 "[ . 1 . 2]" 1
189 1 27 VAL H 1 55 ASN HD22 . . 5.340 2.380 2.038 2.715 . 0 0 "[ . 1 . 2]" 1
190 1 27 VAL HA 1 27 VAL MG1 . . 3.130 2.172 2.133 2.217 . 0 0 "[ . 1 . 2]" 1
191 1 27 VAL HA 1 27 VAL MG2 . . 3.460 3.196 3.186 3.207 . 0 0 "[ . 1 . 2]" 1
192 1 27 VAL HA 1 28 ALA H . . 2.720 2.201 2.184 2.224 . 0 0 "[ . 1 . 2]" 1
193 1 27 VAL HA 1 28 ALA MB . . 4.100 3.931 3.903 3.949 . 0 0 "[ . 1 . 2]" 1
194 1 27 VAL HA 1 29 ASN H . . 5.340 5.151 5.104 5.224 . 0 0 "[ . 1 . 2]" 1
195 1 27 VAL HA 1 51 ILE MD . . 3.980 2.733 2.595 3.151 . 0 0 "[ . 1 . 2]" 1
196 1 27 VAL HA 1 51 ILE HG12 . . 5.130 2.844 2.614 3.379 . 0 0 "[ . 1 . 2]" 1
197 1 27 VAL HA 1 51 ILE HG13 . . 5.020 4.187 4.022 4.525 . 0 0 "[ . 1 . 2]" 1
198 1 27 VAL HA 1 51 ILE MG . . 5.020 3.860 3.650 4.570 . 0 0 "[ . 1 . 2]" 1
199 1 27 VAL HA 1 55 ASN HD22 . . 5.500 4.212 3.954 4.452 . 0 0 "[ . 1 . 2]" 1
200 1 27 VAL HB 1 28 ALA H . . 3.850 3.363 3.204 3.520 . 0 0 "[ . 1 . 2]" 1
201 1 27 VAL HB 1 28 ALA HA . . 5.500 5.084 5.006 5.142 . 0 0 "[ . 1 . 2]" 1
202 1 27 VAL HB 1 28 ALA MB . . 5.270 4.529 4.477 4.640 . 0 0 "[ . 1 . 2]" 1
203 1 27 VAL HB 1 51 ILE MD . . 5.430 4.676 4.488 5.184 . 0 0 "[ . 1 . 2]" 1
204 1 27 VAL HB 1 55 ASN HD22 . . 5.500 5.069 4.960 5.209 . 0 0 "[ . 1 . 2]" 1
205 1 27 VAL MG1 1 28 ALA H . . 3.800 3.820 3.761 3.869 0.069 14 0 "[ . 1 . 2]" 1
206 1 27 VAL MG2 1 28 ALA H . . 5.240 4.207 4.100 4.300 . 0 0 "[ . 1 . 2]" 1
207 1 27 VAL MG2 1 28 ALA HA . . 5.130 4.820 4.700 4.902 . 0 0 "[ . 1 . 2]" 1
208 1 27 VAL MG2 1 29 ASN H . . 4.340 4.041 3.841 4.173 . 0 0 "[ . 1 . 2]" 1
209 1 27 VAL MG2 1 29 ASN HA . . 4.920 3.599 3.409 3.780 . 0 0 "[ . 1 . 2]" 1
210 1 27 VAL MG2 1 30 GLU H . . 5.130 5.132 5.042 5.175 0.045 14 0 "[ . 1 . 2]" 1
211 1 27 VAL MG2 1 55 ASN HD21 . . 5.500 4.552 3.840 5.014 . 0 0 "[ . 1 . 2]" 1
212 1 27 VAL MG2 1 55 ASN HD22 . . 5.430 3.505 3.074 3.846 . 0 0 "[ . 1 . 2]" 1
213 1 28 ALA H 1 28 ALA MB . . 2.900 2.031 1.986 2.070 . 0 0 "[ . 1 . 2]" 1
214 1 28 ALA H 1 29 ASN HA . . 5.500 5.339 5.266 5.400 . 0 0 "[ . 1 . 2]" 1
215 1 28 ALA H 1 47 GLN HA . . 5.270 4.798 4.717 4.941 . 0 0 "[ . 1 . 2]" 1
216 1 28 ALA H 1 51 ILE H . . 5.500 4.788 4.622 5.176 . 0 0 "[ . 1 . 2]" 1
217 1 28 ALA H 1 51 ILE HA . . 5.500 4.752 4.631 5.181 . 0 0 "[ . 1 . 2]" 1
218 1 28 ALA H 1 51 ILE MD . . 3.960 2.186 2.055 2.600 . 0 0 "[ . 1 . 2]" 1
219 1 28 ALA H 1 51 ILE HG12 . . 4.540 2.464 2.337 2.964 . 0 0 "[ . 1 . 2]" 1
220 1 28 ALA H 1 51 ILE HG13 . . 4.690 2.809 2.695 3.190 . 0 0 "[ . 1 . 2]" 1
221 1 28 ALA H 1 51 ILE MG . . 4.690 4.194 4.046 4.649 . 0 0 "[ . 1 . 2]" 1
222 1 28 ALA H 1 55 ASN HD22 . . 5.500 4.350 3.956 4.725 . 0 0 "[ . 1 . 2]" 1
223 1 28 ALA HA 1 29 ASN H . . 2.850 2.291 2.269 2.308 . 0 0 "[ . 1 . 2]" 1
224 1 28 ALA HA 1 29 ASN HB2 . . 4.690 4.493 4.411 4.575 . 0 0 "[ . 1 . 2]" 1
225 1 28 ALA HA 1 29 ASN HB3 . . 4.840 4.696 4.604 4.791 . 0 0 "[ . 1 . 2]" 1
226 1 28 ALA HA 1 33 VAL MG2 . . 4.760 3.333 3.210 3.493 . 0 0 "[ . 1 . 2]" 1
227 1 28 ALA HA 1 47 GLN HA . . 5.130 3.408 3.331 3.548 . 0 0 "[ . 1 . 2]" 1
228 1 28 ALA HA 1 50 ALA H . . 5.500 4.889 4.748 5.025 . 0 0 "[ . 1 . 2]" 1
229 1 28 ALA HA 1 50 ALA MB . . 3.430 2.420 2.288 2.580 . 0 0 "[ . 1 . 2]" 1
230 1 28 ALA HA 1 51 ILE H . . 4.690 3.001 2.861 3.331 . 0 0 "[ . 1 . 2]" 1
231 1 28 ALA HA 1 51 ILE HA . . 4.470 3.779 3.691 4.087 . 0 0 "[ . 1 . 2]" 1
232 1 28 ALA HA 1 51 ILE MD . . 4.180 3.407 3.297 3.573 . 0 0 "[ . 1 . 2]" 1
233 1 28 ALA HA 1 51 ILE HG12 . . 3.420 2.793 2.685 3.048 . 0 0 "[ . 1 . 2]" 1
234 1 28 ALA HA 1 51 ILE HG13 . . 4.270 2.101 1.998 2.359 . 0 0 "[ . 1 . 2]" 1
235 1 28 ALA HA 1 55 ASN HD21 . . 4.340 2.922 2.486 4.498 0.158 11 0 "[ . 1 . 2]" 1
236 1 28 ALA HA 1 55 ASN HD22 . . 3.750 3.306 2.802 3.780 0.030 12 0 "[ . 1 . 2]" 1
237 1 28 ALA MB 1 29 ASN H . . 3.850 3.661 3.634 3.678 . 0 0 "[ . 1 . 2]" 1
238 1 28 ALA MB 1 29 ASN HA . . 5.270 4.699 4.678 4.714 . 0 0 "[ . 1 . 2]" 1
239 1 28 ALA MB 1 29 ASN HB2 . . 5.500 5.397 5.335 5.459 . 0 0 "[ . 1 . 2]" 1
240 1 28 ALA MB 1 29 ASN HB3 . . 5.500 5.160 5.115 5.211 . 0 0 "[ . 1 . 2]" 1
241 1 28 ALA MB 1 30 GLU H . . 5.500 5.371 5.165 5.618 0.118 14 0 "[ . 1 . 2]" 1
242 1 28 ALA MB 1 30 GLU HA . . 5.020 4.668 4.512 4.830 . 0 0 "[ . 1 . 2]" 1
243 1 28 ALA MB 1 33 VAL H . . 5.020 4.860 4.729 5.044 0.024 18 0 "[ . 1 . 2]" 1
244 1 28 ALA MB 1 33 VAL HA . . 5.130 5.032 4.873 5.133 0.003 20 0 "[ . 1 . 2]" 1
245 1 28 ALA MB 1 33 VAL HB . . 4.840 4.015 3.868 4.165 . 0 0 "[ . 1 . 2]" 1
246 1 28 ALA MB 1 33 VAL MG1 . . 4.150 3.530 3.317 3.644 . 0 0 "[ . 1 . 2]" 1
247 1 28 ALA MB 1 33 VAL MG2 . . 2.880 1.933 1.873 2.041 . 0 0 "[ . 1 . 2]" 1
248 1 28 ALA MB 1 46 CYS HB3 . . 5.500 5.303 5.198 5.413 . 0 0 "[ . 1 . 2]" 1
249 1 28 ALA MB 1 47 GLN H . . 5.270 3.844 3.820 3.892 . 0 0 "[ . 1 . 2]" 1
250 1 28 ALA MB 1 47 GLN HA . . 3.120 1.802 1.769 1.865 . 0 0 "[ . 1 . 2]" 1
251 1 28 ALA MB 1 47 GLN HB2 . . 4.470 3.128 3.094 3.205 . 0 0 "[ . 1 . 2]" 1
252 1 28 ALA MB 1 47 GLN HB3 . . 3.920 1.863 1.832 1.968 . 0 0 "[ . 1 . 2]" 1
253 1 28 ALA MB 1 47 GLN HE21 . . 4.690 3.714 3.049 4.424 . 0 0 "[ . 1 . 2]" 1
254 1 28 ALA MB 1 47 GLN HE22 . . 5.270 4.372 4.051 4.643 . 0 0 "[ . 1 . 2]" 1
255 1 28 ALA MB 1 47 GLN HG2 . . 3.660 1.943 1.922 1.958 . 0 0 "[ . 1 . 2]" 1
256 1 28 ALA MB 1 47 GLN HG3 . . 4.150 3.241 3.108 3.331 . 0 0 "[ . 1 . 2]" 1
257 1 28 ALA MB 1 50 ALA H . . 4.570 4.522 4.444 4.581 0.011 8 0 "[ . 1 . 2]" 1
258 1 28 ALA MB 1 50 ALA MB . . 3.030 3.041 2.927 3.075 0.045 19 0 "[ . 1 . 2]" 1
259 1 28 ALA MB 1 51 ILE H . . 4.180 3.193 3.144 3.372 . 0 0 "[ . 1 . 2]" 1
260 1 28 ALA MB 1 51 ILE HA . . 4.920 4.547 4.507 4.708 . 0 0 "[ . 1 . 2]" 1
261 1 28 ALA MB 1 51 ILE HB . . 3.980 3.790 3.730 3.993 0.013 20 0 "[ . 1 . 2]" 1
262 1 28 ALA MB 1 51 ILE MD . . 3.420 2.073 1.974 2.284 . 0 0 "[ . 1 . 2]" 1
263 1 28 ALA MB 1 51 ILE HG12 . . 3.780 3.160 3.102 3.313 . 0 0 "[ . 1 . 2]" 1
264 1 28 ALA MB 1 51 ILE HG13 . . 3.130 1.972 1.930 2.152 . 0 0 "[ . 1 . 2]" 1
265 1 28 ALA MB 1 55 ASN HD22 . . 5.270 4.686 4.252 5.096 . 0 0 "[ . 1 . 2]" 1
266 1 29 ASN H 1 29 ASN HB2 . . 3.410 2.246 2.182 2.315 . 0 0 "[ . 1 . 2]" 1
267 1 29 ASN H 1 29 ASN HB3 . . 3.340 2.825 2.745 2.927 . 0 0 "[ . 1 . 2]" 1
268 1 29 ASN H 1 29 ASN HD21 . . 5.130 4.173 4.064 4.300 . 0 0 "[ . 1 . 2]" 1
269 1 29 ASN H 1 29 ASN HD22 . . 5.500 5.491 5.445 5.518 0.018 11 0 "[ . 1 . 2]" 1
270 1 29 ASN H 1 30 GLU H . . 4.830 4.598 4.533 4.657 . 0 0 "[ . 1 . 2]" 1
271 1 29 ASN H 1 31 GLU H . . 5.500 5.497 5.347 5.537 0.037 14 0 "[ . 1 . 2]" 1
272 1 29 ASN H 1 32 ILE H . . 5.420 4.927 4.853 5.047 . 0 0 "[ . 1 . 2]" 1
273 1 29 ASN H 1 32 ILE HB . . 4.760 3.963 3.852 4.055 . 0 0 "[ . 1 . 2]" 1
274 1 29 ASN H 1 32 ILE MD . . 4.300 3.958 3.718 4.236 . 0 0 "[ . 1 . 2]" 1
275 1 29 ASN H 1 32 ILE HG13 . . 5.500 4.726 4.541 4.831 . 0 0 "[ . 1 . 2]" 1
276 1 29 ASN H 1 33 VAL H . . 5.500 4.989 4.837 5.135 . 0 0 "[ . 1 . 2]" 1
277 1 29 ASN H 1 33 VAL MG2 . . 4.470 3.698 3.525 3.876 . 0 0 "[ . 1 . 2]" 1
278 1 29 ASN H 1 50 ALA HA . . 5.500 5.505 5.406 5.592 0.092 11 0 "[ . 1 . 2]" 1
279 1 29 ASN H 1 50 ALA MB . . 3.620 2.849 2.729 2.998 . 0 0 "[ . 1 . 2]" 1
280 1 29 ASN H 1 51 ILE H . . 5.500 4.694 4.561 5.024 . 0 0 "[ . 1 . 2]" 1
281 1 29 ASN H 1 51 ILE HG13 . . 4.720 4.268 4.160 4.521 . 0 0 "[ . 1 . 2]" 1
282 1 29 ASN H 1 55 ASN HB2 . . 5.420 3.876 3.552 4.462 . 0 0 "[ . 1 . 2]" 1
283 1 29 ASN H 1 55 ASN HB3 . . 5.270 2.676 2.332 3.378 . 0 0 "[ . 1 . 2]" 1
284 1 29 ASN H 1 55 ASN HD21 . . 4.570 2.531 1.973 3.649 . 0 0 "[ . 1 . 2]" 1
285 1 29 ASN H 1 55 ASN HD22 . . 3.900 3.060 2.750 3.273 . 0 0 "[ . 1 . 2]" 1
286 1 29 ASN HA 1 29 ASN HD21 . . 4.520 3.385 2.880 3.974 . 0 0 "[ . 1 . 2]" 1
287 1 29 ASN HA 1 29 ASN HD22 . . 5.190 4.052 3.821 4.340 . 0 0 "[ . 1 . 2]" 1
288 1 29 ASN HA 1 30 GLU H . . 2.970 2.296 2.259 2.375 . 0 0 "[ . 1 . 2]" 1
289 1 29 ASN HA 1 30 GLU HA . . 4.690 4.353 4.341 4.371 . 0 0 "[ . 1 . 2]" 1
290 1 29 ASN HA 1 30 GLU HB2 . . 4.690 4.424 4.329 4.617 . 0 0 "[ . 1 . 2]" 1
291 1 29 ASN HA 1 30 GLU QG . . 5.430 4.459 4.100 4.892 . 0 0 "[ . 1 . 2]" 1
292 1 29 ASN HA 1 31 GLU H . . 4.690 3.798 3.697 3.946 . 0 0 "[ . 1 . 2]" 1
293 1 29 ASN HA 1 32 ILE H . . 5.430 4.495 4.328 4.689 . 0 0 "[ . 1 . 2]" 1
294 1 29 ASN HA 1 32 ILE HB . . 5.430 4.945 4.855 5.087 . 0 0 "[ . 1 . 2]" 1
295 1 29 ASN HA 1 32 ILE MD . . 5.130 4.949 4.741 5.212 0.082 17 0 "[ . 1 . 2]" 1
296 1 29 ASN HA 1 50 ALA MB . . 5.430 4.858 4.774 5.031 . 0 0 "[ . 1 . 2]" 1
297 1 29 ASN HA 1 55 ASN HD21 . . 5.500 4.915 4.373 5.396 . 0 0 "[ . 1 . 2]" 1
298 1 29 ASN HA 1 55 ASN HD22 . . 5.500 5.039 4.833 5.230 . 0 0 "[ . 1 . 2]" 1
299 1 29 ASN HB2 1 30 GLU H . . 4.870 4.357 4.239 4.460 . 0 0 "[ . 1 . 2]" 1
300 1 29 ASN HB2 1 31 GLU H . . 5.500 4.468 4.338 4.567 . 0 0 "[ . 1 . 2]" 1
301 1 29 ASN HB2 1 32 ILE H . . 4.470 3.766 3.733 3.844 . 0 0 "[ . 1 . 2]" 1
302 1 29 ASN HB2 1 32 ILE HB . . 3.980 3.473 3.364 3.588 . 0 0 "[ . 1 . 2]" 1
303 1 29 ASN HB2 1 32 ILE MD . . 3.740 2.840 2.686 3.089 . 0 0 "[ . 1 . 2]" 1
304 1 29 ASN HB2 1 32 ILE HG12 . . 4.630 4.625 4.536 4.666 0.036 14 0 "[ . 1 . 2]" 1
305 1 29 ASN HB2 1 32 ILE HG13 . . 4.630 3.021 2.834 3.108 . 0 0 "[ . 1 . 2]" 1
306 1 29 ASN HB2 1 32 ILE MG . . 4.920 4.575 4.510 4.655 . 0 0 "[ . 1 . 2]" 1
307 1 29 ASN HB2 1 50 ALA MB . . 4.760 3.620 3.504 3.892 . 0 0 "[ . 1 . 2]" 1
308 1 29 ASN HB2 1 55 ASN HB2 . . 4.840 2.564 2.075 3.138 . 0 0 "[ . 1 . 2]" 1
309 1 29 ASN HB2 1 55 ASN HD21 . . 3.940 3.591 3.065 3.972 0.032 17 0 "[ . 1 . 2]" 1
310 1 29 ASN HB2 1 55 ASN HD22 . . 4.320 4.212 4.005 4.330 0.010 13 0 "[ . 1 . 2]" 1
311 1 29 ASN HB3 1 30 GLU H . . 5.020 4.027 3.716 4.180 . 0 0 "[ . 1 . 2]" 1
312 1 29 ASN HB3 1 31 GLU H . . 5.190 3.499 3.260 3.678 . 0 0 "[ . 1 . 2]" 1
313 1 29 ASN HB3 1 32 ILE H . . 4.290 2.209 2.130 2.310 . 0 0 "[ . 1 . 2]" 1
314 1 29 ASN HB3 1 32 ILE HB . . 3.740 2.047 1.984 2.201 . 0 0 "[ . 1 . 2]" 1
315 1 29 ASN HB3 1 32 ILE MD . . 3.470 2.788 2.502 3.078 . 0 0 "[ . 1 . 2]" 1
316 1 29 ASN HB3 1 32 ILE HG12 . . 4.570 3.671 3.576 3.813 . 0 0 "[ . 1 . 2]" 1
317 1 29 ASN HB3 1 32 ILE HG13 . . 4.520 2.090 1.983 2.217 . 0 0 "[ . 1 . 2]" 1
318 1 29 ASN HB3 1 32 ILE MG . . 4.430 3.683 3.608 3.826 . 0 0 "[ . 1 . 2]" 1
319 1 29 ASN HB3 1 33 VAL H . . 4.790 3.332 3.214 3.588 . 0 0 "[ . 1 . 2]" 1
320 1 29 ASN HB3 1 33 VAL MG2 . . 3.780 3.736 3.578 3.828 0.048 15 0 "[ . 1 . 2]" 1
321 1 29 ASN HB3 1 50 ALA MB . . 4.470 3.392 3.226 3.602 . 0 0 "[ . 1 . 2]" 1
322 1 29 ASN HB3 1 55 ASN HA . . 5.430 4.610 4.388 4.863 . 0 0 "[ . 1 . 2]" 1
323 1 29 ASN HB3 1 55 ASN HB2 . . 4.760 3.750 3.135 4.334 . 0 0 "[ . 1 . 2]" 1
324 1 29 ASN HB3 1 55 ASN HB3 . . 4.310 2.763 2.592 2.937 . 0 0 "[ . 1 . 2]" 1
325 1 29 ASN HB3 1 55 ASN HD21 . . 5.420 4.477 3.771 5.438 0.018 11 0 "[ . 1 . 2]" 1
326 1 29 ASN HB3 1 55 ASN HD22 . . 5.500 5.434 5.155 5.524 0.024 7 0 "[ . 1 . 2]" 1
327 1 29 ASN HD21 1 30 GLU H . . 5.500 4.735 4.216 5.111 . 0 0 "[ . 1 . 2]" 1
328 1 29 ASN HD21 1 31 GLU H . . 5.340 4.618 4.362 4.783 . 0 0 "[ . 1 . 2]" 1
329 1 29 ASN HD21 1 31 GLU HB2 . . 5.500 4.772 4.327 4.931 . 0 0 "[ . 1 . 2]" 1
330 1 29 ASN HD21 1 31 GLU HB3 . . 5.500 5.281 5.070 5.499 . 0 0 "[ . 1 . 2]" 1
331 1 29 ASN HD21 1 32 ILE MD . . 4.630 3.338 2.533 3.932 . 0 0 "[ . 1 . 2]" 1
332 1 29 ASN HD21 1 32 ILE HG13 . . 5.500 3.541 2.774 4.036 . 0 0 "[ . 1 . 2]" 1
333 1 29 ASN HD21 1 50 ALA MB . . 5.500 5.335 4.960 5.530 0.030 3 0 "[ . 1 . 2]" 1
334 1 29 ASN HD21 1 55 ASN HB2 . . 5.500 3.094 2.581 4.018 . 0 0 "[ . 1 . 2]" 1
335 1 29 ASN HD21 1 55 ASN HB3 . . 5.020 3.594 2.989 4.103 . 0 0 "[ . 1 . 2]" 1
336 1 29 ASN HD22 1 30 GLU H . . 5.500 4.579 4.244 4.943 . 0 0 "[ . 1 . 2]" 1
337 1 29 ASN HD22 1 31 GLU H . . 4.830 3.963 3.651 4.122 . 0 0 "[ . 1 . 2]" 1
338 1 29 ASN HD22 1 31 GLU HB2 . . 4.920 3.537 3.345 3.660 . 0 0 "[ . 1 . 2]" 1
339 1 29 ASN HD22 1 31 GLU HB3 . . 4.920 4.299 4.041 4.796 . 0 0 "[ . 1 . 2]" 1
340 1 29 ASN HD22 1 31 GLU QG . . 5.500 5.096 4.866 5.233 . 0 0 "[ . 1 . 2]" 1
341 1 29 ASN HD22 1 32 ILE H . . 4.870 4.407 4.251 4.544 . 0 0 "[ . 1 . 2]" 1
342 1 29 ASN HD22 1 32 ILE MD . . 5.130 4.155 3.837 4.491 . 0 0 "[ . 1 . 2]" 1
343 1 29 ASN HD22 1 32 ILE HG13 . . 5.190 3.804 3.499 4.083 . 0 0 "[ . 1 . 2]" 1
344 1 29 ASN HD22 1 55 ASN HB2 . . 5.500 4.596 4.173 5.234 . 0 0 "[ . 1 . 2]" 1
345 1 30 GLU H 1 30 GLU HB2 . . 3.350 2.172 2.096 2.315 . 0 0 "[ . 1 . 2]" 1
346 1 30 GLU H 1 30 GLU HB3 . . 3.520 3.450 3.352 3.538 0.018 1 0 "[ . 1 . 2]" 1
347 1 30 GLU H 1 30 GLU QG . . 4.080 2.948 2.540 3.350 . 0 0 "[ . 1 . 2]" 1
348 1 30 GLU H 1 31 GLU H . . 3.700 2.513 2.358 2.613 . 0 0 "[ . 1 . 2]" 1
349 1 30 GLU H 1 31 GLU HA . . 5.500 5.038 4.908 5.121 . 0 0 "[ . 1 . 2]" 1
350 1 30 GLU H 1 31 GLU HB2 . . 4.630 4.312 4.212 4.429 . 0 0 "[ . 1 . 2]" 1
351 1 30 GLU H 1 31 GLU HB3 . . 5.500 5.542 5.462 5.731 0.231 14 0 "[ . 1 . 2]" 1
352 1 30 GLU H 1 32 ILE H . . 5.070 4.336 4.231 4.466 . 0 0 "[ . 1 . 2]" 1
353 1 30 GLU H 1 33 VAL H . . 5.500 4.653 4.592 4.709 . 0 0 "[ . 1 . 2]" 1
354 1 30 GLU H 1 33 VAL MG2 . . 5.500 4.684 4.512 4.877 . 0 0 "[ . 1 . 2]" 1
355 1 30 GLU H 1 34 ALA H . . 5.500 5.472 5.399 5.533 0.033 19 0 "[ . 1 . 2]" 1
356 1 30 GLU HA 1 30 GLU QG . . 3.890 2.095 1.977 2.497 . 0 0 "[ . 1 . 2]" 1
357 1 30 GLU HA 1 31 GLU HA . . 5.020 4.693 4.660 4.725 . 0 0 "[ . 1 . 2]" 1
358 1 30 GLU HA 1 32 ILE H . . 5.260 4.697 4.408 4.850 . 0 0 "[ . 1 . 2]" 1
359 1 30 GLU HA 1 33 VAL H . . 3.790 3.491 3.313 3.593 . 0 0 "[ . 1 . 2]" 1
360 1 30 GLU HA 1 33 VAL HA . . 5.430 5.397 5.271 5.463 0.033 11 0 "[ . 1 . 2]" 1
361 1 30 GLU HA 1 33 VAL HB . . 2.840 2.487 2.369 2.556 . 0 0 "[ . 1 . 2]" 1
362 1 30 GLU HA 1 33 VAL MG1 . . 4.210 3.698 3.576 3.849 . 0 0 "[ . 1 . 2]" 1
363 1 30 GLU HA 1 33 VAL MG2 . . 3.720 3.464 3.272 3.645 . 0 0 "[ . 1 . 2]" 1
364 1 30 GLU HA 1 34 ALA H . . 4.070 3.490 3.277 3.756 . 0 0 "[ . 1 . 2]" 1
365 1 30 GLU HA 1 34 ALA MB . . 4.760 4.025 3.911 4.163 . 0 0 "[ . 1 . 2]" 1
366 1 30 GLU HB2 1 31 GLU H . . 4.310 3.210 3.081 3.360 . 0 0 "[ . 1 . 2]" 1
367 1 30 GLU HB2 1 31 GLU HA . . 5.020 4.726 4.498 4.931 . 0 0 "[ . 1 . 2]" 1
368 1 30 GLU HB3 1 31 GLU H . . 3.960 3.744 3.615 3.947 . 0 0 "[ . 1 . 2]" 1
369 1 30 GLU HB3 1 31 GLU HA . . 4.570 4.203 4.092 4.398 . 0 0 "[ . 1 . 2]" 1
370 1 30 GLU HB3 1 34 ALA MB . . 4.430 3.704 3.475 3.887 . 0 0 "[ . 1 . 2]" 1
371 1 30 GLU QG 1 31 GLU H . . 5.270 4.524 4.379 4.747 . 0 0 "[ . 1 . 2]" 1
372 1 30 GLU QG 1 34 ALA H . . 5.500 5.111 4.861 5.249 . 0 0 "[ . 1 . 2]" 1
373 1 31 GLU H 1 31 GLU HB2 . . 3.480 2.101 2.087 2.131 . 0 0 "[ . 1 . 2]" 1
374 1 31 GLU H 1 31 GLU HB3 . . 3.400 3.113 3.043 3.414 0.014 18 0 "[ . 1 . 2]" 1
375 1 31 GLU H 1 31 GLU QG . . 4.000 3.614 3.554 3.677 . 0 0 "[ . 1 . 2]" 1
376 1 31 GLU H 1 32 ILE H . . 3.320 2.536 2.486 2.606 . 0 0 "[ . 1 . 2]" 1
377 1 31 GLU H 1 32 ILE HA . . 5.270 5.108 5.067 5.158 . 0 0 "[ . 1 . 2]" 1
378 1 31 GLU H 1 32 ILE HB . . 5.130 4.719 4.683 4.761 . 0 0 "[ . 1 . 2]" 1
379 1 31 GLU H 1 32 ILE MD . . 5.260 5.265 5.205 5.301 0.041 17 0 "[ . 1 . 2]" 1
380 1 31 GLU H 1 32 ILE HG13 . . 5.130 3.957 3.884 4.028 . 0 0 "[ . 1 . 2]" 1
381 1 31 GLU H 1 33 VAL H . . 4.870 3.738 3.569 3.880 . 0 0 "[ . 1 . 2]" 1
382 1 31 GLU H 1 34 ALA MB . . 5.420 4.311 4.241 4.435 . 0 0 "[ . 1 . 2]" 1
383 1 31 GLU HA 1 31 GLU QG . . 3.740 2.002 1.950 2.366 . 0 0 "[ . 1 . 2]" 1
384 1 31 GLU HA 1 32 ILE HA . . 5.130 4.770 4.735 4.798 . 0 0 "[ . 1 . 2]" 1
385 1 31 GLU HA 1 33 VAL H . . 5.500 4.331 4.175 4.439 . 0 0 "[ . 1 . 2]" 1
386 1 31 GLU HA 1 34 ALA H . . 4.000 3.409 3.189 3.616 . 0 0 "[ . 1 . 2]" 1
387 1 31 GLU HA 1 34 ALA MB . . 3.290 2.339 2.205 2.527 . 0 0 "[ . 1 . 2]" 1
388 1 31 GLU HA 1 35 GLN H . . 4.630 4.072 3.907 4.222 . 0 0 "[ . 1 . 2]" 1
389 1 31 GLU HA 1 35 GLN HE21 . . 5.500 4.254 3.319 5.220 . 0 0 "[ . 1 . 2]" 1
390 1 31 GLU HA 1 35 GLN HG2 . . 5.430 5.382 4.622 5.893 0.463 13 0 "[ . 1 . 2]" 1
391 1 31 GLU HB2 1 32 ILE H . . 4.000 3.194 2.732 3.397 . 0 0 "[ . 1 . 2]" 1
392 1 31 GLU HB2 1 32 ILE HG12 . . 5.430 4.929 4.306 5.246 . 0 0 "[ . 1 . 2]" 1
393 1 31 GLU HB2 1 32 ILE HG13 . . 4.380 4.022 3.479 4.158 . 0 0 "[ . 1 . 2]" 1
394 1 31 GLU HB2 1 35 GLN HE21 . . 5.500 4.908 4.202 5.513 0.013 7 0 "[ . 1 . 2]" 1
395 1 31 GLU HB3 1 32 ILE H . . 4.000 2.754 2.595 3.112 . 0 0 "[ . 1 . 2]" 1
396 1 31 GLU HB3 1 32 ILE HB . . 5.500 5.013 4.908 5.397 . 0 0 "[ . 1 . 2]" 1
397 1 31 GLU HB3 1 32 ILE MD . . 5.430 4.739 4.655 5.120 . 0 0 "[ . 1 . 2]" 1
398 1 31 GLU HB3 1 32 ILE HG12 . . 5.500 3.693 3.415 4.041 . 0 0 "[ . 1 . 2]" 1
399 1 31 GLU HB3 1 32 ILE HG13 . . 5.130 3.365 3.236 3.881 . 0 0 "[ . 1 . 2]" 1
400 1 31 GLU HB3 1 33 VAL H . . 5.070 4.978 4.842 5.113 0.043 18 0 "[ . 1 . 2]" 1
401 1 31 GLU HB3 1 35 GLN HE21 . . 5.500 3.350 2.651 3.997 . 0 0 "[ . 1 . 2]" 1
402 1 31 GLU QG 1 32 ILE H . . 5.020 4.440 4.384 4.502 . 0 0 "[ . 1 . 2]" 1
403 1 31 GLU QG 1 34 ALA H . . 5.500 5.109 4.946 5.288 . 0 0 "[ . 1 . 2]" 1
404 1 31 GLU QG 1 34 ALA MB . . 4.840 3.539 3.372 3.789 . 0 0 "[ . 1 . 2]" 1
405 1 31 GLU QG 1 35 GLN HE21 . . 5.270 3.819 3.048 4.489 . 0 0 "[ . 1 . 2]" 1
406 1 32 ILE H 1 32 ILE HB . . 3.080 2.494 2.426 2.565 . 0 0 "[ . 1 . 2]" 1
407 1 32 ILE H 1 32 ILE MD . . 3.710 3.608 3.571 3.655 . 0 0 "[ . 1 . 2]" 1
408 1 32 ILE H 1 32 ILE HG12 . . 4.180 2.999 2.721 3.233 . 0 0 "[ . 1 . 2]" 1
409 1 32 ILE H 1 32 ILE HG13 . . 3.410 1.971 1.931 2.085 . 0 0 "[ . 1 . 2]" 1
410 1 32 ILE H 1 32 ILE MG . . 3.670 3.713 3.708 3.722 0.052 6 0 "[ . 1 . 2]" 1
411 1 32 ILE H 1 33 VAL HA . . 5.500 5.177 5.073 5.241 . 0 0 "[ . 1 . 2]" 1
412 1 32 ILE H 1 33 VAL MG2 . . 4.540 4.232 3.919 4.385 . 0 0 "[ . 1 . 2]" 1
413 1 32 ILE H 1 34 ALA H . . 4.830 4.163 4.032 4.287 . 0 0 "[ . 1 . 2]" 1
414 1 32 ILE H 1 50 ALA MB . . 5.190 4.633 4.518 4.706 . 0 0 "[ . 1 . 2]" 1
415 1 32 ILE H 1 58 VAL MG2 . . 4.630 4.166 4.045 4.266 . 0 0 "[ . 1 . 2]" 1
416 1 32 ILE HA 1 32 ILE HG12 . . 3.350 2.493 2.477 2.524 . 0 0 "[ . 1 . 2]" 1
417 1 32 ILE HA 1 32 ILE HG13 . . 3.530 3.225 3.124 3.373 . 0 0 "[ . 1 . 2]" 1
418 1 32 ILE HA 1 32 ILE MG . . 3.170 2.307 2.284 2.334 . 0 0 "[ . 1 . 2]" 1
419 1 32 ILE HA 1 34 ALA H . . 5.270 4.696 4.439 4.894 . 0 0 "[ . 1 . 2]" 1
420 1 32 ILE HA 1 34 ALA MB . . 5.270 5.039 4.953 5.158 . 0 0 "[ . 1 . 2]" 1
421 1 32 ILE HA 1 35 GLN H . . 4.150 3.507 3.416 3.641 . 0 0 "[ . 1 . 2]" 1
422 1 32 ILE HA 1 35 GLN HB2 . . 3.890 2.651 2.519 2.777 . 0 0 "[ . 1 . 2]" 1
423 1 32 ILE HA 1 35 GLN HB3 . . 4.310 4.216 4.044 4.325 0.015 20 0 "[ . 1 . 2]" 1
424 1 32 ILE HA 1 35 GLN HE21 . . 4.840 3.290 2.145 4.356 . 0 0 "[ . 1 . 2]" 1
425 1 32 ILE HA 1 35 GLN HE22 . . 5.500 4.146 2.988 5.500 . 0 0 "[ . 1 . 2]" 1
426 1 32 ILE HA 1 35 GLN HG2 . . 4.760 4.985 4.764 5.150 0.390 8 0 "[ . 1 . 2]" 1
427 1 32 ILE HA 1 35 GLN HG3 . . 5.130 3.699 3.197 4.144 . 0 0 "[ . 1 . 2]" 1
428 1 32 ILE HA 1 36 LEU H . . 5.020 4.191 4.074 4.368 . 0 0 "[ . 1 . 2]" 1
429 1 32 ILE HA 1 36 LEU MD2 . . 5.430 5.307 5.186 5.360 . 0 0 "[ . 1 . 2]" 1
430 1 32 ILE HA 1 36 LEU HG . . 4.210 4.205 4.157 4.223 0.013 19 0 "[ . 1 . 2]" 1
431 1 32 ILE HA 1 50 ALA MB . . 4.920 4.860 4.789 4.938 0.018 8 0 "[ . 1 . 2]" 1
432 1 32 ILE HA 1 58 VAL H . . 5.500 4.649 4.480 4.875 . 0 0 "[ . 1 . 2]" 1
433 1 32 ILE HA 1 58 VAL HB . . 4.920 4.877 4.710 4.937 0.017 9 0 "[ . 1 . 2]" 1
434 1 32 ILE HA 1 58 VAL MG1 . . 4.840 3.746 3.461 3.910 . 0 0 "[ . 1 . 2]" 1
435 1 32 ILE HA 1 58 VAL MG2 . . 2.920 2.028 1.911 2.147 . 0 0 "[ . 1 . 2]" 1
436 1 32 ILE HB 1 32 ILE MD . . 3.170 2.389 2.330 2.481 . 0 0 "[ . 1 . 2]" 1
437 1 32 ILE HB 1 33 VAL H . . 3.550 2.828 2.743 2.933 . 0 0 "[ . 1 . 2]" 1
438 1 32 ILE HB 1 33 VAL HA . . 5.270 4.347 4.308 4.387 . 0 0 "[ . 1 . 2]" 1
439 1 32 ILE HB 1 33 VAL HB . . 5.270 4.796 4.710 4.900 . 0 0 "[ . 1 . 2]" 1
440 1 32 ILE HB 1 33 VAL MG2 . . 3.890 3.245 3.045 3.429 . 0 0 "[ . 1 . 2]" 1
441 1 32 ILE HB 1 34 ALA H . . 5.500 5.229 5.121 5.353 . 0 0 "[ . 1 . 2]" 1
442 1 32 ILE HB 1 50 ALA H . . 5.500 5.348 5.042 5.498 . 0 0 "[ . 1 . 2]" 1
443 1 32 ILE HB 1 50 ALA MB . . 4.210 2.653 2.503 2.749 . 0 0 "[ . 1 . 2]" 1
444 1 32 ILE HB 1 58 VAL MG2 . . 5.430 4.040 3.844 4.192 . 0 0 "[ . 1 . 2]" 1
445 1 32 ILE HB 1 61 ALA MB . . 5.270 3.819 3.695 3.950 . 0 0 "[ . 1 . 2]" 1
446 1 32 ILE MD 1 50 ALA HA . . 4.840 3.677 3.446 3.849 . 0 0 "[ . 1 . 2]" 1
447 1 32 ILE MD 1 50 ALA MB . . 3.360 2.560 2.167 2.810 . 0 0 "[ . 1 . 2]" 1
448 1 32 ILE MD 1 55 ASN H . . 4.630 3.944 3.767 4.044 . 0 0 "[ . 1 . 2]" 1
449 1 32 ILE MD 1 55 ASN HA . . 3.450 2.090 1.936 2.180 . 0 0 "[ . 1 . 2]" 1
450 1 32 ILE MD 1 55 ASN HB2 . . 4.270 2.155 1.847 2.925 . 0 0 "[ . 1 . 2]" 1
451 1 32 ILE MD 1 55 ASN HB3 . . 3.340 1.961 1.766 2.183 . 0 0 "[ . 1 . 2]" 1
452 1 32 ILE MD 1 55 ASN HD21 . . 5.500 3.867 3.356 4.539 . 0 0 "[ . 1 . 2]" 1
453 1 32 ILE MD 1 55 ASN HD22 . . 5.500 4.946 4.651 5.125 . 0 0 "[ . 1 . 2]" 1
454 1 32 ILE MD 1 56 ALA H . . 4.790 3.850 3.766 3.963 . 0 0 "[ . 1 . 2]" 1
455 1 32 ILE MD 1 56 ALA HA . . 5.270 4.257 4.111 4.566 . 0 0 "[ . 1 . 2]" 1
456 1 32 ILE MD 1 56 ALA MB . . 5.430 4.444 4.373 4.630 . 0 0 "[ . 1 . 2]" 1
457 1 32 ILE MD 1 57 GLY H . . 3.760 2.775 2.182 3.080 . 0 0 "[ . 1 . 2]" 1
458 1 32 ILE MD 1 57 GLY HA2 . . 3.610 2.565 2.207 3.029 . 0 0 "[ . 1 . 2]" 1
459 1 32 ILE MD 1 58 VAL H . . 4.150 3.288 3.139 3.731 . 0 0 "[ . 1 . 2]" 1
460 1 32 ILE MD 1 58 VAL HA . . 3.450 3.421 3.265 3.469 0.019 2 0 "[ . 1 . 2]" 1
461 1 32 ILE MD 1 58 VAL MG2 . . 4.210 3.226 3.093 3.396 . 0 0 "[ . 1 . 2]" 1
462 1 32 ILE MD 1 60 GLU H . . 5.500 5.107 4.841 5.306 . 0 0 "[ . 1 . 2]" 1
463 1 32 ILE MD 1 60 GLU HB2 . . 4.840 4.631 4.252 4.785 . 0 0 "[ . 1 . 2]" 1
464 1 32 ILE MD 1 61 ALA MB . . 3.530 3.198 3.047 3.307 . 0 0 "[ . 1 . 2]" 1
465 1 32 ILE HG12 1 32 ILE MG . . 2.900 2.539 2.503 2.597 . 0 0 "[ . 1 . 2]" 1
466 1 32 ILE HG12 1 55 ASN HB2 . . 5.500 4.849 4.379 5.620 0.120 17 0 "[ . 1 . 2]" 1
467 1 32 ILE HG12 1 55 ASN HB3 . . 5.020 4.546 4.049 4.892 . 0 0 "[ . 1 . 2]" 1
468 1 32 ILE HG12 1 57 GLY HA2 . . 4.920 3.900 3.619 4.021 . 0 0 "[ . 1 . 2]" 1
469 1 32 ILE HG12 1 58 VAL H . . 4.630 3.614 3.348 3.899 . 0 0 "[ . 1 . 2]" 1
470 1 32 ILE HG12 1 58 VAL HA . . 4.150 3.786 3.499 4.160 0.010 17 0 "[ . 1 . 2]" 1
471 1 32 ILE HG12 1 58 VAL HB . . 5.430 5.011 4.705 5.374 . 0 0 "[ . 1 . 2]" 1
472 1 32 ILE HG12 1 58 VAL MG2 . . 3.550 2.336 2.063 2.609 . 0 0 "[ . 1 . 2]" 1
473 1 32 ILE HG13 1 33 VAL H . . 4.870 4.167 4.112 4.230 . 0 0 "[ . 1 . 2]" 1
474 1 32 ILE HG13 1 57 GLY HA2 . . 5.270 5.106 4.815 5.278 0.008 20 0 "[ . 1 . 2]" 1
475 1 32 ILE HG13 1 58 VAL H . . 5.500 5.283 5.052 5.507 0.007 19 0 "[ . 1 . 2]" 1
476 1 32 ILE HG13 1 58 VAL HA . . 5.500 5.141 4.942 5.349 . 0 0 "[ . 1 . 2]" 1
477 1 32 ILE HG13 1 58 VAL MG2 . . 4.430 3.793 3.491 4.038 . 0 0 "[ . 1 . 2]" 1
478 1 32 ILE MG 1 33 VAL H . . 4.060 3.774 3.686 3.907 . 0 0 "[ . 1 . 2]" 1
479 1 32 ILE MG 1 33 VAL HA . . 4.310 3.886 3.800 4.005 . 0 0 "[ . 1 . 2]" 1
480 1 32 ILE MG 1 34 ALA H . . 5.500 5.398 5.277 5.517 0.017 10 0 "[ . 1 . 2]" 1
481 1 32 ILE MG 1 35 GLN H . . 5.500 4.628 4.527 4.708 . 0 0 "[ . 1 . 2]" 1
482 1 32 ILE MG 1 35 GLN HB2 . . 5.430 3.690 3.615 3.755 . 0 0 "[ . 1 . 2]" 1
483 1 32 ILE MG 1 35 GLN HB3 . . 5.430 4.773 4.536 4.893 . 0 0 "[ . 1 . 2]" 1
484 1 32 ILE MG 1 36 LEU H . . 4.960 4.082 3.998 4.171 . 0 0 "[ . 1 . 2]" 1
485 1 32 ILE MG 1 36 LEU HB2 . . 5.430 4.435 4.286 4.609 . 0 0 "[ . 1 . 2]" 1
486 1 32 ILE MG 1 36 LEU HB3 . . 5.270 5.198 5.106 5.267 . 0 0 "[ . 1 . 2]" 1
487 1 32 ILE MG 1 36 LEU MD1 . . 3.590 1.995 1.842 2.118 . 0 0 "[ . 1 . 2]" 1
488 1 32 ILE MG 1 36 LEU HG . . 4.340 2.992 2.931 3.043 . 0 0 "[ . 1 . 2]" 1
489 1 32 ILE MG 1 50 ALA H . . 4.630 3.872 3.496 4.065 . 0 0 "[ . 1 . 2]" 1
490 1 32 ILE MG 1 50 ALA HA . . 4.000 3.223 3.067 3.333 . 0 0 "[ . 1 . 2]" 1
491 1 32 ILE MG 1 50 ALA MB . . 3.110 2.040 1.930 2.203 . 0 0 "[ . 1 . 2]" 1
492 1 32 ILE MG 1 57 GLY H . . 4.060 3.739 3.389 3.909 . 0 0 "[ . 1 . 2]" 1
493 1 32 ILE MG 1 58 VAL H . . 4.840 3.258 3.061 3.569 . 0 0 "[ . 1 . 2]" 1
494 1 32 ILE MG 1 58 VAL HA . . 2.930 1.785 1.761 1.868 . 0 0 "[ . 1 . 2]" 1
495 1 32 ILE MG 1 58 VAL HB . . 4.630 4.037 3.965 4.161 . 0 0 "[ . 1 . 2]" 1
496 1 32 ILE MG 1 58 VAL MG2 . . 3.500 2.299 2.162 2.559 . 0 0 "[ . 1 . 2]" 1
497 1 32 ILE MG 1 59 GLU H . . 5.500 4.638 4.525 4.788 . 0 0 "[ . 1 . 2]" 1
498 1 32 ILE MG 1 61 ALA H . . 5.130 3.337 3.118 3.419 . 0 0 "[ . 1 . 2]" 1
499 1 32 ILE MG 1 61 ALA HA . . 5.270 4.136 3.997 4.216 . 0 0 "[ . 1 . 2]" 1
500 1 32 ILE MG 1 61 ALA MB . . 3.300 1.892 1.805 1.966 . 0 0 "[ . 1 . 2]" 1
501 1 32 ILE MG 1 62 MET H . . 5.500 4.119 3.963 4.244 . 0 0 "[ . 1 . 2]" 1
502 1 33 VAL H 1 33 VAL HB . . 3.240 2.254 2.189 2.349 . 0 0 "[ . 1 . 2]" 1
503 1 33 VAL H 1 33 VAL MG1 . . 4.030 3.663 3.628 3.700 . 0 0 "[ . 1 . 2]" 1
504 1 33 VAL H 1 33 VAL MG2 . . 3.010 2.409 2.145 2.573 . 0 0 "[ . 1 . 2]" 1
505 1 33 VAL H 1 34 ALA H . . 3.620 2.550 2.416 2.615 . 0 0 "[ . 1 . 2]" 1
506 1 33 VAL H 1 34 ALA HA . . 5.260 5.113 5.012 5.158 . 0 0 "[ . 1 . 2]" 1
507 1 33 VAL H 1 34 ALA MB . . 4.100 4.103 4.015 4.134 0.034 8 0 "[ . 1 . 2]" 1
508 1 33 VAL H 1 47 GLN HA . . 5.500 5.389 5.109 5.520 0.020 11 0 "[ . 1 . 2]" 1
509 1 33 VAL H 1 50 ALA MB . . 4.490 4.134 4.051 4.249 . 0 0 "[ . 1 . 2]" 1
510 1 33 VAL H 1 58 VAL MG2 . . 5.500 5.037 4.897 5.119 . 0 0 "[ . 1 . 2]" 1
511 1 33 VAL HA 1 33 VAL MG1 . . 3.050 2.480 2.369 2.581 . 0 0 "[ . 1 . 2]" 1
512 1 33 VAL HA 1 33 VAL MG2 . . 2.940 2.289 2.159 2.412 . 0 0 "[ . 1 . 2]" 1
513 1 33 VAL HA 1 34 ALA HA . . 5.500 4.822 4.781 4.862 . 0 0 "[ . 1 . 2]" 1
514 1 33 VAL HA 1 34 ALA MB . . 5.270 5.017 5.005 5.025 . 0 0 "[ . 1 . 2]" 1
515 1 33 VAL HA 1 35 GLN H . . 4.920 3.990 3.792 4.125 . 0 0 "[ . 1 . 2]" 1
516 1 33 VAL HA 1 36 LEU H . . 4.120 3.115 2.947 3.219 . 0 0 "[ . 1 . 2]" 1
517 1 33 VAL HA 1 36 LEU HA . . 5.430 5.249 5.109 5.313 . 0 0 "[ . 1 . 2]" 1
518 1 33 VAL HA 1 36 LEU HB2 . . 3.360 2.582 2.530 2.609 . 0 0 "[ . 1 . 2]" 1
519 1 33 VAL HA 1 36 LEU HB3 . . 4.270 4.282 4.231 4.311 0.041 12 0 "[ . 1 . 2]" 1
520 1 33 VAL HA 1 36 LEU MD1 . . 2.940 2.496 2.228 2.644 . 0 0 "[ . 1 . 2]" 1
521 1 33 VAL HA 1 36 LEU MD2 . . 5.020 4.846 4.655 4.948 . 0 0 "[ . 1 . 2]" 1
522 1 33 VAL HA 1 36 LEU HG . . 4.840 3.899 3.538 4.119 . 0 0 "[ . 1 . 2]" 1
523 1 33 VAL HA 1 37 VAL H . . 4.600 3.423 3.351 3.498 . 0 0 "[ . 1 . 2]" 1
524 1 33 VAL HA 1 37 VAL HB . . 5.270 4.996 4.885 5.101 . 0 0 "[ . 1 . 2]" 1
525 1 33 VAL HA 1 37 VAL MG2 . . 4.690 3.334 3.237 3.442 . 0 0 "[ . 1 . 2]" 1
526 1 33 VAL HA 1 46 CYS HA . . 5.130 4.276 4.182 4.409 . 0 0 "[ . 1 . 2]" 1
527 1 33 VAL HA 1 46 CYS HB3 . . 3.030 2.083 1.990 2.201 . 0 0 "[ . 1 . 2]" 1
528 1 33 VAL HA 1 47 GLN HA . . 5.500 4.650 4.412 4.812 . 0 0 "[ . 1 . 2]" 1
529 1 33 VAL HA 1 50 ALA H . . 5.500 5.493 5.434 5.534 0.034 14 0 "[ . 1 . 2]" 1
530 1 33 VAL HA 1 50 ALA MB . . 4.760 4.165 3.940 4.457 . 0 0 "[ . 1 . 2]" 1
531 1 33 VAL HB 1 34 ALA H . . 3.360 2.606 2.432 2.816 . 0 0 "[ . 1 . 2]" 1
532 1 33 VAL HB 1 34 ALA HA . . 5.130 4.432 4.273 4.540 . 0 0 "[ . 1 . 2]" 1
533 1 33 VAL HB 1 34 ALA MB . . 4.240 4.072 3.986 4.170 . 0 0 "[ . 1 . 2]" 1
534 1 33 VAL HB 1 47 GLN HA . . 5.130 4.652 4.436 4.920 . 0 0 "[ . 1 . 2]" 1
535 1 33 VAL MG1 1 34 ALA H . . 3.960 3.195 2.972 3.431 . 0 0 "[ . 1 . 2]" 1
536 1 33 VAL MG1 1 34 ALA HA . . 3.920 3.297 3.085 3.547 . 0 0 "[ . 1 . 2]" 1
537 1 33 VAL MG1 1 34 ALA MB . . 4.310 3.892 3.708 4.099 . 0 0 "[ . 1 . 2]" 1
538 1 33 VAL MG1 1 36 LEU H . . 5.130 4.466 4.190 4.626 . 0 0 "[ . 1 . 2]" 1
539 1 33 VAL MG1 1 37 VAL H . . 4.430 3.338 3.005 3.469 . 0 0 "[ . 1 . 2]" 1
540 1 33 VAL MG1 1 37 VAL HA . . 4.840 4.535 4.326 4.676 . 0 0 "[ . 1 . 2]" 1
541 1 33 VAL MG1 1 37 VAL HB . . 4.690 3.444 3.347 3.556 . 0 0 "[ . 1 . 2]" 1
542 1 33 VAL MG1 1 37 VAL MG2 . . 3.100 1.733 1.692 1.800 . 0 0 "[ . 1 . 2]" 1
543 1 33 VAL MG1 1 43 GLN HA . . 3.840 2.684 2.583 2.811 . 0 0 "[ . 1 . 2]" 1
544 1 33 VAL MG1 1 43 GLN HB2 . . 4.920 3.825 3.735 3.949 . 0 0 "[ . 1 . 2]" 1
545 1 33 VAL MG1 1 43 GLN HB3 . . 5.020 4.454 4.363 4.599 . 0 0 "[ . 1 . 2]" 1
546 1 33 VAL MG1 1 43 GLN HE21 . . 4.570 2.844 2.533 3.075 . 0 0 "[ . 1 . 2]" 1
547 1 33 VAL MG1 1 43 GLN HE22 . . 4.870 4.282 3.997 4.516 . 0 0 "[ . 1 . 2]" 1
548 1 33 VAL MG1 1 43 GLN HG2 . . 4.030 2.911 2.776 3.005 . 0 0 "[ . 1 . 2]" 1
549 1 33 VAL MG1 1 43 GLN HG3 . . 3.940 2.179 2.096 2.367 . 0 0 "[ . 1 . 2]" 1
550 1 33 VAL MG1 1 46 CYS H . . 4.920 4.337 4.151 4.495 . 0 0 "[ . 1 . 2]" 1
551 1 33 VAL MG1 1 46 CYS HA . . 5.270 4.452 4.239 4.578 . 0 0 "[ . 1 . 2]" 1
552 1 33 VAL MG1 1 46 CYS HB2 . . 3.180 2.075 1.974 2.191 . 0 0 "[ . 1 . 2]" 1
553 1 33 VAL MG1 1 46 CYS HB3 . . 3.710 2.483 2.262 2.611 . 0 0 "[ . 1 . 2]" 1
554 1 33 VAL MG1 1 47 GLN H . . 4.380 3.559 3.039 3.818 . 0 0 "[ . 1 . 2]" 1
555 1 33 VAL MG1 1 47 GLN HA . . 4.470 3.618 3.300 3.777 . 0 0 "[ . 1 . 2]" 1
556 1 33 VAL MG1 1 47 GLN HB2 . . 4.760 4.586 4.260 4.763 0.003 3 0 "[ . 1 . 2]" 1
557 1 33 VAL MG1 1 47 GLN HE21 . . 4.520 3.865 3.192 4.544 0.024 13 0 "[ . 1 . 2]" 1
558 1 33 VAL MG1 1 47 GLN HE22 . . 5.430 4.801 4.464 5.265 . 0 0 "[ . 1 . 2]" 1
559 1 33 VAL MG1 1 47 GLN HG2 . . 3.230 2.580 2.300 2.851 . 0 0 "[ . 1 . 2]" 1
560 1 33 VAL MG1 1 47 GLN HG3 . . 3.220 2.522 2.122 2.766 . 0 0 "[ . 1 . 2]" 1
561 1 33 VAL MG2 1 34 ALA H . . 4.340 3.970 3.828 4.084 . 0 0 "[ . 1 . 2]" 1
562 1 33 VAL MG2 1 34 ALA HA . . 5.430 5.438 5.419 5.466 0.036 14 0 "[ . 1 . 2]" 1
563 1 33 VAL MG2 1 37 VAL H . . 5.500 4.935 4.835 5.069 . 0 0 "[ . 1 . 2]" 1
564 1 33 VAL MG2 1 43 GLN HA . . 5.430 4.431 4.251 4.629 . 0 0 "[ . 1 . 2]" 1
565 1 33 VAL MG2 1 43 GLN HE21 . . 5.500 4.837 4.652 5.065 . 0 0 "[ . 1 . 2]" 1
566 1 33 VAL MG2 1 46 CYS H . . 5.020 4.744 4.540 5.030 0.010 11 0 "[ . 1 . 2]" 1
567 1 33 VAL MG2 1 46 CYS HA . . 4.690 3.975 3.768 4.308 . 0 0 "[ . 1 . 2]" 1
568 1 33 VAL MG2 1 46 CYS HB2 . . 3.440 3.074 2.873 3.283 . 0 0 "[ . 1 . 2]" 1
569 1 33 VAL MG2 1 47 GLN H . . 4.400 3.151 2.991 3.337 . 0 0 "[ . 1 . 2]" 1
570 1 33 VAL MG2 1 47 GLN HA . . 3.120 1.933 1.805 2.013 . 0 0 "[ . 1 . 2]" 1
571 1 33 VAL MG2 1 47 GLN HB2 . . 4.630 4.010 3.872 4.190 . 0 0 "[ . 1 . 2]" 1
572 1 33 VAL MG2 1 47 GLN HB3 . . 4.520 3.638 3.475 3.732 . 0 0 "[ . 1 . 2]" 1
573 1 33 VAL MG2 1 47 GLN HE21 . . 4.920 4.249 3.553 4.939 0.019 12 0 "[ . 1 . 2]" 1
574 1 33 VAL MG2 1 47 GLN HG2 . . 3.530 2.112 1.952 2.464 . 0 0 "[ . 1 . 2]" 1
575 1 33 VAL MG2 1 47 GLN HG3 . . 3.480 2.786 2.445 3.064 . 0 0 "[ . 1 . 2]" 1
576 1 33 VAL MG2 1 50 ALA H . . 4.630 3.960 3.825 4.081 . 0 0 "[ . 1 . 2]" 1
577 1 33 VAL MG2 1 50 ALA MB . . 3.210 2.653 2.530 2.850 . 0 0 "[ . 1 . 2]" 1
578 1 33 VAL MG2 1 51 ILE H . . 5.430 4.519 4.398 4.765 . 0 0 "[ . 1 . 2]" 1
579 1 34 ALA H 1 34 ALA MB . . 2.890 2.134 2.094 2.160 . 0 0 "[ . 1 . 2]" 1
580 1 34 ALA H 1 35 GLN H . . 3.410 2.701 2.581 2.795 . 0 0 "[ . 1 . 2]" 1
581 1 34 ALA H 1 35 GLN HA . . 5.430 5.214 5.118 5.289 . 0 0 "[ . 1 . 2]" 1
582 1 34 ALA H 1 36 LEU H . . 4.920 4.303 4.163 4.389 . 0 0 "[ . 1 . 2]" 1
583 1 34 ALA H 1 37 VAL H . . 5.500 4.694 4.616 4.773 . 0 0 "[ . 1 . 2]" 1
584 1 34 ALA H 1 37 VAL HB . . 4.830 4.813 4.746 4.844 0.014 7 0 "[ . 1 . 2]" 1
585 1 34 ALA H 1 37 VAL MG2 . . 5.270 4.173 3.939 4.358 . 0 0 "[ . 1 . 2]" 1
586 1 34 ALA HA 1 35 GLN H . . 3.560 3.560 3.536 3.580 0.020 2 0 "[ . 1 . 2]" 1
587 1 34 ALA HA 1 37 VAL H . . 4.020 3.761 3.624 3.857 . 0 0 "[ . 1 . 2]" 1
588 1 34 ALA HA 1 37 VAL HB . . 3.170 2.635 2.562 2.711 . 0 0 "[ . 1 . 2]" 1
589 1 34 ALA HA 1 37 VAL MG1 . . 4.120 3.890 3.826 3.956 . 0 0 "[ . 1 . 2]" 1
590 1 34 ALA HA 1 37 VAL MG2 . . 3.360 3.230 3.034 3.348 . 0 0 "[ . 1 . 2]" 1
591 1 34 ALA MB 1 35 GLN H . . 3.380 2.812 2.738 2.897 . 0 0 "[ . 1 . 2]" 1
592 1 34 ALA MB 1 35 GLN HA . . 4.470 3.890 3.865 3.920 . 0 0 "[ . 1 . 2]" 1
593 1 34 ALA MB 1 35 GLN HB2 . . 5.430 4.540 4.460 4.617 . 0 0 "[ . 1 . 2]" 1
594 1 34 ALA MB 1 35 GLN HE21 . . 5.430 4.783 4.061 5.439 0.009 16 0 "[ . 1 . 2]" 1
595 1 34 ALA MB 1 35 GLN HG2 . . 4.920 4.354 3.772 4.824 . 0 0 "[ . 1 . 2]" 1
596 1 34 ALA MB 1 35 GLN HG3 . . 4.840 3.673 3.420 3.953 . 0 0 "[ . 1 . 2]" 1
597 1 34 ALA MB 1 36 LEU H . . 4.760 4.742 4.659 4.776 0.016 15 0 "[ . 1 . 2]" 1
598 1 34 ALA MB 1 37 VAL H . . 5.130 4.924 4.802 5.021 . 0 0 "[ . 1 . 2]" 1
599 1 34 ALA MB 1 37 VAL HB . . 4.430 4.262 4.192 4.330 . 0 0 "[ . 1 . 2]" 1
600 1 34 ALA MB 1 38 SER H . . 5.130 5.045 4.936 5.139 0.009 10 0 "[ . 1 . 2]" 1
601 1 35 GLN H 1 35 GLN HB2 . . 3.330 2.251 2.174 2.315 . 0 0 "[ . 1 . 2]" 1
602 1 35 GLN H 1 35 GLN HB3 . . 3.590 3.508 3.461 3.536 . 0 0 "[ . 1 . 2]" 1
603 1 35 GLN H 1 35 GLN HE21 . . 5.500 4.169 3.382 5.000 . 0 0 "[ . 1 . 2]" 1
604 1 35 GLN H 1 35 GLN HG2 . . 3.850 3.597 3.078 3.965 0.115 12 0 "[ . 1 . 2]" 1
605 1 35 GLN H 1 35 GLN HG3 . . 4.100 2.782 2.585 2.963 . 0 0 "[ . 1 . 2]" 1
606 1 35 GLN H 1 36 LEU H . . 3.430 2.534 2.450 2.630 . 0 0 "[ . 1 . 2]" 1
607 1 35 GLN H 1 36 LEU HA . . 5.500 5.115 5.049 5.184 . 0 0 "[ . 1 . 2]" 1
608 1 35 GLN H 1 36 LEU HB2 . . 4.760 4.647 4.550 4.697 . 0 0 "[ . 1 . 2]" 1
609 1 35 GLN H 1 36 LEU MD1 . . 5.500 4.775 4.644 4.928 . 0 0 "[ . 1 . 2]" 1
610 1 35 GLN H 1 37 VAL H . . 5.130 4.109 3.895 4.241 . 0 0 "[ . 1 . 2]" 1
611 1 35 GLN H 1 58 VAL MG1 . . 5.420 4.757 4.463 4.891 . 0 0 "[ . 1 . 2]" 1
612 1 35 GLN H 1 58 VAL MG2 . . 4.690 4.118 3.949 4.329 . 0 0 "[ . 1 . 2]" 1
613 1 35 GLN HA 1 35 GLN HE21 . . 5.500 4.866 4.649 5.129 . 0 0 "[ . 1 . 2]" 1
614 1 35 GLN HA 1 35 GLN HG2 . . 4.180 2.324 2.160 2.521 . 0 0 "[ . 1 . 2]" 1
615 1 35 GLN HA 1 35 GLN HG3 . . 3.620 2.983 2.624 3.407 . 0 0 "[ . 1 . 2]" 1
616 1 35 GLN HA 1 36 LEU HA . . 5.430 4.758 4.728 4.787 . 0 0 "[ . 1 . 2]" 1
617 1 35 GLN HA 1 37 VAL H . . 5.430 4.855 4.623 5.028 . 0 0 "[ . 1 . 2]" 1
618 1 35 GLN HA 1 39 MET ME . . 4.340 4.319 4.134 4.351 0.011 1 0 "[ . 1 . 2]" 1
619 1 35 GLN HA 1 58 VAL MG2 . . 5.130 4.763 4.527 4.892 . 0 0 "[ . 1 . 2]" 1
620 1 35 GLN HB2 1 36 LEU H . . 3.850 2.699 2.624 2.816 . 0 0 "[ . 1 . 2]" 1
621 1 35 GLN HB2 1 36 LEU HA . . 5.430 4.542 4.461 4.691 . 0 0 "[ . 1 . 2]" 1
622 1 35 GLN HB2 1 36 LEU MD1 . . 5.270 4.372 4.253 4.498 . 0 0 "[ . 1 . 2]" 1
623 1 35 GLN HB2 1 58 VAL MG1 . . 3.960 2.865 2.646 2.988 . 0 0 "[ . 1 . 2]" 1
624 1 35 GLN HB2 1 58 VAL MG2 . . 3.640 2.314 2.075 2.535 . 0 0 "[ . 1 . 2]" 1
625 1 35 GLN HB3 1 36 LEU H . . 3.990 3.448 3.302 3.593 . 0 0 "[ . 1 . 2]" 1
626 1 35 GLN HB3 1 36 LEU HA . . 5.130 4.188 4.084 4.290 . 0 0 "[ . 1 . 2]" 1
627 1 35 GLN HB3 1 58 VAL MG1 . . 3.940 2.383 2.260 2.522 . 0 0 "[ . 1 . 2]" 1
628 1 35 GLN HB3 1 58 VAL MG2 . . 3.660 2.813 2.491 3.009 . 0 0 "[ . 1 . 2]" 1
629 1 35 GLN HE21 1 58 VAL MG1 . . 5.430 4.531 4.166 4.994 . 0 0 "[ . 1 . 2]" 1
630 1 35 GLN HE21 1 58 VAL MG2 . . 5.020 2.774 2.450 3.293 . 0 0 "[ . 1 . 2]" 1
631 1 35 GLN HE22 1 58 VAL HB . . 5.500 4.588 4.159 5.150 . 0 0 "[ . 1 . 2]" 1
632 1 35 GLN HE22 1 58 VAL MG1 . . 5.430 4.318 3.965 4.718 . 0 0 "[ . 1 . 2]" 1
633 1 35 GLN HE22 1 58 VAL MG2 . . 4.920 2.430 1.874 3.109 . 0 0 "[ . 1 . 2]" 1
634 1 35 GLN HG2 1 36 LEU H . . 5.270 4.987 4.801 5.101 . 0 0 "[ . 1 . 2]" 1
635 1 35 GLN HG2 1 58 VAL MG1 . . 4.690 4.430 4.213 4.696 0.006 5 0 "[ . 1 . 2]" 1
636 1 35 GLN HG2 1 58 VAL MG2 . . 4.240 3.899 3.760 4.019 . 0 0 "[ . 1 . 2]" 1
637 1 35 GLN HG3 1 36 LEU H . . 5.070 4.643 4.571 4.767 . 0 0 "[ . 1 . 2]" 1
638 1 35 GLN HG3 1 58 VAL MG1 . . 4.270 4.465 4.137 4.699 0.429 2 0 "[ . 1 . 2]" 1
639 1 35 GLN HG3 1 58 VAL MG2 . . 3.910 3.372 2.826 3.795 . 0 0 "[ . 1 . 2]" 1
640 1 36 LEU H 1 36 LEU HB2 . . 3.570 2.385 2.339 2.471 . 0 0 "[ . 1 . 2]" 1
641 1 36 LEU H 1 36 LEU HB3 . . 3.520 3.534 3.528 3.541 0.021 13 0 "[ . 1 . 2]" 1
642 1 36 LEU H 1 36 LEU MD1 . . 3.780 3.259 3.142 3.343 . 0 0 "[ . 1 . 2]" 1
643 1 36 LEU H 1 36 LEU MD2 . . 4.180 3.733 3.564 3.824 . 0 0 "[ . 1 . 2]" 1
644 1 36 LEU H 1 36 LEU HG . . 3.210 2.358 2.163 2.493 . 0 0 "[ . 1 . 2]" 1
645 1 36 LEU H 1 37 VAL H . . 3.180 2.687 2.597 2.781 . 0 0 "[ . 1 . 2]" 1
646 1 36 LEU H 1 37 VAL HA . . 5.500 5.216 5.141 5.283 . 0 0 "[ . 1 . 2]" 1
647 1 36 LEU H 1 39 MET H . . 5.500 4.490 4.357 4.673 . 0 0 "[ . 1 . 2]" 1
648 1 36 LEU H 1 39 MET ME . . 5.130 3.513 3.412 3.749 . 0 0 "[ . 1 . 2]" 1
649 1 36 LEU H 1 46 CYS HB3 . . 4.790 4.003 3.869 4.148 . 0 0 "[ . 1 . 2]" 1
650 1 36 LEU H 1 58 VAL MG1 . . 4.960 3.949 3.583 4.118 . 0 0 "[ . 1 . 2]" 1
651 1 36 LEU H 1 58 VAL MG2 . . 4.760 4.278 4.100 4.498 . 0 0 "[ . 1 . 2]" 1
652 1 36 LEU HA 1 36 LEU MD1 . . 4.000 3.900 3.887 3.930 . 0 0 "[ . 1 . 2]" 1
653 1 36 LEU HA 1 36 LEU MD2 . . 3.090 2.232 2.128 2.356 . 0 0 "[ . 1 . 2]" 1
654 1 36 LEU HA 1 36 LEU HG . . 3.710 2.792 2.712 2.904 . 0 0 "[ . 1 . 2]" 1
655 1 36 LEU HA 1 39 MET H . . 3.450 2.872 2.816 2.926 . 0 0 "[ . 1 . 2]" 1
656 1 36 LEU HA 1 39 MET HB2 . . 3.850 2.325 2.054 2.805 . 0 0 "[ . 1 . 2]" 1
657 1 36 LEU HA 1 39 MET HB3 . . 4.840 3.917 3.671 4.254 . 0 0 "[ . 1 . 2]" 1
658 1 36 LEU HA 1 39 MET ME . . 3.820 2.160 1.960 2.326 . 0 0 "[ . 1 . 2]" 1
659 1 36 LEU HA 1 39 MET HG2 . . 4.760 4.293 4.057 4.766 0.006 10 0 "[ . 1 . 2]" 1
660 1 36 LEU HA 1 39 MET HG3 . . 3.960 2.769 2.422 3.490 . 0 0 "[ . 1 . 2]" 1
661 1 36 LEU HA 1 41 PHE H . . 4.870 4.639 4.322 4.832 . 0 0 "[ . 1 . 2]" 1
662 1 36 LEU HA 1 41 PHE HB2 . . 4.690 3.751 3.534 3.957 . 0 0 "[ . 1 . 2]" 1
663 1 36 LEU HA 1 41 PHE HB3 . . 5.500 5.204 5.006 5.400 . 0 0 "[ . 1 . 2]" 1
664 1 36 LEU HA 1 41 PHE QD . . 4.430 3.169 2.718 4.073 . 0 0 "[ . 1 . 2]" 1
665 1 36 LEU HA 1 41 PHE QE . . 5.430 4.447 4.130 4.842 . 0 0 "[ . 1 . 2]" 1
666 1 36 LEU HA 1 65 LEU MD1 . . 5.430 4.901 4.668 5.072 . 0 0 "[ . 1 . 2]" 1
667 1 36 LEU HB2 1 36 LEU MD1 . . 2.900 2.028 1.984 2.066 . 0 0 "[ . 1 . 2]" 1
668 1 36 LEU HB2 1 36 LEU MD2 . . 3.470 3.182 3.161 3.198 . 0 0 "[ . 1 . 2]" 1
669 1 36 LEU HB2 1 37 VAL H . . 3.840 2.494 2.396 2.663 . 0 0 "[ . 1 . 2]" 1
670 1 36 LEU HB2 1 37 VAL HA . . 5.430 4.321 4.246 4.365 . 0 0 "[ . 1 . 2]" 1
671 1 36 LEU HB2 1 37 VAL MG2 . . 4.920 3.303 3.146 3.389 . 0 0 "[ . 1 . 2]" 1
672 1 36 LEU HB2 1 38 SER H . . 5.500 4.625 4.598 4.678 . 0 0 "[ . 1 . 2]" 1
673 1 36 LEU HB2 1 41 PHE HB2 . . 5.270 3.794 3.602 3.966 . 0 0 "[ . 1 . 2]" 1
674 1 36 LEU HB2 1 41 PHE QD . . 4.840 4.699 4.124 4.851 0.011 19 0 "[ . 1 . 2]" 1
675 1 36 LEU HB2 1 46 CYS HA . . 4.920 3.520 3.377 3.691 . 0 0 "[ . 1 . 2]" 1
676 1 36 LEU HB2 1 46 CYS HB2 . . 4.340 3.539 3.449 3.606 . 0 0 "[ . 1 . 2]" 1
677 1 36 LEU HB2 1 46 CYS HB3 . . 3.850 2.065 1.981 2.187 . 0 0 "[ . 1 . 2]" 1
678 1 36 LEU HB2 1 65 LEU MD1 . . 5.130 3.956 3.660 4.124 . 0 0 "[ . 1 . 2]" 1
679 1 36 LEU HB3 1 36 LEU MD1 . . 2.980 2.650 2.596 2.713 . 0 0 "[ . 1 . 2]" 1
680 1 36 LEU HB3 1 36 LEU MD2 . . 3.290 2.293 2.246 2.334 . 0 0 "[ . 1 . 2]" 1
681 1 36 LEU HB3 1 37 VAL H . . 4.290 3.498 3.371 3.660 . 0 0 "[ . 1 . 2]" 1
682 1 36 LEU HB3 1 37 VAL HA . . 5.430 4.367 4.296 4.470 . 0 0 "[ . 1 . 2]" 1
683 1 36 LEU HB3 1 37 VAL MG2 . . 5.270 4.087 4.049 4.132 . 0 0 "[ . 1 . 2]" 1
684 1 36 LEU HB3 1 39 MET H . . 5.500 4.834 4.761 4.913 . 0 0 "[ . 1 . 2]" 1
685 1 36 LEU HB3 1 39 MET HB2 . . 4.470 3.968 3.880 4.080 . 0 0 "[ . 1 . 2]" 1
686 1 36 LEU HB3 1 41 PHE H . . 5.500 4.510 4.267 4.639 . 0 0 "[ . 1 . 2]" 1
687 1 36 LEU HB3 1 41 PHE HB2 . . 4.070 2.581 2.415 2.791 . 0 0 "[ . 1 . 2]" 1
688 1 36 LEU HB3 1 41 PHE HB3 . . 5.020 3.368 3.189 3.592 . 0 0 "[ . 1 . 2]" 1
689 1 36 LEU HB3 1 41 PHE QD . . 4.150 3.272 2.545 3.443 . 0 0 "[ . 1 . 2]" 1
690 1 36 LEU HB3 1 41 PHE QE . . 5.500 4.729 4.314 4.862 . 0 0 "[ . 1 . 2]" 1
691 1 36 LEU HB3 1 46 CYS H . . 5.420 4.945 4.831 5.130 . 0 0 "[ . 1 . 2]" 1
692 1 36 LEU HB3 1 46 CYS HA . . 4.920 3.523 3.400 3.758 . 0 0 "[ . 1 . 2]" 1
693 1 36 LEU HB3 1 46 CYS HB2 . . 4.690 4.387 4.310 4.479 . 0 0 "[ . 1 . 2]" 1
694 1 36 LEU HB3 1 46 CYS HB3 . . 4.240 3.225 3.102 3.385 . 0 0 "[ . 1 . 2]" 1
695 1 36 LEU HB3 1 65 LEU MD1 . . 4.310 3.157 2.859 3.312 . 0 0 "[ . 1 . 2]" 1
696 1 36 LEU HB3 1 65 LEU MD2 . . 4.840 4.422 4.198 4.740 . 0 0 "[ . 1 . 2]" 1
697 1 36 LEU MD1 1 37 VAL H . . 5.020 4.143 4.004 4.277 . 0 0 "[ . 1 . 2]" 1
698 1 36 LEU MD1 1 39 MET ME . . 5.130 3.747 3.664 3.836 . 0 0 "[ . 1 . 2]" 1
699 1 36 LEU MD1 1 41 PHE QD . . 5.270 4.796 4.347 5.014 . 0 0 "[ . 1 . 2]" 1
700 1 36 LEU MD1 1 46 CYS H . . 5.190 4.567 4.344 4.744 . 0 0 "[ . 1 . 2]" 1
701 1 36 LEU MD1 1 46 CYS HA . . 3.660 2.466 2.219 2.648 . 0 0 "[ . 1 . 2]" 1
702 1 36 LEU MD1 1 46 CYS HB3 . . 3.740 2.147 1.981 2.339 . 0 0 "[ . 1 . 2]" 1
703 1 36 LEU MD1 1 49 ALA MB . . 3.710 2.732 2.481 2.899 . 0 0 "[ . 1 . 2]" 1
704 1 36 LEU MD1 1 50 ALA H . . 4.360 3.361 3.291 3.558 . 0 0 "[ . 1 . 2]" 1
705 1 36 LEU MD1 1 50 ALA HA . . 4.920 4.197 4.013 4.450 . 0 0 "[ . 1 . 2]" 1
706 1 36 LEU MD1 1 50 ALA MB . . 4.380 2.953 2.845 3.182 . 0 0 "[ . 1 . 2]" 1
707 1 36 LEU MD1 1 58 VAL HA . . 4.000 3.322 3.097 3.663 . 0 0 "[ . 1 . 2]" 1
708 1 36 LEU MD1 1 58 VAL MG2 . . 4.310 3.962 3.800 4.281 . 0 0 "[ . 1 . 2]" 1
709 1 36 LEU MD1 1 61 ALA H . . 5.020 4.235 4.009 4.379 . 0 0 "[ . 1 . 2]" 1
710 1 36 LEU MD1 1 61 ALA HA . . 5.020 3.968 3.841 4.083 . 0 0 "[ . 1 . 2]" 1
711 1 36 LEU MD1 1 61 ALA MB . . 3.050 1.777 1.692 1.866 . 0 0 "[ . 1 . 2]" 1
712 1 36 LEU MD1 1 62 MET H . . 4.470 3.280 3.120 3.443 . 0 0 "[ . 1 . 2]" 1
713 1 36 LEU MD1 1 62 MET HA . . 4.340 3.412 3.272 3.570 . 0 0 "[ . 1 . 2]" 1
714 1 36 LEU MD1 1 62 MET HG2 . . 5.020 5.057 5.042 5.080 0.060 16 0 "[ . 1 . 2]" 1
715 1 36 LEU MD1 1 62 MET HG3 . . 4.690 4.128 4.010 4.322 . 0 0 "[ . 1 . 2]" 1
716 1 36 LEU MD1 1 65 LEU MD1 . . 3.910 2.260 2.143 2.366 . 0 0 "[ . 1 . 2]" 1
717 1 36 LEU MD2 1 39 MET H . . 5.270 4.640 4.544 4.743 . 0 0 "[ . 1 . 2]" 1
718 1 36 LEU MD2 1 39 MET ME . . 3.470 1.790 1.708 1.883 . 0 0 "[ . 1 . 2]" 1
719 1 36 LEU MD2 1 39 MET HG2 . . 5.270 4.848 4.672 5.096 . 0 0 "[ . 1 . 2]" 1
720 1 36 LEU MD2 1 39 MET HG3 . . 5.270 3.845 3.661 4.408 . 0 0 "[ . 1 . 2]" 1
721 1 36 LEU MD2 1 41 PHE HB2 . . 4.430 3.909 3.767 4.084 . 0 0 "[ . 1 . 2]" 1
722 1 36 LEU MD2 1 41 PHE HB3 . . 5.500 4.404 4.242 4.598 . 0 0 "[ . 1 . 2]" 1
723 1 36 LEU MD2 1 41 PHE QD . . 4.180 3.192 2.515 3.542 . 0 0 "[ . 1 . 2]" 1
724 1 36 LEU MD2 1 41 PHE QE . . 4.310 3.357 2.675 3.710 . 0 0 "[ . 1 . 2]" 1
725 1 36 LEU MD2 1 41 PHE HZ . . 4.920 4.311 4.022 4.569 . 0 0 "[ . 1 . 2]" 1
726 1 36 LEU MD2 1 46 CYS HA . . 4.050 3.952 3.842 4.072 0.022 13 0 "[ . 1 . 2]" 1
727 1 36 LEU MD2 1 46 CYS HB3 . . 4.340 4.400 4.379 4.443 0.103 16 0 "[ . 1 . 2]" 1
728 1 36 LEU MD2 1 49 ALA MB . . 4.310 3.806 3.609 3.867 . 0 0 "[ . 1 . 2]" 1
729 1 36 LEU MD2 1 58 VAL HA . . 3.820 3.753 3.579 3.839 0.019 14 0 "[ . 1 . 2]" 1
730 1 36 LEU MD2 1 61 ALA H . . 5.270 4.711 4.555 4.797 . 0 0 "[ . 1 . 2]" 1
731 1 36 LEU MD2 1 61 ALA HA . . 5.020 4.988 4.834 5.038 0.018 20 0 "[ . 1 . 2]" 1
732 1 36 LEU MD2 1 61 ALA MB . . 3.430 2.782 2.615 2.980 . 0 0 "[ . 1 . 2]" 1
733 1 36 LEU MD2 1 62 MET H . . 4.100 2.662 2.555 2.777 . 0 0 "[ . 1 . 2]" 1
734 1 36 LEU MD2 1 62 MET HA . . 3.750 2.422 2.280 2.566 . 0 0 "[ . 1 . 2]" 1
735 1 36 LEU MD2 1 62 MET HB2 . . 4.430 2.144 2.002 2.295 . 0 0 "[ . 1 . 2]" 1
736 1 36 LEU MD2 1 62 MET HB3 . . 3.630 3.530 3.408 3.640 0.010 9 0 "[ . 1 . 2]" 1
737 1 36 LEU MD2 1 62 MET HG2 . . 4.120 3.192 3.107 3.299 . 0 0 "[ . 1 . 2]" 1
738 1 36 LEU MD2 1 62 MET HG3 . . 3.720 1.983 1.854 2.136 . 0 0 "[ . 1 . 2]" 1
739 1 36 LEU MD2 1 63 ASN H . . 5.500 4.669 4.564 4.784 . 0 0 "[ . 1 . 2]" 1
740 1 36 LEU MD2 1 65 LEU MD1 . . 3.430 2.187 2.070 2.426 . 0 0 "[ . 1 . 2]" 1
741 1 36 LEU HG 1 37 VAL H . . 5.500 4.442 4.323 4.489 . 0 0 "[ . 1 . 2]" 1
742 1 36 LEU HG 1 39 MET H . . 5.500 5.471 5.427 5.532 0.032 12 0 "[ . 1 . 2]" 1
743 1 36 LEU HG 1 46 CYS HB3 . . 4.430 4.284 4.073 4.448 0.018 12 0 "[ . 1 . 2]" 1
744 1 36 LEU HG 1 58 VAL HA . . 5.130 3.904 3.741 4.152 . 0 0 "[ . 1 . 2]" 1
745 1 36 LEU HG 1 58 VAL MG2 . . 4.240 3.766 3.580 3.986 . 0 0 "[ . 1 . 2]" 1
746 1 36 LEU HG 1 61 ALA MB . . 4.570 3.498 3.330 3.617 . 0 0 "[ . 1 . 2]" 1
747 1 36 LEU HG 1 62 MET HA . . 5.430 5.277 5.121 5.425 . 0 0 "[ . 1 . 2]" 1
748 1 37 VAL H 1 37 VAL HB . . 3.220 2.426 2.389 2.491 . 0 0 "[ . 1 . 2]" 1
749 1 37 VAL H 1 37 VAL MG1 . . 4.100 3.700 3.696 3.704 . 0 0 "[ . 1 . 2]" 1
750 1 37 VAL H 1 37 VAL MG2 . . 3.180 2.161 1.972 2.232 . 0 0 "[ . 1 . 2]" 1
751 1 37 VAL H 1 38 SER H . . 3.470 2.753 2.669 2.820 . 0 0 "[ . 1 . 2]" 1
752 1 37 VAL H 1 38 SER HA . . 5.500 5.245 5.158 5.306 . 0 0 "[ . 1 . 2]" 1
753 1 37 VAL H 1 38 SER HB2 . . 5.500 4.575 4.472 4.663 . 0 0 "[ . 1 . 2]" 1
754 1 37 VAL H 1 39 MET H . . 4.960 4.279 4.206 4.344 . 0 0 "[ . 1 . 2]" 1
755 1 37 VAL H 1 41 PHE H . . 5.500 4.802 4.664 5.277 . 0 0 "[ . 1 . 2]" 1
756 1 37 VAL H 1 43 GLN HA . . 5.500 4.418 4.310 4.576 . 0 0 "[ . 1 . 2]" 1
757 1 37 VAL H 1 46 CYS HB3 . . 4.920 3.379 3.169 3.506 . 0 0 "[ . 1 . 2]" 1
758 1 37 VAL HA 1 37 VAL MG1 . . 3.320 2.375 2.336 2.405 . 0 0 "[ . 1 . 2]" 1
759 1 37 VAL HA 1 37 VAL MG2 . . 2.980 2.301 2.250 2.396 . 0 0 "[ . 1 . 2]" 1
760 1 37 VAL HA 1 39 MET H . . 4.570 4.548 4.432 4.580 0.010 9 0 "[ . 1 . 2]" 1
761 1 37 VAL HA 1 40 GLY H . . 4.240 3.742 3.549 3.842 . 0 0 "[ . 1 . 2]" 1
762 1 37 VAL HA 1 40 GLY HA2 . . 5.130 4.991 4.926 5.108 . 0 0 "[ . 1 . 2]" 1
763 1 37 VAL HA 1 41 PHE H . . 3.720 2.906 2.690 3.722 0.002 12 0 "[ . 1 . 2]" 1
764 1 37 VAL HA 1 41 PHE HB2 . . 4.380 3.145 2.956 3.315 . 0 0 "[ . 1 . 2]" 1
765 1 37 VAL HA 1 41 PHE HB3 . . 5.270 4.233 4.129 4.322 . 0 0 "[ . 1 . 2]" 1
766 1 37 VAL HA 1 41 PHE QD . . 5.430 4.741 4.604 4.923 . 0 0 "[ . 1 . 2]" 1
767 1 37 VAL HA 1 43 GLN H . . 5.420 4.106 3.987 4.230 . 0 0 "[ . 1 . 2]" 1
768 1 37 VAL HA 1 43 GLN HA . . 4.920 3.978 3.843 4.112 . 0 0 "[ . 1 . 2]" 1
769 1 37 VAL HA 1 46 CYS HG . . 4.920 3.017 2.659 3.831 . 0 0 "[ . 1 . 2]" 1
770 1 37 VAL HB 1 38 SER H . . 3.560 3.144 3.056 3.253 . 0 0 "[ . 1 . 2]" 1
771 1 37 VAL HB 1 38 SER HA . . 5.020 4.497 4.425 4.548 . 0 0 "[ . 1 . 2]" 1
772 1 37 VAL HB 1 46 CYS HB2 . . 5.430 5.094 4.987 5.158 . 0 0 "[ . 1 . 2]" 1
773 1 37 VAL MG1 1 38 SER H . . 4.150 3.851 3.757 3.971 . 0 0 "[ . 1 . 2]" 1
774 1 37 VAL MG1 1 38 SER HA . . 4.240 3.767 3.691 3.874 . 0 0 "[ . 1 . 2]" 1
775 1 37 VAL MG1 1 39 MET H . . 5.500 5.344 5.263 5.427 . 0 0 "[ . 1 . 2]" 1
776 1 37 VAL MG1 1 40 GLY H . . 5.130 4.752 4.527 4.866 . 0 0 "[ . 1 . 2]" 1
777 1 37 VAL MG1 1 40 GLY HA2 . . 5.500 5.219 4.985 5.426 . 0 0 "[ . 1 . 2]" 1
778 1 37 VAL MG1 1 41 PHE H . . 5.500 4.401 4.159 5.214 . 0 0 "[ . 1 . 2]" 1
779 1 37 VAL MG1 1 41 PHE HB2 . . 5.270 5.051 4.848 5.232 . 0 0 "[ . 1 . 2]" 1
780 1 37 VAL MG1 1 42 SER HA . . 4.570 4.486 4.319 4.591 0.021 18 0 "[ . 1 . 2]" 1
781 1 37 VAL MG1 1 43 GLN H . . 5.500 3.427 3.272 3.563 . 0 0 "[ . 1 . 2]" 1
782 1 37 VAL MG1 1 43 GLN HA . . 4.310 3.631 3.503 3.794 . 0 0 "[ . 1 . 2]" 1
783 1 37 VAL MG1 1 43 GLN HB2 . . 3.040 2.603 2.445 2.875 . 0 0 "[ . 1 . 2]" 1
784 1 37 VAL MG1 1 43 GLN HB3 . . 5.270 4.150 3.992 4.411 . 0 0 "[ . 1 . 2]" 1
785 1 37 VAL MG1 1 43 GLN HG2 . . 5.500 4.925 4.867 5.027 . 0 0 "[ . 1 . 2]" 1
786 1 37 VAL MG1 1 43 GLN HG3 . . 3.660 3.707 3.677 3.756 0.096 18 0 "[ . 1 . 2]" 1
787 1 37 VAL MG1 1 46 CYS HB2 . . 5.270 4.887 4.790 4.965 . 0 0 "[ . 1 . 2]" 1
788 1 37 VAL MG1 1 46 CYS HG . . 5.020 4.186 3.883 5.033 0.013 18 0 "[ . 1 . 2]" 1
789 1 37 VAL MG2 1 38 SER H . . 4.070 4.080 4.033 4.108 0.038 4 0 "[ . 1 . 2]" 1
790 1 37 VAL MG2 1 38 SER HA . . 5.500 5.471 5.456 5.486 . 0 0 "[ . 1 . 2]" 1
791 1 37 VAL MG2 1 39 MET H . . 5.500 5.481 5.433 5.509 0.009 11 0 "[ . 1 . 2]" 1
792 1 37 VAL MG2 1 40 GLY H . . 5.500 5.417 5.283 5.521 0.021 10 0 "[ . 1 . 2]" 1
793 1 37 VAL MG2 1 41 PHE H . . 5.260 4.630 4.469 5.219 . 0 0 "[ . 1 . 2]" 1
794 1 37 VAL MG2 1 41 PHE QD . . 5.500 5.424 5.287 5.503 0.003 20 0 "[ . 1 . 2]" 1
795 1 37 VAL MG2 1 42 SER HA . . 4.310 4.352 4.328 4.364 0.054 17 0 "[ . 1 . 2]" 1
796 1 37 VAL MG2 1 43 GLN H . . 4.630 2.927 2.813 3.050 . 0 0 "[ . 1 . 2]" 1
797 1 37 VAL MG2 1 43 GLN HA . . 3.110 1.806 1.779 1.869 . 0 0 "[ . 1 . 2]" 1
798 1 37 VAL MG2 1 43 GLN HB2 . . 2.920 2.035 1.970 2.334 . 0 0 "[ . 1 . 2]" 1
799 1 37 VAL MG2 1 43 GLN HB3 . . 4.050 3.432 3.382 3.626 . 0 0 "[ . 1 . 2]" 1
800 1 37 VAL MG2 1 43 GLN HE21 . . 5.130 3.693 3.361 3.959 . 0 0 "[ . 1 . 2]" 1
801 1 37 VAL MG2 1 43 GLN HE22 . . 5.430 4.762 4.506 5.051 . 0 0 "[ . 1 . 2]" 1
802 1 37 VAL MG2 1 43 GLN HG2 . . 4.150 3.483 3.452 3.596 . 0 0 "[ . 1 . 2]" 1
803 1 37 VAL MG2 1 43 GLN HG3 . . 4.240 2.306 2.251 2.383 . 0 0 "[ . 1 . 2]" 1
804 1 37 VAL MG2 1 46 CYS H . . 4.920 3.950 3.878 4.002 . 0 0 "[ . 1 . 2]" 1
805 1 37 VAL MG2 1 46 CYS HB2 . . 4.150 2.370 2.282 2.439 . 0 0 "[ . 1 . 2]" 1
806 1 37 VAL MG2 1 46 CYS HB3 . . 4.030 2.854 2.665 2.969 . 0 0 "[ . 1 . 2]" 1
807 1 37 VAL MG2 1 46 CYS HG . . 3.690 2.180 1.940 3.258 . 0 0 "[ . 1 . 2]" 1
808 1 38 SER H 1 38 SER HB2 . . 3.180 2.127 2.080 2.224 . 0 0 "[ . 1 . 2]" 1
809 1 38 SER H 1 38 SER HB3 . . 3.500 3.198 2.992 3.332 . 0 0 "[ . 1 . 2]" 1
810 1 38 SER H 1 39 MET H . . 3.460 2.311 2.207 2.452 . 0 0 "[ . 1 . 2]" 1
811 1 38 SER H 1 39 MET HB2 . . 5.500 4.206 4.057 4.506 . 0 0 "[ . 1 . 2]" 1
812 1 38 SER H 1 39 MET HG3 . . 5.500 4.260 4.013 4.604 . 0 0 "[ . 1 . 2]" 1
813 1 38 SER HA 1 40 GLY H . . 4.210 3.814 3.513 3.925 . 0 0 "[ . 1 . 2]" 1
814 1 38 SER HB2 1 39 MET H . . 4.250 3.186 3.047 3.405 . 0 0 "[ . 1 . 2]" 1
815 1 38 SER HB2 1 39 MET ME . . 5.430 5.259 5.040 5.435 0.005 15 0 "[ . 1 . 2]" 1
816 1 38 SER HB2 1 39 MET HG2 . . 5.500 5.544 5.469 6.381 0.881 10 1 "[ . + . 2]" 1
817 1 38 SER HB2 1 39 MET HG3 . . 5.270 4.533 4.376 4.990 . 0 0 "[ . 1 . 2]" 1
818 1 38 SER HB3 1 39 MET H . . 4.840 3.042 2.827 3.241 . 0 0 "[ . 1 . 2]" 1
819 1 38 SER HB3 1 40 GLY H . . 4.920 4.919 4.651 4.942 0.022 11 0 "[ . 1 . 2]" 1
820 1 39 MET H 1 39 MET HB2 . . 3.500 2.260 2.135 2.402 . 0 0 "[ . 1 . 2]" 1
821 1 39 MET H 1 39 MET HB3 . . 3.940 3.487 3.438 3.514 . 0 0 "[ . 1 . 2]" 1
822 1 39 MET H 1 39 MET ME . . 4.920 3.697 3.483 3.777 . 0 0 "[ . 1 . 2]" 1
823 1 39 MET H 1 39 MET HG2 . . 4.070 3.394 3.211 3.800 . 0 0 "[ . 1 . 2]" 1
824 1 39 MET H 1 39 MET HG3 . . 3.620 2.455 2.136 2.701 . 0 0 "[ . 1 . 2]" 1
825 1 39 MET H 1 40 GLY H . . 3.350 2.742 2.700 2.780 . 0 0 "[ . 1 . 2]" 1
826 1 39 MET H 1 40 GLY HA2 . . 5.190 5.068 5.036 5.110 . 0 0 "[ . 1 . 2]" 1
827 1 39 MET H 1 41 PHE H . . 4.420 4.057 3.866 4.161 . 0 0 "[ . 1 . 2]" 1
828 1 39 MET H 1 41 PHE HB2 . . 4.830 4.655 4.508 4.726 . 0 0 "[ . 1 . 2]" 1
829 1 39 MET HA 1 39 MET HG2 . . 3.690 2.289 2.227 2.421 . 0 0 "[ . 1 . 2]" 1
830 1 39 MET HA 1 39 MET HG3 . . 3.920 3.044 2.737 3.107 . 0 0 "[ . 1 . 2]" 1
831 1 39 MET HB2 1 39 MET ME . . 4.630 3.074 2.761 3.412 . 0 0 "[ . 1 . 2]" 1
832 1 39 MET HB2 1 40 GLY H . . 4.790 3.031 2.903 3.372 . 0 0 "[ . 1 . 2]" 1
833 1 39 MET HB2 1 41 PHE H . . 5.500 3.743 2.743 3.942 . 0 0 "[ . 1 . 2]" 1
834 1 39 MET HB2 1 41 PHE QD . . 4.000 2.054 1.987 2.764 . 0 0 "[ . 1 . 2]" 1
835 1 39 MET HB2 1 41 PHE QE . . 4.690 3.179 3.070 3.403 . 0 0 "[ . 1 . 2]" 1
836 1 39 MET HB3 1 40 GLY H . . 5.340 3.769 3.719 3.866 . 0 0 "[ . 1 . 2]" 1
837 1 39 MET HB3 1 41 PHE H . . 5.430 4.669 3.695 4.902 . 0 0 "[ . 1 . 2]" 1
838 1 39 MET HB3 1 41 PHE QD . . 4.240 2.763 2.613 3.291 . 0 0 "[ . 1 . 2]" 1
839 1 39 MET HB3 1 41 PHE QE . . 4.570 2.567 2.180 3.286 . 0 0 "[ . 1 . 2]" 1
840 1 39 MET ME 1 39 MET HG3 . . 3.980 2.018 1.974 2.068 . 0 0 "[ . 1 . 2]" 1
841 1 39 MET ME 1 40 GLY H . . 5.500 5.497 5.429 5.512 0.012 16 0 "[ . 1 . 2]" 1
842 1 39 MET ME 1 41 PHE QD . . 5.430 4.074 3.515 4.518 . 0 0 "[ . 1 . 2]" 1
843 1 39 MET ME 1 41 PHE QE . . 4.430 3.912 3.345 4.360 . 0 0 "[ . 1 . 2]" 1
844 1 39 MET ME 1 41 PHE HZ . . 5.430 5.308 4.938 5.434 0.004 1 0 "[ . 1 . 2]" 1
845 1 39 MET ME 1 58 VAL HA . . 5.430 4.262 4.127 4.468 . 0 0 "[ . 1 . 2]" 1
846 1 39 MET ME 1 58 VAL MG1 . . 3.280 1.783 1.636 2.007 . 0 0 "[ . 1 . 2]" 1
847 1 39 MET ME 1 58 VAL MG2 . . 4.310 3.552 3.402 3.748 . 0 0 "[ . 1 . 2]" 1
848 1 39 MET ME 1 62 MET H . . 5.430 4.237 4.096 4.663 . 0 0 "[ . 1 . 2]" 1
849 1 39 MET HG2 1 40 GLY H . . 5.500 5.107 5.065 5.294 . 0 0 "[ . 1 . 2]" 1
850 1 39 MET HG2 1 41 PHE QD . . 5.270 4.874 4.711 5.062 . 0 0 "[ . 1 . 2]" 1
851 1 39 MET HG2 1 41 PHE QE . . 5.500 4.717 4.358 4.840 . 0 0 "[ . 1 . 2]" 1
852 1 39 MET HG3 1 40 GLY H . . 5.500 4.738 4.467 4.959 . 0 0 "[ . 1 . 2]" 1
853 1 40 GLY H 1 41 PHE H . . 3.400 1.950 1.897 2.032 . 0 0 "[ . 1 . 2]" 1
854 1 40 GLY H 1 41 PHE HB2 . . 5.070 3.684 3.632 3.893 . 0 0 "[ . 1 . 2]" 1
855 1 40 GLY H 1 41 PHE HB3 . . 5.500 5.216 5.173 5.405 . 0 0 "[ . 1 . 2]" 1
856 1 41 PHE H 1 41 PHE HB2 . . 3.390 2.254 2.140 2.309 . 0 0 "[ . 1 . 2]" 1
857 1 41 PHE H 1 41 PHE HB3 . . 4.020 3.501 3.421 3.539 . 0 0 "[ . 1 . 2]" 1
858 1 41 PHE H 1 41 PHE QD . . 3.880 2.877 2.371 2.964 . 0 0 "[ . 1 . 2]" 1
859 1 41 PHE H 1 41 PHE QE . . 5.130 5.053 4.516 5.158 0.028 18 0 "[ . 1 . 2]" 1
860 1 41 PHE H 1 42 SER H . . 5.340 4.470 4.389 4.620 . 0 0 "[ . 1 . 2]" 1
861 1 41 PHE H 1 46 CYS HG . . 5.190 4.452 4.181 4.942 . 0 0 "[ . 1 . 2]" 1
862 1 41 PHE HA 1 41 PHE QD . . 3.840 2.949 2.511 3.045 . 0 0 "[ . 1 . 2]" 1
863 1 41 PHE HA 1 42 SER H . . 3.390 2.634 2.568 2.760 . 0 0 "[ . 1 . 2]" 1
864 1 41 PHE HA 1 42 SER HA . . 5.500 4.312 4.291 4.350 . 0 0 "[ . 1 . 2]" 1
865 1 41 PHE HA 1 42 SER HB2 . . 5.430 5.408 5.341 5.443 0.013 13 0 "[ . 1 . 2]" 1
866 1 41 PHE HB2 1 42 SER H . . 4.490 3.598 3.413 3.711 . 0 0 "[ . 1 . 2]" 1
867 1 41 PHE HB2 1 45 HIS HB2 . . 5.430 5.371 5.235 5.450 0.020 10 0 "[ . 1 . 2]" 1
868 1 41 PHE HB2 1 46 CYS H . . 5.130 4.861 4.790 4.924 . 0 0 "[ . 1 . 2]" 1
869 1 41 PHE HB2 1 46 CYS HB2 . . 5.130 4.976 4.933 5.002 . 0 0 "[ . 1 . 2]" 1
870 1 41 PHE HB2 1 46 CYS HG . . 4.120 3.122 2.983 3.236 . 0 0 "[ . 1 . 2]" 1
871 1 41 PHE HB2 1 65 LEU MD1 . . 4.520 4.141 3.794 4.481 . 0 0 "[ . 1 . 2]" 1
872 1 41 PHE HB2 1 65 LEU MD2 . . 4.570 4.265 4.060 4.592 0.022 19 0 "[ . 1 . 2]" 1
873 1 41 PHE HB3 1 42 SER H . . 3.800 2.191 1.945 2.329 . 0 0 "[ . 1 . 2]" 1
874 1 41 PHE HB3 1 45 HIS HB2 . . 4.840 3.722 3.569 3.825 . 0 0 "[ . 1 . 2]" 1
875 1 41 PHE HB3 1 46 CYS H . . 5.070 3.800 3.705 3.885 . 0 0 "[ . 1 . 2]" 1
876 1 41 PHE HB3 1 46 CYS HA . . 5.500 4.147 4.024 4.283 . 0 0 "[ . 1 . 2]" 1
877 1 41 PHE HB3 1 46 CYS HB2 . . 4.690 4.801 4.761 4.826 0.136 10 0 "[ . 1 . 2]" 1
878 1 41 PHE HB3 1 46 CYS HG . . 4.000 2.891 2.229 3.155 . 0 0 "[ . 1 . 2]" 1
879 1 41 PHE HB3 1 65 LEU MD1 . . 4.470 3.537 3.132 3.864 . 0 0 "[ . 1 . 2]" 1
880 1 41 PHE HB3 1 65 LEU MD2 . . 4.310 2.960 2.731 3.312 . 0 0 "[ . 1 . 2]" 1
881 1 41 PHE QD 1 42 SER H . . 4.960 3.208 3.024 3.590 . 0 0 "[ . 1 . 2]" 1
882 1 41 PHE QD 1 46 CYS HG . . 5.270 4.735 4.121 4.929 . 0 0 "[ . 1 . 2]" 1
883 1 41 PHE QD 1 62 MET ME . . 5.130 5.118 5.002 5.156 0.026 17 0 "[ . 1 . 2]" 1
884 1 41 PHE QD 1 65 LEU HB3 . . 5.500 3.200 2.949 3.454 . 0 0 "[ . 1 . 2]" 1
885 1 41 PHE QD 1 65 LEU MD1 . . 4.340 3.260 2.329 3.545 . 0 0 "[ . 1 . 2]" 1
886 1 41 PHE QD 1 65 LEU MD2 . . 4.150 2.050 1.971 2.396 . 0 0 "[ . 1 . 2]" 1
887 1 41 PHE QD 1 65 LEU HG . . 5.500 4.847 4.387 5.182 . 0 0 "[ . 1 . 2]" 1
888 1 41 PHE QD 1 66 LEU MD2 . . 5.270 4.580 4.318 4.784 . 0 0 "[ . 1 . 2]" 1
889 1 41 PHE QD 1 69 MET ME . . 4.340 2.133 1.896 3.044 . 0 0 "[ . 1 . 2]" 1
890 1 41 PHE QE 1 62 MET HA . . 5.500 4.275 3.128 4.454 . 0 0 "[ . 1 . 2]" 1
891 1 41 PHE QE 1 62 MET ME . . 4.210 3.500 3.244 3.801 . 0 0 "[ . 1 . 2]" 1
892 1 41 PHE QE 1 62 MET HG2 . . 4.470 3.087 2.118 3.297 . 0 0 "[ . 1 . 2]" 1
893 1 41 PHE QE 1 62 MET HG3 . . 4.310 2.856 2.028 3.217 . 0 0 "[ . 1 . 2]" 1
894 1 41 PHE QE 1 65 LEU HB2 . . 5.500 3.351 2.636 3.709 . 0 0 "[ . 1 . 2]" 1
895 1 41 PHE QE 1 65 LEU HB3 . . 4.840 2.575 2.406 2.876 . 0 0 "[ . 1 . 2]" 1
896 1 41 PHE QE 1 65 LEU MD1 . . 4.630 3.632 2.822 3.840 . 0 0 "[ . 1 . 2]" 1
897 1 41 PHE QE 1 65 LEU MD2 . . 4.760 3.311 3.120 3.508 . 0 0 "[ . 1 . 2]" 1
898 1 41 PHE QE 1 65 LEU HG . . 5.500 5.207 4.874 5.456 . 0 0 "[ . 1 . 2]" 1
899 1 41 PHE QE 1 66 LEU MD1 . . 5.270 4.706 4.474 4.887 . 0 0 "[ . 1 . 2]" 1
900 1 41 PHE QE 1 66 LEU MD2 . . 4.240 2.672 2.377 2.871 . 0 0 "[ . 1 . 2]" 1
901 1 41 PHE QE 1 66 LEU HG . . 5.430 4.327 3.968 4.557 . 0 0 "[ . 1 . 2]" 1
902 1 41 PHE QE 1 69 MET ME . . 4.340 2.159 1.944 3.244 . 0 0 "[ . 1 . 2]" 1
903 1 41 PHE HZ 1 62 MET ME . . 4.310 3.201 2.436 4.325 0.015 11 0 "[ . 1 . 2]" 1
904 1 41 PHE HZ 1 62 MET HG2 . . 4.690 2.489 2.228 2.668 . 0 0 "[ . 1 . 2]" 1
905 1 41 PHE HZ 1 62 MET HG3 . . 5.430 3.181 2.899 3.494 . 0 0 "[ . 1 . 2]" 1
906 1 41 PHE HZ 1 65 LEU HB3 . . 5.270 4.519 4.217 5.096 . 0 0 "[ . 1 . 2]" 1
907 1 41 PHE HZ 1 65 LEU MD1 . . 5.130 4.547 4.217 4.734 . 0 0 "[ . 1 . 2]" 1
908 1 41 PHE HZ 1 65 LEU MD2 . . 5.430 5.089 4.857 5.380 . 0 0 "[ . 1 . 2]" 1
909 1 41 PHE HZ 1 66 LEU MD1 . . 5.020 4.087 3.826 4.371 . 0 0 "[ . 1 . 2]" 1
910 1 41 PHE HZ 1 66 LEU MD2 . . 3.980 2.138 1.968 2.646 . 0 0 "[ . 1 . 2]" 1
911 1 41 PHE HZ 1 66 LEU HG . . 5.130 4.157 3.886 4.625 . 0 0 "[ . 1 . 2]" 1
912 1 41 PHE HZ 1 69 MET ME . . 5.020 4.141 3.924 4.446 . 0 0 "[ . 1 . 2]" 1
913 1 42 SER H 1 42 SER HB2 . . 3.500 2.931 2.857 2.980 . 0 0 "[ . 1 . 2]" 1
914 1 42 SER H 1 42 SER HB3 . . 3.640 3.605 3.552 3.676 0.036 16 0 "[ . 1 . 2]" 1
915 1 42 SER H 1 43 GLN H . . 4.420 4.417 4.322 4.460 0.040 17 0 "[ . 1 . 2]" 1
916 1 42 SER H 1 45 HIS H . . 5.260 4.319 4.165 4.442 . 0 0 "[ . 1 . 2]" 1
917 1 42 SER H 1 45 HIS HB2 . . 4.630 3.032 2.871 3.155 . 0 0 "[ . 1 . 2]" 1
918 1 42 SER H 1 45 HIS HB3 . . 5.130 4.593 4.421 4.711 . 0 0 "[ . 1 . 2]" 1
919 1 42 SER H 1 46 CYS H . . 5.500 3.838 3.688 4.032 . 0 0 "[ . 1 . 2]" 1
920 1 42 SER H 1 65 LEU MD1 . . 5.500 4.855 4.523 5.092 . 0 0 "[ . 1 . 2]" 1
921 1 42 SER H 1 65 LEU MD2 . . 5.430 3.410 3.309 3.545 . 0 0 "[ . 1 . 2]" 1
922 1 42 SER HA 1 43 GLN H . . 3.130 2.216 2.215 2.221 . 0 0 "[ . 1 . 2]" 1
923 1 42 SER HA 1 43 GLN HA . . 4.840 4.346 4.330 4.365 . 0 0 "[ . 1 . 2]" 1
924 1 42 SER HA 1 43 GLN HB2 . . 5.130 4.561 4.490 4.595 . 0 0 "[ . 1 . 2]" 1
925 1 42 SER HA 1 43 GLN HB3 . . 5.270 4.668 4.631 4.733 . 0 0 "[ . 1 . 2]" 1
926 1 42 SER HA 1 44 LEU H . . 4.870 4.408 4.344 4.488 . 0 0 "[ . 1 . 2]" 1
927 1 42 SER HA 1 45 HIS H . . 4.760 4.497 4.350 4.617 . 0 0 "[ . 1 . 2]" 1
928 1 42 SER HA 1 45 HIS HB2 . . 5.020 4.899 4.709 5.029 0.009 1 0 "[ . 1 . 2]" 1
929 1 42 SER HA 1 46 CYS HG . . 5.020 3.778 3.653 3.990 . 0 0 "[ . 1 . 2]" 1
930 1 42 SER HB2 1 43 GLN H . . 4.570 4.036 3.961 4.120 . 0 0 "[ . 1 . 2]" 1
931 1 42 SER HB2 1 43 GLN HB3 . . 5.500 5.470 5.369 5.550 0.050 18 0 "[ . 1 . 2]" 1
932 1 42 SER HB2 1 44 LEU H . . 4.630 3.908 3.773 4.099 . 0 0 "[ . 1 . 2]" 1
933 1 42 SER HB2 1 44 LEU HB2 . . 5.500 5.239 5.100 5.397 . 0 0 "[ . 1 . 2]" 1
934 1 42 SER HB2 1 44 LEU HB3 . . 5.130 3.543 3.403 3.707 . 0 0 "[ . 1 . 2]" 1
935 1 42 SER HB2 1 44 LEU MD2 . . 5.500 4.060 3.939 4.252 . 0 0 "[ . 1 . 2]" 1
936 1 42 SER HB2 1 45 HIS H . . 4.180 2.306 2.252 2.395 . 0 0 "[ . 1 . 2]" 1
937 1 42 SER HB2 1 45 HIS HB2 . . 4.690 2.906 2.702 3.114 . 0 0 "[ . 1 . 2]" 1
938 1 42 SER HB2 1 45 HIS HB3 . . 5.020 4.136 3.987 4.307 . 0 0 "[ . 1 . 2]" 1
939 1 42 SER HB2 1 45 HIS HD2 . . 5.430 3.810 3.680 4.010 . 0 0 "[ . 1 . 2]" 1
940 1 42 SER HB2 1 45 HIS HE1 . . 5.430 3.372 3.228 3.602 . 0 0 "[ . 1 . 2]" 1
941 1 42 SER HB2 1 46 CYS H . . 5.430 3.812 3.675 3.954 . 0 0 "[ . 1 . 2]" 1
942 1 42 SER HB2 1 65 LEU MD2 . . 5.500 4.336 4.221 4.468 . 0 0 "[ . 1 . 2]" 1
943 1 42 SER HB3 1 43 GLN H . . 4.340 3.678 3.600 3.750 . 0 0 "[ . 1 . 2]" 1
944 1 42 SER HB3 1 43 GLN HB3 . . 5.500 5.242 5.137 5.353 . 0 0 "[ . 1 . 2]" 1
945 1 42 SER HB3 1 44 LEU H . . 4.520 4.078 3.886 4.231 . 0 0 "[ . 1 . 2]" 1
946 1 42 SER HB3 1 44 LEU HB3 . . 5.270 3.918 3.730 4.034 . 0 0 "[ . 1 . 2]" 1
947 1 42 SER HB3 1 44 LEU MD2 . . 5.500 4.415 4.297 4.545 . 0 0 "[ . 1 . 2]" 1
948 1 42 SER HB3 1 45 HIS H . . 4.470 3.725 3.645 3.813 . 0 0 "[ . 1 . 2]" 1
949 1 42 SER HB3 1 45 HIS HB2 . . 5.430 4.590 4.395 4.765 . 0 0 "[ . 1 . 2]" 1
950 1 42 SER HB3 1 45 HIS HE1 . . 5.430 3.664 3.551 4.130 . 0 0 "[ . 1 . 2]" 1
951 1 43 GLN H 1 43 GLN HB2 . . 3.480 2.366 2.297 2.401 . 0 0 "[ . 1 . 2]" 1
952 1 43 GLN H 1 43 GLN HB3 . . 3.690 2.654 2.611 2.742 . 0 0 "[ . 1 . 2]" 1
953 1 43 GLN H 1 43 GLN HG2 . . 4.840 4.469 4.438 4.512 . 0 0 "[ . 1 . 2]" 1
954 1 43 GLN H 1 43 GLN HG3 . . 4.660 4.336 4.253 4.382 . 0 0 "[ . 1 . 2]" 1
955 1 43 GLN H 1 44 LEU H . . 4.080 3.196 3.157 3.253 . 0 0 "[ . 1 . 2]" 1
956 1 43 GLN H 1 44 LEU HB3 . . 5.500 4.943 4.897 5.002 . 0 0 "[ . 1 . 2]" 1
957 1 43 GLN H 1 45 HIS H . . 5.500 4.459 4.224 4.599 . 0 0 "[ . 1 . 2]" 1
958 1 43 GLN H 1 46 CYS H . . 5.500 4.396 4.272 4.495 . 0 0 "[ . 1 . 2]" 1
959 1 43 GLN H 1 46 CYS HG . . 5.500 3.314 3.133 3.865 . 0 0 "[ . 1 . 2]" 1
960 1 43 GLN HA 1 43 GLN HG2 . . 3.810 3.001 2.940 3.046 . 0 0 "[ . 1 . 2]" 1
961 1 43 GLN HA 1 43 GLN HG3 . . 3.840 2.598 2.474 2.703 . 0 0 "[ . 1 . 2]" 1
962 1 43 GLN HA 1 44 LEU HA . . 5.270 4.899 4.889 4.908 . 0 0 "[ . 1 . 2]" 1
963 1 43 GLN HA 1 45 HIS H . . 5.340 4.476 4.146 4.682 . 0 0 "[ . 1 . 2]" 1
964 1 43 GLN HA 1 46 CYS H . . 4.310 3.255 3.064 3.390 . 0 0 "[ . 1 . 2]" 1
965 1 43 GLN HA 1 46 CYS HB2 . . 3.600 2.094 1.995 2.225 . 0 0 "[ . 1 . 2]" 1
966 1 43 GLN HA 1 46 CYS HB3 . . 4.380 3.662 3.596 3.774 . 0 0 "[ . 1 . 2]" 1
967 1 43 GLN HA 1 46 CYS HG . . 3.780 2.387 2.148 3.100 . 0 0 "[ . 1 . 2]" 1
968 1 43 GLN HA 1 47 GLN H . . 3.960 3.880 3.686 3.968 0.008 5 0 "[ . 1 . 2]" 1
969 1 43 GLN HA 1 47 GLN HG3 . . 4.180 3.786 3.659 3.894 . 0 0 "[ . 1 . 2]" 1
970 1 43 GLN HB2 1 44 LEU H . . 4.310 3.700 3.596 3.760 . 0 0 "[ . 1 . 2]" 1
971 1 43 GLN HB2 1 46 CYS HB2 . . 5.270 4.513 4.409 4.629 . 0 0 "[ . 1 . 2]" 1
972 1 43 GLN HB3 1 43 GLN HE22 . . 5.500 4.667 4.596 4.751 . 0 0 "[ . 1 . 2]" 1
973 1 43 GLN HB3 1 44 LEU H . . 3.700 2.240 2.126 2.316 . 0 0 "[ . 1 . 2]" 1
974 1 43 GLN HB3 1 45 HIS H . . 5.500 4.955 4.694 5.110 . 0 0 "[ . 1 . 2]" 1
975 1 43 GLN HE21 1 47 GLN HG3 . . 5.500 4.435 4.084 4.823 . 0 0 "[ . 1 . 2]" 1
976 1 43 GLN HG2 1 44 LEU H . . 4.090 3.414 3.366 3.464 . 0 0 "[ . 1 . 2]" 1
977 1 43 GLN HG2 1 44 LEU HA . . 4.840 3.522 3.463 3.643 . 0 0 "[ . 1 . 2]" 1
978 1 43 GLN HG2 1 45 HIS H . . 5.500 5.412 5.147 5.527 0.027 19 0 "[ . 1 . 2]" 1
979 1 43 GLN HG2 1 46 CYS H . . 5.340 5.155 4.963 5.256 . 0 0 "[ . 1 . 2]" 1
980 1 43 GLN HG2 1 46 CYS HB2 . . 4.920 4.047 3.967 4.142 . 0 0 "[ . 1 . 2]" 1
981 1 43 GLN HG2 1 47 GLN HE21 . . 3.850 3.244 2.715 3.861 0.011 19 0 "[ . 1 . 2]" 1
982 1 43 GLN HG2 1 47 GLN HE22 . . 4.300 3.686 3.458 3.848 . 0 0 "[ . 1 . 2]" 1
983 1 43 GLN HG2 1 47 GLN HG3 . . 4.630 2.442 2.162 2.713 . 0 0 "[ . 1 . 2]" 1
984 1 43 GLN HG3 1 44 LEU H . . 4.830 4.542 4.505 4.579 . 0 0 "[ . 1 . 2]" 1
985 1 43 GLN HG3 1 44 LEU HA . . 5.130 5.172 5.143 5.222 0.092 18 0 "[ . 1 . 2]" 1
986 1 43 GLN HG3 1 46 CYS HB2 . . 5.500 3.729 3.537 3.964 . 0 0 "[ . 1 . 2]" 1
987 1 43 GLN HG3 1 47 GLN HE21 . . 4.920 4.380 4.068 4.605 . 0 0 "[ . 1 . 2]" 1
988 1 43 GLN HG3 1 47 GLN HE22 . . 5.190 4.992 4.621 5.208 0.018 12 0 "[ . 1 . 2]" 1
989 1 43 GLN HG3 1 47 GLN HG3 . . 3.710 3.330 3.174 3.430 . 0 0 "[ . 1 . 2]" 1
990 1 44 LEU H 1 44 LEU HB2 . . 3.400 2.654 2.614 2.700 . 0 0 "[ . 1 . 2]" 1
991 1 44 LEU H 1 44 LEU HB3 . . 3.290 2.267 2.225 2.300 . 0 0 "[ . 1 . 2]" 1
992 1 44 LEU H 1 44 LEU MD1 . . 4.630 4.205 4.152 4.243 . 0 0 "[ . 1 . 2]" 1
993 1 44 LEU H 1 44 LEU MD2 . . 4.760 4.074 4.013 4.102 . 0 0 "[ . 1 . 2]" 1
994 1 44 LEU H 1 44 LEU HG . . 4.430 4.297 4.258 4.323 . 0 0 "[ . 1 . 2]" 1
995 1 44 LEU H 1 45 HIS H . . 3.670 3.042 2.967 3.120 . 0 0 "[ . 1 . 2]" 1
996 1 44 LEU H 1 45 HIS HB2 . . 5.500 5.450 5.391 5.491 . 0 0 "[ . 1 . 2]" 1
997 1 44 LEU H 1 45 HIS HD2 . . 5.500 5.175 4.972 5.478 . 0 0 "[ . 1 . 2]" 1
998 1 44 LEU H 1 46 CYS H . . 4.960 4.361 4.317 4.413 . 0 0 "[ . 1 . 2]" 1
999 1 44 LEU H 1 46 CYS HG . . 5.500 5.031 4.881 5.335 . 0 0 "[ . 1 . 2]" 1
1000 1 44 LEU H 1 47 GLN HB2 . . 5.500 5.248 5.165 5.364 . 0 0 "[ . 1 . 2]" 1
1001 1 44 LEU HA 1 44 LEU MD1 . . 3.040 2.421 2.270 2.588 . 0 0 "[ . 1 . 2]" 1
1002 1 44 LEU HA 1 44 LEU MD2 . . 4.270 4.031 4.010 4.041 . 0 0 "[ . 1 . 2]" 1
1003 1 44 LEU HA 1 44 LEU HG . . 4.150 3.214 3.162 3.259 . 0 0 "[ . 1 . 2]" 1
1004 1 44 LEU HA 1 46 CYS H . . 4.830 4.848 4.824 4.871 0.041 12 0 "[ . 1 . 2]" 1
1005 1 44 LEU HA 1 47 GLN H . . 4.310 3.692 3.643 3.766 . 0 0 "[ . 1 . 2]" 1
1006 1 44 LEU HA 1 47 GLN HB2 . . 3.850 3.050 2.961 3.128 . 0 0 "[ . 1 . 2]" 1
1007 1 44 LEU HA 1 47 GLN HB3 . . 4.630 4.574 4.475 4.648 0.018 20 0 "[ . 1 . 2]" 1
1008 1 44 LEU HA 1 47 GLN HE21 . . 5.500 3.753 1.940 5.298 . 0 0 "[ . 1 . 2]" 1
1009 1 44 LEU HA 1 47 GLN HE22 . . 5.500 4.107 3.321 4.845 . 0 0 "[ . 1 . 2]" 1
1010 1 44 LEU HA 1 47 GLN HG2 . . 5.270 4.873 4.788 5.072 . 0 0 "[ . 1 . 2]" 1
1011 1 44 LEU HA 1 47 GLN HG3 . . 4.570 3.495 3.197 3.914 . 0 0 "[ . 1 . 2]" 1
1012 1 44 LEU HA 1 48 LYS H . . 4.790 4.359 4.245 4.420 . 0 0 "[ . 1 . 2]" 1
1013 1 44 LEU HA 1 78 ILE MD . . 4.760 2.942 2.713 3.258 . 0 0 "[ . 1 . 2]" 1
1014 1 44 LEU HB2 1 44 LEU MD1 . . 3.150 2.275 2.134 2.341 . 0 0 "[ . 1 . 2]" 1
1015 1 44 LEU HB2 1 44 LEU MD2 . . 3.360 2.627 2.522 2.669 . 0 0 "[ . 1 . 2]" 1
1016 1 44 LEU HB2 1 45 HIS H . . 4.130 4.040 3.955 4.158 0.028 8 0 "[ . 1 . 2]" 1
1017 1 44 LEU HB2 1 45 HIS HD2 . . 4.920 4.645 4.434 4.932 0.012 9 0 "[ . 1 . 2]" 1
1018 1 44 LEU HB3 1 44 LEU MD2 . . 3.500 2.118 2.033 2.249 . 0 0 "[ . 1 . 2]" 1
1019 1 44 LEU HB3 1 45 HIS H . . 3.520 2.702 2.573 2.881 . 0 0 "[ . 1 . 2]" 1
1020 1 44 LEU HB3 1 45 HIS HB2 . . 5.430 5.244 5.134 5.286 . 0 0 "[ . 1 . 2]" 1
1021 1 44 LEU HB3 1 45 HIS HD2 . . 4.570 3.457 3.200 3.831 . 0 0 "[ . 1 . 2]" 1
1022 1 44 LEU HB3 1 46 CYS H . . 5.260 5.113 5.017 5.228 . 0 0 "[ . 1 . 2]" 1
1023 1 44 LEU MD1 1 45 HIS H . . 5.070 4.375 4.285 4.555 . 0 0 "[ . 1 . 2]" 1
1024 1 44 LEU MD1 1 45 HIS HD2 . . 4.470 3.764 3.664 3.888 . 0 0 "[ . 1 . 2]" 1
1025 1 44 LEU MD1 1 47 GLN H . . 5.190 5.082 4.923 5.185 . 0 0 "[ . 1 . 2]" 1
1026 1 44 LEU MD1 1 47 GLN HB2 . . 4.630 3.897 3.782 4.047 . 0 0 "[ . 1 . 2]" 1
1027 1 44 LEU MD1 1 48 LYS H . . 4.920 4.361 4.129 4.501 . 0 0 "[ . 1 . 2]" 1
1028 1 44 LEU MD1 1 48 LYS HD2 . . 4.920 3.008 2.743 3.184 . 0 0 "[ . 1 . 2]" 1
1029 1 44 LEU MD1 1 48 LYS HD3 . . 4.470 4.312 4.117 4.454 . 0 0 "[ . 1 . 2]" 1
1030 1 44 LEU MD1 1 48 LYS HE3 . . 3.510 2.205 1.982 2.453 . 0 0 "[ . 1 . 2]" 1
1031 1 44 LEU MD1 1 75 ASP HA . . 5.430 5.008 4.829 5.304 . 0 0 "[ . 1 . 2]" 1
1032 1 44 LEU MD1 1 77 PRO HA . . 3.640 2.488 2.222 2.736 . 0 0 "[ . 1 . 2]" 1
1033 1 44 LEU MD1 1 77 PRO HB3 . . 4.840 3.933 3.529 4.174 . 0 0 "[ . 1 . 2]" 1
1034 1 44 LEU MD1 1 78 ILE H . . 3.770 2.683 2.494 2.812 . 0 0 "[ . 1 . 2]" 1
1035 1 44 LEU MD2 1 45 HIS H . . 4.920 3.642 3.397 3.903 . 0 0 "[ . 1 . 2]" 1
1036 1 44 LEU MD2 1 45 HIS HA . . 4.840 4.335 4.173 4.482 . 0 0 "[ . 1 . 2]" 1
1037 1 44 LEU MD2 1 45 HIS HD2 . . 3.910 2.372 2.044 2.570 . 0 0 "[ . 1 . 2]" 1
1038 1 44 LEU MD2 1 48 LYS HD2 . . 5.500 3.776 3.556 4.028 . 0 0 "[ . 1 . 2]" 1
1039 1 44 LEU MD2 1 48 LYS HE3 . . 3.890 3.706 3.491 3.866 . 0 0 "[ . 1 . 2]" 1
1040 1 44 LEU MD2 1 75 ASP HA . . 3.400 2.836 2.718 3.069 . 0 0 "[ . 1 . 2]" 1
1041 1 44 LEU MD2 1 75 ASP HB2 . . 5.130 5.111 4.842 5.159 0.029 17 0 "[ . 1 . 2]" 1
1042 1 44 LEU MD2 1 75 ASP HB3 . . 4.840 4.692 4.490 5.127 0.287 9 0 "[ . 1 . 2]" 1
1043 1 44 LEU MD2 1 76 ALA H . . 5.130 4.567 4.368 4.865 . 0 0 "[ . 1 . 2]" 1
1044 1 44 LEU MD2 1 77 PRO HA . . 3.810 3.573 3.251 3.772 . 0 0 "[ . 1 . 2]" 1
1045 1 44 LEU MD2 1 77 PRO HB3 . . 5.020 4.765 4.321 5.012 . 0 0 "[ . 1 . 2]" 1
1046 1 44 LEU MD2 1 78 ILE H . . 4.840 4.707 4.506 4.840 . 0 0 "[ . 1 . 2]" 1
1047 1 44 LEU HG 1 45 HIS H . . 4.690 3.135 2.975 3.429 . 0 0 "[ . 1 . 2]" 1
1048 1 44 LEU HG 1 45 HIS HA . . 4.470 3.208 3.116 3.363 . 0 0 "[ . 1 . 2]" 1
1049 1 44 LEU HG 1 45 HIS HD2 . . 3.500 2.155 2.020 2.264 . 0 0 "[ . 1 . 2]" 1
1050 1 44 LEU HG 1 48 LYS H . . 4.870 4.542 4.375 4.768 . 0 0 "[ . 1 . 2]" 1
1051 1 44 LEU HG 1 48 LYS HB2 . . 5.130 4.576 4.367 4.846 . 0 0 "[ . 1 . 2]" 1
1052 1 44 LEU HG 1 48 LYS HD2 . . 3.080 2.956 2.805 3.089 0.009 20 0 "[ . 1 . 2]" 1
1053 1 44 LEU HG 1 48 LYS HE3 . . 3.910 3.660 3.435 3.882 . 0 0 "[ . 1 . 2]" 1
1054 1 44 LEU HG 1 77 PRO HA . . 5.500 4.958 4.566 5.184 . 0 0 "[ . 1 . 2]" 1
1055 1 45 HIS H 1 45 HIS HB2 . . 3.430 2.662 2.572 2.707 . 0 0 "[ . 1 . 2]" 1
1056 1 45 HIS H 1 45 HIS HB3 . . 3.840 3.546 3.528 3.578 . 0 0 "[ . 1 . 2]" 1
1057 1 45 HIS H 1 45 HIS HD2 . . 3.940 2.873 2.623 3.086 . 0 0 "[ . 1 . 2]" 1
1058 1 45 HIS H 1 46 CYS H . . 3.410 2.663 2.501 2.794 . 0 0 "[ . 1 . 2]" 1
1059 1 45 HIS H 1 46 CYS HA . . 5.430 5.174 5.045 5.280 . 0 0 "[ . 1 . 2]" 1
1060 1 45 HIS H 1 47 GLN H . . 4.830 3.954 3.713 4.147 . 0 0 "[ . 1 . 2]" 1
1061 1 45 HIS H 1 48 LYS H . . 5.500 4.802 4.772 4.839 . 0 0 "[ . 1 . 2]" 1
1062 1 45 HIS H 1 48 LYS HB2 . . 5.500 5.179 5.060 5.314 . 0 0 "[ . 1 . 2]" 1
1063 1 45 HIS H 1 65 LEU MD2 . . 4.470 4.089 3.962 4.231 . 0 0 "[ . 1 . 2]" 1
1064 1 45 HIS H 1 74 ILE MD . . 5.500 4.757 4.558 5.001 . 0 0 "[ . 1 . 2]" 1
1065 1 45 HIS HA 1 45 HIS HD2 . . 3.480 2.629 2.563 2.676 . 0 0 "[ . 1 . 2]" 1
1066 1 45 HIS HA 1 47 GLN H . . 5.130 3.988 3.737 4.237 . 0 0 "[ . 1 . 2]" 1
1067 1 45 HIS HA 1 48 LYS H . . 4.340 3.175 3.100 3.252 . 0 0 "[ . 1 . 2]" 1
1068 1 45 HIS HA 1 48 LYS HB2 . . 3.910 2.517 2.430 2.613 . 0 0 "[ . 1 . 2]" 1
1069 1 45 HIS HA 1 48 LYS HB3 . . 4.630 4.206 4.114 4.318 . 0 0 "[ . 1 . 2]" 1
1070 1 45 HIS HA 1 48 LYS HD2 . . 3.960 3.112 2.959 3.219 . 0 0 "[ . 1 . 2]" 1
1071 1 45 HIS HA 1 48 LYS HD3 . . 5.130 4.206 4.054 4.360 . 0 0 "[ . 1 . 2]" 1
1072 1 45 HIS HA 1 48 LYS HE3 . . 5.270 5.210 5.070 5.278 0.008 16 0 "[ . 1 . 2]" 1
1073 1 45 HIS HA 1 48 LYS HG2 . . 5.130 5.018 4.833 5.094 . 0 0 "[ . 1 . 2]" 1
1074 1 45 HIS HA 1 48 LYS HG3 . . 4.920 3.761 3.453 3.907 . 0 0 "[ . 1 . 2]" 1
1075 1 45 HIS HA 1 49 ALA H . . 4.920 3.568 3.480 3.688 . 0 0 "[ . 1 . 2]" 1
1076 1 45 HIS HA 1 49 ALA MB . . 5.500 4.309 4.197 4.588 . 0 0 "[ . 1 . 2]" 1
1077 1 45 HIS HA 1 64 TRP HZ3 . . 5.270 3.803 3.682 3.928 . 0 0 "[ . 1 . 2]" 1
1078 1 45 HIS HA 1 65 LEU MD1 . . 5.270 4.957 4.769 5.089 . 0 0 "[ . 1 . 2]" 1
1079 1 45 HIS HA 1 65 LEU MD2 . . 4.570 3.418 3.345 3.602 . 0 0 "[ . 1 . 2]" 1
1080 1 45 HIS HA 1 65 LEU HG . . 5.430 4.945 4.838 5.051 . 0 0 "[ . 1 . 2]" 1
1081 1 45 HIS HA 1 74 ILE MD . . 4.100 2.816 2.690 2.922 . 0 0 "[ . 1 . 2]" 1
1082 1 45 HIS HB2 1 46 CYS H . . 3.780 2.500 2.435 2.545 . 0 0 "[ . 1 . 2]" 1
1083 1 45 HIS HB2 1 47 GLN H . . 5.500 4.838 4.699 5.007 . 0 0 "[ . 1 . 2]" 1
1084 1 45 HIS HB2 1 48 LYS H . . 5.500 5.536 5.519 5.557 0.057 18 0 "[ . 1 . 2]" 1
1085 1 45 HIS HB2 1 48 LYS HB2 . . 5.500 5.238 5.161 5.367 . 0 0 "[ . 1 . 2]" 1
1086 1 45 HIS HB2 1 65 LEU MD1 . . 4.760 3.881 3.702 4.191 . 0 0 "[ . 1 . 2]" 1
1087 1 45 HIS HB2 1 65 LEU MD2 . . 4.000 1.965 1.924 2.155 . 0 0 "[ . 1 . 2]" 1
1088 1 45 HIS HB2 1 74 ILE MD . . 5.430 3.746 3.540 3.923 . 0 0 "[ . 1 . 2]" 1
1089 1 45 HIS HB3 1 46 CYS H . . 4.310 3.783 3.724 3.833 . 0 0 "[ . 1 . 2]" 1
1090 1 45 HIS HB3 1 48 LYS H . . 5.420 5.217 5.165 5.291 . 0 0 "[ . 1 . 2]" 1
1091 1 45 HIS HB3 1 48 LYS HB2 . . 5.130 4.197 4.127 4.293 . 0 0 "[ . 1 . 2]" 1
1092 1 45 HIS HB3 1 48 LYS HD2 . . 5.500 5.034 4.889 5.118 . 0 0 "[ . 1 . 2]" 1
1093 1 45 HIS HB3 1 49 ALA H . . 5.500 4.304 4.203 4.392 . 0 0 "[ . 1 . 2]" 1
1094 1 45 HIS HB3 1 49 ALA MB . . 5.020 4.036 3.922 4.384 . 0 0 "[ . 1 . 2]" 1
1095 1 45 HIS HB3 1 64 TRP HZ3 . . 5.500 3.321 3.150 3.751 . 0 0 "[ . 1 . 2]" 1
1096 1 45 HIS HB3 1 65 LEU MD1 . . 4.210 4.071 3.897 4.183 . 0 0 "[ . 1 . 2]" 1
1097 1 45 HIS HB3 1 65 LEU MD2 . . 3.510 1.861 1.766 1.942 . 0 0 "[ . 1 . 2]" 1
1098 1 45 HIS HB3 1 65 LEU HG . . 5.130 3.644 3.469 3.763 . 0 0 "[ . 1 . 2]" 1
1099 1 45 HIS HB3 1 69 MET ME . . 5.270 4.277 4.001 4.577 . 0 0 "[ . 1 . 2]" 1
1100 1 45 HIS HB3 1 74 ILE MD . . 4.470 2.285 2.092 2.438 . 0 0 "[ . 1 . 2]" 1
1101 1 45 HIS HB3 1 74 ILE HG13 . . 5.430 2.836 2.708 2.948 . 0 0 "[ . 1 . 2]" 1
1102 1 45 HIS HD2 1 46 CYS H . . 5.270 5.118 5.005 5.256 . 0 0 "[ . 1 . 2]" 1
1103 1 45 HIS HD2 1 48 LYS H . . 5.500 5.304 5.173 5.395 . 0 0 "[ . 1 . 2]" 1
1104 1 45 HIS HD2 1 48 LYS HB2 . . 5.500 4.562 4.391 4.704 . 0 0 "[ . 1 . 2]" 1
1105 1 45 HIS HD2 1 48 LYS HD2 . . 4.180 3.342 3.211 3.439 . 0 0 "[ . 1 . 2]" 1
1106 1 45 HIS HD2 1 48 LYS HD3 . . 5.500 4.767 4.531 4.926 . 0 0 "[ . 1 . 2]" 1
1107 1 45 HIS HD2 1 48 LYS HE3 . . 5.130 4.764 4.628 4.851 . 0 0 "[ . 1 . 2]" 1
1108 1 45 HIS HD2 1 65 LEU MD2 . . 4.840 4.722 4.647 4.799 . 0 0 "[ . 1 . 2]" 1
1109 1 45 HIS HD2 1 74 ILE HA . . 5.020 3.549 3.297 3.814 . 0 0 "[ . 1 . 2]" 1
1110 1 45 HIS HD2 1 74 ILE MD . . 4.240 3.393 3.070 3.810 . 0 0 "[ . 1 . 2]" 1
1111 1 45 HIS HD2 1 74 ILE HG12 . . 4.520 4.530 4.516 4.546 0.026 16 0 "[ . 1 . 2]" 1
1112 1 45 HIS HD2 1 74 ILE HG13 . . 4.150 2.801 2.785 2.854 . 0 0 "[ . 1 . 2]" 1
1113 1 45 HIS HD2 1 74 ILE MG . . 4.920 4.123 4.006 4.233 . 0 0 "[ . 1 . 2]" 1
1114 1 45 HIS HD2 1 75 ASP HA . . 4.470 4.216 4.009 4.353 . 0 0 "[ . 1 . 2]" 1
1115 1 45 HIS HE1 1 69 MET ME . . 5.130 4.486 4.324 4.785 . 0 0 "[ . 1 . 2]" 1
1116 1 45 HIS HE1 1 74 ILE MD . . 5.500 5.157 5.016 5.493 . 0 0 "[ . 1 . 2]" 1
1117 1 45 HIS HE1 1 74 ILE HG12 . . 5.270 4.378 4.106 4.642 . 0 0 "[ . 1 . 2]" 1
1118 1 45 HIS HE1 1 74 ILE HG13 . . 5.270 3.812 3.645 4.303 . 0 0 "[ . 1 . 2]" 1
1119 1 45 HIS HE1 1 74 ILE MG . . 4.310 3.391 3.105 3.761 . 0 0 "[ . 1 . 2]" 1
1120 1 46 CYS H 1 46 CYS HB2 . . 3.650 2.561 2.495 2.600 . 0 0 "[ . 1 . 2]" 1
1121 1 46 CYS H 1 46 CYS HB3 . . 3.950 3.571 3.565 3.575 . 0 0 "[ . 1 . 2]" 1
1122 1 46 CYS H 1 46 CYS HG . . 3.070 2.555 1.933 2.954 . 0 0 "[ . 1 . 2]" 1
1123 1 46 CYS H 1 47 GLN H . . 3.450 2.832 2.740 2.916 . 0 0 "[ . 1 . 2]" 1
1124 1 46 CYS H 1 47 GLN HB2 . . 5.270 4.987 4.913 5.079 . 0 0 "[ . 1 . 2]" 1
1125 1 46 CYS H 1 47 GLN HG3 . . 5.430 4.553 4.384 4.779 . 0 0 "[ . 1 . 2]" 1
1126 1 46 CYS H 1 48 LYS H . . 4.660 4.648 4.553 4.681 0.021 11 0 "[ . 1 . 2]" 1
1127 1 46 CYS H 1 49 ALA MB . . 5.500 4.372 4.302 4.469 . 0 0 "[ . 1 . 2]" 1
1128 1 46 CYS H 1 65 LEU MD1 . . 4.920 3.798 3.546 4.008 . 0 0 "[ . 1 . 2]" 1
1129 1 46 CYS H 1 65 LEU MD2 . . 4.310 3.077 2.961 3.248 . 0 0 "[ . 1 . 2]" 1
1130 1 46 CYS HA 1 48 LYS H . . 5.190 5.023 4.909 5.083 . 0 0 "[ . 1 . 2]" 1
1131 1 46 CYS HA 1 49 ALA H . . 4.120 3.954 3.855 4.055 . 0 0 "[ . 1 . 2]" 1
1132 1 46 CYS HA 1 49 ALA MB . . 3.340 2.724 2.580 2.833 . 0 0 "[ . 1 . 2]" 1
1133 1 46 CYS HA 1 50 ALA H . . 4.430 3.969 3.827 4.297 . 0 0 "[ . 1 . 2]" 1
1134 1 46 CYS HA 1 50 ALA MB . . 5.500 4.608 4.346 5.017 . 0 0 "[ . 1 . 2]" 1
1135 1 46 CYS HA 1 65 LEU MD1 . . 3.650 1.952 1.915 1.964 . 0 0 "[ . 1 . 2]" 1
1136 1 46 CYS HA 1 65 LEU MD2 . . 3.910 2.928 2.690 3.114 . 0 0 "[ . 1 . 2]" 1
1137 1 46 CYS HB2 1 47 GLN H . . 3.710 2.813 2.633 3.033 . 0 0 "[ . 1 . 2]" 1
1138 1 46 CYS HB2 1 47 GLN HB2 . . 5.130 5.013 4.891 5.141 0.011 18 0 "[ . 1 . 2]" 1
1139 1 46 CYS HB2 1 47 GLN HG3 . . 4.920 3.451 3.247 3.665 . 0 0 "[ . 1 . 2]" 1
1140 1 46 CYS HB3 1 47 GLN H . . 4.380 3.830 3.657 3.973 . 0 0 "[ . 1 . 2]" 1
1141 1 46 CYS HB3 1 47 GLN HA . . 4.920 4.459 4.368 4.528 . 0 0 "[ . 1 . 2]" 1
1142 1 46 CYS HB3 1 49 ALA MB . . 4.920 4.598 4.427 4.712 . 0 0 "[ . 1 . 2]" 1
1143 1 46 CYS HB3 1 50 ALA H . . 5.500 5.080 4.909 5.300 . 0 0 "[ . 1 . 2]" 1
1144 1 46 CYS HB3 1 65 LEU MD2 . . 5.430 4.899 4.703 5.143 . 0 0 "[ . 1 . 2]" 1
1145 1 47 GLN H 1 47 GLN HB2 . . 3.380 2.396 2.367 2.449 . 0 0 "[ . 1 . 2]" 1
1146 1 47 GLN H 1 47 GLN HB3 . . 3.840 3.547 3.537 3.555 . 0 0 "[ . 1 . 2]" 1
1147 1 47 GLN H 1 47 GLN HE21 . . 5.500 4.626 3.652 5.341 . 0 0 "[ . 1 . 2]" 1
1148 1 47 GLN H 1 47 GLN HG2 . . 4.110 3.442 3.209 3.640 . 0 0 "[ . 1 . 2]" 1
1149 1 47 GLN H 1 47 GLN HG3 . . 3.370 2.297 2.152 2.499 . 0 0 "[ . 1 . 2]" 1
1150 1 47 GLN H 1 48 LYS H . . 3.590 2.779 2.659 2.885 . 0 0 "[ . 1 . 2]" 1
1151 1 47 GLN H 1 48 LYS HA . . 5.340 5.280 5.180 5.365 0.025 19 0 "[ . 1 . 2]" 1
1152 1 47 GLN H 1 48 LYS HG3 . . 5.340 4.715 4.621 4.823 . 0 0 "[ . 1 . 2]" 1
1153 1 47 GLN H 1 50 ALA H . . 5.420 5.030 4.848 5.272 . 0 0 "[ . 1 . 2]" 1
1154 1 47 GLN H 1 50 ALA MB . . 5.500 4.965 4.795 5.247 . 0 0 "[ . 1 . 2]" 1
1155 1 47 GLN H 1 51 ILE MD . . 5.500 5.446 5.378 5.509 0.009 19 0 "[ . 1 . 2]" 1
1156 1 47 GLN HA 1 47 GLN HG2 . . 3.590 2.450 2.289 2.611 . 0 0 "[ . 1 . 2]" 1
1157 1 47 GLN HA 1 47 GLN HG3 . . 3.870 2.977 2.709 3.212 . 0 0 "[ . 1 . 2]" 1
1158 1 47 GLN HA 1 49 ALA H . . 4.920 4.839 4.655 4.950 0.030 19 0 "[ . 1 . 2]" 1
1159 1 47 GLN HA 1 50 ALA H . . 4.490 3.999 3.819 4.127 . 0 0 "[ . 1 . 2]" 1
1160 1 47 GLN HA 1 50 ALA MB . . 3.660 3.055 2.896 3.330 . 0 0 "[ . 1 . 2]" 1
1161 1 47 GLN HA 1 51 ILE H . . 4.920 3.899 3.657 4.264 . 0 0 "[ . 1 . 2]" 1
1162 1 47 GLN HA 1 51 ILE MD . . 4.570 3.993 3.884 4.198 . 0 0 "[ . 1 . 2]" 1
1163 1 47 GLN HA 1 51 ILE HG12 . . 5.500 5.256 5.043 5.524 0.024 20 0 "[ . 1 . 2]" 1
1164 1 47 GLN HA 1 78 ILE MD . . 5.430 4.164 4.021 4.291 . 0 0 "[ . 1 . 2]" 1
1165 1 47 GLN HB2 1 48 LYS H . . 3.680 2.320 2.267 2.378 . 0 0 "[ . 1 . 2]" 1
1166 1 47 GLN HB2 1 48 LYS HA . . 5.500 4.277 4.199 4.331 . 0 0 "[ . 1 . 2]" 1
1167 1 47 GLN HB2 1 48 LYS HG3 . . 5.430 3.379 3.323 3.418 . 0 0 "[ . 1 . 2]" 1
1168 1 47 GLN HB2 1 51 ILE MD . . 4.690 3.914 3.787 3.988 . 0 0 "[ . 1 . 2]" 1
1169 1 47 GLN HB2 1 78 ILE MD . . 3.890 1.936 1.926 1.959 . 0 0 "[ . 1 . 2]" 1
1170 1 47 GLN HB2 1 78 ILE HG12 . . 5.500 4.353 4.283 4.415 . 0 0 "[ . 1 . 2]" 1
1171 1 47 GLN HB2 1 78 ILE HG13 . . 5.430 4.361 4.144 4.479 . 0 0 "[ . 1 . 2]" 1
1172 1 47 GLN HB3 1 47 GLN HE22 . . 5.500 4.250 3.993 4.460 . 0 0 "[ . 1 . 2]" 1
1173 1 47 GLN HB3 1 48 LYS H . . 4.120 3.299 3.243 3.341 . 0 0 "[ . 1 . 2]" 1
1174 1 47 GLN HB3 1 48 LYS HA . . 5.130 4.224 4.169 4.287 . 0 0 "[ . 1 . 2]" 1
1175 1 47 GLN HB3 1 51 ILE MD . . 3.960 2.629 2.515 2.728 . 0 0 "[ . 1 . 2]" 1
1176 1 47 GLN HB3 1 78 ILE MD . . 3.690 2.324 2.158 2.513 . 0 0 "[ . 1 . 2]" 1
1177 1 47 GLN HB3 1 78 ILE HG13 . . 5.430 5.099 4.803 5.349 . 0 0 "[ . 1 . 2]" 1
1178 1 47 GLN HB3 1 78 ILE MG . . 5.020 4.162 3.940 4.315 . 0 0 "[ . 1 . 2]" 1
1179 1 47 GLN HE21 1 51 ILE MD . . 5.430 5.358 5.180 5.461 0.031 13 0 "[ . 1 . 2]" 1
1180 1 47 GLN HE21 1 78 ILE MD . . 5.130 3.620 2.453 4.543 . 0 0 "[ . 1 . 2]" 1
1181 1 47 GLN HE22 1 78 ILE MD . . 5.130 3.584 2.860 4.155 . 0 0 "[ . 1 . 2]" 1
1182 1 47 GLN HG2 1 48 LYS H . . 5.260 4.897 4.806 4.974 . 0 0 "[ . 1 . 2]" 1
1183 1 47 GLN HG2 1 50 ALA MB . . 5.430 4.917 4.731 5.208 . 0 0 "[ . 1 . 2]" 1
1184 1 47 GLN HG2 1 51 ILE MD . . 4.760 4.501 4.290 4.757 . 0 0 "[ . 1 . 2]" 1
1185 1 47 GLN HG2 1 78 ILE MD . . 4.920 4.059 3.913 4.184 . 0 0 "[ . 1 . 2]" 1
1186 1 47 GLN HG3 1 48 LYS H . . 4.920 4.317 4.246 4.418 . 0 0 "[ . 1 . 2]" 1
1187 1 47 GLN HG3 1 51 ILE MD . . 5.430 5.314 5.194 5.427 . 0 0 "[ . 1 . 2]" 1
1188 1 47 GLN HG3 1 78 ILE MD . . 5.270 3.870 3.674 4.004 . 0 0 "[ . 1 . 2]" 1
1189 1 48 LYS H 1 48 LYS HB2 . . 3.330 2.365 2.336 2.408 . 0 0 "[ . 1 . 2]" 1
1190 1 48 LYS H 1 48 LYS HB3 . . 3.970 3.527 3.521 3.535 . 0 0 "[ . 1 . 2]" 1
1191 1 48 LYS H 1 48 LYS HD2 . . 4.760 3.856 3.779 3.996 . 0 0 "[ . 1 . 2]" 1
1192 1 48 LYS H 1 48 LYS HD3 . . 4.840 4.559 4.487 4.608 . 0 0 "[ . 1 . 2]" 1
1193 1 48 LYS H 1 48 LYS HE2 . . 5.020 5.009 4.955 5.034 0.014 12 0 "[ . 1 . 2]" 1
1194 1 48 LYS H 1 48 LYS HG2 . . 4.110 3.497 3.338 3.555 . 0 0 "[ . 1 . 2]" 1
1195 1 48 LYS H 1 48 LYS HG3 . . 3.440 2.253 2.184 2.306 . 0 0 "[ . 1 . 2]" 1
1196 1 48 LYS H 1 49 ALA H . . 3.290 2.979 2.927 3.059 . 0 0 "[ . 1 . 2]" 1
1197 1 48 LYS H 1 49 ALA HA . . 5.500 5.439 5.405 5.485 . 0 0 "[ . 1 . 2]" 1
1198 1 48 LYS H 1 51 ILE HB . . 4.540 4.645 4.587 4.678 0.138 18 0 "[ . 1 . 2]" 1
1199 1 48 LYS H 1 51 ILE MD . . 4.840 4.191 4.035 4.270 . 0 0 "[ . 1 . 2]" 1
1200 1 48 LYS H 1 65 LEU MD2 . . 5.430 5.176 5.083 5.396 . 0 0 "[ . 1 . 2]" 1
1201 1 48 LYS H 1 78 ILE MD . . 4.430 2.500 2.423 2.559 . 0 0 "[ . 1 . 2]" 1
1202 1 48 LYS HA 1 48 LYS HD2 . . 5.270 4.644 4.616 4.695 . 0 0 "[ . 1 . 2]" 1
1203 1 48 LYS HA 1 48 LYS HD3 . . 4.340 4.338 4.262 4.367 0.027 14 0 "[ . 1 . 2]" 1
1204 1 48 LYS HA 1 48 LYS HE2 . . 5.130 4.558 4.477 4.592 . 0 0 "[ . 1 . 2]" 1
1205 1 48 LYS HA 1 48 LYS HG2 . . 3.580 2.412 2.360 2.451 . 0 0 "[ . 1 . 2]" 1
1206 1 48 LYS HA 1 48 LYS HG3 . . 3.820 2.816 2.783 2.948 . 0 0 "[ . 1 . 2]" 1
1207 1 48 LYS HA 1 50 ALA H . . 5.190 5.082 4.975 5.151 . 0 0 "[ . 1 . 2]" 1
1208 1 48 LYS HA 1 51 ILE H . . 4.380 3.697 3.385 3.817 . 0 0 "[ . 1 . 2]" 1
1209 1 48 LYS HA 1 51 ILE HB . . 3.350 2.359 2.113 2.519 . 0 0 "[ . 1 . 2]" 1
1210 1 48 LYS HA 1 51 ILE MD . . 3.540 2.925 2.779 3.075 . 0 0 "[ . 1 . 2]" 1
1211 1 48 LYS HA 1 51 ILE HG12 . . 5.200 4.946 4.596 5.158 . 0 0 "[ . 1 . 2]" 1
1212 1 48 LYS HA 1 51 ILE HG13 . . 3.980 3.803 3.379 4.005 0.025 11 0 "[ . 1 . 2]" 1
1213 1 48 LYS HA 1 52 ASN H . . 4.570 3.493 3.430 3.607 . 0 0 "[ . 1 . 2]" 1
1214 1 48 LYS HA 1 52 ASN HD21 . . 4.920 3.222 2.989 4.447 . 0 0 "[ . 1 . 2]" 1
1215 1 48 LYS HA 1 52 ASN HD22 . . 4.920 3.958 3.267 4.133 . 0 0 "[ . 1 . 2]" 1
1216 1 48 LYS HA 1 78 ILE MD . . 4.050 3.309 3.160 3.401 . 0 0 "[ . 1 . 2]" 1
1217 1 48 LYS HA 1 78 ILE HG12 . . 5.500 3.575 3.373 3.782 . 0 0 "[ . 1 . 2]" 1
1218 1 48 LYS HA 1 78 ILE MG . . 5.020 4.471 4.188 4.859 . 0 0 "[ . 1 . 2]" 1
1219 1 48 LYS HB2 1 48 LYS HD2 . . 3.810 2.687 2.627 2.784 . 0 0 "[ . 1 . 2]" 1
1220 1 48 LYS HB2 1 48 LYS HE2 . . 4.570 4.517 4.502 4.550 . 0 0 "[ . 1 . 2]" 1
1221 1 48 LYS HB2 1 49 ALA H . . 3.770 2.489 2.387 2.600 . 0 0 "[ . 1 . 2]" 1
1222 1 48 LYS HB2 1 49 ALA MB . . 5.020 4.040 3.999 4.094 . 0 0 "[ . 1 . 2]" 1
1223 1 48 LYS HB2 1 50 ALA H . . 5.500 5.540 5.516 5.571 0.071 16 0 "[ . 1 . 2]" 1
1224 1 48 LYS HB2 1 52 ASN H . . 5.500 5.329 5.153 5.402 . 0 0 "[ . 1 . 2]" 1
1225 1 48 LYS HB2 1 52 ASN HD21 . . 5.500 4.084 3.805 5.534 0.034 20 0 "[ . 1 . 2]" 1
1226 1 48 LYS HB2 1 52 ASN HD22 . . 5.500 4.421 3.907 4.614 . 0 0 "[ . 1 . 2]" 1
1227 1 48 LYS HB2 1 64 TRP HH2 . . 4.520 3.547 3.407 3.742 . 0 0 "[ . 1 . 2]" 1
1228 1 48 LYS HB2 1 64 TRP HZ3 . . 4.760 3.310 2.965 3.419 . 0 0 "[ . 1 . 2]" 1
1229 1 48 LYS HB2 1 65 LEU MD2 . . 5.270 4.597 4.366 4.731 . 0 0 "[ . 1 . 2]" 1
1230 1 48 LYS HB2 1 74 ILE MD . . 4.760 3.282 3.142 3.448 . 0 0 "[ . 1 . 2]" 1
1231 1 48 LYS HB3 1 48 LYS HD3 . . 3.660 2.438 2.345 2.467 . 0 0 "[ . 1 . 2]" 1
1232 1 48 LYS HB3 1 48 LYS HE2 . . 4.470 4.196 4.083 4.270 . 0 0 "[ . 1 . 2]" 1
1233 1 48 LYS HB3 1 49 ALA H . . 4.110 3.295 3.228 3.392 . 0 0 "[ . 1 . 2]" 1
1234 1 48 LYS HB3 1 49 ALA HA . . 5.500 4.239 4.206 4.273 . 0 0 "[ . 1 . 2]" 1
1235 1 48 LYS HB3 1 51 ILE MD . . 5.430 5.054 4.777 5.265 . 0 0 "[ . 1 . 2]" 1
1236 1 48 LYS HB3 1 52 ASN HD21 . . 4.570 2.659 2.431 3.881 . 0 0 "[ . 1 . 2]" 1
1237 1 48 LYS HB3 1 52 ASN HD22 . . 4.760 2.707 2.191 2.884 . 0 0 "[ . 1 . 2]" 1
1238 1 48 LYS HB3 1 64 TRP HH2 . . 4.240 3.008 2.942 3.055 . 0 0 "[ . 1 . 2]" 1
1239 1 48 LYS HB3 1 64 TRP HZ2 . . 5.270 4.005 3.868 4.506 . 0 0 "[ . 1 . 2]" 1
1240 1 48 LYS HB3 1 64 TRP HZ3 . . 5.270 3.718 3.233 3.877 . 0 0 "[ . 1 . 2]" 1
1241 1 48 LYS HB3 1 74 ILE MD . . 4.840 3.941 3.757 4.105 . 0 0 "[ . 1 . 2]" 1
1242 1 48 LYS HB3 1 78 ILE MD . . 5.270 4.530 4.449 4.596 . 0 0 "[ . 1 . 2]" 1
1243 1 48 LYS HD2 1 64 TRP HH2 . . 4.470 4.256 4.190 4.314 . 0 0 "[ . 1 . 2]" 1
1244 1 48 LYS HD2 1 64 TRP HZ3 . . 5.500 4.922 4.599 5.032 . 0 0 "[ . 1 . 2]" 1
1245 1 48 LYS HD2 1 74 ILE HA . . 4.520 3.406 3.018 3.580 . 0 0 "[ . 1 . 2]" 1
1246 1 48 LYS HD2 1 74 ILE MD . . 3.850 3.613 3.412 3.814 . 0 0 "[ . 1 . 2]" 1
1247 1 48 LYS HD2 1 74 ILE HG13 . . 5.430 4.758 4.211 5.004 . 0 0 "[ . 1 . 2]" 1
1248 1 48 LYS HD2 1 78 ILE MD . . 4.920 3.898 3.798 4.087 . 0 0 "[ . 1 . 2]" 1
1249 1 48 LYS HD3 1 52 ASN HD21 . . 5.340 4.808 4.671 5.352 0.012 20 0 "[ . 1 . 2]" 1
1250 1 48 LYS HD3 1 64 TRP HH2 . . 4.340 3.127 3.015 3.204 . 0 0 "[ . 1 . 2]" 1
1251 1 48 LYS HD3 1 64 TRP HZ2 . . 5.500 4.697 4.570 5.003 . 0 0 "[ . 1 . 2]" 1
1252 1 48 LYS HD3 1 74 ILE HA . . 4.840 3.394 3.087 3.551 . 0 0 "[ . 1 . 2]" 1
1253 1 48 LYS HD3 1 74 ILE MD . . 4.210 3.639 3.449 3.947 . 0 0 "[ . 1 . 2]" 1
1254 1 48 LYS HD3 1 78 ILE MD . . 4.840 4.669 4.621 4.793 . 0 0 "[ . 1 . 2]" 1
1255 1 48 LYS HE2 1 48 LYS HG2 . . 3.640 2.183 2.127 2.234 . 0 0 "[ . 1 . 2]" 1
1256 1 48 LYS HE2 1 48 LYS HG3 . . 3.850 2.769 2.675 2.905 . 0 0 "[ . 1 . 2]" 1
1257 1 48 LYS HE2 1 78 ILE HA . . 4.270 2.219 2.026 2.587 . 0 0 "[ . 1 . 2]" 1
1258 1 48 LYS HE2 1 78 ILE HB . . 5.430 4.136 3.953 4.452 . 0 0 "[ . 1 . 2]" 1
1259 1 48 LYS HE2 1 78 ILE MD . . 4.310 3.557 3.446 3.675 . 0 0 "[ . 1 . 2]" 1
1260 1 48 LYS HE2 1 78 ILE HG12 . . 3.980 2.110 1.997 2.350 . 0 0 "[ . 1 . 2]" 1
1261 1 48 LYS HE2 1 78 ILE HG13 . . 3.430 2.169 1.997 2.544 . 0 0 "[ . 1 . 2]" 1
1262 1 48 LYS HE2 1 78 ILE MG . . 4.240 3.695 3.478 3.847 . 0 0 "[ . 1 . 2]" 1
1263 1 48 LYS HE3 1 74 ILE HA . . 5.430 4.828 4.532 5.023 . 0 0 "[ . 1 . 2]" 1
1264 1 48 LYS HE3 1 77 PRO HA . . 5.430 3.339 3.029 3.590 . 0 0 "[ . 1 . 2]" 1
1265 1 48 LYS HE3 1 78 ILE H . . 5.270 3.517 3.385 3.813 . 0 0 "[ . 1 . 2]" 1
1266 1 48 LYS HG2 1 49 ALA H . . 5.020 5.002 4.926 5.048 0.028 11 0 "[ . 1 . 2]" 1
1267 1 48 LYS HG2 1 51 ILE MD . . 5.270 3.910 3.568 4.094 . 0 0 "[ . 1 . 2]" 1
1268 1 48 LYS HG2 1 52 ASN H . . 5.500 5.469 5.413 5.524 0.024 16 0 "[ . 1 . 2]" 1
1269 1 48 LYS HG2 1 52 ASN HD21 . . 5.190 4.261 4.063 5.125 . 0 0 "[ . 1 . 2]" 1
1270 1 48 LYS HG2 1 52 ASN HD22 . . 5.500 4.075 3.581 4.234 . 0 0 "[ . 1 . 2]" 1
1271 1 48 LYS HG2 1 64 TRP HH2 . . 5.020 5.031 5.013 5.043 0.023 3 0 "[ . 1 . 2]" 1
1272 1 48 LYS HG2 1 78 ILE HA . . 5.500 3.783 3.556 4.017 . 0 0 "[ . 1 . 2]" 1
1273 1 48 LYS HG2 1 78 ILE MD . . 4.150 3.061 2.837 3.158 . 0 0 "[ . 1 . 2]" 1
1274 1 48 LYS HG2 1 78 ILE HG12 . . 4.570 2.034 1.995 2.296 . 0 0 "[ . 1 . 2]" 1
1275 1 48 LYS HG2 1 78 ILE HG13 . . 4.380 3.095 2.744 3.431 . 0 0 "[ . 1 . 2]" 1
1276 1 48 LYS HG3 1 49 ALA H . . 4.540 4.500 4.420 4.548 0.008 11 0 "[ . 1 . 2]" 1
1277 1 48 LYS HG3 1 51 ILE MD . . 4.840 4.217 4.140 4.358 . 0 0 "[ . 1 . 2]" 1
1278 1 48 LYS HG3 1 52 ASN HD22 . . 5.500 5.380 4.824 5.505 0.005 16 0 "[ . 1 . 2]" 1
1279 1 48 LYS HG3 1 64 TRP HH2 . . 5.430 5.439 5.385 5.457 0.027 11 0 "[ . 1 . 2]" 1
1280 1 48 LYS HG3 1 78 ILE MD . . 3.250 2.006 1.969 2.138 . 0 0 "[ . 1 . 2]" 1
1281 1 48 LYS HG3 1 78 ILE HG12 . . 3.980 2.235 2.045 2.426 . 0 0 "[ . 1 . 2]" 1
1282 1 48 LYS HG3 1 78 ILE HG13 . . 3.250 2.487 2.212 2.848 . 0 0 "[ . 1 . 2]" 1
1283 1 48 LYS HG3 1 78 ILE MG . . 5.500 4.101 3.887 4.281 . 0 0 "[ . 1 . 2]" 1
1284 1 49 ALA H 1 49 ALA MB . . 3.160 1.968 1.948 2.054 . 0 0 "[ . 1 . 2]" 1
1285 1 49 ALA H 1 50 ALA H . . 3.600 3.272 3.111 3.405 . 0 0 "[ . 1 . 2]" 1
1286 1 49 ALA H 1 64 TRP HE3 . . 5.190 3.586 3.474 3.695 . 0 0 "[ . 1 . 2]" 1
1287 1 49 ALA H 1 64 TRP HH2 . . 5.500 4.713 4.607 4.897 . 0 0 "[ . 1 . 2]" 1
1288 1 49 ALA H 1 64 TRP HZ3 . . 5.070 3.323 3.122 3.455 . 0 0 "[ . 1 . 2]" 1
1289 1 49 ALA H 1 65 LEU MD1 . . 5.500 3.668 3.441 3.917 . 0 0 "[ . 1 . 2]" 1
1290 1 49 ALA H 1 65 LEU MD2 . . 4.660 3.771 3.711 3.960 . 0 0 "[ . 1 . 2]" 1
1291 1 49 ALA H 1 65 LEU HG . . 5.500 3.577 3.479 3.707 . 0 0 "[ . 1 . 2]" 1
1292 1 49 ALA H 1 78 ILE MD . . 5.130 5.125 5.055 5.137 0.007 9 0 "[ . 1 . 2]" 1
1293 1 49 ALA HA 1 50 ALA HA . . 5.430 4.828 4.814 4.839 . 0 0 "[ . 1 . 2]" 1
1294 1 49 ALA HA 1 50 ALA MB . . 5.500 5.031 5.023 5.035 . 0 0 "[ . 1 . 2]" 1
1295 1 49 ALA HA 1 51 ILE H . . 5.500 4.914 4.691 5.044 . 0 0 "[ . 1 . 2]" 1
1296 1 49 ALA HA 1 52 ASN H . . 4.340 3.671 3.442 3.753 . 0 0 "[ . 1 . 2]" 1
1297 1 49 ALA HA 1 52 ASN HB2 . . 4.310 2.534 2.389 2.909 . 0 0 "[ . 1 . 2]" 1
1298 1 49 ALA HA 1 52 ASN HB3 . . 5.500 3.913 3.714 4.297 . 0 0 "[ . 1 . 2]" 1
1299 1 49 ALA HA 1 52 ASN HD21 . . 5.500 3.508 3.192 5.077 . 0 0 "[ . 1 . 2]" 1
1300 1 49 ALA HA 1 52 ASN HD22 . . 5.270 4.671 4.573 4.874 . 0 0 "[ . 1 . 2]" 1
1301 1 49 ALA HA 1 53 THR H . . 5.500 4.450 4.264 4.611 . 0 0 "[ . 1 . 2]" 1
1302 1 49 ALA HA 1 53 THR HG1 . . 5.500 4.606 3.690 5.039 . 0 0 "[ . 1 . 2]" 1
1303 1 49 ALA HA 1 53 THR MG . . 4.920 3.636 3.337 4.271 . 0 0 "[ . 1 . 2]" 1
1304 1 49 ALA HA 1 61 ALA HA . . 5.020 3.920 3.630 4.062 . 0 0 "[ . 1 . 2]" 1
1305 1 49 ALA HA 1 61 ALA MB . . 5.130 4.419 4.118 4.618 . 0 0 "[ . 1 . 2]" 1
1306 1 49 ALA HA 1 64 TRP HB2 . . 4.690 3.803 3.697 3.996 . 0 0 "[ . 1 . 2]" 1
1307 1 49 ALA HA 1 64 TRP HB3 . . 4.470 2.568 2.476 2.659 . 0 0 "[ . 1 . 2]" 1
1308 1 49 ALA HA 1 64 TRP HD1 . . 5.130 4.688 4.439 5.218 0.088 19 0 "[ . 1 . 2]" 1
1309 1 49 ALA HA 1 64 TRP HE3 . . 3.820 2.347 2.077 2.444 . 0 0 "[ . 1 . 2]" 1
1310 1 49 ALA HA 1 64 TRP HZ3 . . 5.020 3.658 3.425 3.764 . 0 0 "[ . 1 . 2]" 1
1311 1 49 ALA HA 1 65 LEU H . . 5.430 4.316 4.163 4.518 . 0 0 "[ . 1 . 2]" 1
1312 1 49 ALA HA 1 65 LEU HA . . 5.430 4.762 4.678 4.840 . 0 0 "[ . 1 . 2]" 1
1313 1 49 ALA HA 1 65 LEU MD2 . . 5.130 4.818 4.677 4.868 . 0 0 "[ . 1 . 2]" 1
1314 1 49 ALA HA 1 65 LEU HG . . 5.270 3.657 3.474 3.766 . 0 0 "[ . 1 . 2]" 1
1315 1 49 ALA MB 1 50 ALA H . . 3.350 2.103 2.030 2.205 . 0 0 "[ . 1 . 2]" 1
1316 1 49 ALA MB 1 50 ALA HA . . 4.920 3.585 3.574 3.599 . 0 0 "[ . 1 . 2]" 1
1317 1 49 ALA MB 1 52 ASN H . . 5.260 4.650 4.450 4.716 . 0 0 "[ . 1 . 2]" 1
1318 1 49 ALA MB 1 52 ASN HB2 . . 5.500 4.110 4.006 4.359 . 0 0 "[ . 1 . 2]" 1
1319 1 49 ALA MB 1 53 THR H . . 5.500 4.860 4.681 4.971 . 0 0 "[ . 1 . 2]" 1
1320 1 49 ALA MB 1 53 THR HG1 . . 5.270 4.248 3.737 4.565 . 0 0 "[ . 1 . 2]" 1
1321 1 49 ALA MB 1 53 THR MG . . 4.570 3.762 3.390 4.266 . 0 0 "[ . 1 . 2]" 1
1322 1 49 ALA MB 1 61 ALA H . . 5.500 4.620 4.282 4.748 . 0 0 "[ . 1 . 2]" 1
1323 1 49 ALA MB 1 61 ALA HA . . 3.740 2.628 2.372 2.756 . 0 0 "[ . 1 . 2]" 1
1324 1 49 ALA MB 1 61 ALA MB . . 3.200 2.227 1.917 2.430 . 0 0 "[ . 1 . 2]" 1
1325 1 49 ALA MB 1 62 MET H . . 5.500 4.055 3.783 4.191 . 0 0 "[ . 1 . 2]" 1
1326 1 49 ALA MB 1 62 MET HA . . 4.180 3.475 3.306 3.590 . 0 0 "[ . 1 . 2]" 1
1327 1 49 ALA MB 1 64 TRP H . . 4.870 3.792 3.649 3.961 . 0 0 "[ . 1 . 2]" 1
1328 1 49 ALA MB 1 64 TRP HA . . 5.430 4.766 4.567 5.171 . 0 0 "[ . 1 . 2]" 1
1329 1 49 ALA MB 1 64 TRP HB2 . . 4.570 3.895 3.720 4.203 . 0 0 "[ . 1 . 2]" 1
1330 1 49 ALA MB 1 64 TRP HB3 . . 3.920 2.363 2.166 2.775 . 0 0 "[ . 1 . 2]" 1
1331 1 49 ALA MB 1 64 TRP HE3 . . 3.440 1.975 1.921 2.265 . 0 0 "[ . 1 . 2]" 1
1332 1 49 ALA MB 1 64 TRP HH2 . . 5.500 5.111 5.011 5.488 . 0 0 "[ . 1 . 2]" 1
1333 1 49 ALA MB 1 64 TRP HZ3 . . 4.470 3.376 3.260 3.653 . 0 0 "[ . 1 . 2]" 1
1334 1 49 ALA MB 1 65 LEU H . . 3.650 2.585 2.469 2.774 . 0 0 "[ . 1 . 2]" 1
1335 1 49 ALA MB 1 65 LEU HA . . 4.470 3.391 3.288 3.679 . 0 0 "[ . 1 . 2]" 1
1336 1 49 ALA MB 1 65 LEU HB2 . . 4.050 3.369 3.321 3.462 . 0 0 "[ . 1 . 2]" 1
1337 1 49 ALA MB 1 65 LEU MD1 . . 3.190 1.728 1.657 1.845 . 0 0 "[ . 1 . 2]" 1
1338 1 49 ALA MB 1 65 LEU MD2 . . 3.540 2.775 2.630 3.030 . 0 0 "[ . 1 . 2]" 1
1339 1 50 ALA H 1 50 ALA MB . . 2.960 2.145 2.025 2.174 . 0 0 "[ . 1 . 2]" 1
1340 1 50 ALA H 1 51 ILE H . . 3.470 3.080 2.972 3.134 . 0 0 "[ . 1 . 2]" 1
1341 1 50 ALA H 1 51 ILE HA . . 5.500 5.517 5.449 5.553 0.053 13 0 "[ . 1 . 2]" 1
1342 1 50 ALA H 1 51 ILE HB . . 5.020 5.004 4.975 5.033 0.013 17 0 "[ . 1 . 2]" 1
1343 1 50 ALA H 1 53 THR H . . 5.500 4.680 4.556 4.732 . 0 0 "[ . 1 . 2]" 1
1344 1 50 ALA H 1 53 THR HG1 . . 5.500 4.093 3.795 4.280 . 0 0 "[ . 1 . 2]" 1
1345 1 50 ALA H 1 55 ASN H . . 5.500 5.253 5.111 5.422 . 0 0 "[ . 1 . 2]" 1
1346 1 50 ALA H 1 61 ALA HA . . 5.500 3.504 3.378 3.601 . 0 0 "[ . 1 . 2]" 1
1347 1 50 ALA H 1 61 ALA MB . . 4.240 2.273 2.153 2.550 . 0 0 "[ . 1 . 2]" 1
1348 1 50 ALA HA 1 52 ASN H . . 5.260 4.737 4.518 4.831 . 0 0 "[ . 1 . 2]" 1
1349 1 50 ALA HA 1 53 THR H . . 4.000 3.363 3.219 3.432 . 0 0 "[ . 1 . 2]" 1
1350 1 50 ALA HA 1 53 THR HB . . 5.130 4.517 4.130 4.772 . 0 0 "[ . 1 . 2]" 1
1351 1 50 ALA HA 1 53 THR HG1 . . 3.510 2.059 1.993 2.508 . 0 0 "[ . 1 . 2]" 1
1352 1 50 ALA HA 1 53 THR MG . . 4.760 3.674 3.171 4.223 . 0 0 "[ . 1 . 2]" 1
1353 1 50 ALA HA 1 55 ASN H . . 3.510 3.044 2.839 3.249 . 0 0 "[ . 1 . 2]" 1
1354 1 50 ALA HA 1 55 ASN HA . . 4.380 2.664 2.586 2.751 . 0 0 "[ . 1 . 2]" 1
1355 1 50 ALA HA 1 61 ALA H . . 4.690 3.832 3.746 4.005 . 0 0 "[ . 1 . 2]" 1
1356 1 50 ALA HA 1 61 ALA HA . . 4.430 2.653 2.573 2.948 . 0 0 "[ . 1 . 2]" 1
1357 1 50 ALA HA 1 61 ALA MB . . 3.390 2.113 1.949 2.288 . 0 0 "[ . 1 . 2]" 1
1358 1 50 ALA MB 1 51 ILE H . . 2.840 2.235 2.169 2.363 . 0 0 "[ . 1 . 2]" 1
1359 1 50 ALA MB 1 51 ILE HA . . 4.570 3.753 3.675 3.786 . 0 0 "[ . 1 . 2]" 1
1360 1 50 ALA MB 1 52 ASN H . . 4.690 4.558 4.433 4.625 . 0 0 "[ . 1 . 2]" 1
1361 1 50 ALA MB 1 53 THR H . . 5.260 4.302 4.253 4.349 . 0 0 "[ . 1 . 2]" 1
1362 1 50 ALA MB 1 53 THR HG1 . . 5.020 3.684 3.559 4.060 . 0 0 "[ . 1 . 2]" 1
1363 1 50 ALA MB 1 54 SER H . . 5.500 5.255 5.065 5.497 . 0 0 "[ . 1 . 2]" 1
1364 1 50 ALA MB 1 55 ASN H . . 4.630 3.170 2.955 3.448 . 0 0 "[ . 1 . 2]" 1
1365 1 50 ALA MB 1 55 ASN HA . . 3.740 2.353 2.150 2.535 . 0 0 "[ . 1 . 2]" 1
1366 1 50 ALA MB 1 55 ASN HB2 . . 5.500 3.807 3.523 4.128 . 0 0 "[ . 1 . 2]" 1
1367 1 50 ALA MB 1 55 ASN HB3 . . 5.270 2.360 1.997 3.122 . 0 0 "[ . 1 . 2]" 1
1368 1 50 ALA MB 1 55 ASN HD21 . . 5.500 2.449 1.890 4.413 . 0 0 "[ . 1 . 2]" 1
1369 1 50 ALA MB 1 55 ASN HD22 . . 4.760 3.695 3.225 4.203 . 0 0 "[ . 1 . 2]" 1
1370 1 51 ILE H 1 51 ILE HB . . 3.230 2.398 2.362 2.426 . 0 0 "[ . 1 . 2]" 1
1371 1 51 ILE H 1 51 ILE MD . . 3.540 3.579 3.553 3.599 0.059 19 0 "[ . 1 . 2]" 1
1372 1 51 ILE H 1 51 ILE HG12 . . 3.490 3.258 3.199 3.308 . 0 0 "[ . 1 . 2]" 1
1373 1 51 ILE H 1 51 ILE HG13 . . 3.840 2.069 2.030 2.123 . 0 0 "[ . 1 . 2]" 1
1374 1 51 ILE H 1 51 ILE MG . . 3.780 3.702 3.694 3.708 . 0 0 "[ . 1 . 2]" 1
1375 1 51 ILE H 1 52 ASN H . . 3.630 2.986 2.798 3.038 . 0 0 "[ . 1 . 2]" 1
1376 1 51 ILE H 1 52 ASN HD21 . . 5.500 4.844 4.670 5.528 0.028 20 0 "[ . 1 . 2]" 1
1377 1 51 ILE H 1 53 THR H . . 5.130 3.930 3.762 4.099 . 0 0 "[ . 1 . 2]" 1
1378 1 51 ILE H 1 53 THR HG1 . . 5.500 4.420 4.234 4.646 . 0 0 "[ . 1 . 2]" 1
1379 1 51 ILE H 1 55 ASN H . . 5.500 4.169 4.092 4.270 . 0 0 "[ . 1 . 2]" 1
1380 1 51 ILE H 1 55 ASN HD21 . . 5.500 3.615 2.994 5.503 0.003 11 0 "[ . 1 . 2]" 1
1381 1 51 ILE H 1 61 ALA HA . . 5.500 5.558 5.533 5.597 0.097 8 0 "[ . 1 . 2]" 1
1382 1 51 ILE HA 1 51 ILE MD . . 4.150 3.766 3.758 3.777 . 0 0 "[ . 1 . 2]" 1
1383 1 51 ILE HA 1 51 ILE HG12 . . 3.240 2.411 2.398 2.430 . 0 0 "[ . 1 . 2]" 1
1384 1 51 ILE HA 1 51 ILE HG13 . . 3.450 2.967 2.935 3.030 . 0 0 "[ . 1 . 2]" 1
1385 1 51 ILE HA 1 51 ILE MG . . 3.100 2.550 2.489 2.575 . 0 0 "[ . 1 . 2]" 1
1386 1 51 ILE HA 1 52 ASN HA . . 5.500 4.814 4.740 4.839 . 0 0 "[ . 1 . 2]" 1
1387 1 51 ILE HA 1 53 THR H . . 4.570 3.836 3.566 4.177 . 0 0 "[ . 1 . 2]" 1
1388 1 51 ILE HA 1 54 SER H . . 4.340 3.329 3.201 3.461 . 0 0 "[ . 1 . 2]" 1
1389 1 51 ILE HA 1 54 SER HA . . 4.430 3.031 2.948 3.110 . 0 0 "[ . 1 . 2]" 1
1390 1 51 ILE HA 1 55 ASN H . . 4.690 3.332 3.215 3.488 . 0 0 "[ . 1 . 2]" 1
1391 1 51 ILE HA 1 55 ASN HD21 . . 5.270 2.967 2.641 3.665 . 0 0 "[ . 1 . 2]" 1
1392 1 51 ILE HA 1 55 ASN HD22 . . 4.470 2.663 2.058 3.410 . 0 0 "[ . 1 . 2]" 1
1393 1 51 ILE HB 1 51 ILE MD . . 2.840 2.326 2.287 2.403 . 0 0 "[ . 1 . 2]" 1
1394 1 51 ILE HB 1 51 ILE HG13 . . 2.870 2.437 2.423 2.451 . 0 0 "[ . 1 . 2]" 1
1395 1 51 ILE HB 1 52 ASN H . . 3.500 2.484 2.435 2.640 . 0 0 "[ . 1 . 2]" 1
1396 1 51 ILE HB 1 52 ASN HA . . 5.130 4.357 4.314 4.400 . 0 0 "[ . 1 . 2]" 1
1397 1 51 ILE HB 1 52 ASN HD21 . . 5.070 3.695 3.531 4.023 . 0 0 "[ . 1 . 2]" 1
1398 1 51 ILE HB 1 52 ASN HD22 . . 5.430 4.744 3.676 5.023 . 0 0 "[ . 1 . 2]" 1
1399 1 51 ILE HB 1 53 THR H . . 5.500 4.684 4.582 4.895 . 0 0 "[ . 1 . 2]" 1
1400 1 51 ILE MD 1 52 ASN H . . 5.130 4.466 4.399 4.645 . 0 0 "[ . 1 . 2]" 1
1401 1 51 ILE HG12 1 52 ASN H . . 5.020 4.976 4.953 5.028 0.008 20 0 "[ . 1 . 2]" 1
1402 1 51 ILE HG12 1 55 ASN HD22 . . 5.340 3.076 2.616 3.670 . 0 0 "[ . 1 . 2]" 1
1403 1 51 ILE HG13 1 52 ASN H . . 5.070 4.372 4.338 4.400 . 0 0 "[ . 1 . 2]" 1
1404 1 51 ILE HG13 1 55 ASN H . . 5.500 5.437 5.323 5.514 0.014 8 0 "[ . 1 . 2]" 1
1405 1 51 ILE HG13 1 55 ASN HD21 . . 5.500 3.886 3.513 5.391 . 0 0 "[ . 1 . 2]" 1
1406 1 51 ILE HG13 1 55 ASN HD22 . . 5.500 3.930 3.314 4.619 . 0 0 "[ . 1 . 2]" 1
1407 1 51 ILE MG 1 52 ASN H . . 3.820 3.123 3.025 3.395 . 0 0 "[ . 1 . 2]" 1
1408 1 51 ILE MG 1 52 ASN HA . . 3.840 3.227 3.122 3.439 . 0 0 "[ . 1 . 2]" 1
1409 1 51 ILE MG 1 52 ASN HD21 . . 4.830 4.035 3.413 4.271 . 0 0 "[ . 1 . 2]" 1
1410 1 51 ILE MG 1 52 ASN HD22 . . 5.130 4.539 3.644 4.851 . 0 0 "[ . 1 . 2]" 1
1411 1 51 ILE MG 1 53 THR H . . 5.270 4.472 4.357 4.753 . 0 0 "[ . 1 . 2]" 1
1412 1 51 ILE MG 1 54 SER H . . 5.260 3.957 3.855 4.135 . 0 0 "[ . 1 . 2]" 1
1413 1 51 ILE MG 1 54 SER HA . . 4.310 4.165 4.066 4.318 0.008 19 0 "[ . 1 . 2]" 1
1414 1 51 ILE MG 1 55 ASN H . . 5.430 5.135 5.008 5.290 . 0 0 "[ . 1 . 2]" 1
1415 1 51 ILE MG 1 55 ASN HD21 . . 5.500 4.845 4.611 5.351 . 0 0 "[ . 1 . 2]" 1
1416 1 51 ILE MG 1 55 ASN HD22 . . 5.020 4.247 3.913 4.850 . 0 0 "[ . 1 . 2]" 1
1417 1 52 ASN H 1 52 ASN HB2 . . 3.320 2.244 2.119 2.810 . 0 0 "[ . 1 . 2]" 1
1418 1 52 ASN H 1 52 ASN HB3 . . 4.150 3.474 3.423 3.514 . 0 0 "[ . 1 . 2]" 1
1419 1 52 ASN H 1 52 ASN HD21 . . 4.540 2.429 2.264 3.068 . 0 0 "[ . 1 . 2]" 1
1420 1 52 ASN H 1 52 ASN HD22 . . 4.150 3.812 3.288 4.059 . 0 0 "[ . 1 . 2]" 1
1421 1 52 ASN H 1 53 THR H . . 3.620 2.771 2.622 2.823 . 0 0 "[ . 1 . 2]" 1
1422 1 52 ASN H 1 53 THR HG1 . . 5.020 4.219 3.489 4.391 . 0 0 "[ . 1 . 2]" 1
1423 1 52 ASN H 1 53 THR MG . . 4.720 4.167 3.806 4.728 0.008 13 0 "[ . 1 . 2]" 1
1424 1 52 ASN H 1 54 SER H . . 4.570 4.236 4.120 4.366 . 0 0 "[ . 1 . 2]" 1
1425 1 52 ASN HA 1 52 ASN HD22 . . 5.270 3.918 3.746 4.017 . 0 0 "[ . 1 . 2]" 1
1426 1 52 ASN HA 1 53 THR HG1 . . 5.500 5.411 4.813 5.517 0.017 18 0 "[ . 1 . 2]" 1
1427 1 52 ASN HA 1 53 THR MG . . 5.430 4.348 4.119 4.660 . 0 0 "[ . 1 . 2]" 1
1428 1 52 ASN HA 1 54 SER H . . 4.420 3.869 3.801 3.950 . 0 0 "[ . 1 . 2]" 1
1429 1 52 ASN HA 1 64 TRP HE1 . . 5.270 4.688 4.510 4.826 . 0 0 "[ . 1 . 2]" 1
1430 1 52 ASN HB2 1 52 ASN HD22 . . 4.050 3.570 3.488 4.158 0.108 19 0 "[ . 1 . 2]" 1
1431 1 52 ASN HB2 1 53 THR H . . 4.600 3.097 2.940 3.338 . 0 0 "[ . 1 . 2]" 1
1432 1 52 ASN HB2 1 53 THR MG . . 4.630 3.052 2.406 3.623 . 0 0 "[ . 1 . 2]" 1
1433 1 52 ASN HB2 1 64 TRP HD1 . . 5.130 3.656 3.314 3.821 . 0 0 "[ . 1 . 2]" 1
1434 1 52 ASN HB2 1 64 TRP HE1 . . 4.830 3.772 3.489 3.974 . 0 0 "[ . 1 . 2]" 1
1435 1 52 ASN HB2 1 64 TRP HH2 . . 5.500 5.468 5.422 5.512 0.012 16 0 "[ . 1 . 2]" 1
1436 1 52 ASN HB2 1 64 TRP HZ2 . . 4.840 4.548 4.370 4.672 . 0 0 "[ . 1 . 2]" 1
1437 1 52 ASN HB3 1 53 THR H . . 5.500 3.589 3.281 4.381 . 0 0 "[ . 1 . 2]" 1
1438 1 52 ASN HB3 1 53 THR MG . . 4.690 2.835 2.509 3.828 . 0 0 "[ . 1 . 2]" 1
1439 1 52 ASN HB3 1 64 TRP HD1 . . 4.920 2.583 2.400 3.321 . 0 0 "[ . 1 . 2]" 1
1440 1 52 ASN HB3 1 64 TRP HE1 . . 4.490 2.833 2.488 3.085 . 0 0 "[ . 1 . 2]" 1
1441 1 52 ASN HB3 1 64 TRP HZ2 . . 5.270 4.591 3.494 4.830 . 0 0 "[ . 1 . 2]" 1
1442 1 52 ASN HD21 1 64 TRP HE1 . . 5.500 4.304 4.166 4.447 . 0 0 "[ . 1 . 2]" 1
1443 1 52 ASN HD21 1 64 TRP HH2 . . 5.020 4.275 4.111 4.659 . 0 0 "[ . 1 . 2]" 1
1444 1 52 ASN HD21 1 64 TRP HZ2 . . 4.340 3.674 3.532 3.800 . 0 0 "[ . 1 . 2]" 1
1445 1 52 ASN HD21 1 64 TRP HZ3 . . 5.500 4.916 4.665 5.711 0.211 19 0 "[ . 1 . 2]" 1
1446 1 52 ASN HD22 1 64 TRP HE1 . . 5.500 3.960 3.657 5.186 . 0 0 "[ . 1 . 2]" 1
1447 1 52 ASN HD22 1 64 TRP HH2 . . 5.020 3.728 3.426 3.954 . 0 0 "[ . 1 . 2]" 1
1448 1 52 ASN HD22 1 64 TRP HZ2 . . 4.070 2.725 2.480 3.594 . 0 0 "[ . 1 . 2]" 1
1449 1 52 ASN HD22 1 64 TRP HZ3 . . 5.500 5.126 4.465 5.485 . 0 0 "[ . 1 . 2]" 1
1450 1 53 THR H 1 53 THR HG1 . . 3.100 1.959 1.928 2.025 . 0 0 "[ . 1 . 2]" 1
1451 1 53 THR H 1 53 THR MG . . 3.670 2.587 2.203 3.085 . 0 0 "[ . 1 . 2]" 1
1452 1 53 THR H 1 54 SER H . . 3.090 2.620 2.278 2.775 . 0 0 "[ . 1 . 2]" 1
1453 1 53 THR H 1 54 SER HA . . 4.470 4.370 4.091 4.497 0.027 16 0 "[ . 1 . 2]" 1
1454 1 53 THR H 1 54 SER HB2 . . 5.430 5.203 4.959 5.312 . 0 0 "[ . 1 . 2]" 1
1455 1 53 THR H 1 55 ASN H . . 4.290 3.038 2.925 3.171 . 0 0 "[ . 1 . 2]" 1
1456 1 53 THR H 1 56 ALA H . . 5.500 4.712 4.483 4.802 . 0 0 "[ . 1 . 2]" 1
1457 1 53 THR H 1 61 ALA HA . . 5.070 4.206 3.999 4.411 . 0 0 "[ . 1 . 2]" 1
1458 1 53 THR H 1 61 ALA MB . . 5.190 4.724 4.579 4.929 . 0 0 "[ . 1 . 2]" 1
1459 1 53 THR HA 1 53 THR MG . . 2.730 2.477 2.193 2.619 . 0 0 "[ . 1 . 2]" 1
1460 1 53 THR HA 1 54 SER HB2 . . 4.920 3.889 3.874 3.918 . 0 0 "[ . 1 . 2]" 1
1461 1 53 THR HA 1 54 SER HB3 . . 5.130 5.149 5.126 5.224 0.094 19 0 "[ . 1 . 2]" 1
1462 1 53 THR HB 1 54 SER H . . 5.500 4.605 4.487 4.678 . 0 0 "[ . 1 . 2]" 1
1463 1 53 THR HB 1 55 ASN H . . 5.020 4.303 3.838 4.612 . 0 0 "[ . 1 . 2]" 1
1464 1 53 THR HB 1 56 ALA H . . 4.290 3.307 2.756 3.652 . 0 0 "[ . 1 . 2]" 1
1465 1 53 THR HB 1 56 ALA MB . . 3.850 3.098 2.682 3.419 . 0 0 "[ . 1 . 2]" 1
1466 1 53 THR HB 1 57 GLY H . . 5.500 4.371 3.788 5.478 . 0 0 "[ . 1 . 2]" 1
1467 1 53 THR HB 1 60 GLU H . . 5.500 5.343 5.251 5.393 . 0 0 "[ . 1 . 2]" 1
1468 1 53 THR HB 1 60 GLU HA . . 5.020 4.409 4.142 4.606 . 0 0 "[ . 1 . 2]" 1
1469 1 53 THR HB 1 60 GLU HB2 . . 4.120 3.545 3.396 3.657 . 0 0 "[ . 1 . 2]" 1
1470 1 53 THR HB 1 60 GLU HB3 . . 3.670 1.985 1.967 1.996 . 0 0 "[ . 1 . 2]" 1
1471 1 53 THR HB 1 60 GLU QG . . 4.920 3.684 2.667 3.947 . 0 0 "[ . 1 . 2]" 1
1472 1 53 THR HB 1 61 ALA H . . 5.340 4.442 4.206 4.637 . 0 0 "[ . 1 . 2]" 1
1473 1 53 THR HB 1 61 ALA HA . . 4.380 4.192 3.937 4.387 0.007 9 0 "[ . 1 . 2]" 1
1474 1 53 THR HB 1 61 ALA MB . . 5.270 4.860 4.573 5.102 . 0 0 "[ . 1 . 2]" 1
1475 1 53 THR HB 1 64 TRP HB2 . . 5.430 4.685 4.483 4.984 . 0 0 "[ . 1 . 2]" 1
1476 1 53 THR HG1 1 53 THR MG . . 3.270 2.275 1.948 3.000 . 0 0 "[ . 1 . 2]" 1
1477 1 53 THR HG1 1 54 SER H . . 4.450 3.913 3.614 4.210 . 0 0 "[ . 1 . 2]" 1
1478 1 53 THR HG1 1 55 ASN H . . 4.720 2.812 2.291 3.700 . 0 0 "[ . 1 . 2]" 1
1479 1 53 THR HG1 1 56 ALA H . . 5.500 3.774 3.355 4.355 . 0 0 "[ . 1 . 2]" 1
1480 1 53 THR HG1 1 61 ALA H . . 5.500 4.138 3.896 4.491 . 0 0 "[ . 1 . 2]" 1
1481 1 53 THR HG1 1 61 ALA HA . . 3.870 2.713 2.319 3.119 . 0 0 "[ . 1 . 2]" 1
1482 1 53 THR HG1 1 61 ALA MB . . 4.070 3.380 3.167 3.637 . 0 0 "[ . 1 . 2]" 1
1483 1 53 THR HG1 1 64 TRP HB2 . . 5.500 4.598 3.921 5.091 . 0 0 "[ . 1 . 2]" 1
1484 1 53 THR MG 1 54 SER H . . 4.840 4.283 4.168 4.425 . 0 0 "[ . 1 . 2]" 1
1485 1 53 THR MG 1 55 ASN H . . 5.500 4.472 4.174 4.786 . 0 0 "[ . 1 . 2]" 1
1486 1 53 THR MG 1 56 ALA H . . 5.430 4.587 4.354 4.680 . 0 0 "[ . 1 . 2]" 1
1487 1 53 THR MG 1 60 GLU HA . . 3.780 3.701 3.528 3.806 0.026 3 0 "[ . 1 . 2]" 1
1488 1 53 THR MG 1 60 GLU HB2 . . 4.270 4.167 4.012 4.296 0.026 16 0 "[ . 1 . 2]" 1
1489 1 53 THR MG 1 60 GLU HB3 . . 3.850 2.712 2.484 2.861 . 0 0 "[ . 1 . 2]" 1
1490 1 53 THR MG 1 60 GLU QG . . 5.270 3.838 3.326 4.192 . 0 0 "[ . 1 . 2]" 1
1491 1 53 THR MG 1 61 ALA H . . 4.840 3.930 3.721 4.294 . 0 0 "[ . 1 . 2]" 1
1492 1 53 THR MG 1 61 ALA HA . . 3.150 2.526 1.980 3.165 0.015 8 0 "[ . 1 . 2]" 1
1493 1 53 THR MG 1 63 ASN H . . 5.270 4.949 4.770 5.152 . 0 0 "[ . 1 . 2]" 1
1494 1 53 THR MG 1 64 TRP H . . 4.030 3.240 2.971 3.507 . 0 0 "[ . 1 . 2]" 1
1495 1 53 THR MG 1 64 TRP HA . . 4.070 3.979 3.761 4.086 0.016 10 0 "[ . 1 . 2]" 1
1496 1 53 THR MG 1 64 TRP HB2 . . 3.180 2.065 1.923 2.189 . 0 0 "[ . 1 . 2]" 1
1497 1 53 THR MG 1 64 TRP HB3 . . 3.550 2.808 2.629 3.123 . 0 0 "[ . 1 . 2]" 1
1498 1 53 THR MG 1 64 TRP HD1 . . 3.780 3.015 2.733 3.204 . 0 0 "[ . 1 . 2]" 1
1499 1 53 THR MG 1 64 TRP HE1 . . 5.500 4.775 4.497 5.027 . 0 0 "[ . 1 . 2]" 1
1500 1 53 THR MG 1 64 TRP HE3 . . 5.430 4.792 4.440 5.241 . 0 0 "[ . 1 . 2]" 1
1501 1 53 THR MG 1 65 LEU H . . 5.270 4.782 4.545 5.125 . 0 0 "[ . 1 . 2]" 1
1502 1 54 SER H 1 54 SER HA . . 2.880 2.196 2.186 2.206 . 0 0 "[ . 1 . 2]" 1
1503 1 54 SER H 1 54 SER HB2 . . 3.670 2.930 2.888 2.985 . 0 0 "[ . 1 . 2]" 1
1504 1 54 SER H 1 54 SER HB3 . . 4.030 3.915 3.894 3.949 . 0 0 "[ . 1 . 2]" 1
1505 1 54 SER H 1 55 ASN H . . 3.670 2.918 2.854 2.972 . 0 0 "[ . 1 . 2]" 1
1506 1 54 SER H 1 55 ASN HA . . 5.500 5.065 5.018 5.104 . 0 0 "[ . 1 . 2]" 1
1507 1 54 SER H 1 55 ASN HD22 . . 5.500 4.872 4.476 5.189 . 0 0 "[ . 1 . 2]" 1
1508 1 54 SER H 1 56 ALA H . . 5.340 4.471 4.383 4.631 . 0 0 "[ . 1 . 2]" 1
1509 1 54 SER HA 1 54 SER HB3 . . 2.870 2.897 2.870 2.905 0.035 14 0 "[ . 1 . 2]" 1
1510 1 54 SER HA 1 55 ASN H . . 3.410 2.939 2.849 3.004 . 0 0 "[ . 1 . 2]" 1
1511 1 54 SER HA 1 55 ASN HA . . 5.270 4.847 4.790 4.876 . 0 0 "[ . 1 . 2]" 1
1512 1 54 SER HA 1 55 ASN HB2 . . 5.430 5.204 4.483 5.503 0.073 15 0 "[ . 1 . 2]" 1
1513 1 54 SER HA 1 55 ASN HD21 . . 5.020 3.883 2.978 4.360 . 0 0 "[ . 1 . 2]" 1
1514 1 54 SER HA 1 55 ASN HD22 . . 4.570 3.392 3.070 3.712 . 0 0 "[ . 1 . 2]" 1
1515 1 54 SER HA 1 56 ALA H . . 5.430 4.594 4.457 4.735 . 0 0 "[ . 1 . 2]" 1
1516 1 54 SER HB2 1 55 ASN H . . 4.520 4.398 4.339 4.482 . 0 0 "[ . 1 . 2]" 1
1517 1 54 SER HB2 1 56 ALA H . . 4.400 4.330 4.162 4.475 0.075 19 0 "[ . 1 . 2]" 1
1518 1 54 SER HB2 1 56 ALA MB . . 4.430 3.879 3.635 4.007 . 0 0 "[ . 1 . 2]" 1
1519 1 54 SER HB3 1 55 ASN H . . 4.790 4.273 4.223 4.322 . 0 0 "[ . 1 . 2]" 1
1520 1 54 SER HB3 1 56 ALA H . . 4.600 3.916 3.733 4.280 . 0 0 "[ . 1 . 2]" 1
1521 1 54 SER HB3 1 56 ALA MB . . 3.960 3.652 3.515 3.810 . 0 0 "[ . 1 . 2]" 1
1522 1 55 ASN H 1 55 ASN HD21 . . 5.190 2.894 2.382 3.546 . 0 0 "[ . 1 . 2]" 1
1523 1 55 ASN H 1 55 ASN HD22 . . 5.500 3.672 3.349 3.970 . 0 0 "[ . 1 . 2]" 1
1524 1 55 ASN H 1 56 ALA H . . 3.730 2.844 2.730 2.964 . 0 0 "[ . 1 . 2]" 1
1525 1 55 ASN H 1 56 ALA MB . . 5.130 4.380 4.277 4.471 . 0 0 "[ . 1 . 2]" 1
1526 1 55 ASN H 1 57 GLY H . . 5.340 4.707 4.470 5.159 . 0 0 "[ . 1 . 2]" 1
1527 1 55 ASN H 1 61 ALA MB . . 5.500 4.559 4.365 4.743 . 0 0 "[ . 1 . 2]" 1
1528 1 55 ASN HA 1 55 ASN HD22 . . 5.270 4.469 4.109 4.826 . 0 0 "[ . 1 . 2]" 1
1529 1 55 ASN HA 1 56 ALA MB . . 5.020 4.459 4.423 4.540 . 0 0 "[ . 1 . 2]" 1
1530 1 55 ASN HA 1 57 GLY H . . 4.570 3.357 2.956 3.574 . 0 0 "[ . 1 . 2]" 1
1531 1 55 ASN HA 1 61 ALA MB . . 5.500 3.493 3.284 3.858 . 0 0 "[ . 1 . 2]" 1
1532 1 55 ASN HB2 1 55 ASN HD21 . . 3.450 3.390 2.194 3.567 0.117 10 0 "[ . 1 . 2]" 1
1533 1 55 ASN HB2 1 55 ASN HD22 . . 3.940 4.068 3.482 4.158 0.218 1 0 "[ . 1 . 2]" 1
1534 1 55 ASN HB2 1 56 ALA H . . 5.340 4.300 4.231 4.387 . 0 0 "[ . 1 . 2]" 1
1535 1 55 ASN HB3 1 56 ALA H . . 5.420 4.712 4.555 4.743 . 0 0 "[ . 1 . 2]" 1
1536 1 56 ALA H 1 56 ALA MB . . 3.030 2.129 2.049 2.212 . 0 0 "[ . 1 . 2]" 1
1537 1 56 ALA H 1 57 GLY H . . 3.510 2.725 2.567 3.386 . 0 0 "[ . 1 . 2]" 1
1538 1 56 ALA H 1 57 GLY HA2 . . 5.500 5.167 5.078 5.490 . 0 0 "[ . 1 . 2]" 1
1539 1 56 ALA H 1 60 GLU HB2 . . 5.270 3.955 3.590 4.137 . 0 0 "[ . 1 . 2]" 1
1540 1 56 ALA H 1 60 GLU HB3 . . 5.500 3.744 3.297 3.909 . 0 0 "[ . 1 . 2]" 1
1541 1 56 ALA H 1 60 GLU QG . . 5.500 4.856 4.094 5.133 . 0 0 "[ . 1 . 2]" 1
1542 1 56 ALA MB 1 57 GLY H . . 3.820 2.786 2.508 3.781 . 0 0 "[ . 1 . 2]" 1
1543 1 56 ALA MB 1 57 GLY HA2 . . 5.500 4.494 4.361 5.070 . 0 0 "[ . 1 . 2]" 1
1544 1 56 ALA MB 1 60 GLU H . . 4.760 4.487 4.333 4.808 0.048 19 0 "[ . 1 . 2]" 1
1545 1 56 ALA MB 1 60 GLU HA . . 5.020 4.847 4.429 5.000 . 0 0 "[ . 1 . 2]" 1
1546 1 56 ALA MB 1 60 GLU HB2 . . 3.540 2.727 2.545 3.009 . 0 0 "[ . 1 . 2]" 1
1547 1 56 ALA MB 1 60 GLU HB3 . . 3.820 2.934 2.534 3.147 . 0 0 "[ . 1 . 2]" 1
1548 1 56 ALA MB 1 60 GLU QG . . 3.380 2.724 2.171 3.030 . 0 0 "[ . 1 . 2]" 1
1549 1 56 ALA MB 1 61 ALA H . . 5.270 4.880 4.711 5.080 . 0 0 "[ . 1 . 2]" 1
1550 1 57 GLY H 1 58 VAL H . . 5.070 4.262 4.152 4.335 . 0 0 "[ . 1 . 2]" 1
1551 1 57 GLY H 1 58 VAL HA . . 5.500 4.715 4.621 4.961 . 0 0 "[ . 1 . 2]" 1
1552 1 57 GLY H 1 58 VAL MG2 . . 5.500 5.217 4.863 5.359 . 0 0 "[ . 1 . 2]" 1
1553 1 57 GLY H 1 60 GLU H . . 5.500 3.773 3.515 5.125 . 0 0 "[ . 1 . 2]" 1
1554 1 57 GLY H 1 60 GLU HB2 . . 4.430 2.475 2.218 4.099 . 0 0 "[ . 1 . 2]" 1
1555 1 57 GLY H 1 60 GLU HB3 . . 5.020 3.425 3.165 5.075 0.055 19 0 "[ . 1 . 2]" 1
1556 1 57 GLY H 1 61 ALA H . . 5.260 3.536 3.344 5.030 . 0 0 "[ . 1 . 2]" 1
1557 1 57 GLY H 1 61 ALA MB . . 4.840 3.972 3.795 4.856 0.016 19 0 "[ . 1 . 2]" 1
1558 1 57 GLY HA2 1 58 VAL H . . 3.180 2.344 2.280 2.412 . 0 0 "[ . 1 . 2]" 1
1559 1 57 GLY HA2 1 58 VAL HA . . 5.430 4.295 4.290 4.302 . 0 0 "[ . 1 . 2]" 1
1560 1 57 GLY HA2 1 58 VAL HB . . 4.920 4.703 4.602 4.826 . 0 0 "[ . 1 . 2]" 1
1561 1 57 GLY HA2 1 58 VAL MG2 . . 4.570 3.757 3.630 3.907 . 0 0 "[ . 1 . 2]" 1
1562 1 57 GLY HA2 1 59 GLU H . . 4.430 4.305 4.034 4.456 0.026 20 0 "[ . 1 . 2]" 1
1563 1 57 GLY HA2 1 60 GLU H . . 5.500 4.436 4.356 4.578 . 0 0 "[ . 1 . 2]" 1
1564 1 58 VAL H 1 58 VAL HB . . 3.130 2.385 2.262 2.519 . 0 0 "[ . 1 . 2]" 1
1565 1 58 VAL H 1 58 VAL MG1 . . 4.030 3.694 3.667 3.704 . 0 0 "[ . 1 . 2]" 1
1566 1 58 VAL H 1 58 VAL MG2 . . 3.250 2.183 1.977 2.338 . 0 0 "[ . 1 . 2]" 1
1567 1 58 VAL H 1 59 GLU HB3 . . 5.500 4.827 4.660 4.989 . 0 0 "[ . 1 . 2]" 1
1568 1 58 VAL H 1 59 GLU HG2 . . 5.500 4.818 4.639 4.964 . 0 0 "[ . 1 . 2]" 1
1569 1 58 VAL H 1 60 GLU H . . 5.260 4.246 4.163 4.375 . 0 0 "[ . 1 . 2]" 1
1570 1 58 VAL H 1 61 ALA H . . 5.500 4.769 4.698 4.850 . 0 0 "[ . 1 . 2]" 1
1571 1 58 VAL H 1 61 ALA MB . . 5.500 4.636 4.515 4.751 . 0 0 "[ . 1 . 2]" 1
1572 1 58 VAL HA 1 58 VAL MG1 . . 3.220 2.416 2.341 2.488 . 0 0 "[ . 1 . 2]" 1
1573 1 58 VAL HA 1 58 VAL MG2 . . 3.290 2.290 2.185 2.386 . 0 0 "[ . 1 . 2]" 1
1574 1 58 VAL HA 1 59 GLU HA . . 5.130 4.776 4.744 4.825 . 0 0 "[ . 1 . 2]" 1
1575 1 58 VAL HA 1 60 GLU H . . 5.500 4.416 4.325 4.486 . 0 0 "[ . 1 . 2]" 1
1576 1 58 VAL HA 1 61 ALA H . . 4.210 3.437 3.267 3.574 . 0 0 "[ . 1 . 2]" 1
1577 1 58 VAL HA 1 61 ALA MB . . 3.470 2.689 2.495 2.829 . 0 0 "[ . 1 . 2]" 1
1578 1 58 VAL HA 1 62 MET H . . 4.760 3.919 3.728 4.084 . 0 0 "[ . 1 . 2]" 1
1579 1 58 VAL HB 1 59 GLU H . . 3.130 2.634 2.445 2.811 . 0 0 "[ . 1 . 2]" 1
1580 1 58 VAL HB 1 59 GLU HA . . 4.690 4.346 4.211 4.455 . 0 0 "[ . 1 . 2]" 1
1581 1 58 VAL MG1 1 59 GLU H . . 3.920 3.374 3.059 3.610 . 0 0 "[ . 1 . 2]" 1
1582 1 58 VAL MG1 1 59 GLU HA . . 4.000 3.471 3.285 3.631 . 0 0 "[ . 1 . 2]" 1
1583 1 58 VAL MG1 1 60 GLU H . . 5.500 5.033 4.860 5.194 . 0 0 "[ . 1 . 2]" 1
1584 1 58 VAL MG1 1 62 MET H . . 4.630 3.710 3.556 3.812 . 0 0 "[ . 1 . 2]" 1
1585 1 58 VAL MG2 1 59 GLU H . . 4.100 3.948 3.821 4.037 . 0 0 "[ . 1 . 2]" 1
1586 1 58 VAL MG2 1 59 GLU HA . . 5.440 5.409 5.385 5.429 . 0 0 "[ . 1 . 2]" 1
1587 1 58 VAL MG2 1 60 GLU H . . 5.500 5.423 5.320 5.492 . 0 0 "[ . 1 . 2]" 1
1588 1 58 VAL MG2 1 62 MET H . . 5.500 5.448 5.328 5.509 0.009 19 0 "[ . 1 . 2]" 1
1589 1 59 GLU H 1 59 GLU HB2 . . 3.480 3.456 3.437 3.483 0.003 12 0 "[ . 1 . 2]" 1
1590 1 59 GLU H 1 59 GLU HB3 . . 3.530 2.162 2.135 2.207 . 0 0 "[ . 1 . 2]" 1
1591 1 59 GLU H 1 59 GLU HG2 . . 3.780 2.792 2.679 2.883 . 0 0 "[ . 1 . 2]" 1
1592 1 59 GLU H 1 60 GLU H . . 3.640 2.760 2.666 2.881 . 0 0 "[ . 1 . 2]" 1
1593 1 59 GLU H 1 60 GLU HA . . 5.500 5.259 5.180 5.355 . 0 0 "[ . 1 . 2]" 1
1594 1 59 GLU H 1 61 ALA H . . 4.920 4.349 4.200 4.462 . 0 0 "[ . 1 . 2]" 1
1595 1 59 GLU H 1 61 ALA MB . . 5.500 4.900 4.800 5.005 . 0 0 "[ . 1 . 2]" 1
1596 1 59 GLU HA 1 59 GLU HG3 . . 3.560 3.586 3.577 3.593 0.033 9 0 "[ . 1 . 2]" 1
1597 1 59 GLU HA 1 61 ALA H . . 5.020 4.681 4.592 4.760 . 0 0 "[ . 1 . 2]" 1
1598 1 59 GLU HA 1 62 MET H . . 3.930 3.704 3.630 3.768 . 0 0 "[ . 1 . 2]" 1
1599 1 59 GLU HA 1 62 MET HB2 . . 3.250 3.252 3.175 3.282 0.032 19 0 "[ . 1 . 2]" 1
1600 1 59 GLU HA 1 62 MET HB3 . . 3.780 3.324 3.257 3.393 . 0 0 "[ . 1 . 2]" 1
1601 1 59 GLU HA 1 62 MET ME . . 4.760 4.046 2.663 4.776 0.016 16 0 "[ . 1 . 2]" 1
1602 1 59 GLU HA 1 63 ASN H . . 4.760 3.753 3.688 3.835 . 0 0 "[ . 1 . 2]" 1
1603 1 59 GLU HB2 1 59 GLU HG3 . . 2.900 2.482 2.445 2.500 . 0 0 "[ . 1 . 2]" 1
1604 1 59 GLU HB3 1 60 GLU H . . 3.610 3.638 3.625 3.645 0.035 14 0 "[ . 1 . 2]" 1
1605 1 59 GLU HG2 1 60 GLU H . . 4.320 1.934 1.919 1.940 . 0 0 "[ . 1 . 2]" 1
1606 1 59 GLU HG2 1 60 GLU HB2 . . 3.390 3.435 3.420 3.473 0.083 16 0 "[ . 1 . 2]" 1
1607 1 59 GLU HG2 1 60 GLU QG . . 3.430 3.167 3.080 3.377 . 0 0 "[ . 1 . 2]" 1
1608 1 59 GLU HG2 1 61 ALA H . . 5.130 4.686 4.648 4.762 . 0 0 "[ . 1 . 2]" 1
1609 1 59 GLU HG3 1 60 GLU HA . . 4.050 2.914 2.866 3.023 . 0 0 "[ . 1 . 2]" 1
1610 1 59 GLU HG3 1 63 ASN H . . 5.430 4.626 4.552 4.699 . 0 0 "[ . 1 . 2]" 1
1611 1 59 GLU HG3 1 63 ASN HB2 . . 5.500 3.835 3.714 3.946 . 0 0 "[ . 1 . 2]" 1
1612 1 59 GLU HG3 1 63 ASN HB3 . . 5.430 5.314 5.178 5.435 0.005 17 0 "[ . 1 . 2]" 1
1613 1 59 GLU HG3 1 63 ASN HD21 . . 4.760 3.023 2.589 3.384 . 0 0 "[ . 1 . 2]" 1
1614 1 59 GLU HG3 1 63 ASN HD22 . . 4.430 4.187 3.735 4.381 . 0 0 "[ . 1 . 2]" 1
1615 1 60 GLU H 1 60 GLU HB2 . . 3.270 2.087 2.076 2.100 . 0 0 "[ . 1 . 2]" 1
1616 1 60 GLU H 1 60 GLU HB3 . . 3.570 3.392 3.381 3.406 . 0 0 "[ . 1 . 2]" 1
1617 1 60 GLU H 1 60 GLU QG . . 4.250 3.018 2.957 3.262 . 0 0 "[ . 1 . 2]" 1
1618 1 60 GLU H 1 61 ALA H . . 3.580 2.763 2.727 2.846 . 0 0 "[ . 1 . 2]" 1
1619 1 60 GLU H 1 61 ALA MB . . 5.270 4.271 4.209 4.353 . 0 0 "[ . 1 . 2]" 1
1620 1 60 GLU H 1 62 MET H . . 4.870 4.406 4.348 4.476 . 0 0 "[ . 1 . 2]" 1
1621 1 60 GLU H 1 63 ASN H . . 5.500 4.636 4.604 4.660 . 0 0 "[ . 1 . 2]" 1
1622 1 60 GLU HA 1 60 GLU QG . . 3.300 2.025 1.969 2.615 . 0 0 "[ . 1 . 2]" 1
1623 1 60 GLU HA 1 61 ALA MB . . 5.430 5.018 5.002 5.030 . 0 0 "[ . 1 . 2]" 1
1624 1 60 GLU HA 1 62 MET H . . 5.430 4.779 4.689 4.863 . 0 0 "[ . 1 . 2]" 1
1625 1 60 GLU HA 1 63 ASN H . . 4.100 3.559 3.469 3.617 . 0 0 "[ . 1 . 2]" 1
1626 1 60 GLU HA 1 63 ASN HB2 . . 3.700 2.377 2.307 2.434 . 0 0 "[ . 1 . 2]" 1
1627 1 60 GLU HA 1 63 ASN HB3 . . 3.960 3.448 3.318 3.515 . 0 0 "[ . 1 . 2]" 1
1628 1 60 GLU HA 1 63 ASN HD21 . . 4.380 2.967 2.838 3.294 . 0 0 "[ . 1 . 2]" 1
1629 1 60 GLU HA 1 63 ASN HD22 . . 4.920 4.680 4.562 4.888 . 0 0 "[ . 1 . 2]" 1
1630 1 60 GLU HA 1 64 TRP H . . 4.150 4.190 4.154 4.217 0.067 19 0 "[ . 1 . 2]" 1
1631 1 60 GLU HB2 1 61 ALA H . . 3.580 2.830 2.758 2.895 . 0 0 "[ . 1 . 2]" 1
1632 1 60 GLU HB2 1 61 ALA HA . . 4.760 4.803 4.773 4.845 0.085 15 0 "[ . 1 . 2]" 1
1633 1 60 GLU HB2 1 61 ALA MB . . 4.340 4.256 4.205 4.313 . 0 0 "[ . 1 . 2]" 1
1634 1 60 GLU HB3 1 61 ALA H . . 4.110 3.040 2.922 3.113 . 0 0 "[ . 1 . 2]" 1
1635 1 60 GLU HB3 1 61 ALA HA . . 4.430 3.907 3.860 3.933 . 0 0 "[ . 1 . 2]" 1
1636 1 60 GLU HB3 1 62 MET H . . 5.500 5.521 5.496 5.537 0.037 3 0 "[ . 1 . 2]" 1
1637 1 60 GLU HB3 1 63 ASN HB2 . . 5.430 4.843 4.776 4.914 . 0 0 "[ . 1 . 2]" 1
1638 1 60 GLU HB3 1 63 ASN HB3 . . 5.500 5.463 5.306 5.524 0.024 16 0 "[ . 1 . 2]" 1
1639 1 60 GLU HB3 1 64 TRP H . . 5.500 5.144 5.117 5.212 . 0 0 "[ . 1 . 2]" 1
1640 1 60 GLU QG 1 61 ALA H . . 5.020 4.390 4.364 4.417 . 0 0 "[ . 1 . 2]" 1
1641 1 61 ALA H 1 61 ALA MB . . 3.110 2.017 1.933 2.158 . 0 0 "[ . 1 . 2]" 1
1642 1 61 ALA H 1 62 MET H . . 3.390 2.928 2.891 2.968 . 0 0 "[ . 1 . 2]" 1
1643 1 61 ALA H 1 62 MET HB2 . . 4.760 4.774 4.754 4.788 0.028 14 0 "[ . 1 . 2]" 1
1644 1 61 ALA H 1 62 MET HB3 . . 5.430 5.477 5.433 5.529 0.099 16 0 "[ . 1 . 2]" 1
1645 1 61 ALA H 1 63 ASN H . . 4.920 4.338 4.296 4.362 . 0 0 "[ . 1 . 2]" 1
1646 1 61 ALA H 1 63 ASN HB2 . . 5.500 4.881 4.835 4.919 . 0 0 "[ . 1 . 2]" 1
1647 1 61 ALA HA 1 63 ASN H . . 5.020 4.809 4.785 4.880 . 0 0 "[ . 1 . 2]" 1
1648 1 61 ALA HA 1 64 TRP H . . 3.690 3.682 3.639 3.709 0.019 20 0 "[ . 1 . 2]" 1
1649 1 61 ALA HA 1 64 TRP HB2 . . 3.940 3.777 3.731 3.838 . 0 0 "[ . 1 . 2]" 1
1650 1 61 ALA HA 1 64 TRP HB3 . . 3.780 3.188 3.124 3.243 . 0 0 "[ . 1 . 2]" 1
1651 1 61 ALA HA 1 64 TRP HE3 . . 5.500 5.046 4.812 5.204 . 0 0 "[ . 1 . 2]" 1
1652 1 61 ALA HA 1 65 LEU H . . 4.470 4.524 4.500 4.576 0.106 8 0 "[ . 1 . 2]" 1
1653 1 61 ALA HA 1 65 LEU MD1 . . 5.020 3.868 3.741 4.172 . 0 0 "[ . 1 . 2]" 1
1654 1 61 ALA HA 1 65 LEU HG . . 5.430 5.365 5.209 5.433 0.003 14 0 "[ . 1 . 2]" 1
1655 1 61 ALA MB 1 62 MET H . . 3.410 2.306 2.226 2.452 . 0 0 "[ . 1 . 2]" 1
1656 1 61 ALA MB 1 62 MET HA . . 3.760 3.663 3.625 3.751 . 0 0 "[ . 1 . 2]" 1
1657 1 61 ALA MB 1 62 MET HB2 . . 5.020 3.736 3.707 3.834 . 0 0 "[ . 1 . 2]" 1
1658 1 61 ALA MB 1 62 MET HB3 . . 5.270 4.838 4.818 4.900 . 0 0 "[ . 1 . 2]" 1
1659 1 61 ALA MB 1 62 MET HG3 . . 5.430 4.823 4.770 4.879 . 0 0 "[ . 1 . 2]" 1
1660 1 61 ALA MB 1 63 ASN H . . 5.270 4.573 4.555 4.619 . 0 0 "[ . 1 . 2]" 1
1661 1 61 ALA MB 1 64 TRP H . . 5.130 4.658 4.595 4.691 . 0 0 "[ . 1 . 2]" 1
1662 1 61 ALA MB 1 64 TRP HB2 . . 5.270 5.184 5.146 5.232 . 0 0 "[ . 1 . 2]" 1
1663 1 61 ALA MB 1 64 TRP HB3 . . 5.130 4.407 4.373 4.447 . 0 0 "[ . 1 . 2]" 1
1664 1 61 ALA MB 1 65 LEU H . . 5.270 4.776 4.730 4.815 . 0 0 "[ . 1 . 2]" 1
1665 1 61 ALA MB 1 65 LEU MD1 . . 5.020 2.973 2.793 3.130 . 0 0 "[ . 1 . 2]" 1
1666 1 62 MET H 1 62 MET HB2 . . 3.450 2.035 2.019 2.050 . 0 0 "[ . 1 . 2]" 1
1667 1 62 MET H 1 62 MET HB3 . . 3.380 2.944 2.911 2.980 . 0 0 "[ . 1 . 2]" 1
1668 1 62 MET H 1 62 MET ME . . 5.270 4.580 3.636 5.092 . 0 0 "[ . 1 . 2]" 1
1669 1 62 MET H 1 62 MET HG2 . . 4.410 4.341 4.292 4.380 . 0 0 "[ . 1 . 2]" 1
1670 1 62 MET H 1 62 MET HG3 . . 4.180 3.915 3.855 3.971 . 0 0 "[ . 1 . 2]" 1
1671 1 62 MET H 1 63 ASN H . . 3.570 2.881 2.820 2.925 . 0 0 "[ . 1 . 2]" 1
1672 1 62 MET H 1 63 ASN HA . . 5.500 5.327 5.280 5.362 . 0 0 "[ . 1 . 2]" 1
1673 1 62 MET H 1 63 ASN HB2 . . 5.500 4.572 4.522 4.620 . 0 0 "[ . 1 . 2]" 1
1674 1 62 MET H 1 64 TRP H . . 5.130 4.242 4.127 4.323 . 0 0 "[ . 1 . 2]" 1
1675 1 62 MET H 1 65 LEU MD1 . . 5.430 3.532 3.391 3.792 . 0 0 "[ . 1 . 2]" 1
1676 1 62 MET HA 1 62 MET ME . . 4.120 4.086 4.044 4.142 0.022 8 0 "[ . 1 . 2]" 1
1677 1 62 MET HA 1 62 MET HG2 . . 3.490 2.457 2.340 2.550 . 0 0 "[ . 1 . 2]" 1
1678 1 62 MET HA 1 62 MET HG3 . . 3.920 2.649 2.541 2.785 . 0 0 "[ . 1 . 2]" 1
1679 1 62 MET HA 1 64 TRP H . . 5.070 4.203 4.065 4.307 . 0 0 "[ . 1 . 2]" 1
1680 1 62 MET HA 1 64 TRP HE3 . . 5.430 5.223 5.122 5.320 . 0 0 "[ . 1 . 2]" 1
1681 1 62 MET HA 1 65 LEU H . . 4.000 3.007 2.918 3.050 . 0 0 "[ . 1 . 2]" 1
1682 1 62 MET HA 1 65 LEU HB2 . . 3.640 2.184 2.092 2.216 . 0 0 "[ . 1 . 2]" 1
1683 1 62 MET HA 1 65 LEU HB3 . . 3.790 3.798 3.715 3.824 0.034 10 0 "[ . 1 . 2]" 1
1684 1 62 MET HA 1 65 LEU MD1 . . 3.570 1.936 1.871 2.083 . 0 0 "[ . 1 . 2]" 1
1685 1 62 MET HA 1 65 LEU MD2 . . 4.380 4.227 4.127 4.398 0.018 13 0 "[ . 1 . 2]" 1
1686 1 62 MET HA 1 65 LEU HG . . 4.270 4.006 3.924 4.067 . 0 0 "[ . 1 . 2]" 1
1687 1 62 MET HA 1 66 LEU MD1 . . 4.920 4.798 4.698 4.863 . 0 0 "[ . 1 . 2]" 1
1688 1 62 MET HA 1 66 LEU HG . . 4.920 3.969 3.867 4.011 . 0 0 "[ . 1 . 2]" 1
1689 1 62 MET HB2 1 62 MET HG2 . . 3.020 3.037 3.013 3.052 0.032 17 0 "[ . 1 . 2]" 1
1690 1 62 MET HB2 1 63 ASN H . . 3.600 3.342 3.312 3.372 . 0 0 "[ . 1 . 2]" 1
1691 1 62 MET HB2 1 64 TRP H . . 5.500 5.465 5.371 5.520 0.020 3 0 "[ . 1 . 2]" 1
1692 1 62 MET HB2 1 66 LEU MD1 . . 4.760 4.715 4.551 4.780 0.020 20 0 "[ . 1 . 2]" 1
1693 1 62 MET HB2 1 66 LEU MD2 . . 5.500 5.105 5.058 5.156 . 0 0 "[ . 1 . 2]" 1
1694 1 62 MET HB3 1 62 MET ME . . 2.660 2.532 2.122 2.690 0.030 17 0 "[ . 1 . 2]" 1
1695 1 62 MET HB3 1 63 ASN H . . 4.150 2.393 2.359 2.438 . 0 0 "[ . 1 . 2]" 1
1696 1 62 MET HB3 1 63 ASN HA . . 5.020 3.687 3.674 3.704 . 0 0 "[ . 1 . 2]" 1
1697 1 62 MET HB3 1 64 TRP H . . 5.020 4.871 4.785 4.928 . 0 0 "[ . 1 . 2]" 1
1698 1 62 MET HB3 1 65 LEU H . . 5.500 5.001 4.895 5.046 . 0 0 "[ . 1 . 2]" 1
1699 1 62 MET HB3 1 65 LEU MD1 . . 5.270 4.471 4.394 4.589 . 0 0 "[ . 1 . 2]" 1
1700 1 62 MET ME 1 63 ASN H . . 4.840 4.164 3.880 4.294 . 0 0 "[ . 1 . 2]" 1
1701 1 62 MET ME 1 63 ASN HA . . 5.430 4.264 3.740 5.142 . 0 0 "[ . 1 . 2]" 1
1702 1 62 MET ME 1 65 LEU MD1 . . 5.020 4.820 4.756 4.893 . 0 0 "[ . 1 . 2]" 1
1703 1 62 MET ME 1 66 LEU MD1 . . 3.540 2.400 1.728 3.559 0.019 11 0 "[ . 1 . 2]" 1
1704 1 62 MET ME 1 66 LEU MD2 . . 4.380 2.778 1.856 4.401 0.021 6 0 "[ . 1 . 2]" 1
1705 1 62 MET ME 1 66 LEU HG . . 5.270 3.262 2.378 4.808 . 0 0 "[ . 1 . 2]" 1
1706 1 62 MET HG2 1 63 ASN H . . 4.470 4.415 4.375 4.478 0.008 8 0 "[ . 1 . 2]" 1
1707 1 62 MET HG2 1 63 ASN HA . . 5.270 4.815 4.758 4.914 . 0 0 "[ . 1 . 2]" 1
1708 1 62 MET HG2 1 65 LEU HB2 . . 5.430 3.126 2.969 3.243 . 0 0 "[ . 1 . 2]" 1
1709 1 62 MET HG2 1 65 LEU HB3 . . 5.020 4.130 3.971 4.233 . 0 0 "[ . 1 . 2]" 1
1710 1 62 MET HG2 1 65 LEU MD1 . . 4.520 3.416 3.122 3.551 . 0 0 "[ . 1 . 2]" 1
1711 1 62 MET HG2 1 65 LEU MD2 . . 5.430 4.934 4.814 5.163 . 0 0 "[ . 1 . 2]" 1
1712 1 62 MET HG2 1 66 LEU H . . 4.340 4.075 3.972 4.216 . 0 0 "[ . 1 . 2]" 1
1713 1 62 MET HG2 1 66 LEU MD1 . . 3.690 3.449 3.365 3.536 . 0 0 "[ . 1 . 2]" 1
1714 1 62 MET HG2 1 66 LEU MD2 . . 3.870 2.546 2.495 2.617 . 0 0 "[ . 1 . 2]" 1
1715 1 62 MET HG2 1 66 LEU HG . . 4.340 2.968 2.843 3.022 . 0 0 "[ . 1 . 2]" 1
1716 1 62 MET HG3 1 63 ASN H . . 5.080 5.020 4.988 5.073 . 0 0 "[ . 1 . 2]" 1
1717 1 62 MET HG3 1 65 LEU H . . 5.500 5.514 5.438 5.580 0.080 12 0 "[ . 1 . 2]" 1
1718 1 62 MET HG3 1 65 LEU HB3 . . 5.500 5.008 4.893 5.144 . 0 0 "[ . 1 . 2]" 1
1719 1 62 MET HG3 1 65 LEU MD1 . . 4.760 3.228 3.023 3.426 . 0 0 "[ . 1 . 2]" 1
1720 1 62 MET HG3 1 66 LEU MD2 . . 3.960 3.971 3.951 3.987 0.027 17 0 "[ . 1 . 2]" 1
1721 1 62 MET HG3 1 66 LEU HG . . 4.690 4.672 4.552 4.714 0.024 16 0 "[ . 1 . 2]" 1
1722 1 63 ASN H 1 63 ASN HB2 . . 3.340 2.066 2.047 2.077 . 0 0 "[ . 1 . 2]" 1
1723 1 63 ASN H 1 63 ASN HB3 . . 3.410 3.308 3.251 3.340 . 0 0 "[ . 1 . 2]" 1
1724 1 63 ASN H 1 63 ASN HD21 . . 5.070 3.927 3.494 4.203 . 0 0 "[ . 1 . 2]" 1
1725 1 63 ASN H 1 63 ASN HD22 . . 5.420 4.963 4.773 5.086 . 0 0 "[ . 1 . 2]" 1
1726 1 63 ASN H 1 64 TRP H . . 3.500 2.928 2.857 2.964 . 0 0 "[ . 1 . 2]" 1
1727 1 63 ASN H 1 64 TRP HB2 . . 5.430 5.282 5.201 5.342 . 0 0 "[ . 1 . 2]" 1
1728 1 63 ASN H 1 64 TRP HB3 . . 5.500 5.112 5.084 5.152 . 0 0 "[ . 1 . 2]" 1
1729 1 63 ASN H 1 65 LEU H . . 5.190 4.209 4.097 4.297 . 0 0 "[ . 1 . 2]" 1
1730 1 63 ASN H 1 66 LEU MD1 . . 5.420 3.969 3.834 4.170 . 0 0 "[ . 1 . 2]" 1
1731 1 63 ASN H 1 66 LEU HG . . 5.500 4.146 4.042 4.243 . 0 0 "[ . 1 . 2]" 1
1732 1 63 ASN HA 1 63 ASN HD22 . . 5.500 4.333 4.098 4.425 . 0 0 "[ . 1 . 2]" 1
1733 1 63 ASN HA 1 65 LEU H . . 5.500 4.478 4.359 4.591 . 0 0 "[ . 1 . 2]" 1
1734 1 63 ASN HA 1 66 LEU H . . 4.540 3.347 3.295 3.463 . 0 0 "[ . 1 . 2]" 1
1735 1 63 ASN HA 1 66 LEU HB2 . . 3.980 2.859 2.760 3.014 . 0 0 "[ . 1 . 2]" 1
1736 1 63 ASN HA 1 66 LEU HB3 . . 4.520 4.378 4.281 4.525 0.005 19 0 "[ . 1 . 2]" 1
1737 1 63 ASN HA 1 66 LEU MD1 . . 3.690 2.526 2.385 2.661 . 0 0 "[ . 1 . 2]" 1
1738 1 63 ASN HA 1 66 LEU MD2 . . 5.270 4.351 4.251 4.480 . 0 0 "[ . 1 . 2]" 1
1739 1 63 ASN HA 1 66 LEU HG . . 4.570 2.820 2.692 2.967 . 0 0 "[ . 1 . 2]" 1
1740 1 63 ASN HA 1 67 SER H . . 5.190 4.849 4.738 4.949 . 0 0 "[ . 1 . 2]" 1
1741 1 63 ASN HB2 1 64 TRP H . . 3.970 3.102 3.015 3.234 . 0 0 "[ . 1 . 2]" 1
1742 1 63 ASN HB2 1 64 TRP HA . . 5.500 5.044 4.994 5.129 . 0 0 "[ . 1 . 2]" 1
1743 1 63 ASN HB3 1 64 TRP H . . 4.030 2.834 2.730 2.967 . 0 0 "[ . 1 . 2]" 1
1744 1 63 ASN HB3 1 64 TRP HA . . 5.270 3.751 3.718 3.798 . 0 0 "[ . 1 . 2]" 1
1745 1 64 TRP H 1 64 TRP HB2 . . 3.260 2.475 2.430 2.507 . 0 0 "[ . 1 . 2]" 1
1746 1 64 TRP H 1 64 TRP HB3 . . 3.310 2.453 2.434 2.490 . 0 0 "[ . 1 . 2]" 1
1747 1 64 TRP H 1 64 TRP HD1 . . 5.020 4.989 4.935 5.031 0.011 6 0 "[ . 1 . 2]" 1
1748 1 64 TRP H 1 64 TRP HE3 . . 5.420 4.509 4.466 4.583 . 0 0 "[ . 1 . 2]" 1
1749 1 64 TRP H 1 65 LEU H . . 3.520 2.620 2.488 2.677 . 0 0 "[ . 1 . 2]" 1
1750 1 64 TRP H 1 65 LEU HA . . 5.430 5.174 5.072 5.220 . 0 0 "[ . 1 . 2]" 1
1751 1 64 TRP H 1 65 LEU HB2 . . 5.420 4.528 4.405 4.597 . 0 0 "[ . 1 . 2]" 1
1752 1 64 TRP H 1 66 LEU H . . 5.420 4.045 3.968 4.091 . 0 0 "[ . 1 . 2]" 1
1753 1 64 TRP H 1 66 LEU HG . . 4.920 4.921 4.837 4.951 0.031 11 0 "[ . 1 . 2]" 1
1754 1 64 TRP H 1 67 SER H . . 5.500 4.779 4.712 4.835 . 0 0 "[ . 1 . 2]" 1
1755 1 64 TRP H 1 67 SER HB2 . . 5.500 4.987 4.770 5.345 . 0 0 "[ . 1 . 2]" 1
1756 1 64 TRP HA 1 64 TRP HD1 . . 4.050 3.354 3.186 3.432 . 0 0 "[ . 1 . 2]" 1
1757 1 64 TRP HA 1 64 TRP HE1 . . 5.270 5.257 5.184 5.282 0.012 14 0 "[ . 1 . 2]" 1
1758 1 64 TRP HA 1 64 TRP HE3 . . 5.430 4.298 4.194 4.463 . 0 0 "[ . 1 . 2]" 1
1759 1 64 TRP HA 1 66 LEU H . . 5.020 4.380 4.282 4.478 . 0 0 "[ . 1 . 2]" 1
1760 1 64 TRP HA 1 67 SER H . . 4.290 3.386 3.343 3.444 . 0 0 "[ . 1 . 2]" 1
1761 1 64 TRP HA 1 67 SER HB2 . . 4.150 2.721 2.404 3.287 . 0 0 "[ . 1 . 2]" 1
1762 1 64 TRP HA 1 67 SER HB3 . . 5.130 3.564 2.793 4.201 . 0 0 "[ . 1 . 2]" 1
1763 1 64 TRP HA 1 68 HIS H . . 4.570 4.403 4.227 4.535 . 0 0 "[ . 1 . 2]" 1
1764 1 64 TRP HA 1 68 HIS HD2 . . 3.780 3.500 3.113 3.780 0.000 9 0 "[ . 1 . 2]" 1
1765 1 64 TRP HB2 1 64 TRP HD1 . . 3.560 2.681 2.659 2.732 . 0 0 "[ . 1 . 2]" 1
1766 1 64 TRP HB2 1 65 LEU H . . 4.150 3.920 3.878 3.971 . 0 0 "[ . 1 . 2]" 1
1767 1 64 TRP HB3 1 64 TRP HE3 . . 4.150 2.594 2.505 2.641 . 0 0 "[ . 1 . 2]" 1
1768 1 64 TRP HB3 1 65 LEU H . . 3.570 2.651 2.580 2.775 . 0 0 "[ . 1 . 2]" 1
1769 1 64 TRP HB3 1 65 LEU HA . . 5.270 4.290 4.256 4.322 . 0 0 "[ . 1 . 2]" 1
1770 1 64 TRP HB3 1 65 LEU HB2 . . 5.430 4.699 4.643 4.742 . 0 0 "[ . 1 . 2]" 1
1771 1 64 TRP HB3 1 65 LEU MD1 . . 5.500 3.863 3.721 4.184 . 0 0 "[ . 1 . 2]" 1
1772 1 64 TRP HB3 1 65 LEU MD2 . . 5.430 5.334 5.250 5.381 . 0 0 "[ . 1 . 2]" 1
1773 1 64 TRP HB3 1 65 LEU HG . . 5.130 3.934 3.862 3.983 . 0 0 "[ . 1 . 2]" 1
1774 1 64 TRP HB3 1 66 LEU H . . 5.270 5.059 4.992 5.142 . 0 0 "[ . 1 . 2]" 1
1775 1 64 TRP HD1 1 67 SER HB2 . . 5.500 5.314 4.849 6.072 0.572 6 1 "[ .+ 1 . 2]" 1
1776 1 64 TRP HD1 1 68 HIS HD2 . . 4.920 4.190 3.744 4.647 . 0 0 "[ . 1 . 2]" 1
1777 1 64 TRP HD1 1 68 HIS HE1 . . 5.430 5.444 5.437 5.451 0.021 13 0 "[ . 1 . 2]" 1
1778 1 64 TRP HE1 1 68 HIS HD2 . . 5.190 4.211 3.820 4.594 . 0 0 "[ . 1 . 2]" 1
1779 1 64 TRP HE1 1 68 HIS HE1 . . 5.260 3.239 3.143 3.298 . 0 0 "[ . 1 . 2]" 1
1780 1 64 TRP HE3 1 65 LEU H . . 4.180 2.868 2.739 3.022 . 0 0 "[ . 1 . 2]" 1
1781 1 64 TRP HE3 1 65 LEU HA . . 3.240 2.444 2.332 2.721 . 0 0 "[ . 1 . 2]" 1
1782 1 64 TRP HE3 1 65 LEU HB2 . . 4.690 4.107 3.991 4.257 . 0 0 "[ . 1 . 2]" 1
1783 1 64 TRP HE3 1 65 LEU HB3 . . 5.020 4.457 4.354 4.687 . 0 0 "[ . 1 . 2]" 1
1784 1 64 TRP HE3 1 65 LEU MD1 . . 5.020 3.501 3.334 3.743 . 0 0 "[ . 1 . 2]" 1
1785 1 64 TRP HE3 1 65 LEU MD2 . . 3.980 3.619 3.502 3.697 . 0 0 "[ . 1 . 2]" 1
1786 1 64 TRP HE3 1 65 LEU HG . . 4.180 2.185 2.081 2.288 . 0 0 "[ . 1 . 2]" 1
1787 1 64 TRP HE3 1 66 LEU H . . 5.500 5.047 4.940 5.311 . 0 0 "[ . 1 . 2]" 1
1788 1 64 TRP HE3 1 68 HIS H . . 5.500 4.366 4.158 4.759 . 0 0 "[ . 1 . 2]" 1
1789 1 64 TRP HE3 1 68 HIS HB3 . . 5.500 4.207 4.036 4.349 . 0 0 "[ . 1 . 2]" 1
1790 1 64 TRP HE3 1 74 ILE MD . . 5.130 3.572 3.451 3.658 . 0 0 "[ . 1 . 2]" 1
1791 1 64 TRP HH2 1 65 LEU HA . . 5.430 5.344 5.200 5.520 0.090 19 0 "[ . 1 . 2]" 1
1792 1 64 TRP HH2 1 65 LEU MD2 . . 5.500 5.220 5.107 5.322 . 0 0 "[ . 1 . 2]" 1
1793 1 64 TRP HH2 1 68 HIS HB2 . . 5.430 3.616 3.446 3.897 . 0 0 "[ . 1 . 2]" 1
1794 1 64 TRP HH2 1 68 HIS HB3 . . 5.270 2.796 2.705 3.079 . 0 0 "[ . 1 . 2]" 1
1795 1 64 TRP HH2 1 74 ILE HA . . 5.430 3.357 3.249 3.462 . 0 0 "[ . 1 . 2]" 1
1796 1 64 TRP HH2 1 74 ILE MD . . 3.500 2.337 2.226 2.483 . 0 0 "[ . 1 . 2]" 1
1797 1 64 TRP HH2 1 74 ILE HG13 . . 4.920 4.915 4.791 4.953 0.033 19 0 "[ . 1 . 2]" 1
1798 1 64 TRP HZ2 1 68 HIS HB2 . . 5.130 4.140 3.953 4.298 . 0 0 "[ . 1 . 2]" 1
1799 1 64 TRP HZ2 1 68 HIS HB3 . . 4.760 3.721 3.586 3.858 . 0 0 "[ . 1 . 2]" 1
1800 1 64 TRP HZ2 1 68 HIS HD2 . . 5.430 4.922 4.559 5.179 . 0 0 "[ . 1 . 2]" 1
1801 1 64 TRP HZ2 1 68 HIS HE1 . . 5.430 3.092 2.980 3.202 . 0 0 "[ . 1 . 2]" 1
1802 1 64 TRP HZ2 1 74 ILE MD . . 4.840 4.253 4.152 4.399 . 0 0 "[ . 1 . 2]" 1
1803 1 64 TRP HZ3 1 65 LEU HA . . 4.430 3.323 3.171 3.648 . 0 0 "[ . 1 . 2]" 1
1804 1 64 TRP HZ3 1 65 LEU MD1 . . 4.920 4.547 4.361 4.753 . 0 0 "[ . 1 . 2]" 1
1805 1 64 TRP HZ3 1 65 LEU MD2 . . 3.980 3.252 3.125 3.383 . 0 0 "[ . 1 . 2]" 1
1806 1 64 TRP HZ3 1 65 LEU HG . . 5.430 3.155 2.929 3.363 . 0 0 "[ . 1 . 2]" 1
1807 1 64 TRP HZ3 1 74 ILE MD . . 3.720 1.867 1.837 1.909 . 0 0 "[ . 1 . 2]" 1
1808 1 65 LEU H 1 65 LEU HB2 . . 3.470 2.217 2.179 2.242 . 0 0 "[ . 1 . 2]" 1
1809 1 65 LEU H 1 65 LEU HB3 . . 3.790 3.481 3.466 3.491 . 0 0 "[ . 1 . 2]" 1
1810 1 65 LEU H 1 65 LEU MD1 . . 4.630 2.785 2.593 3.128 . 0 0 "[ . 1 . 2]" 1
1811 1 65 LEU H 1 65 LEU MD2 . . 4.690 4.129 4.088 4.171 . 0 0 "[ . 1 . 2]" 1
1812 1 65 LEU H 1 65 LEU HG . . 3.550 2.887 2.822 2.965 . 0 0 "[ . 1 . 2]" 1
1813 1 65 LEU H 1 66 LEU H . . 3.610 2.712 2.609 2.786 . 0 0 "[ . 1 . 2]" 1
1814 1 65 LEU H 1 66 LEU MD1 . . 5.500 5.290 5.206 5.356 . 0 0 "[ . 1 . 2]" 1
1815 1 65 LEU H 1 66 LEU HG . . 5.190 4.088 4.012 4.136 . 0 0 "[ . 1 . 2]" 1
1816 1 65 LEU H 1 67 SER H . . 5.340 3.785 3.727 3.825 . 0 0 "[ . 1 . 2]" 1
1817 1 65 LEU H 1 68 HIS H . . 5.500 4.409 4.347 4.488 . 0 0 "[ . 1 . 2]" 1
1818 1 65 LEU H 1 74 ILE MD . . 5.500 5.282 5.028 5.386 . 0 0 "[ . 1 . 2]" 1
1819 1 65 LEU HA 1 65 LEU MD1 . . 4.120 3.694 3.656 3.754 . 0 0 "[ . 1 . 2]" 1
1820 1 65 LEU HA 1 65 LEU MD2 . . 3.480 2.753 2.544 2.858 . 0 0 "[ . 1 . 2]" 1
1821 1 65 LEU HA 1 65 LEU HG . . 3.750 2.348 2.320 2.405 . 0 0 "[ . 1 . 2]" 1
1822 1 65 LEU HA 1 67 SER H . . 5.070 3.524 3.493 3.555 . 0 0 "[ . 1 . 2]" 1
1823 1 65 LEU HA 1 68 HIS H . . 4.340 2.802 2.726 2.894 . 0 0 "[ . 1 . 2]" 1
1824 1 65 LEU HA 1 68 HIS HB2 . . 4.920 2.757 2.657 2.875 . 0 0 "[ . 1 . 2]" 1
1825 1 65 LEU HA 1 68 HIS HB3 . . 4.630 4.029 3.893 4.199 . 0 0 "[ . 1 . 2]" 1
1826 1 65 LEU HA 1 69 MET H . . 5.070 4.152 4.031 4.233 . 0 0 "[ . 1 . 2]" 1
1827 1 65 LEU HA 1 69 MET ME . . 5.430 4.585 4.414 4.716 . 0 0 "[ . 1 . 2]" 1
1828 1 65 LEU HA 1 74 ILE MD . . 4.760 3.069 2.841 3.175 . 0 0 "[ . 1 . 2]" 1
1829 1 65 LEU HB2 1 65 LEU MD1 . . 3.540 2.114 2.004 2.161 . 0 0 "[ . 1 . 2]" 1
1830 1 65 LEU HB2 1 66 LEU H . . 3.320 2.815 2.758 2.878 . 0 0 "[ . 1 . 2]" 1
1831 1 65 LEU HB2 1 66 LEU HA . . 4.920 4.637 4.598 4.696 . 0 0 "[ . 1 . 2]" 1
1832 1 65 LEU HB2 1 66 LEU MD1 . . 5.130 4.925 4.853 4.992 . 0 0 "[ . 1 . 2]" 1
1833 1 65 LEU HB2 1 66 LEU MD2 . . 5.020 3.619 3.546 3.773 . 0 0 "[ . 1 . 2]" 1
1834 1 65 LEU HB3 1 65 LEU MD1 . . 3.670 2.832 2.726 2.892 . 0 0 "[ . 1 . 2]" 1
1835 1 65 LEU HB3 1 65 LEU MD2 . . 3.560 2.155 2.091 2.190 . 0 0 "[ . 1 . 2]" 1
1836 1 65 LEU HB3 1 66 LEU H . . 3.960 3.498 3.417 3.562 . 0 0 "[ . 1 . 2]" 1
1837 1 65 LEU HB3 1 66 LEU HA . . 5.130 4.230 4.186 4.265 . 0 0 "[ . 1 . 2]" 1
1838 1 65 LEU HB3 1 66 LEU MD2 . . 4.760 3.556 3.405 3.746 . 0 0 "[ . 1 . 2]" 1
1839 1 65 LEU HB3 1 66 LEU HG . . 4.920 4.377 4.285 4.504 . 0 0 "[ . 1 . 2]" 1
1840 1 65 LEU HB3 1 67 SER H . . 5.500 4.870 4.848 4.889 . 0 0 "[ . 1 . 2]" 1
1841 1 65 LEU HB3 1 68 HIS H . . 5.500 4.663 4.603 4.777 . 0 0 "[ . 1 . 2]" 1
1842 1 65 LEU HB3 1 68 HIS HB2 . . 5.500 5.331 5.231 5.436 . 0 0 "[ . 1 . 2]" 1
1843 1 65 LEU HB3 1 69 MET ME . . 5.430 2.849 2.533 2.961 . 0 0 "[ . 1 . 2]" 1
1844 1 65 LEU MD1 1 66 LEU H . . 5.020 4.375 4.302 4.483 . 0 0 "[ . 1 . 2]" 1
1845 1 65 LEU MD1 1 69 MET ME . . 4.760 4.184 3.999 4.444 . 0 0 "[ . 1 . 2]" 1
1846 1 65 LEU MD2 1 66 LEU H . . 5.270 4.942 4.895 4.988 . 0 0 "[ . 1 . 2]" 1
1847 1 65 LEU MD2 1 69 MET HA . . 4.920 3.741 3.614 3.993 . 0 0 "[ . 1 . 2]" 1
1848 1 65 LEU MD2 1 69 MET ME . . 4.000 2.600 2.490 2.819 . 0 0 "[ . 1 . 2]" 1
1849 1 65 LEU MD2 1 69 MET HG2 . . 4.840 3.272 3.121 3.622 . 0 0 "[ . 1 . 2]" 1
1850 1 65 LEU MD2 1 69 MET HG3 . . 5.500 4.554 4.436 4.927 . 0 0 "[ . 1 . 2]" 1
1851 1 65 LEU HG 1 66 LEU H . . 4.830 4.833 4.805 4.848 0.018 9 0 "[ . 1 . 2]" 1
1852 1 65 LEU HG 1 67 SER H . . 5.500 5.541 5.525 5.566 0.066 13 0 "[ . 1 . 2]" 1
1853 1 65 LEU HG 1 68 HIS H . . 5.500 5.111 5.007 5.248 . 0 0 "[ . 1 . 2]" 1
1854 1 66 LEU H 1 66 LEU HB2 . . 3.040 2.594 2.556 2.623 . 0 0 "[ . 1 . 2]" 1
1855 1 66 LEU H 1 66 LEU HB3 . . 3.740 3.541 3.535 3.549 . 0 0 "[ . 1 . 2]" 1
1856 1 66 LEU H 1 66 LEU MD1 . . 4.050 3.568 3.516 3.624 . 0 0 "[ . 1 . 2]" 1
1857 1 66 LEU H 1 66 LEU MD2 . . 3.800 2.934 2.856 3.056 . 0 0 "[ . 1 . 2]" 1
1858 1 66 LEU H 1 66 LEU HG . . 3.230 1.993 1.938 2.048 . 0 0 "[ . 1 . 2]" 1
1859 1 66 LEU H 1 67 SER H . . 3.590 2.613 2.584 2.637 . 0 0 "[ . 1 . 2]" 1
1860 1 66 LEU H 1 67 SER HA . . 5.500 5.129 5.088 5.156 . 0 0 "[ . 1 . 2]" 1
1861 1 66 LEU H 1 67 SER HB2 . . 5.430 4.467 4.333 4.613 . 0 0 "[ . 1 . 2]" 1
1862 1 66 LEU H 1 68 HIS H . . 4.960 3.871 3.842 3.903 . 0 0 "[ . 1 . 2]" 1
1863 1 66 LEU H 1 69 MET ME . . 5.430 5.381 5.207 5.437 0.007 16 0 "[ . 1 . 2]" 1
1864 1 66 LEU H 1 69 MET HG3 . . 5.500 4.800 4.632 5.013 . 0 0 "[ . 1 . 2]" 1
1865 1 66 LEU HA 1 66 LEU MD1 . . 4.430 3.888 3.856 3.912 . 0 0 "[ . 1 . 2]" 1
1866 1 66 LEU HA 1 66 LEU MD2 . . 2.930 1.967 1.960 1.974 . 0 0 "[ . 1 . 2]" 1
1867 1 66 LEU HA 1 66 LEU HG . . 3.710 3.285 3.220 3.317 . 0 0 "[ . 1 . 2]" 1
1868 1 66 LEU HA 1 68 HIS H . . 4.570 4.042 3.926 4.206 . 0 0 "[ . 1 . 2]" 1
1869 1 66 LEU HA 1 69 MET HB2 . . 3.520 2.991 2.841 3.103 . 0 0 "[ . 1 . 2]" 1
1870 1 66 LEU HA 1 69 MET HG3 . . 4.030 2.859 2.779 3.022 . 0 0 "[ . 1 . 2]" 1
1871 1 66 LEU HB2 1 66 LEU MD1 . . 3.140 2.279 2.237 2.333 . 0 0 "[ . 1 . 2]" 1
1872 1 66 LEU HB2 1 66 LEU MD2 . . 3.370 3.218 3.216 3.220 . 0 0 "[ . 1 . 2]" 1
1873 1 66 LEU HB2 1 67 SER H . . 3.890 3.447 3.404 3.503 . 0 0 "[ . 1 . 2]" 1
1874 1 66 LEU HB2 1 67 SER HA . . 5.500 4.570 4.540 4.617 . 0 0 "[ . 1 . 2]" 1
1875 1 66 LEU HB2 1 68 HIS H . . 5.500 5.164 5.121 5.258 . 0 0 "[ . 1 . 2]" 1
1876 1 66 LEU HB3 1 66 LEU MD1 . . 3.150 2.388 2.309 2.472 . 0 0 "[ . 1 . 2]" 1
1877 1 66 LEU HB3 1 66 LEU MD2 . . 3.240 2.494 2.467 2.516 . 0 0 "[ . 1 . 2]" 1
1878 1 66 LEU HB3 1 67 SER H . . 4.320 4.364 4.336 4.397 0.077 17 0 "[ . 1 . 2]" 1
1879 1 66 LEU HB3 1 67 SER HA . . 5.430 4.894 4.861 4.927 . 0 0 "[ . 1 . 2]" 1
1880 1 66 LEU MD1 1 67 SER H . . 5.130 5.109 5.057 5.149 0.019 3 0 "[ . 1 . 2]" 1
1881 1 66 LEU MD2 1 67 SER H . . 5.070 4.551 4.503 4.628 . 0 0 "[ . 1 . 2]" 1
1882 1 66 LEU MD2 1 68 HIS H . . 5.500 5.216 5.115 5.346 . 0 0 "[ . 1 . 2]" 1
1883 1 66 LEU MD2 1 69 MET H . . 5.500 5.241 5.101 5.355 . 0 0 "[ . 1 . 2]" 1
1884 1 66 LEU MD2 1 69 MET HB2 . . 4.210 4.138 4.031 4.228 0.018 20 0 "[ . 1 . 2]" 1
1885 1 66 LEU MD2 1 69 MET ME . . 3.870 3.746 3.646 3.848 . 0 0 "[ . 1 . 2]" 1
1886 1 66 LEU MD2 1 69 MET HG2 . . 5.130 3.729 3.509 3.854 . 0 0 "[ . 1 . 2]" 1
1887 1 66 LEU MD2 1 69 MET HG3 . . 5.130 2.879 2.776 3.047 . 0 0 "[ . 1 . 2]" 1
1888 1 66 LEU HG 1 67 SER H . . 4.540 4.402 4.354 4.450 . 0 0 "[ . 1 . 2]" 1
1889 1 67 SER H 1 67 SER HB2 . . 3.570 2.440 2.334 2.728 . 0 0 "[ . 1 . 2]" 1
1890 1 67 SER H 1 67 SER HB3 . . 3.870 3.292 2.750 3.630 . 0 0 "[ . 1 . 2]" 1
1891 1 67 SER H 1 68 HIS H . . 3.260 1.929 1.882 1.980 . 0 0 "[ . 1 . 2]" 1
1892 1 67 SER H 1 68 HIS HB2 . . 5.500 3.954 3.860 4.045 . 0 0 "[ . 1 . 2]" 1
1893 1 67 SER H 1 68 HIS HB3 . . 5.420 5.398 5.333 5.453 0.033 17 0 "[ . 1 . 2]" 1
1894 1 67 SER H 1 68 HIS HD2 . . 5.020 3.767 3.676 3.872 . 0 0 "[ . 1 . 2]" 1
1895 1 67 SER H 1 69 MET H . . 4.450 3.707 3.468 3.866 . 0 0 "[ . 1 . 2]" 1
1896 1 67 SER HA 1 69 MET H . . 5.130 3.879 3.783 3.955 . 0 0 "[ . 1 . 2]" 1
1897 1 67 SER HB2 1 68 HIS H . . 4.380 3.691 3.311 4.057 . 0 0 "[ . 1 . 2]" 1
1898 1 67 SER HB2 1 68 HIS HD2 . . 4.000 3.115 2.496 3.791 . 0 0 "[ . 1 . 2]" 1
1899 1 67 SER HB3 1 68 HIS H . . 4.690 3.776 3.212 4.118 . 0 0 "[ . 1 . 2]" 1
1900 1 67 SER HB3 1 68 HIS HD2 . . 4.430 2.140 1.997 2.499 . 0 0 "[ . 1 . 2]" 1
1901 1 67 SER HB3 1 69 MET H . . 5.500 5.363 5.066 5.501 0.001 9 0 "[ . 1 . 2]" 1
1902 1 68 HIS H 1 68 HIS HB2 . . 4.020 2.586 2.485 2.643 . 0 0 "[ . 1 . 2]" 1
1903 1 68 HIS H 1 68 HIS HB3 . . 3.600 3.698 3.656 3.724 0.124 16 0 "[ . 1 . 2]" 1
1904 1 68 HIS H 1 68 HIS HD2 . . 4.360 3.387 3.167 3.587 . 0 0 "[ . 1 . 2]" 1
1905 1 68 HIS H 1 69 MET H . . 3.210 2.326 2.132 2.487 . 0 0 "[ . 1 . 2]" 1
1906 1 68 HIS H 1 69 MET HA . . 4.920 4.168 4.088 4.253 . 0 0 "[ . 1 . 2]" 1
1907 1 68 HIS H 1 69 MET HB2 . . 5.340 3.789 3.678 3.926 . 0 0 "[ . 1 . 2]" 1
1908 1 68 HIS H 1 69 MET HB3 . . 5.500 5.296 5.186 5.420 . 0 0 "[ . 1 . 2]" 1
1909 1 68 HIS H 1 70 ASP H . . 5.340 4.696 4.481 4.922 . 0 0 "[ . 1 . 2]" 1
1910 1 68 HIS HA 1 68 HIS HD2 . . 4.760 3.476 3.286 3.702 . 0 0 "[ . 1 . 2]" 1
1911 1 68 HIS HA 1 69 MET HB2 . . 5.270 5.005 4.953 5.067 . 0 0 "[ . 1 . 2]" 1
1912 1 68 HIS HA 1 70 ASP H . . 4.570 3.916 3.831 4.055 . 0 0 "[ . 1 . 2]" 1
1913 1 68 HIS HA 1 71 ASP H . . 5.020 4.327 3.655 4.615 . 0 0 "[ . 1 . 2]" 1
1914 1 68 HIS HA 1 71 ASP HB2 . . 5.270 2.739 2.438 2.928 . 0 0 "[ . 1 . 2]" 1
1915 1 68 HIS HA 1 71 ASP HB3 . . 4.630 4.165 3.846 4.322 . 0 0 "[ . 1 . 2]" 1
1916 1 68 HIS HA 1 74 ILE MD . . 5.500 3.935 3.798 4.048 . 0 0 "[ . 1 . 2]" 1
1917 1 68 HIS HB2 1 69 MET H . . 5.500 4.178 4.057 4.278 . 0 0 "[ . 1 . 2]" 1
1918 1 68 HIS HB2 1 69 MET HA . . 5.500 4.865 4.776 4.920 . 0 0 "[ . 1 . 2]" 1
1919 1 68 HIS HB2 1 71 ASP HB2 . . 5.430 4.684 4.292 4.819 . 0 0 "[ . 1 . 2]" 1
1920 1 68 HIS HB2 1 74 ILE HB . . 5.430 4.975 4.743 5.134 . 0 0 "[ . 1 . 2]" 1
1921 1 68 HIS HB2 1 74 ILE MD . . 4.100 2.909 2.621 3.047 . 0 0 "[ . 1 . 2]" 1
1922 1 68 HIS HB2 1 74 ILE HG12 . . 5.270 5.097 4.823 5.256 . 0 0 "[ . 1 . 2]" 1
1923 1 68 HIS HB3 1 69 MET H . . 4.790 4.463 4.428 4.489 . 0 0 "[ . 1 . 2]" 1
1924 1 68 HIS HB3 1 71 ASP HB3 . . 4.430 4.191 3.804 4.390 . 0 0 "[ . 1 . 2]" 1
1925 1 68 HIS HB3 1 74 ILE MD . . 4.690 2.097 1.946 2.260 . 0 0 "[ . 1 . 2]" 1
1926 1 69 MET H 1 69 MET HB2 . . 3.320 2.016 1.988 2.046 . 0 0 "[ . 1 . 2]" 1
1927 1 69 MET H 1 69 MET HB3 . . 3.690 3.239 3.195 3.282 . 0 0 "[ . 1 . 2]" 1
1928 1 69 MET H 1 69 MET ME . . 5.270 5.185 5.071 5.269 . 0 0 "[ . 1 . 2]" 1
1929 1 69 MET H 1 69 MET HG2 . . 3.700 3.510 3.388 3.613 . 0 0 "[ . 1 . 2]" 1
1930 1 69 MET H 1 69 MET HG3 . . 4.100 4.024 3.910 4.087 . 0 0 "[ . 1 . 2]" 1
1931 1 69 MET H 1 70 ASP H . . 3.750 2.488 2.375 2.643 . 0 0 "[ . 1 . 2]" 1
1932 1 69 MET H 1 74 ILE MD . . 5.340 4.428 4.179 4.566 . 0 0 "[ . 1 . 2]" 1
1933 1 69 MET HA 1 69 MET ME . . 3.960 3.416 3.265 3.511 . 0 0 "[ . 1 . 2]" 1
1934 1 69 MET HA 1 69 MET HG2 . . 3.870 2.258 2.197 2.330 . 0 0 "[ . 1 . 2]" 1
1935 1 69 MET HA 1 71 ASP H . . 4.920 4.113 3.920 4.271 . 0 0 "[ . 1 . 2]" 1
1936 1 69 MET HA 1 74 ILE HB . . 4.240 4.254 4.236 4.264 0.024 5 0 "[ . 1 . 2]" 1
1937 1 69 MET HA 1 74 ILE MD . . 3.320 3.257 3.072 3.326 0.006 14 0 "[ . 1 . 2]" 1
1938 1 69 MET HA 1 74 ILE HG12 . . 3.660 2.707 2.615 2.772 . 0 0 "[ . 1 . 2]" 1
1939 1 69 MET HA 1 74 ILE HG13 . . 4.430 4.394 4.284 4.447 0.017 6 0 "[ . 1 . 2]" 1
1940 1 69 MET HA 1 74 ILE MG . . 3.910 3.842 3.664 3.918 0.008 6 0 "[ . 1 . 2]" 1
1941 1 69 MET HB2 1 70 ASP H . . 4.100 3.005 2.937 3.068 . 0 0 "[ . 1 . 2]" 1
1942 1 69 MET HB3 1 70 ASP H . . 5.020 2.984 2.804 3.136 . 0 0 "[ . 1 . 2]" 1
1943 1 69 MET ME 1 74 ILE MD . . 4.690 4.380 4.151 4.528 . 0 0 "[ . 1 . 2]" 1
1944 1 69 MET HG2 1 70 ASP H . . 5.130 4.950 4.917 4.983 . 0 0 "[ . 1 . 2]" 1
1945 1 69 MET HG2 1 74 ILE HG12 . . 5.270 4.454 4.363 4.607 . 0 0 "[ . 1 . 2]" 1
1946 1 69 MET HG3 1 70 ASP H . . 5.190 5.150 5.053 5.194 0.004 16 0 "[ . 1 . 2]" 1
1947 1 70 ASP H 1 70 ASP HB2 . . 4.120 2.774 2.267 3.657 . 0 0 "[ . 1 . 2]" 1
1948 1 70 ASP H 1 70 ASP HB3 . . 3.650 3.028 2.489 3.666 0.016 7 0 "[ . 1 . 2]" 1
1949 1 70 ASP H 1 71 ASP H . . 3.750 3.325 2.958 3.499 . 0 0 "[ . 1 . 2]" 1
1950 1 70 ASP HB2 1 71 ASP H . . 5.130 4.545 4.367 4.718 . 0 0 "[ . 1 . 2]" 1
1951 1 70 ASP HB3 1 71 ASP H . . 4.760 4.451 4.233 4.721 . 0 0 "[ . 1 . 2]" 1
1952 1 71 ASP H 1 71 ASP HB2 . . 3.500 2.417 2.156 2.511 . 0 0 "[ . 1 . 2]" 1
1953 1 71 ASP H 1 71 ASP HB3 . . 3.510 3.420 3.318 3.514 0.004 8 0 "[ . 1 . 2]" 1
1954 1 71 ASP H 1 72 PRO HD2 . . 5.270 4.970 4.959 4.977 . 0 0 "[ . 1 . 2]" 1
1955 1 71 ASP H 1 72 PRO HD3 . . 5.270 4.730 4.697 4.792 . 0 0 "[ . 1 . 2]" 1
1956 1 71 ASP H 1 73 ASP H . . 5.500 5.169 4.685 5.290 . 0 0 "[ . 1 . 2]" 1
1957 1 71 ASP H 1 74 ILE H . . 4.450 4.016 3.768 4.087 . 0 0 "[ . 1 . 2]" 1
1958 1 71 ASP H 1 74 ILE HB . . 4.340 2.959 2.702 3.071 . 0 0 "[ . 1 . 2]" 1
1959 1 71 ASP H 1 74 ILE MD . . 4.840 4.354 4.158 4.472 . 0 0 "[ . 1 . 2]" 1
1960 1 71 ASP H 1 74 ILE HG12 . . 5.500 4.050 3.834 4.128 . 0 0 "[ . 1 . 2]" 1
1961 1 71 ASP H 1 74 ILE MG . . 4.430 2.339 1.962 2.614 . 0 0 "[ . 1 . 2]" 1
1962 1 71 ASP HA 1 72 PRO HB2 . . 5.500 5.653 5.646 5.662 0.162 14 0 "[ . 1 . 2]" 1
1963 1 71 ASP HA 1 72 PRO HD2 . . 3.820 2.783 2.765 2.803 . 0 0 "[ . 1 . 2]" 1
1964 1 71 ASP HA 1 72 PRO HD3 . . 3.020 2.066 2.056 2.077 . 0 0 "[ . 1 . 2]" 1
1965 1 71 ASP HA 1 72 PRO HG2 . . 4.840 4.717 4.703 4.732 . 0 0 "[ . 1 . 2]" 1
1966 1 71 ASP HA 1 72 PRO HG3 . . 4.760 4.334 4.326 4.343 . 0 0 "[ . 1 . 2]" 1
1967 1 71 ASP HA 1 73 ASP H . . 5.270 4.185 3.964 4.231 . 0 0 "[ . 1 . 2]" 1
1968 1 71 ASP HA 1 74 ILE H . . 5.500 4.654 4.559 4.684 . 0 0 "[ . 1 . 2]" 1
1969 1 71 ASP HB2 1 72 PRO HD2 . . 3.940 3.949 3.920 3.969 0.029 17 0 "[ . 1 . 2]" 1
1970 1 71 ASP HB2 1 72 PRO HD3 . . 4.430 4.484 4.463 4.502 0.072 17 0 "[ . 1 . 2]" 1
1971 1 71 ASP HB2 1 73 ASP H . . 4.120 4.080 3.731 4.138 0.018 19 0 "[ . 1 . 2]" 1
1972 1 71 ASP HB2 1 73 ASP HB2 . . 4.470 4.404 4.284 4.469 . 0 0 "[ . 1 . 2]" 1
1973 1 71 ASP HB2 1 74 ILE H . . 4.290 3.168 3.002 3.221 . 0 0 "[ . 1 . 2]" 1
1974 1 71 ASP HB2 1 74 ILE HA . . 4.920 4.869 4.701 4.930 0.010 11 0 "[ . 1 . 2]" 1
1975 1 71 ASP HB2 1 74 ILE HB . . 3.870 2.655 2.482 2.763 . 0 0 "[ . 1 . 2]" 1
1976 1 71 ASP HB2 1 74 ILE MD . . 4.470 3.546 3.427 3.645 . 0 0 "[ . 1 . 2]" 1
1977 1 71 ASP HB2 1 74 ILE MG . . 4.630 3.591 3.178 3.755 . 0 0 "[ . 1 . 2]" 1
1978 1 71 ASP HB3 1 72 PRO HB3 . . 5.500 5.649 5.627 5.697 0.197 9 0 "[ . 1 . 2]" 1
1979 1 71 ASP HB3 1 72 PRO HD2 . . 4.380 2.477 2.421 2.592 . 0 0 "[ . 1 . 2]" 1
1980 1 71 ASP HB3 1 72 PRO HD3 . . 4.760 3.500 3.454 3.591 . 0 0 "[ . 1 . 2]" 1
1981 1 71 ASP HB3 1 73 ASP H . . 4.210 2.388 2.044 2.472 . 0 0 "[ . 1 . 2]" 1
1982 1 71 ASP HB3 1 73 ASP HB2 . . 4.470 3.264 3.101 3.327 . 0 0 "[ . 1 . 2]" 1
1983 1 71 ASP HB3 1 74 ILE H . . 4.360 2.426 2.334 2.490 . 0 0 "[ . 1 . 2]" 1
1984 1 71 ASP HB3 1 74 ILE HA . . 4.840 4.815 4.761 4.852 0.012 17 0 "[ . 1 . 2]" 1
1985 1 71 ASP HB3 1 74 ILE HB . . 3.710 3.189 3.081 3.257 . 0 0 "[ . 1 . 2]" 1
1986 1 71 ASP HB3 1 74 ILE MD . . 4.210 4.217 4.198 4.229 0.019 13 0 "[ . 1 . 2]" 1
1987 1 71 ASP HB3 1 74 ILE MG . . 4.630 3.903 3.645 4.036 . 0 0 "[ . 1 . 2]" 1
1988 1 72 PRO HA 1 74 ILE H . . 4.840 4.165 4.107 4.291 . 0 0 "[ . 1 . 2]" 1
1989 1 72 PRO HA 1 74 ILE MG . . 5.270 3.663 3.577 3.886 . 0 0 "[ . 1 . 2]" 1
1990 1 72 PRO HB3 1 73 ASP H . . 4.240 4.303 4.261 4.478 0.238 9 0 "[ . 1 . 2]" 1
1991 1 72 PRO HD2 1 73 ASP H . . 4.070 2.272 2.254 2.417 . 0 0 "[ . 1 . 2]" 1
1992 1 72 PRO HD3 1 73 ASP H . . 4.630 3.660 3.655 3.699 . 0 0 "[ . 1 . 2]" 1
1993 1 72 PRO HG2 1 73 ASP H . . 4.520 3.011 2.919 3.441 . 0 0 "[ . 1 . 2]" 1
1994 1 72 PRO HG3 1 73 ASP H . . 4.380 4.192 4.133 4.472 0.092 9 0 "[ . 1 . 2]" 1
1995 1 73 ASP H 1 73 ASP HB2 . . 3.840 2.761 2.681 2.798 . 0 0 "[ . 1 . 2]" 1
1996 1 73 ASP H 1 73 ASP HB3 . . 3.820 3.526 3.512 3.579 . 0 0 "[ . 1 . 2]" 1
1997 1 73 ASP H 1 74 ILE H . . 3.430 2.570 2.324 2.621 . 0 0 "[ . 1 . 2]" 1
1998 1 73 ASP H 1 74 ILE HA . . 5.270 5.096 4.885 5.138 . 0 0 "[ . 1 . 2]" 1
1999 1 73 ASP H 1 74 ILE HB . . 5.270 4.446 4.172 4.504 . 0 0 "[ . 1 . 2]" 1
2000 1 73 ASP H 1 74 ILE MG . . 5.130 4.359 4.150 4.424 . 0 0 "[ . 1 . 2]" 1
2001 1 73 ASP H 1 75 ASP H . . 5.500 4.045 3.897 4.116 . 0 0 "[ . 1 . 2]" 1
2002 1 73 ASP HB2 1 74 ILE H . . 4.960 2.646 2.589 2.717 . 0 0 "[ . 1 . 2]" 1
2003 1 73 ASP HB2 1 76 ALA H . . 5.500 4.791 4.734 4.839 . 0 0 "[ . 1 . 2]" 1
2004 1 73 ASP HB2 1 76 ALA MB . . 4.030 4.008 3.964 4.036 0.006 18 0 "[ . 1 . 2]" 1
2005 1 73 ASP HB3 1 74 ILE H . . 5.130 3.959 3.905 4.011 . 0 0 "[ . 1 . 2]" 1
2006 1 73 ASP HB3 1 74 ILE HA . . 4.840 4.761 4.675 4.808 . 0 0 "[ . 1 . 2]" 1
2007 1 73 ASP HB3 1 76 ALA H . . 4.470 4.464 4.440 4.484 0.014 18 0 "[ . 1 . 2]" 1
2008 1 73 ASP HB3 1 76 ALA MB . . 3.540 3.008 2.963 3.072 . 0 0 "[ . 1 . 2]" 1
2009 1 74 ILE H 1 74 ILE HB . . 3.130 2.098 2.081 2.124 . 0 0 "[ . 1 . 2]" 1
2010 1 74 ILE H 1 74 ILE MD . . 3.420 3.328 3.252 3.391 . 0 0 "[ . 1 . 2]" 1
2011 1 74 ILE H 1 74 ILE HG12 . . 4.600 4.500 4.465 4.554 . 0 0 "[ . 1 . 2]" 1
2012 1 74 ILE H 1 74 ILE HG13 . . 4.830 4.452 4.413 4.474 . 0 0 "[ . 1 . 2]" 1
2013 1 74 ILE H 1 74 ILE MG . . 3.110 2.719 2.681 2.744 . 0 0 "[ . 1 . 2]" 1
2014 1 74 ILE H 1 75 ASP H . . 3.770 2.813 2.787 2.831 . 0 0 "[ . 1 . 2]" 1
2015 1 74 ILE H 1 75 ASP HA . . 5.500 5.308 5.286 5.323 . 0 0 "[ . 1 . 2]" 1
2016 1 74 ILE H 1 75 ASP HB2 . . 5.500 5.095 4.629 6.394 0.894 9 2 "[ . +1 -. 2]" 1
2017 1 74 ILE H 1 76 ALA H . . 4.450 4.099 3.936 4.159 . 0 0 "[ . 1 . 2]" 1
2018 1 74 ILE H 1 76 ALA MB . . 5.500 4.535 4.476 4.576 . 0 0 "[ . 1 . 2]" 1
2019 1 74 ILE HA 1 74 ILE MD . . 2.980 2.117 2.026 2.296 . 0 0 "[ . 1 . 2]" 1
2020 1 74 ILE HA 1 74 ILE HG12 . . 4.000 3.583 3.567 3.600 . 0 0 "[ . 1 . 2]" 1
2021 1 74 ILE HA 1 74 ILE HG13 . . 3.610 2.643 2.539 2.695 . 0 0 "[ . 1 . 2]" 1
2022 1 74 ILE HA 1 74 ILE MG . . 3.230 3.173 3.169 3.180 . 0 0 "[ . 1 . 2]" 1
2023 1 74 ILE HA 1 76 ALA H . . 4.520 4.467 4.242 4.533 0.013 17 0 "[ . 1 . 2]" 1
2024 1 74 ILE HA 1 76 ALA MB . . 5.270 4.821 4.772 4.872 . 0 0 "[ . 1 . 2]" 1
2025 1 74 ILE HB 1 74 ILE MD . . 3.300 2.183 2.096 2.239 . 0 0 "[ . 1 . 2]" 1
2026 1 74 ILE HB 1 75 ASP H . . 4.920 3.876 3.746 3.932 . 0 0 "[ . 1 . 2]" 1
2027 1 74 ILE MD 1 75 ASP H . . 5.020 4.812 4.739 4.906 . 0 0 "[ . 1 . 2]" 1
2028 1 74 ILE HG12 1 74 ILE MG . . 3.250 2.373 2.261 2.423 . 0 0 "[ . 1 . 2]" 1
2029 1 74 ILE HG12 1 75 ASP H . . 5.500 5.398 5.285 5.474 . 0 0 "[ . 1 . 2]" 1
2030 1 74 ILE HG13 1 74 ILE MG . . 3.220 2.449 2.401 2.556 . 0 0 "[ . 1 . 2]" 1
2031 1 74 ILE HG13 1 75 ASP H . . 5.500 4.742 4.669 4.793 . 0 0 "[ . 1 . 2]" 1
2032 1 74 ILE MG 1 75 ASP H . . 3.230 2.210 2.010 2.289 . 0 0 "[ . 1 . 2]" 1
2033 1 74 ILE MG 1 75 ASP HA . . 4.520 3.256 3.153 3.307 . 0 0 "[ . 1 . 2]" 1
2034 1 74 ILE MG 1 75 ASP HB2 . . 4.570 3.609 2.937 4.342 . 0 0 "[ . 1 . 2]" 1
2035 1 74 ILE MG 1 75 ASP HB3 . . 4.840 4.224 3.015 4.441 . 0 0 "[ . 1 . 2]" 1
2036 1 74 ILE MG 1 76 ALA H . . 4.920 4.222 4.077 4.289 . 0 0 "[ . 1 . 2]" 1
2037 1 75 ASP H 1 75 ASP HB2 . . 3.380 2.461 2.106 3.585 0.205 9 0 "[ . 1 . 2]" 1
2038 1 75 ASP H 1 75 ASP HB3 . . 4.050 3.372 2.727 3.600 . 0 0 "[ . 1 . 2]" 1
2039 1 75 ASP H 1 76 ALA H . . 3.290 2.227 2.151 2.324 . 0 0 "[ . 1 . 2]" 1
2040 1 75 ASP H 1 76 ALA HA . . 5.500 4.810 4.731 4.902 . 0 0 "[ . 1 . 2]" 1
2041 1 75 ASP H 1 76 ALA MB . . 4.520 3.808 3.755 3.944 . 0 0 "[ . 1 . 2]" 1
2042 1 75 ASP HA 1 76 ALA MB . . 5.500 4.982 4.967 4.993 . 0 0 "[ . 1 . 2]" 1
2043 1 75 ASP HB2 1 76 ALA H . . 4.660 2.962 2.629 3.913 . 0 0 "[ . 1 . 2]" 1
2044 1 75 ASP HB3 1 76 ALA H . . 4.690 3.611 3.007 4.113 . 0 0 "[ . 1 . 2]" 1
2045 1 75 ASP HB3 1 76 ALA HA . . 5.430 4.369 3.758 5.601 0.171 14 0 "[ . 1 . 2]" 1
2046 1 75 ASP HB3 1 76 ALA MB . . 5.020 4.831 4.248 5.436 0.416 9 0 "[ . 1 . 2]" 1
2047 1 76 ALA H 1 76 ALA MB . . 2.940 2.089 2.062 2.122 . 0 0 "[ . 1 . 2]" 1
2048 1 76 ALA H 1 77 PRO HD2 . . 5.270 4.987 4.977 5.008 . 0 0 "[ . 1 . 2]" 1
2049 1 76 ALA H 1 77 PRO HD3 . . 5.020 4.656 4.619 4.701 . 0 0 "[ . 1 . 2]" 1
2050 1 76 ALA HA 1 77 PRO HD2 . . 3.080 2.596 2.560 2.632 . 0 0 "[ . 1 . 2]" 1
2051 1 76 ALA HA 1 77 PRO HD3 . . 2.970 1.947 1.936 1.961 . 0 0 "[ . 1 . 2]" 1
2052 1 76 ALA HA 1 77 PRO HG3 . . 4.150 4.219 4.208 4.231 0.081 15 0 "[ . 1 . 2]" 1
2053 1 76 ALA MB 1 77 PRO HA . . 5.430 4.363 4.350 4.379 . 0 0 "[ . 1 . 2]" 1
2054 1 76 ALA MB 1 77 PRO HD2 . . 3.350 2.471 2.391 2.582 . 0 0 "[ . 1 . 2]" 1
2055 1 76 ALA MB 1 77 PRO HD3 . . 3.790 3.201 3.152 3.256 . 0 0 "[ . 1 . 2]" 1
2056 1 76 ALA MB 1 77 PRO HG2 . . 4.690 4.384 4.321 4.463 . 0 0 "[ . 1 . 2]" 1
2057 1 77 PRO HA 1 78 ILE H . . 2.960 2.308 2.260 2.438 . 0 0 "[ . 1 . 2]" 1
2058 1 77 PRO HA 1 78 ILE HA . . 4.690 4.219 4.211 4.229 . 0 0 "[ . 1 . 2]" 1
2059 1 77 PRO HA 1 78 ILE HB . . 4.760 4.480 4.395 4.595 . 0 0 "[ . 1 . 2]" 1
2060 1 77 PRO HA 1 78 ILE HG13 . . 4.840 3.876 3.640 4.077 . 0 0 "[ . 1 . 2]" 1
2061 1 77 PRO HA 1 78 ILE MG . . 5.430 5.425 5.394 5.468 0.038 14 0 "[ . 1 . 2]" 1
2062 1 77 PRO HA 1 79 SER H . . 5.270 4.398 3.671 4.876 . 0 0 "[ . 1 . 2]" 1
2063 1 77 PRO HB2 1 78 ILE H . . 4.150 3.054 2.705 3.202 . 0 0 "[ . 1 . 2]" 1
2064 1 77 PRO HB2 1 78 ILE HA . . 5.430 4.750 4.590 4.815 . 0 0 "[ . 1 . 2]" 1
2065 1 77 PRO HB2 1 79 SER H . . 4.790 3.219 2.062 3.606 . 0 0 "[ . 1 . 2]" 1
2066 1 77 PRO HB2 1 79 SER HA . . 5.270 4.583 3.239 5.131 . 0 0 "[ . 1 . 2]" 1
2067 1 77 PRO HB2 1 80 GLY H . . 5.500 3.292 2.011 4.879 . 0 0 "[ . 1 . 2]" 1
2068 1 77 PRO HB3 1 78 ILE H . . 4.000 3.584 3.395 3.671 . 0 0 "[ . 1 . 2]" 1
2069 1 77 PRO HB3 1 79 SER H . . 5.500 4.537 3.696 4.944 . 0 0 "[ . 1 . 2]" 1
2070 1 77 PRO HD2 1 78 ILE H . . 5.500 5.502 5.431 5.518 0.018 19 0 "[ . 1 . 2]" 1
2071 1 77 PRO HG2 1 78 ILE H . . 5.130 4.984 4.721 5.086 . 0 0 "[ . 1 . 2]" 1
2072 1 77 PRO HG2 1 79 SER H . . 5.500 5.145 3.575 5.500 0.000 14 0 "[ . 1 . 2]" 1
2073 1 77 PRO HG2 1 80 GLY H . . 5.500 3.918 3.264 5.500 0.000 18 0 "[ . 1 . 2]" 1
2074 1 78 ILE H 1 78 ILE HB . . 3.310 2.212 2.139 2.320 . 0 0 "[ . 1 . 2]" 1
2075 1 78 ILE H 1 78 ILE MD . . 4.470 3.490 3.364 3.589 . 0 0 "[ . 1 . 2]" 1
2076 1 78 ILE H 1 78 ILE HG12 . . 4.210 3.859 3.622 3.990 . 0 0 "[ . 1 . 2]" 1
2077 1 78 ILE H 1 78 ILE HG13 . . 3.610 2.593 2.285 2.775 . 0 0 "[ . 1 . 2]" 1
2078 1 78 ILE H 1 78 ILE MG . . 4.340 3.627 3.574 3.689 . 0 0 "[ . 1 . 2]" 1
2079 1 78 ILE H 1 79 SER H . . 3.800 2.598 2.498 2.702 . 0 0 "[ . 1 . 2]" 1
2080 1 78 ILE H 1 79 SER HA . . 5.190 4.983 4.726 5.116 . 0 0 "[ . 1 . 2]" 1
2081 1 78 ILE HA 1 78 ILE MD . . 4.180 3.794 3.766 3.836 . 0 0 "[ . 1 . 2]" 1
2082 1 78 ILE HA 1 78 ILE HG12 . . 3.580 2.531 2.482 2.622 . 0 0 "[ . 1 . 2]" 1
2083 1 78 ILE HA 1 78 ILE HG13 . . 3.920 2.665 2.535 2.813 . 0 0 "[ . 1 . 2]" 1
2084 1 78 ILE HA 1 78 ILE MG . . 3.430 2.590 2.497 2.657 . 0 0 "[ . 1 . 2]" 1
2085 1 78 ILE HA 1 79 SER HA . . 5.130 4.553 4.487 5.112 . 0 0 "[ . 1 . 2]" 1
2086 1 78 ILE HA 1 80 GLY H . . 5.500 5.198 4.462 5.507 0.007 18 0 "[ . 1 . 2]" 1
2087 1 78 ILE HB 1 78 ILE MD . . 3.600 2.328 2.294 2.353 . 0 0 "[ . 1 . 2]" 1
2088 1 78 ILE HB 1 79 SER H . . 4.250 2.647 2.379 3.563 . 0 0 "[ . 1 . 2]" 1
2089 1 78 ILE MD 1 79 SER H . . 5.340 4.517 4.277 5.226 . 0 0 "[ . 1 . 2]" 1
2090 1 78 ILE HG12 1 79 SER H . . 5.420 5.104 4.952 5.432 0.012 18 0 "[ . 1 . 2]" 1
2091 1 78 ILE HG13 1 79 SER H . . 5.340 4.560 4.364 4.842 . 0 0 "[ . 1 . 2]" 1
2092 1 78 ILE MG 1 79 SER H . . 3.990 2.998 2.766 3.690 . 0 0 "[ . 1 . 2]" 1
2093 1 78 ILE MG 1 79 SER HA . . 4.840 3.709 3.327 4.632 . 0 0 "[ . 1 . 2]" 1
2094 1 78 ILE MG 1 79 SER HB2 . . 4.630 3.341 2.364 4.932 0.302 16 0 "[ . 1 . 2]" 1
2095 1 78 ILE MG 1 80 GLY H . . 5.420 5.021 3.810 5.393 . 0 0 "[ . 1 . 2]" 1
2096 1 79 SER H 1 79 SER HB2 . . 3.710 3.038 2.204 3.968 0.258 13 0 "[ . 1 . 2]" 1
2097 1 79 SER H 1 80 GLY HA2 . . 5.500 4.853 4.115 5.442 . 0 0 "[ . 1 . 2]" 1
2098 1 79 SER HA 1 80 GLY H . . 3.400 2.486 2.229 3.326 . 0 0 "[ . 1 . 2]" 1
2099 1 79 SER HB3 1 80 GLY H . . 4.340 4.327 3.599 4.703 0.363 5 0 "[ . 1 . 2]" 1
2100 1 80 GLY H 1 81 PRO HD3 . . 5.500 4.456 3.136 4.821 . 0 0 "[ . 1 . 2]" 1
2101 1 80 GLY HA2 1 81 PRO HD3 . . 3.430 2.209 1.928 2.765 . 0 0 "[ . 1 . 2]" 1
2102 1 80 GLY HA3 1 81 PRO HD2 . . 3.430 2.706 2.204 3.474 0.044 3 0 "[ . 1 . 2]" 1
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