NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
596320 |
2n2e   |
25194 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n2e
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 2076
_Distance_constraint_stats_list.Viol_count 5495
_Distance_constraint_stats_list.Viol_total 5951.143
_Distance_constraint_stats_list.Viol_max 0.171
_Distance_constraint_stats_list.Viol_rms 0.0205
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0072
_Distance_constraint_stats_list.Viol_average_violations_only 0.0542
_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 ASP 5.220 0.112 7 0 "[ . 1 . 2]"
1 2 ASN 5.742 0.097 7 0 "[ . 1 . 2]"
1 3 PHE 6.142 0.125 20 0 "[ . 1 . 2]"
1 4 VAL 4.344 0.097 7 0 "[ . 1 . 2]"
1 5 ILE 7.082 0.098 13 0 "[ . 1 . 2]"
1 6 ASP 2.241 0.078 19 0 "[ . 1 . 2]"
1 7 LYS 2.688 0.082 12 0 "[ . 1 . 2]"
1 8 ASN 5.842 0.090 13 0 "[ . 1 . 2]"
1 9 ASP 5.229 0.086 6 0 "[ . 1 . 2]"
1 10 SER 4.300 0.099 12 0 "[ . 1 . 2]"
1 11 ARG 6.101 0.100 1 0 "[ . 1 . 2]"
1 12 LYS 8.468 0.100 6 0 "[ . 1 . 2]"
1 13 ILE 8.110 0.098 8 0 "[ . 1 . 2]"
1 14 ASP 3.243 0.100 12 0 "[ . 1 . 2]"
1 15 TYR 11.349 0.114 19 0 "[ . 1 . 2]"
1 16 MET 4.611 0.111 12 0 "[ . 1 . 2]"
1 17 GLY 0.302 0.055 12 0 "[ . 1 . 2]"
1 18 ASN 8.067 0.114 19 0 "[ . 1 . 2]"
1 19 ILE 5.078 0.100 6 0 "[ . 1 . 2]"
1 20 TYR 5.991 0.102 3 0 "[ . 1 . 2]"
1 21 SER 7.886 0.103 15 0 "[ . 1 . 2]"
1 22 ILE 6.384 0.103 15 0 "[ . 1 . 2]"
1 23 SER 2.771 0.100 3 0 "[ . 1 . 2]"
1 24 ASP 2.617 0.080 14 0 "[ . 1 . 2]"
1 25 THR 8.375 0.150 2 0 "[ . 1 . 2]"
1 26 THR 6.485 0.111 12 0 "[ . 1 . 2]"
1 27 VAL 7.114 0.106 2 0 "[ . 1 . 2]"
1 28 SER 5.248 0.106 18 0 "[ . 1 . 2]"
1 29 ASP 3.702 0.085 19 0 "[ . 1 . 2]"
1 30 GLU 3.972 0.088 4 0 "[ . 1 . 2]"
1 31 GLU 4.204 0.088 4 0 "[ . 1 . 2]"
1 32 LEU 7.614 0.106 18 0 "[ . 1 . 2]"
1 33 GLY 2.274 0.097 8 0 "[ . 1 . 2]"
1 34 GLU 3.664 0.171 9 0 "[ . 1 . 2]"
1 35 TYR 9.030 0.171 9 0 "[ . 1 . 2]"
1 36 GLN 1.931 0.071 8 0 "[ . 1 . 2]"
1 37 ASP 2.543 0.092 4 0 "[ . 1 . 2]"
1 38 VAL 2.709 0.112 6 0 "[ . 1 . 2]"
1 39 LEU 6.077 0.124 15 0 "[ . 1 . 2]"
1 40 ALA 3.614 0.130 2 0 "[ . 1 . 2]"
1 41 GLU 2.567 0.098 6 0 "[ . 1 . 2]"
1 42 VAL 5.367 0.116 19 0 "[ . 1 . 2]"
1 43 ARG 2.969 0.088 10 0 "[ . 1 . 2]"
1 44 VAL 5.945 0.128 6 0 "[ . 1 . 2]"
1 45 PHE 15.534 0.117 12 0 "[ . 1 . 2]"
1 46 ASP 2.622 0.098 1 0 "[ . 1 . 2]"
1 47 SER 4.561 0.102 9 0 "[ . 1 . 2]"
1 48 VAL 7.427 0.102 9 0 "[ . 1 . 2]"
1 49 SER 5.571 0.098 1 0 "[ . 1 . 2]"
1 50 GLY 6.022 0.089 20 0 "[ . 1 . 2]"
1 51 LYS 3.877 0.094 20 0 "[ . 1 . 2]"
1 52 SER 3.065 0.085 19 0 "[ . 1 . 2]"
1 53 ILE 10.339 0.128 6 0 "[ . 1 . 2]"
1 54 PRO 2.337 0.072 3 0 "[ . 1 . 2]"
1 55 ARG 4.465 0.102 9 0 "[ . 1 . 2]"
1 56 SER 2.785 0.100 9 0 "[ . 1 . 2]"
1 57 GLU 3.069 0.120 3 0 "[ . 1 . 2]"
1 58 TRP 12.860 0.099 10 0 "[ . 1 . 2]"
1 59 GLY 1.194 0.067 8 0 "[ . 1 . 2]"
1 60 ARG 1.865 0.102 3 0 "[ . 1 . 2]"
1 61 ILE 2.965 0.115 1 0 "[ . 1 . 2]"
1 62 ASP 0.937 0.088 3 0 "[ . 1 . 2]"
1 63 LYS 3.021 0.118 8 0 "[ . 1 . 2]"
1 64 ASP 1.313 0.083 12 0 "[ . 1 . 2]"
1 65 GLY 0.578 0.074 12 0 "[ . 1 . 2]"
1 66 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ASN 1.733 0.094 12 0 "[ . 1 . 2]"
1 68 SER 0.262 0.066 1 0 "[ . 1 . 2]"
1 69 LYS 1.212 0.103 5 0 "[ . 1 . 2]"
1 70 GLN 2.344 0.089 16 0 "[ . 1 . 2]"
1 71 SER 1.609 0.089 16 0 "[ . 1 . 2]"
1 72 ARG 5.486 0.105 19 0 "[ . 1 . 2]"
1 73 THR 7.146 0.102 18 0 "[ . 1 . 2]"
1 74 GLU 1.893 0.085 3 0 "[ . 1 . 2]"
1 75 TRP 10.421 0.101 19 0 "[ . 1 . 2]"
1 76 ASP 3.541 0.083 20 0 "[ . 1 . 2]"
1 77 TYR 15.547 0.130 2 0 "[ . 1 . 2]"
1 78 GLY 4.326 0.090 11 0 "[ . 1 . 2]"
1 79 GLU 6.457 0.115 2 0 "[ . 1 . 2]"
1 80 ILE 12.096 0.125 20 0 "[ . 1 . 2]"
1 81 HIS 6.061 0.106 16 0 "[ . 1 . 2]"
1 82 SER 5.819 0.113 11 0 "[ . 1 . 2]"
1 83 ILE 4.799 0.106 4 0 "[ . 1 . 2]"
1 84 ARG 3.656 0.094 3 0 "[ . 1 . 2]"
1 85 GLY 0.781 0.059 19 0 "[ . 1 . 2]"
1 86 LYS 2.008 0.079 3 0 "[ . 1 . 2]"
1 87 SER 2.640 0.079 3 0 "[ . 1 . 2]"
1 88 LEU 10.092 0.132 12 0 "[ . 1 . 2]"
1 89 THR 7.283 0.091 8 0 "[ . 1 . 2]"
1 90 GLU 4.722 0.091 8 0 "[ . 1 . 2]"
1 91 ALA 8.576 0.106 4 0 "[ . 1 . 2]"
1 92 PHE 8.991 0.107 12 0 "[ . 1 . 2]"
1 93 ALA 7.439 0.125 2 0 "[ . 1 . 2]"
1 94 VAL 9.934 0.158 18 0 "[ . 1 . 2]"
1 95 GLU 10.634 0.106 20 0 "[ . 1 . 2]"
1 96 ILE 10.984 0.114 13 0 "[ . 1 . 2]"
1 97 ASN 8.027 0.102 18 0 "[ . 1 . 2]"
1 98 ASP 1.792 0.098 14 0 "[ . 1 . 2]"
1 99 ASP 5.532 0.111 12 0 "[ . 1 . 2]"
1 100 PHE 13.544 0.158 18 0 "[ . 1 . 2]"
1 101 LYS 3.645 0.102 18 0 "[ . 1 . 2]"
1 102 LEU 9.640 0.150 2 0 "[ . 1 . 2]"
1 103 ALA 8.553 0.102 3 0 "[ . 1 . 2]"
1 104 THR 4.553 0.083 15 0 "[ . 1 . 2]"
1 105 LYS 6.164 0.104 16 0 "[ . 1 . 2]"
1 106 VAL 3.984 0.108 5 0 "[ . 1 . 2]"
1 107 GLY 2.035 0.108 5 0 "[ . 1 . 2]"
1 108 ASN 1.272 0.105 10 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 ASP HA 1 1 ASP QB . . 2.570 2.432 2.277 2.552 . 0 0 "[ . 1 . 2]" 1
2 1 1 ASP HA 1 2 ASN H . . 3.520 3.558 3.397 3.600 0.080 9 0 "[ . 1 . 2]" 1
3 1 1 ASP HA 1 2 ASN HD21 . . 5.500 5.450 4.871 5.574 0.074 17 0 "[ . 1 . 2]" 1
4 1 1 ASP HA 1 15 TYR QE . . 5.500 3.520 2.833 4.037 . 0 0 "[ . 1 . 2]" 1
5 1 1 ASP HA 1 16 MET H . . 5.170 5.022 3.894 5.239 0.069 9 0 "[ . 1 . 2]" 1
6 1 1 ASP HA 1 16 MET HA . . 5.500 4.934 3.770 5.371 . 0 0 "[ . 1 . 2]" 1
7 1 1 ASP HA 1 16 MET ME . . 3.620 3.651 3.377 3.714 0.094 11 0 "[ . 1 . 2]" 1
8 1 1 ASP HA 1 16 MET HG2 . . 4.150 3.892 3.260 4.161 0.011 5 0 "[ . 1 . 2]" 1
9 1 1 ASP QB 1 2 ASN H . . 3.520 2.605 1.960 3.497 . 0 0 "[ . 1 . 2]" 1
10 1 1 ASP QB 1 15 TYR QE . . 4.510 4.506 3.749 4.622 0.112 7 0 "[ . 1 . 2]" 1
11 1 1 ASP QB 1 16 MET H . . 5.130 4.364 2.544 5.217 0.087 19 0 "[ . 1 . 2]" 1
12 1 1 ASP QB 1 16 MET ME . . 5.000 4.844 4.255 5.111 0.111 12 0 "[ . 1 . 2]" 1
13 1 2 ASN H 1 2 ASN HD21 . . 3.830 2.158 1.940 2.470 . 0 0 "[ . 1 . 2]" 1
14 1 2 ASN H 1 2 ASN HD22 . . 3.960 3.487 3.219 3.810 . 0 0 "[ . 1 . 2]" 1
15 1 2 ASN H 1 3 PHE H . . 4.080 4.139 4.022 4.160 0.080 12 0 "[ . 1 . 2]" 1
16 1 2 ASN H 1 3 PHE QD . . 5.490 5.483 5.159 5.583 0.093 18 0 "[ . 1 . 2]" 1
17 1 2 ASN H 1 4 VAL QG . . 4.670 4.144 3.928 4.407 . 0 0 "[ . 1 . 2]" 1
18 1 2 ASN H 1 15 TYR QD . . 4.380 2.881 2.421 3.577 . 0 0 "[ . 1 . 2]" 1
19 1 2 ASN H 1 15 TYR QE . . 4.180 3.295 2.604 3.606 . 0 0 "[ . 1 . 2]" 1
20 1 2 ASN H 1 16 MET H . . 4.420 3.630 3.013 4.336 . 0 0 "[ . 1 . 2]" 1
21 1 2 ASN HA 1 15 TYR QD . . 4.450 3.573 3.179 3.824 . 0 0 "[ . 1 . 2]" 1
22 1 2 ASN QB 1 2 ASN HD21 . . 3.100 2.890 2.634 3.042 . 0 0 "[ . 1 . 2]" 1
23 1 2 ASN QB 1 2 ASN HD22 . . 3.460 3.516 3.430 3.545 0.085 19 0 "[ . 1 . 2]" 1
24 1 2 ASN QB 1 4 VAL QG . . 4.040 3.683 3.122 4.137 0.097 7 0 "[ . 1 . 2]" 1
25 1 2 ASN QB 1 15 TYR QE . . 4.750 4.556 4.240 4.833 0.083 17 0 "[ . 1 . 2]" 1
26 1 2 ASN HD21 1 3 PHE H . . 5.190 4.417 4.019 5.106 . 0 0 "[ . 1 . 2]" 1
27 1 2 ASN HD21 1 4 VAL H . . 5.500 5.191 4.529 5.568 0.068 4 0 "[ . 1 . 2]" 1
28 1 2 ASN HD22 1 4 VAL QG . . 4.250 2.854 2.141 3.748 . 0 0 "[ . 1 . 2]" 1
29 1 3 PHE H 1 3 PHE QB . . 2.770 2.491 2.381 2.644 . 0 0 "[ . 1 . 2]" 1
30 1 3 PHE H 1 3 PHE QD . . 3.110 2.008 1.603 2.421 . 0 0 "[ . 1 . 2]" 1
31 1 3 PHE H 1 4 VAL QG . . 4.430 4.263 4.085 4.450 0.020 7 0 "[ . 1 . 2]" 1
32 1 3 PHE H 1 15 TYR HB2 . . 4.820 4.747 4.327 4.890 0.070 14 0 "[ . 1 . 2]" 1
33 1 3 PHE H 1 15 TYR QD . . 4.130 3.586 3.290 3.887 . 0 0 "[ . 1 . 2]" 1
34 1 3 PHE H 1 15 TYR QE . . 4.270 3.976 3.484 4.347 0.077 9 0 "[ . 1 . 2]" 1
35 1 3 PHE H 1 37 ASP QB . . 5.250 4.282 3.994 4.733 . 0 0 "[ . 1 . 2]" 1
36 1 3 PHE H 1 39 LEU QD . . 5.270 4.858 4.538 5.356 0.086 16 0 "[ . 1 . 2]" 1
37 1 3 PHE H 1 80 ILE MD . . 5.280 4.766 4.381 5.326 0.046 16 0 "[ . 1 . 2]" 1
38 1 3 PHE HA 1 4 VAL HB . . 5.170 4.360 4.215 4.463 . 0 0 "[ . 1 . 2]" 1
39 1 3 PHE HA 1 13 ILE MG . . 3.670 3.216 2.889 3.538 . 0 0 "[ . 1 . 2]" 1
40 1 3 PHE QB 1 4 VAL H . . 3.610 3.079 2.731 3.449 . 0 0 "[ . 1 . 2]" 1
41 1 3 PHE QB 1 5 ILE H . . 5.340 5.264 4.867 5.412 0.072 16 0 "[ . 1 . 2]" 1
42 1 3 PHE QB 1 13 ILE MG . . 3.480 2.666 2.358 2.772 . 0 0 "[ . 1 . 2]" 1
43 1 3 PHE QB 1 39 LEU QD . . 3.480 2.996 2.654 3.604 0.124 15 0 "[ . 1 . 2]" 1
44 1 3 PHE HB2 1 13 ILE MG . . 4.160 3.877 2.519 4.241 0.081 14 0 "[ . 1 . 2]" 1
45 1 3 PHE HB2 1 80 ILE MD . . 3.600 2.945 2.697 3.341 . 0 0 "[ . 1 . 2]" 1
46 1 3 PHE HB3 1 13 ILE MG . . 4.160 2.864 2.380 3.490 . 0 0 "[ . 1 . 2]" 1
47 1 3 PHE HB3 1 80 ILE MD . . 3.600 2.895 2.579 3.489 . 0 0 "[ . 1 . 2]" 1
48 1 3 PHE QD 1 4 VAL H . . 4.600 4.266 3.850 4.681 0.081 16 0 "[ . 1 . 2]" 1
49 1 3 PHE QD 1 13 ILE MD . . 4.340 3.801 3.090 4.434 0.094 14 0 "[ . 1 . 2]" 1
50 1 3 PHE QD 1 13 ILE MG . . 4.100 2.560 1.916 4.187 0.087 16 0 "[ . 1 . 2]" 1
51 1 3 PHE QD 1 15 TYR HB2 . . 4.950 3.210 2.443 5.032 0.082 15 0 "[ . 1 . 2]" 1
52 1 3 PHE QD 1 37 ASP QB . . 3.840 2.630 2.273 3.097 . 0 0 "[ . 1 . 2]" 1
53 1 3 PHE QD 1 37 ASP HB3 . . 4.440 3.174 2.636 3.609 . 0 0 "[ . 1 . 2]" 1
54 1 3 PHE QD 1 39 LEU QD . . 4.370 3.653 2.092 4.164 . 0 0 "[ . 1 . 2]" 1
55 1 3 PHE QD 1 80 ILE MD . . 3.630 2.614 2.288 2.877 . 0 0 "[ . 1 . 2]" 1
56 1 3 PHE QD 1 80 ILE MG . . 4.260 3.876 3.252 4.385 0.125 20 0 "[ . 1 . 2]" 1
57 1 3 PHE QD 1 88 LEU QD . . 4.910 4.194 3.802 5.020 0.110 18 0 "[ . 1 . 2]" 1
58 1 4 VAL H 1 4 VAL HB . . 3.260 2.595 2.425 2.898 . 0 0 "[ . 1 . 2]" 1
59 1 4 VAL H 1 5 ILE H . . 4.440 4.297 4.072 4.446 0.006 8 0 "[ . 1 . 2]" 1
60 1 4 VAL H 1 13 ILE HA . . 5.300 4.274 3.966 4.686 . 0 0 "[ . 1 . 2]" 1
61 1 4 VAL H 1 13 ILE MG . . 3.300 2.779 2.444 3.380 0.080 14 0 "[ . 1 . 2]" 1
62 1 4 VAL H 1 14 ASP H . . 3.760 2.943 2.602 3.444 . 0 0 "[ . 1 . 2]" 1
63 1 4 VAL H 1 14 ASP HA . . 5.190 4.957 4.709 5.209 0.019 7 0 "[ . 1 . 2]" 1
64 1 4 VAL H 1 14 ASP QB . . 5.030 3.630 3.483 3.833 . 0 0 "[ . 1 . 2]" 1
65 1 4 VAL H 1 15 TYR H . . 4.970 4.952 4.779 5.055 0.085 14 0 "[ . 1 . 2]" 1
66 1 4 VAL H 1 15 TYR HB2 . . 3.800 3.489 3.161 3.800 0.000 9 0 "[ . 1 . 2]" 1
67 1 4 VAL H 1 15 TYR QD . . 5.040 4.511 4.263 4.930 . 0 0 "[ . 1 . 2]" 1
68 1 4 VAL H 1 80 ILE MD . . 5.500 5.324 4.963 5.586 0.086 4 0 "[ . 1 . 2]" 1
69 1 4 VAL HA 1 4 VAL QG . . 2.740 2.177 2.085 2.217 . 0 0 "[ . 1 . 2]" 1
70 1 4 VAL HA 1 5 ILE H . . 2.870 2.258 2.141 2.339 . 0 0 "[ . 1 . 2]" 1
71 1 4 VAL HA 1 5 ILE HB . . 4.780 4.797 4.627 4.852 0.072 20 0 "[ . 1 . 2]" 1
72 1 4 VAL HA 1 5 ILE MD . . 4.060 3.142 2.900 4.034 . 0 0 "[ . 1 . 2]" 1
73 1 4 VAL HA 1 5 ILE QG . . 4.400 4.384 3.513 4.484 0.084 12 0 "[ . 1 . 2]" 1
74 1 4 VAL HB 1 5 ILE H . . 4.500 4.314 4.103 4.442 . 0 0 "[ . 1 . 2]" 1
75 1 4 VAL HB 1 14 ASP H . . 4.090 3.550 3.333 3.781 . 0 0 "[ . 1 . 2]" 1
76 1 4 VAL HB 1 14 ASP HA . . 5.170 4.948 4.771 5.074 . 0 0 "[ . 1 . 2]" 1
77 1 4 VAL HB 1 14 ASP QB . . 3.270 2.395 2.175 2.671 . 0 0 "[ . 1 . 2]" 1
78 1 4 VAL HB 1 14 ASP HB3 . . 4.100 2.679 2.188 3.581 . 0 0 "[ . 1 . 2]" 1
79 1 4 VAL HB 1 15 TYR H . . 5.500 5.557 5.515 5.592 0.092 2 0 "[ . 1 . 2]" 1
80 1 4 VAL HB 1 15 TYR HA . . 5.500 4.617 4.357 4.935 . 0 0 "[ . 1 . 2]" 1
81 1 4 VAL QG 1 14 ASP QB . . 3.420 2.810 2.576 3.025 . 0 0 "[ . 1 . 2]" 1
82 1 5 ILE H 1 5 ILE HB . . 3.100 2.556 2.468 2.645 . 0 0 "[ . 1 . 2]" 1
83 1 5 ILE H 1 5 ILE MD . . 3.530 2.076 1.853 2.972 . 0 0 "[ . 1 . 2]" 1
84 1 5 ILE H 1 5 ILE MG . . 3.790 3.791 3.696 3.827 0.037 7 0 "[ . 1 . 2]" 1
85 1 5 ILE H 1 6 ASP H . . 4.620 4.566 4.386 4.659 0.039 3 0 "[ . 1 . 2]" 1
86 1 5 ILE H 1 13 ILE HA . . 5.230 4.961 4.785 5.131 . 0 0 "[ . 1 . 2]" 1
87 1 5 ILE H 1 13 ILE MD . . 5.500 3.999 3.509 4.421 . 0 0 "[ . 1 . 2]" 1
88 1 5 ILE H 1 13 ILE MG . . 5.150 4.991 4.541 5.212 0.062 14 0 "[ . 1 . 2]" 1
89 1 5 ILE H 1 39 LEU QD . . 5.440 4.396 3.886 5.083 . 0 0 "[ . 1 . 2]" 1
90 1 5 ILE H 1 77 TYR QD . . 5.500 5.538 5.302 5.592 0.092 11 0 "[ . 1 . 2]" 1
91 1 5 ILE HA 1 5 ILE MD . . 4.070 3.451 2.489 3.711 . 0 0 "[ . 1 . 2]" 1
92 1 5 ILE HA 1 5 ILE MG . . 3.130 2.310 2.218 2.443 . 0 0 "[ . 1 . 2]" 1
93 1 5 ILE HA 1 6 ASP H . . 3.130 2.247 2.120 2.324 . 0 0 "[ . 1 . 2]" 1
94 1 5 ILE HA 1 6 ASP HB2 . . 5.500 4.587 4.314 4.797 . 0 0 "[ . 1 . 2]" 1
95 1 5 ILE HA 1 10 SER HA . . 5.500 5.127 4.437 5.543 0.043 12 0 "[ . 1 . 2]" 1
96 1 5 ILE HA 1 13 ILE H . . 5.500 5.132 4.906 5.504 0.004 2 0 "[ . 1 . 2]" 1
97 1 5 ILE HA 1 13 ILE HA . . 3.530 2.507 2.337 2.876 . 0 0 "[ . 1 . 2]" 1
98 1 5 ILE HA 1 13 ILE MD . . 3.510 2.162 1.992 2.690 . 0 0 "[ . 1 . 2]" 1
99 1 5 ILE HA 1 13 ILE MG . . 4.350 3.800 3.219 4.069 . 0 0 "[ . 1 . 2]" 1
100 1 5 ILE HA 1 14 ASP H . . 3.890 3.487 3.213 3.724 . 0 0 "[ . 1 . 2]" 1
101 1 5 ILE HB 1 5 ILE MD . . 3.540 2.311 2.123 3.310 . 0 0 "[ . 1 . 2]" 1
102 1 5 ILE HB 1 6 ASP H . . 4.380 4.125 4.011 4.347 . 0 0 "[ . 1 . 2]" 1
103 1 5 ILE MD 1 5 ILE MG . . 3.210 3.123 2.163 3.268 0.058 12 0 "[ . 1 . 2]" 1
104 1 5 ILE MD 1 6 ASP H . . 5.360 5.102 4.297 5.229 . 0 0 "[ . 1 . 2]" 1
105 1 5 ILE MD 1 13 ILE MD . . 5.500 3.334 2.202 3.869 . 0 0 "[ . 1 . 2]" 1
106 1 5 ILE MD 1 39 LEU QD . . 3.490 2.121 1.818 2.667 . 0 0 "[ . 1 . 2]" 1
107 1 5 ILE MD 1 39 LEU HG . . 4.040 3.214 2.492 4.115 0.075 20 0 "[ . 1 . 2]" 1
108 1 5 ILE MD 1 40 ALA H . . 5.020 4.471 3.604 4.742 . 0 0 "[ . 1 . 2]" 1
109 1 5 ILE MD 1 41 GLU H . . 5.500 5.003 4.581 5.390 . 0 0 "[ . 1 . 2]" 1
110 1 5 ILE MD 1 41 GLU HB2 . . 4.030 3.790 2.857 4.100 0.070 18 0 "[ . 1 . 2]" 1
111 1 5 ILE MD 1 77 TYR H . . 5.500 5.579 5.511 5.598 0.098 13 0 "[ . 1 . 2]" 1
112 1 5 ILE MD 1 77 TYR HB2 . . 4.280 3.977 3.783 4.142 . 0 0 "[ . 1 . 2]" 1
113 1 5 ILE MD 1 77 TYR QD . . 3.880 2.333 2.096 2.469 . 0 0 "[ . 1 . 2]" 1
114 1 5 ILE MD 1 77 TYR QE . . 3.930 2.337 2.218 2.760 . 0 0 "[ . 1 . 2]" 1
115 1 5 ILE MG 1 6 ASP H . . 3.100 2.539 2.384 2.788 . 0 0 "[ . 1 . 2]" 1
116 1 5 ILE MG 1 6 ASP HB2 . . 4.890 4.483 4.134 4.754 . 0 0 "[ . 1 . 2]" 1
117 1 5 ILE MG 1 8 ASN H . . 5.500 5.523 5.296 5.590 0.090 13 0 "[ . 1 . 2]" 1
118 1 5 ILE MG 1 9 ASP H . . 5.000 4.694 4.207 5.069 0.069 13 0 "[ . 1 . 2]" 1
119 1 5 ILE MG 1 10 SER H . . 5.060 4.445 4.100 4.915 . 0 0 "[ . 1 . 2]" 1
120 1 5 ILE MG 1 10 SER HA . . 3.190 2.184 1.896 2.650 . 0 0 "[ . 1 . 2]" 1
121 1 5 ILE MG 1 10 SER QB . . 5.340 3.444 2.653 4.003 . 0 0 "[ . 1 . 2]" 1
122 1 5 ILE MG 1 77 TYR QE . . 3.300 2.985 2.128 3.300 0.000 12 0 "[ . 1 . 2]" 1
123 1 6 ASP H 1 6 ASP HB2 . . 3.340 2.513 2.266 2.769 . 0 0 "[ . 1 . 2]" 1
124 1 6 ASP H 1 7 LYS H . . 4.600 4.526 4.449 4.632 0.032 1 0 "[ . 1 . 2]" 1
125 1 6 ASP H 1 8 ASN H . . 5.350 5.330 5.164 5.411 0.061 3 0 "[ . 1 . 2]" 1
126 1 6 ASP H 1 9 ASP H . . 4.870 4.671 4.371 4.887 0.017 13 0 "[ . 1 . 2]" 1
127 1 6 ASP H 1 12 LYS H . . 4.710 3.873 3.593 4.444 . 0 0 "[ . 1 . 2]" 1
128 1 6 ASP H 1 12 LYS HB2 . . 4.270 3.697 3.284 4.103 . 0 0 "[ . 1 . 2]" 1
129 1 6 ASP H 1 13 ILE H . . 5.070 4.458 4.192 4.817 . 0 0 "[ . 1 . 2]" 1
130 1 6 ASP H 1 13 ILE HA . . 3.480 2.861 2.466 3.209 . 0 0 "[ . 1 . 2]" 1
131 1 6 ASP H 1 13 ILE MG . . 5.010 4.848 4.451 5.075 0.065 14 0 "[ . 1 . 2]" 1
132 1 6 ASP H 1 14 ASP H . . 4.030 3.769 3.237 4.083 0.053 4 0 "[ . 1 . 2]" 1
133 1 6 ASP HA 1 7 LYS H . . 2.690 2.112 2.032 2.199 . 0 0 "[ . 1 . 2]" 1
134 1 6 ASP HA 1 7 LYS HA . . 5.500 4.390 4.259 4.452 . 0 0 "[ . 1 . 2]" 1
135 1 6 ASP HA 1 8 ASN H . . 3.680 3.640 3.514 3.752 0.072 5 0 "[ . 1 . 2]" 1
136 1 6 ASP HA 1 9 ASP H . . 4.360 4.316 4.108 4.426 0.066 16 0 "[ . 1 . 2]" 1
137 1 6 ASP HA 1 14 ASP H . . 5.130 4.588 4.145 5.022 . 0 0 "[ . 1 . 2]" 1
138 1 6 ASP HB2 1 7 LYS H . . 4.670 4.237 3.997 4.395 . 0 0 "[ . 1 . 2]" 1
139 1 6 ASP HB2 1 8 ASN H . . 4.550 4.386 4.214 4.480 . 0 0 "[ . 1 . 2]" 1
140 1 6 ASP HB2 1 9 ASP H . . 3.960 3.966 3.734 4.038 0.078 19 0 "[ . 1 . 2]" 1
141 1 6 ASP HB2 1 12 LYS H . . 4.790 4.433 3.865 4.828 0.038 9 0 "[ . 1 . 2]" 1
142 1 6 ASP HB2 1 12 LYS HB2 . . 4.300 2.729 2.296 3.279 . 0 0 "[ . 1 . 2]" 1
143 1 6 ASP HB2 1 13 ILE H . . 5.190 4.364 3.777 4.952 . 0 0 "[ . 1 . 2]" 1
144 1 6 ASP HB2 1 14 ASP H . . 4.960 4.331 3.813 4.714 . 0 0 "[ . 1 . 2]" 1
145 1 6 ASP HB2 1 19 ILE MG . . 5.260 4.070 3.445 4.628 . 0 0 "[ . 1 . 2]" 1
146 1 7 LYS H 1 7 LYS QB . . 2.830 2.565 2.428 2.728 . 0 0 "[ . 1 . 2]" 1
147 1 7 LYS H 1 7 LYS QD . . 4.090 3.341 1.756 4.105 0.015 10 0 "[ . 1 . 2]" 1
148 1 7 LYS H 1 7 LYS QG . . 3.150 2.140 1.794 3.122 . 0 0 "[ . 1 . 2]" 1
149 1 7 LYS H 1 8 ASN H . . 3.220 2.623 2.418 2.777 . 0 0 "[ . 1 . 2]" 1
150 1 7 LYS H 1 8 ASN QB . . 4.880 4.760 4.574 4.920 0.040 10 0 "[ . 1 . 2]" 1
151 1 7 LYS H 1 8 ASN QD . . 5.100 3.889 3.387 5.172 0.072 1 0 "[ . 1 . 2]" 1
152 1 7 LYS H 1 9 ASP H . . 4.420 4.219 3.979 4.372 . 0 0 "[ . 1 . 2]" 1
153 1 7 LYS HA 1 7 LYS QG . . 3.410 3.391 3.349 3.475 0.065 5 0 "[ . 1 . 2]" 1
154 1 7 LYS HA 1 8 ASN H . . 3.520 3.454 3.347 3.507 . 0 0 "[ . 1 . 2]" 1
155 1 7 LYS HA 1 9 ASP H . . 4.610 4.421 4.105 4.686 0.076 5 0 "[ . 1 . 2]" 1
156 1 7 LYS QB 1 8 ASN H . . 3.970 3.697 3.538 3.814 . 0 0 "[ . 1 . 2]" 1
157 1 7 LYS QB 1 8 ASN HA . . 4.530 4.513 4.342 4.608 0.078 4 0 "[ . 1 . 2]" 1
158 1 7 LYS QB 1 8 ASN QD . . 4.520 4.276 3.437 4.602 0.082 12 0 "[ . 1 . 2]" 1
159 1 7 LYS QD 1 8 ASN H . . 4.540 4.404 2.969 4.621 0.081 13 0 "[ . 1 . 2]" 1
160 1 7 LYS QE 1 7 LYS QG . . 2.940 2.356 2.049 2.861 . 0 0 "[ . 1 . 2]" 1
161 1 7 LYS QG 1 8 ASN H . . 3.640 2.564 2.266 2.854 . 0 0 "[ . 1 . 2]" 1
162 1 7 LYS QG 1 8 ASN HA . . 3.930 3.766 3.487 4.000 0.070 8 0 "[ . 1 . 2]" 1
163 1 7 LYS QG 1 8 ASN HD21 . . 4.600 2.848 2.184 3.739 . 0 0 "[ . 1 . 2]" 1
164 1 7 LYS QG 1 8 ASN HD22 . . 4.600 2.846 2.533 3.273 . 0 0 "[ . 1 . 2]" 1
165 1 7 LYS QG 1 9 ASP H . . 4.700 4.626 4.347 4.776 0.076 5 0 "[ . 1 . 2]" 1
166 1 8 ASN H 1 8 ASN QB . . 2.790 2.501 2.327 2.647 . 0 0 "[ . 1 . 2]" 1
167 1 8 ASN H 1 8 ASN HD21 . . 4.150 2.651 2.110 3.814 . 0 0 "[ . 1 . 2]" 1
168 1 8 ASN H 1 8 ASN HD22 . . 4.150 3.824 3.517 4.220 0.070 1 0 "[ . 1 . 2]" 1
169 1 8 ASN H 1 9 ASP H . . 2.830 2.334 2.003 2.448 . 0 0 "[ . 1 . 2]" 1
170 1 8 ASN H 1 9 ASP HA . . 4.990 5.012 4.765 5.060 0.070 11 0 "[ . 1 . 2]" 1
171 1 8 ASN H 1 9 ASP HB2 . . 4.710 4.561 4.202 4.747 0.037 16 0 "[ . 1 . 2]" 1
172 1 8 ASN HA 1 8 ASN QD . . 4.140 3.551 1.900 4.045 . 0 0 "[ . 1 . 2]" 1
173 1 8 ASN HA 1 9 ASP H . . 3.520 3.556 3.384 3.594 0.074 13 0 "[ . 1 . 2]" 1
174 1 8 ASN QB 1 8 ASN QD . . 2.910 2.316 2.139 2.887 . 0 0 "[ . 1 . 2]" 1
175 1 8 ASN QB 1 8 ASN HD22 . . 3.560 3.362 3.277 3.558 . 0 0 "[ . 1 . 2]" 1
176 1 8 ASN QB 1 9 ASP H . . 3.100 2.821 2.365 3.185 0.085 1 0 "[ . 1 . 2]" 1
177 1 9 ASP H 1 9 ASP HB2 . . 3.370 2.664 2.453 3.024 . 0 0 "[ . 1 . 2]" 1
178 1 9 ASP H 1 10 SER H . . 4.240 3.998 3.703 4.194 . 0 0 "[ . 1 . 2]" 1
179 1 9 ASP H 1 12 LYS HB2 . . 4.290 3.903 3.384 4.324 0.034 8 0 "[ . 1 . 2]" 1
180 1 9 ASP H 1 12 LYS QD . . 5.310 4.828 4.228 5.370 0.060 18 0 "[ . 1 . 2]" 1
181 1 9 ASP H 1 12 LYS QE . . 5.500 5.233 4.713 5.577 0.077 6 0 "[ . 1 . 2]" 1
182 1 9 ASP HA 1 10 SER H . . 2.920 2.235 2.094 2.398 . 0 0 "[ . 1 . 2]" 1
183 1 9 ASP HA 1 10 SER QB . . 4.400 4.242 3.891 4.486 0.086 6 0 "[ . 1 . 2]" 1
184 1 9 ASP HA 1 11 ARG H . . 3.840 3.472 3.227 3.785 . 0 0 "[ . 1 . 2]" 1
185 1 9 ASP HA 1 52 SER H . . 4.640 4.129 3.575 4.571 . 0 0 "[ . 1 . 2]" 1
186 1 9 ASP HB2 1 11 ARG H . . 4.750 4.417 4.041 4.806 0.056 15 0 "[ . 1 . 2]" 1
187 1 9 ASP HB2 1 12 LYS H . . 4.330 3.948 3.541 4.402 0.072 8 0 "[ . 1 . 2]" 1
188 1 9 ASP HB2 1 12 LYS QD . . 5.500 2.987 2.319 3.975 . 0 0 "[ . 1 . 2]" 1
189 1 10 SER H 1 10 SER QB . . 3.420 2.259 2.001 2.533 . 0 0 "[ . 1 . 2]" 1
190 1 10 SER H 1 11 ARG H . . 3.550 2.708 2.588 2.822 . 0 0 "[ . 1 . 2]" 1
191 1 10 SER H 1 11 ARG QD . . 5.500 5.338 4.605 5.581 0.081 8 0 "[ . 1 . 2]" 1
192 1 10 SER H 1 12 LYS H . . 4.190 4.255 4.091 4.272 0.082 10 0 "[ . 1 . 2]" 1
193 1 10 SER H 1 45 PHE HB3 . . 3.990 3.787 3.462 4.065 0.075 20 0 "[ . 1 . 2]" 1
194 1 10 SER H 1 45 PHE QD . . 4.190 4.200 3.819 4.289 0.099 12 0 "[ . 1 . 2]" 1
195 1 10 SER H 1 45 PHE QE . . 5.330 5.257 4.739 5.411 0.081 9 0 "[ . 1 . 2]" 1
196 1 10 SER H 1 52 SER H . . 4.960 4.453 3.767 5.009 0.049 15 0 "[ . 1 . 2]" 1
197 1 10 SER H 1 52 SER QB . . 3.900 3.395 2.585 3.966 0.066 11 0 "[ . 1 . 2]" 1
198 1 10 SER HA 1 12 LYS H . . 3.970 3.625 3.223 3.879 . 0 0 "[ . 1 . 2]" 1
199 1 10 SER HA 1 52 SER QB . . 5.340 4.927 4.235 5.413 0.073 3 0 "[ . 1 . 2]" 1
200 1 10 SER QB 1 11 ARG H . . 4.200 3.136 2.665 3.740 . 0 0 "[ . 1 . 2]" 1
201 1 10 SER QB 1 11 ARG QB . . 4.790 4.094 3.696 4.853 0.063 6 0 "[ . 1 . 2]" 1
202 1 11 ARG H 1 11 ARG QB . . 3.390 2.568 2.084 2.793 . 0 0 "[ . 1 . 2]" 1
203 1 11 ARG H 1 11 ARG QD . . 4.080 3.702 3.213 4.093 0.013 8 0 "[ . 1 . 2]" 1
204 1 11 ARG H 1 12 LYS H . . 3.190 2.464 2.265 2.667 . 0 0 "[ . 1 . 2]" 1
205 1 11 ARG H 1 12 LYS HA . . 5.110 5.008 4.870 5.148 0.038 15 0 "[ . 1 . 2]" 1
206 1 11 ARG H 1 12 LYS HB2 . . 4.410 4.444 4.196 4.483 0.073 8 0 "[ . 1 . 2]" 1
207 1 11 ARG H 1 12 LYS QE . . 5.500 5.333 5.049 5.564 0.064 4 0 "[ . 1 . 2]" 1
208 1 11 ARG H 1 12 LYS HG2 . . 5.280 5.302 5.142 5.354 0.074 11 0 "[ . 1 . 2]" 1
209 1 11 ARG H 1 45 PHE QD . . 4.850 4.509 4.284 4.715 . 0 0 "[ . 1 . 2]" 1
210 1 11 ARG H 1 45 PHE QE . . 4.530 4.431 4.042 4.624 0.094 8 0 "[ . 1 . 2]" 1
211 1 11 ARG H 1 50 GLY HA3 . . 5.450 4.953 4.129 5.377 . 0 0 "[ . 1 . 2]" 1
212 1 11 ARG H 1 75 TRP HZ3 . . 5.340 5.076 4.742 5.406 0.066 11 0 "[ . 1 . 2]" 1
213 1 11 ARG HA 1 22 ILE H . . 5.150 4.672 4.203 5.207 0.057 9 0 "[ . 1 . 2]" 1
214 1 11 ARG HA 1 22 ILE HB . . 5.500 4.193 3.645 4.985 . 0 0 "[ . 1 . 2]" 1
215 1 11 ARG HA 1 22 ILE MD . . 3.280 2.854 2.350 3.336 0.056 9 0 "[ . 1 . 2]" 1
216 1 11 ARG HA 1 75 TRP HZ3 . . 3.480 2.422 2.120 3.206 . 0 0 "[ . 1 . 2]" 1
217 1 11 ARG QB 1 11 ARG HE . . 4.250 3.923 2.335 4.235 . 0 0 "[ . 1 . 2]" 1
218 1 11 ARG QB 1 12 LYS H . . 3.900 3.909 3.352 3.974 0.074 19 0 "[ . 1 . 2]" 1
219 1 11 ARG QB 1 22 ILE H . . 4.400 3.539 2.829 4.227 . 0 0 "[ . 1 . 2]" 1
220 1 11 ARG QB 1 45 PHE QD . . 4.210 3.963 3.540 4.295 0.085 20 0 "[ . 1 . 2]" 1
221 1 11 ARG QB 1 45 PHE QE . . 4.200 2.978 2.423 3.501 . 0 0 "[ . 1 . 2]" 1
222 1 11 ARG QB 1 75 TRP HH2 . . 4.140 3.420 3.118 4.223 0.083 8 0 "[ . 1 . 2]" 1
223 1 11 ARG QB 1 75 TRP HZ3 . . 4.390 2.486 2.134 3.894 . 0 0 "[ . 1 . 2]" 1
224 1 11 ARG QD 1 22 ILE MD . . 5.270 5.205 5.009 5.370 0.100 1 0 "[ . 1 . 2]" 1
225 1 11 ARG QD 1 45 PHE QD . . 4.590 3.690 2.957 4.224 . 0 0 "[ . 1 . 2]" 1
226 1 11 ARG QD 1 75 TRP HH2 . . 4.970 4.442 3.533 4.873 . 0 0 "[ . 1 . 2]" 1
227 1 11 ARG QD 1 75 TRP HZ3 . . 4.500 4.466 4.008 4.592 0.092 12 0 "[ . 1 . 2]" 1
228 1 11 ARG HE 1 50 GLY H . . 5.500 5.070 4.529 5.576 0.076 1 0 "[ . 1 . 2]" 1
229 1 11 ARG HE 1 50 GLY HA3 . . 5.060 2.591 2.018 3.948 . 0 0 "[ . 1 . 2]" 1
230 1 12 LYS H 1 12 LYS HB2 . . 3.350 2.495 2.358 2.607 . 0 0 "[ . 1 . 2]" 1
231 1 12 LYS H 1 12 LYS QE . . 4.850 4.862 4.755 4.935 0.085 11 0 "[ . 1 . 2]" 1
232 1 12 LYS H 1 12 LYS HG2 . . 3.890 3.911 3.790 3.958 0.068 10 0 "[ . 1 . 2]" 1
233 1 12 LYS H 1 13 ILE H . . 4.600 4.518 4.449 4.594 . 0 0 "[ . 1 . 2]" 1
234 1 12 LYS HA 1 12 LYS QD . . 3.940 3.809 3.704 3.913 . 0 0 "[ . 1 . 2]" 1
235 1 12 LYS HA 1 12 LYS QE . . 5.350 4.712 4.460 4.827 . 0 0 "[ . 1 . 2]" 1
236 1 12 LYS HA 1 12 LYS HG2 . . 4.150 2.390 2.264 2.503 . 0 0 "[ . 1 . 2]" 1
237 1 12 LYS HA 1 13 ILE H . . 3.040 2.313 2.178 2.463 . 0 0 "[ . 1 . 2]" 1
238 1 12 LYS HA 1 13 ILE HB . . 4.590 4.353 4.219 4.550 . 0 0 "[ . 1 . 2]" 1
239 1 12 LYS HA 1 19 ILE MG . . 4.330 4.186 3.910 4.388 0.058 8 0 "[ . 1 . 2]" 1
240 1 12 LYS HA 1 20 TYR H . . 4.600 4.308 4.120 4.489 . 0 0 "[ . 1 . 2]" 1
241 1 12 LYS HA 1 20 TYR QB . . 5.340 4.422 3.994 4.739 . 0 0 "[ . 1 . 2]" 1
242 1 12 LYS HA 1 21 SER H . . 5.270 4.830 4.548 5.093 . 0 0 "[ . 1 . 2]" 1
243 1 12 LYS HA 1 21 SER HA . . 3.710 2.504 2.327 2.791 . 0 0 "[ . 1 . 2]" 1
244 1 12 LYS HA 1 21 SER HB2 . . 4.590 4.041 3.794 4.286 . 0 0 "[ . 1 . 2]" 1
245 1 12 LYS HA 1 22 ILE H . . 4.140 4.003 3.752 4.203 0.063 11 0 "[ . 1 . 2]" 1
246 1 12 LYS HA 1 22 ILE MD . . 4.390 3.846 3.150 4.233 . 0 0 "[ . 1 . 2]" 1
247 1 12 LYS QD 1 13 ILE H . . 4.320 4.251 4.029 4.393 0.073 19 0 "[ . 1 . 2]" 1
248 1 12 LYS QD 1 19 ILE MG . . 5.500 2.038 1.909 2.282 . 0 0 "[ . 1 . 2]" 1
249 1 12 LYS QD 1 21 SER H . . 5.500 5.494 5.247 5.584 0.084 1 0 "[ . 1 . 2]" 1
250 1 12 LYS QD 1 21 SER HA . . 5.500 4.411 4.204 4.636 . 0 0 "[ . 1 . 2]" 1
251 1 12 LYS QE 1 12 LYS HG2 . . 3.650 2.728 2.517 2.908 . 0 0 "[ . 1 . 2]" 1
252 1 12 LYS QE 1 19 ILE MG . . 3.660 3.613 3.423 3.760 0.100 6 0 "[ . 1 . 2]" 1
253 1 12 LYS QE 1 21 SER HB2 . . 4.060 3.554 2.640 3.909 . 0 0 "[ . 1 . 2]" 1
254 1 12 LYS HG2 1 13 ILE H . . 4.070 3.951 3.813 4.118 0.048 1 0 "[ . 1 . 2]" 1
255 1 12 LYS HG2 1 19 ILE MG . . 3.820 3.530 3.324 3.737 . 0 0 "[ . 1 . 2]" 1
256 1 12 LYS HG2 1 21 SER H . . 5.140 4.928 4.590 5.181 0.041 9 0 "[ . 1 . 2]" 1
257 1 12 LYS HG2 1 21 SER HA . . 4.080 2.776 2.316 3.092 . 0 0 "[ . 1 . 2]" 1
258 1 12 LYS HG2 1 22 ILE H . . 4.630 4.411 4.057 4.675 0.045 9 0 "[ . 1 . 2]" 1
259 1 13 ILE H 1 13 ILE HB . . 3.350 2.585 2.476 2.705 . 0 0 "[ . 1 . 2]" 1
260 1 13 ILE H 1 13 ILE MG . . 3.880 3.831 3.760 3.897 0.017 4 0 "[ . 1 . 2]" 1
261 1 13 ILE H 1 14 ASP H . . 4.450 4.297 4.148 4.417 . 0 0 "[ . 1 . 2]" 1
262 1 13 ILE H 1 19 ILE HA . . 4.280 4.141 3.887 4.300 0.020 9 0 "[ . 1 . 2]" 1
263 1 13 ILE H 1 19 ILE MG . . 3.670 3.495 3.216 3.746 0.076 1 0 "[ . 1 . 2]" 1
264 1 13 ILE H 1 20 TYR H . . 3.880 2.519 2.350 2.645 . 0 0 "[ . 1 . 2]" 1
265 1 13 ILE H 1 20 TYR QB . . 3.700 3.158 2.839 3.496 . 0 0 "[ . 1 . 2]" 1
266 1 13 ILE H 1 20 TYR QD . . 4.830 4.056 3.445 4.690 . 0 0 "[ . 1 . 2]" 1
267 1 13 ILE H 1 21 SER H . . 4.930 4.937 4.848 4.997 0.067 15 0 "[ . 1 . 2]" 1
268 1 13 ILE H 1 21 SER HB2 . . 5.500 5.173 4.922 5.573 0.073 17 0 "[ . 1 . 2]" 1
269 1 13 ILE H 1 92 PHE QE . . 5.500 5.510 5.264 5.579 0.079 10 0 "[ . 1 . 2]" 1
270 1 13 ILE H 1 103 ALA MB . . 5.380 5.187 4.999 5.305 . 0 0 "[ . 1 . 2]" 1
271 1 13 ILE HA 1 13 ILE MD . . 3.620 2.192 1.969 2.328 . 0 0 "[ . 1 . 2]" 1
272 1 13 ILE HA 1 13 ILE MG . . 3.550 2.527 2.389 2.675 . 0 0 "[ . 1 . 2]" 1
273 1 13 ILE HA 1 14 ASP H . . 3.110 2.115 2.034 2.224 . 0 0 "[ . 1 . 2]" 1
274 1 13 ILE HA 1 15 TYR H . . 5.500 5.543 5.304 5.579 0.079 17 0 "[ . 1 . 2]" 1
275 1 13 ILE HA 1 20 TYR H . . 5.040 4.690 4.543 4.811 . 0 0 "[ . 1 . 2]" 1
276 1 13 ILE HB 1 13 ILE MD . . 3.280 3.274 3.217 3.300 0.020 20 0 "[ . 1 . 2]" 1
277 1 13 ILE HB 1 14 ASP H . . 4.400 4.126 3.954 4.354 . 0 0 "[ . 1 . 2]" 1
278 1 13 ILE HB 1 15 TYR H . . 5.470 5.316 4.916 5.525 0.055 19 0 "[ . 1 . 2]" 1
279 1 13 ILE HB 1 15 TYR HB2 . . 5.500 5.138 4.778 5.559 0.059 14 0 "[ . 1 . 2]" 1
280 1 13 ILE HB 1 20 TYR H . . 4.210 3.477 3.185 3.737 . 0 0 "[ . 1 . 2]" 1
281 1 13 ILE HB 1 20 TYR QB . . 3.950 2.267 2.109 2.425 . 0 0 "[ . 1 . 2]" 1
282 1 13 ILE HB 1 20 TYR QD . . 3.650 2.690 2.187 3.169 . 0 0 "[ . 1 . 2]" 1
283 1 13 ILE HB 1 21 SER H . . 5.500 5.518 5.310 5.565 0.065 16 0 "[ . 1 . 2]" 1
284 1 13 ILE HB 1 92 PHE QE . . 4.090 3.674 3.469 3.911 . 0 0 "[ . 1 . 2]" 1
285 1 13 ILE HB 1 103 ALA MB . . 4.670 4.331 4.168 4.512 . 0 0 "[ . 1 . 2]" 1
286 1 13 ILE MD 1 13 ILE MG . . 2.830 2.096 1.983 2.158 . 0 0 "[ . 1 . 2]" 1
287 1 13 ILE MD 1 14 ASP H . . 3.670 3.559 3.216 3.748 0.078 9 0 "[ . 1 . 2]" 1
288 1 13 ILE MD 1 77 TYR QE . . 5.500 5.110 4.738 5.587 0.087 15 0 "[ . 1 . 2]" 1
289 1 13 ILE MD 1 80 ILE MD . . 3.150 3.017 2.625 3.248 0.098 8 0 "[ . 1 . 2]" 1
290 1 13 ILE MD 1 80 ILE HG12 . . 4.660 4.661 4.363 4.743 0.083 9 0 "[ . 1 . 2]" 1
291 1 13 ILE MD 1 80 ILE MG . . 5.500 5.132 4.732 5.354 . 0 0 "[ . 1 . 2]" 1
292 1 13 ILE MD 1 92 PHE QE . . 4.290 4.210 3.783 4.372 0.082 4 0 "[ . 1 . 2]" 1
293 1 13 ILE MG 1 14 ASP H . . 3.390 2.572 2.303 3.250 . 0 0 "[ . 1 . 2]" 1
294 1 13 ILE MG 1 15 TYR H . . 4.220 3.540 3.199 4.064 . 0 0 "[ . 1 . 2]" 1
295 1 13 ILE MG 1 15 TYR HB2 . . 3.710 2.615 2.281 3.091 . 0 0 "[ . 1 . 2]" 1
296 1 13 ILE MG 1 20 TYR H . . 4.560 4.195 3.918 4.421 . 0 0 "[ . 1 . 2]" 1
297 1 13 ILE MG 1 20 TYR QB . . 4.860 3.487 3.185 3.743 . 0 0 "[ . 1 . 2]" 1
298 1 13 ILE MG 1 20 TYR QD . . 3.440 2.572 2.180 2.924 . 0 0 "[ . 1 . 2]" 1
299 1 13 ILE MG 1 39 LEU QD . . 5.150 4.364 4.026 4.796 . 0 0 "[ . 1 . 2]" 1
300 1 13 ILE MG 1 80 ILE MD . . 3.920 3.218 2.903 3.523 . 0 0 "[ . 1 . 2]" 1
301 1 13 ILE MG 1 92 PHE QE . . 3.910 3.432 3.227 3.801 . 0 0 "[ . 1 . 2]" 1
302 1 14 ASP H 1 14 ASP QB . . 3.270 2.362 2.139 2.532 . 0 0 "[ . 1 . 2]" 1
303 1 14 ASP H 1 14 ASP HB3 . . 3.850 2.919 2.186 3.592 . 0 0 "[ . 1 . 2]" 1
304 1 14 ASP H 1 15 TYR H . . 4.280 4.069 3.920 4.297 0.017 14 0 "[ . 1 . 2]" 1
305 1 14 ASP H 1 15 TYR HA . . 5.450 4.901 4.776 5.124 . 0 0 "[ . 1 . 2]" 1
306 1 14 ASP H 1 20 TYR H . . 5.280 5.042 4.893 5.139 . 0 0 "[ . 1 . 2]" 1
307 1 14 ASP HA 1 15 TYR H . . 2.880 2.205 2.053 2.451 . 0 0 "[ . 1 . 2]" 1
308 1 14 ASP HA 1 15 TYR HA . . 4.430 4.454 4.377 4.498 0.068 14 0 "[ . 1 . 2]" 1
309 1 14 ASP HA 1 15 TYR HB2 . . 5.080 4.861 4.719 5.041 . 0 0 "[ . 1 . 2]" 1
310 1 14 ASP HA 1 17 GLY H . . 5.500 4.996 4.449 5.368 . 0 0 "[ . 1 . 2]" 1
311 1 14 ASP HA 1 18 ASN H . . 4.530 4.260 3.914 4.588 0.058 1 0 "[ . 1 . 2]" 1
312 1 14 ASP HA 1 19 ILE H . . 5.330 5.085 4.785 5.292 . 0 0 "[ . 1 . 2]" 1
313 1 14 ASP HA 1 19 ILE HA . . 3.430 2.851 2.565 2.989 . 0 0 "[ . 1 . 2]" 1
314 1 14 ASP HA 1 19 ILE MD . . 5.500 2.499 2.161 2.935 . 0 0 "[ . 1 . 2]" 1
315 1 14 ASP HA 1 19 ILE MG . . 4.480 4.314 4.099 4.546 0.066 8 0 "[ . 1 . 2]" 1
316 1 14 ASP HA 1 20 TYR H . . 4.040 4.046 3.957 4.117 0.077 10 0 "[ . 1 . 2]" 1
317 1 14 ASP QB 1 15 TYR H . . 4.200 3.832 3.642 4.075 . 0 0 "[ . 1 . 2]" 1
318 1 14 ASP QB 1 18 ASN H . . 5.340 5.385 5.202 5.440 0.100 12 0 "[ . 1 . 2]" 1
319 1 15 TYR H 1 15 TYR HB2 . . 3.600 3.417 3.279 3.533 . 0 0 "[ . 1 . 2]" 1
320 1 15 TYR H 1 15 TYR QD . . 4.520 4.437 4.296 4.533 0.013 19 0 "[ . 1 . 2]" 1
321 1 15 TYR H 1 16 MET HB2 . . 5.500 5.051 4.899 5.277 . 0 0 "[ . 1 . 2]" 1
322 1 15 TYR H 1 18 ASN H . . 3.710 2.932 2.661 3.190 . 0 0 "[ . 1 . 2]" 1
323 1 15 TYR H 1 18 ASN HA . . 5.220 4.917 4.547 5.084 . 0 0 "[ . 1 . 2]" 1
324 1 15 TYR H 1 18 ASN QB . . 4.070 3.613 3.301 4.184 0.114 19 0 "[ . 1 . 2]" 1
325 1 15 TYR H 1 18 ASN HB3 . . 4.950 4.919 4.693 5.038 0.088 17 0 "[ . 1 . 2]" 1
326 1 15 TYR H 1 18 ASN HD21 . . 5.460 5.221 4.751 5.519 0.059 15 0 "[ . 1 . 2]" 1
327 1 15 TYR H 1 19 ILE HA . . 3.960 3.799 3.576 3.975 0.015 9 0 "[ . 1 . 2]" 1
328 1 15 TYR H 1 19 ILE MD . . 4.620 4.175 3.944 4.533 . 0 0 "[ . 1 . 2]" 1
329 1 15 TYR H 1 19 ILE HG12 . . 5.500 5.393 4.961 5.567 0.067 9 0 "[ . 1 . 2]" 1
330 1 15 TYR H 1 20 TYR H . . 4.770 4.767 4.448 4.848 0.078 17 0 "[ . 1 . 2]" 1
331 1 15 TYR HA 1 16 MET H . . 3.180 2.177 2.093 2.307 . 0 0 "[ . 1 . 2]" 1
332 1 15 TYR HA 1 17 GLY H . . 4.250 3.594 3.420 3.869 . 0 0 "[ . 1 . 2]" 1
333 1 15 TYR HB2 1 16 MET H . . 4.250 4.161 4.074 4.246 . 0 0 "[ . 1 . 2]" 1
334 1 15 TYR QD 1 16 MET H . . 3.610 2.833 2.457 3.089 . 0 0 "[ . 1 . 2]" 1
335 1 15 TYR QD 1 16 MET ME . . 5.010 4.461 4.167 4.822 . 0 0 "[ . 1 . 2]" 1
336 1 15 TYR QD 1 16 MET HG2 . . 4.340 4.266 4.008 4.414 0.074 1 0 "[ . 1 . 2]" 1
337 1 15 TYR QD 1 17 GLY H . . 5.360 5.165 4.950 5.350 . 0 0 "[ . 1 . 2]" 1
338 1 15 TYR QD 1 18 ASN H . . 5.500 5.398 5.207 5.548 0.048 12 0 "[ . 1 . 2]" 1
339 1 15 TYR QD 1 88 LEU QD . . 4.300 3.282 2.507 4.065 . 0 0 "[ . 1 . 2]" 1
340 1 15 TYR QD 1 89 THR HA . . 5.500 4.477 3.767 5.112 . 0 0 "[ . 1 . 2]" 1
341 1 15 TYR QE 1 16 MET H . . 4.230 4.224 3.918 4.321 0.091 13 0 "[ . 1 . 2]" 1
342 1 15 TYR QE 1 16 MET ME . . 3.720 3.246 2.779 3.787 0.067 15 0 "[ . 1 . 2]" 1
343 1 15 TYR QE 1 16 MET HG2 . . 4.130 3.885 3.420 4.191 0.061 13 0 "[ . 1 . 2]" 1
344 1 15 TYR QE 1 88 LEU H . . 5.500 5.339 4.327 5.581 0.081 13 0 "[ . 1 . 2]" 1
345 1 15 TYR QE 1 88 LEU HB3 . . 3.970 2.655 2.114 3.067 . 0 0 "[ . 1 . 2]" 1
346 1 15 TYR QE 1 88 LEU QD . . 3.860 3.041 2.412 3.759 . 0 0 "[ . 1 . 2]" 1
347 1 15 TYR QE 1 88 LEU HG . . 4.500 3.418 2.758 4.044 . 0 0 "[ . 1 . 2]" 1
348 1 15 TYR QE 1 89 THR H . . 5.500 5.147 4.167 5.536 0.036 9 0 "[ . 1 . 2]" 1
349 1 15 TYR QE 1 89 THR HA . . 5.500 5.147 4.231 5.577 0.077 19 0 "[ . 1 . 2]" 1
350 1 15 TYR QE 1 89 THR MG . . 4.200 3.901 3.112 4.291 0.091 7 0 "[ . 1 . 2]" 1
351 1 16 MET H 1 16 MET HA . . 2.840 2.279 2.257 2.317 . 0 0 "[ . 1 . 2]" 1
352 1 16 MET H 1 16 MET HB2 . . 3.720 3.649 3.575 3.769 0.049 8 0 "[ . 1 . 2]" 1
353 1 16 MET H 1 16 MET ME . . 5.160 4.850 4.661 5.007 . 0 0 "[ . 1 . 2]" 1
354 1 16 MET H 1 16 MET HG2 . . 3.630 3.362 3.096 3.552 . 0 0 "[ . 1 . 2]" 1
355 1 16 MET H 1 18 ASN H . . 4.850 4.207 4.046 4.359 . 0 0 "[ . 1 . 2]" 1
356 1 16 MET HA 1 16 MET ME . . 4.240 4.168 3.834 4.314 0.074 9 0 "[ . 1 . 2]" 1
357 1 16 MET HA 1 16 MET HG2 . . 3.220 2.503 2.295 2.652 . 0 0 "[ . 1 . 2]" 1
358 1 16 MET HA 1 17 GLY H . . 3.170 2.993 2.807 3.218 0.048 17 0 "[ . 1 . 2]" 1
359 1 16 MET HA 1 17 GLY QA . . 4.410 4.093 4.016 4.199 . 0 0 "[ . 1 . 2]" 1
360 1 16 MET HA 1 18 ASN H . . 4.470 4.417 4.184 4.534 0.064 17 0 "[ . 1 . 2]" 1
361 1 16 MET HB2 1 17 GLY H . . 4.370 4.203 3.887 4.391 0.021 16 0 "[ . 1 . 2]" 1
362 1 16 MET HB2 1 18 ASN H . . 4.310 3.649 3.303 3.921 . 0 0 "[ . 1 . 2]" 1
363 1 16 MET HB2 1 18 ASN HD21 . . 4.570 2.708 2.307 3.172 . 0 0 "[ . 1 . 2]" 1
364 1 16 MET HB2 1 18 ASN HD22 . . 4.530 3.046 2.572 3.691 . 0 0 "[ . 1 . 2]" 1
365 1 16 MET HB2 1 89 THR MG . . 4.910 3.719 2.731 4.680 . 0 0 "[ . 1 . 2]" 1
366 1 16 MET ME 1 16 MET HG2 . . 3.150 2.170 2.073 2.240 . 0 0 "[ . 1 . 2]" 1
367 1 16 MET ME 1 89 THR MG . . 5.240 3.838 3.285 4.637 . 0 0 "[ . 1 . 2]" 1
368 1 16 MET HG2 1 17 GLY H . . 5.360 5.203 4.944 5.367 0.007 9 0 "[ . 1 . 2]" 1
369 1 17 GLY H 1 18 ASN H . . 3.010 2.563 2.253 2.734 . 0 0 "[ . 1 . 2]" 1
370 1 17 GLY H 1 18 ASN HA . . 5.500 5.241 4.942 5.379 . 0 0 "[ . 1 . 2]" 1
371 1 17 GLY H 1 18 ASN QB . . 5.140 4.828 4.632 5.132 . 0 0 "[ . 1 . 2]" 1
372 1 17 GLY HA2 1 18 ASN H . . 3.500 3.194 3.063 3.334 . 0 0 "[ . 1 . 2]" 1
373 1 17 GLY HA3 1 18 ASN H . . 3.500 3.463 3.332 3.555 0.055 12 0 "[ . 1 . 2]" 1
374 1 18 ASN H 1 18 ASN QB . . 3.000 2.599 2.409 3.074 0.074 17 0 "[ . 1 . 2]" 1
375 1 18 ASN H 1 18 ASN HB3 . . 3.730 3.633 2.995 3.781 0.051 12 0 "[ . 1 . 2]" 1
376 1 18 ASN H 1 18 ASN HD21 . . 4.180 3.803 3.445 4.212 0.032 19 0 "[ . 1 . 2]" 1
377 1 18 ASN H 1 18 ASN HD22 . . 4.610 4.452 3.969 4.669 0.059 8 0 "[ . 1 . 2]" 1
378 1 18 ASN H 1 19 ILE H . . 4.540 4.483 4.393 4.589 0.049 9 0 "[ . 1 . 2]" 1
379 1 18 ASN H 1 19 ILE HA . . 5.070 4.940 4.763 5.128 0.058 14 0 "[ . 1 . 2]" 1
380 1 18 ASN HA 1 18 ASN HD21 . . 4.460 4.429 3.935 4.526 0.066 3 0 "[ . 1 . 2]" 1
381 1 18 ASN HA 1 18 ASN HD22 . . 4.970 4.834 4.666 5.072 0.102 19 0 "[ . 1 . 2]" 1
382 1 18 ASN HA 1 19 ILE H . . 2.820 2.437 2.315 2.555 . 0 0 "[ . 1 . 2]" 1
383 1 18 ASN HA 1 19 ILE HB . . 4.770 4.517 4.331 4.759 . 0 0 "[ . 1 . 2]" 1
384 1 18 ASN HA 1 19 ILE HG12 . . 3.920 3.575 3.397 3.750 . 0 0 "[ . 1 . 2]" 1
385 1 18 ASN HA 1 19 ILE MG . . 5.500 5.485 5.405 5.557 0.057 3 0 "[ . 1 . 2]" 1
386 1 18 ASN QB 1 18 ASN HD21 . . 3.100 2.120 2.051 2.195 . 0 0 "[ . 1 . 2]" 1
387 1 18 ASN QB 1 18 ASN HD22 . . 3.240 3.232 3.041 3.292 0.052 16 0 "[ . 1 . 2]" 1
388 1 18 ASN QB 1 19 ILE H . . 2.970 2.352 1.957 2.607 . 0 0 "[ . 1 . 2]" 1
389 1 18 ASN QB 1 19 ILE HB . . 4.920 4.700 4.543 4.890 . 0 0 "[ . 1 . 2]" 1
390 1 18 ASN QB 1 89 THR HA . . 5.340 4.386 3.791 5.250 . 0 0 "[ . 1 . 2]" 1
391 1 18 ASN QB 1 89 THR HB . . 5.340 5.201 4.532 5.422 0.082 8 0 "[ . 1 . 2]" 1
392 1 18 ASN HB3 1 18 ASN HD22 . . 3.900 3.801 3.287 3.945 0.045 12 0 "[ . 1 . 2]" 1
393 1 18 ASN HB3 1 19 ILE H . . 3.610 2.592 2.224 3.658 0.048 19 0 "[ . 1 . 2]" 1
394 1 18 ASN HD21 1 19 ILE H . . 5.350 5.339 4.950 5.422 0.072 11 0 "[ . 1 . 2]" 1
395 1 18 ASN HD21 1 89 THR HA . . 4.540 3.546 2.918 4.574 0.034 17 0 "[ . 1 . 2]" 1
396 1 18 ASN HD21 1 89 THR HB . . 4.710 4.157 3.420 4.761 0.051 17 0 "[ . 1 . 2]" 1
397 1 18 ASN HD21 1 89 THR MG . . 4.320 3.005 2.352 3.822 . 0 0 "[ . 1 . 2]" 1
398 1 18 ASN HD21 1 105 LYS QE . . 5.280 3.827 3.030 5.337 0.057 9 0 "[ . 1 . 2]" 1
399 1 18 ASN HD22 1 89 THR HA . . 4.560 4.220 3.197 4.623 0.063 11 0 "[ . 1 . 2]" 1
400 1 18 ASN HD22 1 89 THR HB . . 4.370 4.066 3.317 4.442 0.072 14 0 "[ . 1 . 2]" 1
401 1 18 ASN HD22 1 89 THR MG . . 4.190 3.052 2.433 3.705 . 0 0 "[ . 1 . 2]" 1
402 1 18 ASN HD22 1 105 LYS QE . . 5.180 4.142 3.152 5.262 0.082 19 0 "[ . 1 . 2]" 1
403 1 19 ILE H 1 19 ILE HB . . 3.050 2.566 2.367 2.734 . 0 0 "[ . 1 . 2]" 1
404 1 19 ILE H 1 19 ILE MD . . 4.090 4.025 3.876 4.162 0.072 19 0 "[ . 1 . 2]" 1
405 1 19 ILE H 1 19 ILE HG12 . . 3.620 3.014 2.642 3.283 . 0 0 "[ . 1 . 2]" 1
406 1 19 ILE H 1 19 ILE MG . . 4.070 3.821 3.737 3.902 . 0 0 "[ . 1 . 2]" 1
407 1 19 ILE H 1 20 TYR H . . 4.540 4.350 4.062 4.531 . 0 0 "[ . 1 . 2]" 1
408 1 19 ILE H 1 105 LYS HA . . 4.970 4.813 4.548 5.026 0.056 11 0 "[ . 1 . 2]" 1
409 1 19 ILE H 1 105 LYS QE . . 4.730 3.832 2.972 4.813 0.083 1 0 "[ . 1 . 2]" 1
410 1 19 ILE H 1 106 VAL H . . 4.620 4.113 3.676 4.464 . 0 0 "[ . 1 . 2]" 1
411 1 19 ILE HA 1 19 ILE MD . . 3.750 2.208 2.027 2.357 . 0 0 "[ . 1 . 2]" 1
412 1 19 ILE HA 1 19 ILE HG12 . . 3.620 3.006 2.848 3.151 . 0 0 "[ . 1 . 2]" 1
413 1 19 ILE HA 1 19 ILE MG . . 3.140 2.460 2.342 2.553 . 0 0 "[ . 1 . 2]" 1
414 1 19 ILE HA 1 20 TYR H . . 2.980 2.169 2.092 2.250 . 0 0 "[ . 1 . 2]" 1
415 1 19 ILE HB 1 20 TYR H . . 4.350 4.177 4.036 4.398 0.048 1 0 "[ . 1 . 2]" 1
416 1 19 ILE HB 1 20 TYR HA . . 5.500 4.894 4.766 5.131 . 0 0 "[ . 1 . 2]" 1
417 1 19 ILE HB 1 106 VAL H . . 4.280 3.789 3.544 4.053 . 0 0 "[ . 1 . 2]" 1
418 1 19 ILE HB 1 106 VAL HA . . 5.500 5.542 5.483 5.575 0.075 12 0 "[ . 1 . 2]" 1
419 1 19 ILE HB 1 107 GLY H . . 5.500 5.280 4.890 5.574 0.074 4 0 "[ . 1 . 2]" 1
420 1 19 ILE MD 1 20 TYR H . . 4.280 3.673 3.375 3.924 . 0 0 "[ . 1 . 2]" 1
421 1 19 ILE HG12 1 19 ILE MG . . 3.350 3.225 3.195 3.248 . 0 0 "[ . 1 . 2]" 1
422 1 19 ILE HG12 1 20 TYR H . . 5.140 5.026 4.804 5.166 0.026 4 0 "[ . 1 . 2]" 1
423 1 19 ILE MG 1 20 TYR H . . 3.240 2.594 2.342 2.948 . 0 0 "[ . 1 . 2]" 1
424 1 19 ILE MG 1 20 TYR HA . . 4.080 3.627 3.484 3.848 . 0 0 "[ . 1 . 2]" 1
425 1 19 ILE MG 1 20 TYR QB . . 5.340 4.439 4.201 4.803 . 0 0 "[ . 1 . 2]" 1
426 1 19 ILE MG 1 20 TYR QD . . 4.920 4.590 4.212 5.000 0.080 19 0 "[ . 1 . 2]" 1
427 1 19 ILE MG 1 105 LYS HA . . 5.500 4.829 4.598 5.019 . 0 0 "[ . 1 . 2]" 1
428 1 19 ILE MG 1 106 VAL H . . 3.550 3.442 3.076 3.636 0.086 12 0 "[ . 1 . 2]" 1
429 1 19 ILE MG 1 106 VAL HB . . 4.600 3.589 2.279 4.428 . 0 0 "[ . 1 . 2]" 1
430 1 20 TYR H 1 20 TYR QB . . 3.360 2.739 2.585 2.903 . 0 0 "[ . 1 . 2]" 1
431 1 20 TYR H 1 20 TYR HB3 . . 4.010 3.838 3.745 3.934 . 0 0 "[ . 1 . 2]" 1
432 1 20 TYR H 1 20 TYR QD . . 4.670 2.906 2.260 3.633 . 0 0 "[ . 1 . 2]" 1
433 1 20 TYR H 1 21 SER H . . 4.600 4.442 4.299 4.545 . 0 0 "[ . 1 . 2]" 1
434 1 20 TYR H 1 21 SER HA . . 5.500 4.890 4.753 5.078 . 0 0 "[ . 1 . 2]" 1
435 1 20 TYR H 1 92 PHE QE . . 5.090 5.128 4.991 5.175 0.085 10 0 "[ . 1 . 2]" 1
436 1 20 TYR H 1 103 ALA MB . . 5.500 5.548 5.310 5.599 0.099 5 0 "[ . 1 . 2]" 1
437 1 20 TYR H 1 105 LYS HA . . 4.750 4.643 4.517 4.797 0.047 16 0 "[ . 1 . 2]" 1
438 1 20 TYR H 1 106 VAL H . . 4.770 4.458 4.200 4.717 . 0 0 "[ . 1 . 2]" 1
439 1 20 TYR HA 1 21 SER H . . 2.910 2.329 2.129 2.457 . 0 0 "[ . 1 . 2]" 1
440 1 20 TYR HA 1 103 ALA MB . . 4.500 4.527 4.260 4.585 0.085 18 0 "[ . 1 . 2]" 1
441 1 20 TYR HA 1 105 LYS HA . . 3.200 2.122 1.960 2.285 . 0 0 "[ . 1 . 2]" 1
442 1 20 TYR HA 1 105 LYS QB . . 4.990 4.206 4.038 4.312 . 0 0 "[ . 1 . 2]" 1
443 1 20 TYR HA 1 106 VAL H . . 3.310 2.530 2.072 2.972 . 0 0 "[ . 1 . 2]" 1
444 1 20 TYR HA 1 106 VAL HB . . 4.550 3.865 3.450 4.513 . 0 0 "[ . 1 . 2]" 1
445 1 20 TYR HA 1 106 VAL QG . . 4.260 3.110 2.537 3.892 . 0 0 "[ . 1 . 2]" 1
446 1 20 TYR QB 1 21 SER HA . . 5.340 4.124 3.900 4.297 . 0 0 "[ . 1 . 2]" 1
447 1 20 TYR QB 1 92 PHE H . . 5.340 5.248 4.908 5.390 0.050 19 0 "[ . 1 . 2]" 1
448 1 20 TYR QB 1 92 PHE QE . . 4.570 2.331 2.043 2.875 . 0 0 "[ . 1 . 2]" 1
449 1 20 TYR QB 1 103 ALA HA . . 5.340 4.644 4.289 4.871 . 0 0 "[ . 1 . 2]" 1
450 1 20 TYR QB 1 103 ALA MB . . 3.380 2.674 2.502 2.790 . 0 0 "[ . 1 . 2]" 1
451 1 20 TYR QB 1 104 THR H . . 4.070 3.817 3.568 4.106 0.036 14 0 "[ . 1 . 2]" 1
452 1 20 TYR QB 1 105 LYS H . . 4.540 4.359 4.009 4.589 0.049 14 0 "[ . 1 . 2]" 1
453 1 20 TYR QB 1 105 LYS HA . . 5.110 3.280 2.991 3.549 . 0 0 "[ . 1 . 2]" 1
454 1 20 TYR QB 1 106 VAL QG . . 5.280 4.365 3.898 4.777 . 0 0 "[ . 1 . 2]" 1
455 1 20 TYR HB3 1 21 SER H . . 3.760 2.750 2.256 3.149 . 0 0 "[ . 1 . 2]" 1
456 1 20 TYR HB3 1 103 ALA MB . . 3.910 2.815 2.609 2.981 . 0 0 "[ . 1 . 2]" 1
457 1 20 TYR QD 1 88 LEU QD . . 5.250 4.831 4.346 5.296 0.046 8 0 "[ . 1 . 2]" 1
458 1 20 TYR QD 1 92 PHE QD . . 3.990 3.761 3.279 4.081 0.091 19 0 "[ . 1 . 2]" 1
459 1 20 TYR QD 1 92 PHE QE . . 3.700 2.751 2.300 3.061 . 0 0 "[ . 1 . 2]" 1
460 1 20 TYR QD 1 103 ALA MB . . 4.200 4.117 3.800 4.302 0.102 3 0 "[ . 1 . 2]" 1
461 1 21 SER H 1 21 SER HB2 . . 3.730 3.251 3.006 3.645 . 0 0 "[ . 1 . 2]" 1
462 1 21 SER H 1 22 ILE MD . . 5.500 5.564 5.134 5.603 0.103 15 0 "[ . 1 . 2]" 1
463 1 21 SER H 1 103 ALA HA . . 4.970 4.420 4.157 4.628 . 0 0 "[ . 1 . 2]" 1
464 1 21 SER H 1 103 ALA MB . . 4.200 3.406 3.123 3.765 . 0 0 "[ . 1 . 2]" 1
465 1 21 SER H 1 104 THR H . . 3.450 2.919 2.669 3.170 . 0 0 "[ . 1 . 2]" 1
466 1 21 SER H 1 104 THR HB . . 4.910 4.899 4.650 4.977 0.067 4 0 "[ . 1 . 2]" 1
467 1 21 SER H 1 105 LYS H . . 4.790 4.848 4.713 4.869 0.079 20 0 "[ . 1 . 2]" 1
468 1 21 SER H 1 106 VAL HA . . 5.500 5.554 5.480 5.576 0.076 14 0 "[ . 1 . 2]" 1
469 1 21 SER HA 1 22 ILE H . . 3.100 2.285 2.104 2.419 . 0 0 "[ . 1 . 2]" 1
470 1 21 SER HA 1 104 THR H . . 4.970 4.864 4.695 4.992 0.022 2 0 "[ . 1 . 2]" 1
471 1 21 SER HB2 1 22 ILE H . . 4.020 3.978 3.647 4.080 0.060 11 0 "[ . 1 . 2]" 1
472 1 21 SER HB2 1 104 THR H . . 5.500 5.508 5.275 5.567 0.067 15 0 "[ . 1 . 2]" 1
473 1 22 ILE H 1 22 ILE HB . . 3.440 2.503 2.370 2.743 . 0 0 "[ . 1 . 2]" 1
474 1 22 ILE H 1 22 ILE MD . . 3.580 3.053 2.673 3.346 . 0 0 "[ . 1 . 2]" 1
475 1 22 ILE H 1 22 ILE QG . . 3.530 2.780 2.518 2.952 . 0 0 "[ . 1 . 2]" 1
476 1 22 ILE H 1 22 ILE MG . . 3.930 3.837 3.778 3.897 . 0 0 "[ . 1 . 2]" 1
477 1 22 ILE H 1 23 SER H . . 4.430 4.363 4.151 4.461 0.031 13 0 "[ . 1 . 2]" 1
478 1 22 ILE H 1 75 TRP HH2 . . 4.760 4.452 4.050 4.819 0.059 20 0 "[ . 1 . 2]" 1
479 1 22 ILE H 1 75 TRP HZ3 . . 4.520 3.995 3.655 4.500 . 0 0 "[ . 1 . 2]" 1
480 1 22 ILE H 1 103 ALA HA . . 5.440 4.675 4.402 4.947 . 0 0 "[ . 1 . 2]" 1
481 1 22 ILE H 1 103 ALA MB . . 4.370 4.188 3.947 4.432 0.062 5 0 "[ . 1 . 2]" 1
482 1 22 ILE HA 1 22 ILE MD . . 4.130 3.905 3.819 3.957 . 0 0 "[ . 1 . 2]" 1
483 1 22 ILE HA 1 22 ILE QG . . 3.980 2.545 2.450 2.647 . 0 0 "[ . 1 . 2]" 1
484 1 22 ILE HA 1 22 ILE MG . . 3.320 2.430 2.219 2.507 . 0 0 "[ . 1 . 2]" 1
485 1 22 ILE HA 1 23 SER H . . 2.970 2.112 2.019 2.227 . 0 0 "[ . 1 . 2]" 1
486 1 22 ILE HA 1 103 ALA H . . 5.060 4.906 4.702 5.110 0.050 18 0 "[ . 1 . 2]" 1
487 1 22 ILE HA 1 103 ALA HA . . 3.370 2.233 2.092 2.481 . 0 0 "[ . 1 . 2]" 1
488 1 22 ILE HA 1 103 ALA MB . . 3.540 3.074 2.948 3.230 . 0 0 "[ . 1 . 2]" 1
489 1 22 ILE HA 1 104 THR H . . 3.760 3.490 3.350 3.627 . 0 0 "[ . 1 . 2]" 1
490 1 22 ILE HB 1 22 ILE MD . . 3.460 2.182 2.015 2.230 . 0 0 "[ . 1 . 2]" 1
491 1 22 ILE HB 1 23 SER H . . 4.750 4.183 4.019 4.317 . 0 0 "[ . 1 . 2]" 1
492 1 22 ILE HB 1 75 TRP HH2 . . 3.930 2.660 2.416 2.876 . 0 0 "[ . 1 . 2]" 1
493 1 22 ILE HB 1 75 TRP HZ2 . . 5.160 4.949 4.604 5.222 0.062 19 0 "[ . 1 . 2]" 1
494 1 22 ILE HB 1 75 TRP HZ3 . . 4.040 2.383 2.135 2.823 . 0 0 "[ . 1 . 2]" 1
495 1 22 ILE HB 1 103 ALA HA . . 5.500 4.967 4.767 5.225 . 0 0 "[ . 1 . 2]" 1
496 1 22 ILE MD 1 22 ILE MG . . 2.930 2.444 2.261 2.786 . 0 0 "[ . 1 . 2]" 1
497 1 22 ILE MD 1 45 PHE QE . . 5.400 5.342 5.130 5.503 0.103 6 0 "[ . 1 . 2]" 1
498 1 22 ILE MD 1 75 TRP HE3 . . 3.900 3.274 3.044 3.627 . 0 0 "[ . 1 . 2]" 1
499 1 22 ILE MD 1 75 TRP HH2 . . 4.050 3.793 3.425 4.124 0.074 16 0 "[ . 1 . 2]" 1
500 1 22 ILE MD 1 75 TRP HZ3 . . 3.360 2.266 2.036 2.631 . 0 0 "[ . 1 . 2]" 1
501 1 22 ILE MD 1 94 VAL QG . . 2.840 2.265 2.034 2.539 . 0 0 "[ . 1 . 2]" 1
502 1 22 ILE MD 1 96 ILE MD . . 3.390 2.850 2.588 3.174 . 0 0 "[ . 1 . 2]" 1
503 1 22 ILE MD 1 96 ILE MG . . 4.380 3.842 3.523 4.425 0.045 2 0 "[ . 1 . 2]" 1
504 1 22 ILE MD 1 103 ALA HA . . 5.070 4.794 4.570 5.062 . 0 0 "[ . 1 . 2]" 1
505 1 22 ILE MD 1 103 ALA MB . . 3.590 3.231 3.041 3.468 . 0 0 "[ . 1 . 2]" 1
506 1 22 ILE QG 1 94 VAL QG . . 4.150 2.126 1.898 2.306 . 0 0 "[ . 1 . 2]" 1
507 1 22 ILE QG 1 101 LYS QB . . 5.340 3.721 3.286 4.131 . 0 0 "[ . 1 . 2]" 1
508 1 22 ILE QG 1 103 ALA HA . . 4.410 3.125 2.869 3.424 . 0 0 "[ . 1 . 2]" 1
509 1 22 ILE QG 1 103 ALA MB . . 3.690 1.971 1.854 2.131 . 0 0 "[ . 1 . 2]" 1
510 1 22 ILE MG 1 23 SER H . . 3.310 2.817 2.525 3.039 . 0 0 "[ . 1 . 2]" 1
511 1 22 ILE MG 1 23 SER HA . . 4.420 3.979 3.629 4.164 . 0 0 "[ . 1 . 2]" 1
512 1 22 ILE MG 1 23 SER QB . . 4.570 4.308 4.145 4.495 . 0 0 "[ . 1 . 2]" 1
513 1 22 ILE MG 1 24 ASP HA . . 4.650 3.581 3.199 3.996 . 0 0 "[ . 1 . 2]" 1
514 1 22 ILE MG 1 25 THR H . . 4.180 4.184 3.979 4.266 0.086 12 0 "[ . 1 . 2]" 1
515 1 22 ILE MG 1 75 TRP HE3 . . 5.080 4.696 4.401 4.926 . 0 0 "[ . 1 . 2]" 1
516 1 22 ILE MG 1 75 TRP HH2 . . 3.610 2.729 2.303 3.364 . 0 0 "[ . 1 . 2]" 1
517 1 22 ILE MG 1 75 TRP HZ2 . . 4.210 3.948 3.521 4.284 0.074 3 0 "[ . 1 . 2]" 1
518 1 22 ILE MG 1 75 TRP HZ3 . . 3.800 3.386 3.106 3.788 . 0 0 "[ . 1 . 2]" 1
519 1 22 ILE MG 1 94 VAL QG . . 2.940 2.779 2.081 3.023 0.083 5 0 "[ . 1 . 2]" 1
520 1 22 ILE MG 1 96 ILE MD . . 4.220 4.024 3.706 4.297 0.077 15 0 "[ . 1 . 2]" 1
521 1 22 ILE MG 1 96 ILE MG . . 4.090 3.596 3.156 3.845 . 0 0 "[ . 1 . 2]" 1
522 1 22 ILE MG 1 101 LYS HA . . 4.590 4.457 4.155 4.682 0.092 4 0 "[ . 1 . 2]" 1
523 1 22 ILE MG 1 101 LYS QB . . 3.380 2.266 1.990 2.523 . 0 0 "[ . 1 . 2]" 1
524 1 22 ILE MG 1 101 LYS HB3 . . 4.180 2.513 2.165 2.752 . 0 0 "[ . 1 . 2]" 1
525 1 22 ILE MG 1 103 ALA HA . . 4.020 3.496 3.292 3.842 . 0 0 "[ . 1 . 2]" 1
526 1 22 ILE MG 1 103 ALA MB . . 3.560 3.329 3.004 3.632 0.072 4 0 "[ . 1 . 2]" 1
527 1 23 SER H 1 23 SER QB . . 3.190 2.400 2.267 2.609 . 0 0 "[ . 1 . 2]" 1
528 1 23 SER H 1 24 ASP H . . 4.080 3.577 3.087 4.070 . 0 0 "[ . 1 . 2]" 1
529 1 23 SER H 1 103 ALA HA . . 3.580 3.446 3.295 3.618 0.038 2 0 "[ . 1 . 2]" 1
530 1 23 SER H 1 103 ALA MB . . 4.560 4.623 4.487 4.660 0.100 3 0 "[ . 1 . 2]" 1
531 1 23 SER H 1 104 THR H . . 4.370 4.432 4.313 4.448 0.078 4 0 "[ . 1 . 2]" 1
532 1 23 SER QB 1 24 ASP H . . 2.810 2.092 1.808 2.513 . 0 0 "[ . 1 . 2]" 1
533 1 23 SER QB 1 103 ALA HA . . 5.230 4.934 4.691 5.224 . 0 0 "[ . 1 . 2]" 1
534 1 23 SER QB 1 104 THR H . . 5.340 5.118 4.850 5.359 0.019 16 0 "[ . 1 . 2]" 1
535 1 23 SER HB3 1 24 ASP H . . 3.550 2.122 1.820 2.565 . 0 0 "[ . 1 . 2]" 1
536 1 24 ASP H 1 24 ASP HA . . 2.900 2.871 2.825 2.942 0.042 6 0 "[ . 1 . 2]" 1
537 1 24 ASP H 1 24 ASP HB3 . . 3.460 3.145 2.928 3.415 . 0 0 "[ . 1 . 2]" 1
538 1 24 ASP H 1 25 THR H . . 3.430 3.478 3.385 3.504 0.074 10 0 "[ . 1 . 2]" 1
539 1 24 ASP H 1 25 THR HB . . 4.400 4.348 4.017 4.467 0.067 19 0 "[ . 1 . 2]" 1
540 1 24 ASP H 1 25 THR MG . . 5.250 5.268 5.126 5.330 0.080 14 0 "[ . 1 . 2]" 1
541 1 24 ASP H 1 102 LEU QB . . 5.280 5.122 4.716 5.352 0.072 16 0 "[ . 1 . 2]" 1
542 1 24 ASP HA 1 25 THR H . . 3.190 2.142 1.977 2.255 . 0 0 "[ . 1 . 2]" 1
543 1 24 ASP HA 1 101 LYS QB . . 4.750 3.385 3.062 3.659 . 0 0 "[ . 1 . 2]" 1
544 1 24 ASP QB 1 25 THR H . . 4.130 3.895 3.578 4.017 . 0 0 "[ . 1 . 2]" 1
545 1 24 ASP HB3 1 25 THR H . . 4.860 4.395 4.317 4.515 . 0 0 "[ . 1 . 2]" 1
546 1 25 THR H 1 25 THR HB . . 3.370 2.706 2.585 2.884 . 0 0 "[ . 1 . 2]" 1
547 1 25 THR H 1 25 THR MG . . 3.830 3.836 3.669 3.900 0.070 7 0 "[ . 1 . 2]" 1
548 1 25 THR H 1 26 THR H . . 3.890 3.952 3.912 3.971 0.081 20 0 "[ . 1 . 2]" 1
549 1 25 THR H 1 101 LYS QB . . 4.170 3.058 2.443 3.491 . 0 0 "[ . 1 . 2]" 1
550 1 25 THR H 1 102 LEU H . . 4.080 2.954 2.749 3.134 . 0 0 "[ . 1 . 2]" 1
551 1 25 THR H 1 102 LEU QB . . 3.990 3.775 3.479 4.140 0.150 2 0 "[ . 1 . 2]" 1
552 1 25 THR HA 1 25 THR MG . . 2.820 2.507 2.418 2.711 . 0 0 "[ . 1 . 2]" 1
553 1 25 THR HA 1 26 THR H . . 2.460 2.236 2.067 2.318 . 0 0 "[ . 1 . 2]" 1
554 1 25 THR HA 1 26 THR HB . . 5.290 4.826 4.529 5.024 . 0 0 "[ . 1 . 2]" 1
555 1 25 THR HB 1 102 LEU H . . 3.440 2.660 2.118 3.408 . 0 0 "[ . 1 . 2]" 1
556 1 25 THR HB 1 102 LEU QD . . 3.350 3.420 3.341 3.459 0.109 9 0 "[ . 1 . 2]" 1
557 1 25 THR MG 1 26 THR H . . 3.310 3.159 2.854 3.344 0.034 7 0 "[ . 1 . 2]" 1
558 1 25 THR MG 1 26 THR HA . . 4.400 4.264 4.037 4.373 . 0 0 "[ . 1 . 2]" 1
559 1 25 THR MG 1 27 VAL H . . 4.330 4.393 4.113 4.427 0.097 6 0 "[ . 1 . 2]" 1
560 1 25 THR MG 1 28 SER H . . 5.320 5.187 4.889 5.415 0.095 9 0 "[ . 1 . 2]" 1
561 1 25 THR MG 1 102 LEU H . . 3.660 3.453 2.956 3.711 0.051 18 0 "[ . 1 . 2]" 1
562 1 26 THR H 1 26 THR HB . . 2.880 2.634 2.433 2.806 . 0 0 "[ . 1 . 2]" 1
563 1 26 THR H 1 26 THR MG . . 3.760 3.760 3.705 3.825 0.065 13 0 "[ . 1 . 2]" 1
564 1 26 THR H 1 27 VAL H . . 4.600 4.556 4.429 4.633 0.033 12 0 "[ . 1 . 2]" 1
565 1 26 THR H 1 27 VAL QG . . 4.980 4.775 4.637 4.915 . 0 0 "[ . 1 . 2]" 1
566 1 26 THR H 1 101 LYS HA . . 5.070 5.080 4.904 5.137 0.067 20 0 "[ . 1 . 2]" 1
567 1 26 THR H 1 102 LEU H . . 5.160 5.172 4.963 5.230 0.070 7 0 "[ . 1 . 2]" 1
568 1 26 THR HA 1 26 THR MG . . 2.960 2.361 2.165 2.544 . 0 0 "[ . 1 . 2]" 1
569 1 26 THR HA 1 27 VAL H . . 3.270 2.248 2.146 2.343 . 0 0 "[ . 1 . 2]" 1
570 1 26 THR HA 1 27 VAL HB . . 4.880 4.713 4.315 4.914 0.034 20 0 "[ . 1 . 2]" 1
571 1 26 THR HA 1 27 VAL QG . . 3.840 3.644 3.464 3.903 0.063 8 0 "[ . 1 . 2]" 1
572 1 26 THR HA 1 99 ASP QB . . 5.000 4.515 4.063 4.940 . 0 0 "[ . 1 . 2]" 1
573 1 26 THR HA 1 101 LYS HA . . 5.270 3.218 2.819 3.585 . 0 0 "[ . 1 . 2]" 1
574 1 26 THR HA 1 102 LEU H . . 4.620 4.421 4.007 4.711 0.091 2 0 "[ . 1 . 2]" 1
575 1 26 THR HA 1 102 LEU QB . . 5.460 5.195 4.853 5.534 0.074 2 0 "[ . 1 . 2]" 1
576 1 26 THR HB 1 27 VAL H . . 4.170 4.175 3.917 4.238 0.068 3 0 "[ . 1 . 2]" 1
577 1 26 THR MG 1 27 VAL H . . 3.010 2.921 2.615 3.063 0.053 16 0 "[ . 1 . 2]" 1
578 1 26 THR MG 1 28 SER H . . 4.650 4.552 4.272 4.723 0.073 9 0 "[ . 1 . 2]" 1
579 1 26 THR MG 1 28 SER HA . . 4.120 4.042 3.472 4.198 0.078 9 0 "[ . 1 . 2]" 1
580 1 26 THR MG 1 99 ASP QB . . 3.770 3.630 2.540 3.881 0.111 12 0 "[ . 1 . 2]" 1
581 1 26 THR MG 1 100 PHE H . . 4.810 4.483 3.862 4.892 0.082 16 0 "[ . 1 . 2]" 1
582 1 27 VAL H 1 27 VAL HB . . 3.130 2.518 2.234 2.639 . 0 0 "[ . 1 . 2]" 1
583 1 27 VAL H 1 27 VAL QG . . 3.060 2.425 2.251 2.731 . 0 0 "[ . 1 . 2]" 1
584 1 27 VAL H 1 28 SER H . . 4.500 4.392 4.265 4.494 . 0 0 "[ . 1 . 2]" 1
585 1 27 VAL H 1 28 SER HA . . 5.120 5.038 4.920 5.161 0.041 19 0 "[ . 1 . 2]" 1
586 1 27 VAL H 1 32 LEU QD . . 5.160 4.831 4.456 5.130 . 0 0 "[ . 1 . 2]" 1
587 1 27 VAL H 1 100 PHE H . . 5.000 4.637 4.388 4.859 . 0 0 "[ . 1 . 2]" 1
588 1 27 VAL H 1 100 PHE HA . . 5.370 5.066 4.889 5.287 . 0 0 "[ . 1 . 2]" 1
589 1 27 VAL H 1 100 PHE HB2 . . 4.590 3.875 3.646 4.077 . 0 0 "[ . 1 . 2]" 1
590 1 27 VAL H 1 100 PHE HB3 . . 4.050 3.844 3.562 3.959 . 0 0 "[ . 1 . 2]" 1
591 1 27 VAL H 1 100 PHE QD . . 5.500 5.527 5.314 5.606 0.106 2 0 "[ . 1 . 2]" 1
592 1 27 VAL H 1 101 LYS H . . 5.190 4.912 4.750 5.160 . 0 0 "[ . 1 . 2]" 1
593 1 27 VAL H 1 101 LYS HA . . 3.580 3.260 3.009 3.432 . 0 0 "[ . 1 . 2]" 1
594 1 27 VAL H 1 101 LYS QB . . 5.340 5.246 5.001 5.403 0.063 5 0 "[ . 1 . 2]" 1
595 1 27 VAL H 1 102 LEU H . . 4.390 4.405 4.262 4.451 0.061 7 0 "[ . 1 . 2]" 1
596 1 27 VAL HA 1 27 VAL MG1 . . 3.280 2.388 2.259 2.626 . 0 0 "[ . 1 . 2]" 1
597 1 27 VAL HA 1 27 VAL MG2 . . 3.280 2.427 2.292 2.502 . 0 0 "[ . 1 . 2]" 1
598 1 27 VAL HA 1 28 SER H . . 2.530 2.194 2.114 2.277 . 0 0 "[ . 1 . 2]" 1
599 1 27 VAL HA 1 31 GLU QB . . 3.950 3.726 3.189 4.016 0.066 13 0 "[ . 1 . 2]" 1
600 1 27 VAL HA 1 32 LEU QD . . 4.920 4.773 4.162 4.988 0.068 12 0 "[ . 1 . 2]" 1
601 1 27 VAL HB 1 28 SER H . . 4.420 4.345 3.949 4.450 0.030 18 0 "[ . 1 . 2]" 1
602 1 27 VAL HB 1 32 LEU QD . . 3.820 3.077 2.659 3.681 . 0 0 "[ . 1 . 2]" 1
603 1 27 VAL HB 1 93 ALA HA . . 4.780 4.541 4.248 4.781 0.001 2 0 "[ . 1 . 2]" 1
604 1 27 VAL HB 1 93 ALA MB . . 5.500 2.990 2.742 3.356 . 0 0 "[ . 1 . 2]" 1
605 1 27 VAL HB 1 100 PHE H . . 5.050 4.944 4.621 5.117 0.067 6 0 "[ . 1 . 2]" 1
606 1 27 VAL HB 1 100 PHE HB2 . . 3.920 3.099 2.860 3.267 . 0 0 "[ . 1 . 2]" 1
607 1 27 VAL HB 1 100 PHE HB3 . . 3.680 2.376 2.229 2.477 . 0 0 "[ . 1 . 2]" 1
608 1 27 VAL HB 1 100 PHE QD . . 4.230 4.202 4.034 4.289 0.059 17 0 "[ . 1 . 2]" 1
609 1 27 VAL QG 1 28 SER H . . 3.110 2.913 2.420 3.121 0.011 18 0 "[ . 1 . 2]" 1
610 1 27 VAL QG 1 28 SER HB2 . . 4.730 4.405 4.200 4.547 . 0 0 "[ . 1 . 2]" 1
611 1 27 VAL QG 1 29 ASP HA . . 5.440 4.483 4.197 4.784 . 0 0 "[ . 1 . 2]" 1
612 1 27 VAL QG 1 30 GLU H . . 5.440 5.347 5.105 5.509 0.069 15 0 "[ . 1 . 2]" 1
613 1 27 VAL QG 1 31 GLU H . . 4.050 3.857 3.668 4.018 . 0 0 "[ . 1 . 2]" 1
614 1 27 VAL QG 1 31 GLU QB . . 3.780 2.330 1.984 2.702 . 0 0 "[ . 1 . 2]" 1
615 1 27 VAL QG 1 31 GLU QG . . 3.910 3.713 3.185 3.988 0.078 8 0 "[ . 1 . 2]" 1
616 1 27 VAL QG 1 32 LEU H . . 3.530 3.301 3.103 3.525 . 0 0 "[ . 1 . 2]" 1
617 1 27 VAL QG 1 32 LEU HA . . 3.490 3.079 2.898 3.369 . 0 0 "[ . 1 . 2]" 1
618 1 27 VAL QG 1 32 LEU HB2 . . 5.440 3.360 2.635 4.181 . 0 0 "[ . 1 . 2]" 1
619 1 27 VAL QG 1 32 LEU QD . . 3.250 2.223 1.921 2.763 . 0 0 "[ . 1 . 2]" 1
620 1 27 VAL QG 1 32 LEU HG . . 4.260 3.547 2.064 4.351 0.091 10 0 "[ . 1 . 2]" 1
621 1 27 VAL QG 1 33 GLY H . . 4.730 4.660 4.405 4.827 0.097 8 0 "[ . 1 . 2]" 1
622 1 27 VAL QG 1 93 ALA HA . . 3.430 2.699 2.435 2.890 . 0 0 "[ . 1 . 2]" 1
623 1 27 VAL QG 1 93 ALA MB . . 2.740 2.033 1.908 2.127 . 0 0 "[ . 1 . 2]" 1
624 1 27 VAL QG 1 94 VAL H . . 3.900 3.793 3.611 3.963 0.063 7 0 "[ . 1 . 2]" 1
625 1 27 VAL QG 1 100 PHE HB2 . . 4.550 3.773 3.018 3.972 . 0 0 "[ . 1 . 2]" 1
626 1 27 VAL QG 1 100 PHE HB3 . . 4.060 3.027 2.610 3.189 . 0 0 "[ . 1 . 2]" 1
627 1 27 VAL QG 1 101 LYS H . . 4.030 3.913 3.753 4.089 0.059 1 0 "[ . 1 . 2]" 1
628 1 27 VAL QG 1 101 LYS HA . . 3.490 2.633 2.443 2.793 . 0 0 "[ . 1 . 2]" 1
629 1 27 VAL QG 1 102 LEU H . . 3.140 2.574 2.428 2.729 . 0 0 "[ . 1 . 2]" 1
630 1 27 VAL QG 1 102 LEU HA . . 3.370 2.614 2.484 2.795 . 0 0 "[ . 1 . 2]" 1
631 1 27 VAL QG 1 102 LEU QB . . 3.550 2.200 2.073 2.348 . 0 0 "[ . 1 . 2]" 1
632 1 27 VAL QG 1 103 ALA H . . 5.440 4.280 4.140 4.454 . 0 0 "[ . 1 . 2]" 1
633 1 27 VAL MG1 1 28 SER H . . 4.260 2.975 2.445 3.211 . 0 0 "[ . 1 . 2]" 1
634 1 27 VAL MG1 1 31 GLU QB . . 4.670 2.343 1.989 2.721 . 0 0 "[ . 1 . 2]" 1
635 1 27 VAL MG1 1 93 ALA MB . . 3.620 2.175 2.046 2.473 . 0 0 "[ . 1 . 2]" 1
636 1 27 VAL MG2 1 28 SER H . . 4.260 4.186 3.715 4.306 0.046 14 0 "[ . 1 . 2]" 1
637 1 27 VAL MG2 1 31 GLU QB . . 4.670 4.160 3.578 4.589 . 0 0 "[ . 1 . 2]" 1
638 1 27 VAL MG2 1 93 ALA MB . . 3.620 2.463 2.214 2.633 . 0 0 "[ . 1 . 2]" 1
639 1 28 SER H 1 28 SER HB2 . . 3.160 2.436 2.219 2.532 . 0 0 "[ . 1 . 2]" 1
640 1 28 SER H 1 29 ASP H . . 4.650 4.595 4.502 4.661 0.011 6 0 "[ . 1 . 2]" 1
641 1 28 SER H 1 30 GLU H . . 4.920 4.905 4.655 4.991 0.071 13 0 "[ . 1 . 2]" 1
642 1 28 SER H 1 31 GLU H . . 4.190 4.104 3.554 4.247 0.057 14 0 "[ . 1 . 2]" 1
643 1 28 SER H 1 31 GLU QB . . 3.410 3.109 2.688 3.413 0.003 2 0 "[ . 1 . 2]" 1
644 1 28 SER H 1 31 GLU QG . . 3.460 3.285 2.724 3.519 0.059 17 0 "[ . 1 . 2]" 1
645 1 28 SER H 1 32 LEU H . . 4.970 4.885 4.351 5.026 0.056 11 0 "[ . 1 . 2]" 1
646 1 28 SER H 1 32 LEU QD . . 5.020 4.834 4.180 5.089 0.069 17 0 "[ . 1 . 2]" 1
647 1 28 SER HA 1 29 ASP H . . 2.590 2.357 2.203 2.489 . 0 0 "[ . 1 . 2]" 1
648 1 28 SER HA 1 29 ASP QB . . 4.530 4.251 3.928 4.602 0.072 11 0 "[ . 1 . 2]" 1
649 1 28 SER HA 1 30 GLU H . . 4.490 4.164 3.979 4.258 . 0 0 "[ . 1 . 2]" 1
650 1 28 SER HA 1 31 GLU H . . 4.840 4.751 4.673 4.828 . 0 0 "[ . 1 . 2]" 1
651 1 28 SER HA 1 32 LEU QD . . 4.710 4.435 3.732 4.816 0.106 18 0 "[ . 1 . 2]" 1
652 1 28 SER HB2 1 29 ASP QB . . 5.090 5.069 4.919 5.168 0.078 3 0 "[ . 1 . 2]" 1
653 1 28 SER HB2 1 30 GLU H . . 5.500 3.104 2.876 3.393 . 0 0 "[ . 1 . 2]" 1
654 1 28 SER HB2 1 30 GLU QB . . 4.280 4.245 3.920 4.358 0.078 12 0 "[ . 1 . 2]" 1
655 1 28 SER HB2 1 30 GLU QG . . 4.640 2.183 2.065 2.471 . 0 0 "[ . 1 . 2]" 1
656 1 28 SER HB2 1 31 GLU H . . 3.860 3.309 2.921 3.705 . 0 0 "[ . 1 . 2]" 1
657 1 28 SER HB2 1 31 GLU QG . . 4.190 2.768 2.129 3.127 . 0 0 "[ . 1 . 2]" 1
658 1 29 ASP H 1 29 ASP HA . . 2.880 2.801 2.735 2.842 . 0 0 "[ . 1 . 2]" 1
659 1 29 ASP H 1 29 ASP QB . . 2.740 2.193 2.017 2.399 . 0 0 "[ . 1 . 2]" 1
660 1 29 ASP H 1 30 GLU H . . 3.140 2.736 2.525 2.837 . 0 0 "[ . 1 . 2]" 1
661 1 29 ASP H 1 30 GLU QB . . 4.940 4.807 4.540 4.995 0.055 8 0 "[ . 1 . 2]" 1
662 1 29 ASP H 1 30 GLU QG . . 4.680 4.155 3.758 4.619 . 0 0 "[ . 1 . 2]" 1
663 1 29 ASP H 1 31 GLU H . . 4.160 4.210 4.118 4.237 0.077 20 0 "[ . 1 . 2]" 1
664 1 29 ASP H 1 32 LEU H . . 4.980 4.692 4.547 4.808 . 0 0 "[ . 1 . 2]" 1
665 1 29 ASP H 1 32 LEU HB2 . . 4.670 4.558 4.317 4.738 0.068 8 0 "[ . 1 . 2]" 1
666 1 29 ASP H 1 32 LEU QD . . 4.750 4.226 3.397 4.828 0.078 5 0 "[ . 1 . 2]" 1
667 1 29 ASP HA 1 30 GLU QB . . 5.500 5.432 5.367 5.547 0.047 7 0 "[ . 1 . 2]" 1
668 1 29 ASP HA 1 30 GLU QG . . 5.500 5.138 4.950 5.444 . 0 0 "[ . 1 . 2]" 1
669 1 29 ASP HA 1 31 GLU H . . 5.500 3.752 3.548 4.071 . 0 0 "[ . 1 . 2]" 1
670 1 29 ASP HA 1 32 LEU H . . 3.640 3.063 2.895 3.313 . 0 0 "[ . 1 . 2]" 1
671 1 29 ASP HA 1 32 LEU HA . . 5.270 4.853 4.600 5.023 . 0 0 "[ . 1 . 2]" 1
672 1 29 ASP HA 1 32 LEU HB2 . . 4.520 2.251 2.066 2.651 . 0 0 "[ . 1 . 2]" 1
673 1 29 ASP HA 1 32 LEU QD . . 3.390 2.730 2.103 3.434 0.044 5 0 "[ . 1 . 2]" 1
674 1 29 ASP HA 1 32 LEU HG . . 5.500 4.136 3.190 4.955 . 0 0 "[ . 1 . 2]" 1
675 1 29 ASP QB 1 30 GLU H . . 3.060 2.817 2.592 3.115 0.055 5 0 "[ . 1 . 2]" 1
676 1 29 ASP QB 1 30 GLU HA . . 3.960 3.996 3.923 4.045 0.085 19 0 "[ . 1 . 2]" 1
677 1 29 ASP QB 1 31 GLU H . . 4.670 4.553 4.373 4.643 . 0 0 "[ . 1 . 2]" 1
678 1 29 ASP QB 1 32 LEU H . . 4.760 4.709 4.466 4.830 0.070 20 0 "[ . 1 . 2]" 1
679 1 29 ASP QB 1 32 LEU QD . . 5.500 3.999 3.379 4.689 . 0 0 "[ . 1 . 2]" 1
680 1 30 GLU H 1 30 GLU HA . . 2.870 2.859 2.814 2.901 0.031 5 0 "[ . 1 . 2]" 1
681 1 30 GLU H 1 30 GLU QB . . 2.770 2.467 2.308 2.652 . 0 0 "[ . 1 . 2]" 1
682 1 30 GLU H 1 30 GLU QG . . 3.190 2.160 1.897 2.446 . 0 0 "[ . 1 . 2]" 1
683 1 30 GLU H 1 31 GLU H . . 3.130 2.599 2.482 2.729 . 0 0 "[ . 1 . 2]" 1
684 1 30 GLU H 1 31 GLU QG . . 4.050 4.057 3.657 4.138 0.088 4 0 "[ . 1 . 2]" 1
685 1 30 GLU H 1 32 LEU H . . 3.970 3.899 3.757 4.025 0.055 13 0 "[ . 1 . 2]" 1
686 1 30 GLU H 1 32 LEU HB2 . . 5.100 4.888 4.518 5.091 . 0 0 "[ . 1 . 2]" 1
687 1 30 GLU H 1 32 LEU QD . . 5.500 5.232 4.765 5.575 0.075 9 0 "[ . 1 . 2]" 1
688 1 30 GLU HA 1 30 GLU QB . . 2.590 2.172 2.154 2.202 . 0 0 "[ . 1 . 2]" 1
689 1 30 GLU HA 1 30 GLU QG . . 3.430 3.355 3.319 3.382 . 0 0 "[ . 1 . 2]" 1
690 1 30 GLU HA 1 31 GLU H . . 3.540 3.432 3.356 3.497 . 0 0 "[ . 1 . 2]" 1
691 1 30 GLU HA 1 32 LEU H . . 4.600 4.355 4.164 4.601 0.001 9 0 "[ . 1 . 2]" 1
692 1 30 GLU QB 1 31 GLU H . . 4.100 3.762 3.604 3.883 . 0 0 "[ . 1 . 2]" 1
693 1 30 GLU QG 1 31 GLU H . . 3.720 2.670 2.244 3.023 . 0 0 "[ . 1 . 2]" 1
694 1 30 GLU QG 1 32 LEU H . . 4.510 4.393 4.127 4.583 0.073 18 0 "[ . 1 . 2]" 1
695 1 31 GLU H 1 31 GLU QB . . 2.960 2.532 2.314 2.680 . 0 0 "[ . 1 . 2]" 1
696 1 31 GLU H 1 31 GLU QG . . 2.900 2.666 2.311 2.897 . 0 0 "[ . 1 . 2]" 1
697 1 31 GLU H 1 32 LEU H . . 2.860 1.953 1.751 2.082 . 0 0 "[ . 1 . 2]" 1
698 1 31 GLU H 1 32 LEU HA . . 4.760 4.660 4.494 4.794 0.034 1 0 "[ . 1 . 2]" 1
699 1 31 GLU H 1 32 LEU HB2 . . 3.980 3.816 3.517 4.019 0.039 8 0 "[ . 1 . 2]" 1
700 1 31 GLU H 1 32 LEU QD . . 4.860 4.538 3.784 4.822 . 0 0 "[ . 1 . 2]" 1
701 1 31 GLU H 1 84 ARG HB2 . . 5.500 5.410 5.160 5.563 0.063 15 0 "[ . 1 . 2]" 1
702 1 31 GLU H 1 84 ARG QD . . 5.060 4.627 4.083 5.139 0.079 11 0 "[ . 1 . 2]" 1
703 1 31 GLU HA 1 32 LEU H . . 3.480 3.473 3.372 3.518 0.038 19 0 "[ . 1 . 2]" 1
704 1 31 GLU HA 1 84 ARG HB2 . . 3.290 2.766 2.481 3.096 . 0 0 "[ . 1 . 2]" 1
705 1 31 GLU HA 1 84 ARG QD . . 3.820 3.244 2.550 3.870 0.050 5 0 "[ . 1 . 2]" 1
706 1 31 GLU QB 1 32 LEU H . . 3.460 2.935 2.612 3.213 . 0 0 "[ . 1 . 2]" 1
707 1 31 GLU QB 1 32 LEU HA . . 4.130 3.986 3.816 4.180 0.050 11 0 "[ . 1 . 2]" 1
708 1 31 GLU QB 1 83 ILE MD . . 4.210 3.816 3.452 4.284 0.074 15 0 "[ . 1 . 2]" 1
709 1 31 GLU QB 1 83 ILE MG . . 3.460 2.612 2.173 2.968 . 0 0 "[ . 1 . 2]" 1
710 1 31 GLU QB 1 84 ARG H . . 5.010 4.028 3.625 4.264 . 0 0 "[ . 1 . 2]" 1
711 1 31 GLU QG 1 32 LEU H . . 4.120 4.095 3.854 4.192 0.072 6 0 "[ . 1 . 2]" 1
712 1 32 LEU H 1 32 LEU HB2 . . 2.690 2.190 2.053 2.345 . 0 0 "[ . 1 . 2]" 1
713 1 32 LEU H 1 32 LEU QD . . 3.500 3.395 2.687 3.606 0.106 3 0 "[ . 1 . 2]" 1
714 1 32 LEU H 1 32 LEU HG . . 5.370 3.968 2.777 4.561 . 0 0 "[ . 1 . 2]" 1
715 1 32 LEU H 1 33 GLY H . . 4.710 4.601 4.463 4.685 . 0 0 "[ . 1 . 2]" 1
716 1 32 LEU H 1 83 ILE MG . . 5.090 4.901 4.471 5.153 0.063 13 0 "[ . 1 . 2]" 1
717 1 32 LEU H 1 84 ARG H . . 5.220 4.894 4.721 5.155 . 0 0 "[ . 1 . 2]" 1
718 1 32 LEU H 1 84 ARG HB2 . . 5.220 5.164 4.887 5.292 0.072 11 0 "[ . 1 . 2]" 1
719 1 32 LEU H 1 84 ARG QD . . 4.670 4.378 3.732 4.764 0.094 3 0 "[ . 1 . 2]" 1
720 1 32 LEU HA 1 32 LEU HB2 . . 3.010 2.812 2.627 3.044 0.034 11 0 "[ . 1 . 2]" 1
721 1 32 LEU HA 1 32 LEU QD . . 2.910 2.100 1.971 2.284 . 0 0 "[ . 1 . 2]" 1
722 1 32 LEU HA 1 33 GLY H . . 2.980 2.218 2.104 2.363 . 0 0 "[ . 1 . 2]" 1
723 1 32 LEU HA 1 33 GLY HA2 . . 4.570 4.447 4.369 4.509 . 0 0 "[ . 1 . 2]" 1
724 1 32 LEU HA 1 33 GLY HA3 . . 4.560 4.373 4.286 4.425 . 0 0 "[ . 1 . 2]" 1
725 1 32 LEU HA 1 84 ARG H . . 4.440 3.973 3.578 4.495 0.055 11 0 "[ . 1 . 2]" 1
726 1 32 LEU HA 1 93 ALA MB . . 4.220 3.700 3.437 4.026 . 0 0 "[ . 1 . 2]" 1
727 1 32 LEU HB2 1 32 LEU QD . . 3.050 2.196 2.083 2.451 . 0 0 "[ . 1 . 2]" 1
728 1 32 LEU QD 1 33 GLY H . . 3.360 2.937 2.121 3.286 . 0 0 "[ . 1 . 2]" 1
729 1 32 LEU QD 1 33 GLY HA2 . . 5.140 4.926 3.857 5.226 0.086 13 0 "[ . 1 . 2]" 1
730 1 32 LEU QD 1 33 GLY HA3 . . 5.500 4.727 3.824 5.073 . 0 0 "[ . 1 . 2]" 1
731 1 32 LEU QD 1 81 HIS H . . 4.200 4.125 3.871 4.288 0.088 10 0 "[ . 1 . 2]" 1
732 1 32 LEU QD 1 81 HIS HA . . 4.860 4.389 4.062 4.836 . 0 0 "[ . 1 . 2]" 1
733 1 32 LEU QD 1 81 HIS QB . . 4.030 2.106 1.941 2.463 . 0 0 "[ . 1 . 2]" 1
734 1 32 LEU QD 1 81 HIS HD2 . . 4.680 4.299 4.027 4.644 . 0 0 "[ . 1 . 2]" 1
735 1 32 LEU QD 1 81 HIS HE1 . . 4.620 4.198 3.764 4.700 0.080 11 0 "[ . 1 . 2]" 1
736 1 32 LEU QD 1 82 SER H . . 5.150 4.414 3.886 5.022 . 0 0 "[ . 1 . 2]" 1
737 1 32 LEU QD 1 83 ILE HA . . 4.340 3.957 3.447 4.392 0.052 11 0 "[ . 1 . 2]" 1
738 1 32 LEU QD 1 83 ILE MD . . 4.720 3.955 3.628 4.308 . 0 0 "[ . 1 . 2]" 1
739 1 32 LEU QD 1 84 ARG H . . 5.500 5.170 4.802 5.588 0.088 11 0 "[ . 1 . 2]" 1
740 1 32 LEU QD 1 93 ALA H . . 4.550 4.332 4.103 4.584 0.034 10 0 "[ . 1 . 2]" 1
741 1 32 LEU QD 1 93 ALA HA . . 4.700 4.352 4.192 4.673 . 0 0 "[ . 1 . 2]" 1
742 1 32 LEU QD 1 93 ALA MB . . 2.840 2.104 1.964 2.477 . 0 0 "[ . 1 . 2]" 1
743 1 32 LEU QD 1 100 PHE H . . 4.970 4.664 4.111 5.063 0.093 16 0 "[ . 1 . 2]" 1
744 1 32 LEU QD 1 100 PHE HB2 . . 3.950 3.005 2.478 3.492 . 0 0 "[ . 1 . 2]" 1
745 1 32 LEU QD 1 100 PHE HB3 . . 3.820 2.868 2.436 3.215 . 0 0 "[ . 1 . 2]" 1
746 1 32 LEU QD 1 100 PHE QD . . 3.350 2.816 2.492 3.197 . 0 0 "[ . 1 . 2]" 1
747 1 32 LEU QD 1 100 PHE QE . . 3.570 3.221 2.875 3.498 . 0 0 "[ . 1 . 2]" 1
748 1 32 LEU QD 1 100 PHE HZ . . 4.000 3.923 3.641 4.089 0.089 14 0 "[ . 1 . 2]" 1
749 1 32 LEU HG 1 33 GLY H . . 5.500 3.706 2.267 5.049 . 0 0 "[ . 1 . 2]" 1
750 1 33 GLY H 1 34 GLU H . . 3.540 3.333 3.191 3.593 0.053 20 0 "[ . 1 . 2]" 1
751 1 33 GLY H 1 81 HIS QB . . 4.340 3.424 3.202 3.652 . 0 0 "[ . 1 . 2]" 1
752 1 33 GLY H 1 82 SER H . . 5.010 4.049 3.815 4.449 . 0 0 "[ . 1 . 2]" 1
753 1 33 GLY H 1 82 SER QB . . 4.500 4.165 3.598 4.569 0.069 10 0 "[ . 1 . 2]" 1
754 1 33 GLY H 1 83 ILE H . . 4.760 4.425 4.256 4.674 . 0 0 "[ . 1 . 2]" 1
755 1 33 GLY H 1 83 ILE HA . . 3.340 2.643 2.430 2.906 . 0 0 "[ . 1 . 2]" 1
756 1 33 GLY H 1 83 ILE MG . . 4.880 4.662 4.276 4.900 0.020 17 0 "[ . 1 . 2]" 1
757 1 33 GLY H 1 84 ARG H . . 4.040 3.851 3.619 4.090 0.050 11 0 "[ . 1 . 2]" 1
758 1 33 GLY H 1 84 ARG HB2 . . 5.500 5.527 5.370 5.570 0.070 16 0 "[ . 1 . 2]" 1
759 1 33 GLY H 1 93 ALA MB . . 4.680 4.354 4.100 4.599 . 0 0 "[ . 1 . 2]" 1
760 1 33 GLY HA2 1 84 ARG QD . . 4.770 3.653 2.736 4.426 . 0 0 "[ . 1 . 2]" 1
761 1 33 GLY HA2 1 84 ARG QG . . 4.260 2.495 2.100 3.700 . 0 0 "[ . 1 . 2]" 1
762 1 33 GLY HA3 1 34 GLU H . . 3.070 2.231 2.169 2.277 . 0 0 "[ . 1 . 2]" 1
763 1 33 GLY HA3 1 82 SER H . . 4.690 4.182 3.810 4.448 . 0 0 "[ . 1 . 2]" 1
764 1 33 GLY HA3 1 84 ARG H . . 4.100 3.959 3.519 4.160 0.060 3 0 "[ . 1 . 2]" 1
765 1 33 GLY HA3 1 84 ARG QG . . 5.500 3.389 2.878 4.500 . 0 0 "[ . 1 . 2]" 1
766 1 34 GLU H 1 34 GLU HB3 . . 4.070 3.170 3.057 3.284 . 0 0 "[ . 1 . 2]" 1
767 1 34 GLU H 1 35 TYR H . . 4.640 4.401 4.362 4.441 . 0 0 "[ . 1 . 2]" 1
768 1 34 GLU H 1 81 HIS HA . . 4.880 4.621 4.441 4.817 . 0 0 "[ . 1 . 2]" 1
769 1 34 GLU H 1 81 HIS QB . . 4.730 3.909 3.637 4.066 . 0 0 "[ . 1 . 2]" 1
770 1 34 GLU H 1 82 SER H . . 3.800 2.770 2.624 3.002 . 0 0 "[ . 1 . 2]" 1
771 1 34 GLU H 1 82 SER QB . . 4.090 2.757 1.844 3.525 . 0 0 "[ . 1 . 2]" 1
772 1 34 GLU HA 1 34 GLU HB3 . . 2.560 2.457 2.383 2.539 . 0 0 "[ . 1 . 2]" 1
773 1 34 GLU HA 1 35 TYR H . . 3.170 2.429 2.303 2.489 . 0 0 "[ . 1 . 2]" 1
774 1 34 GLU HA 1 35 TYR HA . . 4.570 4.340 4.251 4.384 . 0 0 "[ . 1 . 2]" 1
775 1 34 GLU HA 1 35 TYR QB . . 5.220 4.198 4.062 4.326 . 0 0 "[ . 1 . 2]" 1
776 1 34 GLU HA 1 82 SER H . . 4.770 4.623 4.423 4.727 . 0 0 "[ . 1 . 2]" 1
777 1 34 GLU HB3 1 35 TYR H . . 3.700 3.828 3.718 3.871 0.171 9 0 "[ . 1 . 2]" 1
778 1 34 GLU QG 1 35 TYR H . . 3.960 3.442 3.037 3.677 . 0 0 "[ . 1 . 2]" 1
779 1 34 GLU QG 1 82 SER H . . 3.620 3.659 3.380 3.711 0.091 14 0 "[ . 1 . 2]" 1
780 1 35 TYR H 1 35 TYR QB . . 2.990 2.129 2.012 2.236 . 0 0 "[ . 1 . 2]" 1
781 1 35 TYR H 1 35 TYR QD . . 4.270 4.070 3.920 4.178 . 0 0 "[ . 1 . 2]" 1
782 1 35 TYR H 1 36 GLN H . . 4.660 4.625 4.478 4.680 0.020 7 0 "[ . 1 . 2]" 1
783 1 35 TYR H 1 81 HIS HA . . 5.130 4.844 4.698 4.979 . 0 0 "[ . 1 . 2]" 1
784 1 35 TYR H 1 81 HIS HE1 . . 4.200 3.708 3.215 4.231 0.031 19 0 "[ . 1 . 2]" 1
785 1 35 TYR H 1 82 SER H . . 5.500 4.947 4.782 5.075 . 0 0 "[ . 1 . 2]" 1
786 1 35 TYR HA 1 35 TYR QD . . 3.890 2.941 2.720 3.133 . 0 0 "[ . 1 . 2]" 1
787 1 35 TYR HA 1 36 GLN H . . 3.080 2.211 2.061 2.305 . 0 0 "[ . 1 . 2]" 1
788 1 35 TYR HA 1 37 ASP H . . 4.370 4.275 3.998 4.433 0.063 8 0 "[ . 1 . 2]" 1
789 1 35 TYR HA 1 81 HIS HA . . 3.640 2.675 2.384 2.865 . 0 0 "[ . 1 . 2]" 1
790 1 35 TYR HA 1 81 HIS HD2 . . 4.030 3.359 3.139 3.702 . 0 0 "[ . 1 . 2]" 1
791 1 35 TYR HA 1 81 HIS HE1 . . 4.470 3.471 3.214 3.659 . 0 0 "[ . 1 . 2]" 1
792 1 35 TYR HA 1 82 SER H . . 4.130 4.003 3.734 4.196 0.066 20 0 "[ . 1 . 2]" 1
793 1 35 TYR QB 1 36 GLN HA . . 5.500 4.657 4.343 4.913 . 0 0 "[ . 1 . 2]" 1
794 1 35 TYR QB 1 79 GLU QB . . 5.450 5.141 4.883 5.525 0.075 5 0 "[ . 1 . 2]" 1
795 1 35 TYR QB 1 81 HIS HE1 . . 3.900 2.859 2.629 3.563 . 0 0 "[ . 1 . 2]" 1
796 1 35 TYR QD 1 36 GLN H . . 3.730 3.049 2.355 3.469 . 0 0 "[ . 1 . 2]" 1
797 1 35 TYR QD 1 37 ASP H . . 3.860 3.658 2.606 3.948 0.088 4 0 "[ . 1 . 2]" 1
798 1 35 TYR QD 1 37 ASP HA . . 4.700 4.474 3.519 4.781 0.081 12 0 "[ . 1 . 2]" 1
799 1 35 TYR QD 1 38 VAL QG . . 4.640 4.686 4.580 4.752 0.112 6 0 "[ . 1 . 2]" 1
800 1 35 TYR QD 1 79 GLU QB . . 3.970 3.210 2.837 4.084 0.114 16 0 "[ . 1 . 2]" 1
801 1 35 TYR QD 1 80 ILE H . . 4.920 4.619 4.304 4.984 0.064 4 0 "[ . 1 . 2]" 1
802 1 35 TYR QD 1 81 HIS HE1 . . 3.960 3.677 2.487 4.035 0.075 3 0 "[ . 1 . 2]" 1
803 1 35 TYR QE 1 36 GLN H . . 5.030 4.171 4.000 4.569 . 0 0 "[ . 1 . 2]" 1
804 1 35 TYR QE 1 37 ASP H . . 4.060 3.616 3.375 3.891 . 0 0 "[ . 1 . 2]" 1
805 1 35 TYR QE 1 37 ASP HA . . 3.840 3.439 3.186 3.744 . 0 0 "[ . 1 . 2]" 1
806 1 35 TYR QE 1 38 VAL H . . 4.140 3.750 3.406 4.199 0.059 15 0 "[ . 1 . 2]" 1
807 1 35 TYR QE 1 38 VAL HB . . 3.440 2.347 2.194 2.505 . 0 0 "[ . 1 . 2]" 1
808 1 35 TYR QE 1 38 VAL QG . . 3.230 3.186 3.110 3.293 0.063 5 0 "[ . 1 . 2]" 1
809 1 35 TYR QE 1 79 GLU H . . 5.500 5.568 5.406 5.592 0.092 4 0 "[ . 1 . 2]" 1
810 1 35 TYR QE 1 79 GLU QB . . 3.580 2.432 2.246 3.003 . 0 0 "[ . 1 . 2]" 1
811 1 35 TYR QE 1 79 GLU QG . . 4.140 3.847 3.202 4.110 . 0 0 "[ . 1 . 2]" 1
812 1 35 TYR QE 1 80 ILE H . . 4.160 3.971 3.672 4.211 0.051 4 0 "[ . 1 . 2]" 1
813 1 35 TYR QE 1 81 HIS HD2 . . 4.620 4.668 4.578 4.696 0.076 4 0 "[ . 1 . 2]" 1
814 1 36 GLN H 1 36 GLN QB . . 3.680 2.491 2.354 2.591 . 0 0 "[ . 1 . 2]" 1
815 1 36 GLN H 1 37 ASP H . . 3.110 2.235 2.124 2.357 . 0 0 "[ . 1 . 2]" 1
816 1 36 GLN H 1 37 ASP HA . . 4.930 4.593 4.450 4.780 . 0 0 "[ . 1 . 2]" 1
817 1 36 GLN H 1 80 ILE H . . 4.790 4.330 4.185 4.515 . 0 0 "[ . 1 . 2]" 1
818 1 36 GLN H 1 80 ILE HB . . 4.730 4.412 4.198 4.746 0.016 20 0 "[ . 1 . 2]" 1
819 1 36 GLN H 1 80 ILE MG . . 4.320 4.092 3.892 4.241 . 0 0 "[ . 1 . 2]" 1
820 1 36 GLN H 1 81 HIS HA . . 3.450 2.508 2.226 2.640 . 0 0 "[ . 1 . 2]" 1
821 1 36 GLN H 1 81 HIS QB . . 4.670 4.433 4.195 4.576 . 0 0 "[ . 1 . 2]" 1
822 1 36 GLN H 1 81 HIS HD2 . . 4.410 3.686 3.509 3.914 . 0 0 "[ . 1 . 2]" 1
823 1 36 GLN H 1 81 HIS HE1 . . 5.500 5.517 5.256 5.567 0.067 16 0 "[ . 1 . 2]" 1
824 1 36 GLN H 1 82 SER H . . 4.230 4.209 3.920 4.295 0.065 9 0 "[ . 1 . 2]" 1
825 1 36 GLN HA 1 80 ILE MG . . 5.410 4.980 4.786 5.240 . 0 0 "[ . 1 . 2]" 1
826 1 36 GLN HA 1 81 HIS HA . . 4.610 4.494 4.299 4.674 0.064 4 0 "[ . 1 . 2]" 1
827 1 36 GLN QB 1 80 ILE H . . 4.830 4.555 4.208 4.802 . 0 0 "[ . 1 . 2]" 1
828 1 36 GLN QB 1 80 ILE MG . . 3.560 2.287 2.143 2.538 . 0 0 "[ . 1 . 2]" 1
829 1 36 GLN QB 1 81 HIS HA . . 3.790 2.640 2.253 2.960 . 0 0 "[ . 1 . 2]" 1
830 1 36 GLN QB 1 82 SER H . . 3.720 3.338 2.714 3.791 0.071 8 0 "[ . 1 . 2]" 1
831 1 36 GLN QB 1 82 SER HA . . 5.440 4.130 3.672 4.587 . 0 0 "[ . 1 . 2]" 1
832 1 36 GLN QB 1 82 SER QB . . 5.340 3.767 2.870 4.575 . 0 0 "[ . 1 . 2]" 1
833 1 36 GLN QB 1 88 LEU QD . . 3.630 3.026 2.545 3.668 0.038 9 0 "[ . 1 . 2]" 1
834 1 37 ASP H 1 37 ASP QB . . 3.470 2.851 2.669 2.982 . 0 0 "[ . 1 . 2]" 1
835 1 37 ASP H 1 37 ASP HB3 . . 4.160 3.404 2.995 3.860 . 0 0 "[ . 1 . 2]" 1
836 1 37 ASP H 1 38 VAL H . . 4.430 4.388 4.318 4.473 0.043 16 0 "[ . 1 . 2]" 1
837 1 37 ASP H 1 38 VAL HA . . 4.960 4.616 4.525 4.721 . 0 0 "[ . 1 . 2]" 1
838 1 37 ASP H 1 79 GLU HA . . 5.400 4.874 4.599 5.157 . 0 0 "[ . 1 . 2]" 1
839 1 37 ASP H 1 80 ILE H . . 3.540 2.945 2.849 3.061 . 0 0 "[ . 1 . 2]" 1
840 1 37 ASP H 1 80 ILE HA . . 4.820 4.636 4.552 4.837 0.017 4 0 "[ . 1 . 2]" 1
841 1 37 ASP H 1 80 ILE HB . . 3.380 2.841 2.635 3.182 . 0 0 "[ . 1 . 2]" 1
842 1 37 ASP H 1 80 ILE MD . . 4.760 4.485 4.265 4.843 0.083 15 0 "[ . 1 . 2]" 1
843 1 37 ASP H 1 80 ILE MG . . 3.720 3.639 2.975 3.812 0.092 4 0 "[ . 1 . 2]" 1
844 1 37 ASP H 1 81 HIS H . . 5.360 4.962 4.809 5.152 . 0 0 "[ . 1 . 2]" 1
845 1 37 ASP H 1 81 HIS HA . . 4.150 4.112 3.849 4.210 0.060 1 0 "[ . 1 . 2]" 1
846 1 37 ASP HA 1 38 VAL H . . 2.850 2.415 2.266 2.604 . 0 0 "[ . 1 . 2]" 1
847 1 37 ASP HA 1 38 VAL HB . . 4.730 4.357 4.188 4.496 . 0 0 "[ . 1 . 2]" 1
848 1 37 ASP HA 1 38 VAL QG . . 5.500 3.719 3.555 3.879 . 0 0 "[ . 1 . 2]" 1
849 1 37 ASP HA 1 80 ILE H . . 4.840 4.763 4.563 4.860 0.020 13 0 "[ . 1 . 2]" 1
850 1 37 ASP QB 1 38 VAL H . . 3.360 3.060 2.243 3.434 0.074 12 0 "[ . 1 . 2]" 1
851 1 37 ASP QB 1 38 VAL HA . . 4.620 4.292 4.058 4.442 . 0 0 "[ . 1 . 2]" 1
852 1 37 ASP QB 1 38 VAL QG . . 4.780 4.378 3.866 4.634 . 0 0 "[ . 1 . 2]" 1
853 1 37 ASP QB 1 80 ILE HB . . 4.150 2.583 2.071 3.030 . 0 0 "[ . 1 . 2]" 1
854 1 37 ASP QB 1 80 ILE MD . . 4.110 2.609 2.314 3.295 . 0 0 "[ . 1 . 2]" 1
855 1 37 ASP HB3 1 38 VAL H . . 4.170 3.191 2.262 3.637 . 0 0 "[ . 1 . 2]" 1
856 1 37 ASP HB3 1 38 VAL QG . . 5.500 4.657 4.019 5.020 . 0 0 "[ . 1 . 2]" 1
857 1 37 ASP HB3 1 80 ILE HB . . 4.770 3.033 2.384 3.981 . 0 0 "[ . 1 . 2]" 1
858 1 37 ASP HB3 1 80 ILE MD . . 4.730 2.873 2.350 4.186 . 0 0 "[ . 1 . 2]" 1
859 1 38 VAL H 1 38 VAL HB . . 3.540 3.031 2.899 3.155 . 0 0 "[ . 1 . 2]" 1
860 1 38 VAL H 1 38 VAL QG . . 2.750 2.109 1.977 2.244 . 0 0 "[ . 1 . 2]" 1
861 1 38 VAL H 1 39 LEU H . . 4.520 4.426 4.331 4.474 . 0 0 "[ . 1 . 2]" 1
862 1 38 VAL H 1 39 LEU QD . . 4.800 3.834 3.570 4.207 . 0 0 "[ . 1 . 2]" 1
863 1 38 VAL H 1 80 ILE H . . 4.940 4.785 4.524 4.919 . 0 0 "[ . 1 . 2]" 1
864 1 38 VAL H 1 80 ILE HB . . 5.500 5.428 5.070 5.561 0.061 8 0 "[ . 1 . 2]" 1
865 1 38 VAL H 1 80 ILE MD . . 5.490 5.284 5.141 5.568 0.078 20 0 "[ . 1 . 2]" 1
866 1 38 VAL HA 1 38 VAL QG . . 3.090 2.272 2.196 2.326 . 0 0 "[ . 1 . 2]" 1
867 1 38 VAL HA 1 39 LEU H . . 3.030 2.111 2.039 2.184 . 0 0 "[ . 1 . 2]" 1
868 1 38 VAL HA 1 79 GLU QB . . 4.260 2.304 2.067 2.613 . 0 0 "[ . 1 . 2]" 1
869 1 38 VAL HB 1 39 LEU H . . 4.160 4.026 3.930 4.134 . 0 0 "[ . 1 . 2]" 1
870 1 38 VAL QG 1 39 LEU H . . 3.050 2.394 2.250 2.538 . 0 0 "[ . 1 . 2]" 1
871 1 38 VAL QG 1 39 LEU HA . . 3.800 3.678 3.518 3.778 . 0 0 "[ . 1 . 2]" 1
872 1 38 VAL QG 1 79 GLU H . . 4.440 4.103 3.787 4.496 0.056 16 0 "[ . 1 . 2]" 1
873 1 38 VAL QG 1 79 GLU HA . . 3.650 3.616 3.209 3.752 0.102 8 0 "[ . 1 . 2]" 1
874 1 38 VAL QG 1 79 GLU QB . . 3.490 2.379 2.104 2.645 . 0 0 "[ . 1 . 2]" 1
875 1 38 VAL QG 1 79 GLU QG . . 4.740 4.170 3.220 4.437 . 0 0 "[ . 1 . 2]" 1
876 1 39 LEU H 1 39 LEU HB3 . . 3.620 3.457 3.254 3.566 . 0 0 "[ . 1 . 2]" 1
877 1 39 LEU H 1 39 LEU MD1 . . 4.540 3.896 3.129 4.292 . 0 0 "[ . 1 . 2]" 1
878 1 39 LEU H 1 39 LEU QD . . 3.410 2.940 2.600 3.297 . 0 0 "[ . 1 . 2]" 1
879 1 39 LEU H 1 39 LEU MD2 . . 4.540 3.283 2.627 4.279 . 0 0 "[ . 1 . 2]" 1
880 1 39 LEU H 1 40 ALA MB . . 4.810 4.667 4.440 4.859 0.049 18 0 "[ . 1 . 2]" 1
881 1 39 LEU H 1 79 GLU H . . 4.840 3.876 3.413 4.227 . 0 0 "[ . 1 . 2]" 1
882 1 39 LEU H 1 79 GLU QB . . 3.610 2.997 2.710 3.211 . 0 0 "[ . 1 . 2]" 1
883 1 39 LEU H 1 80 ILE H . . 4.330 4.369 4.209 4.399 0.069 18 0 "[ . 1 . 2]" 1
884 1 39 LEU H 1 80 ILE MD . . 5.280 5.343 5.255 5.370 0.090 15 0 "[ . 1 . 2]" 1
885 1 39 LEU HA 1 39 LEU QD . . 2.770 2.040 1.871 2.188 . 0 0 "[ . 1 . 2]" 1
886 1 39 LEU HA 1 39 LEU HG . . 3.840 3.353 2.521 3.766 . 0 0 "[ . 1 . 2]" 1
887 1 39 LEU HB3 1 40 ALA H . . 4.130 2.465 2.234 2.897 . 0 0 "[ . 1 . 2]" 1
888 1 39 LEU QD 1 40 ALA H . . 4.100 3.010 2.379 3.754 . 0 0 "[ . 1 . 2]" 1
889 1 39 LEU QD 1 40 ALA HA . . 5.440 4.975 4.509 5.335 . 0 0 "[ . 1 . 2]" 1
890 1 39 LEU QD 1 41 GLU H . . 4.630 4.201 3.730 4.728 0.098 6 0 "[ . 1 . 2]" 1
891 1 39 LEU QD 1 77 TYR H . . 5.070 4.955 4.493 5.164 0.094 19 0 "[ . 1 . 2]" 1
892 1 39 LEU QD 1 77 TYR HA . . 4.170 3.662 2.380 4.262 0.092 1 0 "[ . 1 . 2]" 1
893 1 39 LEU QD 1 77 TYR HB2 . . 3.760 3.228 2.773 3.574 . 0 0 "[ . 1 . 2]" 1
894 1 39 LEU QD 1 77 TYR QD . . 3.460 2.897 2.351 3.496 0.036 11 0 "[ . 1 . 2]" 1
895 1 39 LEU QD 1 77 TYR QE . . 4.550 4.360 4.021 4.664 0.114 5 0 "[ . 1 . 2]" 1
896 1 39 LEU QD 1 78 GLY H . . 5.300 4.038 2.664 4.807 . 0 0 "[ . 1 . 2]" 1
897 1 39 LEU QD 1 78 GLY HA2 . . 5.440 4.611 3.867 5.051 . 0 0 "[ . 1 . 2]" 1
898 1 39 LEU QD 1 79 GLU H . . 5.440 4.634 4.381 4.992 . 0 0 "[ . 1 . 2]" 1
899 1 39 LEU QD 1 80 ILE MD . . 2.930 2.000 1.872 2.119 . 0 0 "[ . 1 . 2]" 1
900 1 39 LEU MD1 1 40 ALA H . . 5.500 3.112 2.393 4.072 . 0 0 "[ . 1 . 2]" 1
901 1 39 LEU MD1 1 80 ILE MD . . 4.060 3.181 2.154 4.062 0.002 2 0 "[ . 1 . 2]" 1
902 1 39 LEU MD2 1 40 ALA H . . 5.500 4.419 4.178 4.624 . 0 0 "[ . 1 . 2]" 1
903 1 39 LEU MD2 1 80 ILE MD . . 4.060 2.095 1.897 2.401 . 0 0 "[ . 1 . 2]" 1
904 1 39 LEU HG 1 40 ALA H . . 4.450 4.017 3.066 4.514 0.064 20 0 "[ . 1 . 2]" 1
905 1 39 LEU HG 1 77 TYR QD . . 4.400 3.930 3.042 4.442 0.042 20 0 "[ . 1 . 2]" 1
906 1 39 LEU HG 1 78 GLY HA2 . . 5.500 5.475 5.030 5.590 0.090 11 0 "[ . 1 . 2]" 1
907 1 40 ALA H 1 40 ALA HA . . 2.890 2.870 2.824 2.919 0.029 5 0 "[ . 1 . 2]" 1
908 1 40 ALA H 1 40 ALA MB . . 3.100 2.866 2.688 3.023 . 0 0 "[ . 1 . 2]" 1
909 1 40 ALA H 1 41 GLU HA . . 5.070 4.708 4.584 4.815 . 0 0 "[ . 1 . 2]" 1
910 1 40 ALA H 1 41 GLU HB2 . . 4.820 3.433 3.244 3.876 . 0 0 "[ . 1 . 2]" 1
911 1 40 ALA H 1 41 GLU QG . . 4.790 4.596 3.626 4.861 0.071 5 0 "[ . 1 . 2]" 1
912 1 40 ALA H 1 77 TYR H . . 5.500 5.291 5.068 5.544 0.044 2 0 "[ . 1 . 2]" 1
913 1 40 ALA H 1 77 TYR HA . . 5.500 5.575 5.546 5.630 0.130 2 0 "[ . 1 . 2]" 1
914 1 40 ALA H 1 77 TYR HB2 . . 4.350 3.026 2.870 3.281 . 0 0 "[ . 1 . 2]" 1
915 1 40 ALA H 1 77 TYR QD . . 4.740 3.678 3.315 4.037 . 0 0 "[ . 1 . 2]" 1
916 1 40 ALA HA 1 41 GLU H . . 2.990 2.728 2.438 2.986 . 0 0 "[ . 1 . 2]" 1
917 1 40 ALA HA 1 41 GLU HA . . 5.500 4.412 4.311 4.549 . 0 0 "[ . 1 . 2]" 1
918 1 40 ALA HA 1 41 GLU QG . . 5.500 5.236 4.651 5.569 0.069 19 0 "[ . 1 . 2]" 1
919 1 40 ALA MB 1 41 GLU H . . 3.810 3.779 3.673 3.858 0.048 18 0 "[ . 1 . 2]" 1
920 1 40 ALA MB 1 41 GLU QG . . 4.310 4.163 3.202 4.401 0.091 17 0 "[ . 1 . 2]" 1
921 1 40 ALA MB 1 77 TYR QD . . 5.500 5.494 5.196 5.622 0.122 4 0 "[ . 1 . 2]" 1
922 1 41 GLU H 1 41 GLU HB2 . . 3.480 2.947 2.672 3.145 . 0 0 "[ . 1 . 2]" 1
923 1 41 GLU H 1 41 GLU QG . . 4.180 3.997 3.448 4.131 . 0 0 "[ . 1 . 2]" 1
924 1 41 GLU H 1 42 VAL H . . 4.530 4.365 4.252 4.466 . 0 0 "[ . 1 . 2]" 1
925 1 41 GLU H 1 42 VAL QG . . 4.260 3.933 3.590 4.204 . 0 0 "[ . 1 . 2]" 1
926 1 41 GLU H 1 76 ASP HA . . 5.170 5.070 4.868 5.237 0.067 13 0 "[ . 1 . 2]" 1
927 1 41 GLU H 1 77 TYR H . . 3.860 3.195 3.034 3.305 . 0 0 "[ . 1 . 2]" 1
928 1 41 GLU H 1 77 TYR HA . . 5.010 4.704 4.544 4.921 . 0 0 "[ . 1 . 2]" 1
929 1 41 GLU H 1 77 TYR HB2 . . 3.610 1.908 1.642 2.145 . 0 0 "[ . 1 . 2]" 1
930 1 41 GLU H 1 77 TYR QD . . 3.890 3.346 2.921 3.784 . 0 0 "[ . 1 . 2]" 1
931 1 41 GLU H 1 77 TYR QE . . 5.500 5.217 4.697 5.572 0.072 11 0 "[ . 1 . 2]" 1
932 1 41 GLU HA 1 41 GLU QG . . 3.030 2.206 2.107 2.601 . 0 0 "[ . 1 . 2]" 1
933 1 41 GLU HA 1 42 VAL H . . 2.710 2.568 2.463 2.679 . 0 0 "[ . 1 . 2]" 1
934 1 41 GLU HA 1 42 VAL HA . . 5.500 4.570 4.515 4.622 . 0 0 "[ . 1 . 2]" 1
935 1 41 GLU HA 1 42 VAL QG . . 3.690 3.168 3.038 3.277 . 0 0 "[ . 1 . 2]" 1
936 1 41 GLU HB2 1 42 VAL H . . 3.920 3.881 3.479 3.985 0.065 1 0 "[ . 1 . 2]" 1
937 1 41 GLU HB2 1 77 TYR QD . . 4.470 2.258 1.994 2.532 . 0 0 "[ . 1 . 2]" 1
938 1 41 GLU QG 1 42 VAL H . . 3.510 2.822 2.331 3.598 0.088 3 0 "[ . 1 . 2]" 1
939 1 41 GLU QG 1 77 TYR QD . . 4.290 4.150 3.734 4.378 0.088 14 0 "[ . 1 . 2]" 1
940 1 42 VAL H 1 42 VAL HB . . 3.800 2.907 2.816 3.135 . 0 0 "[ . 1 . 2]" 1
941 1 42 VAL H 1 42 VAL MG1 . . 4.140 4.010 3.975 4.063 . 0 0 "[ . 1 . 2]" 1
942 1 42 VAL H 1 42 VAL QG . . 3.120 2.865 2.748 2.963 . 0 0 "[ . 1 . 2]" 1
943 1 42 VAL H 1 42 VAL MG2 . . 4.140 2.935 2.801 3.045 . 0 0 "[ . 1 . 2]" 1
944 1 42 VAL H 1 43 ARG H . . 4.500 4.381 4.239 4.471 . 0 0 "[ . 1 . 2]" 1
945 1 42 VAL H 1 76 ASP HA . . 5.190 5.058 4.803 5.214 0.024 20 0 "[ . 1 . 2]" 1
946 1 42 VAL H 1 77 TYR H . . 5.430 4.651 4.505 4.864 . 0 0 "[ . 1 . 2]" 1
947 1 42 VAL H 1 77 TYR QD . . 4.580 4.609 4.362 4.666 0.086 11 0 "[ . 1 . 2]" 1
948 1 42 VAL H 1 77 TYR QE . . 4.830 4.627 4.210 4.915 0.085 4 0 "[ . 1 . 2]" 1
949 1 42 VAL HA 1 42 VAL MG1 . . 3.320 2.382 2.274 2.422 . 0 0 "[ . 1 . 2]" 1
950 1 42 VAL HA 1 42 VAL MG2 . . 3.320 2.575 2.480 2.700 . 0 0 "[ . 1 . 2]" 1
951 1 42 VAL HA 1 43 ARG H . . 3.060 2.352 2.269 2.429 . 0 0 "[ . 1 . 2]" 1
952 1 42 VAL HA 1 74 GLU QG . . 5.060 4.921 4.623 5.128 0.068 1 0 "[ . 1 . 2]" 1
953 1 42 VAL HA 1 75 TRP H . . 5.310 5.047 4.842 5.231 . 0 0 "[ . 1 . 2]" 1
954 1 42 VAL HA 1 76 ASP HA . . 3.330 2.431 2.186 2.573 . 0 0 "[ . 1 . 2]" 1
955 1 42 VAL HA 1 76 ASP QB . . 5.140 4.358 3.951 4.632 . 0 0 "[ . 1 . 2]" 1
956 1 42 VAL HA 1 77 TYR H . . 3.880 2.825 2.655 2.954 . 0 0 "[ . 1 . 2]" 1
957 1 42 VAL HA 1 77 TYR QD . . 3.820 3.721 3.323 3.898 0.078 9 0 "[ . 1 . 2]" 1
958 1 42 VAL HA 1 77 TYR QE . . 4.290 4.000 3.461 4.363 0.073 11 0 "[ . 1 . 2]" 1
959 1 42 VAL HB 1 43 ARG H . . 3.990 3.835 3.732 3.949 . 0 0 "[ . 1 . 2]" 1
960 1 42 VAL HB 1 44 VAL QG . . 5.440 4.761 4.351 5.047 . 0 0 "[ . 1 . 2]" 1
961 1 42 VAL HB 1 58 TRP HH2 . . 3.870 2.941 2.743 3.105 . 0 0 "[ . 1 . 2]" 1
962 1 42 VAL HB 1 58 TRP HZ3 . . 5.470 3.466 3.065 3.652 . 0 0 "[ . 1 . 2]" 1
963 1 42 VAL HB 1 76 ASP HA . . 4.810 4.499 4.382 4.769 . 0 0 "[ . 1 . 2]" 1
964 1 42 VAL QG 1 43 ARG H . . 3.100 2.300 2.136 2.440 . 0 0 "[ . 1 . 2]" 1
965 1 42 VAL QG 1 43 ARG HA . . 5.440 3.570 3.461 3.718 . 0 0 "[ . 1 . 2]" 1
966 1 42 VAL QG 1 44 VAL H . . 4.960 4.808 4.631 4.960 0.000 11 0 "[ . 1 . 2]" 1
967 1 42 VAL QG 1 44 VAL QG . . 3.180 3.161 2.851 3.296 0.116 19 0 "[ . 1 . 2]" 1
968 1 42 VAL QG 1 58 TRP HH2 . . 3.570 3.420 3.067 3.647 0.077 16 0 "[ . 1 . 2]" 1
969 1 42 VAL QG 1 58 TRP HZ2 . . 4.640 4.567 4.160 4.726 0.086 11 0 "[ . 1 . 2]" 1
970 1 42 VAL QG 1 58 TRP HZ3 . . 3.770 3.621 3.060 3.852 0.082 5 0 "[ . 1 . 2]" 1
971 1 42 VAL QG 1 74 GLU QG . . 3.220 2.288 2.055 2.478 . 0 0 "[ . 1 . 2]" 1
972 1 42 VAL QG 1 75 TRP H . . 4.130 3.568 3.367 3.875 . 0 0 "[ . 1 . 2]" 1
973 1 42 VAL QG 1 75 TRP HA . . 4.880 4.254 4.012 4.479 . 0 0 "[ . 1 . 2]" 1
974 1 42 VAL QG 1 76 ASP H . . 4.570 3.600 3.455 3.772 . 0 0 "[ . 1 . 2]" 1
975 1 42 VAL QG 1 76 ASP HA . . 3.220 2.092 1.998 2.298 . 0 0 "[ . 1 . 2]" 1
976 1 42 VAL QG 1 76 ASP QB . . 4.850 2.689 2.432 3.219 . 0 0 "[ . 1 . 2]" 1
977 1 42 VAL QG 1 77 TYR H . . 3.970 3.049 2.815 3.277 . 0 0 "[ . 1 . 2]" 1
978 1 42 VAL QG 1 77 TYR QD . . 5.150 4.328 4.108 4.502 . 0 0 "[ . 1 . 2]" 1
979 1 42 VAL MG1 1 43 ARG H . . 4.260 2.311 2.144 2.457 . 0 0 "[ . 1 . 2]" 1
980 1 42 VAL MG1 1 58 TRP HH2 . . 4.500 3.556 3.115 3.842 . 0 0 "[ . 1 . 2]" 1
981 1 42 VAL MG1 1 58 TRP HZ3 . . 4.560 3.826 3.117 4.145 . 0 0 "[ . 1 . 2]" 1
982 1 42 VAL MG1 1 76 ASP HA . . 3.670 2.357 2.106 2.642 . 0 0 "[ . 1 . 2]" 1
983 1 42 VAL MG1 1 77 TYR H . . 4.660 4.059 3.811 4.282 . 0 0 "[ . 1 . 2]" 1
984 1 42 VAL MG2 1 43 ARG H . . 4.260 4.142 3.970 4.290 0.030 11 0 "[ . 1 . 2]" 1
985 1 42 VAL MG2 1 58 TRP HH2 . . 4.500 4.484 4.330 4.589 0.089 18 0 "[ . 1 . 2]" 1
986 1 42 VAL MG2 1 58 TRP HZ3 . . 4.560 4.528 4.223 4.635 0.075 3 0 "[ . 1 . 2]" 1
987 1 42 VAL MG2 1 76 ASP HA . . 3.670 2.367 2.203 2.667 . 0 0 "[ . 1 . 2]" 1
988 1 42 VAL MG2 1 77 TYR H . . 4.660 3.154 2.881 3.435 . 0 0 "[ . 1 . 2]" 1
989 1 43 ARG H 1 43 ARG HB3 . . 3.870 3.473 3.164 3.825 . 0 0 "[ . 1 . 2]" 1
990 1 43 ARG H 1 44 VAL H . . 4.570 4.375 4.299 4.427 . 0 0 "[ . 1 . 2]" 1
991 1 43 ARG H 1 44 VAL QG . . 4.660 4.046 3.913 4.152 . 0 0 "[ . 1 . 2]" 1
992 1 43 ARG H 1 45 PHE QD . . 5.500 5.384 5.238 5.583 0.083 13 0 "[ . 1 . 2]" 1
993 1 43 ARG H 1 45 PHE QE . . 5.500 5.521 5.289 5.588 0.088 10 0 "[ . 1 . 2]" 1
994 1 43 ARG H 1 74 GLU HA . . 4.740 4.384 4.259 4.547 . 0 0 "[ . 1 . 2]" 1
995 1 43 ARG H 1 74 GLU QG . . 4.010 3.902 3.582 4.085 0.075 13 0 "[ . 1 . 2]" 1
996 1 43 ARG H 1 75 TRP H . . 4.050 3.266 2.990 3.517 . 0 0 "[ . 1 . 2]" 1
997 1 43 ARG H 1 75 TRP HB2 . . 4.430 4.262 3.971 4.495 0.065 6 0 "[ . 1 . 2]" 1
998 1 43 ARG H 1 76 ASP HA . . 3.860 3.834 3.696 3.916 0.056 3 0 "[ . 1 . 2]" 1
999 1 43 ARG H 1 77 TYR H . . 4.790 4.776 4.530 4.857 0.067 13 0 "[ . 1 . 2]" 1
1000 1 43 ARG H 1 77 TYR QD . . 4.860 4.454 4.038 4.799 . 0 0 "[ . 1 . 2]" 1
1001 1 43 ARG H 1 77 TYR QE . . 4.100 3.639 3.073 3.982 . 0 0 "[ . 1 . 2]" 1
1002 1 43 ARG HA 1 44 VAL H . . 3.010 2.392 2.256 2.551 . 0 0 "[ . 1 . 2]" 1
1003 1 43 ARG QB 1 44 VAL H . . 3.330 2.714 2.268 3.138 . 0 0 "[ . 1 . 2]" 1
1004 1 43 ARG QB 1 45 PHE QD . . 3.490 3.173 2.783 3.569 0.079 8 0 "[ . 1 . 2]" 1
1005 1 43 ARG QB 1 45 PHE QE . . 4.800 4.292 3.784 4.647 . 0 0 "[ . 1 . 2]" 1
1006 1 43 ARG QB 1 53 ILE H . . 5.340 5.072 4.518 5.407 0.067 6 0 "[ . 1 . 2]" 1
1007 1 43 ARG QB 1 75 TRP H . . 4.730 4.339 4.066 4.707 . 0 0 "[ . 1 . 2]" 1
1008 1 43 ARG QB 1 77 TYR QE . . 3.340 2.748 2.225 3.295 . 0 0 "[ . 1 . 2]" 1
1009 1 43 ARG HB3 1 44 VAL H . . 4.130 2.897 2.290 3.842 . 0 0 "[ . 1 . 2]" 1
1010 1 44 VAL H 1 44 VAL HB . . 3.230 2.657 2.494 2.849 . 0 0 "[ . 1 . 2]" 1
1011 1 44 VAL H 1 44 VAL MG1 . . 3.920 3.864 3.793 3.940 0.020 11 0 "[ . 1 . 2]" 1
1012 1 44 VAL H 1 44 VAL QG . . 3.200 2.811 2.694 2.933 . 0 0 "[ . 1 . 2]" 1
1013 1 44 VAL H 1 44 VAL MG2 . . 3.920 2.888 2.751 3.048 . 0 0 "[ . 1 . 2]" 1
1014 1 44 VAL H 1 45 PHE H . . 4.260 4.275 4.033 4.331 0.071 6 0 "[ . 1 . 2]" 1
1015 1 44 VAL H 1 45 PHE QD . . 4.270 4.223 3.577 4.341 0.071 10 0 "[ . 1 . 2]" 1
1016 1 44 VAL H 1 53 ILE H . . 5.350 3.756 3.450 3.974 . 0 0 "[ . 1 . 2]" 1
1017 1 44 VAL H 1 58 TRP HE1 . . 4.020 3.321 2.969 3.702 . 0 0 "[ . 1 . 2]" 1
1018 1 44 VAL H 1 58 TRP HH2 . . 4.910 4.880 4.178 4.977 0.067 13 0 "[ . 1 . 2]" 1
1019 1 44 VAL H 1 58 TRP HZ2 . . 3.880 3.027 2.546 3.236 . 0 0 "[ . 1 . 2]" 1
1020 1 44 VAL HA 1 45 PHE H . . 3.070 2.252 2.143 2.358 . 0 0 "[ . 1 . 2]" 1
1021 1 44 VAL HA 1 74 GLU H . . 4.940 4.763 4.471 4.978 0.038 3 0 "[ . 1 . 2]" 1
1022 1 44 VAL HA 1 74 GLU QG . . 5.500 3.962 3.614 4.423 . 0 0 "[ . 1 . 2]" 1
1023 1 44 VAL HA 1 75 TRP H . . 3.860 3.485 3.262 3.688 . 0 0 "[ . 1 . 2]" 1
1024 1 44 VAL HB 1 45 PHE H . . 4.850 4.269 4.137 4.431 . 0 0 "[ . 1 . 2]" 1
1025 1 44 VAL HB 1 53 ILE H . . 4.400 3.991 3.607 4.333 . 0 0 "[ . 1 . 2]" 1
1026 1 44 VAL HB 1 53 ILE MD . . 5.500 4.879 4.043 5.228 . 0 0 "[ . 1 . 2]" 1
1027 1 44 VAL HB 1 58 TRP HD1 . . 3.970 3.312 3.036 3.645 . 0 0 "[ . 1 . 2]" 1
1028 1 44 VAL HB 1 58 TRP HE1 . . 3.430 2.613 2.440 2.850 . 0 0 "[ . 1 . 2]" 1
1029 1 44 VAL HB 1 58 TRP HZ2 . . 4.180 4.083 3.724 4.228 0.048 16 0 "[ . 1 . 2]" 1
1030 1 44 VAL QG 1 45 PHE H . . 3.140 2.779 2.518 3.031 . 0 0 "[ . 1 . 2]" 1
1031 1 44 VAL QG 1 45 PHE HA . . 4.700 3.582 3.454 3.753 . 0 0 "[ . 1 . 2]" 1
1032 1 44 VAL QG 1 53 ILE H . . 4.430 4.060 3.796 4.368 . 0 0 "[ . 1 . 2]" 1
1033 1 44 VAL QG 1 53 ILE HB . . 3.460 2.860 2.480 3.403 . 0 0 "[ . 1 . 2]" 1
1034 1 44 VAL QG 1 53 ILE MD . . 3.650 3.480 2.439 3.778 0.128 6 0 "[ . 1 . 2]" 1
1035 1 44 VAL QG 1 53 ILE MG . . 4.290 2.722 2.354 3.251 . 0 0 "[ . 1 . 2]" 1
1036 1 44 VAL QG 1 58 TRP HB2 . . 4.850 4.383 4.109 4.750 . 0 0 "[ . 1 . 2]" 1
1037 1 44 VAL QG 1 58 TRP HD1 . . 3.850 3.278 3.015 3.591 . 0 0 "[ . 1 . 2]" 1
1038 1 44 VAL QG 1 58 TRP HE1 . . 3.630 3.267 3.072 3.404 . 0 0 "[ . 1 . 2]" 1
1039 1 44 VAL QG 1 58 TRP HH2 . . 4.550 3.866 3.326 4.116 . 0 0 "[ . 1 . 2]" 1
1040 1 44 VAL QG 1 58 TRP HZ2 . . 3.280 3.301 3.093 3.372 0.092 19 0 "[ . 1 . 2]" 1
1041 1 44 VAL QG 1 72 ARG H . . 5.020 4.844 4.067 5.119 0.099 3 0 "[ . 1 . 2]" 1
1042 1 44 VAL QG 1 72 ARG QB . . 3.400 2.095 1.924 2.277 . 0 0 "[ . 1 . 2]" 1
1043 1 44 VAL QG 1 72 ARG QD . . 3.400 2.470 1.938 3.505 0.105 19 0 "[ . 1 . 2]" 1
1044 1 44 VAL QG 1 72 ARG QG . . 4.170 2.774 1.907 3.306 . 0 0 "[ . 1 . 2]" 1
1045 1 44 VAL QG 1 73 THR H . . 3.850 3.023 2.497 3.617 . 0 0 "[ . 1 . 2]" 1
1046 1 44 VAL QG 1 73 THR HB . . 5.010 4.755 4.465 5.090 0.080 5 0 "[ . 1 . 2]" 1
1047 1 44 VAL QG 1 74 GLU HA . . 3.610 2.508 2.295 2.674 . 0 0 "[ . 1 . 2]" 1
1048 1 44 VAL QG 1 74 GLU HB2 . . 3.510 2.487 2.202 2.869 . 0 0 "[ . 1 . 2]" 1
1049 1 44 VAL QG 1 74 GLU QG . . 3.100 2.360 2.154 2.996 . 0 0 "[ . 1 . 2]" 1
1050 1 44 VAL QG 1 75 TRP H . . 4.100 3.861 3.666 4.039 . 0 0 "[ . 1 . 2]" 1
1051 1 44 VAL MG1 1 45 PHE H . . 4.340 2.823 2.542 3.103 . 0 0 "[ . 1 . 2]" 1
1052 1 44 VAL MG1 1 53 ILE MG . . 5.500 2.794 2.393 3.400 . 0 0 "[ . 1 . 2]" 1
1053 1 44 VAL MG1 1 58 TRP HD1 . . 4.670 3.678 3.352 4.164 . 0 0 "[ . 1 . 2]" 1
1054 1 44 VAL MG1 1 58 TRP HE1 . . 4.290 4.092 3.890 4.351 0.061 11 0 "[ . 1 . 2]" 1
1055 1 44 VAL MG1 1 74 GLU H . . 4.760 4.413 4.068 4.821 0.061 15 0 "[ . 1 . 2]" 1
1056 1 44 VAL MG1 1 74 GLU HB2 . . 4.700 3.270 2.429 3.951 . 0 0 "[ . 1 . 2]" 1
1057 1 44 VAL MG1 1 75 TRP H . . 5.400 4.993 4.630 5.189 . 0 0 "[ . 1 . 2]" 1
1058 1 44 VAL MG2 1 45 PHE H . . 4.340 4.179 4.048 4.363 0.023 20 0 "[ . 1 . 2]" 1
1059 1 44 VAL MG2 1 53 ILE MG . . 5.500 3.786 3.473 4.135 . 0 0 "[ . 1 . 2]" 1
1060 1 44 VAL MG2 1 58 TRP HD1 . . 4.670 3.697 3.418 3.923 . 0 0 "[ . 1 . 2]" 1
1061 1 44 VAL MG2 1 58 TRP HE1 . . 4.290 3.440 3.190 3.682 . 0 0 "[ . 1 . 2]" 1
1062 1 44 VAL MG2 1 74 GLU H . . 4.760 4.628 4.272 4.837 0.077 13 0 "[ . 1 . 2]" 1
1063 1 44 VAL MG2 1 74 GLU HB2 . . 4.700 2.598 2.241 3.114 . 0 0 "[ . 1 . 2]" 1
1064 1 44 VAL MG2 1 75 TRP H . . 5.400 4.022 3.802 4.252 . 0 0 "[ . 1 . 2]" 1
1065 1 45 PHE H 1 45 PHE QD . . 3.460 2.980 2.665 3.300 . 0 0 "[ . 1 . 2]" 1
1066 1 45 PHE H 1 45 PHE QE . . 4.260 4.327 4.234 4.353 0.093 20 0 "[ . 1 . 2]" 1
1067 1 45 PHE H 1 46 ASP H . . 4.600 4.445 4.383 4.571 . 0 0 "[ . 1 . 2]" 1
1068 1 45 PHE H 1 52 SER HA . . 4.730 4.646 4.388 4.800 0.070 6 0 "[ . 1 . 2]" 1
1069 1 45 PHE H 1 53 ILE MD . . 5.160 4.674 3.698 5.248 0.088 11 0 "[ . 1 . 2]" 1
1070 1 45 PHE H 1 72 ARG QB . . 4.940 3.587 2.929 4.139 . 0 0 "[ . 1 . 2]" 1
1071 1 45 PHE H 1 72 ARG QD . . 5.500 4.855 4.318 5.550 0.050 16 0 "[ . 1 . 2]" 1
1072 1 45 PHE H 1 73 THR H . . 3.450 2.652 2.461 3.202 . 0 0 "[ . 1 . 2]" 1
1073 1 45 PHE H 1 73 THR HA . . 5.280 4.822 4.708 5.007 . 0 0 "[ . 1 . 2]" 1
1074 1 45 PHE H 1 73 THR HB . . 3.870 3.502 2.882 3.787 . 0 0 "[ . 1 . 2]" 1
1075 1 45 PHE H 1 73 THR MG . . 4.360 4.361 4.125 4.439 0.079 20 0 "[ . 1 . 2]" 1
1076 1 45 PHE H 1 74 GLU H . . 5.450 5.146 4.985 5.370 . 0 0 "[ . 1 . 2]" 1
1077 1 45 PHE H 1 74 GLU HA . . 4.340 4.003 3.812 4.184 . 0 0 "[ . 1 . 2]" 1
1078 1 45 PHE H 1 75 TRP H . . 4.730 4.701 4.462 4.798 0.068 1 0 "[ . 1 . 2]" 1
1079 1 45 PHE HA 1 45 PHE QD . . 4.100 3.759 3.729 3.794 . 0 0 "[ . 1 . 2]" 1
1080 1 45 PHE HA 1 46 ASP H . . 3.200 2.432 2.295 2.669 . 0 0 "[ . 1 . 2]" 1
1081 1 45 PHE HA 1 46 ASP QB . . 5.500 4.250 3.901 4.892 . 0 0 "[ . 1 . 2]" 1
1082 1 45 PHE HA 1 52 SER H . . 5.040 4.749 4.530 4.990 . 0 0 "[ . 1 . 2]" 1
1083 1 45 PHE HA 1 52 SER HA . . 3.450 2.390 2.183 2.682 . 0 0 "[ . 1 . 2]" 1
1084 1 45 PHE HA 1 52 SER QB . . 4.740 4.235 3.992 4.518 . 0 0 "[ . 1 . 2]" 1
1085 1 45 PHE HA 1 53 ILE H . . 3.350 2.914 2.365 3.211 . 0 0 "[ . 1 . 2]" 1
1086 1 45 PHE HA 1 53 ILE HB . . 4.210 3.080 2.438 3.581 . 0 0 "[ . 1 . 2]" 1
1087 1 45 PHE HA 1 53 ILE MD . . 4.010 2.718 2.094 3.288 . 0 0 "[ . 1 . 2]" 1
1088 1 45 PHE HA 1 53 ILE MG . . 4.880 4.532 4.025 4.978 0.098 20 0 "[ . 1 . 2]" 1
1089 1 45 PHE HA 1 72 ARG QG . . 4.460 4.377 3.551 4.558 0.098 6 0 "[ . 1 . 2]" 1
1090 1 45 PHE HB2 1 46 ASP H . . 3.220 2.405 2.197 2.639 . 0 0 "[ . 1 . 2]" 1
1091 1 45 PHE HB2 1 46 ASP QB . . 5.500 4.238 3.827 4.526 . 0 0 "[ . 1 . 2]" 1
1092 1 45 PHE HB2 1 50 GLY H . . 4.590 4.542 4.203 4.653 0.063 14 0 "[ . 1 . 2]" 1
1093 1 45 PHE HB2 1 50 GLY HA2 . . 4.150 3.275 2.707 3.736 . 0 0 "[ . 1 . 2]" 1
1094 1 45 PHE HB2 1 51 LYS H . . 4.350 4.064 3.673 4.366 0.016 19 0 "[ . 1 . 2]" 1
1095 1 45 PHE HB2 1 52 SER H . . 4.630 3.931 3.739 4.125 . 0 0 "[ . 1 . 2]" 1
1096 1 45 PHE HB3 1 52 SER H . . 4.980 4.206 3.908 4.536 . 0 0 "[ . 1 . 2]" 1
1097 1 45 PHE HB3 1 52 SER HA . . 3.430 2.090 1.980 2.196 . 0 0 "[ . 1 . 2]" 1
1098 1 45 PHE HB3 1 53 ILE H . . 3.910 3.678 3.317 3.947 0.037 20 0 "[ . 1 . 2]" 1
1099 1 45 PHE QD 1 46 ASP H . . 3.630 3.342 3.130 3.676 0.046 13 0 "[ . 1 . 2]" 1
1100 1 45 PHE QD 1 47 SER H . . 4.600 3.963 3.397 4.422 . 0 0 "[ . 1 . 2]" 1
1101 1 45 PHE QD 1 47 SER HA . . 3.660 2.915 2.435 3.380 . 0 0 "[ . 1 . 2]" 1
1102 1 45 PHE QD 1 48 VAL H . . 5.390 5.092 4.808 5.444 0.054 12 0 "[ . 1 . 2]" 1
1103 1 45 PHE QD 1 49 SER H . . 5.400 5.076 4.759 5.287 . 0 0 "[ . 1 . 2]" 1
1104 1 45 PHE QD 1 50 GLY H . . 3.860 3.550 3.332 3.804 . 0 0 "[ . 1 . 2]" 1
1105 1 45 PHE QD 1 50 GLY HA2 . . 4.040 2.119 1.996 2.204 . 0 0 "[ . 1 . 2]" 1
1106 1 45 PHE QD 1 50 GLY HA3 . . 3.750 3.792 3.658 3.832 0.082 17 0 "[ . 1 . 2]" 1
1107 1 45 PHE QD 1 51 LYS H . . 4.530 4.386 4.135 4.596 0.066 16 0 "[ . 1 . 2]" 1
1108 1 45 PHE QD 1 52 SER H . . 5.500 5.533 5.312 5.585 0.085 19 0 "[ . 1 . 2]" 1
1109 1 45 PHE QD 1 52 SER HA . . 5.500 4.096 3.970 4.228 . 0 0 "[ . 1 . 2]" 1
1110 1 45 PHE QD 1 53 ILE H . . 5.130 5.110 4.880 5.210 0.080 7 0 "[ . 1 . 2]" 1
1111 1 45 PHE QD 1 73 THR H . . 4.910 4.601 4.240 4.925 0.015 3 0 "[ . 1 . 2]" 1
1112 1 45 PHE QD 1 73 THR HB . . 3.980 3.817 3.430 4.060 0.080 17 0 "[ . 1 . 2]" 1
1113 1 45 PHE QD 1 73 THR MG . . 4.410 4.358 4.175 4.502 0.092 20 0 "[ . 1 . 2]" 1
1114 1 45 PHE QD 1 75 TRP H . . 4.840 4.379 3.877 4.867 0.027 13 0 "[ . 1 . 2]" 1
1115 1 45 PHE QD 1 75 TRP HB2 . . 4.880 4.058 3.709 4.457 . 0 0 "[ . 1 . 2]" 1
1116 1 45 PHE QE 1 47 SER H . . 5.330 4.750 4.045 5.386 0.056 16 0 "[ . 1 . 2]" 1
1117 1 45 PHE QE 1 47 SER HA . . 3.660 2.660 2.211 3.178 . 0 0 "[ . 1 . 2]" 1
1118 1 45 PHE QE 1 50 GLY H . . 5.500 4.959 4.590 5.315 . 0 0 "[ . 1 . 2]" 1
1119 1 45 PHE QE 1 50 GLY HA3 . . 5.080 4.705 4.478 4.951 . 0 0 "[ . 1 . 2]" 1
1120 1 45 PHE QE 1 73 THR H . . 5.500 5.290 4.812 5.552 0.052 2 0 "[ . 1 . 2]" 1
1121 1 45 PHE QE 1 73 THR HB . . 3.870 3.494 2.928 3.919 0.049 7 0 "[ . 1 . 2]" 1
1122 1 45 PHE QE 1 73 THR MG . . 3.690 3.315 3.044 3.601 . 0 0 "[ . 1 . 2]" 1
1123 1 45 PHE QE 1 75 TRP H . . 4.150 3.829 3.534 4.213 0.063 13 0 "[ . 1 . 2]" 1
1124 1 45 PHE QE 1 75 TRP HB2 . . 3.800 2.323 2.054 2.735 . 0 0 "[ . 1 . 2]" 1
1125 1 45 PHE QE 1 75 TRP HD1 . . 5.090 4.707 4.291 5.140 0.050 13 0 "[ . 1 . 2]" 1
1126 1 45 PHE QE 1 75 TRP HE1 . . 5.230 5.097 4.914 5.303 0.073 11 0 "[ . 1 . 2]" 1
1127 1 45 PHE QE 1 75 TRP HE3 . . 4.010 3.046 2.862 3.228 . 0 0 "[ . 1 . 2]" 1
1128 1 45 PHE QE 1 75 TRP HH2 . . 4.990 4.790 4.458 5.033 0.043 17 0 "[ . 1 . 2]" 1
1129 1 45 PHE QE 1 75 TRP HZ3 . . 4.750 4.374 4.066 4.549 . 0 0 "[ . 1 . 2]" 1
1130 1 45 PHE QE 1 77 TYR QE . . 4.680 4.544 3.844 4.797 0.117 12 0 "[ . 1 . 2]" 1
1131 1 46 ASP H 1 46 ASP QB . . 3.110 2.247 2.028 2.536 . 0 0 "[ . 1 . 2]" 1
1132 1 46 ASP H 1 47 SER HA . . 5.500 5.143 4.806 5.518 0.018 16 0 "[ . 1 . 2]" 1
1133 1 46 ASP H 1 49 SER QB . . 5.340 5.403 5.254 5.438 0.098 1 0 "[ . 1 . 2]" 1
1134 1 46 ASP H 1 50 GLY H . . 4.230 4.096 3.624 4.294 0.064 13 0 "[ . 1 . 2]" 1
1135 1 46 ASP H 1 51 LYS H . . 3.980 3.527 2.998 4.004 0.024 12 0 "[ . 1 . 2]" 1
1136 1 46 ASP H 1 51 LYS QB . . 3.840 3.239 3.024 3.486 . 0 0 "[ . 1 . 2]" 1
1137 1 46 ASP H 1 52 SER H . . 5.110 4.792 4.600 5.111 0.001 2 0 "[ . 1 . 2]" 1
1138 1 46 ASP H 1 52 SER HA . . 4.280 3.782 3.414 4.105 . 0 0 "[ . 1 . 2]" 1
1139 1 46 ASP H 1 53 ILE MD . . 4.000 3.075 2.367 3.632 . 0 0 "[ . 1 . 2]" 1
1140 1 46 ASP QB 1 47 SER H . . 3.710 3.700 3.160 3.804 0.094 3 0 "[ . 1 . 2]" 1
1141 1 46 ASP QB 1 48 VAL H . . 4.430 3.219 2.618 3.914 . 0 0 "[ . 1 . 2]" 1
1142 1 46 ASP QB 1 49 SER H . . 4.040 3.153 2.552 3.979 . 0 0 "[ . 1 . 2]" 1
1143 1 46 ASP QB 1 50 GLY H . . 3.970 3.196 2.510 3.965 . 0 0 "[ . 1 . 2]" 1
1144 1 46 ASP QB 1 51 LYS H . . 3.550 2.933 2.468 3.453 . 0 0 "[ . 1 . 2]" 1
1145 1 46 ASP QB 1 51 LYS QB . . 4.230 2.426 2.033 3.167 . 0 0 "[ . 1 . 2]" 1
1146 1 46 ASP QB 1 51 LYS QE . . 3.270 2.366 1.939 3.028 . 0 0 "[ . 1 . 2]" 1
1147 1 46 ASP QB 1 53 ILE MD . . 4.340 3.198 2.131 4.242 . 0 0 "[ . 1 . 2]" 1
1148 1 47 SER H 1 47 SER HB3 . . 3.280 2.889 2.504 3.360 0.080 12 0 "[ . 1 . 2]" 1
1149 1 47 SER H 1 48 VAL H . . 3.320 2.870 2.580 2.979 . 0 0 "[ . 1 . 2]" 1
1150 1 47 SER H 1 48 VAL MG1 . . 4.060 4.019 3.824 4.137 0.077 7 0 "[ . 1 . 2]" 1
1151 1 47 SER H 1 48 VAL MG2 . . 3.880 3.958 3.840 3.982 0.102 9 0 "[ . 1 . 2]" 1
1152 1 47 SER H 1 50 GLY H . . 4.920 4.761 4.507 4.947 0.027 10 0 "[ . 1 . 2]" 1
1153 1 47 SER H 1 72 ARG H . . 5.500 5.397 4.781 5.568 0.068 6 0 "[ . 1 . 2]" 1
1154 1 47 SER H 1 72 ARG QG . . 5.480 5.160 4.634 5.546 0.066 20 0 "[ . 1 . 2]" 1
1155 1 47 SER H 1 73 THR HB . . 4.290 3.893 3.107 4.353 0.063 16 0 "[ . 1 . 2]" 1
1156 1 47 SER HA 1 50 GLY HA2 . . 4.230 3.640 2.714 4.290 0.060 9 0 "[ . 1 . 2]" 1
1157 1 47 SER HA 1 73 THR HB . . 4.300 4.052 3.410 4.361 0.061 13 0 "[ . 1 . 2]" 1
1158 1 47 SER HA 1 73 THR MG . . 5.500 4.547 3.666 5.027 . 0 0 "[ . 1 . 2]" 1
1159 1 47 SER QB 1 48 VAL H . . 3.630 3.147 2.848 3.396 . 0 0 "[ . 1 . 2]" 1
1160 1 47 SER QB 1 48 VAL MG1 . . 5.340 3.449 2.889 3.933 . 0 0 "[ . 1 . 2]" 1
1161 1 47 SER QB 1 48 VAL MG2 . . 4.910 4.399 3.993 4.707 . 0 0 "[ . 1 . 2]" 1
1162 1 48 VAL H 1 48 VAL HB . . 3.790 3.571 3.516 3.629 . 0 0 "[ . 1 . 2]" 1
1163 1 48 VAL H 1 48 VAL MG1 . . 2.780 2.264 2.059 2.503 . 0 0 "[ . 1 . 2]" 1
1164 1 48 VAL H 1 48 VAL MG2 . . 3.310 1.878 1.764 1.943 . 0 0 "[ . 1 . 2]" 1
1165 1 48 VAL H 1 49 SER HA . . 5.300 5.288 5.106 5.363 0.063 4 0 "[ . 1 . 2]" 1
1166 1 48 VAL H 1 50 GLY H . . 3.600 3.645 3.445 3.679 0.079 5 0 "[ . 1 . 2]" 1
1167 1 48 VAL H 1 50 GLY HA2 . . 5.500 5.259 4.953 5.386 . 0 0 "[ . 1 . 2]" 1
1168 1 48 VAL H 1 51 LYS QE . . 4.760 4.725 4.149 4.848 0.088 14 0 "[ . 1 . 2]" 1
1169 1 48 VAL HA 1 48 VAL MG1 . . 2.750 2.306 2.251 2.358 . 0 0 "[ . 1 . 2]" 1
1170 1 48 VAL HA 1 48 VAL MG2 . . 3.210 3.259 3.194 3.277 0.067 11 0 "[ . 1 . 2]" 1
1171 1 48 VAL HB 1 49 SER H . . 3.740 3.674 3.461 3.801 0.061 3 0 "[ . 1 . 2]" 1
1172 1 48 VAL HB 1 49 SER QB . . 5.340 4.199 3.814 4.829 . 0 0 "[ . 1 . 2]" 1
1173 1 48 VAL MG1 1 49 SER H . . 4.010 3.991 3.840 4.072 0.062 14 0 "[ . 1 . 2]" 1
1174 1 48 VAL MG1 1 50 GLY H . . 5.370 5.250 5.069 5.401 0.031 17 0 "[ . 1 . 2]" 1
1175 1 48 VAL MG2 1 49 SER H . . 3.350 2.096 1.860 2.295 . 0 0 "[ . 1 . 2]" 1
1176 1 48 VAL MG2 1 49 SER HA . . 3.910 3.967 3.801 4.000 0.090 20 0 "[ . 1 . 2]" 1
1177 1 48 VAL MG2 1 49 SER QB . . 4.210 2.486 2.286 2.912 . 0 0 "[ . 1 . 2]" 1
1178 1 48 VAL MG2 1 49 SER HB3 . . 4.830 3.597 2.842 4.099 . 0 0 "[ . 1 . 2]" 1
1179 1 48 VAL MG2 1 50 GLY H . . 4.380 3.521 3.172 3.838 . 0 0 "[ . 1 . 2]" 1
1180 1 49 SER H 1 49 SER QB . . 2.910 2.312 2.121 2.551 . 0 0 "[ . 1 . 2]" 1
1181 1 49 SER H 1 49 SER HB3 . . 3.350 3.061 2.489 3.435 0.085 9 0 "[ . 1 . 2]" 1
1182 1 49 SER H 1 50 GLY H . . 3.080 1.917 1.835 2.012 . 0 0 "[ . 1 . 2]" 1
1183 1 49 SER H 1 50 GLY HA3 . . 4.620 4.669 4.565 4.695 0.075 19 0 "[ . 1 . 2]" 1
1184 1 49 SER H 1 51 LYS H . . 3.750 3.455 3.258 3.713 . 0 0 "[ . 1 . 2]" 1
1185 1 49 SER H 1 51 LYS QB . . 5.130 4.836 4.181 5.203 0.073 20 0 "[ . 1 . 2]" 1
1186 1 49 SER H 1 51 LYS QE . . 3.850 3.399 3.123 3.638 . 0 0 "[ . 1 . 2]" 1
1187 1 49 SER QB 1 50 GLY H . . 3.420 2.889 2.612 3.195 . 0 0 "[ . 1 . 2]" 1
1188 1 49 SER QB 1 51 LYS H . . 3.700 2.672 2.357 3.180 . 0 0 "[ . 1 . 2]" 1
1189 1 49 SER HB3 1 50 GLY H . . 3.930 3.357 2.863 3.982 0.052 14 0 "[ . 1 . 2]" 1
1190 1 49 SER HB3 1 51 LYS H . . 4.320 3.048 2.371 4.013 . 0 0 "[ . 1 . 2]" 1
1191 1 49 SER HB3 1 51 LYS QG . . 4.800 2.857 1.970 4.308 . 0 0 "[ . 1 . 2]" 1
1192 1 50 GLY H 1 51 LYS H . . 3.290 2.311 2.114 2.537 . 0 0 "[ . 1 . 2]" 1
1193 1 50 GLY H 1 51 LYS HA . . 5.030 4.973 4.796 5.086 0.056 12 0 "[ . 1 . 2]" 1
1194 1 50 GLY H 1 51 LYS QB . . 4.540 4.326 3.892 4.556 0.016 4 0 "[ . 1 . 2]" 1
1195 1 50 GLY H 1 51 LYS QE . . 4.000 3.975 3.374 4.080 0.080 9 0 "[ . 1 . 2]" 1
1196 1 50 GLY H 1 51 LYS QG . . 4.770 4.338 3.664 4.859 0.089 20 0 "[ . 1 . 2]" 1
1197 1 50 GLY HA2 1 51 LYS H . . 3.550 3.264 3.155 3.371 . 0 0 "[ . 1 . 2]" 1
1198 1 51 LYS H 1 51 LYS QB . . 2.800 2.527 2.270 2.732 . 0 0 "[ . 1 . 2]" 1
1199 1 51 LYS H 1 51 LYS QE . . 3.360 3.135 2.456 3.454 0.094 20 0 "[ . 1 . 2]" 1
1200 1 51 LYS H 1 51 LYS QG . . 3.320 2.497 1.985 3.023 . 0 0 "[ . 1 . 2]" 1
1201 1 51 LYS H 1 52 SER H . . 4.670 4.503 4.418 4.605 . 0 0 "[ . 1 . 2]" 1
1202 1 51 LYS H 1 53 ILE MD . . 5.500 5.232 4.902 5.592 0.092 7 0 "[ . 1 . 2]" 1
1203 1 51 LYS HA 1 51 LYS QG . . 3.140 2.470 2.274 2.600 . 0 0 "[ . 1 . 2]" 1
1204 1 51 LYS HA 1 52 SER H . . 2.720 2.206 2.138 2.304 . 0 0 "[ . 1 . 2]" 1
1205 1 51 LYS QB 1 52 SER H . . 3.550 3.433 3.168 3.547 . 0 0 "[ . 1 . 2]" 1
1206 1 51 LYS QE 1 51 LYS QG . . 3.080 2.544 2.276 2.981 . 0 0 "[ . 1 . 2]" 1
1207 1 51 LYS QE 1 53 ILE MD . . 5.500 4.422 3.813 5.344 . 0 0 "[ . 1 . 2]" 1
1208 1 51 LYS QG 1 52 SER H . . 4.410 4.334 4.135 4.487 0.077 3 0 "[ . 1 . 2]" 1
1209 1 52 SER H 1 52 SER QB . . 3.060 2.611 2.309 2.963 . 0 0 "[ . 1 . 2]" 1
1210 1 52 SER H 1 52 SER HB3 . . 3.550 3.123 2.586 3.600 0.050 5 0 "[ . 1 . 2]" 1
1211 1 52 SER H 1 53 ILE H . . 4.650 4.642 4.588 4.695 0.045 8 0 "[ . 1 . 2]" 1
1212 1 52 SER HA 1 53 ILE H . . 2.960 2.284 2.184 2.392 . 0 0 "[ . 1 . 2]" 1
1213 1 52 SER HA 1 53 ILE HB . . 4.250 4.042 3.854 4.279 0.029 3 0 "[ . 1 . 2]" 1
1214 1 52 SER HA 1 53 ILE MD . . 5.500 3.659 2.973 4.020 . 0 0 "[ . 1 . 2]" 1
1215 1 52 SER QB 1 53 ILE H . . 3.270 2.740 2.519 3.153 . 0 0 "[ . 1 . 2]" 1
1216 1 52 SER QB 1 53 ILE HA . . 4.390 4.324 4.078 4.447 0.057 1 0 "[ . 1 . 2]" 1
1217 1 52 SER HB3 1 53 ILE H . . 3.790 3.371 2.567 3.851 0.061 18 0 "[ . 1 . 2]" 1
1218 1 53 ILE H 1 53 ILE HB . . 3.180 2.404 2.153 2.543 . 0 0 "[ . 1 . 2]" 1
1219 1 53 ILE H 1 53 ILE MD . . 3.720 3.293 2.825 3.610 . 0 0 "[ . 1 . 2]" 1
1220 1 53 ILE H 1 53 ILE MG . . 3.570 3.326 3.149 3.652 0.082 3 0 "[ . 1 . 2]" 1
1221 1 53 ILE H 1 54 PRO HD2 . . 4.940 4.956 4.827 4.992 0.052 19 0 "[ . 1 . 2]" 1
1222 1 53 ILE H 1 58 TRP HD1 . . 5.500 5.458 5.262 5.565 0.065 4 0 "[ . 1 . 2]" 1
1223 1 53 ILE H 1 58 TRP HE1 . . 4.340 4.049 3.764 4.265 . 0 0 "[ . 1 . 2]" 1
1224 1 53 ILE H 1 72 ARG QD . . 5.470 5.419 4.935 5.547 0.077 11 0 "[ . 1 . 2]" 1
1225 1 53 ILE HA 1 53 ILE MD . . 3.240 2.806 2.412 3.299 0.059 11 0 "[ . 1 . 2]" 1
1226 1 53 ILE HA 1 53 ILE MG . . 3.260 2.858 2.481 3.032 . 0 0 "[ . 1 . 2]" 1
1227 1 53 ILE HA 1 54 PRO HD2 . . 3.250 2.476 2.192 2.623 . 0 0 "[ . 1 . 2]" 1
1228 1 53 ILE HA 1 54 PRO QG . . 4.050 4.045 3.880 4.112 0.062 6 0 "[ . 1 . 2]" 1
1229 1 53 ILE HA 1 58 TRP HE1 . . 5.380 5.035 4.811 5.404 0.024 6 0 "[ . 1 . 2]" 1
1230 1 53 ILE HB 1 53 ILE MD . . 3.210 2.235 2.080 2.354 . 0 0 "[ . 1 . 2]" 1
1231 1 53 ILE HB 1 54 PRO HD2 . . 5.500 4.278 4.082 4.447 . 0 0 "[ . 1 . 2]" 1
1232 1 53 ILE HB 1 58 TRP HD1 . . 4.340 4.292 3.833 4.406 0.066 6 0 "[ . 1 . 2]" 1
1233 1 53 ILE HB 1 58 TRP HE1 . . 4.410 4.100 3.545 4.400 . 0 0 "[ . 1 . 2]" 1
1234 1 53 ILE HB 1 72 ARG QD . . 4.310 3.443 3.086 3.862 . 0 0 "[ . 1 . 2]" 1
1235 1 53 ILE MD 1 53 ILE MG . . 3.150 3.093 2.810 3.205 0.055 6 0 "[ . 1 . 2]" 1
1236 1 53 ILE MD 1 54 PRO HD2 . . 4.650 4.233 3.755 4.722 0.072 3 0 "[ . 1 . 2]" 1
1237 1 53 ILE MD 1 57 GLU QB . . 5.340 4.437 3.823 5.356 0.016 20 0 "[ . 1 . 2]" 1
1238 1 53 ILE MD 1 57 GLU QG . . 4.790 4.653 3.839 4.910 0.120 3 0 "[ . 1 . 2]" 1
1239 1 53 ILE MD 1 58 TRP HD1 . . 5.500 5.544 5.357 5.598 0.098 1 0 "[ . 1 . 2]" 1
1240 1 53 ILE MD 1 72 ARG QB . . 4.840 4.031 2.333 4.722 . 0 0 "[ . 1 . 2]" 1
1241 1 53 ILE MD 1 72 ARG QD . . 3.520 2.795 1.929 3.477 . 0 0 "[ . 1 . 2]" 1
1242 1 53 ILE MD 1 72 ARG QG . . 2.970 2.813 2.250 3.071 0.101 9 0 "[ . 1 . 2]" 1
1243 1 53 ILE MG 1 54 PRO HD2 . . 3.390 2.182 1.951 2.260 . 0 0 "[ . 1 . 2]" 1
1244 1 53 ILE MG 1 57 GLU H . . 3.770 3.285 2.983 3.642 . 0 0 "[ . 1 . 2]" 1
1245 1 53 ILE MG 1 57 GLU HA . . 5.500 4.301 4.032 4.697 . 0 0 "[ . 1 . 2]" 1
1246 1 53 ILE MG 1 57 GLU QB . . 3.070 1.965 1.717 2.149 . 0 0 "[ . 1 . 2]" 1
1247 1 53 ILE MG 1 57 GLU HB3 . . 3.550 2.210 1.885 2.875 . 0 0 "[ . 1 . 2]" 1
1248 1 53 ILE MG 1 57 GLU QG . . 3.780 3.290 2.325 3.808 0.028 14 0 "[ . 1 . 2]" 1
1249 1 53 ILE MG 1 58 TRP H . . 3.800 3.644 3.400 3.857 0.057 13 0 "[ . 1 . 2]" 1
1250 1 53 ILE MG 1 58 TRP HA . . 3.430 3.370 2.994 3.529 0.099 10 0 "[ . 1 . 2]" 1
1251 1 53 ILE MG 1 58 TRP HB2 . . 4.830 4.859 4.750 4.916 0.086 11 0 "[ . 1 . 2]" 1
1252 1 53 ILE MG 1 58 TRP HD1 . . 3.090 1.981 1.919 2.064 . 0 0 "[ . 1 . 2]" 1
1253 1 53 ILE MG 1 58 TRP HE1 . . 3.430 2.404 2.216 2.773 . 0 0 "[ . 1 . 2]" 1
1254 1 53 ILE MG 1 72 ARG QD . . 4.170 2.945 2.144 4.264 0.094 19 0 "[ . 1 . 2]" 1
1255 1 53 ILE MG 1 72 ARG QG . . 4.940 3.750 2.603 4.568 . 0 0 "[ . 1 . 2]" 1
1256 1 54 PRO HA 1 55 ARG H . . 2.760 2.342 2.256 2.447 . 0 0 "[ . 1 . 2]" 1
1257 1 54 PRO HA 1 55 ARG HB2 . . 4.370 4.364 4.223 4.435 0.065 7 0 "[ . 1 . 2]" 1
1258 1 54 PRO HA 1 56 SER H . . 4.290 4.207 3.893 4.336 0.046 9 0 "[ . 1 . 2]" 1
1259 1 54 PRO HA 1 58 TRP HE1 . . 4.230 3.832 3.492 4.267 0.037 6 0 "[ . 1 . 2]" 1
1260 1 54 PRO QB 1 55 ARG H . . 3.250 2.832 2.631 3.049 . 0 0 "[ . 1 . 2]" 1
1261 1 54 PRO QB 1 56 SER H . . 3.760 2.581 2.242 2.666 . 0 0 "[ . 1 . 2]" 1
1262 1 54 PRO HB3 1 55 ARG H . . 3.880 3.770 3.594 3.917 0.037 19 0 "[ . 1 . 2]" 1
1263 1 54 PRO HB3 1 56 SER H . . 4.350 4.333 3.945 4.411 0.061 18 0 "[ . 1 . 2]" 1
1264 1 54 PRO HD2 1 57 GLU QB . . 4.010 2.407 2.014 2.717 . 0 0 "[ . 1 . 2]" 1
1265 1 54 PRO HD2 1 57 GLU QG . . 5.500 3.343 2.221 3.892 . 0 0 "[ . 1 . 2]" 1
1266 1 54 PRO HD2 1 58 TRP HE1 . . 5.500 5.150 4.790 5.520 0.020 7 0 "[ . 1 . 2]" 1
1267 1 54 PRO QG 1 56 SER H . . 4.360 3.369 2.991 3.849 . 0 0 "[ . 1 . 2]" 1
1268 1 54 PRO QG 1 57 GLU H . . 5.450 3.019 2.682 3.285 . 0 0 "[ . 1 . 2]" 1
1269 1 55 ARG H 1 55 ARG HB2 . . 3.080 2.198 1.921 2.321 . 0 0 "[ . 1 . 2]" 1
1270 1 55 ARG H 1 55 ARG QD . . 4.310 4.276 3.976 4.412 0.102 9 0 "[ . 1 . 2]" 1
1271 1 55 ARG H 1 55 ARG QG . . 3.910 3.840 3.492 3.963 0.053 4 0 "[ . 1 . 2]" 1
1272 1 55 ARG H 1 56 SER H . . 3.840 2.855 2.665 3.032 . 0 0 "[ . 1 . 2]" 1
1273 1 55 ARG H 1 56 SER QB . . 4.870 4.778 4.231 4.952 0.082 4 0 "[ . 1 . 2]" 1
1274 1 55 ARG H 1 57 GLU H . . 4.690 4.396 4.177 4.587 . 0 0 "[ . 1 . 2]" 1
1275 1 55 ARG H 1 58 TRP H . . 5.360 5.294 5.020 5.435 0.075 13 0 "[ . 1 . 2]" 1
1276 1 55 ARG H 1 58 TRP HE1 . . 4.360 4.069 3.598 4.420 0.060 6 0 "[ . 1 . 2]" 1
1277 1 55 ARG HA 1 55 ARG QD . . 3.900 3.733 2.414 3.963 0.063 8 0 "[ . 1 . 2]" 1
1278 1 55 ARG HA 1 55 ARG QG . . 3.570 2.199 2.093 2.338 . 0 0 "[ . 1 . 2]" 1
1279 1 55 ARG HA 1 57 GLU H . . 4.990 3.581 3.432 3.849 . 0 0 "[ . 1 . 2]" 1
1280 1 55 ARG HA 1 58 TRP H . . 3.510 3.260 3.032 3.421 . 0 0 "[ . 1 . 2]" 1
1281 1 55 ARG HA 1 58 TRP HB2 . . 4.530 3.290 2.943 3.544 . 0 0 "[ . 1 . 2]" 1
1282 1 55 ARG HA 1 58 TRP HD1 . . 3.600 3.147 2.923 3.377 . 0 0 "[ . 1 . 2]" 1
1283 1 55 ARG HA 1 58 TRP HE1 . . 3.410 3.203 3.091 3.379 . 0 0 "[ . 1 . 2]" 1
1284 1 55 ARG HA 1 58 TRP HE3 . . 4.750 4.303 3.953 4.669 . 0 0 "[ . 1 . 2]" 1
1285 1 55 ARG HA 1 58 TRP HZ2 . . 4.580 4.303 4.068 4.599 0.019 7 0 "[ . 1 . 2]" 1
1286 1 55 ARG HB2 1 55 ARG QD . . 3.740 2.371 2.159 3.492 . 0 0 "[ . 1 . 2]" 1
1287 1 55 ARG HB2 1 56 SER H . . 4.680 3.933 3.639 4.210 . 0 0 "[ . 1 . 2]" 1
1288 1 55 ARG QD 1 56 SER H . . 5.500 5.298 4.394 5.574 0.074 18 0 "[ . 1 . 2]" 1
1289 1 55 ARG QD 1 58 TRP HZ2 . . 5.230 4.716 3.842 5.292 0.062 9 0 "[ . 1 . 2]" 1
1290 1 55 ARG QD 1 58 TRP HZ3 . . 4.370 4.001 3.274 4.445 0.075 5 0 "[ . 1 . 2]" 1
1291 1 55 ARG QG 1 56 SER H . . 4.840 4.264 3.940 4.479 . 0 0 "[ . 1 . 2]" 1
1292 1 55 ARG QG 1 56 SER HA . . 4.920 4.457 3.946 5.020 0.100 9 0 "[ . 1 . 2]" 1
1293 1 55 ARG QG 1 58 TRP H . . 4.660 4.287 3.864 4.757 0.097 9 0 "[ . 1 . 2]" 1
1294 1 55 ARG QG 1 58 TRP HE1 . . 4.810 4.545 4.126 4.866 0.056 17 0 "[ . 1 . 2]" 1
1295 1 55 ARG QG 1 58 TRP HE3 . . 4.330 3.149 2.811 3.577 . 0 0 "[ . 1 . 2]" 1
1296 1 55 ARG QG 1 58 TRP HH2 . . 4.600 4.347 3.530 4.657 0.057 8 0 "[ . 1 . 2]" 1
1297 1 55 ARG QG 1 58 TRP HZ2 . . 4.520 4.323 3.471 4.595 0.075 13 0 "[ . 1 . 2]" 1
1298 1 55 ARG QG 1 58 TRP HZ3 . . 4.290 3.811 3.406 4.139 . 0 0 "[ . 1 . 2]" 1
1299 1 56 SER H 1 56 SER QB . . 3.570 2.329 1.992 2.644 . 0 0 "[ . 1 . 2]" 1
1300 1 56 SER H 1 57 GLU QB . . 4.630 4.394 4.038 4.592 . 0 0 "[ . 1 . 2]" 1
1301 1 56 SER H 1 58 TRP H . . 4.640 4.250 3.984 4.440 . 0 0 "[ . 1 . 2]" 1
1302 1 56 SER HA 1 57 GLU H . . 3.480 3.454 3.328 3.546 0.066 10 0 "[ . 1 . 2]" 1
1303 1 56 SER HA 1 57 GLU HA . . 5.500 4.642 4.545 4.787 . 0 0 "[ . 1 . 2]" 1
1304 1 56 SER HA 1 58 TRP H . . 4.030 4.025 3.822 4.104 0.074 19 0 "[ . 1 . 2]" 1
1305 1 56 SER QB 1 57 GLU H . . 4.020 3.397 3.101 3.938 . 0 0 "[ . 1 . 2]" 1
1306 1 57 GLU H 1 57 GLU QB . . 2.850 2.243 2.081 2.399 . 0 0 "[ . 1 . 2]" 1
1307 1 57 GLU H 1 57 GLU HB3 . . 3.320 3.184 2.423 3.397 0.077 1 0 "[ . 1 . 2]" 1
1308 1 57 GLU H 1 57 GLU QG . . 4.280 3.933 2.778 4.200 . 0 0 "[ . 1 . 2]" 1
1309 1 57 GLU H 1 58 TRP H . . 2.860 2.130 1.971 2.288 . 0 0 "[ . 1 . 2]" 1
1310 1 57 GLU H 1 58 TRP HD1 . . 3.320 3.282 3.092 3.370 0.050 1 0 "[ . 1 . 2]" 1
1311 1 57 GLU HA 1 57 GLU QB . . 2.640 2.529 2.434 2.579 . 0 0 "[ . 1 . 2]" 1
1312 1 57 GLU HA 1 57 GLU QG . . 3.220 2.388 2.053 2.763 . 0 0 "[ . 1 . 2]" 1
1313 1 57 GLU HA 1 59 GLY H . . 4.380 3.529 3.022 4.179 . 0 0 "[ . 1 . 2]" 1
1314 1 57 GLU HA 1 60 ARG H . . 3.710 3.132 2.754 3.792 0.082 17 0 "[ . 1 . 2]" 1
1315 1 57 GLU HA 1 60 ARG QD . . 4.690 4.075 2.778 4.775 0.085 20 0 "[ . 1 . 2]" 1
1316 1 57 GLU QB 1 58 TRP H . . 3.500 3.346 3.099 3.557 0.057 7 0 "[ . 1 . 2]" 1
1317 1 57 GLU QB 1 58 TRP HD1 . . 4.560 3.326 2.909 3.596 . 0 0 "[ . 1 . 2]" 1
1318 1 57 GLU HB3 1 58 TRP H . . 4.020 3.781 3.213 4.089 0.069 13 0 "[ . 1 . 2]" 1
1319 1 57 GLU QG 1 58 TRP H . . 4.920 4.806 4.376 4.964 0.044 15 0 "[ . 1 . 2]" 1
1320 1 58 TRP H 1 58 TRP HA . . 2.820 2.832 2.761 2.891 0.071 13 0 "[ . 1 . 2]" 1
1321 1 58 TRP H 1 58 TRP HB2 . . 2.910 2.379 2.225 2.564 . 0 0 "[ . 1 . 2]" 1
1322 1 58 TRP H 1 58 TRP HD1 . . 3.100 2.569 2.330 2.813 . 0 0 "[ . 1 . 2]" 1
1323 1 58 TRP H 1 58 TRP HE1 . . 4.810 4.734 4.498 4.881 0.071 11 0 "[ . 1 . 2]" 1
1324 1 58 TRP H 1 59 GLY H . . 3.900 2.826 2.526 3.041 . 0 0 "[ . 1 . 2]" 1
1325 1 58 TRP H 1 59 GLY QA . . 5.220 4.734 4.571 4.890 . 0 0 "[ . 1 . 2]" 1
1326 1 58 TRP H 1 60 ARG H . . 4.630 4.099 3.776 4.688 0.058 16 0 "[ . 1 . 2]" 1
1327 1 58 TRP HA 1 58 TRP HD1 . . 3.110 2.563 2.416 2.794 . 0 0 "[ . 1 . 2]" 1
1328 1 58 TRP HA 1 58 TRP HE3 . . 5.150 4.956 4.793 5.033 . 0 0 "[ . 1 . 2]" 1
1329 1 58 TRP HB2 1 58 TRP HE3 . . 4.020 3.195 3.083 3.270 . 0 0 "[ . 1 . 2]" 1
1330 1 58 TRP HB2 1 58 TRP HZ3 . . 5.500 5.504 5.396 5.565 0.065 18 0 "[ . 1 . 2]" 1
1331 1 58 TRP HB2 1 59 GLY H . . 4.730 3.307 2.760 3.931 . 0 0 "[ . 1 . 2]" 1
1332 1 58 TRP HD1 1 59 GLY H . . 4.830 4.857 4.704 4.895 0.065 1 0 "[ . 1 . 2]" 1
1333 1 59 GLY H 1 60 ARG H . . 3.940 2.050 1.620 2.427 . 0 0 "[ . 1 . 2]" 1
1334 1 59 GLY H 1 61 ILE H . . 5.500 5.067 3.909 5.567 0.067 8 0 "[ . 1 . 2]" 1
1335 1 59 GLY QA 1 60 ARG H . . 3.050 2.884 2.634 3.054 0.004 10 0 "[ . 1 . 2]" 1
1336 1 60 ARG H 1 60 ARG QB . . 2.930 2.565 2.095 3.022 0.092 3 0 "[ . 1 . 2]" 1
1337 1 60 ARG H 1 60 ARG HB3 . . 3.750 3.370 2.476 3.824 0.074 6 0 "[ . 1 . 2]" 1
1338 1 60 ARG H 1 60 ARG QD . . 4.380 3.392 2.362 4.437 0.057 20 0 "[ . 1 . 2]" 1
1339 1 60 ARG H 1 60 ARG QG . . 4.430 3.642 2.078 4.320 . 0 0 "[ . 1 . 2]" 1
1340 1 60 ARG H 1 61 ILE H . . 4.340 3.434 2.493 4.293 . 0 0 "[ . 1 . 2]" 1
1341 1 60 ARG HA 1 60 ARG QD . . 4.030 3.257 2.229 4.112 0.082 17 0 "[ . 1 . 2]" 1
1342 1 60 ARG HA 1 60 ARG QG . . 3.080 2.553 2.168 3.182 0.102 3 0 "[ . 1 . 2]" 1
1343 1 60 ARG HA 1 60 ARG HG3 . . 3.760 2.879 2.189 3.806 0.046 12 0 "[ . 1 . 2]" 1
1344 1 60 ARG HA 1 61 ILE H . . 2.670 2.426 2.143 2.747 0.077 17 0 "[ . 1 . 2]" 1
1345 1 60 ARG HA 1 62 ASP H . . 4.880 4.229 3.465 4.932 0.052 20 0 "[ . 1 . 2]" 1
1346 1 60 ARG QD 1 61 ILE H . . 5.500 4.764 3.018 5.433 . 0 0 "[ . 1 . 2]" 1
1347 1 60 ARG QG 1 61 ILE H . . 5.340 4.343 3.605 4.929 . 0 0 "[ . 1 . 2]" 1
1348 1 61 ILE H 1 61 ILE HB . . 2.850 2.554 2.292 2.934 0.084 1 0 "[ . 1 . 2]" 1
1349 1 61 ILE H 1 61 ILE HG13 . . 3.960 3.161 2.013 4.039 0.079 7 0 "[ . 1 . 2]" 1
1350 1 61 ILE H 1 61 ILE MG . . 3.840 3.687 1.614 3.927 0.087 16 0 "[ . 1 . 2]" 1
1351 1 61 ILE H 1 62 ASP H . . 3.420 2.649 1.897 3.307 . 0 0 "[ . 1 . 2]" 1
1352 1 61 ILE H 1 62 ASP HA . . 5.210 4.821 4.134 5.265 0.055 19 0 "[ . 1 . 2]" 1
1353 1 61 ILE HA 1 61 ILE MD . . 3.930 3.190 2.110 3.994 0.064 20 0 "[ . 1 . 2]" 1
1354 1 61 ILE HA 1 61 ILE QG . . 3.050 2.662 2.203 3.108 0.058 8 0 "[ . 1 . 2]" 1
1355 1 61 ILE HA 1 61 ILE MG . . 2.710 2.451 2.276 2.825 0.115 1 0 "[ . 1 . 2]" 1
1356 1 61 ILE HB 1 61 ILE QG . . 2.600 2.326 2.150 2.535 . 0 0 "[ . 1 . 2]" 1
1357 1 61 ILE HB 1 62 ASP H . . 3.360 2.310 1.743 3.442 0.082 1 0 "[ . 1 . 2]" 1
1358 1 61 ILE HB 1 67 ASN QB . . 5.340 4.758 3.019 5.419 0.079 20 0 "[ . 1 . 2]" 1
1359 1 61 ILE MD 1 67 ASN HA . . 5.500 5.094 3.534 5.582 0.082 3 0 "[ . 1 . 2]" 1
1360 1 61 ILE QG 1 61 ILE MG . . 3.210 2.274 2.017 2.458 . 0 0 "[ . 1 . 2]" 1
1361 1 61 ILE HG13 1 62 ASP H . . 4.820 4.314 2.382 4.850 0.030 13 0 "[ . 1 . 2]" 1
1362 1 61 ILE MG 1 62 ASP H . . 3.370 2.998 2.336 3.458 0.088 3 0 "[ . 1 . 2]" 1
1363 1 61 ILE MG 1 67 ASN QB . . 5.340 3.517 2.164 5.271 . 0 0 "[ . 1 . 2]" 1
1364 1 62 ASP H 1 62 ASP QB . . 3.390 2.806 2.399 3.342 . 0 0 "[ . 1 . 2]" 1
1365 1 62 ASP H 1 62 ASP HB3 . . 3.980 3.383 2.598 4.020 0.040 16 0 "[ . 1 . 2]" 1
1366 1 62 ASP H 1 63 LYS H . . 4.650 3.836 2.719 4.655 0.005 7 0 "[ . 1 . 2]" 1
1367 1 62 ASP HA 1 62 ASP QB . . 2.610 2.394 2.113 2.563 . 0 0 "[ . 1 . 2]" 1
1368 1 62 ASP HA 1 63 LYS H . . 2.710 2.509 2.134 2.774 0.064 13 0 "[ . 1 . 2]" 1
1369 1 63 LYS H 1 63 LYS QB . . 3.120 2.505 2.059 3.212 0.092 8 0 "[ . 1 . 2]" 1
1370 1 63 LYS H 1 63 LYS HB3 . . 3.730 3.249 2.212 3.804 0.074 10 0 "[ . 1 . 2]" 1
1371 1 63 LYS H 1 63 LYS QG . . 3.770 3.274 2.112 3.871 0.101 13 0 "[ . 1 . 2]" 1
1372 1 63 LYS HA 1 63 LYS QB . . 2.530 2.360 1.988 2.497 . 0 0 "[ . 1 . 2]" 1
1373 1 63 LYS HA 1 63 LYS QD . . 4.420 3.666 2.042 4.308 . 0 0 "[ . 1 . 2]" 1
1374 1 63 LYS HA 1 63 LYS QG . . 2.990 2.580 2.171 3.108 0.118 8 0 "[ . 1 . 2]" 1
1375 1 63 LYS HA 1 64 ASP H . . 3.420 3.124 1.989 3.494 0.074 4 0 "[ . 1 . 2]" 1
1376 1 63 LYS HA 1 65 GLY H . . 4.780 4.389 3.812 4.847 0.067 8 0 "[ . 1 . 2]" 1
1377 1 63 LYS QB 1 64 ASP H . . 3.590 2.866 1.976 3.667 0.077 8 0 "[ . 1 . 2]" 1
1378 1 63 LYS QB 1 64 ASP HA . . 5.340 4.411 3.783 5.156 . 0 0 "[ . 1 . 2]" 1
1379 1 63 LYS HB3 1 64 ASP H . . 4.370 3.274 2.001 4.420 0.050 8 0 "[ . 1 . 2]" 1
1380 1 63 LYS QE 1 63 LYS QG . . 3.310 2.427 2.033 2.990 . 0 0 "[ . 1 . 2]" 1
1381 1 63 LYS QG 1 64 ASP H . . 4.460 3.729 2.038 4.524 0.064 3 0 "[ . 1 . 2]" 1
1382 1 64 ASP H 1 64 ASP QB . . 2.970 2.465 2.081 3.053 0.083 12 0 "[ . 1 . 2]" 1
1383 1 64 ASP HA 1 65 GLY H . . 3.560 3.398 2.941 3.603 0.043 10 0 "[ . 1 . 2]" 1
1384 1 64 ASP QB 1 65 GLY H . . 3.850 3.134 2.307 3.924 0.074 12 0 "[ . 1 . 2]" 1
1385 1 64 ASP QB 1 65 GLY QA . . 5.340 4.065 3.620 4.667 . 0 0 "[ . 1 . 2]" 1
1386 1 66 SER H 1 66 SER QB . . 3.600 2.609 2.123 3.180 . 0 0 "[ . 1 . 2]" 1
1387 1 66 SER QB 1 67 ASN H . . 4.220 3.174 2.054 4.093 . 0 0 "[ . 1 . 2]" 1
1388 1 67 ASN HA 1 67 ASN HD21 . . 4.390 3.182 1.976 4.197 . 0 0 "[ . 1 . 2]" 1
1389 1 67 ASN HA 1 67 ASN QD . . 3.710 3.015 1.967 3.804 0.094 12 0 "[ . 1 . 2]" 1
1390 1 67 ASN HA 1 67 ASN HD22 . . 4.390 3.943 3.186 4.437 0.047 13 0 "[ . 1 . 2]" 1
1391 1 67 ASN HA 1 70 GLN QB . . 4.370 3.453 2.221 4.419 0.049 15 0 "[ . 1 . 2]" 1
1392 1 67 ASN HA 1 70 GLN HB3 . . 5.230 4.686 3.273 5.302 0.072 20 0 "[ . 1 . 2]" 1
1393 1 67 ASN HA 1 70 GLN QG . . 5.340 4.394 2.406 5.414 0.074 16 0 "[ . 1 . 2]" 1
1394 1 67 ASN QB 1 67 ASN QD . . 2.920 2.345 2.065 2.866 . 0 0 "[ . 1 . 2]" 1
1395 1 67 ASN HB3 1 68 SER H . . 5.500 4.163 3.046 4.521 . 0 0 "[ . 1 . 2]" 1
1396 1 68 SER HA 1 68 SER QB . . 2.420 2.353 2.164 2.486 0.066 1 0 "[ . 1 . 2]" 1
1397 1 68 SER QB 1 69 LYS H . . 3.910 2.668 1.935 3.958 0.048 9 0 "[ . 1 . 2]" 1
1398 1 69 LYS H 1 70 GLN H . . 4.160 2.861 1.742 4.214 0.054 3 0 "[ . 1 . 2]" 1
1399 1 69 LYS HA 1 69 LYS QD . . 4.660 3.441 2.219 4.462 . 0 0 "[ . 1 . 2]" 1
1400 1 69 LYS HA 1 69 LYS QG . . 3.180 2.863 2.229 3.283 0.103 5 0 "[ . 1 . 2]" 1
1401 1 69 LYS HA 1 70 GLN H . . 3.190 2.953 2.098 3.260 0.070 13 0 "[ . 1 . 2]" 1
1402 1 69 LYS QE 1 69 LYS QG . . 3.270 2.320 2.020 2.516 . 0 0 "[ . 1 . 2]" 1
1403 1 70 GLN H 1 70 GLN QB . . 3.220 2.545 2.134 2.946 . 0 0 "[ . 1 . 2]" 1
1404 1 70 GLN H 1 71 SER H . . 4.710 4.056 1.837 4.618 . 0 0 "[ . 1 . 2]" 1
1405 1 70 GLN H 1 71 SER QB . . 4.750 4.534 3.558 4.838 0.088 17 0 "[ . 1 . 2]" 1
1406 1 70 GLN HA 1 70 GLN QB . . 2.550 2.421 2.279 2.581 0.031 10 0 "[ . 1 . 2]" 1
1407 1 70 GLN HA 1 70 GLN QG . . 2.770 2.471 2.211 2.826 0.056 9 0 "[ . 1 . 2]" 1
1408 1 70 GLN HA 1 71 SER H . . 3.290 2.466 2.160 3.376 0.086 15 0 "[ . 1 . 2]" 1
1409 1 70 GLN HA 1 71 SER QB . . 4.150 4.011 3.731 4.239 0.089 16 0 "[ . 1 . 2]" 1
1410 1 70 GLN QB 1 71 SER H . . 4.000 3.062 2.112 3.875 . 0 0 "[ . 1 . 2]" 1
1411 1 70 GLN HB3 1 71 SER H . . 4.560 3.203 2.133 4.235 . 0 0 "[ . 1 . 2]" 1
1412 1 70 GLN QE 1 70 GLN QG . . 3.010 2.226 2.136 2.508 . 0 0 "[ . 1 . 2]" 1
1413 1 71 SER H 1 72 ARG H . . 4.230 3.529 2.072 4.301 0.071 16 0 "[ . 1 . 2]" 1
1414 1 71 SER H 1 72 ARG HA . . 5.020 4.521 4.022 5.088 0.068 13 0 "[ . 1 . 2]" 1
1415 1 71 SER HA 1 72 ARG H . . 2.680 2.426 2.169 2.755 0.075 15 0 "[ . 1 . 2]" 1
1416 1 72 ARG H 1 72 ARG QB . . 3.290 2.550 2.174 3.357 0.067 16 0 "[ . 1 . 2]" 1
1417 1 72 ARG H 1 72 ARG QD . . 4.550 4.270 3.459 4.614 0.064 12 0 "[ . 1 . 2]" 1
1418 1 72 ARG H 1 72 ARG QG . . 3.610 2.818 2.413 3.663 0.053 12 0 "[ . 1 . 2]" 1
1419 1 72 ARG H 1 73 THR H . . 4.670 4.465 4.296 4.628 . 0 0 "[ . 1 . 2]" 1
1420 1 72 ARG H 1 73 THR HA . . 5.500 5.198 4.755 5.564 0.064 1 0 "[ . 1 . 2]" 1
1421 1 72 ARG HA 1 72 ARG QD . . 4.200 3.570 2.062 4.122 . 0 0 "[ . 1 . 2]" 1
1422 1 72 ARG HA 1 73 THR HA . . 4.690 4.551 4.424 4.688 . 0 0 "[ . 1 . 2]" 1
1423 1 72 ARG HA 1 73 THR HB . . 4.720 4.416 4.157 4.767 0.047 15 0 "[ . 1 . 2]" 1
1424 1 72 ARG QB 1 73 THR H . . 3.120 2.263 1.988 2.639 . 0 0 "[ . 1 . 2]" 1
1425 1 72 ARG QB 1 73 THR HB . . 5.040 4.720 4.107 5.053 0.013 20 0 "[ . 1 . 2]" 1
1426 1 72 ARG HB3 1 72 ARG QD . . 3.850 2.497 2.137 2.729 . 0 0 "[ . 1 . 2]" 1
1427 1 72 ARG HB3 1 73 THR H . . 3.760 2.335 2.014 3.027 . 0 0 "[ . 1 . 2]" 1
1428 1 72 ARG QD 1 73 THR H . . 4.640 4.284 3.570 4.730 0.090 16 0 "[ . 1 . 2]" 1
1429 1 72 ARG QG 1 73 THR H . . 3.910 3.802 3.127 4.001 0.091 17 0 "[ . 1 . 2]" 1
1430 1 73 THR H 1 73 THR HB . . 3.150 2.690 2.355 2.852 . 0 0 "[ . 1 . 2]" 1
1431 1 73 THR H 1 73 THR MG . . 4.080 3.849 3.755 3.902 . 0 0 "[ . 1 . 2]" 1
1432 1 73 THR H 1 74 GLU H . . 4.390 4.223 3.998 4.460 0.070 16 0 "[ . 1 . 2]" 1
1433 1 73 THR HA 1 73 THR MG . . 3.020 2.411 2.230 2.591 . 0 0 "[ . 1 . 2]" 1
1434 1 73 THR HA 1 74 GLU H . . 2.570 2.143 2.007 2.311 . 0 0 "[ . 1 . 2]" 1
1435 1 73 THR HA 1 75 TRP H . . 5.500 5.569 5.513 5.584 0.084 17 0 "[ . 1 . 2]" 1
1436 1 73 THR HA 1 75 TRP HE1 . . 5.500 5.426 5.192 5.568 0.068 17 0 "[ . 1 . 2]" 1
1437 1 73 THR HB 1 74 GLU H . . 4.500 4.193 3.654 4.408 . 0 0 "[ . 1 . 2]" 1
1438 1 73 THR HB 1 75 TRP HE1 . . 4.980 4.994 4.873 5.043 0.063 9 0 "[ . 1 . 2]" 1
1439 1 73 THR MG 1 74 GLU H . . 2.940 2.684 2.310 2.958 0.018 12 0 "[ . 1 . 2]" 1
1440 1 73 THR MG 1 74 GLU HA . . 4.320 3.999 3.659 4.266 . 0 0 "[ . 1 . 2]" 1
1441 1 73 THR MG 1 75 TRP H . . 4.450 3.882 3.396 4.169 . 0 0 "[ . 1 . 2]" 1
1442 1 73 THR MG 1 75 TRP HA . . 5.500 4.157 3.928 4.339 . 0 0 "[ . 1 . 2]" 1
1443 1 73 THR MG 1 75 TRP HD1 . . 3.220 2.460 2.348 2.581 . 0 0 "[ . 1 . 2]" 1
1444 1 73 THR MG 1 75 TRP HE1 . . 2.900 2.389 2.332 2.460 . 0 0 "[ . 1 . 2]" 1
1445 1 73 THR MG 1 75 TRP HE3 . . 5.250 4.949 4.509 5.278 0.028 20 0 "[ . 1 . 2]" 1
1446 1 73 THR MG 1 75 TRP HZ2 . . 4.010 3.685 3.287 4.061 0.051 17 0 "[ . 1 . 2]" 1
1447 1 73 THR MG 1 97 ASN HD21 . . 4.640 4.707 4.532 4.742 0.102 18 0 "[ . 1 . 2]" 1
1448 1 73 THR MG 1 97 ASN HD22 . . 4.680 3.962 3.694 4.122 . 0 0 "[ . 1 . 2]" 1
1449 1 74 GLU H 1 74 GLU HB2 . . 3.330 2.922 2.636 3.255 . 0 0 "[ . 1 . 2]" 1
1450 1 74 GLU H 1 75 TRP H . . 4.330 4.102 3.864 4.268 . 0 0 "[ . 1 . 2]" 1
1451 1 74 GLU H 1 75 TRP HA . . 5.250 4.857 4.475 5.118 . 0 0 "[ . 1 . 2]" 1
1452 1 74 GLU H 1 75 TRP HD1 . . 4.260 3.783 3.228 4.112 . 0 0 "[ . 1 . 2]" 1
1453 1 74 GLU H 1 75 TRP HE1 . . 5.500 5.208 4.742 5.556 0.056 19 0 "[ . 1 . 2]" 1
1454 1 74 GLU HA 1 74 GLU QG . . 3.890 2.378 2.233 2.525 . 0 0 "[ . 1 . 2]" 1
1455 1 74 GLU HA 1 75 TRP H . . 3.060 2.111 2.021 2.266 . 0 0 "[ . 1 . 2]" 1
1456 1 74 GLU HB2 1 75 TRP H . . 4.540 4.398 4.257 4.571 0.031 5 0 "[ . 1 . 2]" 1
1457 1 74 GLU QG 1 75 TRP H . . 3.490 3.214 3.027 3.393 . 0 0 "[ . 1 . 2]" 1
1458 1 74 GLU QG 1 75 TRP HA . . 4.230 4.180 3.996 4.315 0.085 3 0 "[ . 1 . 2]" 1
1459 1 75 TRP H 1 75 TRP HB2 . . 3.770 2.488 2.367 2.580 . 0 0 "[ . 1 . 2]" 1
1460 1 75 TRP H 1 75 TRP HD1 . . 4.390 3.749 3.531 4.038 . 0 0 "[ . 1 . 2]" 1
1461 1 75 TRP H 1 75 TRP HE3 . . 5.500 5.513 5.354 5.565 0.065 20 0 "[ . 1 . 2]" 1
1462 1 75 TRP H 1 76 ASP H . . 4.580 4.286 4.207 4.393 . 0 0 "[ . 1 . 2]" 1
1463 1 75 TRP H 1 77 TYR QE . . 5.440 4.884 4.566 5.270 . 0 0 "[ . 1 . 2]" 1
1464 1 75 TRP H 1 96 ILE MG . . 5.280 5.210 4.950 5.377 0.097 17 0 "[ . 1 . 2]" 1
1465 1 75 TRP H 1 97 ASN HD22 . . 4.720 4.450 4.277 4.736 0.016 10 0 "[ . 1 . 2]" 1
1466 1 75 TRP HA 1 75 TRP HD1 . . 3.430 2.333 2.190 2.425 . 0 0 "[ . 1 . 2]" 1
1467 1 75 TRP HA 1 75 TRP HE1 . . 4.660 4.634 4.514 4.723 0.063 16 0 "[ . 1 . 2]" 1
1468 1 75 TRP HA 1 76 ASP H . . 2.950 2.078 1.986 2.145 . 0 0 "[ . 1 . 2]" 1
1469 1 75 TRP HA 1 76 ASP HA . . 5.500 4.420 4.375 4.482 . 0 0 "[ . 1 . 2]" 1
1470 1 75 TRP HA 1 96 ILE MG . . 3.980 3.095 2.786 3.401 . 0 0 "[ . 1 . 2]" 1
1471 1 75 TRP HA 1 97 ASN H . . 4.450 4.084 3.801 4.366 . 0 0 "[ . 1 . 2]" 1
1472 1 75 TRP HA 1 97 ASN HD21 . . 3.790 2.392 2.196 2.629 . 0 0 "[ . 1 . 2]" 1
1473 1 75 TRP HA 1 97 ASN HD22 . . 3.680 2.171 1.949 2.477 . 0 0 "[ . 1 . 2]" 1
1474 1 75 TRP HB2 1 75 TRP HE3 . . 3.940 3.051 2.915 3.185 . 0 0 "[ . 1 . 2]" 1
1475 1 75 TRP HB2 1 76 ASP H . . 4.680 4.420 4.295 4.490 . 0 0 "[ . 1 . 2]" 1
1476 1 75 TRP HB2 1 77 TYR QE . . 4.100 3.673 2.837 4.110 0.010 2 0 "[ . 1 . 2]" 1
1477 1 75 TRP HB2 1 96 ILE MG . . 4.280 3.875 3.712 4.057 . 0 0 "[ . 1 . 2]" 1
1478 1 75 TRP HD1 1 76 ASP H . . 4.340 4.296 4.122 4.387 0.047 20 0 "[ . 1 . 2]" 1
1479 1 75 TRP HD1 1 96 ILE MG . . 3.860 3.295 3.072 3.508 . 0 0 "[ . 1 . 2]" 1
1480 1 75 TRP HD1 1 97 ASN QB . . 4.880 4.535 4.274 4.807 . 0 0 "[ . 1 . 2]" 1
1481 1 75 TRP HD1 1 97 ASN HD21 . . 3.550 2.751 2.479 2.899 . 0 0 "[ . 1 . 2]" 1
1482 1 75 TRP HD1 1 97 ASN HD22 . . 2.830 2.125 1.696 2.260 . 0 0 "[ . 1 . 2]" 1
1483 1 75 TRP HE1 1 96 ILE MG . . 3.760 3.353 3.104 3.740 . 0 0 "[ . 1 . 2]" 1
1484 1 75 TRP HE1 1 97 ASN QB . . 5.500 4.792 4.145 5.246 . 0 0 "[ . 1 . 2]" 1
1485 1 75 TRP HE1 1 97 ASN HD21 . . 4.400 4.122 3.681 4.475 0.075 19 0 "[ . 1 . 2]" 1
1486 1 75 TRP HE1 1 97 ASN HD22 . . 4.070 4.034 2.840 4.137 0.067 20 0 "[ . 1 . 2]" 1
1487 1 75 TRP HE3 1 77 TYR QE . . 4.770 4.544 3.495 4.860 0.090 12 0 "[ . 1 . 2]" 1
1488 1 75 TRP HE3 1 94 VAL QG . . 4.880 4.916 4.785 4.981 0.101 19 0 "[ . 1 . 2]" 1
1489 1 75 TRP HE3 1 96 ILE MD . . 3.760 3.015 2.765 3.238 . 0 0 "[ . 1 . 2]" 1
1490 1 75 TRP HE3 1 96 ILE MG . . 4.250 3.359 3.024 3.686 . 0 0 "[ . 1 . 2]" 1
1491 1 75 TRP HZ2 1 96 ILE MG . . 4.520 3.804 3.181 4.236 . 0 0 "[ . 1 . 2]" 1
1492 1 75 TRP HZ3 1 94 VAL QG . . 4.900 4.783 4.526 4.991 0.091 13 0 "[ . 1 . 2]" 1
1493 1 75 TRP HZ3 1 96 ILE MD . . 4.710 4.270 3.791 4.635 . 0 0 "[ . 1 . 2]" 1
1494 1 76 ASP H 1 76 ASP HB3 . . 3.310 2.390 2.024 3.380 0.070 19 0 "[ . 1 . 2]" 1
1495 1 76 ASP H 1 77 TYR H . . 4.640 4.517 4.384 4.674 0.034 12 0 "[ . 1 . 2]" 1
1496 1 76 ASP H 1 96 ILE MD . . 4.640 4.252 3.956 4.432 . 0 0 "[ . 1 . 2]" 1
1497 1 76 ASP H 1 96 ILE MG . . 3.930 3.582 3.259 4.008 0.078 17 0 "[ . 1 . 2]" 1
1498 1 76 ASP H 1 97 ASN H . . 3.710 3.016 2.888 3.218 . 0 0 "[ . 1 . 2]" 1
1499 1 76 ASP H 1 97 ASN HA . . 3.770 3.792 3.533 3.852 0.082 11 0 "[ . 1 . 2]" 1
1500 1 76 ASP H 1 97 ASN HD21 . . 4.230 2.998 2.527 3.455 . 0 0 "[ . 1 . 2]" 1
1501 1 76 ASP H 1 97 ASN HD22 . . 3.750 3.281 2.990 3.808 0.058 19 0 "[ . 1 . 2]" 1
1502 1 76 ASP HA 1 77 TYR H . . 3.240 2.238 2.149 2.341 . 0 0 "[ . 1 . 2]" 1
1503 1 76 ASP HA 1 77 TYR HA . . 5.500 4.438 4.351 4.502 . 0 0 "[ . 1 . 2]" 1
1504 1 76 ASP HA 1 77 TYR HB2 . . 4.800 4.719 4.501 4.838 0.038 17 0 "[ . 1 . 2]" 1
1505 1 76 ASP HA 1 77 TYR QD . . 4.160 3.780 3.566 4.053 . 0 0 "[ . 1 . 2]" 1
1506 1 76 ASP HA 1 77 TYR QE . . 5.360 4.959 4.663 5.341 . 0 0 "[ . 1 . 2]" 1
1507 1 76 ASP HA 1 97 ASN H . . 5.200 5.223 4.886 5.282 0.082 17 0 "[ . 1 . 2]" 1
1508 1 76 ASP QB 1 77 TYR H . . 4.270 3.698 3.160 3.990 . 0 0 "[ . 1 . 2]" 1
1509 1 76 ASP QB 1 77 TYR QD . . 5.340 5.009 4.765 5.268 . 0 0 "[ . 1 . 2]" 1
1510 1 76 ASP QB 1 97 ASN H . . 3.830 3.019 2.220 3.913 0.083 20 0 "[ . 1 . 2]" 1
1511 1 76 ASP QB 1 97 ASN HA . . 4.080 3.373 2.875 4.150 0.070 20 0 "[ . 1 . 2]" 1
1512 1 77 TYR H 1 77 TYR HB2 . . 3.880 2.501 2.319 2.613 . 0 0 "[ . 1 . 2]" 1
1513 1 77 TYR H 1 77 TYR QD . . 3.290 2.810 2.630 3.049 . 0 0 "[ . 1 . 2]" 1
1514 1 77 TYR H 1 77 TYR QE . . 4.400 4.476 4.378 4.492 0.092 3 0 "[ . 1 . 2]" 1
1515 1 77 TYR H 1 78 GLY H . . 5.380 4.196 4.032 4.328 . 0 0 "[ . 1 . 2]" 1
1516 1 77 TYR H 1 96 ILE MD . . 4.890 4.885 4.583 4.983 0.093 18 0 "[ . 1 . 2]" 1
1517 1 77 TYR HA 1 77 TYR QD . . 3.790 2.305 1.990 2.463 . 0 0 "[ . 1 . 2]" 1
1518 1 77 TYR HA 1 78 GLY H . . 3.120 2.088 1.999 2.173 . 0 0 "[ . 1 . 2]" 1
1519 1 77 TYR HA 1 78 GLY HA2 . . 5.500 4.414 4.326 4.506 . 0 0 "[ . 1 . 2]" 1
1520 1 77 TYR HA 1 78 GLY HA3 . . 4.710 4.314 4.180 4.438 . 0 0 "[ . 1 . 2]" 1
1521 1 77 TYR HA 1 94 VAL QG . . 4.320 4.068 3.857 4.282 . 0 0 "[ . 1 . 2]" 1
1522 1 77 TYR HA 1 96 ILE MD . . 3.600 3.050 2.732 3.234 . 0 0 "[ . 1 . 2]" 1
1523 1 77 TYR HB2 1 78 GLY H . . 4.510 4.393 4.302 4.499 . 0 0 "[ . 1 . 2]" 1
1524 1 77 TYR QD 1 78 GLY H . . 4.170 4.184 3.876 4.257 0.087 7 0 "[ . 1 . 2]" 1
1525 1 77 TYR QD 1 96 ILE MD . . 3.580 3.397 2.710 3.688 0.108 12 0 "[ . 1 . 2]" 1
1526 1 77 TYR QD 1 96 ILE MG . . 5.130 4.958 4.335 5.208 0.078 13 0 "[ . 1 . 2]" 1
1527 1 77 TYR QE 1 96 ILE MD . . 4.560 4.380 3.510 4.674 0.114 13 0 "[ . 1 . 2]" 1
1528 1 78 GLY H 1 95 GLU H . . 4.510 4.576 4.550 4.588 0.078 20 0 "[ . 1 . 2]" 1
1529 1 78 GLY H 1 95 GLU HA . . 5.500 5.503 5.393 5.557 0.057 18 0 "[ . 1 . 2]" 1
1530 1 78 GLY H 1 95 GLU QG . . 4.600 4.437 4.263 4.631 0.031 7 0 "[ . 1 . 2]" 1
1531 1 78 GLY H 1 96 ILE H . . 5.450 5.450 5.271 5.513 0.063 18 0 "[ . 1 . 2]" 1
1532 1 78 GLY H 1 96 ILE HA . . 4.260 3.700 3.450 3.882 . 0 0 "[ . 1 . 2]" 1
1533 1 78 GLY H 1 96 ILE MD . . 4.120 2.926 2.703 3.165 . 0 0 "[ . 1 . 2]" 1
1534 1 78 GLY H 1 97 ASN H . . 5.140 4.876 4.548 5.167 0.027 18 0 "[ . 1 . 2]" 1
1535 1 78 GLY HA2 1 79 GLU H . . 3.560 2.446 2.373 2.496 . 0 0 "[ . 1 . 2]" 1
1536 1 78 GLY HA2 1 95 GLU QG . . 5.340 4.098 3.657 4.377 . 0 0 "[ . 1 . 2]" 1
1537 1 78 GLY HA3 1 79 GLU H . . 3.470 2.876 2.774 2.945 . 0 0 "[ . 1 . 2]" 1
1538 1 78 GLY HA3 1 79 GLU QG . . 5.340 4.208 4.028 4.535 . 0 0 "[ . 1 . 2]" 1
1539 1 78 GLY HA3 1 95 GLU H . . 4.380 3.980 3.822 4.225 . 0 0 "[ . 1 . 2]" 1
1540 1 78 GLY HA3 1 95 GLU HB2 . . 4.280 3.746 3.570 3.871 . 0 0 "[ . 1 . 2]" 1
1541 1 78 GLY HA3 1 95 GLU QG . . 4.640 2.732 2.491 3.008 . 0 0 "[ . 1 . 2]" 1
1542 1 79 GLU H 1 79 GLU QB . . 3.500 2.555 2.419 2.919 . 0 0 "[ . 1 . 2]" 1
1543 1 79 GLU H 1 79 GLU QG . . 3.360 1.989 1.754 2.351 . 0 0 "[ . 1 . 2]" 1
1544 1 79 GLU H 1 79 GLU HG3 . . 3.840 3.398 2.562 3.643 . 0 0 "[ . 1 . 2]" 1
1545 1 79 GLU H 1 80 ILE H . . 4.640 4.564 4.517 4.624 . 0 0 "[ . 1 . 2]" 1
1546 1 79 GLU H 1 81 HIS HD2 . . 5.500 5.405 5.263 5.544 0.044 6 0 "[ . 1 . 2]" 1
1547 1 79 GLU H 1 95 GLU H . . 4.900 4.400 4.238 4.709 . 0 0 "[ . 1 . 2]" 1
1548 1 79 GLU H 1 95 GLU HB2 . . 3.820 3.736 3.525 3.875 0.055 2 0 "[ . 1 . 2]" 1
1549 1 79 GLU H 1 95 GLU QG . . 4.150 4.206 3.901 4.250 0.100 4 0 "[ . 1 . 2]" 1
1550 1 79 GLU H 1 100 PHE QE . . 5.300 5.075 4.951 5.218 . 0 0 "[ . 1 . 2]" 1
1551 1 79 GLU HA 1 79 GLU HG3 . . 4.080 4.016 3.872 4.154 0.074 19 0 "[ . 1 . 2]" 1
1552 1 79 GLU HA 1 80 ILE H . . 3.070 2.224 2.047 2.339 . 0 0 "[ . 1 . 2]" 1
1553 1 79 GLU HA 1 80 ILE HA . . 5.500 4.376 4.334 4.457 . 0 0 "[ . 1 . 2]" 1
1554 1 79 GLU HA 1 80 ILE HB . . 4.700 4.349 4.081 4.587 . 0 0 "[ . 1 . 2]" 1
1555 1 79 GLU HA 1 80 ILE MD . . 5.500 4.375 4.158 4.565 . 0 0 "[ . 1 . 2]" 1
1556 1 79 GLU HA 1 95 GLU H . . 5.190 4.752 4.649 5.064 . 0 0 "[ . 1 . 2]" 1
1557 1 79 GLU HA 1 95 GLU HB2 . . 5.450 5.364 5.278 5.497 0.047 15 0 "[ . 1 . 2]" 1
1558 1 79 GLU QB 1 80 ILE H . . 3.240 2.502 2.322 2.934 . 0 0 "[ . 1 . 2]" 1
1559 1 79 GLU QB 1 81 HIS HD2 . . 3.230 3.237 2.940 3.301 0.071 4 0 "[ . 1 . 2]" 1
1560 1 79 GLU QB 1 95 GLU H . . 5.500 5.165 5.067 5.461 . 0 0 "[ . 1 . 2]" 1
1561 1 79 GLU QB 1 100 PHE HZ . . 4.000 4.070 4.025 4.115 0.115 2 0 "[ . 1 . 2]" 1
1562 1 79 GLU QG 1 80 ILE H . . 4.210 3.848 3.618 4.169 . 0 0 "[ . 1 . 2]" 1
1563 1 79 GLU QG 1 81 HIS HD2 . . 3.490 2.618 2.341 3.524 0.034 15 0 "[ . 1 . 2]" 1
1564 1 79 GLU QG 1 95 GLU H . . 5.340 4.244 3.959 4.872 . 0 0 "[ . 1 . 2]" 1
1565 1 79 GLU QG 1 100 PHE QE . . 3.810 3.369 3.176 3.847 0.037 15 0 "[ . 1 . 2]" 1
1566 1 79 GLU QG 1 100 PHE HZ . . 3.880 2.271 2.076 2.869 . 0 0 "[ . 1 . 2]" 1
1567 1 79 GLU HG3 1 80 ILE H . . 4.820 4.134 3.851 4.730 . 0 0 "[ . 1 . 2]" 1
1568 1 79 GLU HG3 1 100 PHE HZ . . 4.560 2.399 2.114 3.105 . 0 0 "[ . 1 . 2]" 1
1569 1 80 ILE H 1 80 ILE HB . . 3.390 2.449 2.323 2.587 . 0 0 "[ . 1 . 2]" 1
1570 1 80 ILE H 1 80 ILE MD . . 4.140 3.628 3.244 4.014 . 0 0 "[ . 1 . 2]" 1
1571 1 80 ILE H 1 80 ILE MG . . 3.960 3.780 3.657 3.854 . 0 0 "[ . 1 . 2]" 1
1572 1 80 ILE H 1 81 HIS H . . 4.660 4.405 4.308 4.568 . 0 0 "[ . 1 . 2]" 1
1573 1 80 ILE H 1 81 HIS HA . . 5.380 5.190 5.072 5.272 . 0 0 "[ . 1 . 2]" 1
1574 1 80 ILE H 1 81 HIS HD2 . . 4.150 3.737 3.525 3.997 . 0 0 "[ . 1 . 2]" 1
1575 1 80 ILE H 1 94 VAL HA . . 5.440 4.973 4.763 5.440 . 15 0 "[ . 1 . 2]" 1
1576 1 80 ILE H 1 94 VAL QG . . 5.320 4.799 4.491 5.366 0.046 18 0 "[ . 1 . 2]" 1
1577 1 80 ILE H 1 100 PHE QE . . 5.050 4.699 4.473 5.141 0.091 15 0 "[ . 1 . 2]" 1
1578 1 80 ILE HA 1 80 ILE MD . . 3.850 3.859 3.712 3.898 0.048 14 0 "[ . 1 . 2]" 1
1579 1 80 ILE HA 1 80 ILE HG12 . . 4.140 2.638 2.325 2.873 . 0 0 "[ . 1 . 2]" 1
1580 1 80 ILE HA 1 80 ILE MG . . 3.480 2.414 2.317 2.577 . 0 0 "[ . 1 . 2]" 1
1581 1 80 ILE HA 1 81 HIS H . . 3.020 2.066 1.995 2.226 . 0 0 "[ . 1 . 2]" 1
1582 1 80 ILE HA 1 81 HIS QB . . 5.500 4.084 4.013 4.216 . 0 0 "[ . 1 . 2]" 1
1583 1 80 ILE HA 1 81 HIS HD2 . . 4.470 3.588 3.336 4.011 . 0 0 "[ . 1 . 2]" 1
1584 1 80 ILE HA 1 93 ALA H . . 5.460 5.160 4.939 5.382 . 0 0 "[ . 1 . 2]" 1
1585 1 80 ILE HA 1 94 VAL H . . 5.300 4.976 4.848 5.288 . 0 0 "[ . 1 . 2]" 1
1586 1 80 ILE HA 1 94 VAL HA . . 3.500 2.424 2.215 2.922 . 0 0 "[ . 1 . 2]" 1
1587 1 80 ILE HA 1 94 VAL HB . . 4.880 4.080 3.656 4.593 . 0 0 "[ . 1 . 2]" 1
1588 1 80 ILE HA 1 94 VAL QG . . 4.120 3.560 3.295 3.894 . 0 0 "[ . 1 . 2]" 1
1589 1 80 ILE HA 1 95 GLU H . . 3.850 3.265 2.993 3.505 . 0 0 "[ . 1 . 2]" 1
1590 1 80 ILE HA 1 100 PHE QE . . 5.500 2.788 2.429 3.630 . 0 0 "[ . 1 . 2]" 1
1591 1 80 ILE HB 1 80 ILE MD . . 3.390 2.298 2.130 2.401 . 0 0 "[ . 1 . 2]" 1
1592 1 80 ILE HB 1 81 HIS H . . 4.470 4.045 3.954 4.254 . 0 0 "[ . 1 . 2]" 1
1593 1 80 ILE HB 1 88 LEU QD . . 4.880 4.567 4.216 4.953 0.073 9 0 "[ . 1 . 2]" 1
1594 1 80 ILE HB 1 94 VAL QG . . 5.430 4.766 4.390 5.123 . 0 0 "[ . 1 . 2]" 1
1595 1 80 ILE MD 1 80 ILE MG . . 3.030 2.177 2.053 2.472 . 0 0 "[ . 1 . 2]" 1
1596 1 80 ILE MD 1 81 HIS H . . 5.340 4.978 4.880 5.215 . 0 0 "[ . 1 . 2]" 1
1597 1 80 ILE MD 1 92 PHE QD . . 4.450 4.117 3.571 4.400 . 0 0 "[ . 1 . 2]" 1
1598 1 80 ILE MD 1 92 PHE QE . . 4.070 3.116 2.471 3.712 . 0 0 "[ . 1 . 2]" 1
1599 1 80 ILE MD 1 94 VAL HA . . 4.510 4.438 3.939 4.589 0.079 6 0 "[ . 1 . 2]" 1
1600 1 80 ILE MD 1 94 VAL HB . . 4.150 3.892 3.295 4.201 0.051 18 0 "[ . 1 . 2]" 1
1601 1 80 ILE MD 1 94 VAL QG . . 3.450 3.117 2.485 3.429 . 0 0 "[ . 1 . 2]" 1
1602 1 80 ILE MD 1 103 ALA MB . . 5.500 5.470 5.097 5.602 0.102 9 0 "[ . 1 . 2]" 1
1603 1 80 ILE HG12 1 81 HIS H . . 4.860 4.101 3.877 4.322 . 0 0 "[ . 1 . 2]" 1
1604 1 80 ILE HG12 1 94 VAL HA . . 3.880 2.866 2.310 3.054 . 0 0 "[ . 1 . 2]" 1
1605 1 80 ILE HG12 1 94 VAL HB . . 4.710 2.686 2.387 3.186 . 0 0 "[ . 1 . 2]" 1
1606 1 80 ILE HG12 1 95 GLU H . . 4.780 4.262 3.795 4.480 . 0 0 "[ . 1 . 2]" 1
1607 1 80 ILE MG 1 81 HIS H . . 3.350 2.385 2.252 2.613 . 0 0 "[ . 1 . 2]" 1
1608 1 80 ILE MG 1 81 HIS HA . . 4.260 3.547 3.341 3.627 . 0 0 "[ . 1 . 2]" 1
1609 1 80 ILE MG 1 81 HIS QB . . 4.440 4.241 4.081 4.365 . 0 0 "[ . 1 . 2]" 1
1610 1 80 ILE MG 1 82 SER H . . 4.540 4.570 4.248 4.621 0.081 13 0 "[ . 1 . 2]" 1
1611 1 80 ILE MG 1 82 SER HA . . 4.260 4.313 4.108 4.358 0.098 8 0 "[ . 1 . 2]" 1
1612 1 80 ILE MG 1 82 SER QB . . 5.340 5.063 4.873 5.453 0.113 11 0 "[ . 1 . 2]" 1
1613 1 80 ILE MG 1 88 LEU QD . . 3.200 2.532 2.300 2.790 . 0 0 "[ . 1 . 2]" 1
1614 1 80 ILE MG 1 92 PHE QB . . 3.930 3.139 2.895 3.441 . 0 0 "[ . 1 . 2]" 1
1615 1 80 ILE MG 1 92 PHE QD . . 3.280 2.127 1.931 2.660 . 0 0 "[ . 1 . 2]" 1
1616 1 80 ILE MG 1 93 ALA H . . 3.970 3.579 3.328 3.740 . 0 0 "[ . 1 . 2]" 1
1617 1 80 ILE MG 1 93 ALA HA . . 5.110 4.962 4.708 5.187 0.077 18 0 "[ . 1 . 2]" 1
1618 1 80 ILE MG 1 94 VAL HA . . 4.340 3.398 3.081 3.559 . 0 0 "[ . 1 . 2]" 1
1619 1 80 ILE MG 1 94 VAL HB . . 4.620 3.530 3.115 3.904 . 0 0 "[ . 1 . 2]" 1
1620 1 80 ILE MG 1 94 VAL QG . . 5.500 3.734 3.518 3.913 . 0 0 "[ . 1 . 2]" 1
1621 1 80 ILE MG 1 95 GLU H . . 4.820 4.896 4.526 4.926 0.106 20 0 "[ . 1 . 2]" 1
1622 1 80 ILE MG 1 100 PHE QE . . 4.730 4.321 3.663 4.841 0.111 18 0 "[ . 1 . 2]" 1
1623 1 81 HIS H 1 81 HIS QB . . 3.620 2.576 2.435 2.666 . 0 0 "[ . 1 . 2]" 1
1624 1 81 HIS H 1 81 HIS HD2 . . 3.950 3.443 3.222 3.533 . 0 0 "[ . 1 . 2]" 1
1625 1 81 HIS H 1 82 SER H . . 4.540 4.456 4.366 4.562 0.022 4 0 "[ . 1 . 2]" 1
1626 1 81 HIS H 1 88 LEU QD . . 4.680 4.545 4.246 4.786 0.106 16 0 "[ . 1 . 2]" 1
1627 1 81 HIS H 1 92 PHE QD . . 4.380 3.850 3.595 4.226 . 0 0 "[ . 1 . 2]" 1
1628 1 81 HIS H 1 93 ALA H . . 3.930 3.677 3.440 3.929 . 0 0 "[ . 1 . 2]" 1
1629 1 81 HIS H 1 93 ALA MB . . 3.610 3.085 2.932 3.298 . 0 0 "[ . 1 . 2]" 1
1630 1 81 HIS H 1 94 VAL HA . . 3.830 3.515 3.313 3.809 . 0 0 "[ . 1 . 2]" 1
1631 1 81 HIS H 1 95 GLU H . . 4.640 4.649 4.347 4.702 0.062 8 0 "[ . 1 . 2]" 1
1632 1 81 HIS H 1 100 PHE QD . . 4.380 3.900 3.650 4.050 . 0 0 "[ . 1 . 2]" 1
1633 1 81 HIS H 1 100 PHE QE . . 4.090 2.652 2.071 3.003 . 0 0 "[ . 1 . 2]" 1
1634 1 81 HIS HA 1 82 SER H . . 3.070 2.261 2.180 2.328 . 0 0 "[ . 1 . 2]" 1
1635 1 81 HIS HA 1 88 LEU QD . . 4.720 4.540 4.211 4.811 0.091 16 0 "[ . 1 . 2]" 1
1636 1 81 HIS QB 1 82 SER H . . 3.390 2.695 2.582 2.919 . 0 0 "[ . 1 . 2]" 1
1637 1 81 HIS QB 1 93 ALA MB . . 3.290 2.558 2.297 2.901 . 0 0 "[ . 1 . 2]" 1
1638 1 81 HIS QB 1 100 PHE QE . . 4.150 2.549 2.158 2.922 . 0 0 "[ . 1 . 2]" 1
1639 1 81 HIS HD2 1 82 SER H . . 5.500 5.431 5.288 5.543 0.043 19 0 "[ . 1 . 2]" 1
1640 1 81 HIS HD2 1 93 ALA MB . . 5.360 5.104 4.854 5.361 0.001 2 0 "[ . 1 . 2]" 1
1641 1 81 HIS HD2 1 100 PHE QE . . 3.330 2.743 2.464 3.166 . 0 0 "[ . 1 . 2]" 1
1642 1 81 HIS HD2 1 100 PHE HZ . . 2.830 2.505 2.238 2.856 0.026 18 0 "[ . 1 . 2]" 1
1643 1 82 SER H 1 82 SER QB . . 3.170 2.494 2.074 2.959 . 0 0 "[ . 1 . 2]" 1
1644 1 82 SER H 1 82 SER HB3 . . 3.740 2.886 2.421 3.587 . 0 0 "[ . 1 . 2]" 1
1645 1 82 SER H 1 83 ILE H . . 4.630 4.587 4.520 4.647 0.017 9 0 "[ . 1 . 2]" 1
1646 1 82 SER H 1 88 LEU QD . . 4.110 3.942 3.687 4.198 0.088 16 0 "[ . 1 . 2]" 1
1647 1 82 SER H 1 93 ALA MB . . 5.220 4.763 4.597 5.162 . 0 0 "[ . 1 . 2]" 1
1648 1 82 SER HA 1 83 ILE H . . 3.180 2.555 2.464 2.660 . 0 0 "[ . 1 . 2]" 1
1649 1 82 SER HA 1 88 LEU QD . . 3.130 2.197 2.023 2.421 . 0 0 "[ . 1 . 2]" 1
1650 1 82 SER HA 1 88 LEU HG . . 5.500 4.737 4.416 5.056 . 0 0 "[ . 1 . 2]" 1
1651 1 82 SER HA 1 93 ALA H . . 3.850 3.679 3.447 3.881 0.031 2 0 "[ . 1 . 2]" 1
1652 1 82 SER QB 1 83 ILE H . . 3.230 2.547 2.200 3.179 . 0 0 "[ . 1 . 2]" 1
1653 1 82 SER QB 1 83 ILE HB . . 5.340 4.906 4.567 5.403 0.063 14 0 "[ . 1 . 2]" 1
1654 1 82 SER HB3 1 83 ILE H . . 3.800 3.275 2.367 3.816 0.016 13 0 "[ . 1 . 2]" 1
1655 1 82 SER HB3 1 88 LEU QD . . 3.870 3.043 2.139 3.951 0.081 14 0 "[ . 1 . 2]" 1
1656 1 83 ILE H 1 83 ILE HB . . 3.390 2.601 2.493 2.734 . 0 0 "[ . 1 . 2]" 1
1657 1 83 ILE H 1 83 ILE MD . . 4.290 4.245 4.077 4.357 0.067 14 0 "[ . 1 . 2]" 1
1658 1 83 ILE H 1 84 ARG H . . 4.580 4.352 4.252 4.486 . 0 0 "[ . 1 . 2]" 1
1659 1 83 ILE H 1 86 LYS H . . 4.850 4.357 3.954 4.599 . 0 0 "[ . 1 . 2]" 1
1660 1 83 ILE H 1 86 LYS QB . . 4.130 3.771 3.363 3.950 . 0 0 "[ . 1 . 2]" 1
1661 1 83 ILE H 1 88 LEU QD . . 3.370 3.308 3.013 3.444 0.074 18 0 "[ . 1 . 2]" 1
1662 1 83 ILE H 1 92 PHE HA . . 4.290 4.018 3.786 4.267 . 0 0 "[ . 1 . 2]" 1
1663 1 83 ILE H 1 93 ALA H . . 4.930 4.895 4.728 4.994 0.064 12 0 "[ . 1 . 2]" 1
1664 1 83 ILE HA 1 83 ILE MD . . 3.810 3.764 3.662 3.832 0.022 3 0 "[ . 1 . 2]" 1
1665 1 83 ILE HA 1 83 ILE MG . . 2.910 2.577 2.407 2.645 . 0 0 "[ . 1 . 2]" 1
1666 1 83 ILE HA 1 84 ARG H . . 2.790 2.145 2.055 2.219 . 0 0 "[ . 1 . 2]" 1
1667 1 83 ILE HA 1 86 LYS H . . 5.500 5.244 4.942 5.454 . 0 0 "[ . 1 . 2]" 1
1668 1 83 ILE HB 1 83 ILE MD . . 3.540 2.440 2.292 2.665 . 0 0 "[ . 1 . 2]" 1
1669 1 83 ILE HB 1 86 LYS H . . 4.120 4.056 3.783 4.187 0.067 6 0 "[ . 1 . 2]" 1
1670 1 83 ILE HB 1 86 LYS QB . . 3.480 2.148 1.947 2.302 . 0 0 "[ . 1 . 2]" 1
1671 1 83 ILE MD 1 83 ILE MG . . 2.640 2.008 1.907 2.044 . 0 0 "[ . 1 . 2]" 1
1672 1 83 ILE MD 1 84 ARG H . . 4.920 4.795 4.474 4.926 0.006 19 0 "[ . 1 . 2]" 1
1673 1 83 ILE MD 1 86 LYS QB . . 3.620 3.357 3.079 3.540 . 0 0 "[ . 1 . 2]" 1
1674 1 83 ILE MD 1 91 ALA H . . 5.110 5.162 5.014 5.196 0.086 20 0 "[ . 1 . 2]" 1
1675 1 83 ILE MD 1 91 ALA MB . . 2.940 2.999 2.800 3.046 0.106 4 0 "[ . 1 . 2]" 1
1676 1 83 ILE MD 1 92 PHE H . . 3.680 3.355 3.205 3.501 . 0 0 "[ . 1 . 2]" 1
1677 1 83 ILE MD 1 92 PHE HA . . 3.590 2.297 1.952 2.391 . 0 0 "[ . 1 . 2]" 1
1678 1 83 ILE MD 1 93 ALA H . . 3.780 3.083 2.801 3.169 . 0 0 "[ . 1 . 2]" 1
1679 1 83 ILE MD 1 93 ALA HA . . 3.990 2.976 2.832 3.070 . 0 0 "[ . 1 . 2]" 1
1680 1 83 ILE MD 1 93 ALA MB . . 3.250 2.243 2.169 2.348 . 0 0 "[ . 1 . 2]" 1
1681 1 83 ILE MD 1 94 VAL H . . 5.050 4.962 4.807 5.059 0.009 5 0 "[ . 1 . 2]" 1
1682 1 83 ILE MD 1 102 LEU H . . 5.390 5.293 5.167 5.450 0.060 5 0 "[ . 1 . 2]" 1
1683 1 83 ILE MD 1 102 LEU HA . . 3.760 3.234 3.121 3.355 . 0 0 "[ . 1 . 2]" 1
1684 1 83 ILE MD 1 103 ALA H . . 4.010 3.929 3.782 4.047 0.037 3 0 "[ . 1 . 2]" 1
1685 1 83 ILE MG 1 84 ARG H . . 2.970 2.496 2.265 2.633 . 0 0 "[ . 1 . 2]" 1
1686 1 83 ILE MG 1 84 ARG HA . . 5.500 4.095 3.919 4.178 . 0 0 "[ . 1 . 2]" 1
1687 1 83 ILE MG 1 86 LYS H . . 3.830 3.428 2.963 3.792 . 0 0 "[ . 1 . 2]" 1
1688 1 83 ILE MG 1 86 LYS QB . . 5.500 2.322 2.138 2.581 . 0 0 "[ . 1 . 2]" 1
1689 1 84 ARG H 1 84 ARG HB2 . . 3.050 2.194 2.033 2.344 . 0 0 "[ . 1 . 2]" 1
1690 1 84 ARG H 1 84 ARG QD . . 3.840 3.679 3.455 3.909 0.069 13 0 "[ . 1 . 2]" 1
1691 1 84 ARG H 1 84 ARG QG . . 3.120 2.659 2.215 3.171 0.051 20 0 "[ . 1 . 2]" 1
1692 1 84 ARG H 1 85 GLY H . . 4.550 4.538 4.447 4.600 0.050 3 0 "[ . 1 . 2]" 1
1693 1 84 ARG H 1 86 LYS H . . 5.000 4.717 4.390 4.863 . 0 0 "[ . 1 . 2]" 1
1694 1 84 ARG HA 1 85 GLY H . . 3.140 2.165 2.108 2.238 . 0 0 "[ . 1 . 2]" 1
1695 1 84 ARG HA 1 85 GLY HA2 . . 5.500 4.385 4.304 4.453 . 0 0 "[ . 1 . 2]" 1
1696 1 84 ARG HA 1 85 GLY HA3 . . 5.500 4.448 4.403 4.482 . 0 0 "[ . 1 . 2]" 1
1697 1 84 ARG HA 1 86 LYS H . . 3.740 3.726 3.568 3.796 0.056 7 0 "[ . 1 . 2]" 1
1698 1 84 ARG HB2 1 84 ARG QD . . 2.650 2.404 2.182 2.548 . 0 0 "[ . 1 . 2]" 1
1699 1 84 ARG HB2 1 85 GLY H . . 4.510 4.453 4.317 4.560 0.050 11 0 "[ . 1 . 2]" 1
1700 1 85 GLY H 1 86 LYS H . . 3.250 2.756 2.484 2.934 . 0 0 "[ . 1 . 2]" 1
1701 1 85 GLY QA 1 86 LYS H . . 2.980 2.980 2.823 3.039 0.059 19 0 "[ . 1 . 2]" 1
1702 1 86 LYS H 1 86 LYS QB . . 2.780 2.638 2.389 2.780 . 0 0 "[ . 1 . 2]" 1
1703 1 86 LYS H 1 86 LYS QG . . 3.690 3.362 3.148 3.659 . 0 0 "[ . 1 . 2]" 1
1704 1 86 LYS H 1 87 SER H . . 4.410 4.319 4.184 4.441 0.031 19 0 "[ . 1 . 2]" 1
1705 1 86 LYS H 1 87 SER HA . . 4.700 4.681 4.518 4.771 0.071 19 0 "[ . 1 . 2]" 1
1706 1 86 LYS HA 1 86 LYS QD . . 3.930 2.194 2.014 2.501 . 0 0 "[ . 1 . 2]" 1
1707 1 86 LYS HA 1 87 SER H . . 2.730 2.227 2.131 2.341 . 0 0 "[ . 1 . 2]" 1
1708 1 86 LYS QB 1 87 SER H . . 3.210 2.939 2.493 3.277 0.067 15 0 "[ . 1 . 2]" 1
1709 1 86 LYS QB 1 91 ALA H . . 4.170 3.462 3.136 3.777 . 0 0 "[ . 1 . 2]" 1
1710 1 86 LYS QB 1 92 PHE H . . 5.480 5.197 4.914 5.519 0.039 1 0 "[ . 1 . 2]" 1
1711 1 86 LYS QD 1 87 SER H . . 4.280 3.419 2.931 3.675 . 0 0 "[ . 1 . 2]" 1
1712 1 86 LYS QD 1 87 SER HB2 . . 5.500 5.225 4.721 5.579 0.079 3 0 "[ . 1 . 2]" 1
1713 1 86 LYS QG 1 87 SER H . . 4.780 4.485 4.204 4.678 . 0 0 "[ . 1 . 2]" 1
1714 1 87 SER H 1 87 SER HB2 . . 3.110 2.368 2.225 2.593 . 0 0 "[ . 1 . 2]" 1
1715 1 87 SER H 1 88 LEU H . . 4.620 4.588 4.448 4.674 0.054 10 0 "[ . 1 . 2]" 1
1716 1 87 SER H 1 89 THR H . . 5.020 4.884 4.720 5.070 0.050 19 0 "[ . 1 . 2]" 1
1717 1 87 SER H 1 90 GLU H . . 4.240 4.064 3.702 4.297 0.057 1 0 "[ . 1 . 2]" 1
1718 1 87 SER H 1 90 GLU QB . . 4.250 4.197 3.978 4.316 0.066 7 0 "[ . 1 . 2]" 1
1719 1 87 SER H 1 90 GLU HG2 . . 4.360 2.325 1.988 2.560 . 0 0 "[ . 1 . 2]" 1
1720 1 87 SER H 1 91 ALA H . . 4.360 3.950 3.447 4.213 . 0 0 "[ . 1 . 2]" 1
1721 1 87 SER H 1 91 ALA MB . . 5.190 4.652 4.209 5.039 . 0 0 "[ . 1 . 2]" 1
1722 1 87 SER HA 1 88 LEU H . . 2.790 2.302 2.211 2.401 . 0 0 "[ . 1 . 2]" 1
1723 1 87 SER HA 1 89 THR H . . 4.030 3.946 3.792 4.078 0.048 8 0 "[ . 1 . 2]" 1
1724 1 87 SER HB2 1 88 LEU H . . 4.330 4.073 3.910 4.205 . 0 0 "[ . 1 . 2]" 1
1725 1 87 SER HB2 1 89 THR H . . 3.560 3.406 3.026 3.618 0.058 3 0 "[ . 1 . 2]" 1
1726 1 87 SER HB2 1 89 THR MG . . 5.500 4.557 4.141 4.816 . 0 0 "[ . 1 . 2]" 1
1727 1 87 SER HB2 1 90 GLU H . . 3.630 3.409 2.937 3.668 0.038 7 0 "[ . 1 . 2]" 1
1728 1 87 SER HB2 1 90 GLU HG2 . . 4.090 2.155 1.991 2.283 . 0 0 "[ . 1 . 2]" 1
1729 1 87 SER HB2 1 91 ALA H . . 4.500 4.479 4.160 4.570 0.070 16 0 "[ . 1 . 2]" 1
1730 1 88 LEU H 1 88 LEU HB3 . . 3.430 3.318 2.874 3.562 0.132 12 0 "[ . 1 . 2]" 1
1731 1 88 LEU H 1 88 LEU QD . . 3.460 2.570 2.105 3.213 . 0 0 "[ . 1 . 2]" 1
1732 1 88 LEU H 1 88 LEU HG . . 4.100 3.849 3.532 4.174 0.074 10 0 "[ . 1 . 2]" 1
1733 1 88 LEU H 1 89 THR H . . 3.400 2.712 2.589 2.776 . 0 0 "[ . 1 . 2]" 1
1734 1 88 LEU H 1 89 THR HA . . 5.230 5.282 5.199 5.301 0.071 3 0 "[ . 1 . 2]" 1
1735 1 88 LEU H 1 89 THR MG . . 4.400 4.032 3.847 4.225 . 0 0 "[ . 1 . 2]" 1
1736 1 88 LEU H 1 90 GLU H . . 4.420 4.327 4.161 4.392 . 0 0 "[ . 1 . 2]" 1
1737 1 88 LEU H 1 91 ALA H . . 4.890 4.895 4.820 4.957 0.067 9 0 "[ . 1 . 2]" 1
1738 1 88 LEU HA 1 88 LEU QD . . 3.120 1.994 1.822 2.113 . 0 0 "[ . 1 . 2]" 1
1739 1 88 LEU HA 1 88 LEU HG . . 3.770 3.709 3.635 3.759 . 0 0 "[ . 1 . 2]" 1
1740 1 88 LEU HA 1 90 GLU H . . 4.120 3.789 3.613 3.903 . 0 0 "[ . 1 . 2]" 1
1741 1 88 LEU HA 1 91 ALA H . . 3.670 3.560 3.441 3.672 0.002 2 0 "[ . 1 . 2]" 1
1742 1 88 LEU HA 1 93 ALA H . . 5.500 5.576 5.561 5.625 0.125 2 0 "[ . 1 . 2]" 1
1743 1 88 LEU HB3 1 89 THR H . . 3.790 3.404 3.057 3.693 . 0 0 "[ . 1 . 2]" 1
1744 1 88 LEU HB3 1 92 PHE QD . . 5.500 4.474 3.878 4.977 . 0 0 "[ . 1 . 2]" 1
1745 1 88 LEU QD 1 89 THR H . . 4.090 4.082 3.973 4.159 0.069 18 0 "[ . 1 . 2]" 1
1746 1 88 LEU QD 1 89 THR HA . . 5.500 4.793 4.241 5.180 . 0 0 "[ . 1 . 2]" 1
1747 1 88 LEU QD 1 90 GLU H . . 4.920 4.702 4.462 4.839 . 0 0 "[ . 1 . 2]" 1
1748 1 88 LEU QD 1 91 ALA H . . 4.420 4.477 4.363 4.525 0.105 16 0 "[ . 1 . 2]" 1
1749 1 88 LEU QD 1 92 PHE H . . 4.460 4.421 4.109 4.567 0.107 12 0 "[ . 1 . 2]" 1
1750 1 88 LEU QD 1 92 PHE HA . . 3.250 3.216 3.001 3.347 0.097 20 0 "[ . 1 . 2]" 1
1751 1 88 LEU QD 1 92 PHE HB2 . . 3.800 2.235 2.007 2.364 . 0 0 "[ . 1 . 2]" 1
1752 1 88 LEU QD 1 92 PHE HB3 . . 3.800 1.966 1.740 2.048 . 0 0 "[ . 1 . 2]" 1
1753 1 88 LEU QD 1 92 PHE QD . . 2.900 2.645 2.288 3.000 0.100 12 0 "[ . 1 . 2]" 1
1754 1 88 LEU QD 1 93 ALA H . . 3.660 3.662 3.410 3.767 0.107 1 0 "[ . 1 . 2]" 1
1755 1 89 THR H 1 89 THR HB . . 3.850 3.478 3.400 3.642 . 0 0 "[ . 1 . 2]" 1
1756 1 89 THR H 1 89 THR MG . . 2.970 2.292 2.149 2.410 . 0 0 "[ . 1 . 2]" 1
1757 1 89 THR H 1 90 GLU H . . 3.100 2.680 2.423 2.794 . 0 0 "[ . 1 . 2]" 1
1758 1 89 THR H 1 90 GLU QB . . 4.980 4.959 4.715 5.049 0.069 6 0 "[ . 1 . 2]" 1
1759 1 89 THR H 1 90 GLU HG2 . . 4.600 3.989 3.337 4.255 . 0 0 "[ . 1 . 2]" 1
1760 1 89 THR H 1 91 ALA H . . 4.220 4.273 4.147 4.294 0.074 14 0 "[ . 1 . 2]" 1
1761 1 89 THR HA 1 89 THR MG . . 2.910 2.288 2.160 2.401 . 0 0 "[ . 1 . 2]" 1
1762 1 89 THR HA 1 90 GLU HG2 . . 5.500 5.417 5.011 5.573 0.073 6 0 "[ . 1 . 2]" 1
1763 1 89 THR HB 1 90 GLU H . . 4.440 4.124 4.034 4.335 . 0 0 "[ . 1 . 2]" 1
1764 1 89 THR HB 1 105 LYS QE . . 5.500 3.958 3.247 5.560 0.060 11 0 "[ . 1 . 2]" 1
1765 1 89 THR MG 1 90 GLU H . . 4.170 4.240 4.119 4.261 0.091 8 0 "[ . 1 . 2]" 1
1766 1 89 THR MG 1 90 GLU HG2 . . 5.500 5.318 4.873 5.554 0.054 10 0 "[ . 1 . 2]" 1
1767 1 90 GLU H 1 90 GLU QB . . 3.200 3.071 2.979 3.155 . 0 0 "[ . 1 . 2]" 1
1768 1 90 GLU H 1 90 GLU HG2 . . 3.770 2.349 2.000 2.545 . 0 0 "[ . 1 . 2]" 1
1769 1 90 GLU H 1 91 ALA H . . 2.760 2.064 1.952 2.156 . 0 0 "[ . 1 . 2]" 1
1770 1 90 GLU H 1 91 ALA HA . . 4.720 4.464 4.315 4.557 . 0 0 "[ . 1 . 2]" 1
1771 1 90 GLU H 1 105 LYS H . . 5.500 5.545 5.375 5.578 0.078 19 0 "[ . 1 . 2]" 1
1772 1 90 GLU HA 1 105 LYS H . . 3.840 3.510 3.315 3.660 . 0 0 "[ . 1 . 2]" 1
1773 1 90 GLU HA 1 105 LYS QB . . 3.190 2.653 2.352 3.078 . 0 0 "[ . 1 . 2]" 1
1774 1 90 GLU HA 1 105 LYS QE . . 5.500 4.176 3.658 5.138 . 0 0 "[ . 1 . 2]" 1
1775 1 90 GLU QB 1 91 ALA H . . 3.620 3.527 3.120 3.658 0.038 13 0 "[ . 1 . 2]" 1
1776 1 90 GLU QB 1 91 ALA MB . . 3.720 3.690 3.270 3.795 0.075 8 0 "[ . 1 . 2]" 1
1777 1 90 GLU HG2 1 91 ALA H . . 3.900 2.928 2.568 3.147 . 0 0 "[ . 1 . 2]" 1
1778 1 90 GLU HG2 1 91 ALA MB . . 5.500 4.355 3.985 4.549 . 0 0 "[ . 1 . 2]" 1
1779 1 91 ALA H 1 91 ALA MB . . 2.980 2.804 2.674 2.888 . 0 0 "[ . 1 . 2]" 1
1780 1 91 ALA H 1 92 PHE H . . 4.500 4.255 4.142 4.335 . 0 0 "[ . 1 . 2]" 1
1781 1 91 ALA H 1 92 PHE QD . . 4.540 4.123 3.746 4.492 . 0 0 "[ . 1 . 2]" 1
1782 1 91 ALA H 1 105 LYS H . . 5.280 5.159 4.889 5.302 0.022 16 0 "[ . 1 . 2]" 1
1783 1 91 ALA HA 1 92 PHE H . . 2.800 2.304 2.246 2.365 . 0 0 "[ . 1 . 2]" 1
1784 1 91 ALA HA 1 92 PHE QD . . 5.500 3.401 3.081 3.829 . 0 0 "[ . 1 . 2]" 1
1785 1 91 ALA HA 1 102 LEU QD . . 3.960 3.423 3.173 3.639 . 0 0 "[ . 1 . 2]" 1
1786 1 91 ALA HA 1 103 ALA H . . 4.670 4.406 4.244 4.627 . 0 0 "[ . 1 . 2]" 1
1787 1 91 ALA HA 1 104 THR H . . 5.040 4.929 4.693 5.099 0.059 16 0 "[ . 1 . 2]" 1
1788 1 91 ALA HA 1 104 THR HA . . 4.860 2.616 2.368 2.947 . 0 0 "[ . 1 . 2]" 1
1789 1 91 ALA HA 1 104 THR HB . . 5.500 5.118 4.837 5.533 0.033 2 0 "[ . 1 . 2]" 1
1790 1 91 ALA HA 1 105 LYS H . . 3.890 3.802 3.505 3.957 0.067 4 0 "[ . 1 . 2]" 1
1791 1 91 ALA MB 1 92 PHE H . . 2.860 2.799 2.604 2.923 0.063 18 0 "[ . 1 . 2]" 1
1792 1 91 ALA MB 1 92 PHE HA . . 3.890 3.898 3.802 3.947 0.057 20 0 "[ . 1 . 2]" 1
1793 1 91 ALA MB 1 92 PHE QB . . 5.340 4.503 4.446 4.541 . 0 0 "[ . 1 . 2]" 1
1794 1 91 ALA MB 1 92 PHE QD . . 4.740 4.595 4.369 4.824 0.084 8 0 "[ . 1 . 2]" 1
1795 1 91 ALA MB 1 102 LEU QD . . 2.800 2.087 1.957 2.369 . 0 0 "[ . 1 . 2]" 1
1796 1 91 ALA MB 1 103 ALA H . . 4.590 4.078 3.874 4.440 . 0 0 "[ . 1 . 2]" 1
1797 1 91 ALA MB 1 103 ALA MB . . 4.850 4.706 4.358 4.897 0.047 14 0 "[ . 1 . 2]" 1
1798 1 91 ALA MB 1 104 THR HA . . 3.310 3.099 2.839 3.328 0.018 18 0 "[ . 1 . 2]" 1
1799 1 91 ALA MB 1 105 LYS H . . 4.190 4.157 3.912 4.275 0.085 19 0 "[ . 1 . 2]" 1
1800 1 92 PHE H 1 92 PHE HB2 . . 4.060 3.956 3.910 4.005 . 0 0 "[ . 1 . 2]" 1
1801 1 92 PHE H 1 92 PHE HB3 . . 4.060 3.349 3.267 3.437 . 0 0 "[ . 1 . 2]" 1
1802 1 92 PHE H 1 92 PHE QD . . 3.790 3.016 2.709 3.310 . 0 0 "[ . 1 . 2]" 1
1803 1 92 PHE H 1 92 PHE QE . . 4.470 4.399 4.092 4.549 0.079 11 0 "[ . 1 . 2]" 1
1804 1 92 PHE H 1 93 ALA H . . 4.560 4.333 4.283 4.383 . 0 0 "[ . 1 . 2]" 1
1805 1 92 PHE H 1 93 ALA HA . . 4.850 4.701 4.586 4.792 . 0 0 "[ . 1 . 2]" 1
1806 1 92 PHE H 1 93 ALA MB . . 5.500 5.222 5.179 5.294 . 0 0 "[ . 1 . 2]" 1
1807 1 92 PHE H 1 102 LEU HA . . 4.220 4.244 4.126 4.288 0.068 12 0 "[ . 1 . 2]" 1
1808 1 92 PHE H 1 102 LEU QB . . 5.500 5.506 5.314 5.568 0.068 11 0 "[ . 1 . 2]" 1
1809 1 92 PHE H 1 102 LEU MD1 . . 4.220 3.636 3.003 4.120 . 0 0 "[ . 1 . 2]" 1
1810 1 92 PHE H 1 102 LEU QD . . 3.340 2.758 2.314 2.920 . 0 0 "[ . 1 . 2]" 1
1811 1 92 PHE H 1 102 LEU MD2 . . 4.220 2.890 2.366 3.277 . 0 0 "[ . 1 . 2]" 1
1812 1 92 PHE H 1 103 ALA H . . 3.450 2.781 2.680 2.995 . 0 0 "[ . 1 . 2]" 1
1813 1 92 PHE H 1 103 ALA HA . . 5.500 4.914 4.751 5.050 . 0 0 "[ . 1 . 2]" 1
1814 1 92 PHE H 1 103 ALA MB . . 3.450 3.177 2.823 3.441 . 0 0 "[ . 1 . 2]" 1
1815 1 92 PHE H 1 104 THR H . . 5.480 5.315 5.081 5.514 0.034 16 0 "[ . 1 . 2]" 1
1816 1 92 PHE H 1 104 THR HA . . 4.550 4.188 3.955 4.504 . 0 0 "[ . 1 . 2]" 1
1817 1 92 PHE HA 1 92 PHE QD . . 3.810 3.742 3.720 3.761 . 0 0 "[ . 1 . 2]" 1
1818 1 92 PHE HA 1 93 ALA H . . 3.200 2.522 2.467 2.563 . 0 0 "[ . 1 . 2]" 1
1819 1 92 PHE HA 1 93 ALA MB . . 4.050 3.897 3.863 3.933 . 0 0 "[ . 1 . 2]" 1
1820 1 92 PHE HA 1 103 ALA H . . 4.900 4.810 4.678 4.940 0.040 18 0 "[ . 1 . 2]" 1
1821 1 92 PHE QB 1 93 ALA H . . 3.140 2.186 2.090 2.289 . 0 0 "[ . 1 . 2]" 1
1822 1 92 PHE HB2 1 93 ALA H . . 3.810 2.203 2.105 2.310 . 0 0 "[ . 1 . 2]" 1
1823 1 92 PHE HB3 1 93 ALA H . . 3.810 3.655 3.544 3.742 . 0 0 "[ . 1 . 2]" 1
1824 1 92 PHE QD 1 93 ALA H . . 3.460 2.784 2.582 2.926 . 0 0 "[ . 1 . 2]" 1
1825 1 92 PHE QD 1 93 ALA HA . . 4.520 3.962 3.738 4.221 . 0 0 "[ . 1 . 2]" 1
1826 1 92 PHE QD 1 93 ALA MB . . 4.310 4.130 3.990 4.301 . 0 0 "[ . 1 . 2]" 1
1827 1 92 PHE QD 1 94 VAL H . . 4.490 4.306 4.138 4.530 0.040 9 0 "[ . 1 . 2]" 1
1828 1 92 PHE QD 1 94 VAL HB . . 4.100 3.311 3.007 3.771 . 0 0 "[ . 1 . 2]" 1
1829 1 92 PHE QD 1 103 ALA MB . . 3.640 3.401 3.161 3.645 0.005 9 0 "[ . 1 . 2]" 1
1830 1 92 PHE QE 1 93 ALA H . . 4.970 5.013 4.795 5.064 0.094 2 0 "[ . 1 . 2]" 1
1831 1 92 PHE QE 1 94 VAL H . . 4.700 4.745 4.472 4.783 0.083 15 0 "[ . 1 . 2]" 1
1832 1 92 PHE QE 1 94 VAL HB . . 3.530 2.174 1.965 2.395 . 0 0 "[ . 1 . 2]" 1
1833 1 92 PHE QE 1 94 VAL QG . . 3.620 2.940 2.600 3.237 . 0 0 "[ . 1 . 2]" 1
1834 1 92 PHE QE 1 103 ALA MB . . 3.870 2.844 2.469 3.174 . 0 0 "[ . 1 . 2]" 1
1835 1 93 ALA H 1 93 ALA MB . . 3.200 2.406 2.370 2.444 . 0 0 "[ . 1 . 2]" 1
1836 1 93 ALA H 1 94 VAL H . . 5.030 4.506 4.386 4.585 . 0 0 "[ . 1 . 2]" 1
1837 1 93 ALA H 1 100 PHE QD . . 4.890 4.899 4.573 4.969 0.079 8 0 "[ . 1 . 2]" 1
1838 1 93 ALA H 1 102 LEU QD . . 4.300 4.373 4.028 4.412 0.112 20 0 "[ . 1 . 2]" 1
1839 1 93 ALA HA 1 94 VAL H . . 2.880 2.224 2.148 2.291 . 0 0 "[ . 1 . 2]" 1
1840 1 93 ALA HA 1 94 VAL HA . . 5.500 4.499 4.396 4.524 . 0 0 "[ . 1 . 2]" 1
1841 1 93 ALA HA 1 94 VAL HB . . 4.770 4.594 4.446 4.702 . 0 0 "[ . 1 . 2]" 1
1842 1 93 ALA HA 1 94 VAL QG . . 3.700 3.577 3.354 3.789 0.089 20 0 "[ . 1 . 2]" 1
1843 1 93 ALA HA 1 100 PHE QD . . 4.590 3.687 3.367 3.928 . 0 0 "[ . 1 . 2]" 1
1844 1 93 ALA HA 1 101 LYS H . . 4.550 4.322 4.129 4.462 . 0 0 "[ . 1 . 2]" 1
1845 1 93 ALA HA 1 101 LYS HA . . 5.500 5.058 4.963 5.182 . 0 0 "[ . 1 . 2]" 1
1846 1 93 ALA HA 1 102 LEU HA . . 3.730 2.793 2.655 2.941 . 0 0 "[ . 1 . 2]" 1
1847 1 93 ALA HA 1 102 LEU QD . . 3.890 3.478 3.109 3.593 . 0 0 "[ . 1 . 2]" 1
1848 1 93 ALA HA 1 103 ALA H . . 3.830 3.594 3.328 3.750 . 0 0 "[ . 1 . 2]" 1
1849 1 93 ALA MB 1 94 VAL H . . 3.210 3.067 2.818 3.169 . 0 0 "[ . 1 . 2]" 1
1850 1 93 ALA MB 1 100 PHE HA . . 4.370 4.185 3.989 4.372 0.002 8 0 "[ . 1 . 2]" 1
1851 1 93 ALA MB 1 100 PHE HB2 . . 4.300 3.981 3.795 4.129 . 0 0 "[ . 1 . 2]" 1
1852 1 93 ALA MB 1 100 PHE HB3 . . 3.370 2.497 2.299 2.685 . 0 0 "[ . 1 . 2]" 1
1853 1 93 ALA MB 1 100 PHE QD . . 3.330 2.140 2.031 2.196 . 0 0 "[ . 1 . 2]" 1
1854 1 93 ALA MB 1 100 PHE QE . . 4.060 3.389 2.960 3.520 . 0 0 "[ . 1 . 2]" 1
1855 1 93 ALA MB 1 100 PHE HZ . . 5.220 5.180 4.767 5.293 0.073 13 0 "[ . 1 . 2]" 1
1856 1 93 ALA MB 1 102 LEU HA . . 4.240 3.939 3.807 4.146 . 0 0 "[ . 1 . 2]" 1
1857 1 94 VAL H 1 94 VAL HB . . 3.680 3.214 3.098 3.338 . 0 0 "[ . 1 . 2]" 1
1858 1 94 VAL H 1 94 VAL QG . . 3.070 2.238 1.970 2.374 . 0 0 "[ . 1 . 2]" 1
1859 1 94 VAL H 1 95 GLU H . . 4.560 4.309 4.198 4.417 . 0 0 "[ . 1 . 2]" 1
1860 1 94 VAL H 1 95 GLU HA . . 4.970 4.807 4.696 4.940 . 0 0 "[ . 1 . 2]" 1
1861 1 94 VAL H 1 100 PHE HA . . 4.290 3.851 3.694 3.990 . 0 0 "[ . 1 . 2]" 1
1862 1 94 VAL H 1 100 PHE HB3 . . 4.680 4.047 3.847 4.263 . 0 0 "[ . 1 . 2]" 1
1863 1 94 VAL H 1 100 PHE QD . . 4.130 3.079 2.875 3.233 . 0 0 "[ . 1 . 2]" 1
1864 1 94 VAL H 1 100 PHE QE . . 5.030 4.722 4.458 5.115 0.085 15 0 "[ . 1 . 2]" 1
1865 1 94 VAL H 1 101 LYS H . . 3.760 2.708 2.505 2.848 . 0 0 "[ . 1 . 2]" 1
1866 1 94 VAL H 1 101 LYS QB . . 4.020 3.860 3.504 4.072 0.052 6 0 "[ . 1 . 2]" 1
1867 1 94 VAL H 1 102 LEU H . . 4.950 4.980 4.888 5.020 0.070 16 0 "[ . 1 . 2]" 1
1868 1 94 VAL H 1 102 LEU HA . . 4.140 4.028 3.759 4.132 . 0 0 "[ . 1 . 2]" 1
1869 1 94 VAL H 1 103 ALA H . . 4.640 4.546 4.090 4.702 0.062 15 0 "[ . 1 . 2]" 1
1870 1 94 VAL H 1 103 ALA MB . . 4.470 4.409 4.114 4.538 0.068 1 0 "[ . 1 . 2]" 1
1871 1 94 VAL HA 1 94 VAL QG . . 3.060 2.312 2.140 2.432 . 0 0 "[ . 1 . 2]" 1
1872 1 94 VAL HA 1 95 GLU H . . 3.120 2.140 2.093 2.217 . 0 0 "[ . 1 . 2]" 1
1873 1 94 VAL HA 1 95 GLU HA . . 4.610 4.389 4.333 4.503 . 0 0 "[ . 1 . 2]" 1
1874 1 94 VAL HA 1 95 GLU HB2 . . 4.580 4.482 4.356 4.607 0.027 9 0 "[ . 1 . 2]" 1
1875 1 94 VAL HA 1 96 ILE H . . 5.500 5.559 5.432 5.575 0.075 20 0 "[ . 1 . 2]" 1
1876 1 94 VAL HA 1 100 PHE QD . . 4.190 3.421 3.275 3.890 . 0 0 "[ . 1 . 2]" 1
1877 1 94 VAL HA 1 100 PHE QE . . 5.500 3.294 2.964 4.398 . 0 0 "[ . 1 . 2]" 1
1878 1 94 VAL HB 1 96 ILE MD . . 4.390 4.449 4.325 4.480 0.090 12 0 "[ . 1 . 2]" 1
1879 1 94 VAL QG 1 95 GLU HA . . 4.280 3.879 3.765 3.999 . 0 0 "[ . 1 . 2]" 1
1880 1 94 VAL QG 1 96 ILE H . . 4.310 3.790 3.605 3.912 . 0 0 "[ . 1 . 2]" 1
1881 1 94 VAL QG 1 96 ILE HB . . 5.500 3.555 3.388 3.822 . 0 0 "[ . 1 . 2]" 1
1882 1 94 VAL QG 1 96 ILE MD . . 3.030 2.061 1.946 2.148 . 0 0 "[ . 1 . 2]" 1
1883 1 94 VAL QG 1 96 ILE MG . . 3.960 3.825 3.701 3.968 0.008 14 0 "[ . 1 . 2]" 1
1884 1 94 VAL QG 1 100 PHE QD . . 4.220 4.225 4.014 4.378 0.158 18 0 "[ . 1 . 2]" 1
1885 1 94 VAL QG 1 101 LYS H . . 3.930 2.948 2.471 3.153 . 0 0 "[ . 1 . 2]" 1
1886 1 94 VAL QG 1 101 LYS QB . . 4.470 2.583 2.286 3.051 . 0 0 "[ . 1 . 2]" 1
1887 1 94 VAL QG 1 102 LEU H . . 4.710 4.684 4.471 4.811 0.101 19 0 "[ . 1 . 2]" 1
1888 1 94 VAL QG 1 103 ALA H . . 3.960 3.812 3.244 4.054 0.094 7 0 "[ . 1 . 2]" 1
1889 1 94 VAL QG 1 103 ALA HA . . 4.520 4.327 3.931 4.584 0.064 10 0 "[ . 1 . 2]" 1
1890 1 94 VAL QG 1 103 ALA MB . . 3.000 2.522 2.223 2.836 . 0 0 "[ . 1 . 2]" 1
1891 1 95 GLU H 1 95 GLU HB2 . . 3.490 2.573 2.476 2.667 . 0 0 "[ . 1 . 2]" 1
1892 1 95 GLU H 1 95 GLU QG . . 4.100 3.970 3.922 4.081 . 0 0 "[ . 1 . 2]" 1
1893 1 95 GLU H 1 95 GLU HG3 . . 4.710 4.487 4.423 4.640 . 0 0 "[ . 1 . 2]" 1
1894 1 95 GLU H 1 96 ILE H . . 4.440 4.381 4.290 4.416 . 0 0 "[ . 1 . 2]" 1
1895 1 95 GLU H 1 96 ILE MD . . 5.120 4.600 4.456 4.742 . 0 0 "[ . 1 . 2]" 1
1896 1 95 GLU H 1 96 ILE HG12 . . 4.560 4.365 4.259 4.511 . 0 0 "[ . 1 . 2]" 1
1897 1 95 GLU H 1 100 PHE HA . . 4.470 4.106 4.011 4.317 . 0 0 "[ . 1 . 2]" 1
1898 1 95 GLU H 1 100 PHE HB3 . . 5.500 5.562 5.543 5.572 0.072 3 0 "[ . 1 . 2]" 1
1899 1 95 GLU H 1 100 PHE QD . . 3.890 3.673 3.525 3.846 . 0 0 "[ . 1 . 2]" 1
1900 1 95 GLU H 1 100 PHE QE . . 3.860 3.157 2.931 3.933 0.073 18 0 "[ . 1 . 2]" 1
1901 1 95 GLU H 1 100 PHE HZ . . 4.690 4.233 3.927 4.732 0.042 15 0 "[ . 1 . 2]" 1
1902 1 95 GLU H 1 101 LYS H . . 4.810 4.728 4.620 4.823 0.013 19 0 "[ . 1 . 2]" 1
1903 1 95 GLU HA 1 95 GLU QG . . 3.550 2.401 2.253 2.626 . 0 0 "[ . 1 . 2]" 1
1904 1 95 GLU HA 1 96 ILE H . . 3.090 2.165 2.069 2.249 . 0 0 "[ . 1 . 2]" 1
1905 1 95 GLU HA 1 96 ILE HB . . 4.940 4.668 4.554 4.790 . 0 0 "[ . 1 . 2]" 1
1906 1 95 GLU HA 1 96 ILE HG12 . . 4.130 4.153 4.071 4.190 0.060 6 0 "[ . 1 . 2]" 1
1907 1 95 GLU HA 1 99 ASP H . . 4.330 4.231 3.922 4.397 0.067 15 0 "[ . 1 . 2]" 1
1908 1 95 GLU HA 1 99 ASP HA . . 4.910 4.743 4.534 4.992 0.082 18 0 "[ . 1 . 2]" 1
1909 1 95 GLU HA 1 100 PHE H . . 4.420 3.900 3.712 4.018 . 0 0 "[ . 1 . 2]" 1
1910 1 95 GLU HA 1 100 PHE HA . . 3.460 2.096 2.032 2.236 . 0 0 "[ . 1 . 2]" 1
1911 1 95 GLU HA 1 100 PHE HB2 . . 4.690 4.563 4.313 4.636 . 0 0 "[ . 1 . 2]" 1
1912 1 95 GLU HA 1 100 PHE HB3 . . 4.520 4.418 4.258 4.527 0.007 19 0 "[ . 1 . 2]" 1
1913 1 95 GLU HA 1 100 PHE QD . . 4.080 3.501 3.335 3.576 . 0 0 "[ . 1 . 2]" 1
1914 1 95 GLU HA 1 101 LYS H . . 3.640 3.505 3.354 3.667 0.027 4 0 "[ . 1 . 2]" 1
1915 1 95 GLU HB2 1 96 ILE H . . 4.750 4.468 4.353 4.576 . 0 0 "[ . 1 . 2]" 1
1916 1 95 GLU HB2 1 100 PHE QD . . 4.250 3.610 3.517 3.718 . 0 0 "[ . 1 . 2]" 1
1917 1 95 GLU HB2 1 100 PHE QE . . 4.050 2.918 2.766 2.990 . 0 0 "[ . 1 . 2]" 1
1918 1 95 GLU HB2 1 100 PHE HZ . . 4.490 2.857 2.661 2.943 . 0 0 "[ . 1 . 2]" 1
1919 1 95 GLU QG 1 96 ILE H . . 3.610 3.217 2.910 3.488 . 0 0 "[ . 1 . 2]" 1
1920 1 95 GLU QG 1 98 ASP H . . 3.730 2.953 2.502 3.244 . 0 0 "[ . 1 . 2]" 1
1921 1 95 GLU QG 1 98 ASP HA . . 3.370 2.618 2.378 2.990 . 0 0 "[ . 1 . 2]" 1
1922 1 95 GLU QG 1 98 ASP QB . . 5.200 4.296 3.998 4.600 . 0 0 "[ . 1 . 2]" 1
1923 1 95 GLU QG 1 100 PHE H . . 4.430 4.099 3.680 4.350 . 0 0 "[ . 1 . 2]" 1
1924 1 95 GLU QG 1 100 PHE QD . . 3.480 3.501 3.157 3.564 0.084 7 0 "[ . 1 . 2]" 1
1925 1 95 GLU QG 1 100 PHE QE . . 4.060 3.481 2.859 3.695 . 0 0 "[ . 1 . 2]" 1
1926 1 95 GLU QG 1 100 PHE HZ . . 4.500 4.493 4.236 4.577 0.077 10 0 "[ . 1 . 2]" 1
1927 1 95 GLU HG3 1 96 ILE H . . 4.140 3.776 3.434 4.201 0.061 7 0 "[ . 1 . 2]" 1
1928 1 95 GLU HG3 1 98 ASP H . . 4.520 4.128 3.569 4.502 . 0 0 "[ . 1 . 2]" 1
1929 1 95 GLU HG3 1 98 ASP HA . . 4.110 3.110 2.640 3.630 . 0 0 "[ . 1 . 2]" 1
1930 1 95 GLU HG3 1 99 ASP H . . 4.190 3.971 3.475 4.274 0.084 18 0 "[ . 1 . 2]" 1
1931 1 96 ILE H 1 96 ILE HB . . 3.490 2.687 2.584 2.789 . 0 0 "[ . 1 . 2]" 1
1932 1 96 ILE H 1 96 ILE MD . . 4.110 3.979 3.724 4.084 . 0 0 "[ . 1 . 2]" 1
1933 1 96 ILE H 1 96 ILE HG12 . . 3.590 3.092 2.854 3.191 . 0 0 "[ . 1 . 2]" 1
1934 1 96 ILE H 1 96 ILE MG . . 3.910 3.900 3.836 3.962 0.052 17 0 "[ . 1 . 2]" 1
1935 1 96 ILE H 1 97 ASN H . . 4.640 4.252 4.115 4.349 . 0 0 "[ . 1 . 2]" 1
1936 1 96 ILE H 1 99 ASP H . . 3.760 3.074 2.830 3.240 . 0 0 "[ . 1 . 2]" 1
1937 1 96 ILE H 1 99 ASP HA . . 5.500 4.604 4.527 4.799 . 0 0 "[ . 1 . 2]" 1
1938 1 96 ILE H 1 99 ASP QB . . 4.300 4.024 3.799 4.352 0.052 18 0 "[ . 1 . 2]" 1
1939 1 96 ILE H 1 99 ASP HB3 . . 5.120 4.638 4.052 5.156 0.036 3 0 "[ . 1 . 2]" 1
1940 1 96 ILE H 1 100 PHE H . . 4.390 4.449 4.304 4.471 0.081 20 0 "[ . 1 . 2]" 1
1941 1 96 ILE H 1 100 PHE HA . . 3.510 2.986 2.711 3.108 . 0 0 "[ . 1 . 2]" 1
1942 1 96 ILE H 1 100 PHE QD . . 4.970 4.957 4.718 5.043 0.073 16 0 "[ . 1 . 2]" 1
1943 1 96 ILE H 1 101 LYS H . . 3.950 3.414 3.220 3.613 . 0 0 "[ . 1 . 2]" 1
1944 1 96 ILE H 1 101 LYS QB . . 4.820 4.292 3.788 4.736 . 0 0 "[ . 1 . 2]" 1
1945 1 96 ILE HA 1 96 ILE MD . . 3.260 2.122 1.962 2.223 . 0 0 "[ . 1 . 2]" 1
1946 1 96 ILE HA 1 96 ILE MG . . 3.330 2.480 2.310 2.697 . 0 0 "[ . 1 . 2]" 1
1947 1 96 ILE HA 1 97 ASN H . . 3.300 2.182 2.089 2.262 . 0 0 "[ . 1 . 2]" 1
1948 1 96 ILE HB 1 96 ILE MD . . 3.630 3.283 3.230 3.319 . 0 0 "[ . 1 . 2]" 1
1949 1 96 ILE HB 1 97 ASN H . . 4.450 4.381 4.267 4.467 0.017 11 0 "[ . 1 . 2]" 1
1950 1 96 ILE HB 1 99 ASP H . . 4.640 4.556 4.419 4.697 0.057 17 0 "[ . 1 . 2]" 1
1951 1 96 ILE MD 1 96 ILE MG . . 3.060 2.122 2.062 2.170 . 0 0 "[ . 1 . 2]" 1
1952 1 96 ILE MD 1 97 ASN H . . 3.810 3.775 3.626 3.885 0.075 20 0 "[ . 1 . 2]" 1
1953 1 96 ILE MD 1 98 ASP H . . 5.350 5.407 5.208 5.448 0.098 14 0 "[ . 1 . 2]" 1
1954 1 96 ILE HG12 1 96 ILE MG . . 3.520 3.216 3.189 3.234 . 0 0 "[ . 1 . 2]" 1
1955 1 96 ILE HG12 1 97 ASN H . . 5.290 5.157 5.003 5.296 0.006 18 0 "[ . 1 . 2]" 1
1956 1 96 ILE HG12 1 101 LYS H . . 3.800 3.807 3.671 3.877 0.077 18 0 "[ . 1 . 2]" 1
1957 1 96 ILE MG 1 97 ASN H . . 3.570 2.958 2.611 3.150 . 0 0 "[ . 1 . 2]" 1
1958 1 96 ILE MG 1 97 ASN HA . . 5.500 4.194 3.973 4.316 . 0 0 "[ . 1 . 2]" 1
1959 1 96 ILE MG 1 97 ASN QB . . 4.060 2.861 2.492 3.662 . 0 0 "[ . 1 . 2]" 1
1960 1 96 ILE MG 1 97 ASN HD21 . . 4.150 2.353 1.861 3.372 . 0 0 "[ . 1 . 2]" 1
1961 1 96 ILE MG 1 97 ASN HD22 . . 4.180 3.512 2.463 4.097 . 0 0 "[ . 1 . 2]" 1
1962 1 96 ILE MG 1 99 ASP H . . 4.800 4.646 4.536 4.786 . 0 0 "[ . 1 . 2]" 1
1963 1 97 ASN H 1 97 ASN HA . . 2.890 2.258 2.155 2.318 . 0 0 "[ . 1 . 2]" 1
1964 1 97 ASN H 1 97 ASN QB . . 3.480 3.349 3.174 3.518 0.038 10 0 "[ . 1 . 2]" 1
1965 1 97 ASN H 1 97 ASN HD21 . . 4.850 2.897 2.473 3.462 . 0 0 "[ . 1 . 2]" 1
1966 1 97 ASN H 1 98 ASP H . . 3.640 2.643 2.413 2.742 . 0 0 "[ . 1 . 2]" 1
1967 1 97 ASN H 1 98 ASP HA . . 5.120 4.864 4.613 4.977 . 0 0 "[ . 1 . 2]" 1
1968 1 97 ASN H 1 99 ASP H . . 4.390 4.101 3.875 4.288 . 0 0 "[ . 1 . 2]" 1
1969 1 97 ASN HA 1 97 ASN HD21 . . 4.350 3.170 2.352 3.780 . 0 0 "[ . 1 . 2]" 1
1970 1 97 ASN HA 1 97 ASN HD22 . . 4.740 3.908 3.563 4.359 . 0 0 "[ . 1 . 2]" 1
1971 1 97 ASN HA 1 98 ASP H . . 3.380 2.702 2.548 2.848 . 0 0 "[ . 1 . 2]" 1
1972 1 97 ASN HA 1 98 ASP HA . . 5.500 4.694 4.569 4.825 . 0 0 "[ . 1 . 2]" 1
1973 1 97 ASN HA 1 99 ASP H . . 4.170 4.233 4.183 4.250 0.080 20 0 "[ . 1 . 2]" 1
1974 1 97 ASN QB 1 97 ASN HD21 . . 3.240 2.627 2.269 3.023 . 0 0 "[ . 1 . 2]" 1
1975 1 97 ASN QB 1 97 ASN HD22 . . 3.440 3.449 3.324 3.522 0.082 19 0 "[ . 1 . 2]" 1
1976 1 97 ASN QB 1 98 ASP H . . 4.090 3.943 3.874 3.972 . 0 0 "[ . 1 . 2]" 1
1977 1 97 ASN QB 1 99 ASP H . . 3.610 3.608 3.327 3.696 0.086 6 0 "[ . 1 . 2]" 1
1978 1 97 ASN HD21 1 98 ASP H . . 5.500 5.095 4.721 5.556 0.056 20 0 "[ . 1 . 2]" 1
1979 1 98 ASP H 1 98 ASP QB . . 3.900 3.250 2.874 3.547 . 0 0 "[ . 1 . 2]" 1
1980 1 98 ASP H 1 99 ASP H . . 3.010 2.816 2.595 3.038 0.028 17 0 "[ . 1 . 2]" 1
1981 1 98 ASP H 1 99 ASP HA . . 5.500 5.411 5.211 5.535 0.035 17 0 "[ . 1 . 2]" 1
1982 1 98 ASP H 1 99 ASP QB . . 5.120 4.904 4.699 5.191 0.071 3 0 "[ . 1 . 2]" 1
1983 1 98 ASP HA 1 98 ASP QB . . 2.770 2.358 2.246 2.458 . 0 0 "[ . 1 . 2]" 1
1984 1 98 ASP HA 1 99 ASP H . . 3.350 3.227 2.973 3.395 0.045 9 0 "[ . 1 . 2]" 1
1985 1 98 ASP QB 1 99 ASP H . . 5.500 3.609 3.331 3.832 . 0 0 "[ . 1 . 2]" 1
1986 1 99 ASP H 1 99 ASP QB . . 2.780 2.464 2.138 2.759 . 0 0 "[ . 1 . 2]" 1
1987 1 99 ASP H 1 100 PHE H . . 4.440 4.352 4.176 4.475 0.035 3 0 "[ . 1 . 2]" 1
1988 1 99 ASP H 1 100 PHE HA . . 5.000 4.879 4.635 5.066 0.066 20 0 "[ . 1 . 2]" 1
1989 1 99 ASP HA 1 99 ASP QB . . 2.560 2.487 2.276 2.591 0.031 18 0 "[ . 1 . 2]" 1
1990 1 99 ASP HA 1 100 PHE H . . 2.770 2.187 2.123 2.250 . 0 0 "[ . 1 . 2]" 1
1991 1 99 ASP HA 1 100 PHE HB2 . . 4.470 4.460 4.252 4.523 0.053 3 0 "[ . 1 . 2]" 1
1992 1 99 ASP HA 1 100 PHE QD . . 5.500 4.162 3.523 4.561 . 0 0 "[ . 1 . 2]" 1
1993 1 99 ASP QB 1 100 PHE H . . 3.580 3.427 2.994 3.667 0.087 10 0 "[ . 1 . 2]" 1
1994 1 100 PHE H 1 100 PHE HB2 . . 3.200 2.300 2.147 2.357 . 0 0 "[ . 1 . 2]" 1
1995 1 100 PHE H 1 100 PHE HB3 . . 4.020 3.558 3.455 3.604 . 0 0 "[ . 1 . 2]" 1
1996 1 100 PHE H 1 100 PHE QD . . 3.220 2.736 2.212 3.067 . 0 0 "[ . 1 . 2]" 1
1997 1 100 PHE H 1 100 PHE QE . . 5.150 4.913 4.511 5.191 0.041 20 0 "[ . 1 . 2]" 1
1998 1 100 PHE H 1 101 LYS H . . 4.520 4.489 4.361 4.563 0.043 8 0 "[ . 1 . 2]" 1
1999 1 100 PHE HA 1 101 LYS H . . 3.150 2.108 2.030 2.205 . 0 0 "[ . 1 . 2]" 1
2000 1 100 PHE HB2 1 101 LYS H . . 4.600 4.441 4.173 4.566 . 0 0 "[ . 1 . 2]" 1
2001 1 100 PHE HB3 1 101 LYS H . . 3.840 3.451 3.031 3.644 . 0 0 "[ . 1 . 2]" 1
2002 1 100 PHE QD 1 101 LYS H . . 3.810 3.703 3.438 3.859 0.049 19 0 "[ . 1 . 2]" 1
2003 1 100 PHE QE 1 101 LYS H . . 5.500 5.560 5.376 5.602 0.102 18 0 "[ . 1 . 2]" 1
2004 1 101 LYS H 1 101 LYS QB . . 3.300 2.558 2.404 2.668 . 0 0 "[ . 1 . 2]" 1
2005 1 101 LYS H 1 101 LYS HB3 . . 3.910 3.746 3.644 3.851 . 0 0 "[ . 1 . 2]" 1
2006 1 101 LYS H 1 102 LEU H . . 4.530 4.486 4.402 4.567 0.037 4 0 "[ . 1 . 2]" 1
2007 1 101 LYS HA 1 101 LYS QG . . 3.360 2.676 2.157 3.210 . 0 0 "[ . 1 . 2]" 1
2008 1 101 LYS HA 1 102 LEU H . . 3.100 2.167 2.067 2.245 . 0 0 "[ . 1 . 2]" 1
2009 1 101 LYS QB 1 102 LEU H . . 3.370 2.737 2.626 2.916 . 0 0 "[ . 1 . 2]" 1
2010 1 101 LYS HB3 1 102 LEU H . . 3.940 2.797 2.665 3.013 . 0 0 "[ . 1 . 2]" 1
2011 1 102 LEU H 1 102 LEU QB . . 3.060 2.219 2.133 2.333 . 0 0 "[ . 1 . 2]" 1
2012 1 102 LEU H 1 102 LEU MD1 . . 5.500 4.300 4.117 4.339 . 0 0 "[ . 1 . 2]" 1
2013 1 102 LEU H 1 102 LEU MD2 . . 5.500 4.053 3.948 4.136 . 0 0 "[ . 1 . 2]" 1
2014 1 102 LEU H 1 102 LEU HG . . 4.930 4.522 4.421 4.640 . 0 0 "[ . 1 . 2]" 1
2015 1 102 LEU H 1 103 ALA H . . 4.650 4.545 4.440 4.642 . 0 0 "[ . 1 . 2]" 1
2016 1 102 LEU HA 1 102 LEU QD . . 2.980 2.091 1.904 2.154 . 0 0 "[ . 1 . 2]" 1
2017 1 102 LEU HA 1 102 LEU HG . . 3.860 3.733 3.607 3.818 . 0 0 "[ . 1 . 2]" 1
2018 1 102 LEU HA 1 103 ALA H . . 2.940 2.176 2.081 2.243 . 0 0 "[ . 1 . 2]" 1
2019 1 102 LEU HA 1 103 ALA HA . . 4.450 4.483 4.391 4.507 0.057 17 0 "[ . 1 . 2]" 1
2020 1 102 LEU HA 1 103 ALA MB . . 4.180 4.054 3.959 4.139 . 0 0 "[ . 1 . 2]" 1
2021 1 102 LEU QB 1 103 ALA H . . 3.870 3.755 3.625 3.840 . 0 0 "[ . 1 . 2]" 1
2022 1 102 LEU QD 1 103 ALA H . . 2.880 2.343 2.196 2.449 . 0 0 "[ . 1 . 2]" 1
2023 1 102 LEU QD 1 103 ALA HA . . 4.400 3.377 3.270 3.493 . 0 0 "[ . 1 . 2]" 1
2024 1 102 LEU QD 1 103 ALA MB . . 4.070 3.646 3.478 3.755 . 0 0 "[ . 1 . 2]" 1
2025 1 102 LEU QD 1 104 THR H . . 4.900 3.775 3.499 4.034 . 0 0 "[ . 1 . 2]" 1
2026 1 102 LEU QD 1 104 THR HA . . 5.440 3.533 3.357 3.724 . 0 0 "[ . 1 . 2]" 1
2027 1 102 LEU QD 1 104 THR HB . . 5.440 4.371 4.201 4.614 . 0 0 "[ . 1 . 2]" 1
2028 1 102 LEU QD 1 104 THR MG . . 2.850 2.035 1.945 2.418 . 0 0 "[ . 1 . 2]" 1
2029 1 102 LEU MD1 1 103 ALA H . . 3.590 2.818 2.344 3.404 . 0 0 "[ . 1 . 2]" 1
2030 1 102 LEU MD2 1 103 ALA H . . 3.590 2.555 2.290 2.891 . 0 0 "[ . 1 . 2]" 1
2031 1 102 LEU HG 1 103 ALA H . . 4.810 4.802 4.654 4.882 0.072 8 0 "[ . 1 . 2]" 1
2032 1 103 ALA H 1 103 ALA MB . . 3.250 2.439 2.328 2.531 . 0 0 "[ . 1 . 2]" 1
2033 1 103 ALA H 1 104 THR H . . 4.590 4.446 4.300 4.543 . 0 0 "[ . 1 . 2]" 1
2034 1 103 ALA HA 1 104 THR H . . 2.780 2.220 2.150 2.313 . 0 0 "[ . 1 . 2]" 1
2035 1 103 ALA HA 1 104 THR HA . . 4.510 4.459 4.390 4.517 0.007 6 0 "[ . 1 . 2]" 1
2036 1 103 ALA HA 1 104 THR HB . . 5.500 5.547 5.466 5.572 0.072 15 0 "[ . 1 . 2]" 1
2037 1 103 ALA MB 1 104 THR H . . 3.220 2.839 2.569 3.171 . 0 0 "[ . 1 . 2]" 1
2038 1 104 THR H 1 104 THR HB . . 3.650 3.599 3.447 3.698 0.048 8 0 "[ . 1 . 2]" 1
2039 1 104 THR H 1 104 THR MG . . 3.740 3.320 3.069 3.713 . 0 0 "[ . 1 . 2]" 1
2040 1 104 THR H 1 105 LYS H . . 4.560 4.473 4.386 4.576 0.016 14 0 "[ . 1 . 2]" 1
2041 1 104 THR HA 1 104 THR MG . . 3.010 2.214 2.084 2.281 . 0 0 "[ . 1 . 2]" 1
2042 1 104 THR HA 1 105 LYS H . . 2.870 2.216 2.124 2.305 . 0 0 "[ . 1 . 2]" 1
2043 1 104 THR HA 1 105 LYS QB . . 4.540 4.126 4.024 4.199 . 0 0 "[ . 1 . 2]" 1
2044 1 104 THR HB 1 105 LYS H . . 3.240 2.909 2.609 3.194 . 0 0 "[ . 1 . 2]" 1
2045 1 104 THR HB 1 105 LYS QB . . 5.340 4.329 4.062 4.603 . 0 0 "[ . 1 . 2]" 1
2046 1 104 THR MG 1 105 LYS H . . 3.410 3.334 2.880 3.493 0.083 15 0 "[ . 1 . 2]" 1
2047 1 105 LYS H 1 105 LYS QB . . 2.760 2.247 2.140 2.312 . 0 0 "[ . 1 . 2]" 1
2048 1 105 LYS H 1 105 LYS HB3 . . 3.160 2.512 2.247 2.902 . 0 0 "[ . 1 . 2]" 1
2049 1 105 LYS H 1 105 LYS HG2 . . 4.680 4.456 4.251 4.718 0.038 19 0 "[ . 1 . 2]" 1
2050 1 105 LYS H 1 106 VAL H . . 4.830 4.657 4.505 4.752 . 0 0 "[ . 1 . 2]" 1
2051 1 105 LYS H 1 106 VAL QG . . 5.440 4.848 4.080 5.470 0.030 16 0 "[ . 1 . 2]" 1
2052 1 105 LYS HA 1 105 LYS QE . . 5.500 4.234 3.793 5.082 . 0 0 "[ . 1 . 2]" 1
2053 1 105 LYS HA 1 105 LYS HG2 . . 3.560 3.194 2.718 3.538 . 0 0 "[ . 1 . 2]" 1
2054 1 105 LYS HA 1 106 VAL H . . 2.940 2.232 2.142 2.318 . 0 0 "[ . 1 . 2]" 1
2055 1 105 LYS HA 1 106 VAL HB . . 4.680 4.496 4.206 4.733 0.053 13 0 "[ . 1 . 2]" 1
2056 1 105 LYS QB 1 105 LYS QE . . 2.930 2.702 2.322 3.034 0.104 16 0 "[ . 1 . 2]" 1
2057 1 105 LYS HB3 1 106 VAL H . . 4.350 4.184 3.933 4.353 0.003 10 0 "[ . 1 . 2]" 1
2058 1 105 LYS QE 1 106 VAL H . . 5.220 4.760 4.283 5.288 0.068 6 0 "[ . 1 . 2]" 1
2059 1 105 LYS HG2 1 106 VAL H . . 3.490 3.031 2.346 3.398 . 0 0 "[ . 1 . 2]" 1
2060 1 105 LYS HG2 1 107 GLY H . . 5.020 4.726 3.658 5.089 0.069 12 0 "[ . 1 . 2]" 1
2061 1 106 VAL H 1 106 VAL HB . . 3.330 2.978 2.612 3.297 . 0 0 "[ . 1 . 2]" 1
2062 1 106 VAL H 1 107 GLY H . . 4.560 4.243 3.707 4.400 . 0 0 "[ . 1 . 2]" 1
2063 1 106 VAL HA 1 106 VAL MG1 . . 3.450 2.788 2.311 3.244 . 0 0 "[ . 1 . 2]" 1
2064 1 106 VAL HA 1 106 VAL QG . . 2.920 2.171 2.053 2.299 . 0 0 "[ . 1 . 2]" 1
2065 1 106 VAL HA 1 106 VAL MG2 . . 3.450 2.323 2.228 2.563 . 0 0 "[ . 1 . 2]" 1
2066 1 106 VAL HA 1 107 GLY H . . 2.670 2.269 1.971 2.574 . 0 0 "[ . 1 . 2]" 1
2067 1 106 VAL HA 1 108 ASN H . . 4.500 3.987 3.287 4.560 0.060 9 0 "[ . 1 . 2]" 1
2068 1 106 VAL HB 1 107 GLY H . . 4.210 4.094 3.736 4.291 0.081 20 0 "[ . 1 . 2]" 1
2069 1 106 VAL QG 1 107 GLY H . . 3.230 2.393 1.949 3.090 . 0 0 "[ . 1 . 2]" 1
2070 1 106 VAL QG 1 107 GLY QA . . 3.560 3.346 2.986 3.668 0.108 5 0 "[ . 1 . 2]" 1
2071 1 106 VAL QG 1 108 ASN H . . 4.160 2.588 1.705 4.249 0.089 4 0 "[ . 1 . 2]" 1
2072 1 106 VAL QG 1 108 ASN HA . . 5.440 4.517 3.685 5.545 0.105 10 0 "[ . 1 . 2]" 1
2073 1 107 GLY H 1 107 GLY QA . . 2.760 2.335 2.191 2.532 . 0 0 "[ . 1 . 2]" 1
2074 1 107 GLY H 1 108 ASN H . . 3.460 2.658 1.848 3.529 0.069 10 0 "[ . 1 . 2]" 1
2075 1 107 GLY QA 1 108 ASN H . . 2.880 2.791 2.402 2.959 0.079 1 0 "[ . 1 . 2]" 1
2076 1 108 ASN H 1 108 ASN QB . . 3.160 2.706 2.241 3.249 0.089 17 0 "[ . 1 . 2]" 1
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