NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
603791 |
5i22   |
30010 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5i22
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 2572
_Distance_constraint_stats_list.Viol_count 4063
_Distance_constraint_stats_list.Viol_total 2869.588
_Distance_constraint_stats_list.Viol_max 1.076
_Distance_constraint_stats_list.Viol_rms 0.0230
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.0353
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 0.160 0.029 5 0 "[ . 1 . 2]"
1 2 ARG 0.925 0.046 18 0 "[ . 1 . 2]"
1 3 LEU 1.190 0.352 19 0 "[ . 1 . 2]"
1 4 ASP 0.264 0.068 11 0 "[ . 1 . 2]"
1 5 LEU 5.350 0.079 19 0 "[ . 1 . 2]"
1 6 PRO 4.745 0.074 19 0 "[ . 1 . 2]"
1 7 PRO 1.276 0.056 16 0 "[ . 1 . 2]"
1 8 GLY 0.098 0.015 9 0 "[ . 1 . 2]"
1 9 PHE 5.335 0.057 19 0 "[ . 1 . 2]"
1 10 MET 1.202 0.061 8 0 "[ . 1 . 2]"
1 11 PHE 5.290 0.111 1 0 "[ . 1 . 2]"
1 12 LYS 6.820 0.081 12 0 "[ . 1 . 2]"
1 13 VAL 3.833 0.095 5 0 "[ . 1 . 2]"
1 14 GLN 1.056 0.050 6 0 "[ . 1 . 2]"
1 15 ALA 1.878 0.074 8 0 "[ . 1 . 2]"
1 16 GLN 2.516 0.086 11 0 "[ . 1 . 2]"
1 17 HIS 3.607 0.817 1 2 "[+ . 1- . 2]"
1 18 ASP 0.985 0.059 12 0 "[ . 1 . 2]"
1 19 TYR 4.955 0.402 4 0 "[ . 1 . 2]"
1 20 THR 0.570 0.055 14 0 "[ . 1 . 2]"
1 21 ALA 1.688 0.060 20 0 "[ . 1 . 2]"
1 22 THR 1.050 0.060 20 0 "[ . 1 . 2]"
1 23 ASP 1.241 0.057 14 0 "[ . 1 . 2]"
1 24 THR 0.495 0.047 3 0 "[ . 1 . 2]"
1 25 ASP 0.152 0.033 15 0 "[ . 1 . 2]"
1 26 GLU 1.755 0.069 12 0 "[ . 1 . 2]"
1 27 LEU 3.416 0.118 6 0 "[ . 1 . 2]"
1 28 GLN 1.354 0.056 2 0 "[ . 1 . 2]"
1 29 LEU 10.089 0.402 4 0 "[ . 1 . 2]"
1 30 LYS 2.152 0.074 8 0 "[ . 1 . 2]"
1 31 ALA 0.370 0.029 2 0 "[ . 1 . 2]"
1 32 GLY 1.124 0.102 5 0 "[ . 1 . 2]"
1 33 ASP 4.029 0.181 14 0 "[ . 1 . 2]"
1 34 VAL 9.337 0.493 5 0 "[ . 1 . 2]"
1 35 VAL 3.923 0.187 1 0 "[ . 1 . 2]"
1 36 LEU 6.326 0.081 12 0 "[ . 1 . 2]"
1 37 VAL 7.475 0.187 1 0 "[ . 1 . 2]"
1 38 ILE 3.898 0.131 1 0 "[ . 1 . 2]"
1 39 PRO 2.123 0.053 4 0 "[ . 1 . 2]"
1 40 PHE 2.751 0.387 20 0 "[ . 1 . 2]"
1 41 GLN 1.448 0.089 9 0 "[ . 1 . 2]"
1 42 ASN 2.564 0.087 10 0 "[ . 1 . 2]"
1 43 PRO 1.435 0.087 10 0 "[ . 1 . 2]"
1 44 GLU 0.311 0.041 3 0 "[ . 1 . 2]"
1 45 GLU 1.574 0.062 15 0 "[ . 1 . 2]"
1 46 GLN 2.186 0.105 9 0 "[ . 1 . 2]"
1 47 ASP 2.837 0.098 14 0 "[ . 1 . 2]"
1 48 GLU 0.166 0.059 13 0 "[ . 1 . 2]"
1 49 GLY 0.141 0.021 4 0 "[ . 1 . 2]"
1 50 TRP 20.016 1.076 14 19 "[****-****** *+******]"
1 51 LEU 23.797 1.076 14 19 "[****-****** *+******]"
1 52 MET 1.368 0.096 1 0 "[ . 1 . 2]"
1 53 GLY 1.563 0.075 10 0 "[ . 1 . 2]"
1 54 VAL 1.415 0.036 15 0 "[ . 1 . 2]"
1 55 LYS 2.825 0.066 6 0 "[ . 1 . 2]"
1 56 GLU 9.888 0.493 5 0 "[ . 1 . 2]"
1 57 SER 0.697 0.052 7 0 "[ . 1 . 2]"
1 58 ASP 1.668 0.066 6 0 "[ . 1 . 2]"
1 59 TRP 4.326 0.092 10 0 "[ . 1 . 2]"
1 60 ASN 1.382 0.053 2 0 "[ . 1 . 2]"
1 61 GLN 0.943 0.058 3 0 "[ . 1 . 2]"
1 62 HIS 0.879 0.053 11 0 "[ . 1 . 2]"
1 63 LYS 0.906 0.058 3 0 "[ . 1 . 2]"
1 64 GLU 1.000 0.066 20 0 "[ . 1 . 2]"
1 65 LEU 4.774 0.659 5 2 "[ + 1 -. 2]"
1 66 GLU 1.496 0.198 2 0 "[ . 1 . 2]"
1 67 LYS 1.115 0.086 16 0 "[ . 1 . 2]"
1 68 CYS 0.436 0.086 16 0 "[ . 1 . 2]"
1 69 ARG 3.699 0.659 5 2 "[ + 1 -. 2]"
1 70 GLY 3.058 0.086 9 0 "[ . 1 . 2]"
1 71 VAL 3.733 0.078 11 0 "[ . 1 . 2]"
1 72 PHE 1.955 0.118 6 0 "[ . 1 . 2]"
1 73 PRO 7.209 0.376 4 0 "[ . 1 . 2]"
1 74 GLU 6.277 0.442 18 0 "[ . 1 . 2]"
1 75 ASN 1.693 0.050 12 0 "[ . 1 . 2]"
1 76 PHE 1.269 0.044 2 0 "[ . 1 . 2]"
1 77 THR 4.616 0.141 12 0 "[ . 1 . 2]"
1 78 GLU 1.529 0.057 14 0 "[ . 1 . 2]"
1 79 ARG 1.782 0.111 1 0 "[ . 1 . 2]"
1 80 VAL 3.872 0.125 15 0 "[ . 1 . 2]"
1 81 PRO 0.560 0.061 11 0 "[ . 1 . 2]"
2 2 THR 4.072 0.367 10 0 "[ . 1 . 2]"
2 3 VAL 11.689 0.817 1 2 "[+ . 1- . 2]"
2 4 PRO 4.237 0.232 1 0 "[ . 1 . 2]"
2 5 VAL 0.049 0.011 16 0 "[ . 1 . 2]"
2 6 ALA 0.962 0.061 7 0 "[ . 1 . 2]"
2 7 PRO 1.172 0.054 16 0 "[ . 1 . 2]"
2 8 PRO 0.154 0.032 15 0 "[ . 1 . 2]"
2 9 ARG 2.240 0.098 14 0 "[ . 1 . 2]"
2 10 ARG 1.365 0.128 19 0 "[ . 1 . 2]"
2 11 ARG 0.430 0.090 13 0 "[ . 1 . 2]"
2 12 ARG 0.533 0.058 10 0 "[ . 1 . 2]"
2 13 GLY 0.179 0.053 20 0 "[ . 1 . 2]"
2 14 ARG 0.182 0.063 12 0 "[ . 1 . 2]"
2 15 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 16 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 THR 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 ARG HA . . 4.180 4.021 3.909 4.162 . 0 0 "[ . 1 . 2]" 1
2 1 1 GLY QA 1 2 ARG QG . . 4.460 3.867 3.243 4.479 0.019 5 0 "[ . 1 . 2]" 1
3 1 1 GLY QA 1 60 ASN HB3 . . 5.320 5.078 4.372 5.349 0.029 5 0 "[ . 1 . 2]" 1
4 1 1 GLY QA 1 60 ASN HD21 . . 4.300 3.404 2.195 4.312 0.012 6 0 "[ . 1 . 2]" 1
5 1 1 GLY QA 1 60 ASN HD22 . . 4.030 2.675 1.948 3.464 . 0 0 "[ . 1 . 2]" 1
6 1 2 ARG QB 1 3 LEU H . . 4.640 2.670 2.121 3.728 . 0 0 "[ . 1 . 2]" 1
7 1 2 ARG QB 1 60 ASN HA . . 4.130 3.442 2.067 4.159 0.029 11 0 "[ . 1 . 2]" 1
8 1 2 ARG QB 1 60 ASN HD22 . . 4.850 4.675 3.637 4.888 0.038 19 0 "[ . 1 . 2]" 1
9 1 2 ARG QB 1 62 HIS HE1 . . 4.860 3.782 2.280 4.897 0.037 16 0 "[ . 1 . 2]" 1
10 1 2 ARG QG 1 3 LEU H . . 4.070 3.831 2.539 4.097 0.027 10 0 "[ . 1 . 2]" 1
11 1 2 ARG QG 1 59 TRP HD1 . . 4.020 3.317 2.289 4.066 0.046 18 0 "[ . 1 . 2]" 1
12 1 2 ARG QG 1 59 TRP HE1 . . 4.560 3.880 2.899 4.565 0.005 3 0 "[ . 1 . 2]" 1
13 1 2 ARG QG 1 60 ASN HA . . 4.270 2.611 2.014 4.092 . 0 0 "[ . 1 . 2]" 1
14 1 2 ARG QG 1 60 ASN HD22 . . 4.650 3.456 2.598 4.667 0.017 6 0 "[ . 1 . 2]" 1
15 1 2 ARG QG 1 62 HIS HE1 . . 4.970 3.991 2.809 4.995 0.025 8 0 "[ . 1 . 2]" 1
16 1 2 ARG HG2 1 3 LEU H . . 4.690 4.309 2.759 4.711 0.021 7 0 "[ . 1 . 2]" 1
17 1 2 ARG HG2 1 60 ASN HA . . 5.000 3.065 2.208 5.034 0.034 6 0 "[ . 1 . 2]" 1
18 1 2 ARG HG2 1 60 ASN HD22 . . 5.500 3.911 2.627 5.512 0.012 15 0 "[ . 1 . 2]" 1
19 1 2 ARG HG3 1 3 LEU H . . 4.690 4.409 2.966 4.733 0.043 15 0 "[ . 1 . 2]" 1
20 1 2 ARG HG3 1 60 ASN HA . . 5.000 3.130 2.204 4.331 . 0 0 "[ . 1 . 2]" 1
21 1 2 ARG HG3 1 60 ASN HD22 . . 5.500 4.522 2.810 5.518 0.018 18 0 "[ . 1 . 2]" 1
22 1 3 LEU H 1 3 LEU QB . . 3.310 2.505 2.121 3.420 0.110 18 0 "[ . 1 . 2]" 1
23 1 3 LEU H 1 3 LEU HG . . 5.280 3.808 2.462 4.811 . 0 0 "[ . 1 . 2]" 1
24 1 3 LEU HA 1 3 LEU MD1 . . 3.970 3.115 2.122 3.927 . 0 0 "[ . 1 . 2]" 1
25 1 3 LEU HA 1 3 LEU QD . . 2.730 2.246 2.073 3.082 0.352 19 0 "[ . 1 . 2]" 1
26 1 3 LEU HA 1 3 LEU MD2 . . 3.970 2.860 2.124 3.906 . 0 0 "[ . 1 . 2]" 1
27 1 3 LEU HA 1 3 LEU HG . . 3.690 3.187 2.285 3.722 0.032 16 0 "[ . 1 . 2]" 1
28 1 3 LEU QB 1 3 LEU QD . . 2.780 1.977 1.925 2.099 . 0 0 "[ . 1 . 2]" 1
29 1 3 LEU QB 1 4 ASP H . . 4.130 2.797 2.063 3.424 . 0 0 "[ . 1 . 2]" 1
30 1 3 LEU HB2 1 4 ASP H . . 4.850 3.456 2.115 4.292 . 0 0 "[ . 1 . 2]" 1
31 1 3 LEU HB3 1 4 ASP H . . 4.850 3.316 2.359 4.216 . 0 0 "[ . 1 . 2]" 1
32 1 3 LEU QD 1 4 ASP H . . 4.730 4.004 3.126 4.438 . 0 0 "[ . 1 . 2]" 1
33 1 3 LEU HG 1 4 ASP H . . 5.500 4.532 3.698 5.325 . 0 0 "[ . 1 . 2]" 1
34 1 4 ASP H 1 4 ASP HB2 . . 4.130 3.119 2.347 3.932 . 0 0 "[ . 1 . 2]" 1
35 1 4 ASP H 1 4 ASP HB3 . . 4.130 2.910 2.217 3.665 . 0 0 "[ . 1 . 2]" 1
36 1 4 ASP HA 1 5 LEU H . . 3.410 2.234 2.056 2.523 . 0 0 "[ . 1 . 2]" 1
37 1 4 ASP HA 1 5 LEU HB2 . . 4.980 4.113 3.760 4.631 . 0 0 "[ . 1 . 2]" 1
38 1 4 ASP HA 1 5 LEU HG . . 4.470 3.901 3.247 4.483 0.013 15 0 "[ . 1 . 2]" 1
39 1 4 ASP QB 1 5 LEU H . . 3.470 3.033 2.051 3.538 0.068 11 0 "[ . 1 . 2]" 1
40 1 4 ASP HB2 1 5 LEU H . . 4.080 3.437 2.066 4.114 0.034 14 0 "[ . 1 . 2]" 1
41 1 4 ASP HB3 1 5 LEU H . . 4.080 3.671 2.666 4.083 0.003 19 0 "[ . 1 . 2]" 1
42 1 5 LEU H 1 5 LEU HB2 . . 3.480 2.425 2.191 2.671 . 0 0 "[ . 1 . 2]" 1
43 1 5 LEU H 1 5 LEU HB3 . . 4.140 3.626 3.482 3.763 . 0 0 "[ . 1 . 2]" 1
44 1 5 LEU H 1 5 LEU MD1 . . 4.570 4.261 3.843 4.531 . 0 0 "[ . 1 . 2]" 1
45 1 5 LEU H 1 5 LEU MD2 . . 4.520 3.910 3.578 4.072 . 0 0 "[ . 1 . 2]" 1
46 1 5 LEU H 1 5 LEU HG . . 3.760 3.298 2.642 3.671 . 0 0 "[ . 1 . 2]" 1
47 1 5 LEU H 1 6 PRO HD2 . . 4.990 4.857 4.824 4.933 . 0 0 "[ . 1 . 2]" 1
48 1 5 LEU H 1 6 PRO HD3 . . 5.190 5.076 4.981 5.189 . 0 0 "[ . 1 . 2]" 1
49 1 5 LEU HA 1 5 LEU MD1 . . 3.910 3.672 3.640 3.711 . 0 0 "[ . 1 . 2]" 1
50 1 5 LEU HA 1 5 LEU MD2 . . 2.990 2.035 2.005 2.057 . 0 0 "[ . 1 . 2]" 1
51 1 5 LEU HA 1 5 LEU HG . . 3.740 3.110 3.044 3.167 . 0 0 "[ . 1 . 2]" 1
52 1 5 LEU HA 1 6 PRO HB3 . . 5.300 4.826 4.719 4.886 . 0 0 "[ . 1 . 2]" 1
53 1 5 LEU HA 1 6 PRO HD2 . . 3.260 2.581 2.516 2.705 . 0 0 "[ . 1 . 2]" 1
54 1 5 LEU HA 1 6 PRO HD3 . . 3.040 2.344 2.250 2.448 . 0 0 "[ . 1 . 2]" 1
55 1 5 LEU HA 1 6 PRO HG2 . . 4.780 4.698 4.637 4.770 . 0 0 "[ . 1 . 2]" 1
56 1 5 LEU HA 1 6 PRO HG3 . . 4.720 4.562 4.438 4.658 . 0 0 "[ . 1 . 2]" 1
57 1 5 LEU HA 1 36 LEU MD1 . . 4.190 3.175 2.979 3.346 . 0 0 "[ . 1 . 2]" 1
58 1 5 LEU HA 1 36 LEU QD . . 3.530 3.089 2.922 3.227 . 0 0 "[ . 1 . 2]" 1
59 1 5 LEU HA 1 36 LEU MD2 . . 4.190 4.238 4.222 4.252 0.062 1 0 "[ . 1 . 2]" 1
60 1 5 LEU HA 1 59 TRP HD1 . . 4.350 3.940 3.694 4.077 . 0 0 "[ . 1 . 2]" 1
61 1 5 LEU HA 1 59 TRP HE1 . . 3.510 2.410 2.193 2.574 . 0 0 "[ . 1 . 2]" 1
62 1 5 LEU HA 1 59 TRP HZ2 . . 4.190 3.677 3.412 3.988 . 0 0 "[ . 1 . 2]" 1
63 1 5 LEU HB2 1 5 LEU MD1 . . 2.910 2.414 2.371 2.456 . 0 0 "[ . 1 . 2]" 1
64 1 5 LEU HB2 1 6 PRO HD2 . . 3.620 3.636 3.625 3.652 0.032 11 0 "[ . 1 . 2]" 1
65 1 5 LEU HB2 1 6 PRO HD3 . . 4.720 4.673 4.607 4.705 . 0 0 "[ . 1 . 2]" 1
66 1 5 LEU HB2 1 9 PHE HB2 . . 4.520 4.342 4.146 4.483 . 0 0 "[ . 1 . 2]" 1
67 1 5 LEU HB2 1 9 PHE HB3 . . 4.170 3.829 3.580 3.971 . 0 0 "[ . 1 . 2]" 1
68 1 5 LEU HB2 1 9 PHE QD . . 4.570 4.300 4.093 4.435 . 0 0 "[ . 1 . 2]" 1
69 1 5 LEU HB3 1 5 LEU MD1 . . 3.080 2.222 2.175 2.262 . 0 0 "[ . 1 . 2]" 1
70 1 5 LEU HB3 1 6 PRO HD2 . . 3.240 2.030 2.008 2.047 . 0 0 "[ . 1 . 2]" 1
71 1 5 LEU HB3 1 6 PRO HD3 . . 3.510 3.429 3.352 3.461 . 0 0 "[ . 1 . 2]" 1
72 1 5 LEU HB3 1 6 PRO HG3 . . 4.960 4.685 4.651 4.747 . 0 0 "[ . 1 . 2]" 1
73 1 5 LEU HB3 1 9 PHE H . . 4.860 4.827 4.757 4.875 0.015 12 0 "[ . 1 . 2]" 1
74 1 5 LEU HB3 1 9 PHE HB2 . . 3.770 2.929 2.787 3.007 . 0 0 "[ . 1 . 2]" 1
75 1 5 LEU HB3 1 9 PHE HB3 . . 3.810 3.006 2.872 3.097 . 0 0 "[ . 1 . 2]" 1
76 1 5 LEU HB3 1 9 PHE QD . . 3.860 3.422 3.317 3.518 . 0 0 "[ . 1 . 2]" 1
77 1 5 LEU HB3 1 59 TRP HE1 . . 5.500 5.014 4.813 5.172 . 0 0 "[ . 1 . 2]" 1
78 1 5 LEU MD1 1 9 PHE H . . 5.500 5.539 5.524 5.554 0.054 20 0 "[ . 1 . 2]" 1
79 1 5 LEU MD1 1 9 PHE HB2 . . 4.300 3.763 3.703 3.830 . 0 0 "[ . 1 . 2]" 1
80 1 5 LEU MD1 1 9 PHE HB3 . . 4.110 3.554 3.499 3.614 . 0 0 "[ . 1 . 2]" 1
81 1 5 LEU MD1 1 9 PHE QD . . 3.510 2.799 2.730 2.856 . 0 0 "[ . 1 . 2]" 1
82 1 5 LEU MD1 1 9 PHE QE . . 3.750 2.706 2.634 2.754 . 0 0 "[ . 1 . 2]" 1
83 1 5 LEU MD1 1 9 PHE HZ . . 4.110 2.944 2.830 3.032 . 0 0 "[ . 1 . 2]" 1
84 1 5 LEU MD1 1 12 LYS QD . . 5.340 4.463 4.099 4.692 . 0 0 "[ . 1 . 2]" 1
85 1 5 LEU MD1 1 12 LYS HE2 . . 4.040 3.294 2.888 3.762 . 0 0 "[ . 1 . 2]" 1
86 1 5 LEU MD1 1 12 LYS HG3 . . 4.130 3.749 3.345 3.944 . 0 0 "[ . 1 . 2]" 1
87 1 5 LEU MD1 1 36 LEU HG . . 5.500 5.567 5.552 5.579 0.079 19 0 "[ . 1 . 2]" 1
88 1 5 LEU MD2 1 6 PRO HD2 . . 3.270 2.313 2.250 2.347 . 0 0 "[ . 1 . 2]" 1
89 1 5 LEU MD2 1 6 PRO HD3 . . 3.430 2.815 2.612 2.890 . 0 0 "[ . 1 . 2]" 1
90 1 5 LEU MD2 1 6 PRO HG2 . . 4.420 4.294 4.202 4.337 . 0 0 "[ . 1 . 2]" 1
91 1 5 LEU MD2 1 9 PHE HB2 . . 4.370 4.321 4.206 4.381 0.011 16 0 "[ . 1 . 2]" 1
92 1 5 LEU MD2 1 9 PHE QD . . 3.940 3.541 3.417 3.661 . 0 0 "[ . 1 . 2]" 1
93 1 5 LEU MD2 1 9 PHE QE . . 3.920 3.537 3.416 3.623 . 0 0 "[ . 1 . 2]" 1
94 1 5 LEU MD2 1 9 PHE HZ . . 4.190 4.223 4.208 4.241 0.051 1 0 "[ . 1 . 2]" 1
95 1 5 LEU MD2 1 12 LYS HE2 . . 4.200 2.456 2.031 2.903 . 0 0 "[ . 1 . 2]" 1
96 1 5 LEU MD2 1 12 LYS HE3 . . 4.400 3.066 2.474 3.329 . 0 0 "[ . 1 . 2]" 1
97 1 5 LEU MD2 1 12 LYS HG2 . . 4.550 4.165 3.808 4.513 . 0 0 "[ . 1 . 2]" 1
98 1 5 LEU MD2 1 12 LYS HG3 . . 4.660 4.263 3.848 4.438 . 0 0 "[ . 1 . 2]" 1
99 1 5 LEU MD2 1 36 LEU HB2 . . 4.770 4.312 4.156 4.410 . 0 0 "[ . 1 . 2]" 1
100 1 5 LEU MD2 1 36 LEU HB3 . . 4.420 3.200 2.986 3.332 . 0 0 "[ . 1 . 2]" 1
101 1 5 LEU MD2 1 36 LEU MD1 . . 3.350 2.132 2.046 2.202 . 0 0 "[ . 1 . 2]" 1
102 1 5 LEU MD2 1 36 LEU QD . . 2.910 1.817 1.772 1.862 . 0 0 "[ . 1 . 2]" 1
103 1 5 LEU MD2 1 36 LEU MD2 . . 3.350 1.971 1.937 2.009 . 0 0 "[ . 1 . 2]" 1
104 1 5 LEU MD2 1 36 LEU HG . . 4.600 4.069 3.964 4.163 . 0 0 "[ . 1 . 2]" 1
105 1 5 LEU MD2 1 59 TRP HD1 . . 4.420 3.367 3.098 3.617 . 0 0 "[ . 1 . 2]" 1
106 1 5 LEU MD2 1 59 TRP HE1 . . 4.090 3.173 2.998 3.509 . 0 0 "[ . 1 . 2]" 1
107 1 5 LEU MD2 1 59 TRP HZ2 . . 5.500 5.047 4.832 5.346 . 0 0 "[ . 1 . 2]" 1
108 1 5 LEU HG 1 6 PRO HD2 . . 4.310 4.353 4.333 4.365 0.055 17 0 "[ . 1 . 2]" 1
109 1 5 LEU HG 1 6 PRO HD3 . . 5.080 5.061 4.922 5.091 0.011 8 0 "[ . 1 . 2]" 1
110 1 5 LEU HG 1 36 LEU QD . . 4.920 4.031 3.957 4.106 . 0 0 "[ . 1 . 2]" 1
111 1 6 PRO HA 1 7 PRO HD2 . . 3.130 2.545 2.433 2.650 . 0 0 "[ . 1 . 2]" 1
112 1 6 PRO HA 1 7 PRO HD3 . . 2.850 2.461 2.315 2.564 . 0 0 "[ . 1 . 2]" 1
113 1 6 PRO HA 1 7 PRO HG2 . . 5.200 4.660 4.573 4.723 . 0 0 "[ . 1 . 2]" 1
114 1 6 PRO HA 1 7 PRO HG3 . . 4.710 4.689 4.621 4.716 0.006 15 0 "[ . 1 . 2]" 1
115 1 6 PRO HA 1 36 LEU QD . . 5.360 4.880 4.812 4.935 . 0 0 "[ . 1 . 2]" 1
116 1 6 PRO HA 1 38 ILE MG . . 5.500 4.819 4.744 4.950 . 0 0 "[ . 1 . 2]" 1
117 1 6 PRO HA 1 59 TRP HH2 . . 3.590 2.654 2.528 2.777 . 0 0 "[ . 1 . 2]" 1
118 1 6 PRO HA 1 59 TRP HZ2 . . 3.990 2.742 2.564 2.855 . 0 0 "[ . 1 . 2]" 1
119 1 6 PRO HB2 1 7 PRO HD2 . . 3.150 2.260 2.194 2.346 . 0 0 "[ . 1 . 2]" 1
120 1 6 PRO HB2 1 7 PRO HD3 . . 3.770 3.714 3.599 3.784 0.014 13 0 "[ . 1 . 2]" 1
121 1 6 PRO HB2 1 7 PRO HG2 . . 4.060 3.836 3.573 4.005 . 0 0 "[ . 1 . 2]" 1
122 1 6 PRO HB2 1 9 PHE QD . . 5.360 4.896 4.810 4.962 . 0 0 "[ . 1 . 2]" 1
123 1 6 PRO HB2 1 38 ILE MG . . 3.020 2.514 2.412 2.677 . 0 0 "[ . 1 . 2]" 1
124 1 6 PRO HB2 1 59 TRP HH2 . . 5.500 4.691 4.547 4.827 . 0 0 "[ . 1 . 2]" 1
125 1 6 PRO HB2 1 59 TRP HZ2 . . 5.470 5.284 5.123 5.411 . 0 0 "[ . 1 . 2]" 1
126 1 6 PRO HB2 1 59 TRP HZ3 . . 5.410 4.669 4.496 4.806 . 0 0 "[ . 1 . 2]" 1
127 1 6 PRO HB3 1 7 PRO HD2 . . 3.690 2.806 2.648 2.931 . 0 0 "[ . 1 . 2]" 1
128 1 6 PRO HB3 1 7 PRO HD3 . . 3.890 3.867 3.657 3.912 0.022 14 0 "[ . 1 . 2]" 1
129 1 6 PRO HB3 1 7 PRO HG2 . . 5.480 4.969 4.693 5.166 . 0 0 "[ . 1 . 2]" 1
130 1 6 PRO HB3 1 9 PHE HB2 . . 5.120 4.831 4.692 4.906 . 0 0 "[ . 1 . 2]" 1
131 1 6 PRO HB3 1 36 LEU HB2 . . 5.500 5.109 4.966 5.346 . 0 0 "[ . 1 . 2]" 1
132 1 6 PRO HB3 1 36 LEU QD . . 4.130 3.903 3.740 4.025 . 0 0 "[ . 1 . 2]" 1
133 1 6 PRO HB3 1 38 ILE MG . . 4.420 3.630 3.518 3.854 . 0 0 "[ . 1 . 2]" 1
134 1 6 PRO HB3 1 59 TRP HB2 . . 5.500 4.949 4.787 5.111 . 0 0 "[ . 1 . 2]" 1
135 1 6 PRO HB3 1 59 TRP HH2 . . 5.500 3.617 3.512 3.701 . 0 0 "[ . 1 . 2]" 1
136 1 6 PRO HB3 1 59 TRP HZ2 . . 4.790 4.051 3.883 4.198 . 0 0 "[ . 1 . 2]" 1
137 1 6 PRO HB3 1 59 TRP HZ3 . . 5.180 3.379 3.187 3.488 . 0 0 "[ . 1 . 2]" 1
138 1 6 PRO HD2 1 9 PHE HB2 . . 4.000 2.687 2.571 2.757 . 0 0 "[ . 1 . 2]" 1
139 1 6 PRO HD2 1 9 PHE QD . . 4.010 2.770 2.735 2.808 . 0 0 "[ . 1 . 2]" 1
140 1 6 PRO HD2 1 36 LEU HB2 . . 4.740 4.250 4.083 4.452 . 0 0 "[ . 1 . 2]" 1
141 1 6 PRO HD2 1 36 LEU QD . . 3.520 2.582 2.523 2.643 . 0 0 "[ . 1 . 2]" 1
142 1 6 PRO HD2 1 54 VAL MG1 . . 5.050 4.545 4.401 4.728 . 0 0 "[ . 1 . 2]" 1
143 1 6 PRO HD2 1 59 TRP HZ2 . . 5.250 5.026 4.880 5.169 . 0 0 "[ . 1 . 2]" 1
144 1 6 PRO HD3 1 9 PHE HB2 . . 4.280 4.178 4.058 4.250 . 0 0 "[ . 1 . 2]" 1
145 1 6 PRO HD3 1 9 PHE HB3 . . 5.500 5.429 5.261 5.502 0.002 8 0 "[ . 1 . 2]" 1
146 1 6 PRO HD3 1 9 PHE QD . . 4.110 4.140 4.129 4.151 0.041 17 0 "[ . 1 . 2]" 1
147 1 6 PRO HD3 1 36 LEU HB2 . . 4.410 4.146 3.970 4.334 . 0 0 "[ . 1 . 2]" 1
148 1 6 PRO HD3 1 36 LEU HB3 . . 4.520 3.761 3.532 3.857 . 0 0 "[ . 1 . 2]" 1
149 1 6 PRO HD3 1 36 LEU QD . . 3.090 2.078 2.042 2.118 . 0 0 "[ . 1 . 2]" 1
150 1 6 PRO HD3 1 59 TRP HB2 . . 5.280 4.692 4.520 4.845 . 0 0 "[ . 1 . 2]" 1
151 1 6 PRO HD3 1 59 TRP HD1 . . 4.390 3.890 3.817 3.970 . 0 0 "[ . 1 . 2]" 1
152 1 6 PRO HD3 1 59 TRP HE1 . . 3.910 3.296 3.222 3.396 . 0 0 "[ . 1 . 2]" 1
153 1 6 PRO HD3 1 59 TRP HE3 . . 5.460 4.859 4.688 5.015 . 0 0 "[ . 1 . 2]" 1
154 1 6 PRO HD3 1 59 TRP HZ2 . . 4.590 3.902 3.788 4.057 . 0 0 "[ . 1 . 2]" 1
155 1 6 PRO HG2 1 9 PHE H . . 4.220 3.802 3.763 3.839 . 0 0 "[ . 1 . 2]" 1
156 1 6 PRO HG2 1 9 PHE HA . . 4.050 3.397 3.342 3.449 . 0 0 "[ . 1 . 2]" 1
157 1 6 PRO HG2 1 9 PHE HB2 . . 3.900 2.191 2.137 2.234 . 0 0 "[ . 1 . 2]" 1
158 1 6 PRO HG2 1 9 PHE HB3 . . 4.180 3.918 3.862 3.964 . 0 0 "[ . 1 . 2]" 1
159 1 6 PRO HG2 1 9 PHE QD . . 4.140 2.602 2.538 2.664 . 0 0 "[ . 1 . 2]" 1
160 1 6 PRO HG2 1 9 PHE QE . . 4.990 4.877 4.806 4.954 . 0 0 "[ . 1 . 2]" 1
161 1 6 PRO HG2 1 36 LEU HB2 . . 4.620 3.982 3.836 4.214 . 0 0 "[ . 1 . 2]" 1
162 1 6 PRO HG2 1 38 ILE MG . . 2.940 2.325 2.232 2.476 . 0 0 "[ . 1 . 2]" 1
163 1 6 PRO HG3 1 9 PHE H . . 5.500 5.542 5.524 5.557 0.057 19 0 "[ . 1 . 2]" 1
164 1 6 PRO HG3 1 9 PHE HA . . 5.010 5.031 4.974 5.059 0.049 3 0 "[ . 1 . 2]" 1
165 1 6 PRO HG3 1 9 PHE HB2 . . 4.740 3.853 3.793 3.890 . 0 0 "[ . 1 . 2]" 1
166 1 6 PRO HG3 1 9 PHE QD . . 4.780 3.453 3.361 3.530 . 0 0 "[ . 1 . 2]" 1
167 1 6 PRO HG3 1 36 LEU HB2 . . 4.080 2.899 2.749 3.141 . 0 0 "[ . 1 . 2]" 1
168 1 6 PRO HG3 1 36 LEU HB3 . . 4.700 3.072 2.873 3.164 . 0 0 "[ . 1 . 2]" 1
169 1 6 PRO HG3 1 36 LEU QD . . 3.490 2.646 2.488 2.755 . 0 0 "[ . 1 . 2]" 1
170 1 6 PRO HG3 1 38 ILE MD . . 4.670 4.514 4.262 4.641 . 0 0 "[ . 1 . 2]" 1
171 1 6 PRO HG3 1 38 ILE MG . . 3.460 2.887 2.717 3.071 . 0 0 "[ . 1 . 2]" 1
172 1 6 PRO HG3 1 54 VAL HB . . 5.470 4.937 4.719 5.155 . 0 0 "[ . 1 . 2]" 1
173 1 6 PRO HG3 1 54 VAL MG1 . . 3.320 2.505 2.349 2.674 . 0 0 "[ . 1 . 2]" 1
174 1 6 PRO HG3 1 59 TRP HD1 . . 5.500 5.541 5.503 5.574 0.074 19 0 "[ . 1 . 2]" 1
175 1 6 PRO HG3 1 59 TRP HE3 . . 5.270 4.837 4.604 5.020 . 0 0 "[ . 1 . 2]" 1
176 1 6 PRO HG3 1 59 TRP HZ2 . . 5.500 5.521 5.502 5.545 0.045 1 0 "[ . 1 . 2]" 1
177 1 6 PRO HG3 1 59 TRP HZ3 . . 5.500 5.464 5.198 5.527 0.027 5 0 "[ . 1 . 2]" 1
178 1 7 PRO HA 1 8 GLY H . . 2.990 2.162 2.110 2.221 . 0 0 "[ . 1 . 2]" 1
179 1 7 PRO HA 1 8 GLY QA . . 4.390 3.964 3.925 4.001 . 0 0 "[ . 1 . 2]" 1
180 1 7 PRO HA 1 9 PHE H . . 3.920 3.597 3.502 3.723 . 0 0 "[ . 1 . 2]" 1
181 1 7 PRO HB2 1 8 GLY H . . 4.320 3.478 3.190 3.681 . 0 0 "[ . 1 . 2]" 1
182 1 7 PRO HB3 1 8 GLY H . . 4.320 3.965 3.811 4.034 . 0 0 "[ . 1 . 2]" 1
183 1 7 PRO HD2 1 38 ILE MD . . 5.170 4.839 4.545 5.177 0.007 12 0 "[ . 1 . 2]" 1
184 1 7 PRO HD2 1 38 ILE MG . . 4.370 4.145 4.089 4.186 . 0 0 "[ . 1 . 2]" 1
185 1 7 PRO HD2 1 59 TRP HH2 . . 4.170 3.523 3.356 3.638 . 0 0 "[ . 1 . 2]" 1
186 1 7 PRO HD2 1 59 TRP HZ2 . . 5.020 4.973 4.765 5.046 0.026 6 0 "[ . 1 . 2]" 1
187 1 7 PRO HD2 1 65 LEU MD1 . . 4.360 3.695 3.405 4.037 . 0 0 "[ . 1 . 2]" 1
188 1 7 PRO HD2 1 65 LEU QD . . 3.410 2.191 2.024 2.440 . 0 0 "[ . 1 . 2]" 1
189 1 7 PRO HD2 1 65 LEU MD2 . . 4.360 2.209 2.032 2.472 . 0 0 "[ . 1 . 2]" 1
190 1 7 PRO HD3 1 38 ILE MG . . 5.500 5.528 5.505 5.556 0.056 16 0 "[ . 1 . 2]" 1
191 1 7 PRO HD3 1 59 TRP HH2 . . 3.910 2.862 2.667 3.083 . 0 0 "[ . 1 . 2]" 1
192 1 7 PRO HD3 1 59 TRP HZ2 . . 4.530 4.334 4.019 4.539 0.009 14 0 "[ . 1 . 2]" 1
193 1 7 PRO HD3 1 65 LEU QD . . 3.810 3.088 2.859 3.298 . 0 0 "[ . 1 . 2]" 1
194 1 7 PRO HG2 1 9 PHE H . . 5.340 5.355 5.330 5.379 0.039 12 0 "[ . 1 . 2]" 1
195 1 7 PRO HG2 1 65 LEU MD1 . . 5.170 4.817 4.514 5.173 0.003 9 0 "[ . 1 . 2]" 1
196 1 7 PRO HG2 1 65 LEU QD . . 4.080 2.875 2.566 3.191 . 0 0 "[ . 1 . 2]" 1
197 1 7 PRO HG2 1 65 LEU MD2 . . 5.170 2.898 2.580 3.229 . 0 0 "[ . 1 . 2]" 1
198 1 7 PRO HG3 1 59 TRP HH2 . . 5.040 4.763 4.540 4.980 . 0 0 "[ . 1 . 2]" 1
199 1 7 PRO HG3 1 65 LEU QD . . 4.030 3.046 2.729 3.275 . 0 0 "[ . 1 . 2]" 1
200 1 8 GLY H 1 9 PHE H . . 3.300 2.931 2.806 3.058 . 0 0 "[ . 1 . 2]" 1
201 1 8 GLY QA 1 39 PRO HD3 . . 3.770 3.463 3.228 3.667 . 0 0 "[ . 1 . 2]" 1
202 1 8 GLY QA 1 39 PRO QG . . 3.320 2.693 2.429 2.932 . 0 0 "[ . 1 . 2]" 1
203 1 8 GLY HA2 1 39 PRO QG . . 3.810 3.754 3.551 3.825 0.015 9 0 "[ . 1 . 2]" 1
204 1 8 GLY HA3 1 39 PRO QG . . 3.810 2.763 2.473 3.047 . 0 0 "[ . 1 . 2]" 1
205 1 9 PHE H 1 9 PHE HB2 . . 3.090 2.492 2.462 2.545 . 0 0 "[ . 1 . 2]" 1
206 1 9 PHE H 1 9 PHE HB3 . . 3.070 2.478 2.393 2.541 . 0 0 "[ . 1 . 2]" 1
207 1 9 PHE H 1 9 PHE QD . . 4.400 4.187 4.139 4.224 . 0 0 "[ . 1 . 2]" 1
208 1 9 PHE H 1 10 MET H . . 4.860 4.600 4.539 4.638 . 0 0 "[ . 1 . 2]" 1
209 1 9 PHE H 1 38 ILE HA . . 5.400 4.696 4.558 4.851 . 0 0 "[ . 1 . 2]" 1
210 1 9 PHE H 1 38 ILE MG . . 4.380 3.680 3.475 3.973 . 0 0 "[ . 1 . 2]" 1
211 1 9 PHE HA 1 9 PHE QD . . 3.400 3.021 2.942 3.115 . 0 0 "[ . 1 . 2]" 1
212 1 9 PHE HA 1 9 PHE QE . . 4.960 4.833 4.767 4.935 . 0 0 "[ . 1 . 2]" 1
213 1 9 PHE HA 1 10 MET H . . 2.970 2.155 2.112 2.191 . 0 0 "[ . 1 . 2]" 1
214 1 9 PHE HA 1 10 MET HB2 . . 4.830 4.644 4.462 4.718 . 0 0 "[ . 1 . 2]" 1
215 1 9 PHE HA 1 10 MET QG . . 4.780 3.580 3.410 3.674 . 0 0 "[ . 1 . 2]" 1
216 1 9 PHE HA 1 11 PHE H . . 4.460 4.269 4.049 4.471 0.011 16 0 "[ . 1 . 2]" 1
217 1 9 PHE HA 1 38 ILE HA . . 3.930 2.703 2.524 2.913 . 0 0 "[ . 1 . 2]" 1
218 1 9 PHE HA 1 38 ILE HB . . 4.420 4.021 3.866 4.151 . 0 0 "[ . 1 . 2]" 1
219 1 9 PHE HA 1 38 ILE MG . . 3.220 2.425 2.228 2.716 . 0 0 "[ . 1 . 2]" 1
220 1 9 PHE HB2 1 10 MET H . . 4.460 4.020 3.918 4.101 . 0 0 "[ . 1 . 2]" 1
221 1 9 PHE HB2 1 38 ILE MG . . 4.080 3.170 3.049 3.314 . 0 0 "[ . 1 . 2]" 1
222 1 9 PHE HB3 1 10 MET H . . 4.490 4.287 4.185 4.388 . 0 0 "[ . 1 . 2]" 1
223 1 9 PHE HB3 1 38 ILE MG . . 5.040 4.496 4.359 4.696 . 0 0 "[ . 1 . 2]" 1
224 1 9 PHE QD 1 10 MET H . . 4.110 3.465 3.321 3.597 . 0 0 "[ . 1 . 2]" 1
225 1 9 PHE QD 1 11 PHE H . . 4.690 4.004 3.900 4.135 . 0 0 "[ . 1 . 2]" 1
226 1 9 PHE QD 1 11 PHE HA . . 4.980 4.511 4.360 4.586 . 0 0 "[ . 1 . 2]" 1
227 1 9 PHE QD 1 12 LYS HA . . 5.490 5.364 5.062 5.475 . 0 0 "[ . 1 . 2]" 1
228 1 9 PHE QD 1 12 LYS HG2 . . 5.140 4.799 4.577 5.150 0.010 12 0 "[ . 1 . 2]" 1
229 1 9 PHE QD 1 36 LEU HA . . 4.100 3.711 3.504 3.805 . 0 0 "[ . 1 . 2]" 1
230 1 9 PHE QD 1 36 LEU HB2 . . 4.100 3.661 3.564 3.801 . 0 0 "[ . 1 . 2]" 1
231 1 9 PHE QD 1 36 LEU HB3 . . 3.490 2.259 2.188 2.309 . 0 0 "[ . 1 . 2]" 1
232 1 9 PHE QD 1 36 LEU MD1 . . 4.460 3.798 3.722 3.920 . 0 0 "[ . 1 . 2]" 1
233 1 9 PHE QD 1 36 LEU QD . . 3.890 3.245 3.141 3.325 . 0 0 "[ . 1 . 2]" 1
234 1 9 PHE QD 1 36 LEU MD2 . . 4.460 3.524 3.381 3.629 . 0 0 "[ . 1 . 2]" 1
235 1 9 PHE QD 1 36 LEU HG . . 5.290 5.242 5.155 5.293 0.003 19 0 "[ . 1 . 2]" 1
236 1 9 PHE QD 1 37 VAL H . . 4.650 4.307 4.106 4.486 . 0 0 "[ . 1 . 2]" 1
237 1 9 PHE QD 1 38 ILE MG . . 3.900 3.135 2.974 3.269 . 0 0 "[ . 1 . 2]" 1
238 1 9 PHE QE 1 11 PHE H . . 4.160 3.731 3.615 3.843 . 0 0 "[ . 1 . 2]" 1
239 1 9 PHE QE 1 11 PHE HA . . 3.670 2.991 2.918 3.044 . 0 0 "[ . 1 . 2]" 1
240 1 9 PHE QE 1 11 PHE HB2 . . 5.080 5.034 4.918 5.081 0.001 15 0 "[ . 1 . 2]" 1
241 1 9 PHE QE 1 11 PHE HB3 . . 4.800 4.817 4.807 4.836 0.036 14 0 "[ . 1 . 2]" 1
242 1 9 PHE QE 1 12 LYS H . . 4.670 4.059 3.788 4.189 . 0 0 "[ . 1 . 2]" 1
243 1 9 PHE QE 1 12 LYS HA . . 4.240 3.310 3.021 3.431 . 0 0 "[ . 1 . 2]" 1
244 1 9 PHE QE 1 12 LYS HB2 . . 4.590 4.567 4.271 4.615 0.025 8 0 "[ . 1 . 2]" 1
245 1 9 PHE QE 1 12 LYS HB3 . . 4.810 4.677 4.496 4.817 0.007 6 0 "[ . 1 . 2]" 1
246 1 9 PHE QE 1 12 LYS HD2 . . 5.100 4.933 4.618 5.069 . 0 0 "[ . 1 . 2]" 1
247 1 9 PHE QE 1 12 LYS QD . . 4.420 4.257 4.193 4.352 . 0 0 "[ . 1 . 2]" 1
248 1 9 PHE QE 1 12 LYS HD3 . . 5.100 4.667 4.538 4.961 . 0 0 "[ . 1 . 2]" 1
249 1 9 PHE QE 1 12 LYS HE2 . . 4.090 3.894 3.573 4.117 0.027 12 0 "[ . 1 . 2]" 1
250 1 9 PHE QE 1 12 LYS HG2 . . 3.780 2.517 2.310 2.912 . 0 0 "[ . 1 . 2]" 1
251 1 9 PHE QE 1 12 LYS HG3 . . 3.780 2.802 2.285 3.006 . 0 0 "[ . 1 . 2]" 1
252 1 9 PHE QE 1 36 LEU HA . . 3.690 2.204 2.145 2.271 . 0 0 "[ . 1 . 2]" 1
253 1 9 PHE QE 1 36 LEU HB2 . . 4.270 4.035 3.947 4.206 . 0 0 "[ . 1 . 2]" 1
254 1 9 PHE QE 1 36 LEU HB3 . . 3.600 2.494 2.393 2.728 . 0 0 "[ . 1 . 2]" 1
255 1 9 PHE QE 1 36 LEU MD1 . . 4.420 4.131 4.045 4.278 . 0 0 "[ . 1 . 2]" 1
256 1 9 PHE QE 1 36 LEU QD . . 3.360 2.481 2.318 2.579 . 0 0 "[ . 1 . 2]" 1
257 1 9 PHE QE 1 36 LEU MD2 . . 4.420 2.501 2.331 2.602 . 0 0 "[ . 1 . 2]" 1
258 1 9 PHE QE 1 36 LEU HG . . 5.340 4.576 4.439 4.739 . 0 0 "[ . 1 . 2]" 1
259 1 9 PHE QE 1 37 VAL H . . 3.860 3.235 3.112 3.310 . 0 0 "[ . 1 . 2]" 1
260 1 9 PHE QE 1 37 VAL HA . . 5.500 5.500 5.405 5.523 0.023 12 0 "[ . 1 . 2]" 1
261 1 9 PHE QE 1 38 ILE MG . . 5.060 4.796 4.641 4.907 . 0 0 "[ . 1 . 2]" 1
262 1 9 PHE HZ 1 11 PHE H . . 4.900 4.197 4.003 4.298 . 0 0 "[ . 1 . 2]" 1
263 1 9 PHE HZ 1 11 PHE HA . . 3.350 2.714 2.526 2.852 . 0 0 "[ . 1 . 2]" 1
264 1 9 PHE HZ 1 12 LYS H . . 4.200 3.188 2.870 3.362 . 0 0 "[ . 1 . 2]" 1
265 1 9 PHE HZ 1 12 LYS HA . . 4.660 4.055 3.917 4.129 . 0 0 "[ . 1 . 2]" 1
266 1 9 PHE HZ 1 12 LYS HB2 . . 4.350 3.888 3.556 4.007 . 0 0 "[ . 1 . 2]" 1
267 1 9 PHE HZ 1 12 LYS HB3 . . 4.830 4.824 4.669 4.876 0.046 10 0 "[ . 1 . 2]" 1
268 1 9 PHE HZ 1 12 LYS HD2 . . 4.870 4.385 3.913 4.553 . 0 0 "[ . 1 . 2]" 1
269 1 9 PHE HZ 1 12 LYS QD . . 4.190 4.084 3.766 4.193 0.003 15 0 "[ . 1 . 2]" 1
270 1 9 PHE HZ 1 12 LYS HD3 . . 4.870 4.896 4.859 4.923 0.053 16 0 "[ . 1 . 2]" 1
271 1 9 PHE HZ 1 12 LYS HE2 . . 4.870 4.116 3.738 4.539 . 0 0 "[ . 1 . 2]" 1
272 1 9 PHE HZ 1 12 LYS HE3 . . 4.130 3.137 2.841 3.408 . 0 0 "[ . 1 . 2]" 1
273 1 9 PHE HZ 1 12 LYS HG2 . . 3.860 3.260 3.013 3.731 . 0 0 "[ . 1 . 2]" 1
274 1 9 PHE HZ 1 12 LYS HG3 . . 3.280 2.048 2.024 2.092 . 0 0 "[ . 1 . 2]" 1
275 1 9 PHE HZ 1 36 LEU HA . . 4.710 4.324 4.211 4.435 . 0 0 "[ . 1 . 2]" 1
276 1 9 PHE HZ 1 36 LEU QD . . 4.850 3.709 3.561 3.899 . 0 0 "[ . 1 . 2]" 1
277 1 10 MET H 1 10 MET HB2 . . 3.490 2.607 2.513 2.646 . 0 0 "[ . 1 . 2]" 1
278 1 10 MET H 1 10 MET HB3 . . 4.040 3.727 3.677 3.766 . 0 0 "[ . 1 . 2]" 1
279 1 10 MET H 1 10 MET ME . . 4.510 4.076 3.826 4.310 . 0 0 "[ . 1 . 2]" 1
280 1 10 MET H 1 10 MET HG2 . . 4.060 3.451 3.314 3.618 . 0 0 "[ . 1 . 2]" 1
281 1 10 MET H 1 10 MET QG . . 3.500 2.565 2.462 2.680 . 0 0 "[ . 1 . 2]" 1
282 1 10 MET H 1 10 MET HG3 . . 4.060 2.646 2.530 2.770 . 0 0 "[ . 1 . 2]" 1
283 1 10 MET H 1 11 PHE H . . 3.340 2.322 2.220 2.423 . 0 0 "[ . 1 . 2]" 1
284 1 10 MET H 1 37 VAL H . . 5.390 4.913 4.799 5.040 . 0 0 "[ . 1 . 2]" 1
285 1 10 MET H 1 37 VAL HB . . 4.250 3.849 3.715 4.058 . 0 0 "[ . 1 . 2]" 1
286 1 10 MET H 1 37 VAL MG2 . . 5.320 5.181 5.081 5.322 0.002 16 0 "[ . 1 . 2]" 1
287 1 10 MET H 1 38 ILE HA . . 4.250 2.914 2.716 3.188 . 0 0 "[ . 1 . 2]" 1
288 1 10 MET H 1 38 ILE MG . . 3.960 3.667 3.535 3.871 . 0 0 "[ . 1 . 2]" 1
289 1 10 MET HA 1 10 MET ME . . 4.550 4.553 4.547 4.559 0.009 18 0 "[ . 1 . 2]" 1
290 1 10 MET HA 1 10 MET HG2 . . 3.880 2.424 2.331 2.488 . 0 0 "[ . 1 . 2]" 1
291 1 10 MET HA 1 10 MET QG . . 3.390 2.368 2.285 2.422 . 0 0 "[ . 1 . 2]" 1
292 1 10 MET HA 1 10 MET HG3 . . 3.880 3.327 3.234 3.460 . 0 0 "[ . 1 . 2]" 1
293 1 10 MET HA 1 11 PHE QD . . 4.250 3.823 3.686 3.919 . 0 0 "[ . 1 . 2]" 1
294 1 10 MET HB2 1 10 MET ME . . 2.830 2.343 2.243 2.456 . 0 0 "[ . 1 . 2]" 1
295 1 10 MET HB2 1 11 PHE H . . 4.070 2.380 2.269 2.469 . 0 0 "[ . 1 . 2]" 1
296 1 10 MET HB2 1 11 PHE HB3 . . 5.500 4.504 4.411 4.632 . 0 0 "[ . 1 . 2]" 1
297 1 10 MET HB2 1 11 PHE QD . . 4.110 2.923 2.742 3.000 . 0 0 "[ . 1 . 2]" 1
298 1 10 MET HB2 1 11 PHE QE . . 4.470 3.426 3.360 3.480 . 0 0 "[ . 1 . 2]" 1
299 1 10 MET HB2 1 37 VAL HB . . 3.980 2.914 2.722 3.077 . 0 0 "[ . 1 . 2]" 1
300 1 10 MET HB3 1 11 PHE H . . 3.840 3.506 3.393 3.596 . 0 0 "[ . 1 . 2]" 1
301 1 10 MET HB3 1 11 PHE HB2 . . 5.500 5.522 5.504 5.561 0.061 8 0 "[ . 1 . 2]" 1
302 1 10 MET HB3 1 11 PHE QD . . 3.490 2.232 2.149 2.274 . 0 0 "[ . 1 . 2]" 1
303 1 10 MET HB3 1 11 PHE QE . . 4.220 2.983 2.847 3.316 . 0 0 "[ . 1 . 2]" 1
304 1 10 MET HB3 1 37 VAL HB . . 4.630 4.468 4.210 4.632 0.002 9 0 "[ . 1 . 2]" 1
305 1 10 MET ME 1 10 MET QG . . 3.420 2.439 2.358 2.505 . 0 0 "[ . 1 . 2]" 1
306 1 10 MET ME 1 11 PHE H . . 4.920 4.221 3.983 4.403 . 0 0 "[ . 1 . 2]" 1
307 1 10 MET ME 1 11 PHE QD . . 4.730 3.725 3.487 3.842 . 0 0 "[ . 1 . 2]" 1
308 1 10 MET ME 1 11 PHE QE . . 3.760 2.573 2.363 2.879 . 0 0 "[ . 1 . 2]" 1
309 1 10 MET ME 1 37 VAL HB . . 3.690 3.486 3.297 3.699 0.009 12 0 "[ . 1 . 2]" 1
310 1 10 MET ME 1 37 VAL MG1 . . 3.570 2.049 1.909 2.183 . 0 0 "[ . 1 . 2]" 1
311 1 10 MET ME 1 38 ILE H . . 4.860 3.692 3.472 3.842 . 0 0 "[ . 1 . 2]" 1
312 1 10 MET ME 1 38 ILE HA . . 4.310 3.570 3.139 3.977 . 0 0 "[ . 1 . 2]" 1
313 1 10 MET ME 1 39 PRO HA . . 3.300 2.749 2.555 2.948 . 0 0 "[ . 1 . 2]" 1
314 1 10 MET ME 1 39 PRO HB3 . . 4.030 3.625 3.247 3.885 . 0 0 "[ . 1 . 2]" 1
315 1 10 MET ME 1 39 PRO HD2 . . 5.190 4.622 4.279 4.971 . 0 0 "[ . 1 . 2]" 1
316 1 10 MET ME 1 40 PHE H . . 4.800 4.352 3.919 4.799 . 0 0 "[ . 1 . 2]" 1
317 1 10 MET ME 1 51 LEU QD . . 4.170 2.956 2.664 3.294 . 0 0 "[ . 1 . 2]" 1
318 1 10 MET QG 1 11 PHE H . . 4.120 3.853 3.759 3.940 . 0 0 "[ . 1 . 2]" 1
319 1 10 MET QG 1 11 PHE QD . . 4.320 4.312 4.248 4.336 0.016 18 0 "[ . 1 . 2]" 1
320 1 10 MET QG 1 11 PHE QE . . 4.950 4.508 4.440 4.696 . 0 0 "[ . 1 . 2]" 1
321 1 10 MET QG 1 37 VAL MG1 . . 3.850 3.614 2.943 3.857 0.007 9 0 "[ . 1 . 2]" 1
322 1 10 MET QG 1 38 ILE HA . . 4.070 2.705 2.496 2.979 . 0 0 "[ . 1 . 2]" 1
323 1 10 MET QG 1 38 ILE HB . . 5.340 4.688 4.462 4.981 . 0 0 "[ . 1 . 2]" 1
324 1 10 MET QG 1 39 PRO HD2 . . 4.720 3.668 3.487 3.978 . 0 0 "[ . 1 . 2]" 1
325 1 10 MET QG 1 39 PRO HD3 . . 5.040 2.199 2.075 2.485 . 0 0 "[ . 1 . 2]" 1
326 1 10 MET HG2 1 11 PHE H . . 4.710 4.716 4.629 4.745 0.035 8 0 "[ . 1 . 2]" 1
327 1 10 MET HG2 1 11 PHE QD . . 4.930 4.756 4.691 4.804 . 0 0 "[ . 1 . 2]" 1
328 1 10 MET HG2 1 38 ILE HA . . 4.640 4.292 3.955 4.610 . 0 0 "[ . 1 . 2]" 1
329 1 10 MET HG3 1 11 PHE H . . 4.710 4.087 3.976 4.215 . 0 0 "[ . 1 . 2]" 1
330 1 10 MET HG3 1 11 PHE QD . . 4.930 4.937 4.854 4.965 0.035 6 0 "[ . 1 . 2]" 1
331 1 10 MET HG3 1 38 ILE HA . . 4.640 2.735 2.523 3.017 . 0 0 "[ . 1 . 2]" 1
332 1 11 PHE H 1 11 PHE QD . . 4.320 3.428 3.209 3.530 . 0 0 "[ . 1 . 2]" 1
333 1 11 PHE H 1 37 VAL H . . 4.200 3.737 3.636 3.818 . 0 0 "[ . 1 . 2]" 1
334 1 11 PHE H 1 37 VAL HA . . 5.390 4.890 4.739 4.961 . 0 0 "[ . 1 . 2]" 1
335 1 11 PHE H 1 37 VAL HB . . 3.270 2.527 2.281 2.615 . 0 0 "[ . 1 . 2]" 1
336 1 11 PHE H 1 37 VAL MG1 . . 4.070 3.854 3.476 3.975 . 0 0 "[ . 1 . 2]" 1
337 1 11 PHE H 1 37 VAL MG2 . . 3.910 3.879 3.803 3.925 0.015 15 0 "[ . 1 . 2]" 1
338 1 11 PHE H 1 38 ILE HA . . 5.170 4.725 4.528 4.898 . 0 0 "[ . 1 . 2]" 1
339 1 11 PHE HA 1 11 PHE HB2 . . 3.020 2.494 2.451 2.522 . 0 0 "[ . 1 . 2]" 1
340 1 11 PHE HA 1 11 PHE QD . . 3.950 3.776 3.762 3.800 . 0 0 "[ . 1 . 2]" 1
341 1 11 PHE HA 1 12 LYS H . . 3.010 2.455 2.383 2.540 . 0 0 "[ . 1 . 2]" 1
342 1 11 PHE HA 1 12 LYS HB2 . . 4.590 4.631 4.597 4.655 0.065 2 0 "[ . 1 . 2]" 1
343 1 11 PHE HA 1 12 LYS HG3 . . 4.850 4.008 3.816 4.298 . 0 0 "[ . 1 . 2]" 1
344 1 11 PHE HA 1 37 VAL HB . . 4.690 4.666 4.448 4.699 0.009 8 0 "[ . 1 . 2]" 1
345 1 11 PHE HA 1 37 VAL MG2 . . 4.870 4.876 4.767 4.895 0.025 2 0 "[ . 1 . 2]" 1
346 1 11 PHE HB2 1 12 LYS H . . 3.490 2.283 2.175 2.365 . 0 0 "[ . 1 . 2]" 1
347 1 11 PHE HB2 1 12 LYS HA . . 5.080 4.537 4.485 4.623 . 0 0 "[ . 1 . 2]" 1
348 1 11 PHE HB2 1 13 VAL MG1 . . 4.960 4.485 4.249 4.771 . 0 0 "[ . 1 . 2]" 1
349 1 11 PHE HB2 1 37 VAL HB . . 5.470 4.596 4.465 4.770 . 0 0 "[ . 1 . 2]" 1
350 1 11 PHE HB2 1 37 VAL MG2 . . 4.830 4.245 4.080 4.390 . 0 0 "[ . 1 . 2]" 1
351 1 11 PHE HB2 1 79 ARG QD . . 4.370 2.657 2.140 3.122 . 0 0 "[ . 1 . 2]" 1
352 1 11 PHE HB2 1 80 VAL MG2 . . 4.760 4.514 4.338 4.782 0.022 17 0 "[ . 1 . 2]" 1
353 1 11 PHE HB3 1 12 LYS H . . 3.550 3.572 3.550 3.606 0.056 1 0 "[ . 1 . 2]" 1
354 1 11 PHE HB3 1 37 VAL HB . . 5.200 4.846 4.735 4.900 . 0 0 "[ . 1 . 2]" 1
355 1 11 PHE HB3 1 37 VAL MG1 . . 5.500 5.518 5.273 5.544 0.044 6 0 "[ . 1 . 2]" 1
356 1 11 PHE HB3 1 79 ARG QD . . 4.490 3.742 3.015 4.206 . 0 0 "[ . 1 . 2]" 1
357 1 11 PHE QD 1 12 LYS H . . 3.900 3.510 3.195 3.712 . 0 0 "[ . 1 . 2]" 1
358 1 11 PHE QD 1 12 LYS HA . . 4.490 4.077 3.984 4.222 . 0 0 "[ . 1 . 2]" 1
359 1 11 PHE QD 1 13 VAL HA . . 4.960 4.565 4.338 4.734 . 0 0 "[ . 1 . 2]" 1
360 1 11 PHE QD 1 13 VAL MG1 . . 3.050 2.618 2.326 2.871 . 0 0 "[ . 1 . 2]" 1
361 1 11 PHE QD 1 37 VAL H . . 5.500 4.428 4.244 4.761 . 0 0 "[ . 1 . 2]" 1
362 1 11 PHE QD 1 37 VAL HB . . 4.410 3.355 3.217 3.611 . 0 0 "[ . 1 . 2]" 1
363 1 11 PHE QD 1 37 VAL MG1 . . 3.940 3.690 3.588 3.838 . 0 0 "[ . 1 . 2]" 1
364 1 11 PHE QD 1 37 VAL MG2 . . 3.240 2.600 2.439 3.011 . 0 0 "[ . 1 . 2]" 1
365 1 11 PHE QD 1 79 ARG HA . . 4.500 3.951 3.618 4.210 . 0 0 "[ . 1 . 2]" 1
366 1 11 PHE QD 1 79 ARG QD . . 3.560 2.427 1.950 2.674 . 0 0 "[ . 1 . 2]" 1
367 1 11 PHE QD 1 79 ARG HG2 . . 4.660 3.587 2.791 4.695 0.035 12 0 "[ . 1 . 2]" 1
368 1 11 PHE QD 1 79 ARG QG . . 3.870 3.368 2.743 3.981 0.111 1 0 "[ . 1 . 2]" 1
369 1 11 PHE QD 1 79 ARG HG3 . . 4.660 4.409 4.029 4.665 0.005 9 0 "[ . 1 . 2]" 1
370 1 11 PHE QD 1 80 VAL H . . 4.430 4.281 3.851 4.440 0.010 13 0 "[ . 1 . 2]" 1
371 1 11 PHE QD 1 80 VAL MG2 . . 4.730 4.577 4.289 4.712 . 0 0 "[ . 1 . 2]" 1
372 1 11 PHE QE 1 13 VAL MG1 . . 2.980 2.639 2.353 2.892 . 0 0 "[ . 1 . 2]" 1
373 1 11 PHE QE 1 13 VAL MG2 . . 5.060 4.650 4.323 4.921 . 0 0 "[ . 1 . 2]" 1
374 1 11 PHE QE 1 37 VAL HA . . 5.500 5.548 5.529 5.586 0.086 16 0 "[ . 1 . 2]" 1
375 1 11 PHE QE 1 37 VAL HB . . 4.390 3.708 3.656 3.875 . 0 0 "[ . 1 . 2]" 1
376 1 11 PHE QE 1 37 VAL MG1 . . 3.570 2.794 2.704 2.906 . 0 0 "[ . 1 . 2]" 1
377 1 11 PHE QE 1 37 VAL MG2 . . 3.270 2.267 2.218 2.481 . 0 0 "[ . 1 . 2]" 1
378 1 11 PHE QE 1 51 LEU MD1 . . 3.760 2.419 2.203 2.867 . 0 0 "[ . 1 . 2]" 1
379 1 11 PHE QE 1 51 LEU QD . . 3.140 2.375 2.172 2.765 . 0 0 "[ . 1 . 2]" 1
380 1 11 PHE QE 1 51 LEU MD2 . . 3.760 3.512 3.299 3.786 0.026 12 0 "[ . 1 . 2]" 1
381 1 11 PHE QE 1 51 LEU HG . . 5.500 5.011 3.549 5.501 0.001 16 0 "[ . 1 . 2]" 1
382 1 11 PHE QE 1 79 ARG HA . . 4.940 4.698 4.129 4.960 0.020 12 0 "[ . 1 . 2]" 1
383 1 11 PHE QE 1 79 ARG QD . . 4.120 3.621 2.623 4.123 0.003 4 0 "[ . 1 . 2]" 1
384 1 11 PHE QE 1 79 ARG HG2 . . 5.440 3.726 2.833 5.175 . 0 0 "[ . 1 . 2]" 1
385 1 11 PHE QE 1 79 ARG QG . . 4.640 3.570 2.779 4.671 0.031 16 0 "[ . 1 . 2]" 1
386 1 11 PHE QE 1 79 ARG HG3 . . 5.440 4.757 3.951 5.492 0.052 10 0 "[ . 1 . 2]" 1
387 1 11 PHE HZ 1 37 VAL MG1 . . 3.980 2.773 2.616 2.895 . 0 0 "[ . 1 . 2]" 1
388 1 11 PHE HZ 1 51 LEU QD . . 3.840 2.383 2.145 2.591 . 0 0 "[ . 1 . 2]" 1
389 1 11 PHE HZ 1 51 LEU HG . . 5.230 4.812 4.238 5.106 . 0 0 "[ . 1 . 2]" 1
390 1 12 LYS H 1 12 LYS HB2 . . 3.550 2.457 2.398 2.497 . 0 0 "[ . 1 . 2]" 1
391 1 12 LYS H 1 12 LYS HB3 . . 4.130 3.707 3.664 3.739 . 0 0 "[ . 1 . 2]" 1
392 1 12 LYS H 1 12 LYS HG2 . . 4.600 3.981 3.788 4.287 . 0 0 "[ . 1 . 2]" 1
393 1 12 LYS H 1 12 LYS HG3 . . 3.500 3.020 2.852 3.203 . 0 0 "[ . 1 . 2]" 1
394 1 12 LYS H 1 13 VAL H . . 4.560 4.532 4.503 4.554 . 0 0 "[ . 1 . 2]" 1
395 1 12 LYS H 1 79 ARG QD . . 4.940 3.760 3.447 4.161 . 0 0 "[ . 1 . 2]" 1
396 1 12 LYS H 1 80 VAL HB . . 5.500 5.493 5.390 5.552 0.052 8 0 "[ . 1 . 2]" 1
397 1 12 LYS H 1 80 VAL MG2 . . 4.530 3.209 3.074 3.534 . 0 0 "[ . 1 . 2]" 1
398 1 12 LYS HA 1 12 LYS HD2 . . 4.690 4.552 4.497 4.625 . 0 0 "[ . 1 . 2]" 1
399 1 12 LYS HA 1 12 LYS HD3 . . 4.690 4.279 4.107 4.457 . 0 0 "[ . 1 . 2]" 1
400 1 12 LYS HA 1 12 LYS HE3 . . 5.270 5.190 4.896 5.297 0.027 16 0 "[ . 1 . 2]" 1
401 1 12 LYS HA 1 12 LYS HG2 . . 3.560 2.467 2.412 2.528 . 0 0 "[ . 1 . 2]" 1
402 1 12 LYS HA 1 12 LYS HG3 . . 3.650 3.118 2.812 3.262 . 0 0 "[ . 1 . 2]" 1
403 1 12 LYS HA 1 13 VAL H . . 2.880 2.268 2.219 2.298 . 0 0 "[ . 1 . 2]" 1
404 1 12 LYS HA 1 13 VAL MG1 . . 3.990 3.700 3.647 3.770 . 0 0 "[ . 1 . 2]" 1
405 1 12 LYS HA 1 13 VAL MG2 . . 4.130 3.814 3.713 3.894 . 0 0 "[ . 1 . 2]" 1
406 1 12 LYS HA 1 34 VAL QG . . 4.560 3.944 3.741 4.101 . 0 0 "[ . 1 . 2]" 1
407 1 12 LYS HA 1 35 VAL H . . 4.420 4.444 4.430 4.465 0.045 12 0 "[ . 1 . 2]" 1
408 1 12 LYS HA 1 35 VAL HA . . 5.500 5.424 5.367 5.504 0.004 12 0 "[ . 1 . 2]" 1
409 1 12 LYS HA 1 35 VAL HB . . 5.500 4.964 4.890 5.102 . 0 0 "[ . 1 . 2]" 1
410 1 12 LYS HA 1 36 LEU HA . . 3.440 2.566 2.541 2.606 . 0 0 "[ . 1 . 2]" 1
411 1 12 LYS HA 1 36 LEU HB2 . . 5.500 5.558 5.541 5.581 0.081 12 0 "[ . 1 . 2]" 1
412 1 12 LYS HA 1 36 LEU QD . . 4.190 3.853 3.710 3.992 . 0 0 "[ . 1 . 2]" 1
413 1 12 LYS HA 1 37 VAL H . . 3.780 2.395 2.346 2.433 . 0 0 "[ . 1 . 2]" 1
414 1 12 LYS HA 1 37 VAL MG2 . . 3.560 2.736 2.663 2.819 . 0 0 "[ . 1 . 2]" 1
415 1 12 LYS HA 1 80 VAL MG2 . . 4.330 3.687 3.655 3.715 . 0 0 "[ . 1 . 2]" 1
416 1 12 LYS HB2 1 12 LYS HE2 . . 4.870 4.653 4.489 4.750 . 0 0 "[ . 1 . 2]" 1
417 1 12 LYS HB2 1 12 LYS HE3 . . 3.970 3.933 3.638 3.998 0.028 17 0 "[ . 1 . 2]" 1
418 1 12 LYS HB2 1 13 VAL H . . 3.960 3.781 3.719 3.860 . 0 0 "[ . 1 . 2]" 1
419 1 12 LYS HB2 1 37 VAL H . . 5.330 5.317 5.259 5.351 0.021 2 0 "[ . 1 . 2]" 1
420 1 12 LYS HB2 1 79 ARG QD . . 5.500 4.988 4.533 5.514 0.014 12 0 "[ . 1 . 2]" 1
421 1 12 LYS HB2 1 80 VAL MG2 . . 2.960 2.002 1.931 2.134 . 0 0 "[ . 1 . 2]" 1
422 1 12 LYS HB3 1 12 LYS HE2 . . 4.880 4.534 4.412 4.687 . 0 0 "[ . 1 . 2]" 1
423 1 12 LYS HB3 1 12 LYS HE3 . . 4.480 4.499 4.483 4.527 0.047 10 0 "[ . 1 . 2]" 1
424 1 12 LYS HB3 1 13 VAL H . . 3.700 2.484 2.447 2.545 . 0 0 "[ . 1 . 2]" 1
425 1 12 LYS HB3 1 13 VAL HA . . 4.480 4.136 3.925 4.242 . 0 0 "[ . 1 . 2]" 1
426 1 12 LYS HB3 1 13 VAL MG2 . . 4.410 4.467 4.454 4.480 0.070 2 0 "[ . 1 . 2]" 1
427 1 12 LYS HB3 1 35 VAL H . . 4.480 3.799 3.714 3.917 . 0 0 "[ . 1 . 2]" 1
428 1 12 LYS HB3 1 37 VAL H . . 5.260 4.772 4.705 4.866 . 0 0 "[ . 1 . 2]" 1
429 1 12 LYS HB3 1 80 VAL MG2 . . 2.940 2.318 2.091 2.426 . 0 0 "[ . 1 . 2]" 1
430 1 12 LYS QD 1 34 VAL QG . . 3.130 2.024 1.962 2.142 . 0 0 "[ . 1 . 2]" 1
431 1 12 LYS QD 1 36 LEU QD . . 3.020 2.439 2.198 2.898 . 0 0 "[ . 1 . 2]" 1
432 1 12 LYS HE2 1 12 LYS HG2 . . 3.540 2.792 2.627 2.946 . 0 0 "[ . 1 . 2]" 1
433 1 12 LYS HE2 1 12 LYS HG3 . . 3.450 2.998 2.655 3.147 . 0 0 "[ . 1 . 2]" 1
434 1 12 LYS HE2 1 34 VAL QG . . 4.180 3.768 3.208 4.127 . 0 0 "[ . 1 . 2]" 1
435 1 12 LYS HE2 1 36 LEU HB3 . . 4.950 4.598 4.343 4.952 0.002 10 0 "[ . 1 . 2]" 1
436 1 12 LYS HE2 1 36 LEU MD1 . . 4.070 3.931 3.826 4.086 0.016 10 0 "[ . 1 . 2]" 1
437 1 12 LYS HE2 1 36 LEU QD . . 3.200 1.873 1.831 1.938 . 0 0 "[ . 1 . 2]" 1
438 1 12 LYS HE2 1 36 LEU MD2 . . 4.070 1.877 1.834 1.941 . 0 0 "[ . 1 . 2]" 1
439 1 12 LYS HE3 1 12 LYS HG3 . . 3.290 2.236 2.146 2.303 . 0 0 "[ . 1 . 2]" 1
440 1 12 LYS HE3 1 34 VAL QG . . 4.770 4.385 4.252 4.488 . 0 0 "[ . 1 . 2]" 1
441 1 12 LYS HE3 1 36 LEU HB3 . . 5.500 5.468 4.921 5.565 0.065 15 0 "[ . 1 . 2]" 1
442 1 12 LYS HE3 1 36 LEU QD . . 3.790 2.965 2.526 3.112 . 0 0 "[ . 1 . 2]" 1
443 1 12 LYS HE3 1 80 VAL MG2 . . 5.380 5.109 4.968 5.311 . 0 0 "[ . 1 . 2]" 1
444 1 12 LYS HG2 1 13 VAL H . . 4.270 3.914 3.583 4.116 . 0 0 "[ . 1 . 2]" 1
445 1 12 LYS HG2 1 34 VAL QG . . 3.640 3.230 2.841 3.463 . 0 0 "[ . 1 . 2]" 1
446 1 12 LYS HG2 1 36 LEU H . . 4.910 4.566 4.131 4.781 . 0 0 "[ . 1 . 2]" 1
447 1 12 LYS HG2 1 36 LEU HA . . 4.100 2.348 2.229 2.469 . 0 0 "[ . 1 . 2]" 1
448 1 12 LYS HG2 1 36 LEU QD . . 3.160 2.065 2.013 2.097 . 0 0 "[ . 1 . 2]" 1
449 1 12 LYS HG2 1 37 VAL H . . 4.640 3.904 3.807 4.090 . 0 0 "[ . 1 . 2]" 1
450 1 12 LYS HG2 1 80 VAL MG2 . . 4.340 4.216 4.018 4.325 . 0 0 "[ . 1 . 2]" 1
451 1 12 LYS HG3 1 13 VAL H . . 4.960 4.825 4.574 4.951 . 0 0 "[ . 1 . 2]" 1
452 1 12 LYS HG3 1 36 LEU HA . . 4.760 3.709 3.134 3.977 . 0 0 "[ . 1 . 2]" 1
453 1 12 LYS HG3 1 37 VAL H . . 5.490 4.749 4.288 4.978 . 0 0 "[ . 1 . 2]" 1
454 1 13 VAL H 1 13 VAL MG1 . . 3.670 3.003 2.924 3.079 . 0 0 "[ . 1 . 2]" 1
455 1 13 VAL H 1 13 VAL MG2 . . 3.230 2.299 2.252 2.333 . 0 0 "[ . 1 . 2]" 1
456 1 13 VAL H 1 34 VAL QG . . 3.840 3.286 3.079 3.541 . 0 0 "[ . 1 . 2]" 1
457 1 13 VAL H 1 35 VAL H . . 3.780 2.758 2.693 2.835 . 0 0 "[ . 1 . 2]" 1
458 1 13 VAL H 1 35 VAL HB . . 4.770 3.736 3.634 3.854 . 0 0 "[ . 1 . 2]" 1
459 1 13 VAL H 1 35 VAL MG1 . . 5.120 4.875 4.802 4.961 . 0 0 "[ . 1 . 2]" 1
460 1 13 VAL H 1 35 VAL QG . . 4.330 3.976 3.917 4.031 . 0 0 "[ . 1 . 2]" 1
461 1 13 VAL H 1 35 VAL MG2 . . 5.120 4.214 4.145 4.297 . 0 0 "[ . 1 . 2]" 1
462 1 13 VAL H 1 36 LEU HA . . 4.520 4.013 3.917 4.058 . 0 0 "[ . 1 . 2]" 1
463 1 13 VAL H 1 37 VAL H . . 4.480 3.808 3.664 3.892 . 0 0 "[ . 1 . 2]" 1
464 1 13 VAL H 1 37 VAL MG2 . . 4.040 3.213 3.086 3.321 . 0 0 "[ . 1 . 2]" 1
465 1 13 VAL H 1 80 VAL MG2 . . 4.150 3.136 3.094 3.180 . 0 0 "[ . 1 . 2]" 1
466 1 13 VAL HA 1 13 VAL MG1 . . 3.050 2.455 2.424 2.489 . 0 0 "[ . 1 . 2]" 1
467 1 13 VAL HA 1 13 VAL MG2 . . 3.580 3.196 3.177 3.207 . 0 0 "[ . 1 . 2]" 1
468 1 13 VAL HA 1 14 GLN H . . 3.140 2.400 2.354 2.430 . 0 0 "[ . 1 . 2]" 1
469 1 13 VAL HA 1 77 THR HB . . 4.210 4.133 4.051 4.191 . 0 0 "[ . 1 . 2]" 1
470 1 13 VAL HA 1 78 GLU H . . 4.170 4.152 4.006 4.193 0.023 18 0 "[ . 1 . 2]" 1
471 1 13 VAL HA 1 78 GLU QG . . 4.880 4.368 4.147 4.754 . 0 0 "[ . 1 . 2]" 1
472 1 13 VAL HA 1 79 ARG H . . 4.940 4.670 4.471 4.826 . 0 0 "[ . 1 . 2]" 1
473 1 13 VAL HA 1 79 ARG HA . . 3.150 2.622 2.493 2.717 . 0 0 "[ . 1 . 2]" 1
474 1 13 VAL HA 1 79 ARG QB . . 5.340 4.758 4.468 4.881 . 0 0 "[ . 1 . 2]" 1
475 1 13 VAL HA 1 79 ARG QD . . 4.610 3.992 3.843 4.185 . 0 0 "[ . 1 . 2]" 1
476 1 13 VAL HA 1 80 VAL H . . 3.320 2.627 2.261 2.858 . 0 0 "[ . 1 . 2]" 1
477 1 13 VAL HA 1 80 VAL HB . . 5.200 5.025 4.979 5.080 . 0 0 "[ . 1 . 2]" 1
478 1 13 VAL HA 1 80 VAL MG1 . . 3.870 3.376 3.147 3.779 . 0 0 "[ . 1 . 2]" 1
479 1 13 VAL HA 1 80 VAL MG2 . . 3.210 2.120 2.085 2.146 . 0 0 "[ . 1 . 2]" 1
480 1 13 VAL HB 1 14 GLN H . . 3.300 2.692 2.605 2.809 . 0 0 "[ . 1 . 2]" 1
481 1 13 VAL HB 1 77 THR H . . 5.120 5.184 5.145 5.215 0.095 5 0 "[ . 1 . 2]" 1
482 1 13 VAL HB 1 77 THR HA . . 4.450 4.437 4.373 4.472 0.022 7 0 "[ . 1 . 2]" 1
483 1 13 VAL HB 1 77 THR HB . . 3.070 2.115 2.058 2.170 . 0 0 "[ . 1 . 2]" 1
484 1 13 VAL HB 1 77 THR HG1 . . 4.390 3.444 2.967 3.643 . 0 0 "[ . 1 . 2]" 1
485 1 13 VAL HB 1 78 GLU H . . 3.210 3.116 2.945 3.227 0.017 12 0 "[ . 1 . 2]" 1
486 1 13 VAL HB 1 78 GLU HA . . 5.500 4.409 4.221 4.609 . 0 0 "[ . 1 . 2]" 1
487 1 13 VAL HB 1 79 ARG HA . . 4.230 3.677 3.449 3.913 . 0 0 "[ . 1 . 2]" 1
488 1 13 VAL HB 1 79 ARG QD . . 5.500 5.262 4.566 5.499 . 0 0 "[ . 1 . 2]" 1
489 1 13 VAL MG1 1 14 GLN H . . 4.060 3.945 3.864 4.011 . 0 0 "[ . 1 . 2]" 1
490 1 13 VAL MG1 1 35 VAL QG . . 4.710 4.240 4.156 4.345 . 0 0 "[ . 1 . 2]" 1
491 1 13 VAL MG1 1 37 VAL H . . 3.980 4.017 4.008 4.024 0.044 13 0 "[ . 1 . 2]" 1
492 1 13 VAL MG1 1 72 PHE HZ . . 4.440 3.295 3.077 3.459 . 0 0 "[ . 1 . 2]" 1
493 1 13 VAL MG1 1 74 GLU HA . . 4.610 4.312 4.022 4.577 . 0 0 "[ . 1 . 2]" 1
494 1 13 VAL MG1 1 77 THR HB . . 3.920 3.699 3.620 3.775 . 0 0 "[ . 1 . 2]" 1
495 1 13 VAL MG1 1 77 THR HG1 . . 4.370 3.716 3.288 3.837 . 0 0 "[ . 1 . 2]" 1
496 1 13 VAL MG1 1 79 ARG H . . 4.440 3.964 3.454 4.302 . 0 0 "[ . 1 . 2]" 1
497 1 13 VAL MG1 1 79 ARG HA . . 3.020 2.253 2.108 2.457 . 0 0 "[ . 1 . 2]" 1
498 1 13 VAL MG1 1 79 ARG QD . . 3.360 3.102 2.268 3.367 0.007 20 0 "[ . 1 . 2]" 1
499 1 13 VAL MG1 1 80 VAL H . . 3.700 3.519 3.409 3.700 0.000 17 0 "[ . 1 . 2]" 1
500 1 13 VAL MG2 1 14 GLN H . . 4.070 3.459 3.309 3.581 . 0 0 "[ . 1 . 2]" 1
501 1 13 VAL MG2 1 14 GLN HA . . 4.290 3.554 3.389 3.730 . 0 0 "[ . 1 . 2]" 1
502 1 13 VAL MG2 1 15 ALA H . . 4.980 4.139 3.970 4.363 . 0 0 "[ . 1 . 2]" 1
503 1 13 VAL MG2 1 15 ALA HA . . 5.100 4.623 4.498 4.822 . 0 0 "[ . 1 . 2]" 1
504 1 13 VAL MG2 1 34 VAL HA . . 4.310 4.171 4.046 4.314 0.004 14 0 "[ . 1 . 2]" 1
505 1 13 VAL MG2 1 35 VAL H . . 3.550 2.901 2.777 3.001 . 0 0 "[ . 1 . 2]" 1
506 1 13 VAL MG2 1 35 VAL HA . . 4.630 4.201 4.129 4.268 . 0 0 "[ . 1 . 2]" 1
507 1 13 VAL MG2 1 35 VAL HB . . 2.810 2.125 2.047 2.204 . 0 0 "[ . 1 . 2]" 1
508 1 13 VAL MG2 1 35 VAL MG1 . . 3.560 3.430 3.353 3.505 . 0 0 "[ . 1 . 2]" 1
509 1 13 VAL MG2 1 35 VAL QG . . 2.970 2.286 2.224 2.345 . 0 0 "[ . 1 . 2]" 1
510 1 13 VAL MG2 1 35 VAL MG2 . . 3.560 2.322 2.252 2.383 . 0 0 "[ . 1 . 2]" 1
511 1 13 VAL MG2 1 36 LEU HA . . 5.500 4.832 4.666 4.911 . 0 0 "[ . 1 . 2]" 1
512 1 13 VAL MG2 1 37 VAL H . . 4.590 4.051 3.737 4.258 . 0 0 "[ . 1 . 2]" 1
513 1 13 VAL MG2 1 37 VAL HA . . 5.500 4.791 4.494 4.965 . 0 0 "[ . 1 . 2]" 1
514 1 13 VAL MG2 1 53 GLY HA3 . . 5.020 4.959 4.854 5.039 0.019 7 0 "[ . 1 . 2]" 1
515 1 13 VAL MG2 1 72 PHE QE . . 4.030 2.206 2.153 2.257 . 0 0 "[ . 1 . 2]" 1
516 1 13 VAL MG2 1 72 PHE HZ . . 3.300 2.435 2.306 2.527 . 0 0 "[ . 1 . 2]" 1
517 1 13 VAL MG2 1 74 GLU HA . . 5.300 4.281 4.060 4.429 . 0 0 "[ . 1 . 2]" 1
518 1 13 VAL MG2 1 74 GLU HB2 . . 5.500 5.119 4.801 5.360 . 0 0 "[ . 1 . 2]" 1
519 1 13 VAL MG2 1 77 THR HA . . 4.670 4.540 4.478 4.681 0.011 2 0 "[ . 1 . 2]" 1
520 1 13 VAL MG2 1 77 THR HB . . 3.390 2.581 2.501 2.687 . 0 0 "[ . 1 . 2]" 1
521 1 13 VAL MG2 1 77 THR HG1 . . 4.170 3.595 3.277 3.686 . 0 0 "[ . 1 . 2]" 1
522 1 13 VAL MG2 1 77 THR MG . . 3.010 2.286 2.191 2.514 . 0 0 "[ . 1 . 2]" 1
523 1 13 VAL MG2 1 78 GLU H . . 4.140 4.159 4.144 4.172 0.032 19 0 "[ . 1 . 2]" 1
524 1 13 VAL MG2 1 79 ARG HA . . 5.500 4.709 4.575 4.868 . 0 0 "[ . 1 . 2]" 1
525 1 14 GLN H 1 14 GLN HB2 . . 4.040 3.075 2.934 3.191 . 0 0 "[ . 1 . 2]" 1
526 1 14 GLN H 1 14 GLN HB3 . . 4.040 2.790 2.681 2.885 . 0 0 "[ . 1 . 2]" 1
527 1 14 GLN H 1 77 THR HA . . 5.000 4.352 4.244 4.444 . 0 0 "[ . 1 . 2]" 1
528 1 14 GLN H 1 77 THR HB . . 3.830 2.981 2.757 3.151 . 0 0 "[ . 1 . 2]" 1
529 1 14 GLN H 1 78 GLU H . . 3.140 2.348 2.284 2.445 . 0 0 "[ . 1 . 2]" 1
530 1 14 GLN H 1 78 GLU QG . . 4.870 2.932 2.693 3.153 . 0 0 "[ . 1 . 2]" 1
531 1 14 GLN H 1 79 ARG HA . . 4.540 4.212 4.050 4.331 . 0 0 "[ . 1 . 2]" 1
532 1 14 GLN H 1 80 VAL H . . 4.530 4.380 3.860 4.568 0.038 16 0 "[ . 1 . 2]" 1
533 1 14 GLN H 1 80 VAL MG1 . . 3.880 3.067 2.722 3.429 . 0 0 "[ . 1 . 2]" 1
534 1 14 GLN H 1 80 VAL MG2 . . 3.660 3.120 2.750 3.255 . 0 0 "[ . 1 . 2]" 1
535 1 14 GLN HA 1 14 GLN QG . . 3.110 2.279 2.210 2.363 . 0 0 "[ . 1 . 2]" 1
536 1 14 GLN HA 1 15 ALA H . . 2.810 2.193 2.164 2.233 . 0 0 "[ . 1 . 2]" 1
537 1 14 GLN HA 1 15 ALA MB . . 4.030 4.008 3.976 4.037 0.007 6 0 "[ . 1 . 2]" 1
538 1 14 GLN HA 1 34 VAL H . . 5.120 4.531 4.323 4.637 . 0 0 "[ . 1 . 2]" 1
539 1 14 GLN HA 1 34 VAL HA . . 3.120 2.336 2.207 2.548 . 0 0 "[ . 1 . 2]" 1
540 1 14 GLN HA 1 34 VAL MG1 . . 4.250 3.657 3.351 4.226 . 0 0 "[ . 1 . 2]" 1
541 1 14 GLN HA 1 34 VAL MG2 . . 4.250 3.635 3.239 3.965 . 0 0 "[ . 1 . 2]" 1
542 1 14 GLN HA 1 35 VAL H . . 4.350 3.362 3.281 3.466 . 0 0 "[ . 1 . 2]" 1
543 1 14 GLN HA 1 35 VAL QG . . 4.320 3.596 3.395 3.814 . 0 0 "[ . 1 . 2]" 1
544 1 14 GLN HA 1 80 VAL MG2 . . 4.280 4.256 3.886 4.330 0.050 6 0 "[ . 1 . 2]" 1
545 1 14 GLN QB 1 16 GLN HE21 . . 4.340 3.171 3.054 3.310 . 0 0 "[ . 1 . 2]" 1
546 1 14 GLN QB 1 16 GLN HE22 . . 4.240 3.097 3.070 3.131 . 0 0 "[ . 1 . 2]" 1
547 1 14 GLN QB 1 78 GLU H . . 4.310 3.657 3.534 3.805 . 0 0 "[ . 1 . 2]" 1
548 1 14 GLN QB 1 80 VAL MG1 . . 3.270 2.427 2.165 2.718 . 0 0 "[ . 1 . 2]" 1
549 1 14 GLN HB2 1 15 ALA H . . 4.550 4.320 4.233 4.383 . 0 0 "[ . 1 . 2]" 1
550 1 14 GLN HB2 1 16 GLN HE22 . . 4.840 4.857 4.796 4.880 0.040 5 0 "[ . 1 . 2]" 1
551 1 14 GLN HB3 1 15 ALA H . . 4.550 4.210 4.151 4.306 . 0 0 "[ . 1 . 2]" 1
552 1 14 GLN HB3 1 16 GLN HE22 . . 4.840 3.133 3.104 3.169 . 0 0 "[ . 1 . 2]" 1
553 1 14 GLN QE 1 14 GLN QG . . 3.050 2.209 2.141 2.266 . 0 0 "[ . 1 . 2]" 1
554 1 14 GLN QE 1 32 GLY HA2 . . 3.690 2.862 2.516 3.125 . 0 0 "[ . 1 . 2]" 1
555 1 14 GLN QE 1 32 GLY HA3 . . 4.820 3.646 3.182 3.953 . 0 0 "[ . 1 . 2]" 1
556 1 14 GLN QE 1 33 ASP HA . . 5.220 4.249 4.027 4.649 . 0 0 "[ . 1 . 2]" 1
557 1 14 GLN QE 1 34 VAL QG . . 3.510 2.881 2.601 3.456 . 0 0 "[ . 1 . 2]" 1
558 1 14 GLN HE21 1 32 GLY HA2 . . 4.370 2.930 2.604 3.200 . 0 0 "[ . 1 . 2]" 1
559 1 14 GLN HE22 1 14 GLN QG . . 3.740 3.256 3.229 3.280 . 0 0 "[ . 1 . 2]" 1
560 1 14 GLN HE22 1 32 GLY HA2 . . 4.370 4.040 3.272 4.397 0.027 17 0 "[ . 1 . 2]" 1
561 1 14 GLN QG 1 15 ALA H . . 3.460 2.701 2.644 2.827 . 0 0 "[ . 1 . 2]" 1
562 1 14 GLN QG 1 15 ALA MB . . 4.340 3.709 3.539 3.831 . 0 0 "[ . 1 . 2]" 1
563 1 14 GLN QG 1 16 GLN HE21 . . 4.070 3.460 3.062 3.733 . 0 0 "[ . 1 . 2]" 1
564 1 14 GLN QG 1 16 GLN HE22 . . 4.130 3.504 3.103 4.038 . 0 0 "[ . 1 . 2]" 1
565 1 14 GLN QG 1 31 ALA HA . . 5.500 5.420 5.275 5.518 0.018 20 0 "[ . 1 . 2]" 1
566 1 14 GLN QG 1 32 GLY H . . 4.160 3.670 3.496 3.855 . 0 0 "[ . 1 . 2]" 1
567 1 14 GLN QG 1 32 GLY HA2 . . 3.640 2.855 2.555 3.095 . 0 0 "[ . 1 . 2]" 1
568 1 14 GLN QG 1 33 ASP H . . 5.020 3.911 3.749 4.168 . 0 0 "[ . 1 . 2]" 1
569 1 14 GLN QG 1 33 ASP HB2 . . 5.500 5.066 4.924 5.267 . 0 0 "[ . 1 . 2]" 1
570 1 14 GLN QG 1 34 VAL QG . . 4.320 2.768 2.594 2.995 . 0 0 "[ . 1 . 2]" 1
571 1 14 GLN QG 1 35 VAL QG . . 5.440 4.800 4.585 5.036 . 0 0 "[ . 1 . 2]" 1
572 1 15 ALA H 1 15 ALA MB . . 2.940 2.196 2.167 2.217 . 0 0 "[ . 1 . 2]" 1
573 1 15 ALA H 1 16 GLN H . . 4.560 4.551 4.499 4.581 0.021 11 0 "[ . 1 . 2]" 1
574 1 15 ALA H 1 29 LEU MD1 . . 5.240 4.287 4.115 4.460 . 0 0 "[ . 1 . 2]" 1
575 1 15 ALA H 1 29 LEU MD2 . . 5.240 4.464 4.193 4.720 . 0 0 "[ . 1 . 2]" 1
576 1 15 ALA H 1 31 ALA HA . . 5.500 5.181 4.928 5.361 . 0 0 "[ . 1 . 2]" 1
577 1 15 ALA H 1 33 ASP H . . 4.200 3.374 3.267 3.478 . 0 0 "[ . 1 . 2]" 1
578 1 15 ALA H 1 33 ASP HB2 . . 4.660 3.766 3.623 4.001 . 0 0 "[ . 1 . 2]" 1
579 1 15 ALA H 1 33 ASP HB3 . . 4.880 4.462 4.150 4.617 . 0 0 "[ . 1 . 2]" 1
580 1 15 ALA H 1 34 VAL H . . 5.180 4.758 4.564 4.864 . 0 0 "[ . 1 . 2]" 1
581 1 15 ALA H 1 35 VAL QG . . 4.560 3.494 3.374 3.644 . 0 0 "[ . 1 . 2]" 1
582 1 15 ALA H 1 77 THR MG . . 3.980 2.963 2.872 3.063 . 0 0 "[ . 1 . 2]" 1
583 1 15 ALA HA 1 16 GLN H . . 2.940 2.087 2.053 2.114 . 0 0 "[ . 1 . 2]" 1
584 1 15 ALA HA 1 16 GLN HE21 . . 4.470 3.762 3.618 3.928 . 0 0 "[ . 1 . 2]" 1
585 1 15 ALA HA 1 16 GLN HG2 . . 4.220 3.888 3.740 3.981 . 0 0 "[ . 1 . 2]" 1
586 1 15 ALA HA 1 17 HIS H . . 3.840 3.439 3.310 3.545 . 0 0 "[ . 1 . 2]" 1
587 1 15 ALA HA 1 29 LEU MD1 . . 5.500 3.592 3.418 3.714 . 0 0 "[ . 1 . 2]" 1
588 1 15 ALA HA 1 29 LEU QD . . 4.260 3.516 3.356 3.631 . 0 0 "[ . 1 . 2]" 1
589 1 15 ALA HA 1 29 LEU MD2 . . 5.500 5.010 4.731 5.212 . 0 0 "[ . 1 . 2]" 1
590 1 15 ALA HA 1 35 VAL QG . . 5.020 4.571 4.457 4.630 . 0 0 "[ . 1 . 2]" 1
591 1 15 ALA HA 1 76 PHE HB3 . . 4.600 4.218 4.129 4.294 . 0 0 "[ . 1 . 2]" 1
592 1 15 ALA HA 1 77 THR HA . . 3.060 2.196 2.147 2.260 . 0 0 "[ . 1 . 2]" 1
593 1 15 ALA HA 1 77 THR HB . . 4.000 3.413 3.326 3.557 . 0 0 "[ . 1 . 2]" 1
594 1 15 ALA HA 1 77 THR MG . . 2.930 2.028 2.008 2.050 . 0 0 "[ . 1 . 2]" 1
595 1 15 ALA HA 1 78 GLU H . . 4.100 4.041 3.939 4.118 0.018 2 0 "[ . 1 . 2]" 1
596 1 15 ALA MB 1 16 GLN H . . 3.530 3.195 3.091 3.291 . 0 0 "[ . 1 . 2]" 1
597 1 15 ALA MB 1 17 HIS H . . 3.440 3.050 2.852 3.286 . 0 0 "[ . 1 . 2]" 1
598 1 15 ALA MB 1 18 ASP H . . 5.500 5.226 4.910 5.422 . 0 0 "[ . 1 . 2]" 1
599 1 15 ALA MB 1 19 TYR H . . 4.740 4.714 4.550 4.764 0.024 4 0 "[ . 1 . 2]" 1
600 1 15 ALA MB 1 19 TYR HB3 . . 4.970 4.990 4.902 5.013 0.043 4 0 "[ . 1 . 2]" 1
601 1 15 ALA MB 1 29 LEU HA . . 4.420 4.092 3.963 4.234 . 0 0 "[ . 1 . 2]" 1
602 1 15 ALA MB 1 29 LEU HB2 . . 3.830 3.497 3.404 3.604 . 0 0 "[ . 1 . 2]" 1
603 1 15 ALA MB 1 29 LEU HB3 . . 3.210 2.349 2.270 2.454 . 0 0 "[ . 1 . 2]" 1
604 1 15 ALA MB 1 29 LEU MD1 . . 3.680 2.419 2.333 2.561 . 0 0 "[ . 1 . 2]" 1
605 1 15 ALA MB 1 29 LEU QD . . 2.870 2.322 2.256 2.446 . 0 0 "[ . 1 . 2]" 1
606 1 15 ALA MB 1 29 LEU MD2 . . 3.680 3.009 2.755 3.165 . 0 0 "[ . 1 . 2]" 1
607 1 15 ALA MB 1 30 LYS H . . 4.240 3.568 3.368 3.769 . 0 0 "[ . 1 . 2]" 1
608 1 15 ALA MB 1 30 LYS HA . . 4.290 4.329 4.299 4.364 0.074 8 0 "[ . 1 . 2]" 1
609 1 15 ALA MB 1 31 ALA H . . 4.180 4.113 3.941 4.209 0.029 2 0 "[ . 1 . 2]" 1
610 1 15 ALA MB 1 31 ALA HA . . 3.150 2.600 2.349 2.803 . 0 0 "[ . 1 . 2]" 1
611 1 15 ALA MB 1 32 GLY H . . 3.340 2.260 2.131 2.441 . 0 0 "[ . 1 . 2]" 1
612 1 15 ALA MB 1 32 GLY HA2 . . 4.490 4.059 3.857 4.325 . 0 0 "[ . 1 . 2]" 1
613 1 15 ALA MB 1 33 ASP H . . 3.220 1.939 1.827 2.056 . 0 0 "[ . 1 . 2]" 1
614 1 15 ALA MB 1 33 ASP HB2 . . 3.440 2.485 2.382 2.604 . 0 0 "[ . 1 . 2]" 1
615 1 15 ALA MB 1 33 ASP HB3 . . 3.720 3.718 3.515 3.754 0.034 5 0 "[ . 1 . 2]" 1
616 1 15 ALA MB 1 35 VAL QG . . 3.900 3.372 3.276 3.441 . 0 0 "[ . 1 . 2]" 1
617 1 15 ALA MB 1 76 PHE HB2 . . 5.360 4.985 4.754 5.188 . 0 0 "[ . 1 . 2]" 1
618 1 15 ALA MB 1 76 PHE HB3 . . 4.800 3.953 3.833 4.101 . 0 0 "[ . 1 . 2]" 1
619 1 15 ALA MB 1 77 THR H . . 5.500 5.468 5.390 5.517 0.017 7 0 "[ . 1 . 2]" 1
620 1 15 ALA MB 1 77 THR HA . . 4.130 3.916 3.858 3.969 . 0 0 "[ . 1 . 2]" 1
621 1 15 ALA MB 1 77 THR HB . . 4.750 4.447 4.359 4.559 . 0 0 "[ . 1 . 2]" 1
622 1 15 ALA MB 1 77 THR MG . . 3.190 2.458 2.375 2.553 . 0 0 "[ . 1 . 2]" 1
623 1 15 ALA MB 1 78 GLU H . . 5.500 5.261 5.186 5.330 . 0 0 "[ . 1 . 2]" 1
624 1 16 GLN H 1 16 GLN HB2 . . 3.480 2.521 2.466 2.598 . 0 0 "[ . 1 . 2]" 1
625 1 16 GLN H 1 16 GLN HB3 . . 3.810 3.635 3.599 3.680 . 0 0 "[ . 1 . 2]" 1
626 1 16 GLN H 1 16 GLN HE21 . . 4.590 3.206 3.091 3.489 . 0 0 "[ . 1 . 2]" 1
627 1 16 GLN H 1 16 GLN HG2 . . 3.680 2.489 2.359 2.613 . 0 0 "[ . 1 . 2]" 1
628 1 16 GLN H 1 16 GLN HG3 . . 3.950 3.873 3.758 3.964 0.014 11 0 "[ . 1 . 2]" 1
629 1 16 GLN H 1 17 HIS H . . 2.750 2.178 2.046 2.313 . 0 0 "[ . 1 . 2]" 1
630 1 16 GLN H 1 17 HIS HD2 . . 4.630 4.335 3.926 4.618 . 0 0 "[ . 1 . 2]" 1
631 1 16 GLN H 1 32 GLY H . . 5.050 4.621 4.349 4.842 . 0 0 "[ . 1 . 2]" 1
632 1 16 GLN H 1 77 THR HA . . 3.290 2.291 2.142 2.410 . 0 0 "[ . 1 . 2]" 1
633 1 16 GLN H 1 77 THR HB . . 4.610 4.566 4.381 4.641 0.031 4 0 "[ . 1 . 2]" 1
634 1 16 GLN H 1 77 THR MG . . 3.670 3.511 3.416 3.620 . 0 0 "[ . 1 . 2]" 1
635 1 16 GLN H 1 78 GLU H . . 4.630 4.354 4.105 4.565 . 0 0 "[ . 1 . 2]" 1
636 1 16 GLN HA 1 16 GLN HE21 . . 4.600 3.172 3.006 3.343 . 0 0 "[ . 1 . 2]" 1
637 1 16 GLN HA 1 16 GLN HG2 . . 3.530 3.377 3.318 3.435 . 0 0 "[ . 1 . 2]" 1
638 1 16 GLN HA 1 16 GLN HG3 . . 3.910 3.836 3.779 3.879 . 0 0 "[ . 1 . 2]" 1
639 1 16 GLN HA 1 17 HIS HD2 . . 5.360 4.962 4.671 5.243 . 0 0 "[ . 1 . 2]" 1
640 1 16 GLN HA 1 31 ALA HA . . 4.650 4.179 3.920 4.439 . 0 0 "[ . 1 . 2]" 1
641 1 16 GLN HA 1 31 ALA MB . . 4.680 3.992 3.560 4.293 . 0 0 "[ . 1 . 2]" 1
642 1 16 GLN HA 1 32 GLY H . . 4.270 4.126 3.761 4.289 0.019 19 0 "[ . 1 . 2]" 1
643 1 16 GLN HA 1 77 THR HA . . 4.940 4.772 4.670 4.850 . 0 0 "[ . 1 . 2]" 1
644 1 16 GLN HB2 1 17 HIS H . . 3.570 2.978 2.655 3.257 . 0 0 "[ . 1 . 2]" 1
645 1 16 GLN HB2 1 17 HIS HB2 . . 4.870 3.980 3.700 4.327 . 0 0 "[ . 1 . 2]" 1
646 1 16 GLN HB2 1 17 HIS HB3 . . 5.500 5.312 5.097 5.518 0.018 4 0 "[ . 1 . 2]" 1
647 1 16 GLN HB2 1 17 HIS HD2 . . 3.490 2.451 2.296 2.675 . 0 0 "[ . 1 . 2]" 1
648 1 16 GLN HB2 1 76 PHE HB3 . . 5.110 5.113 4.956 5.136 0.026 3 0 "[ . 1 . 2]" 1
649 1 16 GLN HB2 1 77 THR HA . . 4.380 3.933 3.702 4.072 . 0 0 "[ . 1 . 2]" 1
650 1 16 GLN HB3 1 16 GLN HE21 . . 4.110 4.156 4.113 4.196 0.086 11 0 "[ . 1 . 2]" 1
651 1 16 GLN HB3 1 16 GLN HE22 . . 5.100 4.585 4.478 4.654 . 0 0 "[ . 1 . 2]" 1
652 1 16 GLN HB3 1 17 HIS H . . 4.480 4.024 3.747 4.183 . 0 0 "[ . 1 . 2]" 1
653 1 16 GLN HB3 1 17 HIS HB2 . . 5.500 5.164 4.932 5.429 . 0 0 "[ . 1 . 2]" 1
654 1 16 GLN HB3 1 17 HIS HD2 . . 3.760 3.426 2.990 3.682 . 0 0 "[ . 1 . 2]" 1
655 1 16 GLN HE21 1 16 GLN HG2 . . 3.540 2.259 2.157 2.354 . 0 0 "[ . 1 . 2]" 1
656 1 16 GLN HE21 1 77 THR HB . . 5.080 4.512 4.407 4.618 . 0 0 "[ . 1 . 2]" 1
657 1 16 GLN HE21 1 78 GLU H . . 4.100 2.980 2.794 3.152 . 0 0 "[ . 1 . 2]" 1
658 1 16 GLN HE21 1 78 GLU HB2 . . 5.110 4.832 4.640 5.032 . 0 0 "[ . 1 . 2]" 1
659 1 16 GLN HE21 1 78 GLU HB3 . . 4.510 3.389 3.175 3.653 . 0 0 "[ . 1 . 2]" 1
660 1 16 GLN HE21 1 78 GLU QG . . 4.710 2.617 2.484 2.743 . 0 0 "[ . 1 . 2]" 1
661 1 16 GLN HE22 1 16 GLN HG2 . . 4.050 3.530 3.482 3.579 . 0 0 "[ . 1 . 2]" 1
662 1 16 GLN HE22 1 78 GLU H . . 4.900 4.235 4.124 4.391 . 0 0 "[ . 1 . 2]" 1
663 1 16 GLN HE22 1 78 GLU HB2 . . 4.860 4.878 4.674 4.917 0.057 14 0 "[ . 1 . 2]" 1
664 1 16 GLN HE22 1 78 GLU HB3 . . 4.700 3.735 3.535 3.815 . 0 0 "[ . 1 . 2]" 1
665 1 16 GLN HG2 1 17 HIS H . . 4.490 4.326 4.131 4.494 0.004 4 0 "[ . 1 . 2]" 1
666 1 16 GLN HG2 1 17 HIS HD2 . . 5.100 4.753 4.419 4.949 . 0 0 "[ . 1 . 2]" 1
667 1 16 GLN HG2 1 77 THR HA . . 3.580 2.519 2.314 2.593 . 0 0 "[ . 1 . 2]" 1
668 1 16 GLN HG2 1 78 GLU H . . 3.920 3.302 2.975 3.528 . 0 0 "[ . 1 . 2]" 1
669 1 16 GLN HG3 1 17 HIS HD2 . . 4.630 4.467 4.267 4.637 0.007 4 0 "[ . 1 . 2]" 1
670 1 16 GLN HG3 1 77 THR HA . . 4.240 4.182 3.950 4.266 0.026 18 0 "[ . 1 . 2]" 1
671 1 16 GLN HG3 1 78 GLU H . . 4.930 4.666 4.328 4.892 . 0 0 "[ . 1 . 2]" 1
672 1 17 HIS H 1 17 HIS HB2 . . 3.430 2.700 2.547 2.826 . 0 0 "[ . 1 . 2]" 1
673 1 17 HIS H 1 17 HIS HB3 . . 3.890 3.805 3.685 3.879 . 0 0 "[ . 1 . 2]" 1
674 1 17 HIS H 1 17 HIS HD2 . . 4.050 3.596 3.204 3.838 . 0 0 "[ . 1 . 2]" 1
675 1 17 HIS H 1 18 ASP H . . 4.630 4.441 4.394 4.487 . 0 0 "[ . 1 . 2]" 1
676 1 17 HIS H 1 29 LEU QD . . 5.440 5.056 4.907 5.151 . 0 0 "[ . 1 . 2]" 1
677 1 17 HIS H 1 31 ALA HA . . 3.770 3.465 3.231 3.782 0.012 18 0 "[ . 1 . 2]" 1
678 1 17 HIS H 1 31 ALA MB . . 4.330 3.835 3.658 4.098 . 0 0 "[ . 1 . 2]" 1
679 1 17 HIS H 1 32 GLY H . . 4.980 4.617 4.251 4.979 . 0 0 "[ . 1 . 2]" 1
680 1 17 HIS H 1 76 PHE HB2 . . 5.500 5.217 5.025 5.509 0.009 5 0 "[ . 1 . 2]" 1
681 1 17 HIS H 1 76 PHE HB3 . . 4.580 3.559 3.403 3.854 . 0 0 "[ . 1 . 2]" 1
682 1 17 HIS H 1 77 THR HA . . 4.670 4.278 4.038 4.426 . 0 0 "[ . 1 . 2]" 1
683 1 17 HIS H 1 77 THR MG . . 4.640 4.484 4.288 4.641 0.001 14 0 "[ . 1 . 2]" 1
684 1 17 HIS HA 1 17 HIS HD2 . . 4.620 4.325 4.084 4.561 . 0 0 "[ . 1 . 2]" 1
685 1 17 HIS HA 1 18 ASP H . . 2.900 2.428 2.312 2.575 . 0 0 "[ . 1 . 2]" 1
686 1 17 HIS HA 1 31 ALA H . . 4.510 4.426 4.182 4.538 0.028 19 0 "[ . 1 . 2]" 1
687 1 17 HIS HA 1 31 ALA MB . . 3.130 2.336 2.184 2.583 . 0 0 "[ . 1 . 2]" 1
688 1 17 HIS HB2 1 17 HIS HD2 . . 3.900 2.665 2.617 2.743 . 0 0 "[ . 1 . 2]" 1
689 1 17 HIS HB2 1 18 ASP H . . 4.300 3.725 3.400 3.879 . 0 0 "[ . 1 . 2]" 1
690 1 17 HIS HB2 1 76 PHE HA . . 4.510 3.237 2.812 3.707 . 0 0 "[ . 1 . 2]" 1
691 1 17 HIS HB2 1 76 PHE HB3 . . 4.470 3.426 3.093 3.724 . 0 0 "[ . 1 . 2]" 1
692 1 17 HIS HB2 1 76 PHE QD . . 3.550 2.481 2.246 2.940 . 0 0 "[ . 1 . 2]" 1
693 1 17 HIS HB2 2 3 VAL HB . . 5.500 4.901 4.184 5.508 0.008 18 0 "[ . 1 . 2]" 1
694 1 17 HIS HB2 2 3 VAL QG . . 5.340 4.945 4.182 5.524 0.184 18 0 "[ . 1 . 2]" 1
695 1 17 HIS HB2 2 4 PRO HG2 . . 4.830 3.275 3.009 3.587 . 0 0 "[ . 1 . 2]" 1
696 1 17 HIS HB2 2 4 PRO QG . . 4.100 2.898 2.560 3.288 . 0 0 "[ . 1 . 2]" 1
697 1 17 HIS HB2 2 4 PRO HG3 . . 4.830 3.243 2.754 3.819 . 0 0 "[ . 1 . 2]" 1
698 1 17 HIS HB3 1 18 ASP H . . 3.500 2.526 2.364 2.666 . 0 0 "[ . 1 . 2]" 1
699 1 17 HIS HB3 1 18 ASP HA . . 4.870 4.800 4.666 4.890 0.020 1 0 "[ . 1 . 2]" 1
700 1 17 HIS HB3 1 31 ALA MB . . 5.010 4.352 4.187 4.682 . 0 0 "[ . 1 . 2]" 1
701 1 17 HIS HB3 1 76 PHE QD . . 3.660 3.141 2.620 3.548 . 0 0 "[ . 1 . 2]" 1
702 1 17 HIS HB3 2 3 VAL HB . . 5.500 4.022 2.934 5.001 . 0 0 "[ . 1 . 2]" 1
703 1 17 HIS HB3 2 3 VAL QG . . 4.590 4.070 2.987 5.020 0.430 18 0 "[ . 1 . 2]" 1
704 1 17 HIS HB3 2 4 PRO HD2 . . 4.580 3.395 2.832 4.032 . 0 0 "[ . 1 . 2]" 1
705 1 17 HIS HB3 2 4 PRO HG2 . . 5.330 3.963 3.579 4.428 . 0 0 "[ . 1 . 2]" 1
706 1 17 HIS HB3 2 4 PRO HG3 . . 5.330 4.398 3.958 4.897 . 0 0 "[ . 1 . 2]" 1
707 1 17 HIS HD2 1 76 PHE HA . . 3.700 3.311 2.705 3.727 0.027 13 0 "[ . 1 . 2]" 1
708 1 17 HIS HD2 1 76 PHE HB3 . . 5.320 4.942 4.308 5.321 0.001 15 0 "[ . 1 . 2]" 1
709 1 17 HIS HD2 1 76 PHE QD . . 5.180 4.707 4.326 5.192 0.012 10 0 "[ . 1 . 2]" 1
710 1 17 HIS HD2 2 3 VAL HA . . 5.500 4.814 4.221 5.495 . 0 0 "[ . 1 . 2]" 1
711 1 17 HIS HD2 2 3 VAL QG . . 5.120 5.175 4.779 5.937 0.817 1 2 "[+ . 1- . 2]" 1
712 1 17 HIS HD2 2 4 PRO HB3 . . 5.110 4.555 4.292 4.824 . 0 0 "[ . 1 . 2]" 1
713 1 17 HIS HD2 2 4 PRO HD2 . . 4.170 3.434 3.160 4.030 . 0 0 "[ . 1 . 2]" 1
714 1 17 HIS HD2 2 4 PRO HD3 . . 4.830 3.087 2.625 3.418 . 0 0 "[ . 1 . 2]" 1
715 1 17 HIS HD2 2 4 PRO HG2 . . 4.490 3.824 3.563 4.258 . 0 0 "[ . 1 . 2]" 1
716 1 17 HIS HD2 2 4 PRO QG . . 3.820 2.521 2.267 2.747 . 0 0 "[ . 1 . 2]" 1
717 1 17 HIS HD2 2 4 PRO HG3 . . 4.490 2.558 2.293 2.782 . 0 0 "[ . 1 . 2]" 1
718 1 17 HIS HE1 2 3 VAL HA . . 4.500 3.591 2.778 4.303 . 0 0 "[ . 1 . 2]" 1
719 1 17 HIS HE1 2 3 VAL QG . . 4.290 3.170 2.407 4.508 0.218 1 0 "[ . 1 . 2]" 1
720 1 17 HIS HE1 2 4 PRO HD2 . . 5.130 4.293 3.794 4.763 . 0 0 "[ . 1 . 2]" 1
721 1 17 HIS HE1 2 4 PRO HD3 . . 4.780 4.237 3.597 4.785 0.005 13 0 "[ . 1 . 2]" 1
722 1 18 ASP H 1 18 ASP HB2 . . 3.770 3.327 2.489 3.788 0.018 9 0 "[ . 1 . 2]" 1
723 1 18 ASP H 1 18 ASP QB . . 3.040 2.734 2.154 3.045 0.005 10 0 "[ . 1 . 2]" 1
724 1 18 ASP H 1 18 ASP HB3 . . 3.770 3.129 2.199 3.717 . 0 0 "[ . 1 . 2]" 1
725 1 18 ASP H 1 19 TYR HB2 . . 5.500 5.523 5.427 5.559 0.059 12 0 "[ . 1 . 2]" 1
726 1 18 ASP H 1 31 ALA H . . 4.090 3.925 3.606 4.092 0.002 19 0 "[ . 1 . 2]" 1
727 1 18 ASP H 1 31 ALA MB . . 3.580 2.975 2.582 3.241 . 0 0 "[ . 1 . 2]" 1
728 1 18 ASP HA 1 19 TYR H . . 2.820 2.185 2.101 2.272 . 0 0 "[ . 1 . 2]" 1
729 1 18 ASP HA 1 19 TYR HB2 . . 4.990 4.475 4.251 4.775 . 0 0 "[ . 1 . 2]" 1
730 1 18 ASP HA 1 19 TYR HB3 . . 4.890 4.466 4.276 4.749 . 0 0 "[ . 1 . 2]" 1
731 1 18 ASP HA 1 29 LEU HB2 . . 5.210 3.977 3.543 4.304 . 0 0 "[ . 1 . 2]" 1
732 1 18 ASP HA 1 29 LEU HB3 . . 5.500 4.245 3.759 4.681 . 0 0 "[ . 1 . 2]" 1
733 1 18 ASP HA 1 30 LYS HA . . 3.070 2.509 2.111 2.770 . 0 0 "[ . 1 . 2]" 1
734 1 18 ASP HA 1 30 LYS HB2 . . 5.500 4.963 4.662 5.220 . 0 0 "[ . 1 . 2]" 1
735 1 18 ASP HA 1 30 LYS HB3 . . 5.500 5.387 5.021 5.544 0.044 2 0 "[ . 1 . 2]" 1
736 1 18 ASP HA 1 31 ALA H . . 3.380 2.880 2.647 3.090 . 0 0 "[ . 1 . 2]" 1
737 1 18 ASP QB 1 19 TYR H . . 3.700 3.000 2.744 3.723 0.023 16 0 "[ . 1 . 2]" 1
738 1 18 ASP QB 1 30 LYS QD . . 4.370 3.820 2.504 4.392 0.022 2 0 "[ . 1 . 2]" 1
739 1 18 ASP QB 1 31 ALA H . . 4.380 2.595 1.951 3.802 . 0 0 "[ . 1 . 2]" 1
740 1 18 ASP QB 1 31 ALA MB . . 4.190 3.395 2.689 4.211 0.021 13 0 "[ . 1 . 2]" 1
741 1 18 ASP HB2 1 19 TYR H . . 4.580 3.350 2.803 4.095 . 0 0 "[ . 1 . 2]" 1
742 1 18 ASP HB2 1 31 ALA MB . . 4.780 4.439 3.102 4.804 0.024 11 0 "[ . 1 . 2]" 1
743 1 18 ASP HB3 1 19 TYR H . . 4.580 3.707 2.851 4.447 . 0 0 "[ . 1 . 2]" 1
744 1 18 ASP HB3 1 31 ALA MB . . 4.780 3.654 2.726 4.803 0.023 5 0 "[ . 1 . 2]" 1
745 1 19 TYR H 1 19 TYR HB2 . . 3.810 3.264 3.154 3.345 . 0 0 "[ . 1 . 2]" 1
746 1 19 TYR H 1 19 TYR HB3 . . 3.980 2.760 2.648 2.844 . 0 0 "[ . 1 . 2]" 1
747 1 19 TYR H 1 20 THR H . . 4.740 4.190 4.015 4.346 . 0 0 "[ . 1 . 2]" 1
748 1 19 TYR H 1 29 LEU HB2 . . 3.820 2.881 2.651 3.117 . 0 0 "[ . 1 . 2]" 1
749 1 19 TYR H 1 29 LEU HB3 . . 4.380 3.936 3.756 4.150 . 0 0 "[ . 1 . 2]" 1
750 1 19 TYR H 1 29 LEU QD . . 4.940 4.381 4.190 4.548 . 0 0 "[ . 1 . 2]" 1
751 1 19 TYR H 1 30 LYS HA . . 4.020 3.497 3.216 3.800 . 0 0 "[ . 1 . 2]" 1
752 1 19 TYR H 1 76 PHE QD . . 5.500 4.367 4.211 4.606 . 0 0 "[ . 1 . 2]" 1
753 1 19 TYR HA 1 19 TYR QD . . 4.550 2.682 2.549 2.877 . 0 0 "[ . 1 . 2]" 1
754 1 19 TYR HA 1 20 THR H . . 2.910 2.117 2.072 2.190 . 0 0 "[ . 1 . 2]" 1
755 1 19 TYR HA 1 76 PHE QD . . 4.870 4.088 3.776 4.523 . 0 0 "[ . 1 . 2]" 1
756 1 19 TYR HB2 1 20 THR H . . 4.380 4.306 4.112 4.389 0.009 16 0 "[ . 1 . 2]" 1
757 1 19 TYR HB2 1 29 LEU HB2 . . 3.700 3.495 3.422 3.628 . 0 0 "[ . 1 . 2]" 1
758 1 19 TYR HB2 1 29 LEU HB3 . . 4.950 4.988 4.967 5.007 0.057 1 0 "[ . 1 . 2]" 1
759 1 19 TYR HB2 1 73 PRO HG2 . . 4.890 3.790 3.534 4.127 . 0 0 "[ . 1 . 2]" 1
760 1 19 TYR HB2 1 73 PRO HG3 . . 4.930 4.198 4.004 4.515 . 0 0 "[ . 1 . 2]" 1
761 1 19 TYR HB2 1 76 PHE HB2 . . 4.370 3.789 3.490 4.168 . 0 0 "[ . 1 . 2]" 1
762 1 19 TYR HB2 1 76 PHE QD . . 3.800 2.621 2.480 2.789 . 0 0 "[ . 1 . 2]" 1
763 1 19 TYR HB3 1 20 THR H . . 4.400 4.369 4.254 4.433 0.033 3 0 "[ . 1 . 2]" 1
764 1 19 TYR HB3 1 29 LEU H . . 3.800 3.014 2.764 3.301 . 0 0 "[ . 1 . 2]" 1
765 1 19 TYR HB3 1 29 LEU HA . . 5.040 4.895 4.793 5.006 . 0 0 "[ . 1 . 2]" 1
766 1 19 TYR HB3 1 29 LEU HB2 . . 3.700 2.208 2.103 2.263 . 0 0 "[ . 1 . 2]" 1
767 1 19 TYR HB3 1 29 LEU HB3 . . 3.990 3.917 3.775 4.003 0.013 4 0 "[ . 1 . 2]" 1
768 1 19 TYR HB3 1 29 LEU QD . . 3.620 3.051 2.868 3.291 . 0 0 "[ . 1 . 2]" 1
769 1 19 TYR HB3 1 29 LEU HG . . 4.490 3.445 3.248 3.781 . 0 0 "[ . 1 . 2]" 1
770 1 19 TYR HB3 1 76 PHE HB3 . . 5.270 4.307 3.993 4.572 . 0 0 "[ . 1 . 2]" 1
771 1 19 TYR HB3 1 76 PHE QD . . 4.530 3.974 3.847 4.085 . 0 0 "[ . 1 . 2]" 1
772 1 19 TYR QD 1 20 THR H . . 4.180 3.601 3.208 3.807 . 0 0 "[ . 1 . 2]" 1
773 1 19 TYR QD 1 21 ALA MB . . 5.500 4.015 3.386 4.670 . 0 0 "[ . 1 . 2]" 1
774 1 19 TYR QD 1 27 LEU HB3 . . 5.500 4.620 4.201 4.834 . 0 0 "[ . 1 . 2]" 1
775 1 19 TYR QD 1 29 LEU H . . 4.240 3.177 3.020 3.363 . 0 0 "[ . 1 . 2]" 1
776 1 19 TYR QD 1 29 LEU HB2 . . 5.010 3.763 3.320 4.034 . 0 0 "[ . 1 . 2]" 1
777 1 19 TYR QD 1 29 LEU MD1 . . 5.470 3.849 3.378 4.308 . 0 0 "[ . 1 . 2]" 1
778 1 19 TYR QD 1 29 LEU QD . . 3.980 3.704 3.272 4.083 0.103 4 0 "[ . 1 . 2]" 1
779 1 19 TYR QD 1 29 LEU MD2 . . 5.470 4.834 4.376 5.071 . 0 0 "[ . 1 . 2]" 1
780 1 19 TYR QD 1 29 LEU HG . . 4.550 3.396 2.798 3.772 . 0 0 "[ . 1 . 2]" 1
781 1 19 TYR QD 1 72 PHE HB3 . . 4.710 4.098 3.710 4.413 . 0 0 "[ . 1 . 2]" 1
782 1 19 TYR QD 1 73 PRO HD2 . . 4.720 3.389 3.187 3.683 . 0 0 "[ . 1 . 2]" 1
783 1 19 TYR QD 1 73 PRO HD3 . . 4.950 3.988 3.821 4.112 . 0 0 "[ . 1 . 2]" 1
784 1 19 TYR QD 1 73 PRO HG2 . . 4.850 3.829 3.637 4.007 . 0 0 "[ . 1 . 2]" 1
785 1 19 TYR QD 1 73 PRO HG3 . . 4.540 3.191 2.941 3.419 . 0 0 "[ . 1 . 2]" 1
786 1 19 TYR QD 1 76 PHE HB2 . . 5.310 4.823 4.617 5.082 . 0 0 "[ . 1 . 2]" 1
787 1 19 TYR QD 1 76 PHE QD . . 4.840 3.910 3.650 4.145 . 0 0 "[ . 1 . 2]" 1
788 1 19 TYR QD 1 76 PHE QE . . 5.000 3.264 2.976 3.637 . 0 0 "[ . 1 . 2]" 1
789 1 19 TYR QD 1 76 PHE HZ . . 5.080 3.355 2.941 3.840 . 0 0 "[ . 1 . 2]" 1
790 1 19 TYR QD 2 6 ALA MB . . 5.500 3.608 3.264 3.883 . 0 0 "[ . 1 . 2]" 1
791 1 19 TYR QE 1 20 THR H . . 4.690 4.482 4.007 4.704 0.014 14 0 "[ . 1 . 2]" 1
792 1 19 TYR QE 1 21 ALA HA . . 3.600 2.599 2.333 3.359 . 0 0 "[ . 1 . 2]" 1
793 1 19 TYR QE 1 22 THR H . . 4.540 3.868 3.377 4.310 . 0 0 "[ . 1 . 2]" 1
794 1 19 TYR QE 1 22 THR MG . . 4.460 4.121 3.392 4.466 0.006 20 0 "[ . 1 . 2]" 1
795 1 19 TYR QE 1 26 GLU HA . . 5.210 4.752 4.405 5.217 0.007 20 0 "[ . 1 . 2]" 1
796 1 19 TYR QE 1 26 GLU HB2 . . 5.310 4.319 3.984 4.855 . 0 0 "[ . 1 . 2]" 1
797 1 19 TYR QE 1 26 GLU HB3 . . 3.980 2.806 2.581 3.528 . 0 0 "[ . 1 . 2]" 1
798 1 19 TYR QE 1 26 GLU HG2 . . 5.120 3.892 3.412 4.542 . 0 0 "[ . 1 . 2]" 1
799 1 19 TYR QE 1 26 GLU QG . . 4.360 3.691 3.264 3.942 . 0 0 "[ . 1 . 2]" 1
800 1 19 TYR QE 1 26 GLU HG3 . . 5.120 4.820 3.517 5.143 0.023 19 0 "[ . 1 . 2]" 1
801 1 19 TYR QE 1 27 LEU H . . 4.670 3.903 3.419 4.382 . 0 0 "[ . 1 . 2]" 1
802 1 19 TYR QE 1 29 LEU QD . . 5.020 5.095 4.596 5.422 0.402 4 0 "[ . 1 . 2]" 1
803 1 19 TYR QE 1 50 TRP HH2 . . 4.350 3.505 3.347 3.739 . 0 0 "[ . 1 . 2]" 1
804 1 19 TYR QE 1 71 VAL MG2 . . 5.210 5.002 4.752 5.212 0.002 5 0 "[ . 1 . 2]" 1
805 1 19 TYR QE 1 72 PHE HB2 . . 5.250 4.838 4.030 5.253 0.003 4 0 "[ . 1 . 2]" 1
806 1 19 TYR QE 1 73 PRO HD2 . . 4.220 3.803 3.449 4.098 . 0 0 "[ . 1 . 2]" 1
807 1 19 TYR QE 1 73 PRO HD3 . . 3.980 3.468 3.220 3.697 . 0 0 "[ . 1 . 2]" 1
808 1 19 TYR QE 1 73 PRO HG2 . . 4.850 4.625 4.431 4.847 . 0 0 "[ . 1 . 2]" 1
809 1 19 TYR QE 1 73 PRO HG3 . . 4.570 3.306 3.124 3.546 . 0 0 "[ . 1 . 2]" 1
810 1 19 TYR QE 2 6 ALA MB . . 3.550 2.519 2.302 2.852 . 0 0 "[ . 1 . 2]" 1
811 1 20 THR H 1 20 THR HB . . 3.020 2.879 2.748 3.010 . 0 0 "[ . 1 . 2]" 1
812 1 20 THR H 1 20 THR MG . . 3.970 3.886 3.753 3.974 0.004 2 0 "[ . 1 . 2]" 1
813 1 20 THR H 1 29 LEU H . . 5.500 5.002 4.946 5.059 . 0 0 "[ . 1 . 2]" 1
814 1 20 THR HA 1 20 THR MG . . 2.980 2.227 2.153 2.279 . 0 0 "[ . 1 . 2]" 1
815 1 20 THR HA 1 21 ALA H . . 2.600 2.150 2.025 2.224 . 0 0 "[ . 1 . 2]" 1
816 1 20 THR HA 1 21 ALA MB . . 4.130 3.947 3.839 4.077 . 0 0 "[ . 1 . 2]" 1
817 1 20 THR HA 1 28 GLN HA . . 3.830 3.530 3.077 3.831 0.001 3 0 "[ . 1 . 2]" 1
818 1 20 THR HA 1 28 GLN QB . . 5.410 4.153 3.850 4.348 . 0 0 "[ . 1 . 2]" 1
819 1 20 THR HA 1 28 GLN QE . . 4.610 4.111 3.567 4.617 0.007 7 0 "[ . 1 . 2]" 1
820 1 20 THR HA 1 28 GLN HG2 . . 3.960 3.670 3.288 3.988 0.028 10 0 "[ . 1 . 2]" 1
821 1 20 THR HA 1 28 GLN QG . . 3.350 2.368 2.066 2.713 . 0 0 "[ . 1 . 2]" 1
822 1 20 THR HA 1 28 GLN HG3 . . 3.960 2.399 2.087 2.760 . 0 0 "[ . 1 . 2]" 1
823 1 20 THR HA 1 29 LEU H . . 4.580 3.958 3.674 4.088 . 0 0 "[ . 1 . 2]" 1
824 1 20 THR HB 1 21 ALA H . . 4.110 4.049 3.827 4.165 0.055 14 0 "[ . 1 . 2]" 1
825 1 20 THR MG 1 21 ALA H . . 3.120 2.734 2.408 3.005 . 0 0 "[ . 1 . 2]" 1
826 1 20 THR MG 1 21 ALA MB . . 4.050 3.787 3.580 3.991 . 0 0 "[ . 1 . 2]" 1
827 1 20 THR MG 1 22 THR H . . 5.370 5.137 4.821 5.373 0.003 5 0 "[ . 1 . 2]" 1
828 1 20 THR MG 1 28 GLN QB . . 4.540 4.355 3.991 4.551 0.011 13 0 "[ . 1 . 2]" 1
829 1 20 THR MG 1 28 GLN QE . . 3.920 3.197 2.734 3.831 . 0 0 "[ . 1 . 2]" 1
830 1 20 THR MG 1 28 GLN HG2 . . 4.560 4.243 3.756 4.567 0.007 17 0 "[ . 1 . 2]" 1
831 1 20 THR MG 1 28 GLN QG . . 3.930 2.972 2.432 3.416 . 0 0 "[ . 1 . 2]" 1
832 1 20 THR MG 1 28 GLN HG3 . . 4.560 3.038 2.463 3.557 . 0 0 "[ . 1 . 2]" 1
833 1 20 THR MG 1 29 LEU H . . 5.500 5.390 5.131 5.527 0.027 6 0 "[ . 1 . 2]" 1
834 1 21 ALA H 1 21 ALA MB . . 2.670 2.193 2.136 2.257 . 0 0 "[ . 1 . 2]" 1
835 1 21 ALA H 1 22 THR H . . 4.490 4.512 4.382 4.550 0.060 20 0 "[ . 1 . 2]" 1
836 1 21 ALA H 1 28 GLN HA . . 3.610 2.989 2.597 3.565 . 0 0 "[ . 1 . 2]" 1
837 1 21 ALA H 1 28 GLN QB . . 3.510 3.108 2.901 3.325 . 0 0 "[ . 1 . 2]" 1
838 1 21 ALA H 1 28 GLN QE . . 4.090 3.557 3.082 4.016 . 0 0 "[ . 1 . 2]" 1
839 1 21 ALA H 1 28 GLN HG2 . . 4.230 4.128 3.679 4.263 0.033 5 0 "[ . 1 . 2]" 1
840 1 21 ALA H 1 28 GLN HG3 . . 4.230 2.548 2.153 2.759 . 0 0 "[ . 1 . 2]" 1
841 1 21 ALA HA 1 22 THR H . . 2.930 2.078 2.037 2.115 . 0 0 "[ . 1 . 2]" 1
842 1 21 ALA HA 1 22 THR MG . . 3.770 3.717 3.399 3.814 0.044 16 0 "[ . 1 . 2]" 1
843 1 21 ALA HA 1 23 ASP H . . 3.790 3.745 3.557 3.838 0.048 3 0 "[ . 1 . 2]" 1
844 1 21 ALA HA 1 26 GLU HB2 . . 3.990 3.381 2.980 3.800 . 0 0 "[ . 1 . 2]" 1
845 1 21 ALA HA 1 26 GLU HB3 . . 3.930 2.768 2.413 3.323 . 0 0 "[ . 1 . 2]" 1
846 1 21 ALA HA 1 26 GLU QG . . 5.340 4.232 3.465 4.567 . 0 0 "[ . 1 . 2]" 1
847 1 21 ALA HA 1 28 GLN QG . . 5.340 5.045 4.771 5.325 . 0 0 "[ . 1 . 2]" 1
848 1 21 ALA MB 1 22 THR H . . 3.460 3.065 2.779 3.414 . 0 0 "[ . 1 . 2]" 1
849 1 21 ALA MB 1 23 ASP H . . 3.350 3.106 2.689 3.362 0.012 20 0 "[ . 1 . 2]" 1
850 1 21 ALA MB 1 26 GLU H . . 4.030 3.769 3.526 4.038 0.008 7 0 "[ . 1 . 2]" 1
851 1 21 ALA MB 1 26 GLU HA . . 4.560 4.117 3.830 4.449 . 0 0 "[ . 1 . 2]" 1
852 1 21 ALA MB 1 26 GLU HB2 . . 3.380 2.397 2.192 2.844 . 0 0 "[ . 1 . 2]" 1
853 1 21 ALA MB 1 26 GLU HB3 . . 3.340 2.481 2.164 3.035 . 0 0 "[ . 1 . 2]" 1
854 1 21 ALA MB 1 28 GLN H . . 3.860 3.367 2.979 3.875 0.015 11 0 "[ . 1 . 2]" 1
855 1 21 ALA MB 1 28 GLN HA . . 3.530 2.903 2.546 3.298 . 0 0 "[ . 1 . 2]" 1
856 1 21 ALA MB 1 28 GLN QB . . 3.190 2.579 2.199 2.896 . 0 0 "[ . 1 . 2]" 1
857 1 21 ALA MB 1 28 GLN QE . . 3.750 3.570 3.229 3.781 0.031 4 0 "[ . 1 . 2]" 1
858 1 21 ALA MB 1 28 GLN QG . . 3.910 3.470 3.075 3.728 . 0 0 "[ . 1 . 2]" 1
859 1 21 ALA MB 1 29 LEU H . . 5.300 4.761 4.267 5.231 . 0 0 "[ . 1 . 2]" 1
860 1 22 THR H 1 22 THR HB . . 4.040 3.062 2.548 3.788 . 0 0 "[ . 1 . 2]" 1
861 1 22 THR H 1 22 THR MG . . 3.440 2.258 2.048 2.477 . 0 0 "[ . 1 . 2]" 1
862 1 22 THR H 1 23 ASP H . . 2.950 2.369 1.944 2.686 . 0 0 "[ . 1 . 2]" 1
863 1 22 THR H 1 26 GLU H . . 5.500 5.230 4.899 5.545 0.045 1 0 "[ . 1 . 2]" 1
864 1 22 THR H 1 26 GLU HB2 . . 4.240 3.140 2.774 3.424 . 0 0 "[ . 1 . 2]" 1
865 1 22 THR H 1 26 GLU HB3 . . 4.230 3.390 2.964 3.812 . 0 0 "[ . 1 . 2]" 1
866 1 22 THR HA 1 22 THR MG . . 3.290 3.107 2.577 3.269 . 0 0 "[ . 1 . 2]" 1
867 1 22 THR HA 1 23 ASP H . . 3.500 3.258 2.787 3.518 0.018 3 0 "[ . 1 . 2]" 1
868 1 22 THR MG 1 23 ASP H . . 4.200 3.333 2.481 4.172 . 0 0 "[ . 1 . 2]" 1
869 1 22 THR MG 1 50 TRP HH2 . . 5.350 4.585 3.869 5.357 0.007 15 0 "[ . 1 . 2]" 1
870 1 23 ASP H 1 23 ASP HB2 . . 3.970 2.844 2.423 3.298 . 0 0 "[ . 1 . 2]" 1
871 1 23 ASP H 1 23 ASP HB3 . . 3.740 3.380 2.681 3.772 0.032 19 0 "[ . 1 . 2]" 1
872 1 23 ASP H 1 24 THR H . . 4.580 4.450 4.265 4.627 0.047 3 0 "[ . 1 . 2]" 1
873 1 23 ASP H 1 26 GLU H . . 4.040 3.687 3.341 4.044 0.004 3 0 "[ . 1 . 2]" 1
874 1 23 ASP H 1 26 GLU HB2 . . 3.660 2.357 1.979 2.722 . 0 0 "[ . 1 . 2]" 1
875 1 23 ASP H 1 26 GLU HB3 . . 4.040 3.723 3.322 4.039 . 0 0 "[ . 1 . 2]" 1
876 1 23 ASP HA 1 24 THR H . . 2.910 2.350 2.202 2.503 . 0 0 "[ . 1 . 2]" 1
877 1 23 ASP HA 1 24 THR MG . . 4.610 4.439 4.080 4.656 0.046 1 0 "[ . 1 . 2]" 1
878 1 23 ASP HA 1 26 GLU HB2 . . 4.680 4.639 4.293 4.737 0.057 14 0 "[ . 1 . 2]" 1
879 1 23 ASP HB2 1 24 THR H . . 4.220 3.983 3.528 4.224 0.004 4 0 "[ . 1 . 2]" 1
880 1 23 ASP HB2 1 25 ASP H . . 4.130 3.923 3.075 4.144 0.014 2 0 "[ . 1 . 2]" 1
881 1 23 ASP HB2 1 26 GLU H . . 4.210 3.847 2.619 4.251 0.041 1 0 "[ . 1 . 2]" 1
882 1 23 ASP HB2 1 26 GLU QG . . 3.780 2.966 2.269 3.502 . 0 0 "[ . 1 . 2]" 1
883 1 23 ASP HB3 1 24 THR H . . 3.680 2.967 2.057 3.690 0.010 5 0 "[ . 1 . 2]" 1
884 1 23 ASP HB3 1 24 THR HA . . 4.740 4.722 4.593 4.777 0.037 4 0 "[ . 1 . 2]" 1
885 1 23 ASP HB3 1 24 THR MG . . 4.890 4.106 3.139 4.900 0.010 16 0 "[ . 1 . 2]" 1
886 1 23 ASP HB3 1 25 ASP H . . 4.500 2.714 2.152 3.416 . 0 0 "[ . 1 . 2]" 1
887 1 23 ASP HB3 1 26 GLU QG . . 4.460 3.256 2.221 4.508 0.048 1 0 "[ . 1 . 2]" 1
888 1 24 THR H 1 24 THR HB . . 3.800 2.406 2.256 2.637 . 0 0 "[ . 1 . 2]" 1
889 1 24 THR H 1 24 THR MG . . 2.980 2.440 2.265 2.665 . 0 0 "[ . 1 . 2]" 1
890 1 24 THR H 1 25 ASP H . . 3.160 2.800 2.458 3.160 . 0 0 "[ . 1 . 2]" 1
891 1 24 THR HA 1 24 THR HB . . 2.920 2.520 2.471 2.606 . 0 0 "[ . 1 . 2]" 1
892 1 24 THR HA 1 24 THR MG . . 3.270 3.226 3.176 3.262 . 0 0 "[ . 1 . 2]" 1
893 1 24 THR HA 1 26 GLU H . . 4.290 3.931 3.616 4.252 . 0 0 "[ . 1 . 2]" 1
894 1 24 THR MG 1 25 ASP H . . 4.160 2.728 2.419 3.218 . 0 0 "[ . 1 . 2]" 1
895 1 24 THR MG 1 25 ASP HA . . 5.010 3.740 3.414 4.152 . 0 0 "[ . 1 . 2]" 1
896 1 24 THR MG 1 25 ASP QB . . 5.270 3.615 3.018 4.328 . 0 0 "[ . 1 . 2]" 1
897 1 24 THR MG 1 26 GLU H . . 5.320 4.673 4.414 4.853 . 0 0 "[ . 1 . 2]" 1
898 1 25 ASP H 1 25 ASP HB2 . . 3.880 2.609 2.264 3.883 0.003 1 0 "[ . 1 . 2]" 1
899 1 25 ASP H 1 25 ASP HB3 . . 3.880 3.320 2.445 3.783 . 0 0 "[ . 1 . 2]" 1
900 1 25 ASP H 1 26 GLU H . . 3.010 2.515 2.021 2.847 . 0 0 "[ . 1 . 2]" 1
901 1 25 ASP H 1 71 VAL MG2 . . 5.040 4.825 4.252 5.073 0.033 15 0 "[ . 1 . 2]" 1
902 1 25 ASP QB 1 71 VAL MG2 . . 3.890 3.008 2.343 3.652 . 0 0 "[ . 1 . 2]" 1
903 1 25 ASP HB2 1 71 VAL MG2 . . 4.690 3.789 2.912 4.540 . 0 0 "[ . 1 . 2]" 1
904 1 25 ASP HB3 1 71 VAL MG2 . . 4.690 3.343 2.421 4.696 0.006 19 0 "[ . 1 . 2]" 1
905 1 26 GLU H 1 26 GLU HB2 . . 3.080 2.229 2.160 2.294 . 0 0 "[ . 1 . 2]" 1
906 1 26 GLU H 1 26 GLU HB3 . . 3.450 3.495 3.436 3.519 0.069 12 0 "[ . 1 . 2]" 1
907 1 26 GLU H 1 27 LEU H . . 4.710 4.598 4.560 4.647 . 0 0 "[ . 1 . 2]" 1
908 1 26 GLU H 1 71 VAL MG2 . . 4.060 3.847 3.526 4.071 0.011 10 0 "[ . 1 . 2]" 1
909 1 26 GLU HA 1 26 GLU HG2 . . 3.620 2.654 2.319 3.640 0.020 11 0 "[ . 1 . 2]" 1
910 1 26 GLU HA 1 26 GLU QG . . 3.110 2.293 2.221 2.469 . 0 0 "[ . 1 . 2]" 1
911 1 26 GLU HA 1 26 GLU HG3 . . 3.620 2.704 2.367 2.907 . 0 0 "[ . 1 . 2]" 1
912 1 26 GLU HA 1 27 LEU H . . 2.940 2.201 2.130 2.302 . 0 0 "[ . 1 . 2]" 1
913 1 26 GLU HA 1 27 LEU HB2 . . 4.910 4.008 3.904 4.090 . 0 0 "[ . 1 . 2]" 1
914 1 26 GLU HA 1 27 LEU HB3 . . 5.460 5.027 4.926 5.114 . 0 0 "[ . 1 . 2]" 1
915 1 26 GLU HA 1 70 GLY HA3 . . 4.160 3.673 3.319 3.978 . 0 0 "[ . 1 . 2]" 1
916 1 26 GLU HA 1 71 VAL H . . 3.140 2.345 2.205 2.498 . 0 0 "[ . 1 . 2]" 1
917 1 26 GLU HA 1 71 VAL HA . . 4.950 4.567 4.504 4.666 . 0 0 "[ . 1 . 2]" 1
918 1 26 GLU HA 1 71 VAL MG1 . . 4.430 4.155 3.991 4.336 . 0 0 "[ . 1 . 2]" 1
919 1 26 GLU HA 1 71 VAL MG2 . . 3.210 2.227 2.078 2.354 . 0 0 "[ . 1 . 2]" 1
920 1 26 GLU HB2 1 27 LEU H . . 4.520 4.065 3.934 4.280 . 0 0 "[ . 1 . 2]" 1
921 1 26 GLU HB2 1 71 VAL MG2 . . 4.310 4.232 4.044 4.324 0.014 19 0 "[ . 1 . 2]" 1
922 1 26 GLU HB3 1 27 LEU H . . 3.610 2.803 2.623 3.135 . 0 0 "[ . 1 . 2]" 1
923 1 26 GLU HB3 1 71 VAL MG2 . . 4.200 3.884 3.748 4.082 . 0 0 "[ . 1 . 2]" 1
924 1 26 GLU QG 1 27 LEU H . . 3.780 3.474 3.010 3.694 . 0 0 "[ . 1 . 2]" 1
925 1 26 GLU QG 1 50 TRP HE3 . . 4.560 4.112 3.751 4.375 . 0 0 "[ . 1 . 2]" 1
926 1 26 GLU QG 1 50 TRP HH2 . . 4.280 3.582 3.097 4.113 . 0 0 "[ . 1 . 2]" 1
927 1 26 GLU QG 1 50 TRP HZ3 . . 3.980 2.708 2.451 3.291 . 0 0 "[ . 1 . 2]" 1
928 1 26 GLU QG 1 71 VAL H . . 4.540 4.022 3.854 4.341 . 0 0 "[ . 1 . 2]" 1
929 1 26 GLU QG 1 71 VAL HA . . 5.340 5.317 5.170 5.386 0.046 1 0 "[ . 1 . 2]" 1
930 1 26 GLU QG 1 71 VAL MG1 . . 5.340 4.495 4.286 4.734 . 0 0 "[ . 1 . 2]" 1
931 1 26 GLU QG 1 71 VAL MG2 . . 3.000 2.120 2.056 2.220 . 0 0 "[ . 1 . 2]" 1
932 1 26 GLU HG2 1 50 TRP HZ3 . . 4.720 2.947 2.468 4.399 . 0 0 "[ . 1 . 2]" 1
933 1 26 GLU HG2 1 71 VAL MG2 . . 3.760 2.476 2.118 3.599 . 0 0 "[ . 1 . 2]" 1
934 1 26 GLU HG3 1 50 TRP HZ3 . . 4.720 4.099 2.660 4.646 . 0 0 "[ . 1 . 2]" 1
935 1 26 GLU HG3 1 71 VAL MG2 . . 3.760 2.656 2.072 2.996 . 0 0 "[ . 1 . 2]" 1
936 1 27 LEU H 1 27 LEU HB2 . . 3.600 2.327 2.205 2.396 . 0 0 "[ . 1 . 2]" 1
937 1 27 LEU H 1 27 LEU HB3 . . 3.330 2.899 2.848 2.974 . 0 0 "[ . 1 . 2]" 1
938 1 27 LEU H 1 27 LEU MD1 . . 5.160 4.331 4.237 4.386 . 0 0 "[ . 1 . 2]" 1
939 1 27 LEU H 1 27 LEU QD . . 4.400 3.857 3.817 3.879 . 0 0 "[ . 1 . 2]" 1
940 1 27 LEU H 1 27 LEU MD2 . . 5.160 4.328 4.290 4.376 . 0 0 "[ . 1 . 2]" 1
941 1 27 LEU H 1 27 LEU HG . . 4.490 4.269 4.136 4.332 . 0 0 "[ . 1 . 2]" 1
942 1 27 LEU H 1 28 GLN H . . 4.550 4.524 4.475 4.571 0.021 11 0 "[ . 1 . 2]" 1
943 1 27 LEU H 1 70 GLY HA3 . . 4.380 3.257 3.053 3.531 . 0 0 "[ . 1 . 2]" 1
944 1 27 LEU H 1 71 VAL MG2 . . 3.580 3.526 3.419 3.587 0.007 16 0 "[ . 1 . 2]" 1
945 1 27 LEU H 1 72 PHE H . . 5.070 4.643 4.519 4.799 . 0 0 "[ . 1 . 2]" 1
946 1 27 LEU H 1 72 PHE HB2 . . 5.460 5.000 4.879 5.125 . 0 0 "[ . 1 . 2]" 1
947 1 27 LEU H 1 72 PHE HB3 . . 4.540 3.540 3.433 3.670 . 0 0 "[ . 1 . 2]" 1
948 1 27 LEU HA 1 27 LEU MD1 . . 4.090 3.824 3.785 3.887 . 0 0 "[ . 1 . 2]" 1
949 1 27 LEU HA 1 27 LEU QD . . 2.890 2.184 2.101 2.328 . 0 0 "[ . 1 . 2]" 1
950 1 27 LEU HA 1 27 LEU MD2 . . 4.090 2.198 2.111 2.348 . 0 0 "[ . 1 . 2]" 1
951 1 27 LEU HA 1 27 LEU HG . . 3.480 2.706 2.580 2.834 . 0 0 "[ . 1 . 2]" 1
952 1 27 LEU HA 1 28 GLN H . . 2.820 2.242 2.158 2.371 . 0 0 "[ . 1 . 2]" 1
953 1 27 LEU HA 1 28 GLN QB . . 4.250 4.020 3.802 4.119 . 0 0 "[ . 1 . 2]" 1
954 1 27 LEU HA 1 29 LEU QD . . 5.440 4.868 4.771 5.103 . 0 0 "[ . 1 . 2]" 1
955 1 27 LEU HA 1 70 GLY HA3 . . 4.340 2.910 2.773 3.016 . 0 0 "[ . 1 . 2]" 1
956 1 27 LEU HB2 1 27 LEU MD1 . . 3.250 2.435 2.359 2.499 . 0 0 "[ . 1 . 2]" 1
957 1 27 LEU HB2 1 27 LEU MD2 . . 3.250 3.251 3.248 3.259 0.009 19 0 "[ . 1 . 2]" 1
958 1 27 LEU HB2 1 28 GLN H . . 4.550 4.466 4.189 4.554 0.004 7 0 "[ . 1 . 2]" 1
959 1 27 LEU HB2 1 70 GLY HA2 . . 4.900 3.964 3.924 4.025 . 0 0 "[ . 1 . 2]" 1
960 1 27 LEU HB2 1 70 GLY HA3 . . 4.550 2.537 2.497 2.589 . 0 0 "[ . 1 . 2]" 1
961 1 27 LEU HB2 1 72 PHE HB2 . . 5.500 4.886 4.676 5.010 . 0 0 "[ . 1 . 2]" 1
962 1 27 LEU HB2 1 72 PHE HB3 . . 4.130 3.145 2.934 3.270 . 0 0 "[ . 1 . 2]" 1
963 1 27 LEU HB3 1 27 LEU MD1 . . 3.520 2.264 2.220 2.307 . 0 0 "[ . 1 . 2]" 1
964 1 27 LEU HB3 1 27 LEU QD . . 2.840 2.133 2.117 2.156 . 0 0 "[ . 1 . 2]" 1
965 1 27 LEU HB3 1 27 LEU MD2 . . 3.520 2.610 2.523 2.684 . 0 0 "[ . 1 . 2]" 1
966 1 27 LEU HB3 1 28 GLN H . . 4.330 3.765 3.265 3.927 . 0 0 "[ . 1 . 2]" 1
967 1 27 LEU HB3 1 29 LEU H . . 5.500 5.409 5.093 5.510 0.010 7 0 "[ . 1 . 2]" 1
968 1 27 LEU HB3 1 29 LEU HG . . 5.020 3.351 3.091 3.506 . 0 0 "[ . 1 . 2]" 1
969 1 27 LEU HB3 1 70 GLY HA3 . . 4.050 4.068 4.025 4.087 0.037 11 0 "[ . 1 . 2]" 1
970 1 27 LEU HB3 1 71 VAL H . . 4.960 4.984 4.897 5.019 0.059 15 0 "[ . 1 . 2]" 1
971 1 27 LEU HB3 1 71 VAL HA . . 5.460 5.031 4.928 5.160 . 0 0 "[ . 1 . 2]" 1
972 1 27 LEU HB3 1 72 PHE HB2 . . 3.960 3.926 3.779 3.981 0.021 6 0 "[ . 1 . 2]" 1
973 1 27 LEU HB3 1 72 PHE HB3 . . 3.660 2.306 2.214 2.375 . 0 0 "[ . 1 . 2]" 1
974 1 27 LEU QD 1 28 GLN H . . 3.620 2.097 1.783 2.281 . 0 0 "[ . 1 . 2]" 1
975 1 27 LEU QD 1 28 GLN QB . . 4.160 3.425 3.294 3.549 . 0 0 "[ . 1 . 2]" 1
976 1 27 LEU QD 1 35 VAL HA . . 5.140 4.240 4.179 4.352 . 0 0 "[ . 1 . 2]" 1
977 1 27 LEU QD 1 35 VAL HB . . 4.340 3.964 3.942 3.985 . 0 0 "[ . 1 . 2]" 1
978 1 27 LEU QD 1 35 VAL QG . . 2.940 1.924 1.903 1.962 . 0 0 "[ . 1 . 2]" 1
979 1 27 LEU QD 1 52 MET HA . . 4.410 4.068 3.901 4.232 . 0 0 "[ . 1 . 2]" 1
980 1 27 LEU QD 1 53 GLY H . . 3.820 2.876 2.773 3.078 . 0 0 "[ . 1 . 2]" 1
981 1 27 LEU QD 1 53 GLY HA2 . . 4.500 4.270 4.157 4.391 . 0 0 "[ . 1 . 2]" 1
982 1 27 LEU QD 1 53 GLY HA3 . . 4.150 3.384 3.243 3.467 . 0 0 "[ . 1 . 2]" 1
983 1 27 LEU QD 1 54 VAL H . . 4.590 3.727 3.591 3.857 . 0 0 "[ . 1 . 2]" 1
984 1 27 LEU QD 1 54 VAL HA . . 3.370 2.495 2.381 2.617 . 0 0 "[ . 1 . 2]" 1
985 1 27 LEU QD 1 55 LYS H . . 3.520 2.661 2.587 2.869 . 0 0 "[ . 1 . 2]" 1
986 1 27 LEU QD 1 55 LYS HA . . 4.840 3.722 3.626 3.892 . 0 0 "[ . 1 . 2]" 1
987 1 27 LEU QD 1 55 LYS HB2 . . 4.910 3.377 3.173 3.610 . 0 0 "[ . 1 . 2]" 1
988 1 27 LEU QD 1 55 LYS HB3 . . 5.090 4.407 4.260 4.580 . 0 0 "[ . 1 . 2]" 1
989 1 27 LEU QD 1 55 LYS QD . . 4.230 3.420 3.228 3.575 . 0 0 "[ . 1 . 2]" 1
990 1 27 LEU QD 1 55 LYS QE . . 3.940 2.414 1.990 2.738 . 0 0 "[ . 1 . 2]" 1
991 1 27 LEU QD 1 55 LYS HG3 . . 3.080 2.381 2.204 2.563 . 0 0 "[ . 1 . 2]" 1
992 1 27 LEU QD 1 58 ASP QB . . 5.280 4.383 4.147 4.728 . 0 0 "[ . 1 . 2]" 1
993 1 27 LEU QD 1 69 ARG HA . . 3.600 3.392 3.231 3.528 . 0 0 "[ . 1 . 2]" 1
994 1 27 LEU QD 1 70 GLY H . . 3.580 2.935 2.793 3.101 . 0 0 "[ . 1 . 2]" 1
995 1 27 LEU QD 1 70 GLY HA3 . . 3.710 3.428 3.349 3.511 . 0 0 "[ . 1 . 2]" 1
996 1 27 LEU QD 1 71 VAL HA . . 4.560 4.251 4.047 4.427 . 0 0 "[ . 1 . 2]" 1
997 1 27 LEU QD 1 72 PHE H . . 4.480 4.444 4.335 4.598 0.118 6 0 "[ . 1 . 2]" 1
998 1 27 LEU QD 1 72 PHE HB2 . . 4.510 4.316 4.139 4.432 . 0 0 "[ . 1 . 2]" 1
999 1 27 LEU QD 1 72 PHE HB3 . . 3.550 3.254 3.112 3.385 . 0 0 "[ . 1 . 2]" 1
1000 1 27 LEU QD 1 72 PHE QD . . 4.230 2.160 2.098 2.223 . 0 0 "[ . 1 . 2]" 1
1001 1 27 LEU QD 1 72 PHE QE . . 4.190 2.764 2.728 2.857 . 0 0 "[ . 1 . 2]" 1
1002 1 27 LEU QD 1 72 PHE HZ . . 4.910 4.485 4.448 4.509 . 0 0 "[ . 1 . 2]" 1
1003 1 27 LEU MD1 1 28 GLN H . . 4.700 4.422 4.007 4.564 . 0 0 "[ . 1 . 2]" 1
1004 1 27 LEU MD1 1 28 GLN QB . . 5.500 5.535 5.514 5.556 0.056 2 0 "[ . 1 . 2]" 1
1005 1 27 LEU MD1 1 54 VAL HA . . 3.840 2.575 2.463 2.700 . 0 0 "[ . 1 . 2]" 1
1006 1 27 LEU MD1 1 55 LYS H . . 4.130 3.136 2.942 3.296 . 0 0 "[ . 1 . 2]" 1
1007 1 27 LEU MD1 1 55 LYS HG3 . . 3.780 3.137 2.826 3.377 . 0 0 "[ . 1 . 2]" 1
1008 1 27 LEU MD1 1 69 ARG HA . . 4.290 3.658 3.478 3.793 . 0 0 "[ . 1 . 2]" 1
1009 1 27 LEU MD1 1 70 GLY H . . 4.120 3.002 2.839 3.200 . 0 0 "[ . 1 . 2]" 1
1010 1 27 LEU MD1 1 70 GLY HA3 . . 4.390 3.801 3.665 3.930 . 0 0 "[ . 1 . 2]" 1
1011 1 27 LEU MD1 1 72 PHE HB3 . . 4.710 3.351 3.189 3.494 . 0 0 "[ . 1 . 2]" 1
1012 1 27 LEU MD2 1 28 GLN H . . 4.700 2.101 1.786 2.288 . 0 0 "[ . 1 . 2]" 1
1013 1 27 LEU MD2 1 28 GLN QB . . 5.500 3.459 3.319 3.592 . 0 0 "[ . 1 . 2]" 1
1014 1 27 LEU MD2 1 54 VAL HA . . 3.840 3.350 3.153 3.514 . 0 0 "[ . 1 . 2]" 1
1015 1 27 LEU MD2 1 55 LYS H . . 4.130 2.882 2.758 3.155 . 0 0 "[ . 1 . 2]" 1
1016 1 27 LEU MD2 1 55 LYS HG3 . . 3.780 2.471 2.293 2.664 . 0 0 "[ . 1 . 2]" 1
1017 1 27 LEU MD2 1 69 ARG HA . . 4.290 4.019 3.838 4.219 . 0 0 "[ . 1 . 2]" 1
1018 1 27 LEU MD2 1 70 GLY H . . 4.120 4.155 4.137 4.171 0.051 20 0 "[ . 1 . 2]" 1
1019 1 27 LEU MD2 1 70 GLY HA3 . . 4.390 3.907 3.810 4.035 . 0 0 "[ . 1 . 2]" 1
1020 1 27 LEU MD2 1 72 PHE HB3 . . 4.710 4.415 4.256 4.550 . 0 0 "[ . 1 . 2]" 1
1021 1 27 LEU HG 1 53 GLY H . . 4.530 4.444 4.286 4.542 0.012 8 0 "[ . 1 . 2]" 1
1022 1 27 LEU HG 1 69 ARG HA . . 4.210 3.355 3.099 3.491 . 0 0 "[ . 1 . 2]" 1
1023 1 27 LEU HG 1 70 GLY H . . 4.190 2.635 2.576 2.696 . 0 0 "[ . 1 . 2]" 1
1024 1 27 LEU HG 1 70 GLY HA2 . . 4.420 4.043 3.962 4.131 . 0 0 "[ . 1 . 2]" 1
1025 1 27 LEU HG 1 70 GLY HA3 . . 4.240 2.645 2.511 2.793 . 0 0 "[ . 1 . 2]" 1
1026 1 27 LEU HG 1 71 VAL H . . 5.390 4.829 4.697 4.939 . 0 0 "[ . 1 . 2]" 1
1027 1 27 LEU HG 1 71 VAL HA . . 5.500 5.517 5.457 5.541 0.041 10 0 "[ . 1 . 2]" 1
1028 1 28 GLN H 1 28 GLN QB . . 2.940 2.257 2.159 2.485 . 0 0 "[ . 1 . 2]" 1
1029 1 28 GLN H 1 28 GLN HG2 . . 4.770 4.485 4.399 4.569 . 0 0 "[ . 1 . 2]" 1
1030 1 28 GLN H 1 28 GLN QG . . 4.170 4.015 3.970 4.138 . 0 0 "[ . 1 . 2]" 1
1031 1 28 GLN H 1 28 GLN HG3 . . 4.770 4.531 4.440 4.757 . 0 0 "[ . 1 . 2]" 1
1032 1 28 GLN H 1 29 LEU H . . 4.650 4.565 4.448 4.613 . 0 0 "[ . 1 . 2]" 1
1033 1 28 GLN H 1 29 LEU QD . . 4.960 4.278 3.792 4.416 . 0 0 "[ . 1 . 2]" 1
1034 1 28 GLN H 1 55 LYS QD . . 5.500 5.340 4.871 5.512 0.012 4 0 "[ . 1 . 2]" 1
1035 1 28 GLN H 1 55 LYS QE . . 4.810 3.763 3.382 4.133 . 0 0 "[ . 1 . 2]" 1
1036 1 28 GLN H 1 55 LYS HG3 . . 5.500 5.344 4.722 5.515 0.015 6 0 "[ . 1 . 2]" 1
1037 1 28 GLN HA 1 28 GLN HG2 . . 3.800 2.925 2.729 3.391 . 0 0 "[ . 1 . 2]" 1
1038 1 28 GLN HA 1 28 GLN QG . . 3.330 2.412 2.252 2.496 . 0 0 "[ . 1 . 2]" 1
1039 1 28 GLN HA 1 28 GLN HG3 . . 3.800 2.591 2.291 2.793 . 0 0 "[ . 1 . 2]" 1
1040 1 28 GLN HA 1 29 LEU H . . 2.940 2.216 2.181 2.245 . 0 0 "[ . 1 . 2]" 1
1041 1 28 GLN HA 1 29 LEU HB2 . . 5.050 4.618 4.452 4.757 . 0 0 "[ . 1 . 2]" 1
1042 1 28 GLN QB 1 28 GLN HE22 . . 5.030 3.523 3.339 3.678 . 0 0 "[ . 1 . 2]" 1
1043 1 28 GLN QB 1 29 LEU H . . 4.200 3.785 3.664 3.899 . 0 0 "[ . 1 . 2]" 1
1044 1 28 GLN QB 1 55 LYS QE . . 3.940 3.541 3.289 3.949 0.009 7 0 "[ . 1 . 2]" 1
1045 1 28 GLN QG 1 29 LEU H . . 3.520 2.738 2.391 3.062 . 0 0 "[ . 1 . 2]" 1
1046 1 28 GLN HG2 1 29 LEU H . . 4.010 2.932 2.438 3.578 . 0 0 "[ . 1 . 2]" 1
1047 1 28 GLN HG3 1 29 LEU H . . 4.010 3.443 2.766 3.880 . 0 0 "[ . 1 . 2]" 1
1048 1 29 LEU H 1 29 LEU HB2 . . 3.620 2.707 2.618 2.786 . 0 0 "[ . 1 . 2]" 1
1049 1 29 LEU H 1 29 LEU HB3 . . 3.910 3.831 3.783 3.884 . 0 0 "[ . 1 . 2]" 1
1050 1 29 LEU H 1 29 LEU MD1 . . 4.850 4.215 4.165 4.261 . 0 0 "[ . 1 . 2]" 1
1051 1 29 LEU H 1 29 LEU QD . . 4.180 3.536 3.435 3.603 . 0 0 "[ . 1 . 2]" 1
1052 1 29 LEU H 1 29 LEU MD2 . . 4.850 3.798 3.659 3.910 . 0 0 "[ . 1 . 2]" 1
1053 1 29 LEU H 1 29 LEU HG . . 4.180 3.106 2.986 3.232 . 0 0 "[ . 1 . 2]" 1
1054 1 29 LEU HA 1 29 LEU MD1 . . 4.000 3.869 3.820 3.903 . 0 0 "[ . 1 . 2]" 1
1055 1 29 LEU HA 1 29 LEU QD . . 2.870 2.142 2.098 2.185 . 0 0 "[ . 1 . 2]" 1
1056 1 29 LEU HA 1 29 LEU MD2 . . 4.000 2.152 2.107 2.197 . 0 0 "[ . 1 . 2]" 1
1057 1 29 LEU HA 1 29 LEU HG . . 4.060 3.258 3.210 3.288 . 0 0 "[ . 1 . 2]" 1
1058 1 29 LEU HA 1 30 LYS H . . 2.900 2.177 2.126 2.249 . 0 0 "[ . 1 . 2]" 1
1059 1 29 LEU HA 1 30 LYS HB2 . . 5.050 4.458 4.236 4.891 . 0 0 "[ . 1 . 2]" 1
1060 1 29 LEU HA 1 30 LYS QB . . 4.330 4.000 3.882 4.135 . 0 0 "[ . 1 . 2]" 1
1061 1 29 LEU HA 1 30 LYS HB3 . . 5.050 4.579 4.258 4.870 . 0 0 "[ . 1 . 2]" 1
1062 1 29 LEU HA 1 33 ASP HB2 . . 4.600 3.471 3.395 3.635 . 0 0 "[ . 1 . 2]" 1
1063 1 29 LEU HA 1 33 ASP HB3 . . 4.880 4.042 3.925 4.268 . 0 0 "[ . 1 . 2]" 1
1064 1 29 LEU HA 1 55 LYS QE . . 4.360 3.977 3.516 4.189 . 0 0 "[ . 1 . 2]" 1
1065 1 29 LEU HB2 1 29 LEU QD . . 3.110 2.299 2.274 2.335 . 0 0 "[ . 1 . 2]" 1
1066 1 29 LEU HB2 1 30 LYS H . . 4.340 4.023 3.832 4.179 . 0 0 "[ . 1 . 2]" 1
1067 1 29 LEU HB2 1 30 LYS HA . . 5.450 4.783 4.668 4.968 . 0 0 "[ . 1 . 2]" 1
1068 1 29 LEU HB2 1 33 ASP HB2 . . 5.500 4.938 4.766 5.116 . 0 0 "[ . 1 . 2]" 1
1069 1 29 LEU HB2 1 35 VAL QG . . 5.440 4.818 4.778 4.847 . 0 0 "[ . 1 . 2]" 1
1070 1 29 LEU HB2 1 73 PRO HD2 . . 5.270 5.253 5.082 5.303 0.033 7 0 "[ . 1 . 2]" 1
1071 1 29 LEU HB2 1 76 PHE QD . . 5.370 4.718 4.547 4.845 . 0 0 "[ . 1 . 2]" 1
1072 1 29 LEU HB3 1 29 LEU MD1 . . 3.570 2.344 2.320 2.370 . 0 0 "[ . 1 . 2]" 1
1073 1 29 LEU HB3 1 29 LEU QD . . 2.970 2.142 2.127 2.161 . 0 0 "[ . 1 . 2]" 1
1074 1 29 LEU HB3 1 29 LEU MD2 . . 3.570 2.479 2.426 2.532 . 0 0 "[ . 1 . 2]" 1
1075 1 29 LEU HB3 1 30 LYS H . . 3.920 2.975 2.713 3.203 . 0 0 "[ . 1 . 2]" 1
1076 1 29 LEU HB3 1 32 GLY H . . 5.500 5.551 5.522 5.602 0.102 5 0 "[ . 1 . 2]" 1
1077 1 29 LEU HB3 1 33 ASP H . . 5.500 4.616 4.452 4.771 . 0 0 "[ . 1 . 2]" 1
1078 1 29 LEU HB3 1 33 ASP HB2 . . 4.280 3.259 3.071 3.481 . 0 0 "[ . 1 . 2]" 1
1079 1 29 LEU HB3 1 33 ASP HB3 . . 4.790 4.496 4.240 4.772 . 0 0 "[ . 1 . 2]" 1
1080 1 29 LEU QD 1 30 LYS H . . 3.720 3.483 3.402 3.550 . 0 0 "[ . 1 . 2]" 1
1081 1 29 LEU QD 1 33 ASP H . . 5.350 4.535 4.424 4.641 . 0 0 "[ . 1 . 2]" 1
1082 1 29 LEU QD 1 33 ASP HA . . 5.440 5.011 4.873 5.158 . 0 0 "[ . 1 . 2]" 1
1083 1 29 LEU QD 1 33 ASP HB2 . . 3.680 2.970 2.817 3.208 . 0 0 "[ . 1 . 2]" 1
1084 1 29 LEU QD 1 33 ASP HB3 . . 3.650 3.092 2.864 3.364 . 0 0 "[ . 1 . 2]" 1
1085 1 29 LEU QD 1 35 VAL H . . 5.440 4.747 4.652 4.838 . 0 0 "[ . 1 . 2]" 1
1086 1 29 LEU QD 1 35 VAL HA . . 4.930 4.389 4.333 4.420 . 0 0 "[ . 1 . 2]" 1
1087 1 29 LEU QD 1 35 VAL QG . . 2.660 1.808 1.792 1.833 . 0 0 "[ . 1 . 2]" 1
1088 1 29 LEU QD 1 55 LYS HA . . 5.140 4.190 4.036 4.315 . 0 0 "[ . 1 . 2]" 1
1089 1 29 LEU QD 1 55 LYS QD . . 3.700 2.580 2.158 2.986 . 0 0 "[ . 1 . 2]" 1
1090 1 29 LEU QD 1 55 LYS QE . . 3.560 3.268 3.003 3.522 . 0 0 "[ . 1 . 2]" 1
1091 1 29 LEU QD 1 72 PHE HB2 . . 3.340 2.444 2.326 2.562 . 0 0 "[ . 1 . 2]" 1
1092 1 29 LEU QD 1 72 PHE HB3 . . 3.480 2.897 2.756 3.049 . 0 0 "[ . 1 . 2]" 1
1093 1 29 LEU QD 1 72 PHE QD . . 4.390 2.732 2.634 2.833 . 0 0 "[ . 1 . 2]" 1
1094 1 29 LEU QD 1 72 PHE QE . . 4.460 3.581 3.527 3.611 . 0 0 "[ . 1 . 2]" 1
1095 1 29 LEU QD 1 72 PHE HZ . . 4.840 4.457 4.444 4.470 . 0 0 "[ . 1 . 2]" 1
1096 1 29 LEU QD 1 73 PRO HD2 . . 3.860 3.506 3.372 3.643 . 0 0 "[ . 1 . 2]" 1
1097 1 29 LEU QD 1 73 PRO HD3 . . 4.680 4.944 4.818 5.056 0.376 4 0 "[ . 1 . 2]" 1
1098 1 29 LEU QD 1 74 GLU HA . . 5.440 4.826 4.745 4.865 . 0 0 "[ . 1 . 2]" 1
1099 1 29 LEU QD 1 76 PHE HB2 . . 4.230 3.277 3.102 3.444 . 0 0 "[ . 1 . 2]" 1
1100 1 29 LEU QD 1 76 PHE HB3 . . 4.170 3.400 3.213 3.532 . 0 0 "[ . 1 . 2]" 1
1101 1 29 LEU QD 1 76 PHE QD . . 4.680 4.364 4.249 4.455 . 0 0 "[ . 1 . 2]" 1
1102 1 29 LEU QD 1 77 THR MG . . 3.180 2.086 1.990 2.205 . 0 0 "[ . 1 . 2]" 1
1103 1 29 LEU MD1 1 72 PHE HZ . . 5.500 4.789 4.742 4.860 . 0 0 "[ . 1 . 2]" 1
1104 1 29 LEU MD2 1 72 PHE HZ . . 5.500 5.312 5.202 5.367 . 0 0 "[ . 1 . 2]" 1
1105 1 29 LEU HG 1 30 LYS H . . 5.190 5.139 5.039 5.198 0.008 15 0 "[ . 1 . 2]" 1
1106 1 29 LEU HG 1 72 PHE HB2 . . 4.580 3.532 3.362 3.744 . 0 0 "[ . 1 . 2]" 1
1107 1 29 LEU HG 1 72 PHE HB3 . . 4.750 3.342 3.191 3.595 . 0 0 "[ . 1 . 2]" 1
1108 1 29 LEU HG 1 73 PRO HD2 . . 5.000 4.661 4.466 4.883 . 0 0 "[ . 1 . 2]" 1
1109 1 30 LYS H 1 30 LYS HB2 . . 3.600 2.904 2.691 3.245 . 0 0 "[ . 1 . 2]" 1
1110 1 30 LYS H 1 30 LYS HB3 . . 3.600 2.562 2.242 2.877 . 0 0 "[ . 1 . 2]" 1
1111 1 30 LYS H 1 30 LYS QD . . 4.830 4.529 4.113 4.840 0.010 7 0 "[ . 1 . 2]" 1
1112 1 30 LYS H 1 30 LYS QG . . 4.600 4.125 3.815 4.262 . 0 0 "[ . 1 . 2]" 1
1113 1 30 LYS H 1 33 ASP H . . 4.090 3.857 3.722 4.017 . 0 0 "[ . 1 . 2]" 1
1114 1 30 LYS H 1 33 ASP HB2 . . 4.100 2.562 2.334 2.749 . 0 0 "[ . 1 . 2]" 1
1115 1 30 LYS H 1 33 ASP HB3 . . 4.230 3.657 3.530 3.803 . 0 0 "[ . 1 . 2]" 1
1116 1 30 LYS H 1 55 LYS QE . . 5.300 5.237 4.702 5.332 0.032 15 0 "[ . 1 . 2]" 1
1117 1 30 LYS HA 1 30 LYS QD . . 3.490 3.118 2.325 3.504 0.014 2 0 "[ . 1 . 2]" 1
1118 1 30 LYS HA 1 30 LYS QG . . 3.590 2.660 2.259 3.305 . 0 0 "[ . 1 . 2]" 1
1119 1 30 LYS HA 1 31 ALA H . . 2.750 2.272 2.225 2.324 . 0 0 "[ . 1 . 2]" 1
1120 1 30 LYS HA 1 31 ALA HA . . 4.570 4.384 4.305 4.434 . 0 0 "[ . 1 . 2]" 1
1121 1 30 LYS HA 1 31 ALA MB . . 4.080 4.058 4.017 4.097 0.017 14 0 "[ . 1 . 2]" 1
1122 1 30 LYS QB 1 30 LYS QE . . 4.280 3.144 2.049 3.838 . 0 0 "[ . 1 . 2]" 1
1123 1 30 LYS QB 1 31 ALA H . . 3.960 3.671 3.542 3.767 . 0 0 "[ . 1 . 2]" 1
1124 1 30 LYS QB 1 33 ASP HB2 . . 4.270 3.862 3.679 4.024 . 0 0 "[ . 1 . 2]" 1
1125 1 30 LYS QB 1 33 ASP HB3 . . 4.620 4.650 4.626 4.691 0.071 6 0 "[ . 1 . 2]" 1
1126 1 30 LYS HB2 1 30 LYS HE2 . . 5.500 4.392 2.356 5.498 . 0 0 "[ . 1 . 2]" 1
1127 1 30 LYS HB2 1 30 LYS HE3 . . 5.500 4.308 2.258 5.519 0.019 5 0 "[ . 1 . 2]" 1
1128 1 30 LYS HB2 1 31 ALA H . . 4.610 4.223 3.935 4.372 . 0 0 "[ . 1 . 2]" 1
1129 1 30 LYS HB3 1 30 LYS HE2 . . 5.500 4.289 2.099 5.514 0.014 4 0 "[ . 1 . 2]" 1
1130 1 30 LYS HB3 1 30 LYS HE3 . . 5.500 4.076 2.198 4.801 . 0 0 "[ . 1 . 2]" 1
1131 1 30 LYS HB3 1 31 ALA H . . 4.610 4.054 3.805 4.348 . 0 0 "[ . 1 . 2]" 1
1132 1 30 LYS QD 1 31 ALA H . . 3.300 2.334 1.890 2.843 . 0 0 "[ . 1 . 2]" 1
1133 1 30 LYS QD 1 33 ASP H . . 5.100 4.591 3.638 5.160 0.060 4 0 "[ . 1 . 2]" 1
1134 1 30 LYS QG 1 31 ALA H . . 3.670 3.039 2.587 3.426 . 0 0 "[ . 1 . 2]" 1
1135 1 31 ALA H 1 31 ALA MB . . 2.690 2.191 2.155 2.219 . 0 0 "[ . 1 . 2]" 1
1136 1 31 ALA HA 1 32 GLY H . . 2.690 2.114 2.026 2.171 . 0 0 "[ . 1 . 2]" 1
1137 1 31 ALA HA 1 32 GLY HA3 . . 4.610 4.498 4.447 4.528 . 0 0 "[ . 1 . 2]" 1
1138 1 31 ALA HA 1 33 ASP H . . 4.000 3.605 3.476 3.735 . 0 0 "[ . 1 . 2]" 1
1139 1 31 ALA MB 1 32 GLY H . . 3.600 3.387 3.222 3.537 . 0 0 "[ . 1 . 2]" 1
1140 1 31 ALA MB 1 32 GLY HA2 . . 5.090 4.585 4.495 4.678 . 0 0 "[ . 1 . 2]" 1
1141 1 31 ALA MB 1 33 ASP H . . 5.360 4.743 4.591 4.878 . 0 0 "[ . 1 . 2]" 1
1142 1 32 GLY H 1 33 ASP HB2 . . 4.540 4.352 4.198 4.544 0.004 13 0 "[ . 1 . 2]" 1
1143 1 32 GLY HA2 1 34 VAL QG . . 5.440 5.155 4.970 5.357 . 0 0 "[ . 1 . 2]" 1
1144 1 33 ASP H 1 33 ASP HB2 . . 3.190 2.320 2.263 2.346 . 0 0 "[ . 1 . 2]" 1
1145 1 33 ASP H 1 33 ASP HB3 . . 3.700 3.563 3.525 3.583 . 0 0 "[ . 1 . 2]" 1
1146 1 33 ASP H 1 34 VAL H . . 4.680 4.577 4.514 4.625 . 0 0 "[ . 1 . 2]" 1
1147 1 33 ASP H 1 34 VAL QG . . 5.440 5.250 5.155 5.404 . 0 0 "[ . 1 . 2]" 1
1148 1 33 ASP H 1 77 THR MG . . 5.220 5.298 5.285 5.313 0.093 17 0 "[ . 1 . 2]" 1
1149 1 33 ASP HA 1 34 VAL H . . 2.700 2.150 2.091 2.219 . 0 0 "[ . 1 . 2]" 1
1150 1 33 ASP HA 1 34 VAL HB . . 5.230 4.880 4.652 5.133 . 0 0 "[ . 1 . 2]" 1
1151 1 33 ASP HA 1 34 VAL QG . . 3.670 3.721 3.498 3.851 0.181 14 0 "[ . 1 . 2]" 1
1152 1 33 ASP HA 1 35 VAL QG . . 5.440 4.800 4.623 4.960 . 0 0 "[ . 1 . 2]" 1
1153 1 33 ASP HB2 1 34 VAL H . . 4.500 4.456 4.350 4.511 0.011 18 0 "[ . 1 . 2]" 1
1154 1 33 ASP HB2 1 35 VAL QG . . 4.370 3.745 3.558 4.012 . 0 0 "[ . 1 . 2]" 1
1155 1 33 ASP HB2 1 55 LYS QD . . 4.510 3.632 3.182 3.949 . 0 0 "[ . 1 . 2]" 1
1156 1 33 ASP HB3 1 34 VAL H . . 3.930 3.472 3.281 3.597 . 0 0 "[ . 1 . 2]" 1
1157 1 33 ASP HB3 1 35 VAL QG . . 3.690 3.218 2.743 3.591 . 0 0 "[ . 1 . 2]" 1
1158 1 33 ASP HB3 1 55 LYS QD . . 4.150 2.822 2.253 3.357 . 0 0 "[ . 1 . 2]" 1
1159 1 33 ASP HB3 1 55 LYS HG2 . . 5.160 2.813 2.486 3.173 . 0 0 "[ . 1 . 2]" 1
1160 1 34 VAL H 1 34 VAL HB . . 3.220 2.755 2.533 2.967 . 0 0 "[ . 1 . 2]" 1
1161 1 34 VAL H 1 34 VAL MG1 . . 3.870 3.863 3.820 3.882 0.012 4 0 "[ . 1 . 2]" 1
1162 1 34 VAL H 1 34 VAL QG . . 2.940 2.179 2.086 2.291 . 0 0 "[ . 1 . 2]" 1
1163 1 34 VAL H 1 34 VAL MG2 . . 3.870 2.191 2.095 2.308 . 0 0 "[ . 1 . 2]" 1
1164 1 34 VAL H 1 35 VAL H . . 5.460 4.602 4.570 4.634 . 0 0 "[ . 1 . 2]" 1
1165 1 34 VAL H 1 35 VAL QG . . 4.610 4.481 4.385 4.592 . 0 0 "[ . 1 . 2]" 1
1166 1 34 VAL H 1 56 GLU H . . 4.770 4.424 4.346 4.567 . 0 0 "[ . 1 . 2]" 1
1167 1 34 VAL H 1 56 GLU HB3 . . 4.310 4.063 3.779 4.318 0.008 14 0 "[ . 1 . 2]" 1
1168 1 34 VAL HA 1 34 VAL MG1 . . 3.100 2.290 2.195 2.401 . 0 0 "[ . 1 . 2]" 1
1169 1 34 VAL HA 1 34 VAL QG . . 2.690 2.121 2.074 2.176 . 0 0 "[ . 1 . 2]" 1
1170 1 34 VAL HA 1 34 VAL MG2 . . 3.100 2.520 2.426 2.596 . 0 0 "[ . 1 . 2]" 1
1171 1 34 VAL HA 1 35 VAL H . . 2.910 2.168 2.139 2.199 . 0 0 "[ . 1 . 2]" 1
1172 1 34 VAL HA 1 35 VAL QG . . 3.750 3.414 3.330 3.527 . 0 0 "[ . 1 . 2]" 1
1173 1 34 VAL HA 1 80 VAL MG2 . . 4.570 4.424 4.068 4.581 0.011 6 0 "[ . 1 . 2]" 1
1174 1 34 VAL HB 1 35 VAL H . . 4.170 3.944 3.791 4.127 . 0 0 "[ . 1 . 2]" 1
1175 1 34 VAL HB 1 35 VAL HA . . 4.840 4.636 4.502 4.791 . 0 0 "[ . 1 . 2]" 1
1176 1 34 VAL HB 1 56 GLU H . . 4.650 3.416 3.163 3.705 . 0 0 "[ . 1 . 2]" 1
1177 1 34 VAL HB 1 56 GLU HA . . 4.830 4.852 4.774 4.875 0.045 8 0 "[ . 1 . 2]" 1
1178 1 34 VAL QG 1 35 VAL H . . 2.990 2.431 2.319 2.580 . 0 0 "[ . 1 . 2]" 1
1179 1 34 VAL QG 1 35 VAL HA . . 3.890 3.686 3.390 3.821 . 0 0 "[ . 1 . 2]" 1
1180 1 34 VAL QG 1 35 VAL QG . . 4.210 3.811 3.782 3.863 . 0 0 "[ . 1 . 2]" 1
1181 1 34 VAL QG 1 36 LEU H . . 5.250 4.190 3.841 4.377 . 0 0 "[ . 1 . 2]" 1
1182 1 34 VAL QG 1 56 GLU H . . 3.980 3.716 3.193 3.958 . 0 0 "[ . 1 . 2]" 1
1183 1 34 VAL QG 1 56 GLU HA . . 4.550 4.615 4.143 4.854 0.304 5 0 "[ . 1 . 2]" 1
1184 1 34 VAL QG 1 56 GLU HB2 . . 3.320 2.742 2.307 3.077 . 0 0 "[ . 1 . 2]" 1
1185 1 34 VAL QG 1 56 GLU HB3 . . 3.370 3.102 2.665 3.230 . 0 0 "[ . 1 . 2]" 1
1186 1 34 VAL QG 1 56 GLU HG2 . . 4.820 4.168 3.865 4.331 . 0 0 "[ . 1 . 2]" 1
1187 1 34 VAL QG 1 56 GLU HG3 . . 4.210 4.400 4.018 4.703 0.493 5 0 "[ . 1 . 2]" 1
1188 1 34 VAL QG 1 57 SER H . . 5.440 4.746 4.449 4.971 . 0 0 "[ . 1 . 2]" 1
1189 1 34 VAL MG1 1 35 VAL H . . 4.130 2.450 2.331 2.609 . 0 0 "[ . 1 . 2]" 1
1190 1 34 VAL MG1 1 56 GLU H . . 5.500 3.871 3.248 4.165 . 0 0 "[ . 1 . 2]" 1
1191 1 34 VAL MG1 1 56 GLU HB3 . . 4.250 3.395 2.772 3.645 . 0 0 "[ . 1 . 2]" 1
1192 1 34 VAL MG1 1 56 GLU HG3 . . 5.500 4.649 4.146 5.098 . 0 0 "[ . 1 . 2]" 1
1193 1 34 VAL MG2 1 35 VAL H . . 4.130 4.095 3.985 4.156 0.026 20 0 "[ . 1 . 2]" 1
1194 1 34 VAL MG2 1 56 GLU H . . 5.500 4.844 4.683 5.101 . 0 0 "[ . 1 . 2]" 1
1195 1 34 VAL MG2 1 56 GLU HB3 . . 4.250 3.622 3.457 3.830 . 0 0 "[ . 1 . 2]" 1
1196 1 34 VAL MG2 1 56 GLU HG3 . . 5.500 5.481 5.324 5.540 0.040 19 0 "[ . 1 . 2]" 1
1197 1 35 VAL H 1 35 VAL HB . . 4.020 3.177 3.101 3.234 . 0 0 "[ . 1 . 2]" 1
1198 1 35 VAL H 1 35 VAL MG1 . . 4.110 4.029 4.001 4.058 . 0 0 "[ . 1 . 2]" 1
1199 1 35 VAL H 1 35 VAL QG . . 3.120 2.552 2.498 2.627 . 0 0 "[ . 1 . 2]" 1
1200 1 35 VAL H 1 35 VAL MG2 . . 4.110 2.580 2.523 2.661 . 0 0 "[ . 1 . 2]" 1
1201 1 35 VAL H 1 36 LEU H . . 4.480 4.291 4.240 4.328 . 0 0 "[ . 1 . 2]" 1
1202 1 35 VAL H 1 56 GLU H . . 4.860 4.522 4.402 4.652 . 0 0 "[ . 1 . 2]" 1
1203 1 35 VAL HA 1 35 VAL MG1 . . 3.080 2.230 2.208 2.255 . 0 0 "[ . 1 . 2]" 1
1204 1 35 VAL HA 1 35 VAL MG2 . . 3.080 2.754 2.725 2.783 . 0 0 "[ . 1 . 2]" 1
1205 1 35 VAL HA 1 36 LEU H . . 2.880 2.045 2.032 2.066 . 0 0 "[ . 1 . 2]" 1
1206 1 35 VAL HA 1 36 LEU HB2 . . 5.320 4.553 4.440 4.599 . 0 0 "[ . 1 . 2]" 1
1207 1 35 VAL HA 1 36 LEU HB3 . . 5.500 5.543 5.523 5.558 0.058 6 0 "[ . 1 . 2]" 1
1208 1 35 VAL HA 1 36 LEU QD . . 4.400 4.088 3.930 4.217 . 0 0 "[ . 1 . 2]" 1
1209 1 35 VAL HA 1 54 VAL H . . 4.670 4.367 4.275 4.503 . 0 0 "[ . 1 . 2]" 1
1210 1 35 VAL HA 1 54 VAL MG1 . . 5.200 4.774 4.649 4.874 . 0 0 "[ . 1 . 2]" 1
1211 1 35 VAL HA 1 56 GLU H . . 3.170 2.779 2.618 2.907 . 0 0 "[ . 1 . 2]" 1
1212 1 35 VAL HA 1 56 GLU HA . . 4.780 4.771 4.594 4.834 0.054 14 0 "[ . 1 . 2]" 1
1213 1 35 VAL HA 1 56 GLU HB2 . . 4.590 4.139 3.924 4.386 . 0 0 "[ . 1 . 2]" 1
1214 1 35 VAL HB 1 36 LEU H . . 4.510 3.897 3.824 3.943 . 0 0 "[ . 1 . 2]" 1
1215 1 35 VAL HB 1 37 VAL MG2 . . 5.000 3.527 3.328 3.744 . 0 0 "[ . 1 . 2]" 1
1216 1 35 VAL HB 1 72 PHE HZ . . 4.680 3.097 2.937 3.243 . 0 0 "[ . 1 . 2]" 1
1217 1 35 VAL QG 1 36 LEU H . . 3.030 2.574 2.493 2.618 . 0 0 "[ . 1 . 2]" 1
1218 1 35 VAL QG 1 36 LEU HA . . 4.750 4.304 4.247 4.371 . 0 0 "[ . 1 . 2]" 1
1219 1 35 VAL QG 1 36 LEU HB2 . . 5.200 4.145 4.072 4.184 . 0 0 "[ . 1 . 2]" 1
1220 1 35 VAL QG 1 36 LEU HG . . 5.410 4.367 4.277 4.471 . 0 0 "[ . 1 . 2]" 1
1221 1 35 VAL QG 1 37 VAL H . . 4.550 4.338 4.215 4.472 . 0 0 "[ . 1 . 2]" 1
1222 1 35 VAL QG 1 37 VAL HA . . 4.020 4.049 3.884 4.207 0.187 1 0 "[ . 1 . 2]" 1
1223 1 35 VAL QG 1 37 VAL MG2 . . 3.820 3.683 3.525 3.843 0.023 1 0 "[ . 1 . 2]" 1
1224 1 35 VAL QG 1 38 ILE H . . 5.260 5.302 5.168 5.391 0.131 1 0 "[ . 1 . 2]" 1
1225 1 35 VAL QG 1 52 MET HA . . 5.440 5.121 5.081 5.170 . 0 0 "[ . 1 . 2]" 1
1226 1 35 VAL QG 1 53 GLY H . . 4.820 3.969 3.891 4.038 . 0 0 "[ . 1 . 2]" 1
1227 1 35 VAL QG 1 53 GLY HA2 . . 4.150 3.810 3.685 3.888 . 0 0 "[ . 1 . 2]" 1
1228 1 35 VAL QG 1 53 GLY HA3 . . 3.180 2.500 2.369 2.575 . 0 0 "[ . 1 . 2]" 1
1229 1 35 VAL QG 1 54 VAL H . . 3.290 2.626 2.531 2.716 . 0 0 "[ . 1 . 2]" 1
1230 1 35 VAL QG 1 54 VAL HA . . 4.480 3.282 3.236 3.319 . 0 0 "[ . 1 . 2]" 1
1231 1 35 VAL QG 1 54 VAL HB . . 5.440 4.797 4.741 4.845 . 0 0 "[ . 1 . 2]" 1
1232 1 35 VAL QG 1 55 LYS H . . 4.360 3.211 3.146 3.272 . 0 0 "[ . 1 . 2]" 1
1233 1 35 VAL QG 1 55 LYS HA . . 3.150 2.390 2.253 2.505 . 0 0 "[ . 1 . 2]" 1
1234 1 35 VAL QG 1 55 LYS HB3 . . 4.690 4.182 3.931 4.322 . 0 0 "[ . 1 . 2]" 1
1235 1 35 VAL QG 1 55 LYS QD . . 4.040 3.610 3.112 3.832 . 0 0 "[ . 1 . 2]" 1
1236 1 35 VAL QG 1 55 LYS QE . . 5.440 4.184 4.011 4.367 . 0 0 "[ . 1 . 2]" 1
1237 1 35 VAL QG 1 55 LYS HG2 . . 3.370 2.569 2.123 2.817 . 0 0 "[ . 1 . 2]" 1
1238 1 35 VAL QG 1 55 LYS HG3 . . 4.200 2.727 2.552 2.871 . 0 0 "[ . 1 . 2]" 1
1239 1 35 VAL QG 1 56 GLU H . . 4.100 3.694 3.566 3.806 . 0 0 "[ . 1 . 2]" 1
1240 1 35 VAL QG 1 72 PHE QE . . 4.100 2.499 2.418 2.587 . 0 0 "[ . 1 . 2]" 1
1241 1 35 VAL QG 1 72 PHE HZ . . 3.880 3.231 3.175 3.294 . 0 0 "[ . 1 . 2]" 1
1242 1 35 VAL QG 1 77 THR HB . . 4.970 4.176 4.043 4.313 . 0 0 "[ . 1 . 2]" 1
1243 1 35 VAL QG 1 77 THR MG . . 3.680 2.686 2.572 2.760 . 0 0 "[ . 1 . 2]" 1
1244 1 35 VAL MG1 1 36 LEU H . . 4.360 2.594 2.510 2.640 . 0 0 "[ . 1 . 2]" 1
1245 1 35 VAL MG1 1 54 VAL HA . . 5.500 3.308 3.259 3.346 . 0 0 "[ . 1 . 2]" 1
1246 1 35 VAL MG1 1 55 LYS H . . 5.050 3.256 3.189 3.321 . 0 0 "[ . 1 . 2]" 1
1247 1 35 VAL MG1 1 55 LYS HA . . 3.690 2.467 2.317 2.597 . 0 0 "[ . 1 . 2]" 1
1248 1 35 VAL MG1 1 55 LYS HB2 . . 5.500 4.278 4.147 4.424 . 0 0 "[ . 1 . 2]" 1
1249 1 35 VAL MG1 1 55 LYS HG3 . . 5.380 2.916 2.752 3.047 . 0 0 "[ . 1 . 2]" 1
1250 1 35 VAL MG1 1 56 GLU H . . 4.970 4.075 3.923 4.205 . 0 0 "[ . 1 . 2]" 1
1251 1 35 VAL MG1 1 72 PHE HB2 . . 5.500 5.398 5.308 5.508 0.008 15 0 "[ . 1 . 2]" 1
1252 1 35 VAL MG1 1 72 PHE HB3 . . 5.500 4.716 4.639 4.814 . 0 0 "[ . 1 . 2]" 1
1253 1 35 VAL MG1 1 72 PHE HZ . . 4.530 3.435 3.378 3.509 . 0 0 "[ . 1 . 2]" 1
1254 1 35 VAL MG2 1 36 LEU H . . 4.360 4.307 4.272 4.333 . 0 0 "[ . 1 . 2]" 1
1255 1 35 VAL MG2 1 54 VAL HA . . 5.500 5.511 5.468 5.524 0.024 1 0 "[ . 1 . 2]" 1
1256 1 35 VAL MG2 1 55 LYS H . . 5.050 4.897 4.813 4.979 . 0 0 "[ . 1 . 2]" 1
1257 1 35 VAL MG2 1 55 LYS HA . . 3.690 3.208 3.079 3.306 . 0 0 "[ . 1 . 2]" 1
1258 1 35 VAL MG2 1 55 LYS HB2 . . 5.500 5.076 4.907 5.287 . 0 0 "[ . 1 . 2]" 1
1259 1 35 VAL MG2 1 55 LYS HG3 . . 5.380 3.288 3.019 3.546 . 0 0 "[ . 1 . 2]" 1
1260 1 35 VAL MG2 1 56 GLU H . . 4.970 4.228 4.087 4.346 . 0 0 "[ . 1 . 2]" 1
1261 1 35 VAL MG2 1 72 PHE HB2 . . 5.500 4.927 4.832 5.022 . 0 0 "[ . 1 . 2]" 1
1262 1 35 VAL MG2 1 72 PHE HB3 . . 5.500 4.829 4.743 4.907 . 0 0 "[ . 1 . 2]" 1
1263 1 35 VAL MG2 1 72 PHE HZ . . 4.530 3.935 3.810 4.044 . 0 0 "[ . 1 . 2]" 1
1264 1 36 LEU H 1 36 LEU HB2 . . 3.590 2.521 2.417 2.573 . 0 0 "[ . 1 . 2]" 1
1265 1 36 LEU H 1 36 LEU HB3 . . 3.770 3.594 3.566 3.613 . 0 0 "[ . 1 . 2]" 1
1266 1 36 LEU H 1 36 LEU MD1 . . 3.880 3.580 3.540 3.617 . 0 0 "[ . 1 . 2]" 1
1267 1 36 LEU H 1 36 LEU MD2 . . 3.880 3.427 3.308 3.549 . 0 0 "[ . 1 . 2]" 1
1268 1 36 LEU H 1 36 LEU HG . . 4.240 2.295 2.222 2.402 . 0 0 "[ . 1 . 2]" 1
1269 1 36 LEU H 1 37 VAL H . . 4.400 4.256 4.220 4.297 . 0 0 "[ . 1 . 2]" 1
1270 1 36 LEU H 1 53 GLY HA3 . . 4.660 4.341 4.204 4.426 . 0 0 "[ . 1 . 2]" 1
1271 1 36 LEU H 1 54 VAL H . . 3.520 3.036 2.954 3.162 . 0 0 "[ . 1 . 2]" 1
1272 1 36 LEU H 1 54 VAL MG1 . . 3.860 3.439 3.324 3.528 . 0 0 "[ . 1 . 2]" 1
1273 1 36 LEU H 1 55 LYS H . . 4.780 4.798 4.777 4.814 0.034 2 0 "[ . 1 . 2]" 1
1274 1 36 LEU H 1 55 LYS HA . . 3.970 3.402 3.292 3.556 . 0 0 "[ . 1 . 2]" 1
1275 1 36 LEU H 1 56 GLU HB2 . . 5.500 4.152 3.952 4.438 . 0 0 "[ . 1 . 2]" 1
1276 1 36 LEU HA 1 36 LEU MD1 . . 4.100 4.015 3.989 4.033 . 0 0 "[ . 1 . 2]" 1
1277 1 36 LEU HA 1 36 LEU QD . . 3.030 2.527 2.432 2.607 . 0 0 "[ . 1 . 2]" 1
1278 1 36 LEU HA 1 36 LEU MD2 . . 4.100 2.554 2.453 2.641 . 0 0 "[ . 1 . 2]" 1
1279 1 36 LEU HA 1 36 LEU HG . . 3.930 3.329 3.291 3.362 . 0 0 "[ . 1 . 2]" 1
1280 1 36 LEU HA 1 37 VAL H . . 2.970 2.267 2.255 2.289 . 0 0 "[ . 1 . 2]" 1
1281 1 36 LEU HA 1 37 VAL HB . . 4.990 4.874 4.796 4.946 . 0 0 "[ . 1 . 2]" 1
1282 1 36 LEU HA 1 37 VAL MG2 . . 4.050 3.797 3.758 3.892 . 0 0 "[ . 1 . 2]" 1
1283 1 36 LEU HB2 1 36 LEU MD1 . . 3.420 2.275 2.241 2.306 . 0 0 "[ . 1 . 2]" 1
1284 1 36 LEU HB2 1 36 LEU MD2 . . 3.420 3.215 3.199 3.241 . 0 0 "[ . 1 . 2]" 1
1285 1 36 LEU HB2 1 37 VAL H . . 4.640 4.426 4.402 4.455 . 0 0 "[ . 1 . 2]" 1
1286 1 36 LEU HB2 1 38 ILE MG . . 4.030 3.607 3.401 3.838 . 0 0 "[ . 1 . 2]" 1
1287 1 36 LEU HB2 1 54 VAL H . . 4.200 2.919 2.875 2.967 . 0 0 "[ . 1 . 2]" 1
1288 1 36 LEU HB2 1 54 VAL HB . . 5.040 4.820 4.743 4.901 . 0 0 "[ . 1 . 2]" 1
1289 1 36 LEU HB2 1 54 VAL MG1 . . 3.080 2.298 2.220 2.372 . 0 0 "[ . 1 . 2]" 1
1290 1 36 LEU HB2 1 55 LYS HA . . 5.500 5.412 5.190 5.512 0.012 18 0 "[ . 1 . 2]" 1
1291 1 36 LEU HB3 1 36 LEU MD1 . . 3.410 2.470 2.436 2.496 . 0 0 "[ . 1 . 2]" 1
1292 1 36 LEU HB3 1 36 LEU QD . . 2.940 2.119 2.099 2.150 . 0 0 "[ . 1 . 2]" 1
1293 1 36 LEU HB3 1 36 LEU MD2 . . 3.410 2.308 2.264 2.373 . 0 0 "[ . 1 . 2]" 1
1294 1 36 LEU HB3 1 37 VAL H . . 4.280 3.990 3.940 4.053 . 0 0 "[ . 1 . 2]" 1
1295 1 36 LEU HB3 1 54 VAL H . . 4.420 4.427 4.324 4.456 0.036 15 0 "[ . 1 . 2]" 1
1296 1 36 LEU HB3 1 54 VAL MG1 . . 3.630 3.576 3.444 3.643 0.013 5 0 "[ . 1 . 2]" 1
1297 1 36 LEU QD 1 37 VAL H . . 4.460 4.271 4.186 4.329 . 0 0 "[ . 1 . 2]" 1
1298 1 36 LEU QD 1 54 VAL H . . 4.810 4.171 4.110 4.248 . 0 0 "[ . 1 . 2]" 1
1299 1 36 LEU QD 1 54 VAL MG1 . . 3.030 2.117 2.046 2.186 . 0 0 "[ . 1 . 2]" 1
1300 1 36 LEU QD 1 55 LYS HA . . 4.800 4.662 4.506 4.721 . 0 0 "[ . 1 . 2]" 1
1301 1 36 LEU QD 1 56 GLU H . . 3.920 3.891 3.760 3.998 0.078 3 0 "[ . 1 . 2]" 1
1302 1 36 LEU QD 1 56 GLU HA . . 3.130 2.341 2.256 2.413 . 0 0 "[ . 1 . 2]" 1
1303 1 36 LEU QD 1 56 GLU HB2 . . 3.010 2.557 2.434 2.730 . 0 0 "[ . 1 . 2]" 1
1304 1 36 LEU QD 1 56 GLU HB3 . . 3.940 3.837 3.689 4.005 0.065 3 0 "[ . 1 . 2]" 1
1305 1 36 LEU QD 1 56 GLU HG2 . . 4.280 3.888 3.555 4.191 . 0 0 "[ . 1 . 2]" 1
1306 1 36 LEU QD 1 56 GLU HG3 . . 3.380 2.674 2.254 3.010 . 0 0 "[ . 1 . 2]" 1
1307 1 36 LEU QD 1 58 ASP H . . 5.440 5.303 5.062 5.480 0.040 8 0 "[ . 1 . 2]" 1
1308 1 36 LEU QD 1 59 TRP H . . 4.910 3.968 3.836 4.072 . 0 0 "[ . 1 . 2]" 1
1309 1 36 LEU QD 1 59 TRP HB2 . . 3.630 2.738 2.622 2.830 . 0 0 "[ . 1 . 2]" 1
1310 1 36 LEU QD 1 59 TRP HB3 . . 3.570 2.338 2.222 2.428 . 0 0 "[ . 1 . 2]" 1
1311 1 36 LEU QD 1 59 TRP HD1 . . 3.440 2.420 2.304 2.579 . 0 0 "[ . 1 . 2]" 1
1312 1 36 LEU QD 1 59 TRP HE1 . . 4.400 3.558 3.438 3.700 . 0 0 "[ . 1 . 2]" 1
1313 1 36 LEU QD 1 59 TRP HE3 . . 4.920 4.240 4.099 4.369 . 0 0 "[ . 1 . 2]" 1
1314 1 36 LEU QD 1 60 ASN H . . 5.440 4.332 4.151 4.489 . 0 0 "[ . 1 . 2]" 1
1315 1 36 LEU MD1 1 55 LYS HA . . 5.500 5.077 4.987 5.155 . 0 0 "[ . 1 . 2]" 1
1316 1 36 LEU MD1 1 56 GLU H . . 4.800 4.413 4.335 4.545 . 0 0 "[ . 1 . 2]" 1
1317 1 36 LEU MD1 1 56 GLU HA . . 4.000 2.397 2.306 2.476 . 0 0 "[ . 1 . 2]" 1
1318 1 36 LEU MD1 1 56 GLU HB2 . . 3.940 3.521 3.279 3.759 . 0 0 "[ . 1 . 2]" 1
1319 1 36 LEU MD1 1 56 GLU HB3 . . 5.220 4.670 4.511 4.886 . 0 0 "[ . 1 . 2]" 1
1320 1 36 LEU MD1 1 56 GLU HG2 . . 5.300 4.507 4.040 4.941 . 0 0 "[ . 1 . 2]" 1
1321 1 36 LEU MD1 1 56 GLU HG3 . . 4.080 3.046 2.622 3.517 . 0 0 "[ . 1 . 2]" 1
1322 1 36 LEU MD1 1 59 TRP HB3 . . 4.920 2.347 2.229 2.437 . 0 0 "[ . 1 . 2]" 1
1323 1 36 LEU MD1 1 59 TRP HD1 . . 4.750 2.441 2.321 2.601 . 0 0 "[ . 1 . 2]" 1
1324 1 36 LEU MD1 1 59 TRP HE1 . . 5.500 3.633 3.506 3.775 . 0 0 "[ . 1 . 2]" 1
1325 1 36 LEU MD2 1 55 LYS HA . . 5.500 5.435 5.135 5.520 0.020 7 0 "[ . 1 . 2]" 1
1326 1 36 LEU MD2 1 56 GLU H . . 4.800 4.329 4.110 4.518 . 0 0 "[ . 1 . 2]" 1
1327 1 36 LEU MD2 1 56 GLU HA . . 4.000 3.293 3.154 3.528 . 0 0 "[ . 1 . 2]" 1
1328 1 36 LEU MD2 1 56 GLU HB2 . . 3.940 2.627 2.492 2.855 . 0 0 "[ . 1 . 2]" 1
1329 1 36 LEU MD2 1 56 GLU HB3 . . 5.220 4.082 3.914 4.338 . 0 0 "[ . 1 . 2]" 1
1330 1 36 LEU MD2 1 56 GLU HG2 . . 5.300 4.253 3.944 4.679 . 0 0 "[ . 1 . 2]" 1
1331 1 36 LEU MD2 1 56 GLU HG3 . . 4.080 2.974 2.457 3.522 . 0 0 "[ . 1 . 2]" 1
1332 1 36 LEU MD2 1 59 TRP HB3 . . 4.920 4.381 4.210 4.581 . 0 0 "[ . 1 . 2]" 1
1333 1 36 LEU MD2 1 59 TRP HD1 . . 4.750 3.980 3.850 4.265 . 0 0 "[ . 1 . 2]" 1
1334 1 36 LEU MD2 1 59 TRP HE1 . . 5.500 5.090 4.948 5.401 . 0 0 "[ . 1 . 2]" 1
1335 1 36 LEU HG 1 54 VAL MG1 . . 4.330 3.404 3.311 3.546 . 0 0 "[ . 1 . 2]" 1
1336 1 36 LEU HG 1 56 GLU H . . 4.810 3.490 3.415 3.638 . 0 0 "[ . 1 . 2]" 1
1337 1 36 LEU HG 1 56 GLU HA . . 3.950 2.627 2.487 2.794 . 0 0 "[ . 1 . 2]" 1
1338 1 36 LEU HG 1 59 TRP H . . 5.500 5.312 5.175 5.513 0.013 9 0 "[ . 1 . 2]" 1
1339 1 36 LEU HG 1 59 TRP HB2 . . 5.500 4.704 4.541 4.862 . 0 0 "[ . 1 . 2]" 1
1340 1 36 LEU HG 1 59 TRP HB3 . . 4.940 4.051 3.932 4.192 . 0 0 "[ . 1 . 2]" 1
1341 1 36 LEU HG 1 59 TRP HD1 . . 5.500 4.940 4.802 5.175 . 0 0 "[ . 1 . 2]" 1
1342 1 37 VAL H 1 37 VAL HB . . 3.090 2.734 2.661 2.802 . 0 0 "[ . 1 . 2]" 1
1343 1 37 VAL H 1 37 VAL MG1 . . 4.050 3.812 3.800 3.826 . 0 0 "[ . 1 . 2]" 1
1344 1 37 VAL H 1 37 VAL MG2 . . 3.060 1.985 1.955 2.064 . 0 0 "[ . 1 . 2]" 1
1345 1 37 VAL H 1 38 ILE H . . 4.870 4.635 4.597 4.669 . 0 0 "[ . 1 . 2]" 1
1346 1 37 VAL H 1 72 PHE HZ . . 5.500 4.917 4.763 5.071 . 0 0 "[ . 1 . 2]" 1
1347 1 37 VAL H 1 80 VAL MG2 . . 5.500 5.605 5.584 5.625 0.125 15 0 "[ . 1 . 2]" 1
1348 1 37 VAL HA 1 37 VAL MG1 . . 3.190 2.348 2.271 2.386 . 0 0 "[ . 1 . 2]" 1
1349 1 37 VAL HA 1 37 VAL MG2 . . 3.150 2.410 2.294 2.456 . 0 0 "[ . 1 . 2]" 1
1350 1 37 VAL HA 1 38 ILE H . . 2.930 2.129 2.099 2.161 . 0 0 "[ . 1 . 2]" 1
1351 1 37 VAL HA 1 38 ILE MD . . 5.180 5.062 4.861 5.185 0.005 10 0 "[ . 1 . 2]" 1
1352 1 37 VAL HA 1 38 ILE HG12 . . 3.880 3.893 3.878 3.913 0.033 2 0 "[ . 1 . 2]" 1
1353 1 37 VAL HA 1 38 ILE MG . . 3.910 3.727 3.540 3.868 . 0 0 "[ . 1 . 2]" 1
1354 1 37 VAL HA 1 53 GLY H . . 4.570 4.627 4.607 4.645 0.075 10 0 "[ . 1 . 2]" 1
1355 1 37 VAL HA 1 53 GLY HA2 . . 3.490 2.826 2.719 2.925 . 0 0 "[ . 1 . 2]" 1
1356 1 37 VAL HA 1 53 GLY HA3 . . 3.750 2.588 2.528 2.674 . 0 0 "[ . 1 . 2]" 1
1357 1 37 VAL HA 1 54 VAL H . . 4.320 4.121 4.022 4.245 . 0 0 "[ . 1 . 2]" 1
1358 1 37 VAL HA 1 72 PHE HZ . . 4.550 3.997 3.860 4.156 . 0 0 "[ . 1 . 2]" 1
1359 1 37 VAL MG1 1 38 ILE H . . 3.270 2.524 2.462 2.580 . 0 0 "[ . 1 . 2]" 1
1360 1 37 VAL MG1 1 38 ILE HA . . 4.300 3.795 3.610 3.919 . 0 0 "[ . 1 . 2]" 1
1361 1 37 VAL MG1 1 51 LEU HA . . 4.450 4.180 4.054 4.416 . 0 0 "[ . 1 . 2]" 1
1362 1 37 VAL MG1 1 52 MET H . . 3.860 3.133 2.942 3.302 . 0 0 "[ . 1 . 2]" 1
1363 1 37 VAL MG1 1 52 MET HB3 . . 4.800 4.336 4.224 4.458 . 0 0 "[ . 1 . 2]" 1
1364 1 37 VAL MG1 1 53 GLY HA2 . . 4.680 4.238 4.138 4.316 . 0 0 "[ . 1 . 2]" 1
1365 1 37 VAL MG1 1 53 GLY HA3 . . 4.820 4.094 3.992 4.187 . 0 0 "[ . 1 . 2]" 1
1366 1 37 VAL MG2 1 38 ILE H . . 4.280 4.057 3.904 4.139 . 0 0 "[ . 1 . 2]" 1
1367 1 37 VAL MG2 1 53 GLY HA2 . . 4.850 4.623 4.475 4.716 . 0 0 "[ . 1 . 2]" 1
1368 1 37 VAL MG2 1 53 GLY HA3 . . 3.860 3.730 3.651 3.808 . 0 0 "[ . 1 . 2]" 1
1369 1 37 VAL MG2 1 72 PHE HZ . . 3.080 2.315 2.241 2.472 . 0 0 "[ . 1 . 2]" 1
1370 1 37 VAL MG2 1 79 ARG QD . . 4.390 4.257 3.732 4.424 0.034 4 0 "[ . 1 . 2]" 1
1371 1 38 ILE H 1 38 ILE MD . . 4.190 3.913 3.806 4.008 . 0 0 "[ . 1 . 2]" 1
1372 1 38 ILE H 1 38 ILE HG12 . . 3.280 2.273 2.187 2.359 . 0 0 "[ . 1 . 2]" 1
1373 1 38 ILE H 1 38 ILE HG13 . . 3.710 3.331 3.234 3.464 . 0 0 "[ . 1 . 2]" 1
1374 1 38 ILE H 1 38 ILE MG . . 3.770 2.986 2.909 3.093 . 0 0 "[ . 1 . 2]" 1
1375 1 38 ILE H 1 39 PRO HD2 . . 4.850 4.884 4.864 4.901 0.051 1 0 "[ . 1 . 2]" 1
1376 1 38 ILE H 1 52 MET HG2 . . 4.870 4.072 3.765 4.889 0.019 15 0 "[ . 1 . 2]" 1
1377 1 38 ILE H 1 53 GLY HA2 . . 3.770 2.594 2.485 2.667 . 0 0 "[ . 1 . 2]" 1
1378 1 38 ILE H 1 53 GLY HA3 . . 4.280 3.508 3.431 3.612 . 0 0 "[ . 1 . 2]" 1
1379 1 38 ILE H 1 54 VAL MG1 . . 5.500 5.496 5.276 5.530 0.030 2 0 "[ . 1 . 2]" 1
1380 1 38 ILE HA 1 38 ILE MD . . 4.320 4.257 4.246 4.280 . 0 0 "[ . 1 . 2]" 1
1381 1 38 ILE HA 1 38 ILE MG . . 3.050 2.363 2.311 2.408 . 0 0 "[ . 1 . 2]" 1
1382 1 38 ILE HA 1 39 PRO HD2 . . 2.980 2.500 2.473 2.542 . 0 0 "[ . 1 . 2]" 1
1383 1 38 ILE HA 1 39 PRO HD3 . . 3.200 2.412 2.329 2.551 . 0 0 "[ . 1 . 2]" 1
1384 1 38 ILE HA 1 39 PRO QG . . 4.280 4.139 4.102 4.190 . 0 0 "[ . 1 . 2]" 1
1385 1 38 ILE HB 1 39 PRO HB3 . . 5.500 5.503 5.445 5.524 0.024 6 0 "[ . 1 . 2]" 1
1386 1 38 ILE HB 1 39 PRO HD2 . . 3.440 2.035 1.982 2.078 . 0 0 "[ . 1 . 2]" 1
1387 1 38 ILE HB 1 39 PRO HD3 . . 3.400 3.437 3.428 3.452 0.052 16 0 "[ . 1 . 2]" 1
1388 1 38 ILE HB 1 53 GLY HA2 . . 5.270 4.744 4.631 4.857 . 0 0 "[ . 1 . 2]" 1
1389 1 38 ILE MD 1 39 PRO HD2 . . 4.450 4.128 3.985 4.377 . 0 0 "[ . 1 . 2]" 1
1390 1 38 ILE MD 1 40 PHE HA . . 4.900 4.883 4.631 4.919 0.019 12 0 "[ . 1 . 2]" 1
1391 1 38 ILE MD 1 52 MET HA . . 5.500 5.154 4.992 5.401 . 0 0 "[ . 1 . 2]" 1
1392 1 38 ILE MD 1 52 MET ME . . 4.790 4.340 4.045 4.618 . 0 0 "[ . 1 . 2]" 1
1393 1 38 ILE MD 1 52 MET HG2 . . 3.510 2.567 2.354 2.938 . 0 0 "[ . 1 . 2]" 1
1394 1 38 ILE MD 1 52 MET HG3 . . 4.740 3.430 2.505 3.753 . 0 0 "[ . 1 . 2]" 1
1395 1 38 ILE MD 1 53 GLY H . . 4.530 4.096 3.853 4.331 . 0 0 "[ . 1 . 2]" 1
1396 1 38 ILE MD 1 53 GLY HA2 . . 3.590 3.010 2.718 3.242 . 0 0 "[ . 1 . 2]" 1
1397 1 38 ILE MD 1 53 GLY HA3 . . 4.750 4.432 4.156 4.671 . 0 0 "[ . 1 . 2]" 1
1398 1 38 ILE MD 1 54 VAL H . . 4.290 4.004 3.598 4.290 0.000 2 0 "[ . 1 . 2]" 1
1399 1 38 ILE MD 1 54 VAL HB . . 4.060 3.465 3.077 3.766 . 0 0 "[ . 1 . 2]" 1
1400 1 38 ILE MD 1 69 ARG HA . . 4.820 4.336 3.726 4.698 . 0 0 "[ . 1 . 2]" 1
1401 1 38 ILE MD 1 69 ARG HB2 . . 4.160 2.738 2.310 3.138 . 0 0 "[ . 1 . 2]" 1
1402 1 38 ILE MD 1 69 ARG QB . . 3.610 2.582 2.182 2.930 . 0 0 "[ . 1 . 2]" 1
1403 1 38 ILE MD 1 69 ARG HB3 . . 4.160 3.169 2.682 3.514 . 0 0 "[ . 1 . 2]" 1
1404 1 38 ILE MD 1 69 ARG HD2 . . 4.080 2.771 2.150 4.113 0.033 5 0 "[ . 1 . 2]" 1
1405 1 38 ILE MD 1 69 ARG QD . . 3.440 2.523 2.082 3.008 . 0 0 "[ . 1 . 2]" 1
1406 1 38 ILE MD 1 69 ARG HD3 . . 4.080 3.181 2.722 3.839 . 0 0 "[ . 1 . 2]" 1
1407 1 38 ILE MD 1 69 ARG QG . . 4.570 3.940 3.631 4.366 . 0 0 "[ . 1 . 2]" 1
1408 1 38 ILE HG12 1 52 MET HG2 . . 3.870 2.539 2.257 3.369 . 0 0 "[ . 1 . 2]" 1
1409 1 38 ILE HG12 1 52 MET HG3 . . 4.530 3.773 2.394 4.203 . 0 0 "[ . 1 . 2]" 1
1410 1 38 ILE HG12 1 53 GLY H . . 4.870 3.802 3.719 3.920 . 0 0 "[ . 1 . 2]" 1
1411 1 38 ILE HG12 1 53 GLY HA2 . . 3.650 2.142 2.089 2.176 . 0 0 "[ . 1 . 2]" 1
1412 1 38 ILE HG12 1 53 GLY HA3 . . 3.860 3.789 3.746 3.842 . 0 0 "[ . 1 . 2]" 1
1413 1 38 ILE HG12 1 54 VAL H . . 4.880 4.422 4.153 4.581 . 0 0 "[ . 1 . 2]" 1
1414 1 38 ILE HG13 1 39 PRO HA . . 4.860 4.560 4.442 4.701 . 0 0 "[ . 1 . 2]" 1
1415 1 38 ILE HG13 1 39 PRO HD2 . . 4.190 3.738 3.598 3.817 . 0 0 "[ . 1 . 2]" 1
1416 1 38 ILE HG13 1 39 PRO HD3 . . 5.060 4.848 4.750 4.918 . 0 0 "[ . 1 . 2]" 1
1417 1 38 ILE HG13 1 52 MET HG2 . . 3.630 2.619 2.439 2.769 . 0 0 "[ . 1 . 2]" 1
1418 1 38 ILE HG13 1 53 GLY HA2 . . 4.110 3.886 3.823 3.914 . 0 0 "[ . 1 . 2]" 1
1419 1 38 ILE MG 1 39 PRO HD2 . . 3.580 3.358 3.270 3.430 . 0 0 "[ . 1 . 2]" 1
1420 1 38 ILE MG 1 39 PRO HD3 . . 4.650 4.054 3.966 4.158 . 0 0 "[ . 1 . 2]" 1
1421 1 38 ILE MG 1 53 GLY H . . 5.410 5.211 5.019 5.354 . 0 0 "[ . 1 . 2]" 1
1422 1 38 ILE MG 1 53 GLY HA2 . . 4.210 2.762 2.550 2.916 . 0 0 "[ . 1 . 2]" 1
1423 1 38 ILE MG 1 53 GLY HA3 . . 4.460 4.047 3.847 4.203 . 0 0 "[ . 1 . 2]" 1
1424 1 38 ILE MG 1 54 VAL H . . 3.860 3.475 3.220 3.654 . 0 0 "[ . 1 . 2]" 1
1425 1 38 ILE MG 1 54 VAL HB . . 4.400 4.298 3.963 4.411 0.011 6 0 "[ . 1 . 2]" 1
1426 1 39 PRO HA 1 40 PHE H . . 2.760 2.249 2.174 2.430 . 0 0 "[ . 1 . 2]" 1
1427 1 39 PRO HA 1 40 PHE HB2 . . 4.550 4.567 4.484 4.603 0.053 4 0 "[ . 1 . 2]" 1
1428 1 39 PRO HA 1 40 PHE QD . . 4.190 3.442 3.109 3.866 . 0 0 "[ . 1 . 2]" 1
1429 1 39 PRO HB2 1 40 PHE H . . 3.850 3.047 2.602 3.407 . 0 0 "[ . 1 . 2]" 1
1430 1 39 PRO HB2 1 40 PHE HA . . 5.180 4.895 4.721 5.107 . 0 0 "[ . 1 . 2]" 1
1431 1 39 PRO HB3 1 40 PHE H . . 4.110 3.779 3.583 3.964 . 0 0 "[ . 1 . 2]" 1
1432 1 39 PRO QG 1 40 PHE H . . 5.500 4.384 4.084 4.595 . 0 0 "[ . 1 . 2]" 1
1433 1 40 PHE H 1 40 PHE HB2 . . 2.960 2.358 2.293 2.407 . 0 0 "[ . 1 . 2]" 1
1434 1 40 PHE H 1 40 PHE HB3 . . 3.780 3.599 3.551 3.636 . 0 0 "[ . 1 . 2]" 1
1435 1 40 PHE H 1 40 PHE QD . . 3.300 2.290 2.093 2.514 . 0 0 "[ . 1 . 2]" 1
1436 1 40 PHE H 1 41 GLN H . . 4.890 4.663 4.575 4.729 . 0 0 "[ . 1 . 2]" 1
1437 1 40 PHE HA 1 40 PHE QD . . 3.510 3.120 3.032 3.226 . 0 0 "[ . 1 . 2]" 1
1438 1 40 PHE HA 1 41 GLN H . . 3.050 2.205 2.082 2.366 . 0 0 "[ . 1 . 2]" 1
1439 1 40 PHE HA 1 42 ASN H . . 4.430 3.995 3.735 4.222 . 0 0 "[ . 1 . 2]" 1
1440 1 40 PHE HA 1 52 MET HB2 . . 4.690 4.288 3.749 4.696 0.006 4 0 "[ . 1 . 2]" 1
1441 1 40 PHE HA 1 52 MET HB3 . . 4.110 3.731 3.242 4.134 0.024 11 0 "[ . 1 . 2]" 1
1442 1 40 PHE HA 1 52 MET ME . . 4.100 3.556 3.161 4.106 0.006 9 0 "[ . 1 . 2]" 1
1443 1 40 PHE HA 1 52 MET HG2 . . 4.670 4.273 3.224 4.699 0.029 4 0 "[ . 1 . 2]" 1
1444 1 40 PHE HB2 1 41 GLN H . . 4.430 4.078 3.880 4.223 . 0 0 "[ . 1 . 2]" 1
1445 1 40 PHE HB2 1 41 GLN HA . . 5.500 5.482 5.343 5.554 0.054 16 0 "[ . 1 . 2]" 1
1446 1 40 PHE HB2 1 46 GLN HA . . 5.500 4.905 4.260 5.457 . 0 0 "[ . 1 . 2]" 1
1447 1 40 PHE HB2 1 46 GLN QB . . 4.640 3.040 2.559 3.590 . 0 0 "[ . 1 . 2]" 1
1448 1 40 PHE HB2 1 46 GLN QG . . 5.500 4.698 4.129 5.223 . 0 0 "[ . 1 . 2]" 1
1449 1 40 PHE HB3 1 41 GLN H . . 3.940 2.828 2.534 3.059 . 0 0 "[ . 1 . 2]" 1
1450 1 40 PHE HB3 1 41 GLN QB . . 4.920 4.885 4.760 4.971 0.051 5 0 "[ . 1 . 2]" 1
1451 1 40 PHE HB3 1 41 GLN HG2 . . 5.500 4.091 3.589 4.842 . 0 0 "[ . 1 . 2]" 1
1452 1 40 PHE HB3 1 41 GLN HG3 . . 5.500 5.164 4.077 5.589 0.089 9 0 "[ . 1 . 2]" 1
1453 1 40 PHE HB3 1 42 ASN H . . 4.480 2.371 2.144 2.852 . 0 0 "[ . 1 . 2]" 1
1454 1 40 PHE HB3 1 45 GLU HB3 . . 4.880 4.323 3.825 4.883 0.003 2 0 "[ . 1 . 2]" 1
1455 1 40 PHE HB3 1 45 GLU QG . . 5.500 4.849 3.689 5.527 0.027 12 0 "[ . 1 . 2]" 1
1456 1 40 PHE HB3 1 46 GLN HA . . 5.090 4.575 3.826 5.136 0.046 9 0 "[ . 1 . 2]" 1
1457 1 40 PHE HB3 1 46 GLN QB . . 5.020 3.354 2.703 3.906 . 0 0 "[ . 1 . 2]" 1
1458 1 40 PHE HB3 1 52 MET ME . . 4.450 4.079 3.544 4.452 0.002 4 0 "[ . 1 . 2]" 1
1459 1 40 PHE QD 1 41 GLN H . . 4.740 3.682 3.364 4.104 . 0 0 "[ . 1 . 2]" 1
1460 1 40 PHE QD 1 42 ASN H . . 4.610 3.864 3.646 4.274 . 0 0 "[ . 1 . 2]" 1
1461 1 40 PHE QD 1 45 GLU HB2 . . 3.920 3.064 2.473 3.930 0.010 6 0 "[ . 1 . 2]" 1
1462 1 40 PHE QD 1 45 GLU HB3 . . 3.810 3.021 2.362 3.830 0.020 19 0 "[ . 1 . 2]" 1
1463 1 40 PHE QD 1 46 GLN H . . 4.520 3.872 3.540 4.139 . 0 0 "[ . 1 . 2]" 1
1464 1 40 PHE QD 1 46 GLN HA . . 4.120 3.203 2.518 3.732 . 0 0 "[ . 1 . 2]" 1
1465 1 40 PHE QD 1 46 GLN HB2 . . 4.840 3.183 2.923 3.508 . 0 0 "[ . 1 . 2]" 1
1466 1 40 PHE QD 1 46 GLN QB . . 4.120 3.123 2.881 3.420 . 0 0 "[ . 1 . 2]" 1
1467 1 40 PHE QD 1 46 GLN HB3 . . 4.840 4.534 4.350 4.840 0.000 8 0 "[ . 1 . 2]" 1
1468 1 40 PHE QD 1 46 GLN QG . . 4.830 3.814 3.393 4.796 . 0 0 "[ . 1 . 2]" 1
1469 1 40 PHE QD 1 52 MET HB3 . . 4.850 3.588 3.284 3.813 . 0 0 "[ . 1 . 2]" 1
1470 1 40 PHE QD 1 52 MET ME . . 3.440 2.634 2.400 2.888 . 0 0 "[ . 1 . 2]" 1
1471 1 40 PHE QD 1 52 MET HG3 . . 5.500 5.332 5.069 5.521 0.021 11 0 "[ . 1 . 2]" 1
1472 1 40 PHE QE 1 46 GLN HA . . 4.330 2.600 2.355 2.954 . 0 0 "[ . 1 . 2]" 1
1473 1 40 PHE QE 1 46 GLN QB . . 5.340 3.695 3.258 4.120 . 0 0 "[ . 1 . 2]" 1
1474 1 40 PHE QE 1 46 GLN HE21 . . 4.510 3.266 2.634 4.184 . 0 0 "[ . 1 . 2]" 1
1475 1 40 PHE QE 1 46 GLN QE . . 3.960 2.958 2.546 3.603 . 0 0 "[ . 1 . 2]" 1
1476 1 40 PHE QE 1 46 GLN HE22 . . 4.510 3.517 2.975 4.002 . 0 0 "[ . 1 . 2]" 1
1477 1 40 PHE QE 1 46 GLN QG . . 5.070 3.218 2.860 4.359 . 0 0 "[ . 1 . 2]" 1
1478 1 40 PHE QE 1 47 ASP H . . 4.670 3.383 2.658 4.073 . 0 0 "[ . 1 . 2]" 1
1479 1 40 PHE QE 1 51 LEU HA . . 3.570 2.685 2.329 3.053 . 0 0 "[ . 1 . 2]" 1
1480 1 40 PHE QE 1 51 LEU QD . . 3.760 3.054 2.308 3.749 . 0 0 "[ . 1 . 2]" 1
1481 1 40 PHE QE 1 52 MET H . . 3.780 2.872 2.629 3.045 . 0 0 "[ . 1 . 2]" 1
1482 1 40 PHE QE 1 52 MET HB2 . . 4.330 3.068 2.851 3.286 . 0 0 "[ . 1 . 2]" 1
1483 1 40 PHE QE 1 52 MET HB3 . . 5.140 3.502 3.297 3.737 . 0 0 "[ . 1 . 2]" 1
1484 1 40 PHE QE 1 52 MET ME . . 3.590 2.572 2.253 2.935 . 0 0 "[ . 1 . 2]" 1
1485 1 40 PHE QE 1 52 MET HG3 . . 5.500 5.056 4.822 5.506 0.006 15 0 "[ . 1 . 2]" 1
1486 1 40 PHE QE 1 71 VAL MG1 . . 3.210 2.132 2.014 2.283 . 0 0 "[ . 1 . 2]" 1
1487 1 40 PHE HZ 1 46 GLN HA . . 4.120 3.435 2.862 4.084 . 0 0 "[ . 1 . 2]" 1
1488 1 40 PHE HZ 1 46 GLN QG . . 4.420 3.444 3.031 4.480 0.060 18 0 "[ . 1 . 2]" 1
1489 1 40 PHE HZ 1 50 TRP HB3 . . 4.940 3.488 3.015 3.931 . 0 0 "[ . 1 . 2]" 1
1490 1 40 PHE HZ 1 51 LEU QD . . 4.860 4.402 3.579 5.247 0.387 20 0 "[ . 1 . 2]" 1
1491 1 40 PHE HZ 1 52 MET H . . 4.760 3.702 3.224 4.349 . 0 0 "[ . 1 . 2]" 1
1492 1 40 PHE HZ 1 52 MET HB2 . . 4.750 3.153 2.797 3.399 . 0 0 "[ . 1 . 2]" 1
1493 1 40 PHE HZ 1 52 MET HB3 . . 5.060 4.187 3.712 4.563 . 0 0 "[ . 1 . 2]" 1
1494 1 40 PHE HZ 1 52 MET ME . . 4.130 3.900 3.438 4.143 0.013 5 0 "[ . 1 . 2]" 1
1495 1 40 PHE HZ 1 71 VAL MG1 . . 3.400 2.782 2.286 3.287 . 0 0 "[ . 1 . 2]" 1
1496 1 41 GLN H 1 41 GLN QB . . 3.140 2.525 2.300 2.828 . 0 0 "[ . 1 . 2]" 1
1497 1 41 GLN H 1 41 GLN QE . . 4.670 3.523 2.176 4.680 0.010 5 0 "[ . 1 . 2]" 1
1498 1 41 GLN H 1 41 GLN HG2 . . 4.500 2.534 1.858 3.406 . 0 0 "[ . 1 . 2]" 1
1499 1 41 GLN H 1 41 GLN QG . . 3.880 2.456 1.843 3.061 . 0 0 "[ . 1 . 2]" 1
1500 1 41 GLN H 1 41 GLN HG3 . . 4.500 3.505 2.851 3.818 . 0 0 "[ . 1 . 2]" 1
1501 1 41 GLN H 1 42 ASN H . . 3.350 2.771 2.533 2.935 . 0 0 "[ . 1 . 2]" 1
1502 1 41 GLN H 1 45 GLU HB3 . . 5.410 4.983 4.278 5.429 0.019 9 0 "[ . 1 . 2]" 1
1503 1 41 GLN H 1 52 MET ME . . 4.470 3.586 2.728 4.425 . 0 0 "[ . 1 . 2]" 1
1504 1 41 GLN HA 1 42 ASN HA . . 4.950 4.556 4.426 4.673 . 0 0 "[ . 1 . 2]" 1
1505 1 41 GLN HA 1 42 ASN HB2 . . 5.500 5.195 4.862 5.506 0.006 12 0 "[ . 1 . 2]" 1
1506 1 41 GLN QB 1 42 ASN H . . 3.750 3.696 3.610 3.764 0.014 1 0 "[ . 1 . 2]" 1
1507 1 41 GLN QB 1 42 ASN HA . . 4.900 4.885 4.777 4.956 0.056 16 0 "[ . 1 . 2]" 1
1508 1 41 GLN QE 1 52 MET ME . . 4.330 2.808 1.812 4.342 0.012 5 0 "[ . 1 . 2]" 1
1509 1 41 GLN QE 1 69 ARG QD . . 4.370 3.915 2.833 4.404 0.034 12 0 "[ . 1 . 2]" 1
1510 1 41 GLN QE 1 69 ARG QG . . 5.180 4.492 3.125 5.190 0.010 10 0 "[ . 1 . 2]" 1
1511 1 41 GLN QG 1 42 ASN H . . 4.410 2.632 2.400 3.015 . 0 0 "[ . 1 . 2]" 1
1512 1 41 GLN QG 1 42 ASN HA . . 4.600 4.425 4.098 4.614 0.014 5 0 "[ . 1 . 2]" 1
1513 1 41 GLN QG 1 42 ASN HB2 . . 4.170 2.858 2.309 3.230 . 0 0 "[ . 1 . 2]" 1
1514 1 41 GLN HG2 1 42 ASN H . . 5.030 2.874 2.470 3.586 . 0 0 "[ . 1 . 2]" 1
1515 1 41 GLN HG3 1 42 ASN H . . 5.030 3.594 2.438 4.375 . 0 0 "[ . 1 . 2]" 1
1516 1 42 ASN H 1 42 ASN HB2 . . 3.330 2.857 2.546 3.067 . 0 0 "[ . 1 . 2]" 1
1517 1 42 ASN H 1 42 ASN HB3 . . 3.730 3.698 3.365 3.776 0.046 17 0 "[ . 1 . 2]" 1
1518 1 42 ASN H 1 43 PRO HD3 . . 5.220 4.800 4.715 4.964 . 0 0 "[ . 1 . 2]" 1
1519 1 42 ASN H 1 45 GLU H . . 4.590 4.112 3.837 4.531 . 0 0 "[ . 1 . 2]" 1
1520 1 42 ASN H 1 45 GLU HB3 . . 4.840 4.273 3.629 4.846 0.006 9 0 "[ . 1 . 2]" 1
1521 1 42 ASN H 1 45 GLU QG . . 5.050 3.659 2.984 4.457 . 0 0 "[ . 1 . 2]" 1
1522 1 42 ASN H 1 52 MET ME . . 5.500 4.951 4.256 5.432 . 0 0 "[ . 1 . 2]" 1
1523 1 42 ASN HA 1 43 PRO HA . . 4.590 4.453 4.356 4.573 . 0 0 "[ . 1 . 2]" 1
1524 1 42 ASN HA 1 43 PRO QB . . 4.950 4.607 4.510 4.699 . 0 0 "[ . 1 . 2]" 1
1525 1 42 ASN HA 1 43 PRO HD2 . . 2.870 2.434 2.288 2.666 . 0 0 "[ . 1 . 2]" 1
1526 1 42 ASN HA 1 43 PRO HD3 . . 2.850 2.366 2.318 2.443 . 0 0 "[ . 1 . 2]" 1
1527 1 42 ASN HA 1 43 PRO HG3 . . 4.550 4.561 4.503 4.593 0.043 5 0 "[ . 1 . 2]" 1
1528 1 42 ASN HA 1 44 GLU H . . 4.580 4.271 4.053 4.500 . 0 0 "[ . 1 . 2]" 1
1529 1 42 ASN HA 1 44 GLU HG2 . . 5.500 4.814 4.323 5.305 . 0 0 "[ . 1 . 2]" 1
1530 1 42 ASN HA 1 45 GLU QG . . 4.890 4.659 4.225 4.922 0.032 11 0 "[ . 1 . 2]" 1
1531 1 42 ASN HB2 1 42 ASN QD . . 3.440 2.290 2.135 2.699 . 0 0 "[ . 1 . 2]" 1
1532 1 42 ASN HB2 1 43 PRO HD2 . . 3.870 3.917 3.886 3.957 0.087 10 0 "[ . 1 . 2]" 1
1533 1 42 ASN HB2 1 43 PRO HD3 . . 4.950 4.897 4.746 4.961 0.011 11 0 "[ . 1 . 2]" 1
1534 1 42 ASN HB2 1 45 GLU H . . 4.350 3.403 2.669 4.042 . 0 0 "[ . 1 . 2]" 1
1535 1 42 ASN HB2 1 45 GLU HB2 . . 3.740 3.010 2.247 3.650 . 0 0 "[ . 1 . 2]" 1
1536 1 42 ASN HB2 1 45 GLU HB3 . . 4.670 4.301 3.815 4.692 0.022 1 0 "[ . 1 . 2]" 1
1537 1 42 ASN HB2 1 45 GLU QG . . 3.460 2.213 2.071 2.416 . 0 0 "[ . 1 . 2]" 1
1538 1 42 ASN HB3 1 43 PRO HA . . 5.140 4.803 4.491 4.950 . 0 0 "[ . 1 . 2]" 1
1539 1 42 ASN HB3 1 43 PRO HD2 . . 4.000 2.573 2.434 2.983 . 0 0 "[ . 1 . 2]" 1
1540 1 42 ASN HB3 1 43 PRO HD3 . . 4.150 3.932 3.797 4.176 0.026 19 0 "[ . 1 . 2]" 1
1541 1 42 ASN HB3 1 44 GLU H . . 4.380 2.723 2.441 3.053 . 0 0 "[ . 1 . 2]" 1
1542 1 42 ASN HB3 1 44 GLU HG3 . . 5.260 2.959 2.380 3.957 . 0 0 "[ . 1 . 2]" 1
1543 1 42 ASN HB3 1 45 GLU H . . 4.210 2.724 2.411 3.018 . 0 0 "[ . 1 . 2]" 1
1544 1 42 ASN HB3 1 45 GLU HA . . 5.050 5.015 4.610 5.112 0.062 15 0 "[ . 1 . 2]" 1
1545 1 42 ASN HB3 1 45 GLU HB2 . . 3.940 3.579 2.921 3.952 0.012 3 0 "[ . 1 . 2]" 1
1546 1 42 ASN HB3 1 45 GLU HB3 . . 5.170 5.038 4.366 5.213 0.043 8 0 "[ . 1 . 2]" 1
1547 1 42 ASN HB3 1 45 GLU QG . . 3.510 2.775 2.309 3.450 . 0 0 "[ . 1 . 2]" 1
1548 1 42 ASN QD 1 45 GLU QG . . 4.020 3.076 2.341 3.339 . 0 0 "[ . 1 . 2]" 1
1549 1 42 ASN HD21 1 45 GLU QG . . 4.820 3.126 2.360 3.404 . 0 0 "[ . 1 . 2]" 1
1550 1 42 ASN HD22 1 45 GLU QG . . 4.820 4.591 3.792 4.837 0.017 1 0 "[ . 1 . 2]" 1
1551 1 43 PRO HA 1 45 GLU H . . 4.650 3.977 3.761 4.310 . 0 0 "[ . 1 . 2]" 1
1552 1 43 PRO HA 1 46 GLN H . . 4.070 3.611 3.191 3.965 . 0 0 "[ . 1 . 2]" 1
1553 1 43 PRO HA 1 46 GLN HB2 . . 4.380 3.757 3.304 4.319 . 0 0 "[ . 1 . 2]" 1
1554 1 43 PRO HA 1 46 GLN QB . . 3.830 3.116 2.604 3.480 . 0 0 "[ . 1 . 2]" 1
1555 1 43 PRO HA 1 46 GLN HB3 . . 4.380 3.346 2.725 3.694 . 0 0 "[ . 1 . 2]" 1
1556 1 43 PRO HA 1 46 GLN QG . . 5.220 5.016 4.606 5.253 0.033 12 0 "[ . 1 . 2]" 1
1557 1 43 PRO QB 1 44 GLU H . . 3.940 3.264 3.109 3.384 . 0 0 "[ . 1 . 2]" 1
1558 1 43 PRO HB2 1 44 GLU H . . 4.530 3.412 3.236 3.557 . 0 0 "[ . 1 . 2]" 1
1559 1 43 PRO HB3 1 44 GLU H . . 4.530 4.163 4.020 4.239 . 0 0 "[ . 1 . 2]" 1
1560 1 43 PRO HD2 1 44 GLU H . . 3.640 2.607 2.330 2.752 . 0 0 "[ . 1 . 2]" 1
1561 1 43 PRO HD2 1 44 GLU HG2 . . 3.650 3.245 2.748 3.563 . 0 0 "[ . 1 . 2]" 1
1562 1 43 PRO HD2 1 44 GLU HG3 . . 5.130 4.652 4.040 5.133 0.003 7 0 "[ . 1 . 2]" 1
1563 1 43 PRO HD3 1 44 GLU H . . 4.410 3.843 3.660 3.937 . 0 0 "[ . 1 . 2]" 1
1564 1 43 PRO HG2 1 44 GLU H . . 3.080 2.294 2.098 2.423 . 0 0 "[ . 1 . 2]" 1
1565 1 43 PRO HG3 1 44 GLU H . . 3.920 3.853 3.638 3.938 0.018 15 0 "[ . 1 . 2]" 1
1566 1 44 GLU H 1 44 GLU QB . . 3.250 2.580 2.433 2.719 . 0 0 "[ . 1 . 2]" 1
1567 1 44 GLU H 1 44 GLU HG2 . . 3.460 2.087 1.803 2.363 . 0 0 "[ . 1 . 2]" 1
1568 1 44 GLU H 1 44 GLU HG3 . . 3.410 3.102 2.588 3.414 0.004 4 0 "[ . 1 . 2]" 1
1569 1 44 GLU H 1 45 GLU H . . 3.060 2.694 2.554 2.843 . 0 0 "[ . 1 . 2]" 1
1570 1 44 GLU H 1 46 GLN H . . 4.330 4.258 4.102 4.371 0.041 3 0 "[ . 1 . 2]" 1
1571 1 44 GLU HA 1 44 GLU HG3 . . 4.180 3.773 3.625 3.850 . 0 0 "[ . 1 . 2]" 1
1572 1 44 GLU HA 1 46 GLN H . . 4.450 3.983 3.640 4.308 . 0 0 "[ . 1 . 2]" 1
1573 1 44 GLU QB 1 45 GLU H . . 4.180 3.792 3.633 3.910 . 0 0 "[ . 1 . 2]" 1
1574 1 44 GLU HG2 1 45 GLU H . . 4.560 3.401 2.896 3.829 . 0 0 "[ . 1 . 2]" 1
1575 1 44 GLU HG3 1 45 GLU H . . 3.190 3.007 2.633 3.215 0.025 17 0 "[ . 1 . 2]" 1
1576 1 44 GLU HG3 1 45 GLU HA . . 4.520 3.966 3.601 4.527 0.007 8 0 "[ . 1 . 2]" 1
1577 1 45 GLU H 1 45 GLU HB2 . . 3.000 2.385 2.208 2.536 . 0 0 "[ . 1 . 2]" 1
1578 1 45 GLU H 1 45 GLU HB3 . . 3.690 3.603 3.502 3.658 . 0 0 "[ . 1 . 2]" 1
1579 1 45 GLU H 1 45 GLU QG . . 3.320 2.692 2.285 3.333 0.013 19 0 "[ . 1 . 2]" 1
1580 1 45 GLU H 1 46 GLN H . . 3.040 2.377 2.193 2.538 . 0 0 "[ . 1 . 2]" 1
1581 1 45 GLU H 1 46 GLN QB . . 4.570 4.105 3.935 4.271 . 0 0 "[ . 1 . 2]" 1
1582 1 45 GLU H 2 12 ARG QG . . 5.500 5.000 3.792 5.532 0.032 6 0 "[ . 1 . 2]" 1
1583 1 45 GLU HA 1 45 GLU QG . . 3.050 2.670 2.086 3.050 . 0 0 "[ . 1 . 2]" 1
1584 1 45 GLU HA 1 46 GLN HA . . 4.930 4.778 4.611 4.926 . 0 0 "[ . 1 . 2]" 1
1585 1 45 GLU HA 2 12 ARG QB . . 5.340 4.204 2.404 5.356 0.016 2 0 "[ . 1 . 2]" 1
1586 1 45 GLU HA 2 12 ARG QD . . 5.070 3.782 1.961 5.078 0.008 14 0 "[ . 1 . 2]" 1
1587 1 45 GLU HA 2 12 ARG QG . . 5.310 3.475 2.225 4.551 . 0 0 "[ . 1 . 2]" 1
1588 1 45 GLU HB2 1 46 GLN H . . 4.020 3.122 2.858 3.528 . 0 0 "[ . 1 . 2]" 1
1589 1 45 GLU HB3 1 46 GLN H . . 3.900 3.892 3.634 3.961 0.061 16 0 "[ . 1 . 2]" 1
1590 1 45 GLU HB3 1 46 GLN HA . . 4.880 4.498 4.099 4.782 . 0 0 "[ . 1 . 2]" 1
1591 1 45 GLU QG 1 46 GLN H . . 4.510 4.366 4.133 4.551 0.041 19 0 "[ . 1 . 2]" 1
1592 1 45 GLU QG 2 12 ARG QD . . 5.120 3.836 2.068 5.130 0.010 11 0 "[ . 1 . 2]" 1
1593 1 46 GLN H 1 46 GLN HB2 . . 3.280 2.644 2.489 2.898 . 0 0 "[ . 1 . 2]" 1
1594 1 46 GLN H 1 46 GLN HB3 . . 3.280 2.445 2.304 2.538 . 0 0 "[ . 1 . 2]" 1
1595 1 46 GLN H 1 46 GLN QG . . 4.000 3.986 3.943 4.024 0.024 16 0 "[ . 1 . 2]" 1
1596 1 46 GLN HA 1 46 GLN QE . . 4.660 4.497 3.302 4.682 0.022 1 0 "[ . 1 . 2]" 1
1597 1 46 GLN HA 1 46 GLN QG . . 3.190 2.492 2.307 3.198 0.008 3 0 "[ . 1 . 2]" 1
1598 1 46 GLN HA 1 47 ASP H . . 2.940 2.088 1.998 2.231 . 0 0 "[ . 1 . 2]" 1
1599 1 46 GLN HA 1 47 ASP HA . . 4.640 4.396 4.333 4.453 . 0 0 "[ . 1 . 2]" 1
1600 1 46 GLN HA 1 47 ASP HB2 . . 5.500 4.412 3.978 5.340 . 0 0 "[ . 1 . 2]" 1
1601 1 46 GLN HA 1 47 ASP HB3 . . 5.500 5.520 5.384 5.580 0.080 9 0 "[ . 1 . 2]" 1
1602 1 46 GLN HA 1 71 VAL MG1 . . 4.830 3.974 3.469 4.611 . 0 0 "[ . 1 . 2]" 1
1603 1 46 GLN QB 1 46 GLN QE . . 3.980 3.602 3.485 3.660 . 0 0 "[ . 1 . 2]" 1
1604 1 46 GLN HB2 1 47 ASP H . . 4.390 4.122 3.809 4.328 . 0 0 "[ . 1 . 2]" 1
1605 1 46 GLN HB3 1 47 ASP H . . 4.390 4.221 3.777 4.422 0.032 5 0 "[ . 1 . 2]" 1
1606 1 46 GLN QE 1 51 LEU QD . . 3.490 3.344 2.878 3.595 0.105 9 0 "[ . 1 . 2]" 1
1607 1 46 GLN HE22 1 46 GLN QG . . 3.650 3.258 3.232 3.315 . 0 0 "[ . 1 . 2]" 1
1608 1 46 GLN QG 1 47 ASP H . . 3.830 2.676 2.037 3.093 . 0 0 "[ . 1 . 2]" 1
1609 1 46 GLN QG 1 47 ASP HB2 . . 5.500 4.779 4.342 5.060 . 0 0 "[ . 1 . 2]" 1
1610 1 46 GLN QG 1 47 ASP QB . . 4.830 4.480 4.141 4.673 . 0 0 "[ . 1 . 2]" 1
1611 1 46 GLN QG 1 47 ASP HB3 . . 5.500 5.425 5.140 5.535 0.035 19 0 "[ . 1 . 2]" 1
1612 1 46 GLN QG 1 48 GLU HA . . 4.410 4.231 3.790 4.469 0.059 13 0 "[ . 1 . 2]" 1
1613 1 47 ASP H 1 47 ASP HB2 . . 3.930 2.603 2.344 3.206 . 0 0 "[ . 1 . 2]" 1
1614 1 47 ASP H 1 47 ASP QB . . 3.400 2.541 2.314 2.969 . 0 0 "[ . 1 . 2]" 1
1615 1 47 ASP H 1 47 ASP HB3 . . 3.930 3.631 3.505 3.844 . 0 0 "[ . 1 . 2]" 1
1616 1 47 ASP H 1 50 TRP H . . 4.850 4.677 4.147 4.887 0.037 19 0 "[ . 1 . 2]" 1
1617 1 47 ASP H 1 50 TRP HB2 . . 4.810 3.135 2.694 3.472 . 0 0 "[ . 1 . 2]" 1
1618 1 47 ASP H 1 50 TRP HB3 . . 4.570 4.220 3.911 4.562 . 0 0 "[ . 1 . 2]" 1
1619 1 47 ASP HA 1 48 GLU H . . 2.840 2.283 2.134 2.377 . 0 0 "[ . 1 . 2]" 1
1620 1 47 ASP HA 1 48 GLU QB . . 4.550 4.034 3.892 4.183 . 0 0 "[ . 1 . 2]" 1
1621 1 47 ASP HA 1 50 TRP HD1 . . 5.250 4.672 4.457 5.067 . 0 0 "[ . 1 . 2]" 1
1622 1 47 ASP QB 1 48 GLU H . . 3.690 2.917 2.586 3.347 . 0 0 "[ . 1 . 2]" 1
1623 1 47 ASP QB 1 50 TRP H . . 4.430 3.914 3.534 4.225 . 0 0 "[ . 1 . 2]" 1
1624 1 47 ASP QB 1 50 TRP HB2 . . 3.880 2.505 2.164 2.961 . 0 0 "[ . 1 . 2]" 1
1625 1 47 ASP QB 1 50 TRP HB3 . . 4.120 3.464 3.133 3.933 . 0 0 "[ . 1 . 2]" 1
1626 1 47 ASP QB 1 50 TRP HD1 . . 3.290 2.654 2.383 3.007 . 0 0 "[ . 1 . 2]" 1
1627 1 47 ASP QB 1 50 TRP HE1 . . 4.590 3.797 3.481 4.319 . 0 0 "[ . 1 . 2]" 1
1628 1 47 ASP QB 1 71 VAL MG1 . . 4.810 4.041 3.742 4.636 . 0 0 "[ . 1 . 2]" 1
1629 1 47 ASP QB 2 9 ARG HA . . 3.660 2.544 2.064 3.105 . 0 0 "[ . 1 . 2]" 1
1630 1 47 ASP QB 2 9 ARG QB . . 4.210 3.217 2.065 3.673 . 0 0 "[ . 1 . 2]" 1
1631 1 47 ASP QB 2 9 ARG QG . . 4.080 2.775 2.194 3.945 . 0 0 "[ . 1 . 2]" 1
1632 1 47 ASP QB 2 10 ARG H . . 5.050 3.261 2.196 4.001 . 0 0 "[ . 1 . 2]" 1
1633 1 47 ASP QB 2 10 ARG QB . . 5.340 4.624 3.748 5.391 0.051 7 0 "[ . 1 . 2]" 1
1634 1 47 ASP QB 2 10 ARG QD . . 5.340 4.581 3.284 5.373 0.033 20 0 "[ . 1 . 2]" 1
1635 1 47 ASP QB 2 10 ARG QG . . 4.550 3.872 2.810 4.574 0.024 10 0 "[ . 1 . 2]" 1
1636 1 47 ASP HB2 1 48 GLU H . . 4.430 4.085 3.586 4.371 . 0 0 "[ . 1 . 2]" 1
1637 1 47 ASP HB2 1 50 TRP HB2 . . 4.470 2.601 2.185 3.346 . 0 0 "[ . 1 . 2]" 1
1638 1 47 ASP HB2 1 50 TRP HD1 . . 3.840 3.341 2.511 3.816 . 0 0 "[ . 1 . 2]" 1
1639 1 47 ASP HB2 1 71 VAL MG1 . . 5.500 4.163 3.826 4.971 . 0 0 "[ . 1 . 2]" 1
1640 1 47 ASP HB2 1 71 VAL MG2 . . 5.500 4.222 3.699 4.976 . 0 0 "[ . 1 . 2]" 1
1641 1 47 ASP HB2 2 9 ARG HA . . 4.230 3.871 3.277 4.253 0.023 16 0 "[ . 1 . 2]" 1
1642 1 47 ASP HB2 2 9 ARG HB2 . . 5.500 5.411 3.145 5.598 0.098 14 0 "[ . 1 . 2]" 1
1643 1 47 ASP HB2 2 9 ARG HB3 . . 5.500 4.033 2.993 4.469 . 0 0 "[ . 1 . 2]" 1
1644 1 47 ASP HB2 2 9 ARG HG2 . . 5.500 3.476 2.732 5.018 . 0 0 "[ . 1 . 2]" 1
1645 1 47 ASP HB2 2 9 ARG HG3 . . 5.500 4.729 3.752 5.524 0.024 14 0 "[ . 1 . 2]" 1
1646 1 47 ASP HB3 1 48 GLU H . . 4.430 2.997 2.619 3.509 . 0 0 "[ . 1 . 2]" 1
1647 1 47 ASP HB3 1 50 TRP HB2 . . 4.470 3.509 3.054 4.068 . 0 0 "[ . 1 . 2]" 1
1648 1 47 ASP HB3 1 50 TRP HD1 . . 3.840 2.914 2.415 3.855 0.015 19 0 "[ . 1 . 2]" 1
1649 1 47 ASP HB3 1 71 VAL MG1 . . 5.500 5.517 5.290 5.574 0.074 14 0 "[ . 1 . 2]" 1
1650 1 47 ASP HB3 1 71 VAL MG2 . . 5.500 5.288 4.877 5.527 0.027 20 0 "[ . 1 . 2]" 1
1651 1 47 ASP HB3 2 9 ARG HA . . 4.230 2.592 2.084 3.231 . 0 0 "[ . 1 . 2]" 1
1652 1 47 ASP HB3 2 9 ARG HB2 . . 5.500 4.770 2.395 5.517 0.017 5 0 "[ . 1 . 2]" 1
1653 1 47 ASP HB3 2 9 ARG HB3 . . 5.500 3.562 2.403 4.374 . 0 0 "[ . 1 . 2]" 1
1654 1 47 ASP HB3 2 9 ARG HG2 . . 5.500 3.226 2.296 5.051 . 0 0 "[ . 1 . 2]" 1
1655 1 47 ASP HB3 2 9 ARG HG3 . . 5.500 4.140 2.932 5.067 . 0 0 "[ . 1 . 2]" 1
1656 1 48 GLU H 1 48 GLU HB2 . . 3.320 2.588 2.419 2.887 . 0 0 "[ . 1 . 2]" 1
1657 1 48 GLU H 1 48 GLU QB . . 2.690 2.239 2.175 2.300 . 0 0 "[ . 1 . 2]" 1
1658 1 48 GLU H 1 48 GLU HB3 . . 3.320 2.468 2.347 2.593 . 0 0 "[ . 1 . 2]" 1
1659 1 48 GLU H 1 48 GLU QG . . 4.160 4.017 3.965 4.083 . 0 0 "[ . 1 . 2]" 1
1660 1 48 GLU H 1 50 TRP H . . 4.950 4.485 4.279 4.695 . 0 0 "[ . 1 . 2]" 1
1661 1 48 GLU H 1 50 TRP HD1 . . 5.040 3.885 3.381 4.465 . 0 0 "[ . 1 . 2]" 1
1662 1 48 GLU HA 1 48 GLU QG . . 3.220 2.740 2.326 3.220 0.000 13 0 "[ . 1 . 2]" 1
1663 1 48 GLU HA 1 49 GLY H . . 2.780 2.170 2.131 2.217 . 0 0 "[ . 1 . 2]" 1
1664 1 48 GLU HA 1 49 GLY HA2 . . 4.510 4.424 4.374 4.490 . 0 0 "[ . 1 . 2]" 1
1665 1 48 GLU HA 1 50 TRP H . . 3.610 3.406 3.142 3.616 0.006 3 0 "[ . 1 . 2]" 1
1666 1 48 GLU QB 1 49 GLY H . . 4.210 3.802 3.621 3.955 . 0 0 "[ . 1 . 2]" 1
1667 1 48 GLU QG 1 49 GLY H . . 3.800 2.960 2.348 3.318 . 0 0 "[ . 1 . 2]" 1
1668 1 48 GLU QG 1 49 GLY HA2 . . 4.190 4.081 3.690 4.211 0.021 4 0 "[ . 1 . 2]" 1
1669 1 48 GLU QG 1 49 GLY HA3 . . 4.650 3.796 3.427 4.093 . 0 0 "[ . 1 . 2]" 1
1670 1 48 GLU QG 1 50 TRP H . . 5.010 4.849 4.595 5.017 0.007 10 0 "[ . 1 . 2]" 1
1671 1 49 GLY H 1 50 TRP H . . 3.110 2.643 2.394 2.840 . 0 0 "[ . 1 . 2]" 1
1672 1 49 GLY HA2 1 50 TRP HD1 . . 5.000 4.937 4.710 5.021 0.021 7 0 "[ . 1 . 2]" 1
1673 1 49 GLY HA2 2 7 PRO QG . . 4.260 3.794 3.449 4.136 . 0 0 "[ . 1 . 2]" 1
1674 1 49 GLY HA3 1 50 TRP HD1 . . 4.620 3.873 3.617 4.096 . 0 0 "[ . 1 . 2]" 1
1675 1 49 GLY HA3 2 7 PRO HB2 . . 4.140 3.559 3.085 4.044 . 0 0 "[ . 1 . 2]" 1
1676 1 49 GLY HA3 2 7 PRO HB3 . . 4.830 3.803 3.411 4.454 . 0 0 "[ . 1 . 2]" 1
1677 1 49 GLY HA3 2 7 PRO HG2 . . 3.670 3.119 2.460 3.454 . 0 0 "[ . 1 . 2]" 1
1678 1 49 GLY HA3 2 7 PRO HG3 . . 3.670 2.688 2.142 3.059 . 0 0 "[ . 1 . 2]" 1
1679 1 50 TRP H 1 50 TRP HB2 . . 3.600 2.381 2.311 2.434 . 0 0 "[ . 1 . 2]" 1
1680 1 50 TRP H 1 50 TRP HB3 . . 3.800 3.606 3.566 3.640 . 0 0 "[ . 1 . 2]" 1
1681 1 50 TRP H 1 50 TRP HD1 . . 3.490 2.665 2.524 2.929 . 0 0 "[ . 1 . 2]" 1
1682 1 50 TRP H 1 51 LEU QD . . 4.390 5.201 4.469 5.466 1.076 14 19 "[****-****** *+******]" 1
1683 1 50 TRP H 2 7 PRO HG2 . . 5.500 4.132 3.801 4.517 . 0 0 "[ . 1 . 2]" 1
1684 1 50 TRP H 2 7 PRO HG3 . . 5.500 4.864 4.538 5.293 . 0 0 "[ . 1 . 2]" 1
1685 1 50 TRP HA 1 50 TRP HD1 . . 4.490 3.781 3.659 3.847 . 0 0 "[ . 1 . 2]" 1
1686 1 50 TRP HA 1 50 TRP HE3 . . 4.780 3.632 3.471 3.777 . 0 0 "[ . 1 . 2]" 1
1687 1 50 TRP HA 1 51 LEU H . . 3.010 2.353 2.266 2.475 . 0 0 "[ . 1 . 2]" 1
1688 1 50 TRP HA 1 71 VAL HB . . 5.420 4.889 4.575 5.219 . 0 0 "[ . 1 . 2]" 1
1689 1 50 TRP HA 1 73 PRO HA . . 3.280 2.854 2.571 3.123 . 0 0 "[ . 1 . 2]" 1
1690 1 50 TRP HA 1 74 GLU H . . 3.680 2.766 2.496 3.028 . 0 0 "[ . 1 . 2]" 1
1691 1 50 TRP HA 1 74 GLU HA . . 5.500 5.246 4.955 5.512 0.012 4 0 "[ . 1 . 2]" 1
1692 1 50 TRP HA 1 74 GLU HG2 . . 5.210 4.298 3.833 4.652 . 0 0 "[ . 1 . 2]" 1
1693 1 50 TRP HA 2 7 PRO HD2 . . 5.480 4.592 4.487 4.797 . 0 0 "[ . 1 . 2]" 1
1694 1 50 TRP HA 2 7 PRO QG . . 4.650 3.788 3.450 4.122 . 0 0 "[ . 1 . 2]" 1
1695 1 50 TRP HB2 1 50 TRP HE1 . . 4.830 4.865 4.849 4.881 0.051 1 0 "[ . 1 . 2]" 1
1696 1 50 TRP HB2 1 50 TRP HE3 . . 4.180 4.018 3.962 4.068 . 0 0 "[ . 1 . 2]" 1
1697 1 50 TRP HB2 1 51 LEU H . . 4.310 3.835 3.684 3.985 . 0 0 "[ . 1 . 2]" 1
1698 1 50 TRP HB2 1 71 VAL HB . . 4.420 4.120 3.929 4.296 . 0 0 "[ . 1 . 2]" 1
1699 1 50 TRP HB2 1 71 VAL MG1 . . 4.390 4.360 4.222 4.412 0.022 6 0 "[ . 1 . 2]" 1
1700 1 50 TRP HB2 1 71 VAL MG2 . . 5.240 4.765 4.514 5.024 . 0 0 "[ . 1 . 2]" 1
1701 1 50 TRP HB3 1 50 TRP HE3 . . 3.880 2.499 2.451 2.534 . 0 0 "[ . 1 . 2]" 1
1702 1 50 TRP HB3 1 50 TRP HZ3 . . 4.980 4.952 4.901 4.987 0.007 13 0 "[ . 1 . 2]" 1
1703 1 50 TRP HB3 1 51 LEU H . . 3.450 2.550 2.328 2.740 . 0 0 "[ . 1 . 2]" 1
1704 1 50 TRP HB3 1 71 VAL HB . . 4.200 2.717 2.520 2.971 . 0 0 "[ . 1 . 2]" 1
1705 1 50 TRP HB3 1 71 VAL MG1 . . 4.260 3.678 3.489 3.825 . 0 0 "[ . 1 . 2]" 1
1706 1 50 TRP HB3 1 71 VAL MG2 . . 4.520 3.894 3.658 4.215 . 0 0 "[ . 1 . 2]" 1
1707 1 50 TRP HB3 1 72 PHE H . . 4.820 3.810 3.690 3.951 . 0 0 "[ . 1 . 2]" 1
1708 1 50 TRP HD1 1 73 PRO HA . . 5.500 5.292 4.919 5.506 0.006 19 0 "[ . 1 . 2]" 1
1709 1 50 TRP HD1 2 7 PRO HB2 . . 4.440 3.773 2.813 4.067 . 0 0 "[ . 1 . 2]" 1
1710 1 50 TRP HD1 2 7 PRO HB3 . . 5.400 5.190 4.280 5.419 0.019 9 0 "[ . 1 . 2]" 1
1711 1 50 TRP HD1 2 7 PRO HG2 . . 4.300 2.782 2.670 2.934 . 0 0 "[ . 1 . 2]" 1
1712 1 50 TRP HD1 2 7 PRO HG3 . . 4.300 4.278 4.175 4.330 0.030 18 0 "[ . 1 . 2]" 1
1713 1 50 TRP HD1 2 9 ARG HG2 . . 5.500 4.032 3.392 5.296 . 0 0 "[ . 1 . 2]" 1
1714 1 50 TRP HD1 2 9 ARG QG . . 4.640 3.648 3.284 4.291 . 0 0 "[ . 1 . 2]" 1
1715 1 50 TRP HD1 2 9 ARG HG3 . . 5.500 4.504 3.708 5.553 0.053 16 0 "[ . 1 . 2]" 1
1716 1 50 TRP HE1 2 6 ALA MB . . 4.240 4.248 4.219 4.272 0.032 5 0 "[ . 1 . 2]" 1
1717 1 50 TRP HE1 2 7 PRO HB2 . . 3.550 3.187 2.198 3.556 0.006 3 0 "[ . 1 . 2]" 1
1718 1 50 TRP HE1 2 7 PRO HB3 . . 5.080 4.537 3.859 4.760 . 0 0 "[ . 1 . 2]" 1
1719 1 50 TRP HE1 2 7 PRO HD2 . . 4.110 3.265 2.877 3.526 . 0 0 "[ . 1 . 2]" 1
1720 1 50 TRP HE1 2 7 PRO HG2 . . 4.260 2.571 2.413 2.997 . 0 0 "[ . 1 . 2]" 1
1721 1 50 TRP HE1 2 7 PRO HG3 . . 4.260 4.245 4.122 4.290 0.030 4 0 "[ . 1 . 2]" 1
1722 1 50 TRP HE1 2 8 PRO HA . . 4.690 4.160 3.963 4.467 . 0 0 "[ . 1 . 2]" 1
1723 1 50 TRP HE1 2 9 ARG H . . 4.880 4.457 3.965 4.771 . 0 0 "[ . 1 . 2]" 1
1724 1 50 TRP HE1 2 9 ARG HA . . 4.270 3.898 3.477 4.283 0.013 5 0 "[ . 1 . 2]" 1
1725 1 50 TRP HE1 2 9 ARG QB . . 4.990 4.404 2.682 4.682 . 0 0 "[ . 1 . 2]" 1
1726 1 50 TRP HE1 2 9 ARG QD . . 4.820 3.805 3.129 4.207 . 0 0 "[ . 1 . 2]" 1
1727 1 50 TRP HE1 2 9 ARG HG2 . . 4.140 3.164 2.388 4.168 0.028 18 0 "[ . 1 . 2]" 1
1728 1 50 TRP HE1 2 9 ARG HG3 . . 4.140 2.810 2.404 4.149 0.009 16 0 "[ . 1 . 2]" 1
1729 1 50 TRP HE3 1 51 LEU H . . 4.260 3.407 3.298 3.487 . 0 0 "[ . 1 . 2]" 1
1730 1 50 TRP HE3 1 71 VAL HA . . 4.420 3.895 3.801 4.015 . 0 0 "[ . 1 . 2]" 1
1731 1 50 TRP HE3 1 71 VAL HB . . 3.390 2.310 2.217 2.410 . 0 0 "[ . 1 . 2]" 1
1732 1 50 TRP HE3 1 71 VAL MG1 . . 4.420 3.969 3.885 4.064 . 0 0 "[ . 1 . 2]" 1
1733 1 50 TRP HE3 1 71 VAL MG2 . . 3.360 2.702 2.533 3.020 . 0 0 "[ . 1 . 2]" 1
1734 1 50 TRP HE3 1 72 PHE H . . 3.790 2.860 2.782 2.942 . 0 0 "[ . 1 . 2]" 1
1735 1 50 TRP HE3 1 72 PHE HA . . 4.210 3.047 2.982 3.108 . 0 0 "[ . 1 . 2]" 1
1736 1 50 TRP HE3 1 73 PRO HA . . 4.700 4.073 3.962 4.243 . 0 0 "[ . 1 . 2]" 1
1737 1 50 TRP HE3 1 73 PRO HD2 . . 4.900 4.831 4.729 4.911 0.011 11 0 "[ . 1 . 2]" 1
1738 1 50 TRP HE3 1 73 PRO HD3 . . 4.690 3.940 3.854 4.034 . 0 0 "[ . 1 . 2]" 1
1739 1 50 TRP HH2 1 71 VAL MG2 . . 4.950 4.428 4.328 4.620 . 0 0 "[ . 1 . 2]" 1
1740 1 50 TRP HH2 1 72 PHE HA . . 4.780 4.286 4.200 4.350 . 0 0 "[ . 1 . 2]" 1
1741 1 50 TRP HH2 1 73 PRO HA . . 5.500 5.258 5.059 5.402 . 0 0 "[ . 1 . 2]" 1
1742 1 50 TRP HH2 1 73 PRO HB3 . . 4.620 4.201 4.003 4.355 . 0 0 "[ . 1 . 2]" 1
1743 1 50 TRP HH2 1 73 PRO HD2 . . 4.720 4.547 4.404 4.696 . 0 0 "[ . 1 . 2]" 1
1744 1 50 TRP HH2 1 73 PRO HD3 . . 4.310 2.851 2.716 2.959 . 0 0 "[ . 1 . 2]" 1
1745 1 50 TRP HH2 1 73 PRO HG2 . . 5.500 5.488 5.333 5.527 0.027 12 0 "[ . 1 . 2]" 1
1746 1 50 TRP HH2 1 73 PRO HG3 . . 4.840 4.105 3.959 4.172 . 0 0 "[ . 1 . 2]" 1
1747 1 50 TRP HH2 2 6 ALA MB . . 3.360 2.735 2.524 2.978 . 0 0 "[ . 1 . 2]" 1
1748 1 50 TRP HH2 2 7 PRO HD2 . . 5.140 4.632 4.514 4.695 . 0 0 "[ . 1 . 2]" 1
1749 1 50 TRP HH2 2 9 ARG HD2 . . 5.060 3.700 3.100 4.515 . 0 0 "[ . 1 . 2]" 1
1750 1 50 TRP HH2 2 9 ARG HD3 . . 5.060 4.075 2.865 5.104 0.044 20 0 "[ . 1 . 2]" 1
1751 1 50 TRP HH2 2 9 ARG HG2 . . 5.440 5.028 3.885 5.475 0.035 12 0 "[ . 1 . 2]" 1
1752 1 50 TRP HH2 2 9 ARG HG3 . . 5.440 4.762 4.357 5.442 0.002 16 0 "[ . 1 . 2]" 1
1753 1 50 TRP HZ2 1 73 PRO HB3 . . 4.630 4.138 3.830 4.301 . 0 0 "[ . 1 . 2]" 1
1754 1 50 TRP HZ2 1 73 PRO HD3 . . 5.020 4.481 4.220 4.708 . 0 0 "[ . 1 . 2]" 1
1755 1 50 TRP HZ2 2 6 ALA MB . . 3.340 2.308 2.158 2.401 . 0 0 "[ . 1 . 2]" 1
1756 1 50 TRP HZ2 2 7 PRO HD2 . . 4.770 3.284 2.924 3.424 . 0 0 "[ . 1 . 2]" 1
1757 1 50 TRP HZ2 2 7 PRO HD3 . . 5.500 4.897 4.524 5.073 . 0 0 "[ . 1 . 2]" 1
1758 1 50 TRP HZ2 2 8 PRO HA . . 5.370 4.817 4.483 5.172 . 0 0 "[ . 1 . 2]" 1
1759 1 50 TRP HZ2 2 9 ARG QB . . 5.260 4.833 4.347 5.261 0.001 18 0 "[ . 1 . 2]" 1
1760 1 50 TRP HZ2 2 9 ARG HD2 . . 4.940 3.292 2.044 4.110 . 0 0 "[ . 1 . 2]" 1
1761 1 50 TRP HZ2 2 9 ARG QD . . 4.260 2.822 2.034 3.396 . 0 0 "[ . 1 . 2]" 1
1762 1 50 TRP HZ2 2 9 ARG HD3 . . 4.940 3.427 2.486 3.978 . 0 0 "[ . 1 . 2]" 1
1763 1 50 TRP HZ2 2 9 ARG HG2 . . 4.440 3.778 2.571 4.458 0.018 1 0 "[ . 1 . 2]" 1
1764 1 50 TRP HZ2 2 9 ARG QG . . 3.870 2.859 2.454 3.372 . 0 0 "[ . 1 . 2]" 1
1765 1 50 TRP HZ2 2 9 ARG HG3 . . 4.440 3.066 2.726 4.176 . 0 0 "[ . 1 . 2]" 1
1766 1 50 TRP HZ3 1 51 LEU H . . 5.500 5.517 5.459 5.543 0.043 9 0 "[ . 1 . 2]" 1
1767 1 50 TRP HZ3 1 71 VAL HA . . 5.170 5.145 5.038 5.206 0.036 11 0 "[ . 1 . 2]" 1
1768 1 50 TRP HZ3 1 71 VAL HB . . 4.460 4.129 3.967 4.352 . 0 0 "[ . 1 . 2]" 1
1769 1 50 TRP HZ3 1 71 VAL MG1 . . 5.400 5.266 5.180 5.391 . 0 0 "[ . 1 . 2]" 1
1770 1 50 TRP HZ3 1 71 VAL MG2 . . 3.580 2.859 2.759 3.029 . 0 0 "[ . 1 . 2]" 1
1771 1 50 TRP HZ3 1 72 PHE H . . 4.260 4.135 4.037 4.189 . 0 0 "[ . 1 . 2]" 1
1772 1 50 TRP HZ3 1 72 PHE HA . . 3.450 2.145 2.116 2.173 . 0 0 "[ . 1 . 2]" 1
1773 1 50 TRP HZ3 1 72 PHE HB2 . . 4.470 4.493 4.478 4.507 0.037 5 0 "[ . 1 . 2]" 1
1774 1 50 TRP HZ3 1 72 PHE HB3 . . 4.440 4.406 4.344 4.453 0.013 11 0 "[ . 1 . 2]" 1
1775 1 50 TRP HZ3 1 73 PRO HD2 . . 4.120 3.603 3.509 3.713 . 0 0 "[ . 1 . 2]" 1
1776 1 50 TRP HZ3 1 73 PRO HD3 . . 3.860 2.429 2.361 2.549 . 0 0 "[ . 1 . 2]" 1
1777 1 50 TRP HZ3 1 73 PRO HG3 . . 5.180 4.688 4.572 4.832 . 0 0 "[ . 1 . 2]" 1
1778 1 50 TRP HZ3 2 6 ALA MB . . 5.020 4.374 4.081 4.662 . 0 0 "[ . 1 . 2]" 1
1779 1 50 TRP HZ3 2 7 PRO HD2 . . 5.500 5.530 5.509 5.554 0.054 16 0 "[ . 1 . 2]" 1
1780 1 50 TRP HZ3 2 9 ARG QD . . 5.340 4.023 3.307 5.158 . 0 0 "[ . 1 . 2]" 1
1781 1 51 LEU H 1 51 LEU HB2 . . 3.440 2.673 2.439 2.756 . 0 0 "[ . 1 . 2]" 1
1782 1 51 LEU H 1 51 LEU HB3 . . 3.960 3.699 3.278 3.792 . 0 0 "[ . 1 . 2]" 1
1783 1 51 LEU H 1 51 LEU QD . . 4.560 3.889 3.520 3.982 . 0 0 "[ . 1 . 2]" 1
1784 1 51 LEU H 1 51 LEU HG . . 4.550 3.862 3.719 4.605 0.055 12 0 "[ . 1 . 2]" 1
1785 1 51 LEU H 1 71 VAL HA . . 4.540 4.261 4.019 4.432 . 0 0 "[ . 1 . 2]" 1
1786 1 51 LEU H 1 71 VAL HB . . 4.580 3.865 3.655 4.041 . 0 0 "[ . 1 . 2]" 1
1787 1 51 LEU H 1 71 VAL MG2 . . 5.500 5.131 4.978 5.314 . 0 0 "[ . 1 . 2]" 1
1788 1 51 LEU H 1 72 PHE H . . 3.430 2.820 2.648 2.931 . 0 0 "[ . 1 . 2]" 1
1789 1 51 LEU H 1 74 GLU HB3 . . 4.380 3.808 3.299 3.981 . 0 0 "[ . 1 . 2]" 1
1790 1 51 LEU HA 1 51 LEU MD1 . . 3.960 3.753 2.353 3.859 . 0 0 "[ . 1 . 2]" 1
1791 1 51 LEU HA 1 51 LEU QD . . 2.820 2.072 2.020 2.096 . 0 0 "[ . 1 . 2]" 1
1792 1 51 LEU HA 1 51 LEU MD2 . . 3.960 2.089 2.053 2.200 . 0 0 "[ . 1 . 2]" 1
1793 1 51 LEU HA 1 51 LEU HG . . 3.800 2.980 2.770 3.666 . 0 0 "[ . 1 . 2]" 1
1794 1 51 LEU HA 1 52 MET H . . 3.120 2.324 2.263 2.393 . 0 0 "[ . 1 . 2]" 1
1795 1 51 LEU HB2 1 51 LEU MD1 . . 3.350 2.368 2.312 3.177 . 0 0 "[ . 1 . 2]" 1
1796 1 51 LEU HB2 1 51 LEU QD . . 2.820 2.288 2.267 2.477 . 0 0 "[ . 1 . 2]" 1
1797 1 51 LEU HB2 1 51 LEU MD2 . . 3.350 3.239 2.584 3.282 . 0 0 "[ . 1 . 2]" 1
1798 1 51 LEU HB2 1 72 PHE H . . 4.780 4.213 3.992 4.490 . 0 0 "[ . 1 . 2]" 1
1799 1 51 LEU HB2 1 72 PHE HZ . . 4.530 3.713 3.478 4.187 . 0 0 "[ . 1 . 2]" 1
1800 1 51 LEU HB2 1 74 GLU H . . 4.780 3.786 3.547 3.829 . 0 0 "[ . 1 . 2]" 1
1801 1 51 LEU HB2 1 74 GLU HB3 . . 4.810 2.708 2.473 2.985 . 0 0 "[ . 1 . 2]" 1
1802 1 51 LEU HB3 1 51 LEU MD1 . . 3.460 2.322 2.240 2.380 . 0 0 "[ . 1 . 2]" 1
1803 1 51 LEU HB3 1 51 LEU QD . . 3.030 2.123 2.101 2.205 . 0 0 "[ . 1 . 2]" 1
1804 1 51 LEU HB3 1 51 LEU MD2 . . 3.460 2.482 2.388 3.284 . 0 0 "[ . 1 . 2]" 1
1805 1 51 LEU HB3 1 52 MET H . . 3.280 2.764 2.544 3.118 . 0 0 "[ . 1 . 2]" 1
1806 1 51 LEU HB3 1 72 PHE HZ . . 4.240 3.225 2.912 3.712 . 0 0 "[ . 1 . 2]" 1
1807 1 51 LEU HB3 1 74 GLU H . . 5.500 5.510 5.199 5.541 0.041 20 0 "[ . 1 . 2]" 1
1808 1 51 LEU HB3 1 74 GLU HB3 . . 4.410 4.222 4.066 4.415 0.005 13 0 "[ . 1 . 2]" 1
1809 1 51 LEU QD 1 52 MET H . . 3.500 2.814 2.264 3.002 . 0 0 "[ . 1 . 2]" 1
1810 1 51 LEU QD 1 52 MET HB3 . . 4.740 4.611 4.237 4.836 0.096 1 0 "[ . 1 . 2]" 1
1811 1 51 LEU QD 1 72 PHE QE . . 5.100 3.181 2.730 3.783 . 0 0 "[ . 1 . 2]" 1
1812 1 51 LEU QD 1 74 GLU H . . 4.460 4.255 4.071 4.508 0.048 18 0 "[ . 1 . 2]" 1
1813 1 51 LEU QD 1 74 GLU HA . . 4.040 3.304 2.821 4.111 0.071 12 0 "[ . 1 . 2]" 1
1814 1 51 LEU QD 1 74 GLU HB2 . . 3.610 2.355 2.205 3.010 . 0 0 "[ . 1 . 2]" 1
1815 1 51 LEU QD 1 74 GLU HB3 . . 3.430 2.543 2.319 2.783 . 0 0 "[ . 1 . 2]" 1
1816 1 51 LEU QD 1 74 GLU HG2 . . 4.180 4.399 4.138 4.622 0.442 18 0 "[ . 1 . 2]" 1
1817 1 51 LEU QD 1 74 GLU HG3 . . 4.200 4.217 4.101 4.352 0.152 16 0 "[ . 1 . 2]" 1
1818 1 51 LEU QD 1 77 THR HG1 . . 5.440 4.495 3.752 5.581 0.141 12 0 "[ . 1 . 2]" 1
1819 1 51 LEU MD1 1 74 GLU HB3 . . 4.780 2.676 2.385 4.473 . 0 0 "[ . 1 . 2]" 1
1820 1 51 LEU MD2 1 74 GLU HB3 . . 4.780 4.044 2.327 4.598 . 0 0 "[ . 1 . 2]" 1
1821 1 51 LEU HG 1 52 MET H . . 5.500 4.706 4.517 4.832 . 0 0 "[ . 1 . 2]" 1
1822 1 51 LEU HG 1 74 GLU H . . 5.500 4.393 4.136 5.109 . 0 0 "[ . 1 . 2]" 1
1823 1 51 LEU HG 1 74 GLU HA . . 5.480 4.579 3.924 5.482 0.002 9 0 "[ . 1 . 2]" 1
1824 1 51 LEU HG 1 74 GLU HB3 . . 3.680 2.514 2.245 3.237 . 0 0 "[ . 1 . 2]" 1
1825 1 52 MET H 1 52 MET HB2 . . 3.470 3.056 2.980 3.130 . 0 0 "[ . 1 . 2]" 1
1826 1 52 MET H 1 52 MET HB3 . . 3.420 2.564 2.467 2.646 . 0 0 "[ . 1 . 2]" 1
1827 1 52 MET H 1 52 MET ME . . 4.880 4.892 4.879 4.908 0.028 14 0 "[ . 1 . 2]" 1
1828 1 52 MET H 1 52 MET HG2 . . 4.900 4.450 4.354 4.714 . 0 0 "[ . 1 . 2]" 1
1829 1 52 MET H 1 52 MET HG3 . . 4.820 4.615 4.332 4.689 . 0 0 "[ . 1 . 2]" 1
1830 1 52 MET H 1 53 GLY H . . 4.570 4.477 4.427 4.515 . 0 0 "[ . 1 . 2]" 1
1831 1 52 MET H 1 71 VAL MG1 . . 4.770 4.435 4.163 4.580 . 0 0 "[ . 1 . 2]" 1
1832 1 52 MET HA 1 52 MET ME . . 3.840 3.704 3.485 3.814 . 0 0 "[ . 1 . 2]" 1
1833 1 52 MET HA 1 52 MET HG2 . . 4.230 3.357 3.206 3.913 . 0 0 "[ . 1 . 2]" 1
1834 1 52 MET HA 1 53 GLY H . . 3.010 2.176 2.153 2.212 . 0 0 "[ . 1 . 2]" 1
1835 1 52 MET HA 1 53 GLY HA2 . . 4.570 4.495 4.468 4.523 . 0 0 "[ . 1 . 2]" 1
1836 1 52 MET HA 1 71 VAL H . . 5.150 4.669 4.575 4.797 . 0 0 "[ . 1 . 2]" 1
1837 1 52 MET HA 1 71 VAL HA . . 3.130 2.332 2.215 2.504 . 0 0 "[ . 1 . 2]" 1
1838 1 52 MET HA 1 71 VAL HB . . 5.500 4.344 4.151 4.520 . 0 0 "[ . 1 . 2]" 1
1839 1 52 MET HA 1 71 VAL MG1 . . 3.520 3.144 2.973 3.362 . 0 0 "[ . 1 . 2]" 1
1840 1 52 MET HA 1 72 PHE H . . 4.000 3.548 3.453 3.661 . 0 0 "[ . 1 . 2]" 1
1841 1 52 MET HB2 1 52 MET ME . . 3.090 2.196 2.144 2.252 . 0 0 "[ . 1 . 2]" 1
1842 1 52 MET HB2 1 53 GLY H . . 4.980 4.063 3.996 4.134 . 0 0 "[ . 1 . 2]" 1
1843 1 52 MET HB2 1 71 VAL HA . . 4.720 3.596 3.464 3.715 . 0 0 "[ . 1 . 2]" 1
1844 1 52 MET HB2 1 71 VAL MG1 . . 3.760 2.408 2.266 2.537 . 0 0 "[ . 1 . 2]" 1
1845 1 52 MET HB3 1 53 GLY H . . 4.310 4.075 4.021 4.106 . 0 0 "[ . 1 . 2]" 1
1846 1 52 MET HB3 1 53 GLY HA3 . . 5.500 5.514 5.504 5.524 0.024 11 0 "[ . 1 . 2]" 1
1847 1 52 MET ME 1 52 MET HG2 . . 3.410 3.247 2.426 3.418 0.008 4 0 "[ . 1 . 2]" 1
1848 1 52 MET ME 1 53 GLY H . . 4.920 4.494 4.197 4.658 . 0 0 "[ . 1 . 2]" 1
1849 1 52 MET ME 1 69 ARG QD . . 4.490 3.866 3.450 4.146 . 0 0 "[ . 1 . 2]" 1
1850 1 52 MET ME 1 70 GLY H . . 4.710 4.508 3.903 4.734 0.024 20 0 "[ . 1 . 2]" 1
1851 1 52 MET ME 1 70 GLY HA2 . . 4.060 3.445 2.948 3.763 . 0 0 "[ . 1 . 2]" 1
1852 1 52 MET ME 1 70 GLY HA3 . . 5.050 4.807 4.329 5.055 0.005 19 0 "[ . 1 . 2]" 1
1853 1 52 MET ME 1 71 VAL H . . 4.690 3.810 3.487 4.080 . 0 0 "[ . 1 . 2]" 1
1854 1 52 MET ME 1 71 VAL HA . . 4.250 3.850 3.621 4.081 . 0 0 "[ . 1 . 2]" 1
1855 1 52 MET ME 1 71 VAL HB . . 4.690 4.390 4.182 4.605 . 0 0 "[ . 1 . 2]" 1
1856 1 52 MET ME 1 71 VAL MG1 . . 2.660 2.045 1.924 2.204 . 0 0 "[ . 1 . 2]" 1
1857 1 52 MET ME 1 71 VAL MG2 . . 4.070 3.914 3.792 4.070 0.000 13 0 "[ . 1 . 2]" 1
1858 1 52 MET HG2 1 53 GLY H . . 4.180 3.122 2.831 4.192 0.012 20 0 "[ . 1 . 2]" 1
1859 1 52 MET HG2 1 69 ARG QD . . 4.220 3.977 3.631 4.245 0.025 18 0 "[ . 1 . 2]" 1
1860 1 52 MET HG2 1 71 VAL MG1 . . 4.990 4.540 4.250 4.751 . 0 0 "[ . 1 . 2]" 1
1861 1 52 MET HG3 1 53 GLY H . . 3.670 2.562 2.380 2.714 . 0 0 "[ . 1 . 2]" 1
1862 1 52 MET HG3 1 53 GLY HA2 . . 5.500 4.252 3.254 4.656 . 0 0 "[ . 1 . 2]" 1
1863 1 52 MET HG3 1 53 GLY HA3 . . 5.500 4.948 4.309 5.242 . 0 0 "[ . 1 . 2]" 1
1864 1 52 MET HG3 1 69 ARG QD . . 4.630 4.085 3.793 4.390 . 0 0 "[ . 1 . 2]" 1
1865 1 52 MET HG3 1 71 VAL HA . . 4.710 3.924 3.641 4.788 0.078 11 0 "[ . 1 . 2]" 1
1866 1 53 GLY H 1 54 VAL H . . 4.630 4.347 4.316 4.378 . 0 0 "[ . 1 . 2]" 1
1867 1 53 GLY H 1 71 VAL HA . . 4.230 3.796 3.657 3.952 . 0 0 "[ . 1 . 2]" 1
1868 1 53 GLY H 1 71 VAL MG1 . . 5.000 4.667 4.517 4.854 . 0 0 "[ . 1 . 2]" 1
1869 1 53 GLY H 1 72 PHE QE . . 4.800 2.913 2.778 3.036 . 0 0 "[ . 1 . 2]" 1
1870 1 53 GLY H 1 72 PHE HZ . . 5.500 5.215 5.023 5.415 . 0 0 "[ . 1 . 2]" 1
1871 1 53 GLY HA2 1 54 VAL H . . 3.220 2.553 2.510 2.609 . 0 0 "[ . 1 . 2]" 1
1872 1 53 GLY HA2 1 54 VAL MG1 . . 3.870 3.829 3.765 3.887 0.017 18 0 "[ . 1 . 2]" 1
1873 1 53 GLY HA2 1 72 PHE QE . . 4.540 3.965 3.891 4.083 . 0 0 "[ . 1 . 2]" 1
1874 1 53 GLY HA3 1 54 VAL H . . 3.280 2.446 2.395 2.484 . 0 0 "[ . 1 . 2]" 1
1875 1 53 GLY HA3 1 54 VAL HA . . 4.470 4.362 4.328 4.404 . 0 0 "[ . 1 . 2]" 1
1876 1 53 GLY HA3 1 72 PHE QD . . 4.830 4.530 4.421 4.591 . 0 0 "[ . 1 . 2]" 1
1877 1 53 GLY HA3 1 72 PHE QE . . 4.470 2.501 2.417 2.613 . 0 0 "[ . 1 . 2]" 1
1878 1 53 GLY HA3 1 72 PHE HZ . . 4.390 3.967 3.808 4.168 . 0 0 "[ . 1 . 2]" 1
1879 1 54 VAL H 1 54 VAL HB . . 3.910 3.254 3.224 3.285 . 0 0 "[ . 1 . 2]" 1
1880 1 54 VAL H 1 54 VAL MG1 . . 3.230 2.312 2.270 2.341 . 0 0 "[ . 1 . 2]" 1
1881 1 54 VAL H 1 54 VAL MG2 . . 4.640 3.982 3.962 3.998 . 0 0 "[ . 1 . 2]" 1
1882 1 54 VAL H 1 55 LYS H . . 4.510 4.411 4.378 4.444 . 0 0 "[ . 1 . 2]" 1
1883 1 54 VAL H 1 65 LEU QD . . 5.420 4.601 4.384 4.772 . 0 0 "[ . 1 . 2]" 1
1884 1 54 VAL HA 1 54 VAL MG1 . . 3.630 3.256 3.245 3.267 . 0 0 "[ . 1 . 2]" 1
1885 1 54 VAL HA 1 54 VAL MG2 . . 3.070 2.375 2.338 2.398 . 0 0 "[ . 1 . 2]" 1
1886 1 54 VAL HA 1 55 LYS H . . 2.990 2.269 2.234 2.310 . 0 0 "[ . 1 . 2]" 1
1887 1 54 VAL HA 1 55 LYS HG3 . . 4.900 4.548 4.390 4.632 . 0 0 "[ . 1 . 2]" 1
1888 1 54 VAL HA 1 65 LEU QD . . 5.120 4.428 4.126 4.634 . 0 0 "[ . 1 . 2]" 1
1889 1 54 VAL HA 1 69 ARG HA . . 3.490 2.631 2.392 2.901 . 0 0 "[ . 1 . 2]" 1
1890 1 54 VAL HA 1 70 GLY H . . 4.590 3.805 3.683 3.961 . 0 0 "[ . 1 . 2]" 1
1891 1 54 VAL HB 1 55 LYS H . . 4.320 4.180 4.103 4.255 . 0 0 "[ . 1 . 2]" 1
1892 1 54 VAL HB 1 59 TRP HE3 . . 5.500 4.905 4.551 5.190 . 0 0 "[ . 1 . 2]" 1
1893 1 54 VAL HB 1 65 LEU HA . . 5.000 4.437 4.272 4.626 . 0 0 "[ . 1 . 2]" 1
1894 1 54 VAL HB 1 69 ARG HA . . 3.960 2.903 2.731 3.077 . 0 0 "[ . 1 . 2]" 1
1895 1 54 VAL MG1 1 55 LYS H . . 4.310 3.865 3.754 3.933 . 0 0 "[ . 1 . 2]" 1
1896 1 54 VAL MG1 1 56 GLU H . . 5.070 4.958 4.839 5.074 0.004 15 0 "[ . 1 . 2]" 1
1897 1 54 VAL MG1 1 56 GLU HA . . 4.410 4.030 3.930 4.148 . 0 0 "[ . 1 . 2]" 1
1898 1 54 VAL MG1 1 58 ASP H . . 5.500 5.467 5.260 5.525 0.025 1 0 "[ . 1 . 2]" 1
1899 1 54 VAL MG1 1 58 ASP QB . . 4.380 4.305 4.184 4.410 0.030 18 0 "[ . 1 . 2]" 1
1900 1 54 VAL MG1 1 59 TRP H . . 4.710 3.984 3.877 4.105 . 0 0 "[ . 1 . 2]" 1
1901 1 54 VAL MG1 1 59 TRP HA . . 4.510 4.276 4.134 4.515 0.005 9 0 "[ . 1 . 2]" 1
1902 1 54 VAL MG1 1 59 TRP HB2 . . 3.700 2.407 2.268 2.619 . 0 0 "[ . 1 . 2]" 1
1903 1 54 VAL MG1 1 59 TRP HB3 . . 3.920 3.342 3.183 3.539 . 0 0 "[ . 1 . 2]" 1
1904 1 54 VAL MG1 1 59 TRP HD1 . . 4.990 4.758 4.618 4.966 . 0 0 "[ . 1 . 2]" 1
1905 1 54 VAL MG1 1 59 TRP HE3 . . 3.870 2.941 2.644 3.166 . 0 0 "[ . 1 . 2]" 1
1906 1 54 VAL MG1 1 59 TRP HZ3 . . 4.530 4.315 4.092 4.486 . 0 0 "[ . 1 . 2]" 1
1907 1 54 VAL MG1 1 65 LEU HA . . 5.500 4.321 4.187 4.505 . 0 0 "[ . 1 . 2]" 1
1908 1 54 VAL MG1 1 65 LEU HG . . 4.960 4.680 4.555 4.833 . 0 0 "[ . 1 . 2]" 1
1909 1 54 VAL MG1 1 68 CYS QB . . 5.070 4.630 4.323 4.947 . 0 0 "[ . 1 . 2]" 1
1910 1 54 VAL MG1 1 69 ARG H . . 5.500 5.341 5.051 5.511 0.011 20 0 "[ . 1 . 2]" 1
1911 1 54 VAL MG2 1 55 LYS H . . 3.480 2.484 2.358 2.577 . 0 0 "[ . 1 . 2]" 1
1912 1 54 VAL MG2 1 56 GLU H . . 5.500 5.135 5.066 5.193 . 0 0 "[ . 1 . 2]" 1
1913 1 54 VAL MG2 1 56 GLU HA . . 4.640 4.644 4.575 4.666 0.026 3 0 "[ . 1 . 2]" 1
1914 1 54 VAL MG2 1 58 ASP H . . 4.300 4.232 4.043 4.314 0.014 18 0 "[ . 1 . 2]" 1
1915 1 54 VAL MG2 1 58 ASP QB . . 3.530 2.537 2.391 2.751 . 0 0 "[ . 1 . 2]" 1
1916 1 54 VAL MG2 1 59 TRP H . . 3.920 3.126 2.977 3.366 . 0 0 "[ . 1 . 2]" 1
1917 1 54 VAL MG2 1 59 TRP HA . . 4.180 3.704 3.478 4.065 . 0 0 "[ . 1 . 2]" 1
1918 1 54 VAL MG2 1 59 TRP HB2 . . 3.650 2.607 2.412 2.814 . 0 0 "[ . 1 . 2]" 1
1919 1 54 VAL MG2 1 59 TRP HB3 . . 4.400 3.777 3.624 4.000 . 0 0 "[ . 1 . 2]" 1
1920 1 54 VAL MG2 1 59 TRP HE3 . . 3.780 3.154 2.867 3.350 . 0 0 "[ . 1 . 2]" 1
1921 1 54 VAL MG2 1 65 LEU HA . . 3.850 3.064 2.843 3.207 . 0 0 "[ . 1 . 2]" 1
1922 1 54 VAL MG2 1 68 CYS QB . . 3.690 2.432 2.151 2.747 . 0 0 "[ . 1 . 2]" 1
1923 1 54 VAL MG2 1 69 ARG H . . 4.210 3.571 3.262 3.756 . 0 0 "[ . 1 . 2]" 1
1924 1 54 VAL MG2 1 69 ARG HA . . 3.680 3.060 2.831 3.332 . 0 0 "[ . 1 . 2]" 1
1925 1 54 VAL MG2 1 70 GLY H . . 5.500 4.896 4.760 5.068 . 0 0 "[ . 1 . 2]" 1
1926 1 55 LYS H 1 55 LYS HB2 . . 3.380 2.206 2.142 2.373 . 0 0 "[ . 1 . 2]" 1
1927 1 55 LYS H 1 55 LYS HB3 . . 3.730 3.504 3.452 3.601 . 0 0 "[ . 1 . 2]" 1
1928 1 55 LYS H 1 55 LYS QD . . 4.530 4.537 4.473 4.558 0.028 6 0 "[ . 1 . 2]" 1
1929 1 55 LYS H 1 55 LYS HG2 . . 4.260 3.920 3.617 4.058 . 0 0 "[ . 1 . 2]" 1
1930 1 55 LYS H 1 55 LYS HG3 . . 3.130 2.910 2.778 2.990 . 0 0 "[ . 1 . 2]" 1
1931 1 55 LYS H 1 56 GLU H . . 4.660 4.655 4.611 4.680 0.020 14 0 "[ . 1 . 2]" 1
1932 1 55 LYS H 1 58 ASP H . . 4.970 4.515 4.366 4.735 . 0 0 "[ . 1 . 2]" 1
1933 1 55 LYS H 1 58 ASP HB2 . . 5.050 3.146 2.923 4.295 . 0 0 "[ . 1 . 2]" 1
1934 1 55 LYS H 1 58 ASP QB . . 4.210 3.036 2.869 3.630 . 0 0 "[ . 1 . 2]" 1
1935 1 55 LYS H 1 58 ASP HB3 . . 5.050 4.177 3.651 4.627 . 0 0 "[ . 1 . 2]" 1
1936 1 55 LYS H 1 68 CYS QB . . 5.130 4.455 4.119 5.159 0.029 6 0 "[ . 1 . 2]" 1
1937 1 55 LYS H 1 69 ARG HA . . 4.800 4.431 4.163 4.784 . 0 0 "[ . 1 . 2]" 1
1938 1 55 LYS HA 1 55 LYS QD . . 4.120 3.882 3.681 3.977 . 0 0 "[ . 1 . 2]" 1
1939 1 55 LYS HA 1 55 LYS QE . . 4.970 4.369 4.253 4.558 . 0 0 "[ . 1 . 2]" 1
1940 1 55 LYS HA 1 55 LYS HG2 . . 3.460 2.267 2.149 2.375 . 0 0 "[ . 1 . 2]" 1
1941 1 55 LYS HA 1 55 LYS HG3 . . 3.780 2.774 2.630 3.045 . 0 0 "[ . 1 . 2]" 1
1942 1 55 LYS HA 1 56 GLU H . . 3.030 2.168 2.099 2.213 . 0 0 "[ . 1 . 2]" 1
1943 1 55 LYS HA 1 56 GLU HA . . 5.100 4.317 4.230 4.356 . 0 0 "[ . 1 . 2]" 1
1944 1 55 LYS HA 1 57 SER H . . 4.450 4.133 3.963 4.318 . 0 0 "[ . 1 . 2]" 1
1945 1 55 LYS HB2 1 55 LYS QE . . 3.730 2.139 1.988 2.464 . 0 0 "[ . 1 . 2]" 1
1946 1 55 LYS HB2 1 56 GLU H . . 4.860 4.345 4.225 4.404 . 0 0 "[ . 1 . 2]" 1
1947 1 55 LYS HB2 1 57 SER H . . 4.550 4.477 4.333 4.559 0.009 6 0 "[ . 1 . 2]" 1
1948 1 55 LYS HB2 1 58 ASP H . . 3.330 3.134 2.997 3.339 0.009 9 0 "[ . 1 . 2]" 1
1949 1 55 LYS HB2 1 58 ASP HB2 . . 3.750 2.320 2.210 3.053 . 0 0 "[ . 1 . 2]" 1
1950 1 55 LYS HB2 1 58 ASP HB3 . . 3.750 3.756 3.604 3.804 0.054 18 0 "[ . 1 . 2]" 1
1951 1 55 LYS HB2 1 59 TRP H . . 5.500 4.537 4.372 4.833 . 0 0 "[ . 1 . 2]" 1
1952 1 55 LYS HB3 1 55 LYS QD . . 3.600 2.415 2.235 2.482 . 0 0 "[ . 1 . 2]" 1
1953 1 55 LYS HB3 1 55 LYS QE . . 3.720 2.965 2.782 3.090 . 0 0 "[ . 1 . 2]" 1
1954 1 55 LYS HB3 1 56 GLU H . . 4.150 3.236 3.045 3.325 . 0 0 "[ . 1 . 2]" 1
1955 1 55 LYS HB3 1 57 SER H . . 3.390 2.894 2.736 3.030 . 0 0 "[ . 1 . 2]" 1
1956 1 55 LYS HB3 1 57 SER QB . . 4.420 3.297 2.702 4.020 . 0 0 "[ . 1 . 2]" 1
1957 1 55 LYS HB3 1 58 ASP H . . 3.490 2.510 2.312 3.202 . 0 0 "[ . 1 . 2]" 1
1958 1 55 LYS HB3 1 58 ASP HB2 . . 4.660 3.104 2.985 4.023 . 0 0 "[ . 1 . 2]" 1
1959 1 55 LYS HB3 1 58 ASP QB . . 4.030 3.057 2.953 3.784 . 0 0 "[ . 1 . 2]" 1
1960 1 55 LYS HB3 1 58 ASP HB3 . . 4.660 4.698 4.604 4.726 0.066 6 0 "[ . 1 . 2]" 1
1961 1 55 LYS QD 1 57 SER H . . 4.420 4.380 4.222 4.445 0.025 4 0 "[ . 1 . 2]" 1
1962 1 55 LYS QD 1 57 SER QB . . 4.380 3.770 3.170 4.372 . 0 0 "[ . 1 . 2]" 1
1963 1 55 LYS QE 1 55 LYS HG2 . . 3.730 3.321 3.287 3.358 . 0 0 "[ . 1 . 2]" 1
1964 1 55 LYS QE 1 55 LYS HG3 . . 3.190 2.394 2.320 2.520 . 0 0 "[ . 1 . 2]" 1
1965 1 55 LYS QE 1 57 SER H . . 5.500 5.487 5.337 5.550 0.050 18 0 "[ . 1 . 2]" 1
1966 1 55 LYS HG2 1 56 GLU H . . 4.400 3.571 3.437 3.713 . 0 0 "[ . 1 . 2]" 1
1967 1 56 GLU H 1 56 GLU HB2 . . 3.370 2.627 2.512 2.803 . 0 0 "[ . 1 . 2]" 1
1968 1 56 GLU H 1 56 GLU HB3 . . 3.250 2.560 2.399 2.653 . 0 0 "[ . 1 . 2]" 1
1969 1 56 GLU H 1 56 GLU HG2 . . 5.150 4.539 4.443 4.615 . 0 0 "[ . 1 . 2]" 1
1970 1 56 GLU H 1 56 GLU HG3 . . 4.980 4.517 4.427 4.581 . 0 0 "[ . 1 . 2]" 1
1971 1 56 GLU H 1 57 SER H . . 3.620 2.796 2.655 2.922 . 0 0 "[ . 1 . 2]" 1
1972 1 56 GLU H 1 57 SER QB . . 5.340 4.634 4.290 5.062 . 0 0 "[ . 1 . 2]" 1
1973 1 56 GLU H 1 58 ASP H . . 4.720 4.158 3.979 4.408 . 0 0 "[ . 1 . 2]" 1
1974 1 56 GLU HA 1 56 GLU HG2 . . 3.510 3.339 3.062 3.516 0.006 3 0 "[ . 1 . 2]" 1
1975 1 56 GLU HA 1 56 GLU HG3 . . 3.430 2.462 2.299 2.587 . 0 0 "[ . 1 . 2]" 1
1976 1 56 GLU HA 1 58 ASP H . . 4.840 4.174 3.852 4.383 . 0 0 "[ . 1 . 2]" 1
1977 1 56 GLU HA 1 59 TRP H . . 4.230 3.362 3.270 3.583 . 0 0 "[ . 1 . 2]" 1
1978 1 56 GLU HA 1 59 TRP HB2 . . 3.850 3.868 3.790 3.926 0.076 10 0 "[ . 1 . 2]" 1
1979 1 56 GLU HA 1 59 TRP HB3 . . 3.440 2.551 2.468 2.673 . 0 0 "[ . 1 . 2]" 1
1980 1 56 GLU HA 1 59 TRP HD1 . . 4.320 3.970 3.798 4.149 . 0 0 "[ . 1 . 2]" 1
1981 1 56 GLU HA 1 60 ASN HB2 . . 4.610 4.353 4.044 4.545 . 0 0 "[ . 1 . 2]" 1
1982 1 56 GLU HB2 1 57 SER H . . 4.660 4.074 3.968 4.155 . 0 0 "[ . 1 . 2]" 1
1983 1 56 GLU HB3 1 57 SER H . . 4.070 2.798 2.667 2.932 . 0 0 "[ . 1 . 2]" 1
1984 1 56 GLU HB3 1 57 SER HA . . 4.550 4.515 4.359 4.565 0.015 6 0 "[ . 1 . 2]" 1
1985 1 56 GLU HG2 1 57 SER H . . 4.750 3.855 3.623 3.999 . 0 0 "[ . 1 . 2]" 1
1986 1 56 GLU HG2 1 57 SER HA . . 4.170 3.889 3.433 4.078 . 0 0 "[ . 1 . 2]" 1
1987 1 56 GLU HG2 1 60 ASN H . . 5.500 4.455 4.015 4.891 . 0 0 "[ . 1 . 2]" 1
1988 1 56 GLU HG2 1 60 ASN HB2 . . 4.490 3.239 2.840 3.677 . 0 0 "[ . 1 . 2]" 1
1989 1 56 GLU HG2 1 60 ASN HB3 . . 4.900 4.449 3.915 4.911 0.011 4 0 "[ . 1 . 2]" 1
1990 1 56 GLU HG2 1 60 ASN HD21 . . 4.190 3.113 2.231 3.604 . 0 0 "[ . 1 . 2]" 1
1991 1 56 GLU HG2 1 60 ASN HD22 . . 4.760 4.596 3.780 4.794 0.034 10 0 "[ . 1 . 2]" 1
1992 1 56 GLU HG3 1 57 SER H . . 4.900 4.617 4.416 4.901 0.001 18 0 "[ . 1 . 2]" 1
1993 1 56 GLU HG3 1 59 TRP HB3 . . 4.230 3.928 3.651 4.237 0.007 3 0 "[ . 1 . 2]" 1
1994 1 56 GLU HG3 1 59 TRP HD1 . . 4.470 3.782 3.411 4.167 . 0 0 "[ . 1 . 2]" 1
1995 1 56 GLU HG3 1 60 ASN H . . 5.360 4.185 3.817 4.417 . 0 0 "[ . 1 . 2]" 1
1996 1 56 GLU HG3 1 60 ASN HA . . 5.500 5.270 4.844 5.511 0.011 19 0 "[ . 1 . 2]" 1
1997 1 56 GLU HG3 1 60 ASN HB2 . . 4.970 3.437 2.790 3.803 . 0 0 "[ . 1 . 2]" 1
1998 1 56 GLU HG3 1 60 ASN HB3 . . 5.500 5.016 4.111 5.503 0.003 15 0 "[ . 1 . 2]" 1
1999 1 56 GLU HG3 1 60 ASN HD21 . . 4.390 4.032 3.029 4.395 0.005 20 0 "[ . 1 . 2]" 1
2000 1 56 GLU HG3 1 60 ASN HD22 . . 5.310 5.274 4.449 5.363 0.053 2 0 "[ . 1 . 2]" 1
2001 1 57 SER H 1 57 SER QB . . 3.160 2.303 2.170 2.548 . 0 0 "[ . 1 . 2]" 1
2002 1 57 SER H 1 58 ASP H . . 3.430 2.721 2.569 2.890 . 0 0 "[ . 1 . 2]" 1
2003 1 57 SER H 1 58 ASP QB . . 5.340 4.554 4.265 4.658 . 0 0 "[ . 1 . 2]" 1
2004 1 57 SER H 1 60 ASN HB2 . . 5.220 4.953 4.599 5.163 . 0 0 "[ . 1 . 2]" 1
2005 1 57 SER H 1 60 ASN HB3 . . 5.500 5.201 4.727 5.530 0.030 9 0 "[ . 1 . 2]" 1
2006 1 57 SER HA 1 59 TRP H . . 4.920 4.580 4.118 4.812 . 0 0 "[ . 1 . 2]" 1
2007 1 57 SER HA 1 60 ASN H . . 3.870 3.485 3.022 3.877 0.007 18 0 "[ . 1 . 2]" 1
2008 1 57 SER HA 1 60 ASN HB2 . . 3.570 3.215 2.699 3.616 0.046 7 0 "[ . 1 . 2]" 1
2009 1 57 SER HA 1 60 ASN HB3 . . 3.650 2.685 2.194 3.177 . 0 0 "[ . 1 . 2]" 1
2010 1 57 SER HA 1 60 ASN HD21 . . 4.910 3.808 3.211 4.586 . 0 0 "[ . 1 . 2]" 1
2011 1 57 SER HA 1 61 GLN H . . 5.160 4.210 3.841 4.592 . 0 0 "[ . 1 . 2]" 1
2012 1 57 SER QB 1 58 ASP H . . 3.760 2.913 2.496 3.610 . 0 0 "[ . 1 . 2]" 1
2013 1 57 SER QB 1 58 ASP QB . . 4.850 4.473 4.066 4.902 0.052 7 0 "[ . 1 . 2]" 1
2014 1 57 SER QB 1 60 ASN H . . 5.340 5.043 4.670 5.307 . 0 0 "[ . 1 . 2]" 1
2015 1 57 SER QB 1 60 ASN HB2 . . 5.340 5.114 4.696 5.351 0.011 13 0 "[ . 1 . 2]" 1
2016 1 58 ASP H 1 58 ASP QB . . 2.940 2.224 1.986 2.341 . 0 0 "[ . 1 . 2]" 1
2017 1 58 ASP H 1 59 TRP H . . 3.120 2.545 2.308 2.665 . 0 0 "[ . 1 . 2]" 1
2018 1 58 ASP H 1 59 TRP HB2 . . 5.190 4.959 4.715 5.094 . 0 0 "[ . 1 . 2]" 1
2019 1 58 ASP H 1 59 TRP HB3 . . 4.970 4.531 4.258 4.687 . 0 0 "[ . 1 . 2]" 1
2020 1 58 ASP H 1 60 ASN H . . 4.910 3.929 3.675 4.090 . 0 0 "[ . 1 . 2]" 1
2021 1 58 ASP H 1 61 GLN H . . 5.370 4.728 4.485 5.034 . 0 0 "[ . 1 . 2]" 1
2022 1 58 ASP HA 1 61 GLN H . . 3.970 3.581 3.297 3.870 . 0 0 "[ . 1 . 2]" 1
2023 1 58 ASP HA 1 61 GLN QB . . 3.630 2.884 2.404 3.307 . 0 0 "[ . 1 . 2]" 1
2024 1 58 ASP HA 1 63 LYS HB2 . . 5.500 3.821 3.308 4.287 . 0 0 "[ . 1 . 2]" 1
2025 1 58 ASP HA 1 63 LYS HD2 . . 4.420 2.872 2.006 4.421 0.001 10 0 "[ . 1 . 2]" 1
2026 1 58 ASP HA 1 63 LYS QD . . 3.720 2.320 1.984 2.938 . 0 0 "[ . 1 . 2]" 1
2027 1 58 ASP HA 1 63 LYS HD3 . . 4.420 3.108 2.202 3.892 . 0 0 "[ . 1 . 2]" 1
2028 1 58 ASP QB 1 59 TRP H . . 3.620 2.638 2.379 2.861 . 0 0 "[ . 1 . 2]" 1
2029 1 58 ASP HB2 1 59 TRP H . . 4.230 2.853 2.678 3.615 . 0 0 "[ . 1 . 2]" 1
2030 1 58 ASP HB3 1 59 TRP H . . 4.230 3.283 2.413 3.606 . 0 0 "[ . 1 . 2]" 1
2031 1 59 TRP H 1 59 TRP HB2 . . 3.540 2.558 2.457 2.687 . 0 0 "[ . 1 . 2]" 1
2032 1 59 TRP H 1 59 TRP HB3 . . 3.480 2.317 2.285 2.401 . 0 0 "[ . 1 . 2]" 1
2033 1 59 TRP H 1 59 TRP HD1 . . 5.170 4.746 4.685 4.867 . 0 0 "[ . 1 . 2]" 1
2034 1 59 TRP H 1 59 TRP HE3 . . 5.320 4.905 4.743 5.058 . 0 0 "[ . 1 . 2]" 1
2035 1 59 TRP H 1 60 ASN H . . 3.890 2.654 2.497 2.776 . 0 0 "[ . 1 . 2]" 1
2036 1 59 TRP HA 1 59 TRP HD1 . . 5.020 4.399 4.240 4.495 . 0 0 "[ . 1 . 2]" 1
2037 1 59 TRP HA 1 59 TRP HE3 . . 3.170 2.919 2.778 3.091 . 0 0 "[ . 1 . 2]" 1
2038 1 59 TRP HA 1 61 GLN H . . 4.180 4.110 3.750 4.220 0.040 16 0 "[ . 1 . 2]" 1
2039 1 59 TRP HA 1 62 HIS H . . 3.990 3.362 2.952 3.604 . 0 0 "[ . 1 . 2]" 1
2040 1 59 TRP HA 1 63 LYS H . . 4.190 3.483 3.261 3.769 . 0 0 "[ . 1 . 2]" 1
2041 1 59 TRP HB2 1 59 TRP HE3 . . 3.890 2.759 2.681 2.848 . 0 0 "[ . 1 . 2]" 1
2042 1 59 TRP HB2 1 60 ASN H . . 4.420 4.089 3.989 4.196 . 0 0 "[ . 1 . 2]" 1
2043 1 59 TRP HB2 1 65 LEU HA . . 5.500 5.523 5.362 5.592 0.092 10 0 "[ . 1 . 2]" 1
2044 1 59 TRP HB3 1 59 TRP HD1 . . 3.610 2.598 2.543 2.652 . 0 0 "[ . 1 . 2]" 1
2045 1 59 TRP HB3 1 60 ASN H . . 4.110 2.863 2.734 3.014 . 0 0 "[ . 1 . 2]" 1
2046 1 59 TRP HB3 1 61 GLN H . . 5.500 5.108 4.894 5.316 . 0 0 "[ . 1 . 2]" 1
2047 1 59 TRP HD1 1 60 ASN H . . 4.860 3.887 3.684 4.089 . 0 0 "[ . 1 . 2]" 1
2048 1 59 TRP HD1 1 60 ASN HA . . 4.220 4.033 3.670 4.237 0.017 13 0 "[ . 1 . 2]" 1
2049 1 59 TRP HD1 1 60 ASN HB2 . . 5.150 4.325 4.068 4.680 . 0 0 "[ . 1 . 2]" 1
2050 1 59 TRP HE3 1 65 LEU H . . 5.410 4.925 4.526 5.305 . 0 0 "[ . 1 . 2]" 1
2051 1 59 TRP HE3 1 65 LEU HA . . 4.640 3.829 3.695 3.985 . 0 0 "[ . 1 . 2]" 1
2052 1 59 TRP HE3 1 65 LEU QB . . 4.420 3.106 2.638 3.383 . 0 0 "[ . 1 . 2]" 1
2053 1 59 TRP HE3 1 65 LEU MD1 . . 4.180 2.456 2.371 2.694 . 0 0 "[ . 1 . 2]" 1
2054 1 59 TRP HE3 1 65 LEU QD . . 3.480 2.427 2.350 2.611 . 0 0 "[ . 1 . 2]" 1
2055 1 59 TRP HE3 1 65 LEU MD2 . . 4.180 3.840 3.477 4.021 . 0 0 "[ . 1 . 2]" 1
2056 1 59 TRP HE3 1 65 LEU HG . . 5.300 5.202 5.030 5.275 . 0 0 "[ . 1 . 2]" 1
2057 1 59 TRP HH2 1 65 LEU QB . . 4.480 4.272 4.192 4.360 . 0 0 "[ . 1 . 2]" 1
2058 1 59 TRP HH2 1 65 LEU QD . . 3.850 3.163 3.061 3.291 . 0 0 "[ . 1 . 2]" 1
2059 1 59 TRP HZ2 1 65 LEU QD . . 5.120 4.687 4.605 4.818 . 0 0 "[ . 1 . 2]" 1
2060 1 59 TRP HZ3 1 65 LEU HA . . 5.050 4.208 4.001 4.488 . 0 0 "[ . 1 . 2]" 1
2061 1 59 TRP HZ3 1 65 LEU QB . . 3.700 2.106 2.030 2.215 . 0 0 "[ . 1 . 2]" 1
2062 1 59 TRP HZ3 1 65 LEU MD1 . . 4.420 2.595 2.373 3.070 . 0 0 "[ . 1 . 2]" 1
2063 1 59 TRP HZ3 1 65 LEU QD . . 3.430 2.057 2.011 2.143 . 0 0 "[ . 1 . 2]" 1
2064 1 59 TRP HZ3 1 65 LEU MD2 . . 4.420 2.168 2.108 2.219 . 0 0 "[ . 1 . 2]" 1
2065 1 59 TRP HZ3 1 65 LEU HG . . 4.270 4.332 4.307 4.351 0.081 17 0 "[ . 1 . 2]" 1
2066 1 60 ASN H 1 60 ASN HB2 . . 3.690 2.228 2.096 2.385 . 0 0 "[ . 1 . 2]" 1
2067 1 60 ASN H 1 60 ASN HB3 . . 3.720 2.697 2.391 3.031 . 0 0 "[ . 1 . 2]" 1
2068 1 60 ASN H 1 61 GLN H . . 3.670 2.648 2.561 2.723 . 0 0 "[ . 1 . 2]" 1
2069 1 60 ASN H 1 62 HIS H . . 4.660 3.895 3.699 4.225 . 0 0 "[ . 1 . 2]" 1
2070 1 60 ASN HA 1 62 HIS H . . 4.010 3.585 3.339 3.775 . 0 0 "[ . 1 . 2]" 1
2071 1 60 ASN HB2 1 60 ASN HD22 . . 4.080 3.465 3.358 3.609 . 0 0 "[ . 1 . 2]" 1
2072 1 60 ASN HB2 1 61 GLN H . . 4.210 3.898 3.601 4.059 . 0 0 "[ . 1 . 2]" 1
2073 1 60 ASN HB2 1 62 HIS H . . 5.500 5.286 5.116 5.510 0.010 12 0 "[ . 1 . 2]" 1
2074 1 60 ASN HB3 1 61 GLN H . . 4.020 3.010 2.768 3.410 . 0 0 "[ . 1 . 2]" 1
2075 1 61 GLN H 1 61 GLN HB2 . . 3.760 2.340 2.160 2.465 . 0 0 "[ . 1 . 2]" 1
2076 1 61 GLN H 1 61 GLN QB . . 3.040 2.312 2.141 2.429 . 0 0 "[ . 1 . 2]" 1
2077 1 61 GLN H 1 61 GLN HB3 . . 3.760 3.602 3.488 3.672 . 0 0 "[ . 1 . 2]" 1
2078 1 61 GLN H 1 61 GLN HG2 . . 4.250 3.508 2.662 4.252 0.002 19 0 "[ . 1 . 2]" 1
2079 1 61 GLN H 1 61 GLN QG . . 3.540 2.774 2.580 3.015 . 0 0 "[ . 1 . 2]" 1
2080 1 61 GLN H 1 61 GLN HG3 . . 4.250 3.242 2.619 4.113 . 0 0 "[ . 1 . 2]" 1
2081 1 61 GLN H 1 62 HIS H . . 3.070 2.548 2.292 2.635 . 0 0 "[ . 1 . 2]" 1
2082 1 61 GLN H 1 62 HIS HA . . 4.750 4.699 4.418 4.770 0.020 19 0 "[ . 1 . 2]" 1
2083 1 61 GLN H 1 62 HIS QB . . 5.500 5.395 5.226 5.523 0.023 8 0 "[ . 1 . 2]" 1
2084 1 61 GLN HA 1 61 GLN HG2 . . 3.670 2.629 2.235 3.087 . 0 0 "[ . 1 . 2]" 1
2085 1 61 GLN HA 1 61 GLN QG . . 3.200 2.487 2.192 2.940 . 0 0 "[ . 1 . 2]" 1
2086 1 61 GLN HA 1 61 GLN HG3 . . 3.670 3.192 2.399 3.700 0.030 7 0 "[ . 1 . 2]" 1
2087 1 61 GLN HA 1 62 HIS HD2 . . 4.660 3.975 2.977 4.693 0.033 4 0 "[ . 1 . 2]" 1
2088 1 61 GLN QB 1 63 LYS QD . . 4.750 2.341 1.956 3.149 . 0 0 "[ . 1 . 2]" 1
2089 1 61 GLN QB 1 63 LYS QE . . 3.650 2.947 1.972 3.676 0.026 12 0 "[ . 1 . 2]" 1
2090 1 61 GLN QB 1 63 LYS QG . . 3.980 2.465 2.185 2.758 . 0 0 "[ . 1 . 2]" 1
2091 1 61 GLN HB2 1 62 HIS H . . 4.290 3.670 3.381 3.888 . 0 0 "[ . 1 . 2]" 1
2092 1 61 GLN HB2 1 63 LYS QE . . 4.180 3.329 2.043 4.137 . 0 0 "[ . 1 . 2]" 1
2093 1 61 GLN HB3 1 62 HIS H . . 4.290 4.232 4.103 4.323 0.033 16 0 "[ . 1 . 2]" 1
2094 1 61 GLN HB3 1 63 LYS QE . . 4.180 3.339 2.187 4.238 0.058 3 0 "[ . 1 . 2]" 1
2095 1 61 GLN QG 1 63 LYS QG . . 4.760 4.382 3.983 4.780 0.020 18 0 "[ . 1 . 2]" 1
2096 1 61 GLN HG2 1 63 LYS QG . . 5.500 5.019 4.677 5.427 . 0 0 "[ . 1 . 2]" 1
2097 1 61 GLN HG3 1 63 LYS QG . . 5.500 4.880 4.214 5.416 . 0 0 "[ . 1 . 2]" 1
2098 1 62 HIS H 1 62 HIS HA . . 2.900 2.230 2.209 2.262 . 0 0 "[ . 1 . 2]" 1
2099 1 62 HIS H 1 62 HIS QB . . 3.580 3.364 3.231 3.468 . 0 0 "[ . 1 . 2]" 1
2100 1 62 HIS H 1 62 HIS HD2 . . 4.930 4.194 3.386 4.758 . 0 0 "[ . 1 . 2]" 1
2101 1 62 HIS H 1 63 LYS H . . 3.300 2.762 2.653 2.907 . 0 0 "[ . 1 . 2]" 1
2102 1 62 HIS H 1 63 LYS HB2 . . 5.160 4.888 4.737 5.068 . 0 0 "[ . 1 . 2]" 1
2103 1 62 HIS H 1 63 LYS QD . . 4.840 4.845 4.629 4.893 0.053 11 0 "[ . 1 . 2]" 1
2104 1 62 HIS H 1 63 LYS QG . . 4.630 4.222 3.799 4.449 . 0 0 "[ . 1 . 2]" 1
2105 1 63 LYS H 1 63 LYS HB2 . . 4.070 2.372 2.309 2.457 . 0 0 "[ . 1 . 2]" 1
2106 1 63 LYS H 1 63 LYS HB3 . . 3.870 3.580 3.531 3.651 . 0 0 "[ . 1 . 2]" 1
2107 1 63 LYS H 1 63 LYS QD . . 4.780 3.389 3.107 3.706 . 0 0 "[ . 1 . 2]" 1
2108 1 63 LYS H 1 63 LYS QG . . 3.790 2.427 2.129 2.642 . 0 0 "[ . 1 . 2]" 1
2109 1 63 LYS HA 1 63 LYS QD . . 4.860 4.123 4.025 4.224 . 0 0 "[ . 1 . 2]" 1
2110 1 63 LYS HA 1 63 LYS QG . . 3.900 2.456 2.327 2.573 . 0 0 "[ . 1 . 2]" 1
2111 1 63 LYS HA 1 64 GLU H . . 3.450 2.321 2.168 2.399 . 0 0 "[ . 1 . 2]" 1
2112 1 63 LYS HB2 1 63 LYS QE . . 4.070 3.711 2.393 4.088 0.018 6 0 "[ . 1 . 2]" 1
2113 1 63 LYS HB2 1 64 GLU H . . 4.210 3.796 3.576 3.936 . 0 0 "[ . 1 . 2]" 1
2114 1 63 LYS HB3 1 63 LYS QE . . 4.030 3.542 2.417 4.074 0.044 6 0 "[ . 1 . 2]" 1
2115 1 63 LYS HB3 1 64 GLU H . . 4.440 2.603 2.363 2.879 . 0 0 "[ . 1 . 2]" 1
2116 1 64 GLU H 1 64 GLU HB2 . . 3.830 3.601 3.555 3.643 . 0 0 "[ . 1 . 2]" 1
2117 1 64 GLU H 1 64 GLU HB3 . . 3.830 2.705 2.584 2.816 . 0 0 "[ . 1 . 2]" 1
2118 1 64 GLU H 1 64 GLU HG2 . . 4.110 2.608 1.872 3.179 . 0 0 "[ . 1 . 2]" 1
2119 1 64 GLU H 1 64 GLU QG . . 3.520 2.540 1.857 3.029 . 0 0 "[ . 1 . 2]" 1
2120 1 64 GLU H 1 64 GLU HG3 . . 4.110 3.568 2.846 3.831 . 0 0 "[ . 1 . 2]" 1
2121 1 64 GLU HA 1 64 GLU QG . . 3.440 3.458 3.353 3.506 0.066 20 0 "[ . 1 . 2]" 1
2122 1 64 GLU HA 1 65 LEU H . . 2.940 2.144 2.076 2.203 . 0 0 "[ . 1 . 2]" 1
2123 1 64 GLU HA 1 66 GLU H . . 4.370 4.098 3.890 4.312 . 0 0 "[ . 1 . 2]" 1
2124 1 64 GLU HA 1 67 LYS H . . 5.110 4.726 4.562 4.937 . 0 0 "[ . 1 . 2]" 1
2125 1 64 GLU QB 1 65 LEU H . . 3.990 3.491 2.981 3.649 . 0 0 "[ . 1 . 2]" 1
2126 1 64 GLU QB 1 66 GLU H . . 4.610 3.681 3.290 4.128 . 0 0 "[ . 1 . 2]" 1
2127 1 64 GLU QB 1 67 LYS H . . 3.390 3.341 3.073 3.415 0.025 20 0 "[ . 1 . 2]" 1
2128 1 64 GLU HB2 1 65 LEU H . . 4.650 3.704 3.081 3.924 . 0 0 "[ . 1 . 2]" 1
2129 1 64 GLU HB3 1 65 LEU H . . 4.650 4.280 3.964 4.405 . 0 0 "[ . 1 . 2]" 1
2130 1 64 GLU QG 1 67 LYS H . . 4.330 3.340 2.910 3.685 . 0 0 "[ . 1 . 2]" 1
2131 1 64 GLU QG 1 67 LYS QG . . 4.040 2.919 2.298 3.889 . 0 0 "[ . 1 . 2]" 1
2132 1 64 GLU QG 1 68 CYS H . . 4.740 3.248 2.941 3.685 . 0 0 "[ . 1 . 2]" 1
2133 1 64 GLU QG 1 68 CYS QB . . 4.160 4.025 2.978 4.199 0.039 2 0 "[ . 1 . 2]" 1
2134 1 64 GLU HG2 1 68 CYS H . . 5.470 3.683 2.989 5.111 . 0 0 "[ . 1 . 2]" 1
2135 1 64 GLU HG3 1 68 CYS H . . 5.470 4.260 3.245 4.986 . 0 0 "[ . 1 . 2]" 1
2136 1 65 LEU H 1 65 LEU QB . . 3.150 2.156 2.092 2.201 . 0 0 "[ . 1 . 2]" 1
2137 1 65 LEU H 1 65 LEU MD1 . . 4.400 4.171 4.099 4.258 . 0 0 "[ . 1 . 2]" 1
2138 1 65 LEU H 1 65 LEU MD2 . . 4.400 4.215 4.150 4.297 . 0 0 "[ . 1 . 2]" 1
2139 1 65 LEU H 1 65 LEU HG . . 4.550 4.412 4.328 4.453 . 0 0 "[ . 1 . 2]" 1
2140 1 65 LEU H 1 66 GLU H . . 3.820 2.933 2.544 3.114 . 0 0 "[ . 1 . 2]" 1
2141 1 65 LEU H 1 66 GLU QB . . 5.130 5.016 4.669 5.147 0.017 11 0 "[ . 1 . 2]" 1
2142 1 65 LEU H 1 66 GLU QG . . 4.670 4.465 3.811 4.714 0.044 6 0 "[ . 1 . 2]" 1
2143 1 65 LEU HA 1 65 LEU MD1 . . 4.250 2.271 2.222 2.347 . 0 0 "[ . 1 . 2]" 1
2144 1 65 LEU HA 1 65 LEU QD . . 3.180 2.258 2.211 2.332 . 0 0 "[ . 1 . 2]" 1
2145 1 65 LEU HA 1 65 LEU MD2 . . 4.250 3.966 3.939 4.007 . 0 0 "[ . 1 . 2]" 1
2146 1 65 LEU HA 1 65 LEU HG . . 3.750 3.250 3.191 3.306 . 0 0 "[ . 1 . 2]" 1
2147 1 65 LEU HA 1 67 LYS H . . 5.290 4.104 3.807 4.384 . 0 0 "[ . 1 . 2]" 1
2148 1 65 LEU HA 1 68 CYS H . . 4.280 3.608 3.395 3.840 . 0 0 "[ . 1 . 2]" 1
2149 1 65 LEU HA 1 68 CYS QB . . 4.280 2.732 2.457 3.192 . 0 0 "[ . 1 . 2]" 1
2150 1 65 LEU HA 1 69 ARG H . . 4.620 3.695 3.382 3.909 . 0 0 "[ . 1 . 2]" 1
2151 1 65 LEU QB 1 65 LEU QD . . 2.830 1.990 1.978 2.006 . 0 0 "[ . 1 . 2]" 1
2152 1 65 LEU QB 1 66 GLU H . . 3.200 2.535 2.397 2.833 . 0 0 "[ . 1 . 2]" 1
2153 1 65 LEU QB 1 66 GLU HA . . 4.800 4.278 4.163 4.453 . 0 0 "[ . 1 . 2]" 1
2154 1 65 LEU QB 1 66 GLU QG . . 4.720 3.890 3.115 4.735 0.015 2 0 "[ . 1 . 2]" 1
2155 1 65 LEU QD 1 66 GLU H . . 4.040 3.782 3.647 4.000 . 0 0 "[ . 1 . 2]" 1
2156 1 65 LEU QD 1 66 GLU HA . . 4.050 4.083 3.799 4.248 0.198 2 0 "[ . 1 . 2]" 1
2157 1 65 LEU QD 1 66 GLU QB . . 5.270 4.524 4.174 4.958 . 0 0 "[ . 1 . 2]" 1
2158 1 65 LEU QD 1 69 ARG H . . 4.170 3.620 3.281 3.828 . 0 0 "[ . 1 . 2]" 1
2159 1 65 LEU QD 1 69 ARG HA . . 4.270 4.063 3.632 4.319 0.049 4 0 "[ . 1 . 2]" 1
2160 1 65 LEU QD 1 69 ARG QB . . 4.280 2.645 2.194 2.883 . 0 0 "[ . 1 . 2]" 1
2161 1 65 LEU QD 1 69 ARG QD . . 3.480 3.370 2.956 4.139 0.659 5 2 "[ + 1 -. 2]" 1
2162 1 65 LEU MD1 1 66 GLU H . . 4.610 4.411 4.298 4.579 . 0 0 "[ . 1 . 2]" 1
2163 1 65 LEU MD1 1 69 ARG HD2 . . 5.500 4.583 3.855 5.162 . 0 0 "[ . 1 . 2]" 1
2164 1 65 LEU MD1 1 69 ARG HD3 . . 5.500 3.742 3.197 4.859 . 0 0 "[ . 1 . 2]" 1
2165 1 65 LEU MD2 1 66 GLU H . . 4.610 4.119 3.942 4.411 . 0 0 "[ . 1 . 2]" 1
2166 1 65 LEU MD2 1 69 ARG HD2 . . 5.500 5.289 4.626 5.545 0.045 14 0 "[ . 1 . 2]" 1
2167 1 65 LEU MD2 1 69 ARG HD3 . . 5.500 4.358 3.851 5.531 0.031 5 0 "[ . 1 . 2]" 1
2168 1 65 LEU HG 1 66 GLU H . . 4.700 3.481 3.279 3.787 . 0 0 "[ . 1 . 2]" 1
2169 1 65 LEU HG 1 69 ARG H . . 5.500 4.636 4.418 4.787 . 0 0 "[ . 1 . 2]" 1
2170 1 65 LEU HG 1 69 ARG QD . . 4.360 3.195 2.545 4.307 . 0 0 "[ . 1 . 2]" 1
2171 1 66 GLU H 1 66 GLU QB . . 2.880 2.437 2.243 2.583 . 0 0 "[ . 1 . 2]" 1
2172 1 66 GLU H 1 66 GLU HG2 . . 3.900 2.810 2.174 3.747 . 0 0 "[ . 1 . 2]" 1
2173 1 66 GLU H 1 66 GLU QG . . 3.260 2.369 2.106 2.780 . 0 0 "[ . 1 . 2]" 1
2174 1 66 GLU H 1 66 GLU HG3 . . 3.900 3.099 2.127 3.802 . 0 0 "[ . 1 . 2]" 1
2175 1 66 GLU H 1 67 LYS H . . 3.480 2.819 2.647 2.952 . 0 0 "[ . 1 . 2]" 1
2176 1 66 GLU HA 1 66 GLU QG . . 3.570 2.986 2.235 3.502 . 0 0 "[ . 1 . 2]" 1
2177 1 66 GLU HA 1 69 ARG H . . 4.320 4.152 3.907 4.327 0.007 14 0 "[ . 1 . 2]" 1
2178 1 66 GLU HA 1 69 ARG HD2 . . 4.240 3.991 2.818 4.272 0.032 4 0 "[ . 1 . 2]" 1
2179 1 66 GLU HA 1 69 ARG QD . . 3.560 2.623 2.112 2.920 . 0 0 "[ . 1 . 2]" 1
2180 1 66 GLU HA 1 69 ARG HD3 . . 4.240 2.793 2.121 4.292 0.052 14 0 "[ . 1 . 2]" 1
2181 1 66 GLU HA 1 69 ARG HE . . 4.630 2.898 2.109 4.282 . 0 0 "[ . 1 . 2]" 1
2182 1 66 GLU HA 1 69 ARG QG . . 3.300 2.878 2.637 3.279 . 0 0 "[ . 1 . 2]" 1
2183 1 66 GLU QB 1 67 LYS H . . 3.960 3.447 2.799 3.843 . 0 0 "[ . 1 . 2]" 1
2184 1 66 GLU QG 1 67 LYS H . . 4.540 3.416 2.132 4.533 . 0 0 "[ . 1 . 2]" 1
2185 1 67 LYS H 1 67 LYS HB2 . . 3.850 2.642 2.446 2.975 . 0 0 "[ . 1 . 2]" 1
2186 1 67 LYS H 1 67 LYS QB . . 3.110 2.478 2.229 2.708 . 0 0 "[ . 1 . 2]" 1
2187 1 67 LYS H 1 67 LYS HB3 . . 3.850 3.335 2.395 3.836 . 0 0 "[ . 1 . 2]" 1
2188 1 67 LYS H 1 67 LYS QD . . 4.470 4.036 3.385 4.547 0.077 9 0 "[ . 1 . 2]" 1
2189 1 67 LYS H 1 67 LYS HG2 . . 4.850 3.555 2.593 4.782 . 0 0 "[ . 1 . 2]" 1
2190 1 67 LYS H 1 67 LYS QG . . 4.060 3.302 2.560 4.124 0.064 3 0 "[ . 1 . 2]" 1
2191 1 67 LYS H 1 67 LYS HG3 . . 4.850 4.295 3.957 4.545 . 0 0 "[ . 1 . 2]" 1
2192 1 67 LYS H 1 68 CYS H . . 3.130 2.160 1.989 2.376 . 0 0 "[ . 1 . 2]" 1
2193 1 67 LYS H 1 68 CYS QB . . 4.830 4.028 3.682 4.334 . 0 0 "[ . 1 . 2]" 1
2194 1 67 LYS H 1 69 ARG H . . 4.350 3.701 3.431 4.007 . 0 0 "[ . 1 . 2]" 1
2195 1 67 LYS H 1 69 ARG QD . . 5.190 5.189 4.986 5.243 0.053 9 0 "[ . 1 . 2]" 1
2196 1 67 LYS HA 1 67 LYS QD . . 3.360 2.222 2.026 2.423 . 0 0 "[ . 1 . 2]" 1
2197 1 67 LYS HA 1 67 LYS QE . . 4.390 3.871 2.464 4.397 0.007 4 0 "[ . 1 . 2]" 1
2198 1 67 LYS HA 1 67 LYS HG2 . . 3.870 3.425 2.973 3.868 . 0 0 "[ . 1 . 2]" 1
2199 1 67 LYS HA 1 67 LYS QG . . 3.200 2.997 2.483 3.202 0.002 14 0 "[ . 1 . 2]" 1
2200 1 67 LYS HA 1 67 LYS HG3 . . 3.870 3.512 2.528 3.862 . 0 0 "[ . 1 . 2]" 1
2201 1 67 LYS QB 1 67 LYS QE . . 4.080 3.478 2.131 3.946 . 0 0 "[ . 1 . 2]" 1
2202 1 67 LYS HB2 1 67 LYS QE . . 4.750 4.067 2.145 4.577 . 0 0 "[ . 1 . 2]" 1
2203 1 67 LYS HB2 1 68 CYS H . . 4.180 3.162 2.617 4.052 . 0 0 "[ . 1 . 2]" 1
2204 1 67 LYS HB2 1 68 CYS QB . . 5.500 4.947 4.392 5.544 0.044 3 0 "[ . 1 . 2]" 1
2205 1 67 LYS HB3 1 67 LYS QE . . 4.750 3.978 2.211 4.573 . 0 0 "[ . 1 . 2]" 1
2206 1 67 LYS HB3 1 68 CYS H . . 4.180 3.358 2.225 3.977 . 0 0 "[ . 1 . 2]" 1
2207 1 67 LYS HB3 1 68 CYS QB . . 5.500 4.996 3.918 5.586 0.086 16 0 "[ . 1 . 2]" 1
2208 1 67 LYS QD 1 68 CYS H . . 5.410 4.880 4.698 5.035 . 0 0 "[ . 1 . 2]" 1
2209 1 67 LYS QE 1 67 LYS HG2 . . 3.800 2.762 2.359 3.566 . 0 0 "[ . 1 . 2]" 1
2210 1 67 LYS QE 1 67 LYS HG3 . . 3.800 2.764 2.188 3.590 . 0 0 "[ . 1 . 2]" 1
2211 1 68 CYS H 1 68 CYS QB . . 3.570 2.281 2.150 2.385 . 0 0 "[ . 1 . 2]" 1
2212 1 68 CYS H 1 69 ARG H . . 2.990 2.705 2.455 2.856 . 0 0 "[ . 1 . 2]" 1
2213 1 68 CYS H 1 69 ARG QG . . 5.340 4.175 3.881 4.375 . 0 0 "[ . 1 . 2]" 1
2214 1 68 CYS QB 1 69 ARG H . . 4.470 2.959 2.796 3.217 . 0 0 "[ . 1 . 2]" 1
2215 1 69 ARG H 1 69 ARG HB2 . . 4.000 3.615 3.591 3.645 . 0 0 "[ . 1 . 2]" 1
2216 1 69 ARG H 1 69 ARG QB . . 3.430 2.443 2.354 2.512 . 0 0 "[ . 1 . 2]" 1
2217 1 69 ARG H 1 69 ARG HB3 . . 4.000 2.484 2.386 2.560 . 0 0 "[ . 1 . 2]" 1
2218 1 69 ARG H 1 69 ARG HD2 . . 5.090 4.769 4.563 4.906 . 0 0 "[ . 1 . 2]" 1
2219 1 69 ARG H 1 69 ARG QD . . 4.400 3.809 3.633 4.241 . 0 0 "[ . 1 . 2]" 1
2220 1 69 ARG H 1 69 ARG HD3 . . 5.090 4.032 3.777 4.892 . 0 0 "[ . 1 . 2]" 1
2221 1 69 ARG H 1 69 ARG QG . . 2.960 2.287 2.171 2.594 . 0 0 "[ . 1 . 2]" 1
2222 1 69 ARG HA 1 69 ARG HD2 . . 5.460 4.873 4.646 5.508 0.048 5 0 "[ . 1 . 2]" 1
2223 1 69 ARG HA 1 69 ARG QD . . 4.630 4.306 4.185 4.526 . 0 0 "[ . 1 . 2]" 1
2224 1 69 ARG HA 1 69 ARG HD3 . . 5.460 4.814 4.682 5.085 . 0 0 "[ . 1 . 2]" 1
2225 1 69 ARG HA 1 70 GLY H . . 2.970 2.263 2.138 2.333 . 0 0 "[ . 1 . 2]" 1
2226 1 69 ARG HA 1 70 GLY HA3 . . 4.320 4.349 4.332 4.374 0.054 2 0 "[ . 1 . 2]" 1
2227 1 69 ARG QB 1 69 ARG QD . . 3.330 2.161 2.055 2.413 . 0 0 "[ . 1 . 2]" 1
2228 1 69 ARG QB 1 69 ARG HE . . 4.980 3.907 2.463 4.211 . 0 0 "[ . 1 . 2]" 1
2229 1 69 ARG QB 1 70 GLY H . . 3.420 2.506 2.357 2.672 . 0 0 "[ . 1 . 2]" 1
2230 1 69 ARG QD 1 70 GLY H . . 4.630 4.471 4.202 4.604 . 0 0 "[ . 1 . 2]" 1
2231 1 69 ARG HD2 1 70 GLY H . . 5.500 4.832 4.424 5.571 0.071 14 0 "[ . 1 . 2]" 1
2232 1 69 ARG HD3 1 70 GLY H . . 5.500 5.415 4.427 5.586 0.086 9 0 "[ . 1 . 2]" 1
2233 1 69 ARG QG 1 70 GLY H . . 4.160 3.494 3.069 3.781 . 0 0 "[ . 1 . 2]" 1
2234 1 69 ARG QG 1 70 GLY HA2 . . 4.330 3.385 2.793 3.702 . 0 0 "[ . 1 . 2]" 1
2235 1 69 ARG QG 1 70 GLY HA3 . . 5.340 4.473 3.971 4.792 . 0 0 "[ . 1 . 2]" 1
2236 1 69 ARG HG2 1 70 GLY H . . 4.900 4.623 4.237 4.842 . 0 0 "[ . 1 . 2]" 1
2237 1 69 ARG HG3 1 70 GLY H . . 4.900 3.617 3.150 3.947 . 0 0 "[ . 1 . 2]" 1
2238 1 70 GLY H 1 71 VAL H . . 4.580 4.407 4.336 4.441 . 0 0 "[ . 1 . 2]" 1
2239 1 70 GLY H 1 71 VAL MG1 . . 5.500 5.150 5.011 5.256 . 0 0 "[ . 1 . 2]" 1
2240 1 70 GLY HA2 1 71 VAL H . . 3.240 2.423 2.379 2.494 . 0 0 "[ . 1 . 2]" 1
2241 1 70 GLY HA2 1 71 VAL HA . . 4.650 4.437 4.381 4.487 . 0 0 "[ . 1 . 2]" 1
2242 1 70 GLY HA2 1 71 VAL MG1 . . 4.240 3.764 3.587 3.882 . 0 0 "[ . 1 . 2]" 1
2243 1 70 GLY HA2 1 71 VAL MG2 . . 4.100 4.111 4.084 4.127 0.027 10 0 "[ . 1 . 2]" 1
2244 1 70 GLY HA3 1 71 VAL H . . 3.340 2.595 2.540 2.644 . 0 0 "[ . 1 . 2]" 1
2245 1 70 GLY HA3 1 71 VAL MG1 . . 4.660 4.628 4.497 4.699 0.039 11 0 "[ . 1 . 2]" 1
2246 1 70 GLY HA3 1 71 VAL MG2 . . 4.370 4.368 4.288 4.402 0.032 9 0 "[ . 1 . 2]" 1
2247 1 71 VAL H 1 71 VAL HB . . 4.070 3.758 3.719 3.781 . 0 0 "[ . 1 . 2]" 1
2248 1 71 VAL H 1 71 VAL MG1 . . 3.310 2.668 2.524 2.778 . 0 0 "[ . 1 . 2]" 1
2249 1 71 VAL H 1 71 VAL MG2 . . 2.930 2.148 2.115 2.184 . 0 0 "[ . 1 . 2]" 1
2250 1 71 VAL H 1 72 PHE H . . 4.500 4.534 4.520 4.549 0.049 17 0 "[ . 1 . 2]" 1
2251 1 71 VAL HA 1 71 VAL MG1 . . 3.100 2.368 2.312 2.417 . 0 0 "[ . 1 . 2]" 1
2252 1 71 VAL HA 1 71 VAL MG2 . . 3.680 3.260 3.220 3.298 . 0 0 "[ . 1 . 2]" 1
2253 1 71 VAL HA 1 72 PHE H . . 3.000 2.175 2.140 2.213 . 0 0 "[ . 1 . 2]" 1
2254 1 71 VAL HA 1 72 PHE HA . . 4.760 4.459 4.428 4.501 . 0 0 "[ . 1 . 2]" 1
2255 1 71 VAL HA 1 72 PHE HB3 . . 4.870 4.580 4.528 4.655 . 0 0 "[ . 1 . 2]" 1
2256 1 71 VAL HB 1 72 PHE H . . 3.510 2.880 2.779 3.028 . 0 0 "[ . 1 . 2]" 1
2257 1 71 VAL MG1 1 72 PHE H . . 3.910 3.837 3.761 3.919 0.009 9 0 "[ . 1 . 2]" 1
2258 1 71 VAL MG2 1 72 PHE H . . 4.170 3.825 3.728 3.896 . 0 0 "[ . 1 . 2]" 1
2259 1 71 VAL MG2 1 72 PHE HA . . 4.120 3.849 3.736 3.948 . 0 0 "[ . 1 . 2]" 1
2260 1 72 PHE H 1 72 PHE HZ . . 5.500 5.482 5.406 5.521 0.021 19 0 "[ . 1 . 2]" 1
2261 1 72 PHE H 1 73 PRO HA . . 5.210 5.120 5.061 5.216 0.006 12 0 "[ . 1 . 2]" 1
2262 1 72 PHE H 1 73 PRO HD2 . . 4.930 4.922 4.891 4.946 0.016 4 0 "[ . 1 . 2]" 1
2263 1 72 PHE H 1 73 PRO HD3 . . 5.090 5.057 4.985 5.112 0.022 1 0 "[ . 1 . 2]" 1
2264 1 72 PHE HA 1 73 PRO HD2 . . 3.280 2.417 2.352 2.496 . 0 0 "[ . 1 . 2]" 1
2265 1 72 PHE HA 1 73 PRO HD3 . . 3.160 2.485 2.398 2.546 . 0 0 "[ . 1 . 2]" 1
2266 1 72 PHE HA 1 73 PRO HG2 . . 5.010 4.544 4.498 4.593 . 0 0 "[ . 1 . 2]" 1
2267 1 72 PHE HA 1 73 PRO HG3 . . 4.840 4.633 4.589 4.668 . 0 0 "[ . 1 . 2]" 1
2268 1 72 PHE HB2 1 73 PRO HA . . 5.250 4.918 4.841 4.979 . 0 0 "[ . 1 . 2]" 1
2269 1 72 PHE HB2 1 73 PRO HD3 . . 3.830 3.594 3.482 3.663 . 0 0 "[ . 1 . 2]" 1
2270 1 72 PHE HB2 1 73 PRO HG2 . . 4.700 3.806 3.691 3.909 . 0 0 "[ . 1 . 2]" 1
2271 1 72 PHE HB2 1 73 PRO HG3 . . 5.460 4.774 4.707 4.839 . 0 0 "[ . 1 . 2]" 1
2272 1 72 PHE HB2 1 77 THR MG . . 5.070 4.188 3.989 4.326 . 0 0 "[ . 1 . 2]" 1
2273 1 72 PHE HB3 1 73 PRO HD2 . . 3.740 3.354 3.253 3.428 . 0 0 "[ . 1 . 2]" 1
2274 1 72 PHE HB3 1 73 PRO HD3 . . 4.530 4.411 4.334 4.471 . 0 0 "[ . 1 . 2]" 1
2275 1 72 PHE HB3 1 73 PRO HG2 . . 5.500 5.395 5.256 5.507 0.007 7 0 "[ . 1 . 2]" 1
2276 1 72 PHE HB3 1 77 THR MG . . 5.290 5.097 4.901 5.244 . 0 0 "[ . 1 . 2]" 1
2277 1 72 PHE QD 1 73 PRO HD2 . . 4.930 3.760 3.569 3.881 . 0 0 "[ . 1 . 2]" 1
2278 1 72 PHE QD 1 74 GLU HA . . 4.000 2.827 2.719 2.963 . 0 0 "[ . 1 . 2]" 1
2279 1 72 PHE QE 1 74 GLU HA . . 4.110 2.635 2.525 2.758 . 0 0 "[ . 1 . 2]" 1
2280 1 73 PRO HA 1 74 GLU H . . 2.890 2.235 2.197 2.265 . 0 0 "[ . 1 . 2]" 1
2281 1 73 PRO HA 1 74 GLU HB3 . . 4.550 4.508 4.438 4.556 0.006 10 0 "[ . 1 . 2]" 1
2282 1 73 PRO HA 1 74 GLU HG2 . . 5.080 4.199 3.875 4.512 . 0 0 "[ . 1 . 2]" 1
2283 1 73 PRO HA 1 75 ASN H . . 4.230 3.672 3.613 3.730 . 0 0 "[ . 1 . 2]" 1
2284 1 73 PRO HA 1 75 ASN QD . . 4.970 4.990 4.952 5.020 0.050 12 0 "[ . 1 . 2]" 1
2285 1 73 PRO HA 1 76 PHE H . . 4.850 4.661 4.590 4.767 . 0 0 "[ . 1 . 2]" 1
2286 1 73 PRO HA 1 76 PHE QD . . 5.500 4.817 4.731 4.949 . 0 0 "[ . 1 . 2]" 1
2287 1 73 PRO HA 2 6 ALA MB . . 4.420 4.257 4.065 4.425 0.005 16 0 "[ . 1 . 2]" 1
2288 1 73 PRO HA 2 7 PRO HD2 . . 4.060 3.092 2.869 3.243 . 0 0 "[ . 1 . 2]" 1
2289 1 73 PRO HA 2 7 PRO HD3 . . 4.910 3.749 3.527 3.938 . 0 0 "[ . 1 . 2]" 1
2290 1 73 PRO HA 2 7 PRO QG . . 5.290 3.666 3.470 3.902 . 0 0 "[ . 1 . 2]" 1
2291 1 73 PRO HB2 1 75 ASN H . . 3.290 3.201 3.146 3.241 . 0 0 "[ . 1 . 2]" 1
2292 1 73 PRO HB2 1 75 ASN HB3 . . 4.900 4.926 4.898 4.943 0.043 19 0 "[ . 1 . 2]" 1
2293 1 73 PRO HB2 1 76 PHE H . . 4.250 3.108 2.959 3.350 . 0 0 "[ . 1 . 2]" 1
2294 1 73 PRO HB2 1 76 PHE QD . . 3.580 2.233 2.145 2.380 . 0 0 "[ . 1 . 2]" 1
2295 1 73 PRO HB2 2 6 ALA HA . . 4.020 2.893 2.776 3.005 . 0 0 "[ . 1 . 2]" 1
2296 1 73 PRO HB2 2 6 ALA MB . . 3.760 3.566 3.465 3.717 . 0 0 "[ . 1 . 2]" 1
2297 1 73 PRO HB2 2 7 PRO HD2 . . 3.860 3.545 3.420 3.630 . 0 0 "[ . 1 . 2]" 1
2298 1 73 PRO HB2 2 7 PRO HD3 . . 4.110 3.263 2.978 3.474 . 0 0 "[ . 1 . 2]" 1
2299 1 73 PRO HB3 1 74 GLU H . . 4.360 4.327 4.255 4.362 0.002 8 0 "[ . 1 . 2]" 1
2300 1 73 PRO HB3 1 75 ASN H . . 4.490 4.513 4.495 4.527 0.037 15 0 "[ . 1 . 2]" 1
2301 1 73 PRO HB3 1 76 PHE QD . . 4.590 3.700 3.633 3.772 . 0 0 "[ . 1 . 2]" 1
2302 1 73 PRO HB3 2 6 ALA HA . . 4.400 2.303 2.236 2.405 . 0 0 "[ . 1 . 2]" 1
2303 1 73 PRO HB3 2 6 ALA MB . . 3.720 2.488 2.314 2.657 . 0 0 "[ . 1 . 2]" 1
2304 1 73 PRO HB3 2 7 PRO HD2 . . 4.080 2.236 2.180 2.291 . 0 0 "[ . 1 . 2]" 1
2305 1 73 PRO HB3 2 7 PRO HD3 . . 4.220 2.844 2.475 3.037 . 0 0 "[ . 1 . 2]" 1
2306 1 73 PRO HD2 1 76 PHE HB2 . . 4.500 3.855 3.625 4.093 . 0 0 "[ . 1 . 2]" 1
2307 1 73 PRO HD2 1 76 PHE HB3 . . 5.500 5.153 4.883 5.425 . 0 0 "[ . 1 . 2]" 1
2308 1 73 PRO HD2 1 76 PHE QD . . 5.460 4.582 4.452 4.717 . 0 0 "[ . 1 . 2]" 1
2309 1 73 PRO HD2 2 6 ALA MB . . 4.650 4.368 4.074 4.528 . 0 0 "[ . 1 . 2]" 1
2310 1 73 PRO HD3 2 6 ALA MB . . 4.530 3.259 2.905 3.407 . 0 0 "[ . 1 . 2]" 1
2311 1 73 PRO HG2 1 75 ASN H . . 5.090 4.834 4.730 4.903 . 0 0 "[ . 1 . 2]" 1
2312 1 73 PRO HG2 1 76 PHE H . . 3.690 3.371 3.263 3.549 . 0 0 "[ . 1 . 2]" 1
2313 1 73 PRO HG2 1 76 PHE HB2 . . 3.570 2.352 2.261 2.581 . 0 0 "[ . 1 . 2]" 1
2314 1 73 PRO HG2 1 76 PHE HB3 . . 4.090 3.812 3.733 4.037 . 0 0 "[ . 1 . 2]" 1
2315 1 73 PRO HG2 1 76 PHE QD . . 3.800 2.476 2.311 2.614 . 0 0 "[ . 1 . 2]" 1
2316 1 73 PRO HG2 1 76 PHE QE . . 5.360 3.860 3.612 3.999 . 0 0 "[ . 1 . 2]" 1
2317 1 73 PRO HG2 2 6 ALA HA . . 4.950 4.430 4.271 4.509 . 0 0 "[ . 1 . 2]" 1
2318 1 73 PRO HG2 2 6 ALA MB . . 4.190 3.816 3.696 3.950 . 0 0 "[ . 1 . 2]" 1
2319 1 73 PRO HG2 2 7 PRO HD2 . . 5.410 5.259 5.196 5.327 . 0 0 "[ . 1 . 2]" 1
2320 1 73 PRO HG3 1 75 ASN QD . . 5.340 4.903 4.732 5.209 . 0 0 "[ . 1 . 2]" 1
2321 1 73 PRO HG3 1 76 PHE H . . 5.450 4.858 4.756 5.076 . 0 0 "[ . 1 . 2]" 1
2322 1 73 PRO HG3 1 76 PHE HB2 . . 4.470 4.036 3.949 4.264 . 0 0 "[ . 1 . 2]" 1
2323 1 73 PRO HG3 1 76 PHE QD . . 3.930 3.174 3.017 3.309 . 0 0 "[ . 1 . 2]" 1
2324 1 73 PRO HG3 2 6 ALA HA . . 4.900 3.384 3.131 3.492 . 0 0 "[ . 1 . 2]" 1
2325 1 73 PRO HG3 2 6 ALA MB . . 3.670 2.304 2.170 2.413 . 0 0 "[ . 1 . 2]" 1
2326 1 73 PRO HG3 2 7 PRO HD2 . . 4.920 4.427 4.342 4.507 . 0 0 "[ . 1 . 2]" 1
2327 1 74 GLU H 1 74 GLU HB2 . . 3.720 3.561 3.525 3.585 . 0 0 "[ . 1 . 2]" 1
2328 1 74 GLU H 1 74 GLU HB3 . . 3.310 2.303 2.258 2.339 . 0 0 "[ . 1 . 2]" 1
2329 1 74 GLU H 1 74 GLU HG2 . . 4.080 2.527 2.360 2.682 . 0 0 "[ . 1 . 2]" 1
2330 1 74 GLU H 1 74 GLU HG3 . . 4.260 3.793 3.710 3.914 . 0 0 "[ . 1 . 2]" 1
2331 1 74 GLU H 1 75 ASN H . . 3.400 2.863 2.743 2.925 . 0 0 "[ . 1 . 2]" 1
2332 1 74 GLU HA 1 74 GLU HG2 . . 3.930 3.774 3.688 3.843 . 0 0 "[ . 1 . 2]" 1
2333 1 74 GLU HA 1 74 GLU HG3 . . 3.750 3.762 3.722 3.789 0.039 2 0 "[ . 1 . 2]" 1
2334 1 74 GLU HA 1 76 PHE H . . 4.420 3.817 3.566 3.972 . 0 0 "[ . 1 . 2]" 1
2335 1 74 GLU HA 1 77 THR H . . 4.120 3.712 3.582 3.886 . 0 0 "[ . 1 . 2]" 1
2336 1 74 GLU HA 1 77 THR HG1 . . 3.230 2.776 2.646 2.939 . 0 0 "[ . 1 . 2]" 1
2337 1 74 GLU HA 1 77 THR MG . . 3.960 3.826 3.648 3.971 0.011 12 0 "[ . 1 . 2]" 1
2338 1 74 GLU HB2 1 75 ASN H . . 4.240 4.104 3.980 4.182 . 0 0 "[ . 1 . 2]" 1
2339 1 74 GLU HB3 1 75 ASN H . . 4.180 4.007 3.923 4.079 . 0 0 "[ . 1 . 2]" 1
2340 1 74 GLU HG2 1 75 ASN H . . 4.200 2.502 2.190 2.663 . 0 0 "[ . 1 . 2]" 1
2341 1 74 GLU HG2 1 75 ASN HA . . 4.360 4.320 4.034 4.383 0.023 7 0 "[ . 1 . 2]" 1
2342 1 74 GLU HG2 1 75 ASN HB2 . . 5.500 5.307 4.963 5.506 0.006 3 0 "[ . 1 . 2]" 1
2343 1 74 GLU HG2 1 75 ASN HB3 . . 5.050 3.776 3.470 4.007 . 0 0 "[ . 1 . 2]" 1
2344 1 74 GLU HG3 1 75 ASN H . . 4.150 2.969 2.745 3.201 . 0 0 "[ . 1 . 2]" 1
2345 1 74 GLU HG3 1 75 ASN HA . . 4.990 3.456 3.300 3.721 . 0 0 "[ . 1 . 2]" 1
2346 1 74 GLU HG3 1 75 ASN HB2 . . 5.250 5.085 4.852 5.273 0.023 2 0 "[ . 1 . 2]" 1
2347 1 74 GLU HG3 1 75 ASN HB3 . . 5.020 3.628 3.334 3.882 . 0 0 "[ . 1 . 2]" 1
2348 1 74 GLU HG3 1 77 THR HG1 . . 5.380 4.862 4.634 5.291 . 0 0 "[ . 1 . 2]" 1
2349 1 75 ASN H 1 75 ASN HB2 . . 3.570 3.567 3.549 3.578 0.008 17 0 "[ . 1 . 2]" 1
2350 1 75 ASN H 1 75 ASN HB3 . . 3.290 2.716 2.669 2.806 . 0 0 "[ . 1 . 2]" 1
2351 1 75 ASN H 1 75 ASN QD . . 4.590 3.844 3.790 3.885 . 0 0 "[ . 1 . 2]" 1
2352 1 75 ASN H 1 76 PHE H . . 3.420 2.712 2.627 2.776 . 0 0 "[ . 1 . 2]" 1
2353 1 75 ASN H 1 76 PHE QD . . 4.740 4.118 3.966 4.383 . 0 0 "[ . 1 . 2]" 1
2354 1 75 ASN H 1 77 THR H . . 4.360 4.201 4.112 4.354 . 0 0 "[ . 1 . 2]" 1
2355 1 75 ASN HA 1 75 ASN HB2 . . 2.920 2.514 2.489 2.540 . 0 0 "[ . 1 . 2]" 1
2356 1 75 ASN HA 1 75 ASN HB3 . . 2.900 2.363 2.316 2.405 . 0 0 "[ . 1 . 2]" 1
2357 1 75 ASN HB2 1 75 ASN QD . . 3.360 2.214 2.181 2.286 . 0 0 "[ . 1 . 2]" 1
2358 1 75 ASN HB2 1 75 ASN HD22 . . 4.000 3.521 3.501 3.546 . 0 0 "[ . 1 . 2]" 1
2359 1 75 ASN HB2 2 4 PRO HB2 . . 4.750 3.554 3.260 3.694 . 0 0 "[ . 1 . 2]" 1
2360 1 75 ASN HB2 2 4 PRO HB3 . . 4.380 3.529 3.144 3.819 . 0 0 "[ . 1 . 2]" 1
2361 1 75 ASN HB3 1 75 ASN QD . . 3.460 3.085 2.954 3.163 . 0 0 "[ . 1 . 2]" 1
2362 1 75 ASN HB3 2 4 PRO HB2 . . 5.130 5.055 4.804 5.143 0.013 9 0 "[ . 1 . 2]" 1
2363 1 75 ASN HB3 2 4 PRO HB3 . . 5.500 5.262 4.898 5.514 0.014 9 0 "[ . 1 . 2]" 1
2364 1 75 ASN QD 1 76 PHE QD . . 4.230 3.275 3.037 3.596 . 0 0 "[ . 1 . 2]" 1
2365 1 75 ASN QD 2 4 PRO HB3 . . 4.390 3.186 2.908 3.413 . 0 0 "[ . 1 . 2]" 1
2366 1 75 ASN QD 2 5 VAL H . . 4.440 2.617 2.327 3.079 . 0 0 "[ . 1 . 2]" 1
2367 1 75 ASN QD 2 6 ALA MB . . 4.480 4.240 4.116 4.389 . 0 0 "[ . 1 . 2]" 1
2368 1 75 ASN QD 2 7 PRO HD2 . . 4.730 4.192 4.025 4.363 . 0 0 "[ . 1 . 2]" 1
2369 1 75 ASN QD 2 7 PRO HD3 . . 3.850 2.706 2.467 2.932 . 0 0 "[ . 1 . 2]" 1
2370 1 75 ASN QD 2 7 PRO QG . . 4.610 4.163 3.675 4.461 . 0 0 "[ . 1 . 2]" 1
2371 1 75 ASN HD21 2 4 PRO HB2 . . 4.620 2.494 2.181 2.831 . 0 0 "[ . 1 . 2]" 1
2372 1 75 ASN HD21 2 7 PRO HD3 . . 4.610 4.357 4.139 4.581 . 0 0 "[ . 1 . 2]" 1
2373 1 75 ASN HD22 2 4 PRO HB2 . . 4.620 3.365 3.109 3.706 . 0 0 "[ . 1 . 2]" 1
2374 1 75 ASN HD22 2 7 PRO HD3 . . 4.610 2.733 2.486 2.967 . 0 0 "[ . 1 . 2]" 1
2375 1 76 PHE H 1 76 PHE HB2 . . 3.470 2.373 2.351 2.407 . 0 0 "[ . 1 . 2]" 1
2376 1 76 PHE H 1 76 PHE HB3 . . 3.860 3.600 3.576 3.616 . 0 0 "[ . 1 . 2]" 1
2377 1 76 PHE H 1 76 PHE QD . . 3.420 2.597 2.407 2.789 . 0 0 "[ . 1 . 2]" 1
2378 1 76 PHE H 1 77 THR H . . 3.110 2.555 2.359 2.684 . 0 0 "[ . 1 . 2]" 1
2379 1 76 PHE H 1 77 THR HG1 . . 4.340 4.004 3.775 4.384 0.044 2 0 "[ . 1 . 2]" 1
2380 1 76 PHE H 1 77 THR MG . . 4.580 3.994 3.852 4.158 . 0 0 "[ . 1 . 2]" 1
2381 1 76 PHE HA 1 76 PHE QD . . 3.490 3.073 3.027 3.134 . 0 0 "[ . 1 . 2]" 1
2382 1 76 PHE HA 2 4 PRO HB2 . . 4.700 3.896 3.516 4.589 . 0 0 "[ . 1 . 2]" 1
2383 1 76 PHE HA 2 4 PRO HG2 . . 4.050 3.236 2.997 3.532 . 0 0 "[ . 1 . 2]" 1
2384 1 76 PHE HA 2 4 PRO QG . . 3.430 2.387 2.205 2.629 . 0 0 "[ . 1 . 2]" 1
2385 1 76 PHE HA 2 4 PRO HG3 . . 4.050 2.461 2.259 2.778 . 0 0 "[ . 1 . 2]" 1
2386 1 76 PHE HB2 1 77 THR H . . 4.290 3.638 3.527 3.776 . 0 0 "[ . 1 . 2]" 1
2387 1 76 PHE HB2 1 77 THR MG . . 3.830 3.267 3.123 3.377 . 0 0 "[ . 1 . 2]" 1
2388 1 76 PHE HB3 1 77 THR H . . 4.560 4.062 3.944 4.164 . 0 0 "[ . 1 . 2]" 1
2389 1 76 PHE HB3 1 77 THR MG . . 3.920 3.276 3.231 3.397 . 0 0 "[ . 1 . 2]" 1
2390 1 76 PHE QD 1 77 THR MG . . 4.750 4.771 4.758 4.790 0.040 5 0 "[ . 1 . 2]" 1
2391 1 76 PHE QD 2 4 PRO HB2 . . 4.280 3.168 2.877 3.697 . 0 0 "[ . 1 . 2]" 1
2392 1 76 PHE QD 2 4 PRO HB3 . . 5.090 4.586 4.306 5.042 . 0 0 "[ . 1 . 2]" 1
2393 1 76 PHE QD 2 4 PRO HD2 . . 5.500 4.681 4.074 5.104 . 0 0 "[ . 1 . 2]" 1
2394 1 76 PHE QD 2 4 PRO QG . . 5.020 3.089 2.928 3.229 . 0 0 "[ . 1 . 2]" 1
2395 1 76 PHE QD 2 6 ALA H . . 5.000 4.940 4.646 5.022 0.022 17 0 "[ . 1 . 2]" 1
2396 1 76 PHE QD 2 6 ALA HA . . 3.980 3.947 3.823 4.006 0.026 9 0 "[ . 1 . 2]" 1
2397 1 76 PHE QD 2 6 ALA MB . . 4.170 4.164 3.994 4.189 0.019 15 0 "[ . 1 . 2]" 1
2398 1 76 PHE QD 2 7 PRO HD2 . . 5.500 5.484 5.353 5.521 0.021 20 0 "[ . 1 . 2]" 1
2399 1 76 PHE QD 2 7 PRO HD3 . . 5.120 4.897 4.568 5.124 0.004 7 0 "[ . 1 . 2]" 1
2400 1 76 PHE QE 2 5 VAL HA . . 4.200 2.818 2.404 3.079 . 0 0 "[ . 1 . 2]" 1
2401 1 76 PHE QE 2 5 VAL MG1 . . 5.500 4.445 4.186 4.752 . 0 0 "[ . 1 . 2]" 1
2402 1 76 PHE QE 2 5 VAL QG . . 4.540 3.997 3.839 4.142 . 0 0 "[ . 1 . 2]" 1
2403 1 76 PHE QE 2 5 VAL MG2 . . 5.500 4.547 4.150 4.730 . 0 0 "[ . 1 . 2]" 1
2404 1 76 PHE QE 2 6 ALA H . . 5.360 2.851 2.755 2.973 . 0 0 "[ . 1 . 2]" 1
2405 1 76 PHE QE 2 6 ALA MB . . 4.770 3.191 3.002 3.454 . 0 0 "[ . 1 . 2]" 1
2406 1 76 PHE HZ 2 4 PRO HD2 . . 5.500 4.803 4.355 5.105 . 0 0 "[ . 1 . 2]" 1
2407 1 76 PHE HZ 2 4 PRO QG . . 5.320 3.442 3.301 3.675 . 0 0 "[ . 1 . 2]" 1
2408 1 76 PHE HZ 2 5 VAL HA . . 4.230 3.141 2.588 3.630 . 0 0 "[ . 1 . 2]" 1
2409 1 76 PHE HZ 2 5 VAL QG . . 5.440 4.162 3.689 4.730 . 0 0 "[ . 1 . 2]" 1
2410 1 76 PHE HZ 2 6 ALA H . . 5.230 3.771 3.250 4.202 . 0 0 "[ . 1 . 2]" 1
2411 1 77 THR H 1 77 THR HB . . 4.110 3.728 3.599 3.788 . 0 0 "[ . 1 . 2]" 1
2412 1 77 THR H 1 77 THR HG1 . . 2.830 2.070 1.969 2.606 . 0 0 "[ . 1 . 2]" 1
2413 1 77 THR H 1 77 THR MG . . 3.160 2.926 2.757 3.022 . 0 0 "[ . 1 . 2]" 1
2414 1 77 THR H 1 78 GLU H . . 4.650 4.458 4.413 4.484 . 0 0 "[ . 1 . 2]" 1
2415 1 77 THR HA 1 77 THR MG . . 3.160 2.538 2.466 2.600 . 0 0 "[ . 1 . 2]" 1
2416 1 77 THR HA 1 78 GLU H . . 2.990 2.491 2.412 2.557 . 0 0 "[ . 1 . 2]" 1
2417 1 77 THR HA 1 78 GLU QG . . 5.210 4.401 4.135 4.677 . 0 0 "[ . 1 . 2]" 1
2418 1 77 THR HB 1 78 GLU H . . 2.970 2.229 2.137 2.323 . 0 0 "[ . 1 . 2]" 1
2419 1 77 THR HB 1 78 GLU HA . . 4.630 4.394 4.271 4.448 . 0 0 "[ . 1 . 2]" 1
2420 1 77 THR HB 1 78 GLU QG . . 4.750 4.514 4.178 4.754 0.004 2 0 "[ . 1 . 2]" 1
2421 1 77 THR HB 1 79 ARG H . . 5.500 5.521 5.441 5.544 0.044 17 0 "[ . 1 . 2]" 1
2422 1 77 THR HG1 1 77 THR MG . . 3.140 2.825 2.661 3.006 . 0 0 "[ . 1 . 2]" 1
2423 1 77 THR HG1 1 78 GLU H . . 4.330 3.886 3.619 4.083 . 0 0 "[ . 1 . 2]" 1
2424 1 77 THR MG 1 78 GLU H . . 3.780 3.682 3.591 3.769 . 0 0 "[ . 1 . 2]" 1
2425 1 77 THR MG 1 78 GLU HA . . 5.500 5.510 5.448 5.531 0.031 8 0 "[ . 1 . 2]" 1
2426 1 78 GLU H 1 78 GLU HB2 . . 3.950 3.919 3.873 3.964 0.014 2 0 "[ . 1 . 2]" 1
2427 1 78 GLU H 1 78 GLU HB3 . . 3.550 3.098 2.988 3.185 . 0 0 "[ . 1 . 2]" 1
2428 1 78 GLU H 1 78 GLU QG . . 3.690 2.565 2.330 2.785 . 0 0 "[ . 1 . 2]" 1
2429 1 78 GLU H 1 79 ARG H . . 4.690 4.368 4.285 4.410 . 0 0 "[ . 1 . 2]" 1
2430 1 78 GLU H 1 80 VAL MG2 . . 5.150 5.079 4.680 5.156 0.006 6 0 "[ . 1 . 2]" 1
2431 1 78 GLU HA 1 78 GLU QG . . 3.680 3.375 3.341 3.497 . 0 0 "[ . 1 . 2]" 1
2432 1 78 GLU HA 1 79 ARG H . . 2.850 2.193 2.127 2.251 . 0 0 "[ . 1 . 2]" 1
2433 1 78 GLU HA 1 80 VAL MG1 . . 5.500 5.342 5.094 5.512 0.012 5 0 "[ . 1 . 2]" 1
2434 1 78 GLU HB2 1 79 ARG H . . 3.660 3.115 2.872 3.241 . 0 0 "[ . 1 . 2]" 1
2435 1 78 GLU HB3 1 79 ARG H . . 4.530 4.243 4.101 4.359 . 0 0 "[ . 1 . 2]" 1
2436 1 78 GLU QG 1 79 ARG H . . 4.140 3.776 3.560 4.167 0.027 15 0 "[ . 1 . 2]" 1
2437 1 78 GLU QG 1 80 VAL MG1 . . 4.050 2.622 2.372 3.251 . 0 0 "[ . 1 . 2]" 1
2438 1 79 ARG H 1 79 ARG HB2 . . 3.400 2.201 1.993 2.756 . 0 0 "[ . 1 . 2]" 1
2439 1 79 ARG H 1 79 ARG QB . . 2.940 2.080 1.970 2.202 . 0 0 "[ . 1 . 2]" 1
2440 1 79 ARG H 1 79 ARG HB3 . . 3.400 2.861 2.241 3.249 . 0 0 "[ . 1 . 2]" 1
2441 1 79 ARG H 1 79 ARG QD . . 4.460 4.437 4.222 4.530 0.070 14 0 "[ . 1 . 2]" 1
2442 1 79 ARG H 1 79 ARG HG2 . . 4.710 4.059 3.466 4.608 . 0 0 "[ . 1 . 2]" 1
2443 1 79 ARG H 1 79 ARG HG3 . . 4.710 4.388 4.152 4.557 . 0 0 "[ . 1 . 2]" 1
2444 1 79 ARG H 1 80 VAL H . . 4.590 4.560 4.390 4.627 0.037 3 0 "[ . 1 . 2]" 1
2445 1 79 ARG HA 1 79 ARG QD . . 3.500 2.390 2.196 2.670 . 0 0 "[ . 1 . 2]" 1
2446 1 79 ARG HA 1 79 ARG QG . . 3.560 2.629 2.404 3.230 . 0 0 "[ . 1 . 2]" 1
2447 1 79 ARG HA 1 80 VAL H . . 2.740 2.147 2.099 2.211 . 0 0 "[ . 1 . 2]" 1
2448 1 79 ARG QB 1 79 ARG QD . . 3.380 2.574 2.299 2.899 . 0 0 "[ . 1 . 2]" 1
2449 1 79 ARG QD 1 80 VAL H . . 4.110 2.476 2.042 3.167 . 0 0 "[ . 1 . 2]" 1
2450 1 79 ARG QD 1 80 VAL MG2 . . 5.110 3.688 3.390 4.218 . 0 0 "[ . 1 . 2]" 1
2451 1 79 ARG QG 1 80 VAL H . . 4.140 3.717 2.779 4.008 . 0 0 "[ . 1 . 2]" 1
2452 1 80 VAL H 1 80 VAL HB . . 3.710 3.679 3.576 3.740 0.030 15 0 "[ . 1 . 2]" 1
2453 1 80 VAL H 1 80 VAL MG1 . . 3.900 3.114 2.833 3.364 . 0 0 "[ . 1 . 2]" 1
2454 1 80 VAL H 1 80 VAL MG2 . . 3.050 2.100 1.973 2.205 . 0 0 "[ . 1 . 2]" 1
2455 1 80 VAL H 1 81 PRO HD2 . . 4.940 4.951 4.916 5.001 0.061 11 0 "[ . 1 . 2]" 1
2456 1 80 VAL HA 1 80 VAL MG1 . . 3.110 2.265 2.236 2.293 . 0 0 "[ . 1 . 2]" 1
2457 1 80 VAL HA 1 80 VAL MG2 . . 3.280 3.241 3.217 3.262 . 0 0 "[ . 1 . 2]" 1
2458 1 80 VAL HA 1 81 PRO HD2 . . 2.870 2.583 2.448 2.707 . 0 0 "[ . 1 . 2]" 1
2459 1 80 VAL HA 1 81 PRO HD3 . . 2.790 2.276 2.047 2.396 . 0 0 "[ . 1 . 2]" 1
2460 1 80 VAL HA 1 81 PRO QG . . 4.800 4.098 3.920 4.174 . 0 0 "[ . 1 . 2]" 1
2461 1 80 VAL HB 1 81 PRO HD2 . . 3.320 2.206 2.087 2.389 . 0 0 "[ . 1 . 2]" 1
2462 1 80 VAL HB 1 81 PRO HD3 . . 3.770 3.503 3.409 3.638 . 0 0 "[ . 1 . 2]" 1
2463 1 80 VAL MG1 1 81 PRO HD2 . . 3.500 2.966 2.818 3.141 . 0 0 "[ . 1 . 2]" 1
2464 1 80 VAL MG1 1 81 PRO HD3 . . 4.370 3.555 3.321 3.679 . 0 0 "[ . 1 . 2]" 1
2465 1 80 VAL MG2 1 81 PRO HD2 . . 3.980 3.849 3.759 3.985 0.005 11 0 "[ . 1 . 2]" 1
2466 1 80 VAL MG2 1 81 PRO HD3 . . 4.610 4.618 4.543 4.651 0.041 1 0 "[ . 1 . 2]" 1
2467 2 2 THR H 2 3 VAL H . . 2.780 2.541 1.972 2.853 0.073 1 0 "[ . 1 . 2]" 1
2468 2 2 THR HA 2 2 THR MG . . 3.500 2.586 2.199 3.264 . 0 0 "[ . 1 . 2]" 1
2469 2 2 THR HA 2 3 VAL H . . 3.370 3.192 2.587 3.435 0.065 4 0 "[ . 1 . 2]" 1
2470 2 2 THR HA 2 3 VAL QG . . 4.100 4.246 3.907 4.467 0.367 10 0 "[ . 1 . 2]" 1
2471 2 2 THR HB 2 3 VAL H . . 4.510 4.216 3.411 4.539 0.029 14 0 "[ . 1 . 2]" 1
2472 2 2 THR MG 2 3 VAL H . . 4.340 3.971 2.482 4.368 0.028 5 0 "[ . 1 . 2]" 1
2473 2 3 VAL H 2 3 VAL HB . . 3.920 3.755 3.598 3.974 0.054 11 0 "[ . 1 . 2]" 1
2474 2 3 VAL H 2 3 VAL QG . . 3.240 2.098 1.885 2.502 . 0 0 "[ . 1 . 2]" 1
2475 2 3 VAL HA 2 3 VAL QG . . 3.090 2.364 2.250 2.490 . 0 0 "[ . 1 . 2]" 1
2476 2 3 VAL HA 2 4 PRO HB3 . . 4.920 4.878 4.788 4.938 0.018 20 0 "[ . 1 . 2]" 1
2477 2 3 VAL HA 2 4 PRO HD2 . . 2.920 2.359 2.219 2.561 . 0 0 "[ . 1 . 2]" 1
2478 2 3 VAL HA 2 4 PRO HD3 . . 2.930 2.433 2.278 2.613 . 0 0 "[ . 1 . 2]" 1
2479 2 3 VAL HA 2 4 PRO HG2 . . 4.850 4.520 4.409 4.680 . 0 0 "[ . 1 . 2]" 1
2480 2 3 VAL HA 2 4 PRO HG3 . . 4.850 4.583 4.461 4.738 . 0 0 "[ . 1 . 2]" 1
2481 2 3 VAL HB 2 4 PRO HA . . 5.200 5.069 4.835 5.217 0.017 3 0 "[ . 1 . 2]" 1
2482 2 3 VAL HB 2 4 PRO HD2 . . 3.930 2.255 2.037 2.788 . 0 0 "[ . 1 . 2]" 1
2483 2 3 VAL HB 2 4 PRO HD3 . . 4.230 3.668 3.493 4.070 . 0 0 "[ . 1 . 2]" 1
2484 2 3 VAL QG 2 4 PRO HA . . 4.250 4.267 4.146 4.473 0.223 17 0 "[ . 1 . 2]" 1
2485 2 3 VAL QG 2 4 PRO HD2 . . 3.390 3.142 2.944 3.291 . 0 0 "[ . 1 . 2]" 1
2486 2 3 VAL QG 2 4 PRO HD3 . . 3.740 3.900 3.764 3.972 0.232 1 0 "[ . 1 . 2]" 1
2487 2 4 PRO HA 2 5 VAL H . . 2.960 2.386 2.293 2.513 . 0 0 "[ . 1 . 2]" 1
2488 2 4 PRO HA 2 5 VAL HB . . 5.480 4.665 4.257 4.874 . 0 0 "[ . 1 . 2]" 1
2489 2 4 PRO HA 2 5 VAL QG . . 4.370 3.355 3.116 3.711 . 0 0 "[ . 1 . 2]" 1
2490 2 4 PRO HB2 2 5 VAL H . . 3.920 2.632 2.372 2.796 . 0 0 "[ . 1 . 2]" 1
2491 2 4 PRO HB3 2 5 VAL H . . 4.060 3.478 3.275 3.647 . 0 0 "[ . 1 . 2]" 1
2492 2 4 PRO QG 2 5 VAL H . . 4.590 4.166 4.030 4.319 . 0 0 "[ . 1 . 2]" 1
2493 2 5 VAL H 2 5 VAL HB . . 3.420 2.935 2.733 3.397 . 0 0 "[ . 1 . 2]" 1
2494 2 5 VAL H 2 5 VAL MG1 . . 4.070 3.747 2.259 4.054 . 0 0 "[ . 1 . 2]" 1
2495 2 5 VAL H 2 5 VAL QG . . 3.100 2.733 2.245 2.941 . 0 0 "[ . 1 . 2]" 1
2496 2 5 VAL H 2 5 VAL MG2 . . 4.070 3.027 2.705 4.030 . 0 0 "[ . 1 . 2]" 1
2497 2 5 VAL HA 2 5 VAL MG1 . . 3.270 2.479 2.265 3.277 0.007 2 0 "[ . 1 . 2]" 1
2498 2 5 VAL HA 2 5 VAL QG . . 2.770 2.169 2.112 2.405 . 0 0 "[ . 1 . 2]" 1
2499 2 5 VAL HA 2 5 VAL MG2 . . 3.270 2.472 2.308 2.580 . 0 0 "[ . 1 . 2]" 1
2500 2 5 VAL HA 2 6 ALA H . . 3.060 2.195 2.138 2.265 . 0 0 "[ . 1 . 2]" 1
2501 2 5 VAL HA 2 6 ALA MB . . 4.000 3.977 3.921 4.011 0.011 16 0 "[ . 1 . 2]" 1
2502 2 5 VAL HB 2 6 ALA H . . 4.590 4.090 3.902 4.218 . 0 0 "[ . 1 . 2]" 1
2503 2 5 VAL QG 2 6 ALA H . . 3.380 2.529 2.255 2.687 . 0 0 "[ . 1 . 2]" 1
2504 2 5 VAL QG 2 6 ALA MB . . 4.370 3.546 3.365 3.664 . 0 0 "[ . 1 . 2]" 1
2505 2 5 VAL MG1 2 6 ALA H . . 4.190 2.778 2.369 4.195 0.005 2 0 "[ . 1 . 2]" 1
2506 2 5 VAL MG2 2 6 ALA H . . 4.190 3.871 2.269 4.196 0.006 13 0 "[ . 1 . 2]" 1
2507 2 6 ALA H 2 6 ALA MB . . 3.190 2.219 2.183 2.247 . 0 0 "[ . 1 . 2]" 1
2508 2 6 ALA HA 2 7 PRO HD2 . . 3.430 2.517 2.327 2.668 . 0 0 "[ . 1 . 2]" 1
2509 2 6 ALA HA 2 7 PRO HD3 . . 3.100 2.196 2.079 2.317 . 0 0 "[ . 1 . 2]" 1
2510 2 6 ALA HA 2 7 PRO QG . . 4.320 4.015 3.940 4.068 . 0 0 "[ . 1 . 2]" 1
2511 2 6 ALA MB 2 7 PRO HD2 . . 3.750 2.684 2.511 2.896 . 0 0 "[ . 1 . 2]" 1
2512 2 6 ALA MB 2 7 PRO HD3 . . 3.830 3.527 3.399 3.682 . 0 0 "[ . 1 . 2]" 1
2513 2 6 ALA MB 2 7 PRO QG . . 4.460 4.236 4.070 4.463 0.003 18 0 "[ . 1 . 2]" 1
2514 2 6 ALA MB 2 9 ARG HD2 . . 5.500 4.963 3.684 5.561 0.061 7 0 "[ . 1 . 2]" 1
2515 2 6 ALA MB 2 9 ARG QD . . 4.800 4.350 3.584 4.813 0.013 17 0 "[ . 1 . 2]" 1
2516 2 6 ALA MB 2 9 ARG HD3 . . 5.500 5.022 3.954 5.551 0.051 19 0 "[ . 1 . 2]" 1
2517 2 7 PRO HA 2 8 PRO HD2 . . 3.340 2.851 2.418 3.249 . 0 0 "[ . 1 . 2]" 1
2518 2 7 PRO HA 2 8 PRO QD . . 2.880 2.168 2.067 2.362 . 0 0 "[ . 1 . 2]" 1
2519 2 7 PRO HA 2 8 PRO HD3 . . 3.340 2.290 2.094 2.598 . 0 0 "[ . 1 . 2]" 1
2520 2 7 PRO HA 2 8 PRO HG2 . . 5.450 4.737 4.588 4.825 . 0 0 "[ . 1 . 2]" 1
2521 2 7 PRO HA 2 8 PRO QG . . 4.680 4.070 3.848 4.305 . 0 0 "[ . 1 . 2]" 1
2522 2 7 PRO HA 2 8 PRO HG3 . . 5.450 4.455 4.075 4.841 . 0 0 "[ . 1 . 2]" 1
2523 2 7 PRO HB2 2 8 PRO HD2 . . 4.010 2.510 2.174 3.041 . 0 0 "[ . 1 . 2]" 1
2524 2 7 PRO HB2 2 8 PRO QD . . 3.350 2.455 2.158 2.937 . 0 0 "[ . 1 . 2]" 1
2525 2 7 PRO HB2 2 8 PRO HD3 . . 4.010 3.584 3.150 4.018 0.008 2 0 "[ . 1 . 2]" 1
2526 2 7 PRO HB3 2 8 PRO HD2 . . 3.870 3.118 2.514 3.574 . 0 0 "[ . 1 . 2]" 1
2527 2 7 PRO HB3 2 8 PRO QD . . 3.350 2.920 2.484 3.164 . 0 0 "[ . 1 . 2]" 1
2528 2 7 PRO HB3 2 8 PRO HD3 . . 3.870 3.677 3.319 3.902 0.032 15 0 "[ . 1 . 2]" 1
2529 2 8 PRO HA 2 9 ARG H . . 3.040 2.287 2.094 2.453 . 0 0 "[ . 1 . 2]" 1
2530 2 8 PRO QB 2 9 ARG H . . 3.620 2.926 2.530 3.465 . 0 0 "[ . 1 . 2]" 1
2531 2 8 PRO HB2 2 9 ARG H . . 4.170 3.368 2.602 3.744 . 0 0 "[ . 1 . 2]" 1
2532 2 8 PRO HB3 2 9 ARG H . . 4.170 3.357 2.858 4.086 . 0 0 "[ . 1 . 2]" 1
2533 2 8 PRO QG 2 9 ARG H . . 4.770 4.489 4.181 4.768 . 0 0 "[ . 1 . 2]" 1
2534 2 9 ARG H 2 9 ARG QB . . 3.620 2.699 2.238 3.463 . 0 0 "[ . 1 . 2]" 1
2535 2 9 ARG H 2 9 ARG HG2 . . 4.700 4.080 3.437 4.460 . 0 0 "[ . 1 . 2]" 1
2536 2 9 ARG H 2 9 ARG QG . . 3.940 2.963 2.389 3.510 . 0 0 "[ . 1 . 2]" 1
2537 2 9 ARG H 2 9 ARG HG3 . . 4.700 3.050 2.423 3.675 . 0 0 "[ . 1 . 2]" 1
2538 2 9 ARG H 2 10 ARG QG . . 5.460 5.191 4.257 5.541 0.081 7 0 "[ . 1 . 2]" 1
2539 2 9 ARG HA 2 9 ARG QG . . 3.570 2.550 2.196 3.378 . 0 0 "[ . 1 . 2]" 1
2540 2 9 ARG HA 2 10 ARG H . . 3.200 2.327 2.023 2.477 . 0 0 "[ . 1 . 2]" 1
2541 2 9 ARG HA 2 10 ARG QG . . 5.060 3.369 2.813 4.408 . 0 0 "[ . 1 . 2]" 1
2542 2 9 ARG QB 2 10 ARG H . . 3.800 2.475 2.139 3.008 . 0 0 "[ . 1 . 2]" 1
2543 2 9 ARG QB 2 10 ARG QB . . 4.770 4.462 3.469 4.781 0.011 19 0 "[ . 1 . 2]" 1
2544 2 9 ARG QB 2 10 ARG QD . . 5.310 4.916 2.782 5.368 0.058 18 0 "[ . 1 . 2]" 1
2545 2 9 ARG QB 2 10 ARG QG . . 4.550 4.237 2.535 4.570 0.020 3 0 "[ . 1 . 2]" 1
2546 2 9 ARG HB2 2 10 ARG H . . 4.380 3.560 3.070 4.053 . 0 0 "[ . 1 . 2]" 1
2547 2 9 ARG HB3 2 10 ARG H . . 4.380 2.565 2.155 3.904 . 0 0 "[ . 1 . 2]" 1
2548 2 10 ARG H 2 10 ARG QB . . 3.520 2.641 2.281 3.317 . 0 0 "[ . 1 . 2]" 1
2549 2 10 ARG H 2 10 ARG QG . . 3.470 2.526 1.958 3.249 . 0 0 "[ . 1 . 2]" 1
2550 2 10 ARG HA 2 10 ARG QD . . 4.230 3.391 2.217 4.292 0.062 16 0 "[ . 1 . 2]" 1
2551 2 10 ARG HA 2 10 ARG QG . . 3.190 2.891 2.306 3.318 0.128 19 0 "[ . 1 . 2]" 1
2552 2 10 ARG HA 2 11 ARG H . . 3.510 2.500 2.092 3.546 0.036 11 0 "[ . 1 . 2]" 1
2553 2 11 ARG H 2 12 ARG H . . 5.070 3.790 1.864 4.731 . 0 0 "[ . 1 . 2]" 1
2554 2 11 ARG HA 2 11 ARG QD . . 4.020 3.626 2.104 4.110 0.090 13 0 "[ . 1 . 2]" 1
2555 2 11 ARG HA 2 12 ARG H . . 3.570 2.667 2.068 3.559 . 0 0 "[ . 1 . 2]" 1
2556 2 11 ARG QB 2 11 ARG QD . . 3.430 2.342 2.016 2.896 . 0 0 "[ . 1 . 2]" 1
2557 2 11 ARG QG 2 12 ARG H . . 4.390 3.892 2.547 4.448 0.058 10 0 "[ . 1 . 2]" 1
2558 2 12 ARG H 2 12 ARG QG . . 4.510 3.374 2.056 4.511 0.001 10 0 "[ . 1 . 2]" 1
2559 2 12 ARG HA 2 12 ARG QD . . 4.080 3.494 2.024 4.134 0.054 6 0 "[ . 1 . 2]" 1
2560 2 12 ARG HA 2 13 GLY QA . . 4.150 3.984 3.751 4.183 0.033 3 0 "[ . 1 . 2]" 1
2561 2 12 ARG QB 2 12 ARG QD . . 3.240 2.352 2.041 2.958 . 0 0 "[ . 1 . 2]" 1
2562 2 12 ARG QB 2 13 GLY QA . . 4.800 4.015 3.406 4.655 . 0 0 "[ . 1 . 2]" 1
2563 2 12 ARG HB2 2 12 ARG QD . . 3.700 2.576 2.094 3.538 . 0 0 "[ . 1 . 2]" 1
2564 2 12 ARG HB3 2 12 ARG QD . . 3.700 2.954 2.292 3.577 . 0 0 "[ . 1 . 2]" 1
2565 2 12 ARG QG 2 13 GLY QA . . 4.990 4.366 3.427 5.043 0.053 20 0 "[ . 1 . 2]" 1
2566 2 14 ARG H 2 14 ARG QG . . 4.640 3.421 2.165 4.411 . 0 0 "[ . 1 . 2]" 1
2567 2 14 ARG HA 2 14 ARG QD . . 4.020 3.252 2.158 4.083 0.063 12 0 "[ . 1 . 2]" 1
2568 2 14 ARG HB2 2 14 ARG QD . . 3.920 2.830 2.220 3.569 . 0 0 "[ . 1 . 2]" 1
2569 2 14 ARG HB3 2 14 ARG QD . . 3.920 2.849 2.200 3.594 . 0 0 "[ . 1 . 2]" 1
2570 2 15 ASN QB 2 16 LEU H . . 4.420 3.446 2.437 4.120 . 0 0 "[ . 1 . 2]" 1
2571 2 16 LEU H 2 16 LEU QB . . 3.550 2.479 2.152 3.446 . 0 0 "[ . 1 . 2]" 1
2572 2 16 LEU QB 2 17 THR H . . 4.680 3.085 2.339 3.929 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, June 1, 2024 5:28:23 PM GMT (wattos1)