NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
383396 |
1jwe   |
4297 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1jwe
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 1170
_Distance_constraint_stats_list.Viol_count 2407
_Distance_constraint_stats_list.Viol_total 2883.984
_Distance_constraint_stats_list.Viol_max 0.357
_Distance_constraint_stats_list.Viol_rms 0.0199
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0062
_Distance_constraint_stats_list.Viol_average_violations_only 0.0599
_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 2 LYS 0.086 0.086 8 0 "[ . 1 . 2]"
1 3 VAL 0.437 0.086 8 0 "[ . 1 . 2]"
1 4 PRO 0.134 0.063 3 0 "[ . 1 . 2]"
1 5 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 HIS 0.245 0.063 15 0 "[ . 1 . 2]"
1 7 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ILE 2.275 0.095 20 0 "[ . 1 . 2]"
1 9 GLU 2.263 0.090 4 0 "[ . 1 . 2]"
1 10 ALA 2.602 0.090 4 0 "[ . 1 . 2]"
1 11 GLU 2.229 0.095 20 0 "[ . 1 . 2]"
1 12 GLN 1.592 0.089 14 0 "[ . 1 . 2]"
1 13 SER 1.826 0.078 4 0 "[ . 1 . 2]"
1 14 VAL 2.591 0.083 8 0 "[ . 1 . 2]"
1 15 LEU 0.751 0.078 8 0 "[ . 1 . 2]"
1 16 GLY 0.810 0.078 8 0 "[ . 1 . 2]"
1 17 GLY 1.444 0.083 8 0 "[ . 1 . 2]"
1 18 LEU 0.446 0.070 15 0 "[ . 1 . 2]"
1 19 MET 1.295 0.077 18 0 "[ . 1 . 2]"
1 20 LEU 2.242 0.088 11 0 "[ . 1 . 2]"
1 21 ASP 4.324 0.089 3 0 "[ . 1 . 2]"
1 22 ASN 1.662 0.089 3 0 "[ . 1 . 2]"
1 23 GLU 2.694 0.091 12 0 "[ . 1 . 2]"
1 24 ARG 1.546 0.084 11 0 "[ . 1 . 2]"
1 25 TRP 2.920 0.088 18 0 "[ . 1 . 2]"
1 26 ASP 6.281 0.103 15 0 "[ . 1 . 2]"
1 27 ASP 4.956 0.103 15 0 "[ . 1 . 2]"
1 28 VAL 2.193 0.096 15 0 "[ . 1 . 2]"
1 29 ALA 2.529 0.083 2 0 "[ . 1 . 2]"
1 30 GLU 8.186 0.104 10 0 "[ . 1 . 2]"
1 31 ARG 2.185 0.081 19 0 "[ . 1 . 2]"
1 32 VAL 5.455 0.099 19 0 "[ . 1 . 2]"
1 33 VAL 0.633 0.070 19 0 "[ . 1 . 2]"
1 34 ALA 0.614 0.075 8 0 "[ . 1 . 2]"
1 35 ASP 2.387 0.085 15 0 "[ . 1 . 2]"
1 36 ASP 3.046 0.085 7 0 "[ . 1 . 2]"
1 37 PHE 1.868 0.075 8 0 "[ . 1 . 2]"
1 38 TYR 0.276 0.082 11 0 "[ . 1 . 2]"
1 39 THR 2.489 0.109 11 0 "[ . 1 . 2]"
1 41 PRO 1.658 0.080 11 0 "[ . 1 . 2]"
1 42 HIS 2.883 0.089 14 0 "[ . 1 . 2]"
1 43 ARG 3.654 0.090 11 0 "[ . 1 . 2]"
1 44 HIS 7.657 0.112 11 0 "[ . 1 . 2]"
1 45 ILE 0.843 0.097 11 0 "[ . 1 . 2]"
1 46 PHE 1.613 0.357 1 0 "[ . 1 . 2]"
1 47 THR 3.309 0.089 1 0 "[ . 1 . 2]"
1 48 GLU 0.883 0.082 9 0 "[ . 1 . 2]"
1 49 MET 0.453 0.063 17 0 "[ . 1 . 2]"
1 50 ALA 2.314 0.357 1 0 "[ . 1 . 2]"
1 51 ARG 3.408 0.086 7 0 "[ . 1 . 2]"
1 52 LEU 4.892 0.093 9 0 "[ . 1 . 2]"
1 53 GLN 5.389 0.094 17 0 "[ . 1 . 2]"
1 54 GLU 5.982 0.094 17 0 "[ . 1 . 2]"
1 55 SER 4.164 0.098 16 0 "[ . 1 . 2]"
1 56 GLY 3.413 0.085 2 0 "[ . 1 . 2]"
1 57 SER 2.939 0.084 3 0 "[ . 1 . 2]"
1 58 PRO 1.679 0.083 15 0 "[ . 1 . 2]"
1 59 ILE 1.241 0.077 17 0 "[ . 1 . 2]"
1 60 ASP 2.516 0.083 15 0 "[ . 1 . 2]"
1 61 LEU 2.146 0.097 7 0 "[ . 1 . 2]"
1 62 ILE 5.664 0.104 7 0 "[ . 1 . 2]"
1 63 THR 5.002 0.086 11 0 "[ . 1 . 2]"
1 64 LEU 5.218 0.087 14 0 "[ . 1 . 2]"
1 65 ALA 4.564 0.089 3 0 "[ . 1 . 2]"
1 66 GLU 2.940 0.079 11 0 "[ . 1 . 2]"
1 67 SER 6.817 0.084 6 0 "[ . 1 . 2]"
1 68 LEU 2.609 0.076 20 0 "[ . 1 . 2]"
1 69 GLU 3.393 0.094 8 0 "[ . 1 . 2]"
1 70 ARG 1.772 0.072 20 0 "[ . 1 . 2]"
1 71 GLN 1.656 0.072 20 0 "[ . 1 . 2]"
1 72 GLY 1.647 0.094 8 0 "[ . 1 . 2]"
1 73 GLN 0.686 0.076 4 0 "[ . 1 . 2]"
1 74 LEU 0.092 0.043 1 0 "[ . 1 . 2]"
1 75 ASP 0.189 0.059 6 0 "[ . 1 . 2]"
1 76 SER 0.265 0.077 18 0 "[ . 1 . 2]"
1 77 VAL 1.856 0.080 11 0 "[ . 1 . 2]"
1 78 GLY 1.172 0.079 18 0 "[ . 1 . 2]"
1 79 GLY 0.577 0.073 19 0 "[ . 1 . 2]"
1 80 PHE 1.062 0.097 7 0 "[ . 1 . 2]"
1 81 ALA 0.971 0.075 8 0 "[ . 1 . 2]"
1 82 TYR 0.718 0.077 9 0 "[ . 1 . 2]"
1 83 LEU 0.958 0.065 20 0 "[ . 1 . 2]"
1 84 ALA 2.347 0.079 7 0 "[ . 1 . 2]"
1 85 GLU 2.672 0.079 7 0 "[ . 1 . 2]"
1 86 LEU 1.888 0.082 8 0 "[ . 1 . 2]"
1 87 SER 3.129 0.081 9 0 "[ . 1 . 2]"
1 88 LYS 2.816 0.083 18 0 "[ . 1 . 2]"
1 89 ASN 2.719 0.098 9 0 "[ . 1 . 2]"
1 90 THR 1.843 0.098 9 0 "[ . 1 . 2]"
1 91 PRO 0.161 0.091 3 0 "[ . 1 . 2]"
1 92 SER 0.225 0.091 3 0 "[ . 1 . 2]"
1 93 ALA 0.111 0.057 19 0 "[ . 1 . 2]"
1 94 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ASN 0.175 0.067 16 0 "[ . 1 . 2]"
1 96 ILE 4.392 0.100 14 0 "[ . 1 . 2]"
1 97 SER 4.198 0.100 14 0 "[ . 1 . 2]"
1 98 ALA 3.283 0.086 15 0 "[ . 1 . 2]"
1 99 TYR 2.901 0.083 9 0 "[ . 1 . 2]"
1 100 ALA 3.624 0.079 5 0 "[ . 1 . 2]"
1 101 ASP 1.188 0.086 3 0 "[ . 1 . 2]"
1 102 ILE 0.946 0.086 3 0 "[ . 1 . 2]"
1 103 VAL 1.280 0.073 7 0 "[ . 1 . 2]"
1 104 ARG 2.393 0.075 8 0 "[ . 1 . 2]"
1 105 GLU 2.742 0.091 9 0 "[ . 1 . 2]"
1 106 ARG 2.358 0.091 9 0 "[ . 1 . 2]"
1 107 ALA 0.240 0.061 7 0 "[ . 1 . 2]"
1 108 VAL 2.461 0.082 20 0 "[ . 1 . 2]"
1 109 VAL 2.153 0.079 17 0 "[ . 1 . 2]"
1 110 ARG 3.074 0.090 12 0 "[ . 1 . 2]"
1 111 GLU 3.969 0.095 3 0 "[ . 1 . 2]"
1 112 MET 1.716 0.095 3 0 "[ . 1 . 2]"
1 113 ILE 1.921 0.084 7 0 "[ . 1 . 2]"
1 114 SER 0.003 0.003 16 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 LYS HA 1 3 VAL H . . 3.050 2.368 2.067 3.136 0.086 8 0 "[ . 1 . 2]" 1
2 1 2 LYS QD 1 3 VAL HB . . 5.200 4.323 3.238 4.761 . 0 0 "[ . 1 . 2]" 1
3 1 3 VAL H 1 3 VAL HB . . 3.670 2.882 2.175 3.751 0.081 4 0 "[ . 1 . 2]" 1
4 1 3 VAL H 1 4 PRO HA . . 5.500 5.099 4.619 5.563 0.063 3 0 "[ . 1 . 2]" 1
5 1 3 VAL HA 1 4 PRO HD2 . . 3.210 2.331 2.111 2.946 . 0 0 "[ . 1 . 2]" 1
6 1 3 VAL HA 1 4 PRO QD . . 2.930 2.118 2.008 2.271 . 0 0 "[ . 1 . 2]" 1
7 1 3 VAL HA 1 4 PRO HD3 . . 3.210 2.522 2.070 2.793 . 0 0 "[ . 1 . 2]" 1
8 1 3 VAL HB 1 4 PRO QD . . 5.640 3.912 2.513 4.314 . 0 0 "[ . 1 . 2]" 1
9 1 3 VAL MG1 1 4 PRO HD2 . . 5.440 2.590 2.028 3.923 . 0 0 "[ . 1 . 2]" 1
10 1 3 VAL MG1 1 4 PRO QD . . 5.040 2.532 2.014 3.713 . 0 0 "[ . 1 . 2]" 1
11 1 3 VAL MG1 1 4 PRO HD3 . . 5.440 3.781 3.027 4.587 . 0 0 "[ . 1 . 2]" 1
12 1 3 VAL MG1 1 6 HIS HE1 . . 4.640 3.106 2.096 3.980 . 0 0 "[ . 1 . 2]" 1
13 1 4 PRO HA 1 5 PRO HD2 . . 3.790 2.490 2.130 2.927 . 0 0 "[ . 1 . 2]" 1
14 1 4 PRO HA 1 5 PRO QD . . 3.500 2.176 2.026 2.438 . 0 0 "[ . 1 . 2]" 1
15 1 4 PRO HA 1 5 PRO HD3 . . 3.790 2.474 2.080 2.755 . 0 0 "[ . 1 . 2]" 1
16 1 4 PRO QB 1 38 TYR QE . . 7.250 5.291 3.916 6.031 . 0 0 "[ . 1 . 2]" 1
17 1 4 PRO HB2 1 38 TYR QE . . 7.630 5.773 4.017 6.703 . 0 0 "[ . 1 . 2]" 1
18 1 4 PRO HB3 1 38 TYR QE . . 7.630 6.237 4.504 7.108 . 0 0 "[ . 1 . 2]" 1
19 1 4 PRO HG2 1 38 TYR QE . . 7.540 4.877 3.157 6.371 . 0 0 "[ . 1 . 2]" 1
20 1 4 PRO HG3 1 38 TYR QE . . 7.540 4.882 3.054 6.582 . 0 0 "[ . 1 . 2]" 1
21 1 6 HIS HA 1 106 ARG HB2 . . 4.540 3.953 2.748 4.603 0.063 15 0 "[ . 1 . 2]" 1
22 1 6 HIS HA 1 106 ARG HB3 . . 4.170 3.057 2.163 4.199 0.029 13 0 "[ . 1 . 2]" 1
23 1 6 HIS HD2 1 8 ILE MD . . 4.700 3.335 2.215 4.054 . 0 0 "[ . 1 . 2]" 1
24 1 7 SER HA 1 8 ILE H . . 3.210 2.606 2.242 3.156 . 0 0 "[ . 1 . 2]" 1
25 1 7 SER QB 1 10 ALA H . . 4.860 3.217 2.610 3.988 . 0 0 "[ . 1 . 2]" 1
26 1 7 SER QB 1 10 ALA MB . . 5.030 2.149 1.945 2.376 . 0 0 "[ . 1 . 2]" 1
27 1 7 SER QB 1 102 ILE MG . . 4.590 2.442 2.018 3.171 . 0 0 "[ . 1 . 2]" 1
28 1 7 SER HB2 1 10 ALA MB . . 5.540 2.639 2.116 3.546 . 0 0 "[ . 1 . 2]" 1
29 1 7 SER HB2 1 102 ILE MG . . 5.130 2.860 2.189 4.133 . 0 0 "[ . 1 . 2]" 1
30 1 7 SER HB3 1 10 ALA MB . . 5.540 2.604 2.022 3.525 . 0 0 "[ . 1 . 2]" 1
31 1 7 SER HB3 1 102 ILE MG . . 5.130 2.817 2.096 4.118 . 0 0 "[ . 1 . 2]" 1
32 1 8 ILE H 1 8 ILE HB . . 3.140 2.350 1.875 2.825 . 0 0 "[ . 1 . 2]" 1
33 1 8 ILE H 1 9 GLU H . . 3.210 3.038 2.712 3.283 0.073 11 0 "[ . 1 . 2]" 1
34 1 8 ILE HA 1 8 ILE MD . . 4.230 2.453 1.987 3.673 . 0 0 "[ . 1 . 2]" 1
35 1 8 ILE HA 1 11 GLU H . . 3.980 3.567 3.163 4.017 0.037 3 0 "[ . 1 . 2]" 1
36 1 8 ILE HA 1 11 GLU HB2 . . 3.890 2.619 2.148 3.985 0.095 20 0 "[ . 1 . 2]" 1
37 1 8 ILE HA 1 11 GLU HB3 . . 3.890 3.809 2.519 3.977 0.087 8 0 "[ . 1 . 2]" 1
38 1 8 ILE HA 1 42 HIS HE1 . . 3.080 2.629 2.112 3.158 0.078 20 0 "[ . 1 . 2]" 1
39 1 8 ILE HB 1 9 GLU H . . 3.240 2.634 2.123 3.318 0.078 2 0 "[ . 1 . 2]" 1
40 1 8 ILE MD 1 38 TYR QD . . 8.170 3.780 2.919 5.017 . 0 0 "[ . 1 . 2]" 1
41 1 8 ILE MD 1 42 HIS HE1 . . 4.020 3.207 2.735 3.377 . 0 0 "[ . 1 . 2]" 1
42 1 8 ILE MG 1 9 GLU H . . 5.100 2.876 2.049 3.346 . 0 0 "[ . 1 . 2]" 1
43 1 8 ILE MG 1 9 GLU QG . . 6.380 2.431 2.036 3.060 . 0 0 "[ . 1 . 2]" 1
44 1 8 ILE MG 1 12 GLN H . . 6.530 4.178 3.993 4.506 . 0 0 "[ . 1 . 2]" 1
45 1 8 ILE MG 1 12 GLN HE21 . . 6.060 3.554 1.976 4.888 . 0 0 "[ . 1 . 2]" 1
46 1 8 ILE MG 1 12 GLN QE . . 5.780 3.286 1.959 4.337 . 0 0 "[ . 1 . 2]" 1
47 1 8 ILE MG 1 12 GLN HE22 . . 6.060 3.971 2.644 4.849 . 0 0 "[ . 1 . 2]" 1
48 1 8 ILE MG 1 12 GLN HG3 . . 4.920 2.838 2.434 3.305 . 0 0 "[ . 1 . 2]" 1
49 1 8 ILE MG 1 42 HIS HE1 . . 4.020 2.153 1.967 3.104 . 0 0 "[ . 1 . 2]" 1
50 1 9 GLU H 1 9 GLU QB . . 3.540 2.233 2.173 2.343 . 0 0 "[ . 1 . 2]" 1
51 1 9 GLU H 1 10 ALA H . . 3.550 2.695 2.504 2.778 . 0 0 "[ . 1 . 2]" 1
52 1 9 GLU HA 1 12 GLN H . . 3.790 3.091 2.878 3.513 . 0 0 "[ . 1 . 2]" 1
53 1 9 GLU HB2 1 10 ALA H . . 3.640 3.032 2.857 3.222 . 0 0 "[ . 1 . 2]" 1
54 1 9 GLU HB3 1 10 ALA H . . 3.640 3.721 3.711 3.730 0.090 4 0 "[ . 1 . 2]" 1
55 1 9 GLU QG 1 10 ALA H . . 6.380 4.297 4.083 4.450 . 0 0 "[ . 1 . 2]" 1
56 1 9 GLU QG 1 42 HIS HE1 . . 5.290 4.760 4.490 4.860 . 0 0 "[ . 1 . 2]" 1
57 1 10 ALA H 1 11 GLU H . . 2.800 2.592 2.471 2.718 . 0 0 "[ . 1 . 2]" 1
58 1 10 ALA HA 1 11 GLU H . . 3.550 3.586 3.548 3.610 0.060 7 0 "[ . 1 . 2]" 1
59 1 10 ALA HA 1 13 SER H . . 3.420 3.327 3.081 3.476 0.056 6 0 "[ . 1 . 2]" 1
60 1 10 ALA HA 1 13 SER HB2 . . 3.300 2.767 2.372 3.335 0.035 15 0 "[ . 1 . 2]" 1
61 1 10 ALA HA 1 99 TYR QD . . 5.930 2.992 2.057 4.197 . 0 0 "[ . 1 . 2]" 1
62 1 10 ALA MB 1 13 SER HB2 . . 5.160 4.108 3.643 4.336 . 0 0 "[ . 1 . 2]" 1
63 1 10 ALA MB 1 14 VAL MG2 . . 7.560 3.597 3.294 4.236 . 0 0 "[ . 1 . 2]" 1
64 1 10 ALA MB 1 99 TYR HA . . 5.660 3.073 2.421 4.379 . 0 0 "[ . 1 . 2]" 1
65 1 10 ALA MB 1 99 TYR QD . . 6.810 2.669 2.033 3.860 . 0 0 "[ . 1 . 2]" 1
66 1 10 ALA MB 1 99 TYR QE . . 8.410 3.957 2.491 5.463 . 0 0 "[ . 1 . 2]" 1
67 1 10 ALA MB 1 102 ILE HB . . 4.790 2.973 2.302 3.887 . 0 0 "[ . 1 . 2]" 1
68 1 10 ALA MB 1 102 ILE MD . . 6.720 2.928 2.072 3.966 . 0 0 "[ . 1 . 2]" 1
69 1 10 ALA MB 1 102 ILE MG . . 5.420 2.656 2.160 3.469 . 0 0 "[ . 1 . 2]" 1
70 1 10 ALA MB 1 103 VAL H . . 6.060 3.895 3.162 4.944 . 0 0 "[ . 1 . 2]" 1
71 1 10 ALA MB 1 103 VAL MG2 . . 5.250 2.664 2.090 3.389 . 0 0 "[ . 1 . 2]" 1
72 1 11 GLU H 1 11 GLU QB . . 3.640 2.327 2.043 2.532 . 0 0 "[ . 1 . 2]" 1
73 1 11 GLU H 1 11 GLU QG . . 4.090 2.533 2.207 3.263 . 0 0 "[ . 1 . 2]" 1
74 1 11 GLU H 1 12 GLN H . . 3.110 2.791 2.650 2.866 . 0 0 "[ . 1 . 2]" 1
75 1 11 GLU H 1 103 VAL MG2 . . 6.220 3.104 2.753 3.660 . 0 0 "[ . 1 . 2]" 1
76 1 11 GLU HA 1 14 VAL H . . 3.700 3.455 3.080 3.762 0.062 2 0 "[ . 1 . 2]" 1
77 1 11 GLU HA 1 14 VAL MG2 . . 5.910 3.094 2.222 3.536 . 0 0 "[ . 1 . 2]" 1
78 1 11 GLU HA 1 37 PHE QE . . 5.520 2.846 2.322 4.081 . 0 0 "[ . 1 . 2]" 1
79 1 11 GLU HA 1 103 VAL MG2 . . 3.950 2.284 2.087 2.603 . 0 0 "[ . 1 . 2]" 1
80 1 11 GLU QB 1 12 GLN H . . 4.240 2.637 2.407 3.455 . 0 0 "[ . 1 . 2]" 1
81 1 11 GLU QB 1 37 PHE QD . . 6.140 2.642 2.106 4.061 . 0 0 "[ . 1 . 2]" 1
82 1 11 GLU QB 1 42 HIS HD1 . . 4.200 2.296 1.948 3.886 . 0 0 "[ . 1 . 2]" 1
83 1 11 GLU QB 1 42 HIS HE1 . . 5.170 3.020 2.540 4.530 . 0 0 "[ . 1 . 2]" 1
84 1 11 GLU QG 1 103 VAL MG2 . . 4.480 2.176 1.888 3.429 . 0 0 "[ . 1 . 2]" 1
85 1 11 GLU HG2 1 103 VAL MG2 . . 4.760 2.588 2.117 3.719 . 0 0 "[ . 1 . 2]" 1
86 1 11 GLU HG3 1 103 VAL MG2 . . 4.760 2.395 2.035 4.020 . 0 0 "[ . 1 . 2]" 1
87 1 12 GLN H 1 12 GLN HB2 . . 2.930 2.505 2.398 2.698 . 0 0 "[ . 1 . 2]" 1
88 1 12 GLN H 1 12 GLN HB3 . . 3.730 3.628 3.584 3.690 . 0 0 "[ . 1 . 2]" 1
89 1 12 GLN H 1 12 GLN HG2 . . 3.520 3.341 2.543 3.582 0.062 20 0 "[ . 1 . 2]" 1
90 1 12 GLN H 1 12 GLN HG3 . . 3.550 2.539 2.266 3.256 . 0 0 "[ . 1 . 2]" 1
91 1 12 GLN H 1 13 SER H . . 3.020 2.853 2.722 2.977 . 0 0 "[ . 1 . 2]" 1
92 1 12 GLN HA 1 12 GLN HG2 . . 3.980 2.390 2.163 2.629 . 0 0 "[ . 1 . 2]" 1
93 1 12 GLN HA 1 15 LEU H . . 5.220 3.633 3.276 4.024 . 0 0 "[ . 1 . 2]" 1
94 1 12 GLN HA 1 15 LEU MD1 . . 5.320 3.062 2.334 3.757 . 0 0 "[ . 1 . 2]" 1
95 1 12 GLN HA 1 42 HIS HE1 . . 4.380 4.429 4.148 4.469 0.089 14 0 "[ . 1 . 2]" 1
96 1 12 GLN HA 1 86 LEU MD2 . . 3.920 2.338 1.956 3.074 . 0 0 "[ . 1 . 2]" 1
97 1 12 GLN HB2 1 13 SER H . . 3.300 2.619 2.333 3.085 . 0 0 "[ . 1 . 2]" 1
98 1 12 GLN HB2 1 86 LEU MD2 . . 6.220 3.609 3.438 3.984 . 0 0 "[ . 1 . 2]" 1
99 1 12 GLN HB3 1 13 SER H . . 3.860 3.492 3.160 3.821 . 0 0 "[ . 1 . 2]" 1
100 1 12 GLN QE 1 82 TYR QE . . 6.830 3.276 2.360 5.285 . 0 0 "[ . 1 . 2]" 1
101 1 12 GLN QE 1 86 LEU MD2 . . 6.050 2.676 1.882 4.401 . 0 0 "[ . 1 . 2]" 1
102 1 12 GLN HE21 1 82 TYR QE . . 7.630 3.663 2.823 6.295 . 0 0 "[ . 1 . 2]" 1
103 1 12 GLN HE21 1 86 LEU MD2 . . 6.530 2.817 1.902 4.835 . 0 0 "[ . 1 . 2]" 1
104 1 12 GLN HE22 1 82 TYR QE . . 7.630 3.749 2.450 5.678 . 0 0 "[ . 1 . 2]" 1
105 1 12 GLN HE22 1 86 LEU MD2 . . 6.530 3.477 2.579 5.063 . 0 0 "[ . 1 . 2]" 1
106 1 12 GLN HG2 1 86 LEU MD2 . . 4.140 2.198 2.021 3.011 . 0 0 "[ . 1 . 2]" 1
107 1 12 GLN HG3 1 42 HIS HE1 . . 3.480 2.466 2.116 3.529 0.049 10 0 "[ . 1 . 2]" 1
108 1 12 GLN HG3 1 86 LEU MD2 . . 5.160 3.509 3.371 3.859 . 0 0 "[ . 1 . 2]" 1
109 1 13 SER H 1 13 SER HB2 . . 2.930 2.452 2.337 2.599 . 0 0 "[ . 1 . 2]" 1
110 1 13 SER H 1 13 SER HB3 . . 3.550 3.564 3.512 3.607 0.057 20 0 "[ . 1 . 2]" 1
111 1 13 SER H 1 14 VAL H . . 2.800 2.748 2.517 2.869 0.069 5 0 "[ . 1 . 2]" 1
112 1 13 SER HA 1 16 GLY H . . 3.980 3.551 2.954 3.986 0.006 18 0 "[ . 1 . 2]" 1
113 1 13 SER HA 1 17 GLY H . . 3.950 3.702 3.338 3.995 0.045 5 0 "[ . 1 . 2]" 1
114 1 13 SER HA 1 89 ASN QB . . 6.380 4.356 3.316 5.610 . 0 0 "[ . 1 . 2]" 1
115 1 13 SER HA 1 90 THR MG . . 5.600 3.457 2.672 4.722 . 0 0 "[ . 1 . 2]" 1
116 1 13 SER HB2 1 14 VAL H . . 3.300 2.932 2.647 3.187 . 0 0 "[ . 1 . 2]" 1
117 1 13 SER HB2 1 99 TYR QD . . 7.640 3.135 2.077 3.780 . 0 0 "[ . 1 . 2]" 1
118 1 13 SER HB3 1 14 VAL H . . 3.860 3.872 3.648 3.938 0.078 4 0 "[ . 1 . 2]" 1
119 1 13 SER HB3 1 99 TYR QD . . 7.640 3.237 2.763 4.016 . 0 0 "[ . 1 . 2]" 1
120 1 13 SER HB3 1 99 TYR QE . . 7.630 3.066 2.448 3.804 . 0 0 "[ . 1 . 2]" 1
121 1 14 VAL H 1 14 VAL HB . . 2.740 2.457 2.315 2.694 . 0 0 "[ . 1 . 2]" 1
122 1 14 VAL H 1 14 VAL MG2 . . 3.800 2.328 2.157 2.463 . 0 0 "[ . 1 . 2]" 1
123 1 14 VAL H 1 15 LEU H . . 2.930 2.683 2.422 2.800 . 0 0 "[ . 1 . 2]" 1
124 1 14 VAL HA 1 17 GLY H . . 3.360 3.430 3.392 3.443 0.083 8 0 "[ . 1 . 2]" 1
125 1 14 VAL HA 1 96 ILE MD . . 4.450 2.662 1.938 3.305 . 0 0 "[ . 1 . 2]" 1
126 1 14 VAL HA 1 96 ILE QG . . 5.140 2.539 1.976 4.305 . 0 0 "[ . 1 . 2]" 1
127 1 14 VAL HB 1 15 LEU H . . 2.900 2.474 2.317 2.592 . 0 0 "[ . 1 . 2]" 1
128 1 14 VAL HB 1 37 PHE QE . . 5.860 3.237 2.372 3.674 . 0 0 "[ . 1 . 2]" 1
129 1 14 VAL QG 1 15 LEU HA . . 6.720 3.261 3.047 3.600 . 0 0 "[ . 1 . 2]" 1
130 1 14 VAL MG1 1 15 LEU H . . 4.610 3.206 2.933 3.459 . 0 0 "[ . 1 . 2]" 1
131 1 14 VAL MG1 1 18 LEU H . . 5.600 4.230 4.077 4.441 . 0 0 "[ . 1 . 2]" 1
132 1 14 VAL MG1 1 28 VAL MG1 . . 5.420 2.038 1.945 2.232 . 0 0 "[ . 1 . 2]" 1
133 1 14 VAL MG1 1 32 VAL MG1 . . 7.090 4.263 3.754 4.648 . 0 0 "[ . 1 . 2]" 1
134 1 14 VAL MG1 1 32 VAL MG2 . . 6.660 2.961 2.566 3.453 . 0 0 "[ . 1 . 2]" 1
135 1 14 VAL MG1 1 37 PHE QE . . 7.280 3.373 2.758 3.776 . 0 0 "[ . 1 . 2]" 1
136 1 14 VAL MG1 1 37 PHE HZ . . 4.020 2.507 2.156 3.046 . 0 0 "[ . 1 . 2]" 1
137 1 14 VAL MG1 1 100 ALA MB . . 5.940 2.653 2.275 2.959 . 0 0 "[ . 1 . 2]" 1
138 1 14 VAL MG2 1 15 LEU H . . 4.610 3.878 3.608 3.936 . 0 0 "[ . 1 . 2]" 1
139 1 14 VAL MG2 1 32 VAL MG2 . . 7.560 3.892 3.482 4.496 . 0 0 "[ . 1 . 2]" 1
140 1 14 VAL MG2 1 99 TYR HB2 . . 4.730 2.351 2.125 2.678 . 0 0 "[ . 1 . 2]" 1
141 1 14 VAL MG2 1 99 TYR HB3 . . 4.510 2.158 2.084 2.262 . 0 0 "[ . 1 . 2]" 1
142 1 14 VAL MG2 1 99 TYR QD . . 7.830 3.483 2.706 3.885 . 0 0 "[ . 1 . 2]" 1
143 1 14 VAL MG2 1 100 ALA H . . 4.610 2.699 2.522 2.989 . 0 0 "[ . 1 . 2]" 1
144 1 14 VAL MG2 1 100 ALA HA . . 3.890 2.295 2.142 2.615 . 0 0 "[ . 1 . 2]" 1
145 1 14 VAL MG2 1 100 ALA MB . . 6.220 2.478 2.202 2.825 . 0 0 "[ . 1 . 2]" 1
146 1 15 LEU H 1 15 LEU HB2 . . 3.020 2.453 2.242 2.637 . 0 0 "[ . 1 . 2]" 1
147 1 15 LEU H 1 15 LEU MD2 . . 5.540 3.420 3.105 3.839 . 0 0 "[ . 1 . 2]" 1
148 1 15 LEU H 1 15 LEU HG . . 5.500 2.261 2.120 2.489 . 0 0 "[ . 1 . 2]" 1
149 1 15 LEU H 1 16 GLY H . . 3.140 2.792 2.642 2.945 . 0 0 "[ . 1 . 2]" 1
150 1 15 LEU HA 1 15 LEU MD2 . . 3.890 2.145 2.075 2.204 . 0 0 "[ . 1 . 2]" 1
151 1 15 LEU HA 1 18 LEU H . . 4.010 3.391 3.209 3.656 . 0 0 "[ . 1 . 2]" 1
152 1 15 LEU HA 1 18 LEU MD1 . . 5.190 2.361 2.133 3.217 . 0 0 "[ . 1 . 2]" 1
153 1 15 LEU HA 1 49 MET ME . . 4.420 3.171 2.286 3.562 . 0 0 "[ . 1 . 2]" 1
154 1 15 LEU HB2 1 16 GLY H . . 3.330 2.629 2.433 2.880 . 0 0 "[ . 1 . 2]" 1
155 1 15 LEU HB3 1 16 GLY H . . 3.580 3.593 3.355 3.658 0.078 8 0 "[ . 1 . 2]" 1
156 1 15 LEU MD1 1 37 PHE QD . . 7.640 3.265 2.444 4.570 . 0 0 "[ . 1 . 2]" 1
157 1 15 LEU MD1 1 37 PHE QE . . 7.450 3.075 2.355 4.836 . 0 0 "[ . 1 . 2]" 1
158 1 15 LEU MD1 1 42 HIS HA . . 4.730 2.179 1.975 2.571 . 0 0 "[ . 1 . 2]" 1
159 1 15 LEU MD1 1 42 HIS HB2 . . 6.280 3.559 3.376 3.871 . 0 0 "[ . 1 . 2]" 1
160 1 15 LEU MD1 1 42 HIS HB3 . . 5.130 2.172 2.011 2.351 . 0 0 "[ . 1 . 2]" 1
161 1 15 LEU MD1 1 42 HIS HD2 . . 4.670 3.118 2.593 3.890 . 0 0 "[ . 1 . 2]" 1
162 1 15 LEU MD1 1 45 ILE HB . . 4.790 2.348 2.181 3.170 . 0 0 "[ . 1 . 2]" 1
163 1 15 LEU MD1 1 45 ILE MD . . 6.690 2.520 2.139 3.109 . 0 0 "[ . 1 . 2]" 1
164 1 15 LEU MD1 1 45 ILE MG . . 5.820 2.640 2.187 3.238 . 0 0 "[ . 1 . 2]" 1
165 1 15 LEU MD1 1 46 PHE H . . 6.530 3.519 3.075 4.423 . 0 0 "[ . 1 . 2]" 1
166 1 15 LEU MD2 1 37 PHE QE . . 7.060 3.143 2.348 3.492 . 0 0 "[ . 1 . 2]" 1
167 1 15 LEU MD2 1 37 PHE HZ . . 4.760 3.306 2.741 3.877 . 0 0 "[ . 1 . 2]" 1
168 1 15 LEU MD2 1 46 PHE H . . 5.740 2.988 2.588 3.469 . 0 0 "[ . 1 . 2]" 1
169 1 15 LEU MD2 1 46 PHE HA . . 4.720 3.055 2.359 3.765 . 0 0 "[ . 1 . 2]" 1
170 1 15 LEU MD2 1 46 PHE HB2 . . 4.380 2.433 2.163 2.827 . 0 0 "[ . 1 . 2]" 1
171 1 15 LEU MD2 1 46 PHE QD . . 5.610 2.445 2.088 3.163 . 0 0 "[ . 1 . 2]" 1
172 1 15 LEU MD2 1 49 MET ME . . 5.450 3.286 2.558 3.623 . 0 0 "[ . 1 . 2]" 1
173 1 15 LEU HG 1 37 PHE QE . . 6.380 2.678 2.268 4.173 . 0 0 "[ . 1 . 2]" 1
174 1 16 GLY H 1 16 GLY HA2 . . 2.960 2.855 2.811 2.902 . 0 0 "[ . 1 . 2]" 1
175 1 16 GLY H 1 16 GLY HA3 . . 2.680 2.286 2.244 2.341 . 0 0 "[ . 1 . 2]" 1
176 1 16 GLY H 1 17 GLY H . . 3.050 2.733 2.573 2.864 . 0 0 "[ . 1 . 2]" 1
177 1 16 GLY H 1 86 LEU HB2 . . 5.500 4.946 4.158 5.553 0.053 12 0 "[ . 1 . 2]" 1
178 1 16 GLY HA2 1 19 MET H . . 4.570 3.542 3.095 3.833 . 0 0 "[ . 1 . 2]" 1
179 1 16 GLY HA2 1 19 MET ME . . 5.810 2.696 2.135 3.813 . 0 0 "[ . 1 . 2]" 1
180 1 16 GLY HA2 1 87 SER HA . . 4.450 2.679 2.148 3.462 . 0 0 "[ . 1 . 2]" 1
181 1 16 GLY HA3 1 17 GLY H . . 3.170 2.873 2.692 3.054 . 0 0 "[ . 1 . 2]" 1
182 1 16 GLY HA3 1 19 MET ME . . 6.160 4.053 3.444 5.011 . 0 0 "[ . 1 . 2]" 1
183 1 16 GLY HA3 1 87 SER HA . . 4.170 3.173 2.597 3.786 . 0 0 "[ . 1 . 2]" 1
184 1 16 GLY HA3 1 90 THR MG . . 6.430 3.679 2.599 4.474 . 0 0 "[ . 1 . 2]" 1
185 1 17 GLY H 1 18 LEU H . . 2.900 2.736 2.562 2.866 . 0 0 "[ . 1 . 2]" 1
186 1 17 GLY H 1 90 THR MG . . 5.350 2.964 2.642 4.422 . 0 0 "[ . 1 . 2]" 1
187 1 17 GLY H 1 96 ILE MD . . 5.600 3.499 2.752 3.717 . 0 0 "[ . 1 . 2]" 1
188 1 17 GLY QA 1 20 LEU H . . 5.290 3.251 2.992 3.561 . 0 0 "[ . 1 . 2]" 1
189 1 17 GLY QA 1 21 ASP H . . 5.970 3.865 3.636 4.397 . 0 0 "[ . 1 . 2]" 1
190 1 17 GLY QA 1 90 THR MG . . 6.130 2.155 1.914 3.657 . 0 0 "[ . 1 . 2]" 1
191 1 17 GLY QA 1 96 ILE MD . . 6.230 2.144 1.886 2.941 . 0 0 "[ . 1 . 2]" 1
192 1 18 LEU H 1 18 LEU HB2 . . 2.740 2.371 2.315 2.487 . 0 0 "[ . 1 . 2]" 1
193 1 18 LEU H 1 18 LEU MD1 . . 5.880 3.554 3.283 3.658 . 0 0 "[ . 1 . 2]" 1
194 1 18 LEU H 1 18 LEU MD2 . . 4.920 3.590 3.411 3.848 . 0 0 "[ . 1 . 2]" 1
195 1 18 LEU H 1 18 LEU HG . . 2.990 2.448 2.289 2.562 . 0 0 "[ . 1 . 2]" 1
196 1 18 LEU H 1 19 MET H . . 2.930 2.704 2.565 2.922 . 0 0 "[ . 1 . 2]" 1
197 1 18 LEU H 1 96 ILE MD . . 4.790 3.097 2.652 3.926 . 0 0 "[ . 1 . 2]" 1
198 1 18 LEU HA 1 18 LEU MD2 . . 3.890 2.113 2.042 2.164 . 0 0 "[ . 1 . 2]" 1
199 1 18 LEU HA 1 21 ASP H . . 3.360 3.271 2.937 3.430 0.070 15 0 "[ . 1 . 2]" 1
200 1 18 LEU HA 1 96 ILE MD . . 5.780 3.645 3.006 4.763 . 0 0 "[ . 1 . 2]" 1
201 1 18 LEU HB2 1 19 MET H . . 2.990 2.787 2.484 3.052 0.062 14 0 "[ . 1 . 2]" 1
202 1 18 LEU HB3 1 19 MET H . . 4.320 3.649 3.452 3.810 . 0 0 "[ . 1 . 2]" 1
203 1 18 LEU HB3 1 49 MET ME . . 5.010 2.928 2.630 3.352 . 0 0 "[ . 1 . 2]" 1
204 1 18 LEU HB3 1 59 ILE MD . . 5.880 2.147 2.038 2.408 . 0 0 "[ . 1 . 2]" 1
205 1 18 LEU MD1 1 25 TRP HA . . 5.750 3.448 2.991 3.939 . 0 0 "[ . 1 . 2]" 1
206 1 18 LEU MD1 1 25 TRP HE3 . . 4.140 2.292 2.117 2.646 . 0 0 "[ . 1 . 2]" 1
207 1 18 LEU MD1 1 25 TRP HZ3 . . 4.450 2.459 2.149 2.886 . 0 0 "[ . 1 . 2]" 1
208 1 18 LEU MD1 1 28 VAL MG1 . . 5.880 2.142 2.057 2.317 . 0 0 "[ . 1 . 2]" 1
209 1 18 LEU MD1 1 28 VAL MG2 . . 6.010 3.160 2.621 3.679 . 0 0 "[ . 1 . 2]" 1
210 1 18 LEU MD1 1 46 PHE QD . . 7.190 3.328 2.336 4.558 . 0 0 "[ . 1 . 2]" 1
211 1 18 LEU MD1 1 46 PHE QE . . 6.980 3.185 2.169 4.535 . 0 0 "[ . 1 . 2]" 1
212 1 18 LEU MD1 1 49 MET ME . . 7.150 3.029 2.558 3.548 . 0 0 "[ . 1 . 2]" 1
213 1 18 LEU MD2 1 22 ASN HA . . 5.690 3.674 3.245 4.315 . 0 0 "[ . 1 . 2]" 1
214 1 18 LEU MD2 1 24 ARG H . . 5.410 3.915 3.453 4.498 . 0 0 "[ . 1 . 2]" 1
215 1 18 LEU MD2 1 25 TRP H . . 5.190 2.991 2.767 3.348 . 0 0 "[ . 1 . 2]" 1
216 1 18 LEU MD2 1 25 TRP HA . . 4.140 1.989 1.932 2.100 . 0 0 "[ . 1 . 2]" 1
217 1 18 LEU MD2 1 25 TRP HB2 . . 5.540 2.761 2.515 3.066 . 0 0 "[ . 1 . 2]" 1
218 1 18 LEU MD2 1 25 TRP HB3 . . 6.530 3.943 3.813 4.154 . 0 0 "[ . 1 . 2]" 1
219 1 18 LEU MD2 1 25 TRP HE3 . . 3.860 2.455 2.115 3.021 . 0 0 "[ . 1 . 2]" 1
220 1 18 LEU MD2 1 28 VAL H . . 6.030 3.725 3.415 3.949 . 0 0 "[ . 1 . 2]" 1
221 1 18 LEU MD2 1 28 VAL HB . . 4.790 2.369 2.153 2.829 . 0 0 "[ . 1 . 2]" 1
222 1 19 MET H 1 19 MET HB2 . . 2.930 2.564 2.371 2.696 . 0 0 "[ . 1 . 2]" 1
223 1 19 MET H 1 19 MET QG . . 4.640 2.302 1.957 3.254 . 0 0 "[ . 1 . 2]" 1
224 1 19 MET HA 1 20 LEU H . . 3.480 3.515 3.441 3.540 0.060 7 0 "[ . 1 . 2]" 1
225 1 19 MET HA 1 22 ASN QD . . 5.870 4.300 2.353 5.233 . 0 0 "[ . 1 . 2]" 1
226 1 19 MET HA 1 49 MET ME . . 5.470 3.542 2.996 4.081 . 0 0 "[ . 1 . 2]" 1
227 1 19 MET HA 1 60 ASP HA . . 3.270 2.946 2.183 3.347 0.077 18 0 "[ . 1 . 2]" 1
228 1 19 MET HB2 1 20 LEU H . . 3.300 2.904 2.552 3.140 . 0 0 "[ . 1 . 2]" 1
229 1 19 MET HB3 1 61 LEU H . . 3.760 3.079 2.515 3.803 0.043 3 0 "[ . 1 . 2]" 1
230 1 19 MET ME 1 45 ILE MG . . 6.070 2.952 2.342 4.103 . 0 0 "[ . 1 . 2]" 1
231 1 19 MET ME 1 49 MET ME . . 5.850 2.704 2.015 3.602 . 0 0 "[ . 1 . 2]" 1
232 1 19 MET ME 1 61 LEU MD2 . . 5.790 3.104 1.902 3.846 . 0 0 "[ . 1 . 2]" 1
233 1 19 MET ME 1 64 LEU MD2 . . 5.600 2.464 2.026 3.611 . 0 0 "[ . 1 . 2]" 1
234 1 19 MET ME 1 83 LEU HA . . 5.320 2.925 2.384 3.301 . 0 0 "[ . 1 . 2]" 1
235 1 19 MET ME 1 83 LEU HB3 . . 4.360 2.860 2.446 3.469 . 0 0 "[ . 1 . 2]" 1
236 1 19 MET ME 1 83 LEU MD2 . . 5.480 2.854 2.188 3.503 . 0 0 "[ . 1 . 2]" 1
237 1 19 MET ME 1 86 LEU MD1 . . 5.540 2.744 2.171 3.567 . 0 0 "[ . 1 . 2]" 1
238 1 19 MET ME 1 87 SER HA . . 4.730 3.589 2.187 4.062 . 0 0 "[ . 1 . 2]" 1
239 1 19 MET ME 1 87 SER QB . . 5.450 3.130 2.093 3.789 . 0 0 "[ . 1 . 2]" 1
240 1 19 MET QG 1 49 MET ME . . 5.570 2.189 1.927 3.081 . 0 0 "[ . 1 . 2]" 1
241 1 20 LEU H 1 20 LEU QB . . 3.450 2.187 1.973 2.522 . 0 0 "[ . 1 . 2]" 1
242 1 20 LEU H 1 20 LEU MD1 . . 5.540 3.476 2.324 4.176 . 0 0 "[ . 1 . 2]" 1
243 1 20 LEU HA 1 20 LEU MD1 . . 4.200 3.458 2.808 3.654 . 0 0 "[ . 1 . 2]" 1
244 1 20 LEU HA 1 20 LEU MD2 . . 4.140 2.886 2.051 3.571 . 0 0 "[ . 1 . 2]" 1
245 1 20 LEU HA 1 21 ASP H . . 3.450 3.525 3.484 3.538 0.088 11 0 "[ . 1 . 2]" 1
246 1 20 LEU QB 1 21 ASP H . . 3.840 2.686 2.159 3.229 . 0 0 "[ . 1 . 2]" 1
247 1 20 LEU MD1 1 90 THR HA . . 5.570 4.581 4.289 4.761 . 0 0 "[ . 1 . 2]" 1
248 1 20 LEU MD1 1 90 THR HB . . 4.820 2.422 2.051 3.723 . 0 0 "[ . 1 . 2]" 1
249 1 20 LEU MD1 1 92 SER HA . . 5.260 2.677 2.058 4.414 . 0 0 "[ . 1 . 2]" 1
250 1 20 LEU MD2 1 92 SER HA . . 4.610 2.632 2.069 3.746 . 0 0 "[ . 1 . 2]" 1
251 1 20 LEU MD2 1 93 ALA MB . . 6.840 3.578 2.260 4.509 . 0 0 "[ . 1 . 2]" 1
252 1 21 ASP H 1 21 ASP HB3 . . 3.020 2.840 2.496 3.072 0.052 2 0 "[ . 1 . 2]" 1
253 1 21 ASP H 1 93 ALA MB . . 6.530 3.979 2.825 5.430 . 0 0 "[ . 1 . 2]" 1
254 1 21 ASP HA 1 22 ASN H . . 2.520 2.094 2.000 2.199 . 0 0 "[ . 1 . 2]" 1
255 1 21 ASP HA 1 23 GLU H . . 3.550 3.574 3.196 3.630 0.080 4 0 "[ . 1 . 2]" 1
256 1 21 ASP HB2 1 22 ASN H . . 4.320 4.389 4.337 4.409 0.089 3 0 "[ . 1 . 2]" 1
257 1 21 ASP HB2 1 93 ALA MB . . 5.100 3.017 2.269 4.344 . 0 0 "[ . 1 . 2]" 1
258 1 21 ASP HB3 1 93 ALA MB . . 4.980 2.760 2.222 4.072 . 0 0 "[ . 1 . 2]" 1
259 1 22 ASN H 1 22 ASN HD21 . . 5.500 3.216 1.961 4.783 . 0 0 "[ . 1 . 2]" 1
260 1 22 ASN H 1 22 ASN QD . . 4.640 3.009 1.943 4.251 . 0 0 "[ . 1 . 2]" 1
261 1 22 ASN H 1 22 ASN HD22 . . 5.500 3.960 2.743 5.449 . 0 0 "[ . 1 . 2]" 1
262 1 22 ASN H 1 23 GLU H . . 3.080 2.788 2.307 3.045 . 0 0 "[ . 1 . 2]" 1
263 1 22 ASN HA 1 22 ASN QD . . 4.350 3.186 2.065 4.020 . 0 0 "[ . 1 . 2]" 1
264 1 22 ASN HA 1 23 GLU H . . 3.580 3.528 3.384 3.611 0.031 10 0 "[ . 1 . 2]" 1
265 1 22 ASN HA 1 25 TRP H . . 3.830 3.663 3.115 3.886 0.056 15 0 "[ . 1 . 2]" 1
266 1 22 ASN HA 1 59 ILE MD . . 5.260 2.364 2.190 2.696 . 0 0 "[ . 1 . 2]" 1
267 1 22 ASN QD 1 23 GLU H . . 6.180 4.716 3.794 5.557 . 0 0 "[ . 1 . 2]" 1
268 1 22 ASN QD 1 60 ASP H . . 6.370 4.060 2.642 5.564 . 0 0 "[ . 1 . 2]" 1
269 1 23 GLU H 1 23 GLU QB . . 3.740 2.365 1.865 2.692 . 0 0 "[ . 1 . 2]" 1
270 1 23 GLU H 1 23 GLU HG2 . . 3.860 3.130 2.195 3.833 . 0 0 "[ . 1 . 2]" 1
271 1 23 GLU H 1 23 GLU QG . . 3.650 2.570 2.103 3.419 . 0 0 "[ . 1 . 2]" 1
272 1 23 GLU H 1 23 GLU HG3 . . 3.860 3.078 2.149 3.940 0.080 10 0 "[ . 1 . 2]" 1
273 1 23 GLU H 1 24 ARG H . . 2.860 2.564 2.280 2.709 . 0 0 "[ . 1 . 2]" 1
274 1 23 GLU HA 1 23 GLU HG2 . . 3.860 2.671 2.161 3.929 0.069 4 0 "[ . 1 . 2]" 1
275 1 23 GLU HA 1 23 GLU QG . . 3.620 2.555 2.141 3.364 . 0 0 "[ . 1 . 2]" 1
276 1 23 GLU HA 1 23 GLU HG3 . . 3.860 3.463 3.015 3.865 0.005 20 0 "[ . 1 . 2]" 1
277 1 23 GLU HA 1 24 ARG H . . 3.550 3.499 3.416 3.605 0.055 20 0 "[ . 1 . 2]" 1
278 1 23 GLU HA 1 25 TRP H . . 3.760 3.383 3.207 3.670 . 0 0 "[ . 1 . 2]" 1
279 1 23 GLU HA 1 26 ASP H . . 3.920 3.975 3.634 4.011 0.091 12 0 "[ . 1 . 2]" 1
280 1 23 GLU QB 1 24 ARG H . . 4.330 3.137 2.613 3.730 . 0 0 "[ . 1 . 2]" 1
281 1 24 ARG H 1 24 ARG HB2 . . 2.860 2.447 2.311 2.648 . 0 0 "[ . 1 . 2]" 1
282 1 24 ARG H 1 24 ARG HG2 . . 3.480 2.458 2.103 3.540 0.060 14 0 "[ . 1 . 2]" 1
283 1 24 ARG H 1 24 ARG QG . . 3.290 2.350 2.088 2.550 . 0 0 "[ . 1 . 2]" 1
284 1 24 ARG H 1 24 ARG HG3 . . 3.480 3.439 2.530 3.564 0.084 11 0 "[ . 1 . 2]" 1
285 1 24 ARG H 1 25 TRP H . . 2.710 2.655 2.535 2.773 0.063 20 0 "[ . 1 . 2]" 1
286 1 24 ARG HA 1 24 ARG QD . . 5.040 2.691 2.022 4.108 . 0 0 "[ . 1 . 2]" 1
287 1 24 ARG HA 1 24 ARG HE . . 4.850 3.670 1.793 4.913 0.063 7 0 "[ . 1 . 2]" 1
288 1 24 ARG HA 1 26 ASP H . . 4.450 3.873 3.383 4.434 . 0 0 "[ . 1 . 2]" 1
289 1 24 ARG HA 1 27 ASP H . . 3.670 2.962 2.718 3.294 . 0 0 "[ . 1 . 2]" 1
290 1 24 ARG HB3 1 25 TRP H . . 4.510 4.311 4.202 4.459 . 0 0 "[ . 1 . 2]" 1
291 1 24 ARG HB3 1 96 ILE MG . . 4.700 2.512 2.069 3.750 . 0 0 "[ . 1 . 2]" 1
292 1 24 ARG QD 1 93 ALA MB . . 6.630 3.726 2.162 4.841 . 0 0 "[ . 1 . 2]" 1
293 1 24 ARG QD 1 96 ILE MG . . 5.950 2.243 1.970 3.151 . 0 0 "[ . 1 . 2]" 1
294 1 25 TRP H 1 25 TRP HB2 . . 2.770 2.592 2.501 2.673 . 0 0 "[ . 1 . 2]" 1
295 1 25 TRP H 1 25 TRP HB3 . . 2.770 2.510 2.432 2.593 . 0 0 "[ . 1 . 2]" 1
296 1 25 TRP H 1 26 ASP H . . 3.270 2.864 2.623 3.079 . 0 0 "[ . 1 . 2]" 1
297 1 25 TRP HA 1 25 TRP HE3 . . 3.300 2.830 2.542 3.128 . 0 0 "[ . 1 . 2]" 1
298 1 25 TRP HA 1 26 ASP H . . 3.610 3.596 3.571 3.631 0.021 14 0 "[ . 1 . 2]" 1
299 1 25 TRP HA 1 28 VAL H . . 4.070 3.742 3.453 3.938 . 0 0 "[ . 1 . 2]" 1
300 1 25 TRP HA 1 28 VAL HB . . 3.670 2.781 2.426 3.118 . 0 0 "[ . 1 . 2]" 1
301 1 25 TRP HA 1 28 VAL MG2 . . 5.470 3.782 3.448 4.045 . 0 0 "[ . 1 . 2]" 1
302 1 25 TRP HA 1 29 ALA H . . 3.760 3.734 3.541 3.843 0.083 2 0 "[ . 1 . 2]" 1
303 1 25 TRP HB2 1 25 TRP HD1 . . 3.890 3.784 3.734 3.820 . 0 0 "[ . 1 . 2]" 1
304 1 25 TRP HB2 1 25 TRP HE3 . . 3.420 2.747 2.645 2.867 . 0 0 "[ . 1 . 2]" 1
305 1 25 TRP HB2 1 59 ILE MD . . 6.400 2.216 2.007 2.670 . 0 0 "[ . 1 . 2]" 1
306 1 25 TRP HB3 1 25 TRP HD1 . . 3.170 2.613 2.540 2.672 . 0 0 "[ . 1 . 2]" 1
307 1 25 TRP HB3 1 26 ASP H . . 2.740 2.505 2.319 2.748 0.008 4 0 "[ . 1 . 2]" 1
308 1 25 TRP HB3 1 59 ILE MD . . 6.530 3.549 3.276 3.862 . 0 0 "[ . 1 . 2]" 1
309 1 25 TRP HD1 1 26 ASP H . . 3.580 3.347 3.080 3.612 0.032 4 0 "[ . 1 . 2]" 1
310 1 25 TRP HD1 1 26 ASP HA . . 3.110 3.154 2.931 3.198 0.088 18 0 "[ . 1 . 2]" 1
311 1 25 TRP HD1 1 29 ALA MB . . 4.760 3.633 3.298 3.964 . 0 0 "[ . 1 . 2]" 1
312 1 25 TRP HE1 1 26 ASP HA . . 5.470 4.485 4.112 4.901 . 0 0 "[ . 1 . 2]" 1
313 1 25 TRP HE1 1 29 ALA MB . . 4.140 3.124 2.649 3.561 . 0 0 "[ . 1 . 2]" 1
314 1 25 TRP HE1 1 50 ALA HA . . 5.500 4.414 3.709 4.958 . 0 0 "[ . 1 . 2]" 1
315 1 25 TRP HE1 1 50 ALA MB . . 6.530 4.776 4.326 5.273 . 0 0 "[ . 1 . 2]" 1
316 1 25 TRP HE1 1 53 GLN QB . . 5.850 3.972 3.183 4.486 . 0 0 "[ . 1 . 2]" 1
317 1 25 TRP HE1 1 53 GLN QE . . 6.370 4.241 2.471 5.574 . 0 0 "[ . 1 . 2]" 1
318 1 25 TRP HE1 1 53 GLN HG2 . . 4.480 3.488 2.759 4.567 0.087 11 0 "[ . 1 . 2]" 1
319 1 25 TRP HE1 1 53 GLN HG3 . . 4.880 4.617 4.134 4.957 0.077 17 0 "[ . 1 . 2]" 1
320 1 25 TRP HE3 1 59 ILE MD . . 3.890 2.259 2.098 2.787 . 0 0 "[ . 1 . 2]" 1
321 1 25 TRP HH2 1 50 ALA H . . 3.980 2.861 2.708 3.049 . 0 0 "[ . 1 . 2]" 1
322 1 25 TRP HH2 1 50 ALA HA . . 3.830 3.217 2.696 3.505 . 0 0 "[ . 1 . 2]" 1
323 1 25 TRP HH2 1 50 ALA MB . . 4.140 2.230 2.115 2.356 . 0 0 "[ . 1 . 2]" 1
324 1 25 TRP HZ2 1 29 ALA MB . . 4.510 3.533 3.050 3.741 . 0 0 "[ . 1 . 2]" 1
325 1 25 TRP HZ2 1 50 ALA HA . . 2.860 2.706 2.399 2.934 0.074 2 0 "[ . 1 . 2]" 1
326 1 25 TRP HZ2 1 50 ALA MB . . 3.740 2.542 2.189 2.971 . 0 0 "[ . 1 . 2]" 1
327 1 25 TRP HZ3 1 49 MET HB2 . . 4.110 2.459 2.266 2.644 . 0 0 "[ . 1 . 2]" 1
328 1 25 TRP HZ3 1 49 MET HB3 . . 3.700 2.556 2.350 2.991 . 0 0 "[ . 1 . 2]" 1
329 1 25 TRP HZ3 1 59 ILE MD . . 5.380 3.634 3.329 4.410 . 0 0 "[ . 1 . 2]" 1
330 1 26 ASP H 1 26 ASP HB2 . . 2.740 2.173 2.014 2.324 . 0 0 "[ . 1 . 2]" 1
331 1 26 ASP H 1 27 ASP H . . 2.990 2.652 2.492 2.895 . 0 0 "[ . 1 . 2]" 1
332 1 26 ASP H 1 28 VAL H . . 5.310 4.347 4.095 4.513 . 0 0 "[ . 1 . 2]" 1
333 1 26 ASP HA 1 27 ASP H . . 3.500 3.401 3.275 3.559 0.059 13 0 "[ . 1 . 2]" 1
334 1 26 ASP HA 1 29 ALA MB . . 3.890 2.462 2.109 2.865 . 0 0 "[ . 1 . 2]" 1
335 1 26 ASP HA 1 30 GLU H . . 4.010 4.097 4.075 4.109 0.099 19 0 "[ . 1 . 2]" 1
336 1 26 ASP HB2 1 27 ASP H . . 3.270 3.141 2.734 3.373 0.103 15 0 "[ . 1 . 2]" 1
337 1 26 ASP HB3 1 27 ASP H . . 3.480 3.474 2.454 3.576 0.096 10 0 "[ . 1 . 2]" 1
338 1 27 ASP H 1 27 ASP QB . . 3.420 2.291 2.075 2.563 . 0 0 "[ . 1 . 2]" 1
339 1 27 ASP H 1 28 VAL H . . 2.800 2.298 2.189 2.481 . 0 0 "[ . 1 . 2]" 1
340 1 27 ASP H 1 28 VAL HB . . 3.950 4.035 4.024 4.046 0.096 15 0 "[ . 1 . 2]" 1
341 1 27 ASP H 1 29 ALA H . . 4.260 3.694 3.485 3.873 . 0 0 "[ . 1 . 2]" 1
342 1 27 ASP HA 1 30 GLU H . . 3.450 3.502 3.177 3.545 0.095 1 0 "[ . 1 . 2]" 1
343 1 27 ASP QB 1 28 VAL H . . 4.430 2.538 2.304 2.868 . 0 0 "[ . 1 . 2]" 1
344 1 28 VAL H 1 28 VAL HB . . 2.680 2.171 2.052 2.258 . 0 0 "[ . 1 . 2]" 1
345 1 28 VAL H 1 28 VAL MG2 . . 4.080 2.302 2.154 2.495 . 0 0 "[ . 1 . 2]" 1
346 1 28 VAL H 1 29 ALA H . . 2.830 2.700 2.482 2.796 . 0 0 "[ . 1 . 2]" 1
347 1 28 VAL H 1 30 GLU H . . 5.500 3.922 3.653 4.097 . 0 0 "[ . 1 . 2]" 1
348 1 28 VAL HA 1 30 GLU H . . 4.070 4.072 3.947 4.144 0.074 16 0 "[ . 1 . 2]" 1
349 1 28 VAL HA 1 31 ARG H . . 4.010 3.367 2.969 3.753 . 0 0 "[ . 1 . 2]" 1
350 1 28 VAL HA 1 32 VAL H . . 4.450 3.944 3.806 4.151 . 0 0 "[ . 1 . 2]" 1
351 1 28 VAL HA 1 32 VAL MG1 . . 5.910 4.791 4.618 4.857 . 0 0 "[ . 1 . 2]" 1
352 1 28 VAL HA 1 100 ALA MB . . 4.540 2.672 2.149 3.219 . 0 0 "[ . 1 . 2]" 1
353 1 28 VAL HB 1 29 ALA H . . 2.930 2.612 2.388 2.787 . 0 0 "[ . 1 . 2]" 1
354 1 28 VAL MG1 1 29 ALA H . . 5.130 3.202 2.976 3.371 . 0 0 "[ . 1 . 2]" 1
355 1 28 VAL MG1 1 32 VAL H . . 5.880 3.814 3.727 3.939 . 0 0 "[ . 1 . 2]" 1
356 1 28 VAL MG1 1 32 VAL MG1 . . 6.010 3.954 3.783 4.032 . 0 0 "[ . 1 . 2]" 1
357 1 28 VAL MG1 1 32 VAL MG2 . . 5.480 2.074 1.963 2.230 . 0 0 "[ . 1 . 2]" 1
358 1 28 VAL MG1 1 46 PHE QE . . 6.560 2.291 2.052 3.060 . 0 0 "[ . 1 . 2]" 1
359 1 28 VAL MG1 1 46 PHE HZ . . 5.780 3.196 2.400 4.200 . 0 0 "[ . 1 . 2]" 1
360 1 28 VAL MG1 1 100 ALA MB . . 6.100 2.694 2.295 3.096 . 0 0 "[ . 1 . 2]" 1
361 1 28 VAL MG2 1 29 ALA H . . 5.130 4.033 3.891 4.131 . 0 0 "[ . 1 . 2]" 1
362 1 28 VAL MG2 1 32 VAL MG2 . . 6.070 3.731 3.529 3.930 . 0 0 "[ . 1 . 2]" 1
363 1 28 VAL MG2 1 100 ALA MB . . 6.040 2.420 2.040 2.927 . 0 0 "[ . 1 . 2]" 1
364 1 29 ALA H 1 29 ALA HA . . 2.800 2.823 2.776 2.850 0.050 18 0 "[ . 1 . 2]" 1
365 1 29 ALA H 1 29 ALA MB . . 3.490 2.223 2.184 2.272 . 0 0 "[ . 1 . 2]" 1
366 1 29 ALA H 1 30 GLU H . . 2.990 2.773 2.657 2.893 . 0 0 "[ . 1 . 2]" 1
367 1 29 ALA H 1 31 ARG H . . 4.660 4.089 3.861 4.283 . 0 0 "[ . 1 . 2]" 1
368 1 29 ALA HA 1 30 GLU H . . 3.500 3.490 3.436 3.555 0.055 10 0 "[ . 1 . 2]" 1
369 1 29 ALA HA 1 31 ARG H . . 3.670 3.705 3.626 3.748 0.078 14 0 "[ . 1 . 2]" 1
370 1 29 ALA HA 1 32 VAL H . . 3.210 3.168 2.953 3.285 0.075 2 0 "[ . 1 . 2]" 1
371 1 29 ALA HA 1 32 VAL MG2 . . 5.600 3.296 2.761 3.665 . 0 0 "[ . 1 . 2]" 1
372 1 29 ALA HA 1 46 PHE HZ . . 4.790 2.721 2.201 3.414 . 0 0 "[ . 1 . 2]" 1
373 1 29 ALA MB 1 30 GLU HA . . 5.440 4.102 3.972 4.192 . 0 0 "[ . 1 . 2]" 1
374 1 29 ALA MB 1 46 PHE HZ . . 6.120 3.144 2.308 4.346 . 0 0 "[ . 1 . 2]" 1
375 1 30 GLU H 1 30 GLU HA . . 2.770 2.861 2.838 2.873 0.103 12 0 "[ . 1 . 2]" 1
376 1 30 GLU H 1 30 GLU QB . . 3.740 2.290 1.945 2.761 . 0 0 "[ . 1 . 2]" 1
377 1 30 GLU H 1 30 GLU HG2 . . 3.920 3.087 2.014 3.864 . 0 0 "[ . 1 . 2]" 1
378 1 30 GLU H 1 30 GLU HG3 . . 3.920 3.715 3.130 4.024 0.104 10 0 "[ . 1 . 2]" 1
379 1 30 GLU H 1 31 ARG H . . 2.740 2.464 2.310 2.634 . 0 0 "[ . 1 . 2]" 1
380 1 30 GLU H 1 32 VAL H . . 3.950 4.043 4.032 4.049 0.099 7 0 "[ . 1 . 2]" 1
381 1 30 GLU HA 1 30 GLU HG2 . . 3.730 2.751 2.173 3.804 0.074 10 0 "[ . 1 . 2]" 1
382 1 30 GLU HA 1 30 GLU QG . . 3.480 2.573 2.133 3.275 . 0 0 "[ . 1 . 2]" 1
383 1 30 GLU HA 1 30 GLU HG3 . . 3.730 3.508 2.710 3.695 . 0 0 "[ . 1 . 2]" 1
384 1 30 GLU HA 1 31 ARG H . . 3.550 3.363 3.177 3.553 0.003 10 0 "[ . 1 . 2]" 1
385 1 30 GLU QB 1 31 ARG H . . 4.450 3.393 2.809 3.988 . 0 0 "[ . 1 . 2]" 1
386 1 31 ARG H 1 31 ARG QB . . 3.540 2.418 2.251 2.554 . 0 0 "[ . 1 . 2]" 1
387 1 31 ARG H 1 32 VAL H . . 2.550 2.122 1.921 2.310 . 0 0 "[ . 1 . 2]" 1
388 1 31 ARG H 1 32 VAL MG2 . . 4.540 3.509 3.294 3.636 . 0 0 "[ . 1 . 2]" 1
389 1 31 ARG HA 1 32 VAL H . . 3.520 3.586 3.525 3.601 0.081 19 0 "[ . 1 . 2]" 1
390 1 31 ARG QB 1 32 VAL H . . 4.270 2.748 2.362 3.205 . 0 0 "[ . 1 . 2]" 1
391 1 31 ARG QB 1 104 ARG H . . 6.190 4.236 3.445 5.076 . 0 0 "[ . 1 . 2]" 1
392 1 32 VAL H 1 32 VAL HB . . 3.580 3.671 3.665 3.679 0.099 19 0 "[ . 1 . 2]" 1
393 1 32 VAL H 1 32 VAL MG1 . . 4.540 3.222 2.990 3.484 . 0 0 "[ . 1 . 2]" 1
394 1 32 VAL H 1 33 VAL H . . 5.100 4.405 4.281 4.508 . 0 0 "[ . 1 . 2]" 1
395 1 32 VAL HA 1 33 VAL H . . 2.490 2.351 2.119 2.491 0.001 8 0 "[ . 1 . 2]" 1
396 1 32 VAL HA 1 104 ARG HB2 . . 5.340 3.804 3.051 4.259 . 0 0 "[ . 1 . 2]" 1
397 1 32 VAL HB 1 33 VAL H . . 2.930 2.408 2.092 2.989 0.059 7 0 "[ . 1 . 2]" 1
398 1 32 VAL HB 1 103 VAL MG1 . . 6.500 3.622 3.287 4.098 . 0 0 "[ . 1 . 2]" 1
399 1 32 VAL QG 1 100 ALA MB . . 7.940 2.229 1.942 2.944 . 0 0 "[ . 1 . 2]" 1
400 1 32 VAL QG 1 103 VAL HB . . 6.600 2.271 2.049 2.485 . 0 0 "[ . 1 . 2]" 1
401 1 32 VAL QG 1 103 VAL MG1 . . 7.840 2.299 2.009 2.841 . 0 0 "[ . 1 . 2]" 1
402 1 32 VAL MG1 1 33 VAL H . . 4.950 3.443 3.300 3.608 . 0 0 "[ . 1 . 2]" 1
403 1 32 VAL MG1 1 37 PHE QE . . 7.610 3.488 2.580 4.178 . 0 0 "[ . 1 . 2]" 1
404 1 32 VAL MG1 1 37 PHE HZ . . 5.880 4.219 3.473 4.745 . 0 0 "[ . 1 . 2]" 1
405 1 32 VAL MG1 1 100 ALA HA . . 5.040 3.279 2.669 3.806 . 0 0 "[ . 1 . 2]" 1
406 1 32 VAL MG1 1 100 ALA MB . . 6.250 2.837 2.317 3.567 . 0 0 "[ . 1 . 2]" 1
407 1 32 VAL MG1 1 103 VAL H . . 6.530 4.147 3.925 4.372 . 0 0 "[ . 1 . 2]" 1
408 1 32 VAL MG1 1 103 VAL HB . . 4.230 2.291 2.059 2.515 . 0 0 "[ . 1 . 2]" 1
409 1 32 VAL MG1 1 103 VAL MG1 . . 6.350 2.333 2.022 2.902 . 0 0 "[ . 1 . 2]" 1
410 1 32 VAL MG1 1 103 VAL MG2 . . 6.190 3.579 3.277 3.810 . 0 0 "[ . 1 . 2]" 1
411 1 32 VAL MG1 1 104 ARG H . . 5.070 2.644 2.462 2.813 . 0 0 "[ . 1 . 2]" 1
412 1 32 VAL MG1 1 104 ARG HA . . 5.130 2.622 2.330 3.070 . 0 0 "[ . 1 . 2]" 1
413 1 32 VAL MG1 1 104 ARG HB2 . . 4.570 2.188 1.992 2.456 . 0 0 "[ . 1 . 2]" 1
414 1 32 VAL MG2 1 33 VAL H . . 5.040 3.716 3.425 4.153 . 0 0 "[ . 1 . 2]" 1
415 1 32 VAL MG2 1 37 PHE QD . . 7.790 4.147 3.638 4.581 . 0 0 "[ . 1 . 2]" 1
416 1 32 VAL MG2 1 37 PHE QE . . 6.420 2.387 2.061 2.918 . 0 0 "[ . 1 . 2]" 1
417 1 32 VAL MG2 1 37 PHE HZ . . 4.480 2.869 2.165 3.489 . 0 0 "[ . 1 . 2]" 1
418 1 32 VAL MG2 1 46 PHE QE . . 7.400 2.774 2.070 3.926 . 0 0 "[ . 1 . 2]" 1
419 1 32 VAL MG2 1 46 PHE HZ . . 5.130 3.201 2.574 4.075 . 0 0 "[ . 1 . 2]" 1
420 1 32 VAL MG2 1 100 ALA HA . . 6.030 3.570 3.169 3.914 . 0 0 "[ . 1 . 2]" 1
421 1 32 VAL MG2 1 100 ALA MB . . 6.840 2.344 1.991 3.137 . 0 0 "[ . 1 . 2]" 1
422 1 32 VAL MG2 1 103 VAL HB . . 4.950 3.735 3.191 4.004 . 0 0 "[ . 1 . 2]" 1
423 1 32 VAL MG2 1 103 VAL MG1 . . 6.590 3.497 3.232 4.054 . 0 0 "[ . 1 . 2]" 1
424 1 33 VAL H 1 33 VAL MG2 . . 3.920 2.318 2.174 2.470 . 0 0 "[ . 1 . 2]" 1
425 1 33 VAL H 1 36 ASP H . . 5.000 3.245 2.950 3.606 . 0 0 "[ . 1 . 2]" 1
426 1 33 VAL H 1 36 ASP HB2 . . 3.420 2.614 1.880 3.001 . 0 0 "[ . 1 . 2]" 1
427 1 33 VAL H 1 36 ASP HB3 . . 4.420 3.957 3.361 4.205 . 0 0 "[ . 1 . 2]" 1
428 1 33 VAL HA 1 33 VAL HB . . 2.930 2.514 2.417 2.643 . 0 0 "[ . 1 . 2]" 1
429 1 33 VAL HA 1 34 ALA H . . 2.650 2.545 2.418 2.720 0.070 19 0 "[ . 1 . 2]" 1
430 1 33 VAL HA 1 46 PHE QE . . 6.080 2.810 2.322 3.338 . 0 0 "[ . 1 . 2]" 1
431 1 33 VAL HB 1 34 ALA H . . 2.550 2.416 2.094 2.618 0.068 5 0 "[ . 1 . 2]" 1
432 1 33 VAL HB 1 35 ASP H . . 3.240 3.027 2.467 3.303 0.063 9 0 "[ . 1 . 2]" 1
433 1 33 VAL MG1 1 34 ALA H . . 5.230 3.653 3.270 3.836 . 0 0 "[ . 1 . 2]" 1
434 1 33 VAL MG2 1 34 ALA H . . 5.190 3.541 3.120 3.841 . 0 0 "[ . 1 . 2]" 1
435 1 33 VAL MG2 1 35 ASP H . . 4.080 2.481 1.867 3.182 . 0 0 "[ . 1 . 2]" 1
436 1 33 VAL MG2 1 35 ASP HB2 . . 5.130 2.576 2.063 3.551 . 0 0 "[ . 1 . 2]" 1
437 1 33 VAL MG2 1 35 ASP HB3 . . 5.350 3.388 2.413 4.025 . 0 0 "[ . 1 . 2]" 1
438 1 33 VAL MG2 1 36 ASP H . . 4.230 2.604 2.160 3.328 . 0 0 "[ . 1 . 2]" 1
439 1 34 ALA H 1 35 ASP H . . 3.270 2.838 2.643 3.020 . 0 0 "[ . 1 . 2]" 1
440 1 34 ALA H 1 46 PHE QD . . 6.330 3.159 2.548 3.666 . 0 0 "[ . 1 . 2]" 1
441 1 34 ALA H 1 46 PHE QE . . 6.420 3.015 2.688 3.364 . 0 0 "[ . 1 . 2]" 1
442 1 34 ALA HA 1 36 ASP H . . 4.200 3.912 3.656 4.209 0.009 12 0 "[ . 1 . 2]" 1
443 1 34 ALA HA 1 37 PHE H . . 3.890 3.627 3.097 3.965 0.075 8 0 "[ . 1 . 2]" 1
444 1 34 ALA HA 1 37 PHE QD . . 3.100 2.736 2.020 3.158 0.058 2 0 "[ . 1 . 2]" 1
445 1 34 ALA HA 1 37 PHE QE . . 6.700 4.076 3.265 5.034 . 0 0 "[ . 1 . 2]" 1
446 1 34 ALA HA 1 46 PHE QD . . 5.240 3.054 2.304 3.585 . 0 0 "[ . 1 . 2]" 1
447 1 34 ALA MB 1 35 ASP H . . 4.080 2.741 2.411 2.986 . 0 0 "[ . 1 . 2]" 1
448 1 34 ALA MB 1 35 ASP HA . . 5.500 3.852 3.567 4.039 . 0 0 "[ . 1 . 2]" 1
449 1 34 ALA MB 1 37 PHE QD . . 7.790 4.252 3.604 4.634 . 0 0 "[ . 1 . 2]" 1
450 1 34 ALA MB 1 43 ARG HA . . 4.790 3.450 2.603 3.835 . 0 0 "[ . 1 . 2]" 1
451 1 34 ALA MB 1 46 PHE HB2 . . 5.690 4.160 3.596 4.651 . 0 0 "[ . 1 . 2]" 1
452 1 34 ALA MB 1 46 PHE HB3 . . 5.500 2.752 2.243 3.205 . 0 0 "[ . 1 . 2]" 1
453 1 34 ALA MB 1 46 PHE QD . . 6.060 2.233 2.082 2.519 . 0 0 "[ . 1 . 2]" 1
454 1 34 ALA MB 1 46 PHE QE . . 7.420 3.656 3.096 4.109 . 0 0 "[ . 1 . 2]" 1
455 1 34 ALA MB 1 47 THR H . . 6.030 3.542 2.720 4.118 . 0 0 "[ . 1 . 2]" 1
456 1 34 ALA MB 1 47 THR MG . . 6.630 3.710 2.556 4.188 . 0 0 "[ . 1 . 2]" 1
457 1 35 ASP H 1 35 ASP HB2 . . 2.650 2.269 2.048 2.558 . 0 0 "[ . 1 . 2]" 1
458 1 35 ASP HA 1 35 ASP HB3 . . 3.050 2.737 2.483 3.043 . 0 0 "[ . 1 . 2]" 1
459 1 35 ASP HA 1 36 ASP H . . 3.450 3.491 3.423 3.528 0.078 2 0 "[ . 1 . 2]" 1
460 1 35 ASP HA 1 37 PHE H . . 4.320 4.006 3.719 4.380 0.060 15 0 "[ . 1 . 2]" 1
461 1 35 ASP HA 1 43 ARG HD2 . . 4.450 3.350 2.317 4.523 0.073 2 0 "[ . 1 . 2]" 1
462 1 35 ASP HA 1 43 ARG QD . . 4.280 2.938 2.142 3.606 . 0 0 "[ . 1 . 2]" 1
463 1 35 ASP HA 1 43 ARG HD3 . . 4.450 3.591 2.517 4.535 0.085 6 0 "[ . 1 . 2]" 1
464 1 35 ASP HB2 1 36 ASP H . . 3.830 3.523 3.098 3.915 0.085 15 0 "[ . 1 . 2]" 1
465 1 35 ASP HB3 1 36 ASP H . . 3.980 3.720 2.925 4.049 0.069 17 0 "[ . 1 . 2]" 1
466 1 36 ASP H 1 36 ASP HB2 . . 2.770 2.333 2.265 2.408 . 0 0 "[ . 1 . 2]" 1
467 1 36 ASP H 1 36 ASP HB3 . . 3.450 3.527 3.493 3.535 0.085 7 0 "[ . 1 . 2]" 1
468 1 36 ASP H 1 37 PHE H . . 2.930 2.423 2.176 2.629 . 0 0 "[ . 1 . 2]" 1
469 1 36 ASP H 1 37 PHE QD . . 6.100 3.487 3.091 4.331 . 0 0 "[ . 1 . 2]" 1
470 1 36 ASP HA 1 107 ALA MB . . 3.290 2.389 1.998 2.687 . 0 0 "[ . 1 . 2]" 1
471 1 36 ASP HB2 1 37 PHE H . . 4.070 2.988 2.617 3.304 . 0 0 "[ . 1 . 2]" 1
472 1 36 ASP HB2 1 103 VAL MG1 . . 5.130 3.355 2.626 4.188 . 0 0 "[ . 1 . 2]" 1
473 1 36 ASP HB2 1 107 ALA MB . . 4.750 3.708 3.478 4.056 . 0 0 "[ . 1 . 2]" 1
474 1 36 ASP HB3 1 103 VAL MG1 . . 4.670 2.722 2.195 3.216 . 0 0 "[ . 1 . 2]" 1
475 1 36 ASP HB3 1 107 ALA MB . . 3.850 2.355 2.072 2.784 . 0 0 "[ . 1 . 2]" 1
476 1 37 PHE H 1 37 PHE HB2 . . 2.800 2.363 2.193 2.482 . 0 0 "[ . 1 . 2]" 1
477 1 37 PHE H 1 37 PHE HB3 . . 3.520 3.569 3.490 3.594 0.074 19 0 "[ . 1 . 2]" 1
478 1 37 PHE HA 1 38 TYR H . . 2.740 2.238 2.119 2.414 . 0 0 "[ . 1 . 2]" 1
479 1 37 PHE HA 1 39 THR H . . 4.570 3.839 3.185 4.629 0.059 15 0 "[ . 1 . 2]" 1
480 1 37 PHE HA 1 103 VAL MG1 . . 4.220 3.126 2.626 3.659 . 0 0 "[ . 1 . 2]" 1
481 1 37 PHE HB3 1 39 THR H . . 3.760 3.512 2.800 3.832 0.072 19 0 "[ . 1 . 2]" 1
482 1 37 PHE QD 1 42 HIS HB3 . . 5.970 2.331 2.050 4.157 . 0 0 "[ . 1 . 2]" 1
483 1 37 PHE QD 1 42 HIS HD1 . . 5.420 3.462 2.700 4.406 . 0 0 "[ . 1 . 2]" 1
484 1 37 PHE QD 1 103 VAL MG1 . . 6.990 3.246 2.305 3.689 . 0 0 "[ . 1 . 2]" 1
485 1 37 PHE QE 1 103 VAL MG1 . . 7.190 3.073 2.559 3.738 . 0 0 "[ . 1 . 2]" 1
486 1 37 PHE QE 1 103 VAL MG2 . . 7.760 3.387 2.380 4.063 . 0 0 "[ . 1 . 2]" 1
487 1 38 TYR H 1 38 TYR HB2 . . 3.110 2.725 2.367 3.192 0.082 11 0 "[ . 1 . 2]" 1
488 1 38 TYR H 1 38 TYR HB3 . . 3.170 2.395 2.224 2.694 . 0 0 "[ . 1 . 2]" 1
489 1 38 TYR H 1 39 THR H . . 3.210 2.513 1.770 3.023 . 0 0 "[ . 1 . 2]" 1
490 1 38 TYR HB3 1 39 THR H . . 3.140 2.830 2.400 3.207 0.067 1 0 "[ . 1 . 2]" 1
491 1 38 TYR QD 1 39 THR MG . . 6.370 3.316 2.177 4.801 . 0 0 "[ . 1 . 2]" 1
492 1 38 TYR QD 1 110 ARG QD . . 8.520 4.314 2.400 5.869 . 0 0 "[ . 1 . 2]" 1
493 1 38 TYR QE 1 39 THR MG . . 7.510 4.347 3.063 5.297 . 0 0 "[ . 1 . 2]" 1
494 1 38 TYR QE 1 110 ARG QD . . 8.510 5.096 3.155 6.987 . 0 0 "[ . 1 . 2]" 1
495 1 39 THR H 1 39 THR HB . . 3.550 3.090 2.325 3.631 0.081 19 0 "[ . 1 . 2]" 1
496 1 39 THR H 1 39 THR MG . . 4.300 3.082 1.921 3.661 . 0 0 "[ . 1 . 2]" 1
497 1 39 THR H 1 42 HIS HB2 . . 3.580 3.413 2.499 3.669 0.089 1 0 "[ . 1 . 2]" 1
498 1 39 THR HA 1 39 THR HB . . 2.740 2.694 2.229 2.849 0.109 11 0 "[ . 1 . 2]" 1
499 1 39 THR HB 1 41 PRO QD . . 4.950 3.064 2.098 4.067 . 0 0 "[ . 1 . 2]" 1
500 1 39 THR HB 1 41 PRO QG . . 6.380 3.432 2.748 4.168 . 0 0 "[ . 1 . 2]" 1
501 1 39 THR HB 1 42 HIS H . . 4.380 2.972 2.201 3.977 . 0 0 "[ . 1 . 2]" 1
502 1 39 THR MG 1 41 PRO QD . . 6.380 2.825 2.075 4.004 . 0 0 "[ . 1 . 2]" 1
503 1 39 THR MG 1 42 HIS H . . 6.530 3.669 2.709 4.485 . 0 0 "[ . 1 . 2]" 1
504 1 39 THR MG 1 42 HIS HD1 . . 4.320 3.280 2.520 3.577 . 0 0 "[ . 1 . 2]" 1
505 1 39 THR MG 1 42 HIS HE1 . . 6.000 3.603 3.029 4.467 . 0 0 "[ . 1 . 2]" 1
506 1 41 PRO HA 1 43 ARG H . . 4.540 4.457 4.217 4.619 0.079 15 0 "[ . 1 . 2]" 1
507 1 41 PRO HA 1 44 HIS H . . 3.760 3.476 3.120 3.811 0.051 15 0 "[ . 1 . 2]" 1
508 1 41 PRO HA 1 44 HIS HB2 . . 3.890 2.635 2.365 3.969 0.079 11 0 "[ . 1 . 2]" 1
509 1 41 PRO HA 1 44 HIS HB3 . . 3.890 3.820 2.555 3.966 0.076 1 0 "[ . 1 . 2]" 1
510 1 41 PRO HA 1 77 VAL HA . . 3.360 2.904 2.223 3.440 0.080 11 0 "[ . 1 . 2]" 1
511 1 41 PRO HA 1 77 VAL MG1 . . 4.570 2.525 2.096 3.141 . 0 0 "[ . 1 . 2]" 1
512 1 41 PRO HB2 1 42 HIS H . . 3.730 3.385 3.052 3.779 0.049 18 0 "[ . 1 . 2]" 1
513 1 41 PRO HB2 1 77 VAL HA . . 5.040 3.339 2.530 4.837 . 0 0 "[ . 1 . 2]" 1
514 1 41 PRO HB3 1 77 VAL HA . . 4.010 2.305 2.000 3.290 . 0 0 "[ . 1 . 2]" 1
515 1 41 PRO QG 1 77 VAL HA . . 6.380 4.209 3.556 5.006 . 0 0 "[ . 1 . 2]" 1
516 1 42 HIS H 1 42 HIS HB2 . . 2.770 2.501 2.363 2.600 . 0 0 "[ . 1 . 2]" 1
517 1 42 HIS H 1 42 HIS HB3 . . 3.580 3.581 3.480 3.629 0.049 4 0 "[ . 1 . 2]" 1
518 1 42 HIS H 1 42 HIS HD2 . . 3.920 3.028 2.546 3.407 . 0 0 "[ . 1 . 2]" 1
519 1 42 HIS H 1 43 ARG H . . 3.050 2.658 2.470 2.932 . 0 0 "[ . 1 . 2]" 1
520 1 42 HIS HA 1 42 HIS HD2 . . 3.110 2.491 2.355 2.724 . 0 0 "[ . 1 . 2]" 1
521 1 42 HIS HA 1 45 ILE H . . 3.860 3.579 3.260 3.924 0.064 11 0 "[ . 1 . 2]" 1
522 1 42 HIS HA 1 45 ILE HB . . 3.580 2.943 2.441 3.644 0.064 11 0 "[ . 1 . 2]" 1
523 1 42 HIS HA 1 45 ILE MD . . 4.730 2.505 2.162 2.805 . 0 0 "[ . 1 . 2]" 1
524 1 42 HIS HB2 1 42 HIS HD1 . . 3.500 2.821 2.625 3.062 . 0 0 "[ . 1 . 2]" 1
525 1 42 HIS HB2 1 43 ARG H . . 3.450 2.734 2.493 2.918 . 0 0 "[ . 1 . 2]" 1
526 1 42 HIS HB3 1 42 HIS HD1 . . 3.040 2.963 2.728 3.108 0.068 9 0 "[ . 1 . 2]" 1
527 1 42 HIS HB3 1 43 ARG H . . 3.860 3.749 3.445 3.907 0.047 2 0 "[ . 1 . 2]" 1
528 1 42 HIS HD2 1 45 ILE MD . . 4.080 3.038 2.366 3.452 . 0 0 "[ . 1 . 2]" 1
529 1 42 HIS HD2 1 82 TYR QE . . 5.370 2.768 2.277 3.606 . 0 0 "[ . 1 . 2]" 1
530 1 43 ARG H 1 43 ARG QB . . 3.610 2.261 2.069 2.586 . 0 0 "[ . 1 . 2]" 1
531 1 43 ARG H 1 44 HIS H . . 2.740 2.800 2.703 2.817 0.077 17 0 "[ . 1 . 2]" 1
532 1 43 ARG HA 1 43 ARG QG . . 3.620 2.182 2.057 2.463 . 0 0 "[ . 1 . 2]" 1
533 1 43 ARG HA 1 44 HIS H . . 3.580 3.606 3.547 3.645 0.065 15 0 "[ . 1 . 2]" 1
534 1 43 ARG HA 1 46 PHE H . . 4.320 3.515 3.260 3.722 . 0 0 "[ . 1 . 2]" 1
535 1 43 ARG QB 1 44 HIS H . . 3.100 2.485 2.307 2.892 . 0 0 "[ . 1 . 2]" 1
536 1 43 ARG HB2 1 44 HIS H . . 3.390 3.068 2.395 3.472 0.082 14 0 "[ . 1 . 2]" 1
537 1 43 ARG HB3 1 44 HIS H . . 3.390 2.915 2.342 3.480 0.090 11 0 "[ . 1 . 2]" 1
538 1 44 HIS H 1 44 HIS HA . . 2.930 2.753 2.703 2.811 . 0 0 "[ . 1 . 2]" 1
539 1 44 HIS H 1 44 HIS QB . . 3.420 2.272 1.928 2.443 . 0 0 "[ . 1 . 2]" 1
540 1 44 HIS H 1 44 HIS HD2 . . 4.260 4.345 4.324 4.372 0.112 11 0 "[ . 1 . 2]" 1
541 1 44 HIS H 1 45 ILE H . . 3.140 2.992 2.577 3.176 0.036 13 0 "[ . 1 . 2]" 1
542 1 44 HIS HA 1 44 HIS HD2 . . 3.670 2.744 2.370 3.753 0.083 15 0 "[ . 1 . 2]" 1
543 1 44 HIS HA 1 47 THR H . . 3.520 3.577 3.453 3.609 0.089 1 0 "[ . 1 . 2]" 1
544 1 44 HIS HB2 1 45 ILE H . . 3.550 2.698 2.313 3.647 0.097 11 0 "[ . 1 . 2]" 1
545 1 44 HIS HB2 1 77 VAL MG1 . . 4.640 2.255 2.028 3.112 . 0 0 "[ . 1 . 2]" 1
546 1 44 HIS HB3 1 45 ILE H . . 3.550 3.092 2.581 3.592 0.042 17 0 "[ . 1 . 2]" 1
547 1 44 HIS HB3 1 77 VAL MG1 . . 4.640 2.145 1.993 2.538 . 0 0 "[ . 1 . 2]" 1
548 1 44 HIS HD2 1 68 LEU MD2 . . 4.230 3.549 2.108 3.681 . 0 0 "[ . 1 . 2]" 1
549 1 44 HIS HD2 1 77 VAL MG1 . . 4.540 3.838 3.230 3.937 . 0 0 "[ . 1 . 2]" 1
550 1 45 ILE H 1 45 ILE HB . . 2.860 2.405 2.277 2.775 . 0 0 "[ . 1 . 2]" 1
551 1 45 ILE H 1 45 ILE MD . . 4.790 3.057 1.863 3.425 . 0 0 "[ . 1 . 2]" 1
552 1 45 ILE H 1 45 ILE HG12 . . 4.450 3.679 3.410 4.063 . 0 0 "[ . 1 . 2]" 1
553 1 45 ILE H 1 45 ILE HG13 . . 2.990 2.396 2.048 3.071 0.081 10 0 "[ . 1 . 2]" 1
554 1 45 ILE H 1 46 PHE H . . 3.170 2.914 2.697 3.180 0.010 11 0 "[ . 1 . 2]" 1
555 1 45 ILE H 1 77 VAL MG1 . . 5.690 3.443 2.981 4.507 . 0 0 "[ . 1 . 2]" 1
556 1 45 ILE HA 1 48 GLU H . . 3.950 3.507 3.314 4.017 0.067 19 0 "[ . 1 . 2]" 1
557 1 45 ILE HA 1 64 LEU MD1 . . 5.130 2.789 2.236 3.517 . 0 0 "[ . 1 . 2]" 1
558 1 45 ILE HA 1 68 LEU MD2 . . 5.130 3.534 2.956 4.058 . 0 0 "[ . 1 . 2]" 1
559 1 45 ILE HB 1 46 PHE H . . 3.170 2.611 2.487 2.778 . 0 0 "[ . 1 . 2]" 1
560 1 45 ILE MD 1 77 VAL HB . . 5.100 2.801 2.237 4.181 . 0 0 "[ . 1 . 2]" 1
561 1 45 ILE MD 1 82 TYR QD . . 7.240 2.940 2.306 3.586 . 0 0 "[ . 1 . 2]" 1
562 1 45 ILE MD 1 82 TYR QE . . 7.050 3.116 2.294 4.319 . 0 0 "[ . 1 . 2]" 1
563 1 45 ILE MD 1 83 LEU MD2 . . 5.420 2.156 2.011 2.740 . 0 0 "[ . 1 . 2]" 1
564 1 45 ILE MD 1 86 LEU MD1 . . 5.820 2.019 1.881 2.472 . 0 0 "[ . 1 . 2]" 1
565 1 45 ILE MG 1 46 PHE H . . 5.130 3.205 2.917 3.439 . 0 0 "[ . 1 . 2]" 1
566 1 45 ILE MG 1 49 MET ME . . 5.660 2.185 1.982 2.944 . 0 0 "[ . 1 . 2]" 1
567 1 45 ILE MG 1 49 MET QG . . 6.380 2.616 2.325 3.109 . 0 0 "[ . 1 . 2]" 1
568 1 46 PHE H 1 46 PHE HB2 . . 2.800 2.310 2.141 2.526 . 0 0 "[ . 1 . 2]" 1
569 1 46 PHE H 1 46 PHE HB3 . . 2.900 2.768 2.594 2.936 0.036 11 0 "[ . 1 . 2]" 1
570 1 46 PHE H 1 47 THR H . . 3.170 2.853 2.774 2.933 . 0 0 "[ . 1 . 2]" 1
571 1 46 PHE HA 1 49 MET H . . 3.670 3.510 3.275 3.733 0.063 17 0 "[ . 1 . 2]" 1
572 1 46 PHE HA 1 50 ALA H . . 4.570 3.819 3.698 4.077 . 0 0 "[ . 1 . 2]" 1
573 1 46 PHE HB2 1 47 THR H . . 3.950 3.853 3.647 3.996 0.046 8 0 "[ . 1 . 2]" 1
574 1 46 PHE HB3 1 47 THR H . . 3.140 2.754 2.482 2.995 . 0 0 "[ . 1 . 2]" 1
575 1 46 PHE QD 1 47 THR H . . 6.860 3.958 3.349 4.272 . 0 0 "[ . 1 . 2]" 1
576 1 46 PHE HD1 1 50 ALA MB . . 5.350 3.683 2.655 5.707 0.357 1 0 "[ . 1 . 2]" 1
577 1 47 THR H 1 47 THR HB . . 2.800 2.494 2.242 2.810 0.010 19 0 "[ . 1 . 2]" 1
578 1 47 THR H 1 48 GLU H . . 3.020 2.723 2.602 3.072 0.052 17 0 "[ . 1 . 2]" 1
579 1 47 THR HA 1 50 ALA H . . 3.670 3.554 3.243 3.732 0.062 17 0 "[ . 1 . 2]" 1
580 1 47 THR HA 1 50 ALA MB . . 4.300 2.600 2.315 2.942 . 0 0 "[ . 1 . 2]" 1
581 1 47 THR HA 1 51 ARG H . . 3.860 3.932 3.906 3.946 0.086 7 0 "[ . 1 . 2]" 1
582 1 47 THR HB 1 48 GLU H . . 2.900 2.725 2.423 2.967 0.067 1 0 "[ . 1 . 2]" 1
583 1 47 THR MG 1 48 GLU H . . 6.030 3.645 3.188 3.878 . 0 0 "[ . 1 . 2]" 1
584 1 48 GLU H 1 48 GLU HB2 . . 2.770 2.337 2.065 2.572 . 0 0 "[ . 1 . 2]" 1
585 1 48 GLU H 1 48 GLU HB3 . . 2.770 2.746 2.555 2.852 0.082 9 0 "[ . 1 . 2]" 1
586 1 48 GLU H 1 48 GLU QG . . 4.950 4.054 3.644 4.160 . 0 0 "[ . 1 . 2]" 1
587 1 48 GLU H 1 49 MET H . . 2.930 2.563 2.362 2.717 . 0 0 "[ . 1 . 2]" 1
588 1 48 GLU H 1 64 LEU MD1 . . 6.530 3.951 3.490 4.259 . 0 0 "[ . 1 . 2]" 1
589 1 48 GLU H 1 68 LEU MD2 . . 6.530 4.145 3.523 5.225 . 0 0 "[ . 1 . 2]" 1
590 1 48 GLU HA 1 51 ARG H . . 3.360 3.173 2.900 3.423 0.063 15 0 "[ . 1 . 2]" 1
591 1 48 GLU HA 1 51 ARG QB . . 4.300 2.370 1.954 3.768 . 0 0 "[ . 1 . 2]" 1
592 1 48 GLU HB3 1 49 MET H . . 3.390 2.878 2.418 3.185 . 0 0 "[ . 1 . 2]" 1
593 1 48 GLU QG 1 52 LEU MD1 . . 6.290 2.874 2.193 4.257 . 0 0 "[ . 1 . 2]" 1
594 1 48 GLU QG 1 64 LEU MD1 . . 5.610 2.678 2.104 3.518 . 0 0 "[ . 1 . 2]" 1
595 1 48 GLU QG 1 68 LEU H . . 6.380 3.159 2.622 3.799 . 0 0 "[ . 1 . 2]" 1
596 1 49 MET H 1 49 MET HB2 . . 2.860 2.405 2.347 2.502 . 0 0 "[ . 1 . 2]" 1
597 1 49 MET H 1 49 MET HB3 . . 3.580 3.590 3.551 3.629 0.049 5 0 "[ . 1 . 2]" 1
598 1 49 MET H 1 49 MET QG . . 4.210 2.458 2.290 2.733 . 0 0 "[ . 1 . 2]" 1
599 1 49 MET H 1 50 ALA H . . 3.170 2.750 2.670 2.840 . 0 0 "[ . 1 . 2]" 1
600 1 49 MET H 1 51 ARG H . . 5.500 4.126 3.926 4.300 . 0 0 "[ . 1 . 2]" 1
601 1 49 MET H 1 52 LEU MD1 . . 6.530 4.258 3.924 4.713 . 0 0 "[ . 1 . 2]" 1
602 1 49 MET H 1 64 LEU MD1 . . 5.810 2.952 2.449 3.374 . 0 0 "[ . 1 . 2]" 1
603 1 49 MET HA 1 52 LEU H . . 3.950 3.454 3.288 3.674 . 0 0 "[ . 1 . 2]" 1
604 1 49 MET HA 1 52 LEU MD1 . . 4.820 2.687 2.383 3.144 . 0 0 "[ . 1 . 2]" 1
605 1 49 MET HA 1 59 ILE MG . . 4.420 2.369 2.160 2.769 . 0 0 "[ . 1 . 2]" 1
606 1 49 MET HA 1 64 LEU MD1 . . 5.570 2.949 2.426 3.891 . 0 0 "[ . 1 . 2]" 1
607 1 49 MET HB2 1 50 ALA H . . 3.110 2.487 2.384 2.616 . 0 0 "[ . 1 . 2]" 1
608 1 49 MET HB3 1 50 ALA H . . 3.520 3.386 3.246 3.537 0.017 18 0 "[ . 1 . 2]" 1
609 1 49 MET ME 1 59 ILE MD . . 6.870 3.225 2.322 3.943 . 0 0 "[ . 1 . 2]" 1
610 1 49 MET ME 1 59 ILE MG . . 6.940 4.125 3.808 4.589 . 0 0 "[ . 1 . 2]" 1
611 1 49 MET ME 1 64 LEU MD1 . . 6.280 3.084 2.626 3.475 . 0 0 "[ . 1 . 2]" 1
612 1 49 MET ME 1 64 LEU MD2 . . 5.450 2.091 1.922 2.607 . 0 0 "[ . 1 . 2]" 1
613 1 49 MET QG 1 59 ILE MG . . 7.070 2.986 2.582 3.298 . 0 0 "[ . 1 . 2]" 1
614 1 49 MET QG 1 64 LEU MD1 . . 5.950 2.052 1.928 2.412 . 0 0 "[ . 1 . 2]" 1
615 1 50 ALA H 1 51 ARG H . . 2.900 2.817 2.663 2.886 . 0 0 "[ . 1 . 2]" 1
616 1 50 ALA HA 1 51 ARG H . . 3.580 3.587 3.545 3.625 0.045 12 0 "[ . 1 . 2]" 1
617 1 50 ALA HA 1 53 GLN H . . 3.760 3.662 3.234 3.818 0.058 13 0 "[ . 1 . 2]" 1
618 1 50 ALA HA 1 53 GLN HB2 . . 3.670 3.474 2.744 3.736 0.066 18 0 "[ . 1 . 2]" 1
619 1 50 ALA HA 1 53 GLN HB3 . . 3.670 2.984 2.593 3.382 . 0 0 "[ . 1 . 2]" 1
620 1 50 ALA HA 1 54 GLU H . . 4.450 3.949 3.679 4.276 . 0 0 "[ . 1 . 2]" 1
621 1 50 ALA MB 1 51 ARG H . . 3.740 2.469 2.324 2.690 . 0 0 "[ . 1 . 2]" 1
622 1 51 ARG H 1 51 ARG QB . . 3.520 2.257 2.092 2.497 . 0 0 "[ . 1 . 2]" 1
623 1 51 ARG H 1 51 ARG QG . . 4.490 3.458 2.437 4.070 . 0 0 "[ . 1 . 2]" 1
624 1 51 ARG H 1 52 LEU H . . 2.860 2.873 2.658 2.929 0.069 9 0 "[ . 1 . 2]" 1
625 1 51 ARG HA 1 51 ARG HG2 . . 3.890 3.135 2.339 3.907 0.017 1 0 "[ . 1 . 2]" 1
626 1 51 ARG HA 1 51 ARG QG . . 3.720 2.536 2.161 3.339 . 0 0 "[ . 1 . 2]" 1
627 1 51 ARG HA 1 51 ARG HG3 . . 3.890 2.900 2.230 3.811 . 0 0 "[ . 1 . 2]" 1
628 1 51 ARG HA 1 54 GLU H . . 3.550 3.505 3.189 3.632 0.082 11 0 "[ . 1 . 2]" 1
629 1 51 ARG QB 1 52 LEU H . . 4.050 2.709 2.346 3.691 . 0 0 "[ . 1 . 2]" 1
630 1 52 LEU H 1 52 LEU HB2 . . 2.520 2.152 2.120 2.175 . 0 0 "[ . 1 . 2]" 1
631 1 52 LEU H 1 52 LEU HB3 . . 3.360 3.440 3.433 3.446 0.086 11 0 "[ . 1 . 2]" 1
632 1 52 LEU H 1 52 LEU MD1 . . 5.410 3.415 3.282 3.617 . 0 0 "[ . 1 . 2]" 1
633 1 52 LEU H 1 52 LEU MD2 . . 5.630 3.883 3.772 3.928 . 0 0 "[ . 1 . 2]" 1
634 1 52 LEU H 1 52 LEU HG . . 2.620 2.674 2.565 2.696 0.076 19 0 "[ . 1 . 2]" 1
635 1 52 LEU H 1 59 ILE MG . . 6.530 4.081 3.856 4.592 . 0 0 "[ . 1 . 2]" 1
636 1 52 LEU HA 1 52 LEU MD2 . . 3.710 2.147 2.035 2.298 . 0 0 "[ . 1 . 2]" 1
637 1 52 LEU HA 1 52 LEU HG . . 4.040 2.694 2.578 2.869 . 0 0 "[ . 1 . 2]" 1
638 1 52 LEU HA 1 55 SER H . . 3.210 3.268 3.093 3.303 0.093 9 0 "[ . 1 . 2]" 1
639 1 52 LEU HB2 1 53 GLN H . . 3.050 2.592 2.450 2.682 . 0 0 "[ . 1 . 2]" 1
640 1 52 LEU HB2 1 59 ILE MG . . 4.480 2.538 2.157 3.399 . 0 0 "[ . 1 . 2]" 1
641 1 52 LEU HB3 1 53 GLN H . . 3.240 3.184 3.087 3.297 0.057 2 0 "[ . 1 . 2]" 1
642 1 52 LEU HB3 1 57 SER HB2 . . 4.420 2.631 2.111 3.276 . 0 0 "[ . 1 . 2]" 1
643 1 52 LEU MD1 1 59 ILE HA . . 4.920 2.661 2.343 3.079 . 0 0 "[ . 1 . 2]" 1
644 1 52 LEU MD1 1 63 THR MG . . 5.660 2.541 2.024 3.048 . 0 0 "[ . 1 . 2]" 1
645 1 52 LEU MD1 1 64 LEU HA . . 4.170 2.040 1.952 2.172 . 0 0 "[ . 1 . 2]" 1
646 1 52 LEU MD1 1 67 SER H . . 6.530 3.764 3.483 4.167 . 0 0 "[ . 1 . 2]" 1
647 1 52 LEU MD1 1 67 SER HB3 . . 5.320 2.548 2.305 3.052 . 0 0 "[ . 1 . 2]" 1
648 1 52 LEU MD2 1 53 GLN H . . 6.530 4.697 4.606 4.776 . 0 0 "[ . 1 . 2]" 1
649 1 52 LEU MD2 1 57 SER HB2 . . 4.610 2.220 2.095 2.358 . 0 0 "[ . 1 . 2]" 1
650 1 52 LEU MD2 1 57 SER HB3 . . 4.330 2.432 2.182 2.755 . 0 0 "[ . 1 . 2]" 1
651 1 52 LEU MD2 1 63 THR MG . . 5.940 2.165 1.972 2.474 . 0 0 "[ . 1 . 2]" 1
652 1 52 LEU MD2 1 67 SER HB2 . . 4.880 2.352 2.129 3.059 . 0 0 "[ . 1 . 2]" 1
653 1 52 LEU MD2 1 67 SER HB3 . . 5.350 3.444 3.146 4.016 . 0 0 "[ . 1 . 2]" 1
654 1 53 GLN H 1 53 GLN HB2 . . 2.740 2.197 2.086 2.306 . 0 0 "[ . 1 . 2]" 1
655 1 53 GLN H 1 53 GLN HB3 . . 2.740 2.687 2.504 2.810 0.070 18 0 "[ . 1 . 2]" 1
656 1 53 GLN H 1 54 GLU H . . 3.020 2.732 2.664 2.808 . 0 0 "[ . 1 . 2]" 1
657 1 53 GLN H 1 59 ILE MG . . 5.320 3.004 2.762 3.436 . 0 0 "[ . 1 . 2]" 1
658 1 53 GLN HA 1 56 GLY H . . 3.210 3.249 3.046 3.295 0.085 2 0 "[ . 1 . 2]" 1
659 1 53 GLN HA 1 57 SER H . . 2.770 2.830 2.662 2.854 0.084 3 0 "[ . 1 . 2]" 1
660 1 53 GLN HA 1 59 ILE MG . . 5.410 3.650 3.380 4.224 . 0 0 "[ . 1 . 2]" 1
661 1 53 GLN QB 1 54 GLU H . . 3.370 2.473 2.312 2.635 . 0 0 "[ . 1 . 2]" 1
662 1 53 GLN QB 1 59 ILE MG . . 6.320 2.621 2.222 3.212 . 0 0 "[ . 1 . 2]" 1
663 1 53 GLN HB2 1 54 GLU H . . 3.550 3.631 3.599 3.644 0.094 17 0 "[ . 1 . 2]" 1
664 1 53 GLN HB3 1 54 GLU H . . 3.550 2.518 2.339 2.704 . 0 0 "[ . 1 . 2]" 1
665 1 53 GLN HE21 1 59 ILE MG . . 6.530 3.613 2.199 5.389 . 0 0 "[ . 1 . 2]" 1
666 1 53 GLN HE22 1 59 ILE MG . . 6.530 3.777 2.785 5.471 . 0 0 "[ . 1 . 2]" 1
667 1 53 GLN HG2 1 59 ILE MG . . 5.690 4.287 3.612 4.857 . 0 0 "[ . 1 . 2]" 1
668 1 53 GLN HG3 1 54 GLU H . . 5.500 4.267 3.784 4.938 . 0 0 "[ . 1 . 2]" 1
669 1 54 GLU H 1 54 GLU HA . . 2.800 2.836 2.805 2.857 0.057 1 0 "[ . 1 . 2]" 1
670 1 54 GLU H 1 54 GLU HB2 . . 2.650 2.439 1.973 2.634 . 0 0 "[ . 1 . 2]" 1
671 1 54 GLU H 1 54 GLU HB3 . . 2.740 2.569 2.280 2.827 0.087 15 0 "[ . 1 . 2]" 1
672 1 54 GLU H 1 55 SER H . . 2.800 2.777 2.602 2.867 0.067 17 0 "[ . 1 . 2]" 1
673 1 54 GLU HA 1 54 GLU HB2 . . 2.830 2.496 2.374 2.752 . 0 0 "[ . 1 . 2]" 1
674 1 54 GLU HA 1 55 SER H . . 3.500 3.561 3.532 3.581 0.081 15 0 "[ . 1 . 2]" 1
675 1 54 GLU HA 1 56 GLY H . . 3.640 3.689 3.619 3.720 0.080 6 0 "[ . 1 . 2]" 1
676 1 54 GLU HB3 1 55 SER H . . 3.140 2.852 2.594 3.037 . 0 0 "[ . 1 . 2]" 1
677 1 54 GLU QG 1 55 SER H . . 6.380 3.965 3.506 4.442 . 0 0 "[ . 1 . 2]" 1
678 1 55 SER H 1 55 SER QB . . 3.640 2.502 2.053 2.959 . 0 0 "[ . 1 . 2]" 1
679 1 55 SER H 1 56 GLY H . . 2.830 2.638 2.480 2.776 . 0 0 "[ . 1 . 2]" 1
680 1 55 SER H 1 57 SER H . . 3.790 3.685 3.349 3.857 0.067 18 0 "[ . 1 . 2]" 1
681 1 55 SER HA 1 55 SER HB2 . . 2.830 2.730 2.385 2.928 0.098 16 0 "[ . 1 . 2]" 1
682 1 55 SER HA 1 55 SER HB3 . . 2.830 2.438 2.243 2.816 . 0 0 "[ . 1 . 2]" 1
683 1 56 GLY H 1 56 GLY HA2 . . 2.550 2.289 2.247 2.333 . 0 0 "[ . 1 . 2]" 1
684 1 56 GLY H 1 56 GLY HA3 . . 2.900 2.894 2.852 2.951 0.051 11 0 "[ . 1 . 2]" 1
685 1 56 GLY H 1 57 SER H . . 2.400 2.459 2.341 2.483 0.083 6 0 "[ . 1 . 2]" 1
686 1 56 GLY HA2 1 57 SER H . . 3.110 2.919 2.572 3.132 0.022 11 0 "[ . 1 . 2]" 1
687 1 57 SER H 1 57 SER HB2 . . 2.830 2.564 2.437 2.740 . 0 0 "[ . 1 . 2]" 1
688 1 57 SER HA 1 57 SER HB3 . . 3.050 2.467 2.397 2.522 . 0 0 "[ . 1 . 2]" 1
689 1 57 SER HA 1 58 PRO HD2 . . 3.390 2.521 2.335 2.907 . 0 0 "[ . 1 . 2]" 1
690 1 57 SER HA 1 58 PRO HD3 . . 3.390 2.387 2.037 2.566 . 0 0 "[ . 1 . 2]" 1
691 1 57 SER HB2 1 63 THR MG . . 5.970 3.808 3.441 4.071 . 0 0 "[ . 1 . 2]" 1
692 1 57 SER HB3 1 63 THR MG . . 5.540 2.823 2.303 3.144 . 0 0 "[ . 1 . 2]" 1
693 1 58 PRO HA 1 59 ILE H . . 2.680 2.290 2.156 2.409 . 0 0 "[ . 1 . 2]" 1
694 1 58 PRO HA 1 60 ASP H . . 3.980 3.887 3.737 4.052 0.072 18 0 "[ . 1 . 2]" 1
695 1 58 PRO HB2 1 59 ILE H . . 3.270 2.924 2.603 3.259 . 0 0 "[ . 1 . 2]" 1
696 1 58 PRO HB2 1 60 ASP H . . 3.270 2.174 2.001 2.757 . 0 0 "[ . 1 . 2]" 1
697 1 58 PRO HB2 1 63 THR MG . . 5.320 3.725 2.215 4.294 . 0 0 "[ . 1 . 2]" 1
698 1 58 PRO HB3 1 59 ILE H . . 3.580 3.385 2.741 3.646 0.066 4 0 "[ . 1 . 2]" 1
699 1 58 PRO HB3 1 60 ASP H . . 3.670 3.659 3.107 3.753 0.083 15 0 "[ . 1 . 2]" 1
700 1 58 PRO QG 1 63 THR MG . . 5.490 2.394 2.071 3.518 . 0 0 "[ . 1 . 2]" 1
701 1 59 ILE H 1 59 ILE HB . . 4.040 3.711 3.565 3.890 . 0 0 "[ . 1 . 2]" 1
702 1 59 ILE H 1 59 ILE HG12 . . 4.200 2.175 1.972 2.610 . 0 0 "[ . 1 . 2]" 1
703 1 59 ILE H 1 59 ILE QG . . 3.710 2.118 1.949 2.439 . 0 0 "[ . 1 . 2]" 1
704 1 59 ILE H 1 59 ILE HG13 . . 4.200 3.051 2.634 3.526 . 0 0 "[ . 1 . 2]" 1
705 1 59 ILE H 1 59 ILE MG . . 4.260 2.681 2.291 2.990 . 0 0 "[ . 1 . 2]" 1
706 1 59 ILE H 1 60 ASP H . . 2.900 2.595 2.168 2.785 . 0 0 "[ . 1 . 2]" 1
707 1 59 ILE HA 1 60 ASP H . . 2.930 2.951 2.841 3.007 0.077 17 0 "[ . 1 . 2]" 1
708 1 59 ILE HA 1 63 THR MG . . 5.720 4.215 3.806 4.665 . 0 0 "[ . 1 . 2]" 1
709 1 59 ILE HA 1 64 LEU H . . 4.600 4.393 3.988 4.672 0.072 17 0 "[ . 1 . 2]" 1
710 1 59 ILE MG 1 60 ASP H . . 6.280 4.286 4.227 4.366 . 0 0 "[ . 1 . 2]" 1
711 1 60 ASP H 1 60 ASP QB . . 3.550 2.192 2.030 2.715 . 0 0 "[ . 1 . 2]" 1
712 1 60 ASP H 1 63 THR HB . . 3.390 3.130 2.773 3.404 0.014 20 0 "[ . 1 . 2]" 1
713 1 60 ASP H 1 63 THR MG . . 6.530 4.021 3.625 4.475 . 0 0 "[ . 1 . 2]" 1
714 1 60 ASP HA 1 61 LEU H . . 2.770 2.327 2.193 2.473 . 0 0 "[ . 1 . 2]" 1
715 1 60 ASP QB 1 61 LEU H . . 3.840 3.065 2.218 3.485 . 0 0 "[ . 1 . 2]" 1
716 1 60 ASP QB 1 62 ILE H . . 4.800 3.590 2.970 4.176 . 0 0 "[ . 1 . 2]" 1
717 1 61 LEU H 1 61 LEU HB2 . . 2.860 2.411 2.114 2.670 . 0 0 "[ . 1 . 2]" 1
718 1 61 LEU H 1 61 LEU HB3 . . 2.740 2.584 2.167 2.804 0.064 5 0 "[ . 1 . 2]" 1
719 1 61 LEU H 1 61 LEU HG . . 5.500 4.496 4.412 4.572 . 0 0 "[ . 1 . 2]" 1
720 1 61 LEU H 1 62 ILE H . . 3.240 3.138 2.823 3.309 0.069 1 0 "[ . 1 . 2]" 1
721 1 61 LEU HA 1 61 LEU MD2 . . 4.390 2.939 2.095 3.773 . 0 0 "[ . 1 . 2]" 1
722 1 61 LEU HA 1 64 LEU H . . 3.860 3.820 3.626 3.936 0.076 18 0 "[ . 1 . 2]" 1
723 1 61 LEU HA 1 65 ALA H . . 3.950 3.875 3.623 4.039 0.089 3 0 "[ . 1 . 2]" 1
724 1 61 LEU HB3 1 62 ILE H . . 2.930 2.475 2.102 2.868 . 0 0 "[ . 1 . 2]" 1
725 1 61 LEU HB3 1 62 ILE MD . . 4.480 2.695 2.276 3.479 . 0 0 "[ . 1 . 2]" 1
726 1 61 LEU HB3 1 87 SER QB . . 6.380 4.718 3.656 5.516 . 0 0 "[ . 1 . 2]" 1
727 1 61 LEU MD1 1 62 ILE H . . 6.470 3.649 2.455 4.321 . 0 0 "[ . 1 . 2]" 1
728 1 61 LEU MD1 1 80 PHE HZ . . 4.480 2.936 1.881 3.710 . 0 0 "[ . 1 . 2]" 1
729 1 61 LEU MD1 1 84 ALA HA . . 4.260 3.370 3.140 3.469 . 0 0 "[ . 1 . 2]" 1
730 1 61 LEU MD1 1 84 ALA MB . . 5.660 3.387 2.923 3.683 . 0 0 "[ . 1 . 2]" 1
731 1 61 LEU MD1 1 87 SER QB . . 5.570 3.679 3.108 4.130 . 0 0 "[ . 1 . 2]" 1
732 1 61 LEU MD2 1 65 ALA H . . 6.530 5.056 3.534 5.554 . 0 0 "[ . 1 . 2]" 1
733 1 61 LEU MD2 1 80 PHE QE . . 7.720 3.327 2.145 4.710 . 0 0 "[ . 1 . 2]" 1
734 1 61 LEU MD2 1 83 LEU HB2 . . 4.230 3.236 2.408 3.455 . 0 0 "[ . 1 . 2]" 1
735 1 61 LEU MD2 1 83 LEU HB3 . . 4.880 2.935 2.065 3.821 . 0 0 "[ . 1 . 2]" 1
736 1 61 LEU MD2 1 84 ALA H . . 5.350 3.507 2.925 3.802 . 0 0 "[ . 1 . 2]" 1
737 1 61 LEU MD2 1 84 ALA HA . . 4.480 2.363 2.108 2.884 . 0 0 "[ . 1 . 2]" 1
738 1 61 LEU MD2 1 84 ALA MB . . 5.910 3.082 2.409 3.893 . 0 0 "[ . 1 . 2]" 1
739 1 61 LEU MD2 1 87 SER H . . 6.530 3.692 3.105 4.650 . 0 0 "[ . 1 . 2]" 1
740 1 61 LEU MD2 1 87 SER QB . . 5.230 2.238 1.948 3.635 . 0 0 "[ . 1 . 2]" 1
741 1 61 LEU HG 1 80 PHE HZ . . 3.920 3.422 2.556 4.017 0.097 7 0 "[ . 1 . 2]" 1
742 1 62 ILE H 1 62 ILE HB . . 2.520 2.565 2.410 2.600 0.080 3 0 "[ . 1 . 2]" 1
743 1 62 ILE H 1 62 ILE MD . . 4.670 2.281 1.550 3.098 . 0 0 "[ . 1 . 2]" 1
744 1 62 ILE H 1 62 ILE HG12 . . 3.110 2.312 1.685 3.214 0.104 7 0 "[ . 1 . 2]" 1
745 1 62 ILE H 1 62 ILE QG . . 2.910 1.915 1.679 2.611 . 0 0 "[ . 1 . 2]" 1
746 1 62 ILE H 1 62 ILE HG13 . . 3.110 2.833 2.063 3.205 0.095 13 0 "[ . 1 . 2]" 1
747 1 62 ILE H 1 63 THR H . . 2.930 2.779 2.580 2.914 . 0 0 "[ . 1 . 2]" 1
748 1 62 ILE H 1 64 LEU H . . 4.510 4.274 4.083 4.498 . 0 0 "[ . 1 . 2]" 1
749 1 62 ILE HA 1 62 ILE MD . . 4.450 2.934 2.224 3.711 . 0 0 "[ . 1 . 2]" 1
750 1 62 ILE HA 1 62 ILE QG . . 3.890 2.966 2.472 3.296 . 0 0 "[ . 1 . 2]" 1
751 1 62 ILE HA 1 63 THR H . . 3.500 3.573 3.558 3.585 0.085 7 0 "[ . 1 . 2]" 1
752 1 62 ILE HA 1 65 ALA H . . 3.580 3.558 3.308 3.659 0.079 20 0 "[ . 1 . 2]" 1
753 1 62 ILE HA 1 80 PHE QE . . 6.660 2.871 2.237 3.871 . 0 0 "[ . 1 . 2]" 1
754 1 62 ILE HA 1 80 PHE HZ . . 3.700 3.099 2.155 3.763 0.063 3 0 "[ . 1 . 2]" 1
755 1 62 ILE HB 1 63 THR H . . 2.680 2.562 2.332 2.745 0.065 10 0 "[ . 1 . 2]" 1
756 1 62 ILE MD 1 80 PHE HZ . . 4.730 2.867 1.981 4.043 . 0 0 "[ . 1 . 2]" 1
757 1 62 ILE MG 1 63 THR H . . 4.880 3.714 3.453 3.965 . 0 0 "[ . 1 . 2]" 1
758 1 62 ILE MG 1 66 GLU HG2 . . 5.850 3.739 2.555 4.799 . 0 0 "[ . 1 . 2]" 1
759 1 62 ILE MG 1 66 GLU QG . . 5.610 2.891 2.258 3.760 . 0 0 "[ . 1 . 2]" 1
760 1 62 ILE MG 1 66 GLU HG3 . . 5.850 3.101 2.513 4.801 . 0 0 "[ . 1 . 2]" 1
761 1 62 ILE MG 1 80 PHE QE . . 7.750 3.010 2.240 4.153 . 0 0 "[ . 1 . 2]" 1
762 1 62 ILE MG 1 80 PHE HZ . . 4.480 3.382 2.615 3.555 . 0 0 "[ . 1 . 2]" 1
763 1 63 THR H 1 63 THR HA . . 2.710 2.784 2.771 2.792 0.082 20 0 "[ . 1 . 2]" 1
764 1 63 THR H 1 63 THR HB . . 2.770 2.655 2.367 2.836 0.066 10 0 "[ . 1 . 2]" 1
765 1 63 THR H 1 64 LEU H . . 2.960 2.698 2.580 2.823 . 0 0 "[ . 1 . 2]" 1
766 1 63 THR HA 1 63 THR MG . . 3.640 2.338 2.249 2.526 . 0 0 "[ . 1 . 2]" 1
767 1 63 THR HA 1 64 LEU H . . 3.420 3.498 3.492 3.506 0.086 11 0 "[ . 1 . 2]" 1
768 1 63 THR HB 1 64 LEU H . . 3.050 2.533 2.321 2.863 . 0 0 "[ . 1 . 2]" 1
769 1 63 THR MG 1 64 LEU H . . 5.940 3.635 3.253 3.816 . 0 0 "[ . 1 . 2]" 1
770 1 64 LEU H 1 64 LEU HB2 . . 2.770 2.415 2.266 2.513 . 0 0 "[ . 1 . 2]" 1
771 1 64 LEU H 1 64 LEU HB3 . . 2.710 2.470 2.214 2.705 . 0 0 "[ . 1 . 2]" 1
772 1 64 LEU H 1 64 LEU MD2 . . 5.380 4.160 4.020 4.389 . 0 0 "[ . 1 . 2]" 1
773 1 64 LEU H 1 64 LEU HG . . 4.910 4.458 4.320 4.525 . 0 0 "[ . 1 . 2]" 1
774 1 64 LEU HA 1 64 LEU MD1 . . 3.860 2.232 2.102 2.387 . 0 0 "[ . 1 . 2]" 1
775 1 64 LEU HA 1 67 SER H . . 3.420 3.476 3.353 3.503 0.083 16 0 "[ . 1 . 2]" 1
776 1 64 LEU HB2 1 65 ALA H . . 3.550 3.629 3.611 3.637 0.087 14 0 "[ . 1 . 2]" 1
777 1 64 LEU HB2 1 83 LEU QD . . 7.630 4.386 3.992 5.002 . 0 0 "[ . 1 . 2]" 1
778 1 64 LEU HB3 1 65 ALA H . . 2.860 2.258 2.184 2.389 . 0 0 "[ . 1 . 2]" 1
779 1 64 LEU HB3 1 83 LEU QD . . 7.630 3.247 2.791 3.755 . 0 0 "[ . 1 . 2]" 1
780 1 64 LEU MD1 1 65 ALA H . . 6.530 4.395 4.172 4.719 . 0 0 "[ . 1 . 2]" 1
781 1 64 LEU MD2 1 65 ALA H . . 5.810 3.838 3.564 4.230 . 0 0 "[ . 1 . 2]" 1
782 1 64 LEU MD2 1 83 LEU MD1 . . 5.660 2.693 2.294 3.541 . 0 0 "[ . 1 . 2]" 1
783 1 64 LEU MD2 1 83 LEU QD . . 7.670 2.222 1.903 2.980 . 0 0 "[ . 1 . 2]" 1
784 1 65 ALA H 1 66 GLU H . . 2.830 2.837 2.685 2.902 0.072 11 0 "[ . 1 . 2]" 1
785 1 65 ALA H 1 67 SER H . . 4.010 4.057 3.910 4.093 0.083 3 0 "[ . 1 . 2]" 1
786 1 65 ALA H 1 83 LEU MD1 . . 5.750 3.223 2.898 3.585 . 0 0 "[ . 1 . 2]" 1
787 1 65 ALA HA 1 66 GLU H . . 3.580 3.589 3.548 3.615 0.035 1 0 "[ . 1 . 2]" 1
788 1 65 ALA HA 1 68 LEU H . . 3.730 3.565 3.287 3.688 . 0 0 "[ . 1 . 2]" 1
789 1 65 ALA HA 1 68 LEU MD1 . . 5.040 2.680 2.118 3.092 . 0 0 "[ . 1 . 2]" 1
790 1 65 ALA HA 1 74 LEU MD1 . . 4.760 2.356 2.110 2.594 . 0 0 "[ . 1 . 2]" 1
791 1 65 ALA HA 1 83 LEU MD1 . . 4.670 2.287 2.080 2.535 . 0 0 "[ . 1 . 2]" 1
792 1 65 ALA MB 1 80 PHE QE . . 7.720 2.430 2.189 2.808 . 0 0 "[ . 1 . 2]" 1
793 1 65 ALA MB 1 83 LEU MD1 . . 6.500 2.120 2.002 2.212 . 0 0 "[ . 1 . 2]" 1
794 1 66 GLU H 1 66 GLU HB2 . . 2.590 2.323 2.121 2.476 . 0 0 "[ . 1 . 2]" 1
795 1 66 GLU H 1 66 GLU QG . . 4.640 2.524 2.176 3.604 . 0 0 "[ . 1 . 2]" 1
796 1 66 GLU H 1 67 SER H . . 2.990 2.732 2.662 2.794 . 0 0 "[ . 1 . 2]" 1
797 1 66 GLU H 1 80 PHE QE . . 7.620 4.530 4.113 4.984 . 0 0 "[ . 1 . 2]" 1
798 1 66 GLU HA 1 66 GLU HB3 . . 3.020 2.575 2.467 2.744 . 0 0 "[ . 1 . 2]" 1
799 1 66 GLU HA 1 66 GLU HG2 . . 4.200 2.616 2.185 3.594 . 0 0 "[ . 1 . 2]" 1
800 1 66 GLU HA 1 66 GLU QG . . 3.890 2.451 2.129 2.898 . 0 0 "[ . 1 . 2]" 1
801 1 66 GLU HA 1 66 GLU HG3 . . 4.200 3.243 2.345 3.830 . 0 0 "[ . 1 . 2]" 1
802 1 66 GLU HA 1 67 SER H . . 3.500 3.565 3.522 3.577 0.077 14 0 "[ . 1 . 2]" 1
803 1 66 GLU HA 1 69 GLU H . . 3.360 3.286 2.949 3.439 0.079 10 0 "[ . 1 . 2]" 1
804 1 66 GLU HA 1 70 ARG H . . 4.820 4.084 3.821 4.404 . 0 0 "[ . 1 . 2]" 1
805 1 66 GLU HB2 1 67 SER H . . 3.080 2.937 2.567 3.159 0.079 11 0 "[ . 1 . 2]" 1
806 1 66 GLU QG 1 67 SER H . . 6.380 4.365 4.129 4.752 . 0 0 "[ . 1 . 2]" 1
807 1 67 SER H 1 67 SER HA . . 2.800 2.867 2.850 2.884 0.084 6 0 "[ . 1 . 2]" 1
808 1 67 SER H 1 67 SER HB2 . . 2.770 2.345 2.156 2.469 . 0 0 "[ . 1 . 2]" 1
809 1 67 SER H 1 67 SER HB3 . . 2.770 2.727 2.502 2.846 0.076 8 0 "[ . 1 . 2]" 1
810 1 67 SER H 1 68 LEU H . . 2.990 2.588 2.477 2.700 . 0 0 "[ . 1 . 2]" 1
811 1 67 SER H 1 68 LEU MD1 . . 6.430 5.031 4.648 5.247 . 0 0 "[ . 1 . 2]" 1
812 1 67 SER HA 1 67 SER HB2 . . 2.930 2.570 2.501 2.698 . 0 0 "[ . 1 . 2]" 1
813 1 67 SER HA 1 68 LEU H . . 3.500 3.557 3.521 3.576 0.076 20 0 "[ . 1 . 2]" 1
814 1 67 SER HA 1 70 ARG H . . 3.730 3.272 2.856 3.782 0.052 4 0 "[ . 1 . 2]" 1
815 1 67 SER HB3 1 68 LEU H . . 3.610 2.651 2.232 2.925 . 0 0 "[ . 1 . 2]" 1
816 1 68 LEU H 1 68 LEU HB2 . . 2.830 2.282 2.206 2.354 . 0 0 "[ . 1 . 2]" 1
817 1 68 LEU H 1 68 LEU MD1 . . 4.330 3.388 3.035 3.546 . 0 0 "[ . 1 . 2]" 1
818 1 68 LEU H 1 68 LEU MD2 . . 5.380 3.968 3.795 4.150 . 0 0 "[ . 1 . 2]" 1
819 1 68 LEU H 1 68 LEU HG . . 2.800 2.718 2.445 2.870 0.070 20 0 "[ . 1 . 2]" 1
820 1 68 LEU H 1 69 GLU H . . 3.110 2.803 2.654 2.983 . 0 0 "[ . 1 . 2]" 1
821 1 68 LEU HA 1 68 LEU MD2 . . 3.830 2.231 2.141 2.462 . 0 0 "[ . 1 . 2]" 1
822 1 68 LEU HA 1 68 LEU HG . . 4.070 2.661 2.267 2.864 . 0 0 "[ . 1 . 2]" 1
823 1 68 LEU HA 1 71 GLN H . . 3.700 3.278 3.016 3.554 . 0 0 "[ . 1 . 2]" 1
824 1 68 LEU HA 1 71 GLN QE . . 6.370 4.385 2.411 5.165 . 0 0 "[ . 1 . 2]" 1
825 1 68 LEU HA 1 73 GLN H . . 3.950 3.744 3.488 3.989 0.039 20 0 "[ . 1 . 2]" 1
826 1 68 LEU HB2 1 69 GLU H . . 2.990 2.833 2.683 2.971 . 0 0 "[ . 1 . 2]" 1
827 1 68 LEU HB2 1 74 LEU HA . . 5.500 3.307 3.032 3.824 . 0 0 "[ . 1 . 2]" 1
828 1 68 LEU HB3 1 69 GLU H . . 3.450 3.485 3.319 3.524 0.074 13 0 "[ . 1 . 2]" 1
829 1 68 LEU HB3 1 74 LEU HA . . 5.280 2.320 2.109 2.535 . 0 0 "[ . 1 . 2]" 1
830 1 68 LEU MD1 1 74 LEU HA . . 5.690 3.000 2.595 3.804 . 0 0 "[ . 1 . 2]" 1
831 1 68 LEU MD1 1 77 VAL MG2 . . 5.850 2.088 1.994 2.499 . 0 0 "[ . 1 . 2]" 1
832 1 68 LEU MD2 1 73 GLN HB2 . . 4.730 2.436 2.115 2.925 . 0 0 "[ . 1 . 2]" 1
833 1 69 GLU H 1 69 GLU QG . . 3.830 2.924 2.188 3.537 . 0 0 "[ . 1 . 2]" 1
834 1 69 GLU H 1 70 ARG H . . 3.140 2.799 2.697 2.959 . 0 0 "[ . 1 . 2]" 1
835 1 69 GLU H 1 74 LEU HB2 . . 5.500 2.928 2.541 3.415 . 0 0 "[ . 1 . 2]" 1
836 1 69 GLU H 1 74 LEU MD2 . . 6.530 3.618 3.065 4.989 . 0 0 "[ . 1 . 2]" 1
837 1 69 GLU HA 1 72 GLY H . . 2.800 2.872 2.800 2.894 0.094 8 0 "[ . 1 . 2]" 1
838 1 69 GLU HA 1 73 GLN H . . 3.360 3.303 2.948 3.436 0.076 4 0 "[ . 1 . 2]" 1
839 1 69 GLU HA 1 74 LEU H . . 3.140 2.852 2.399 3.164 0.024 1 0 "[ . 1 . 2]" 1
840 1 69 GLU HA 1 74 LEU HB2 . . 4.320 2.820 2.506 3.239 . 0 0 "[ . 1 . 2]" 1
841 1 69 GLU HA 1 74 LEU HB3 . . 4.790 3.226 2.839 3.616 . 0 0 "[ . 1 . 2]" 1
842 1 69 GLU HA 1 74 LEU MD2 . . 5.350 3.898 3.682 4.236 . 0 0 "[ . 1 . 2]" 1
843 1 69 GLU QG 1 70 ARG H . . 4.830 3.559 2.284 4.428 . 0 0 "[ . 1 . 2]" 1
844 1 69 GLU QG 1 74 LEU MD1 . . 7.400 4.079 2.584 5.474 . 0 0 "[ . 1 . 2]" 1
845 1 69 GLU QG 1 74 LEU MD2 . . 5.820 2.626 1.960 3.976 . 0 0 "[ . 1 . 2]" 1
846 1 70 ARG H 1 70 ARG QB . . 3.520 2.474 2.353 2.687 . 0 0 "[ . 1 . 2]" 1
847 1 70 ARG H 1 70 ARG HG2 . . 3.520 3.083 2.214 3.592 0.072 9 0 "[ . 1 . 2]" 1
848 1 70 ARG H 1 70 ARG HG3 . . 3.520 2.832 2.282 3.589 0.069 3 0 "[ . 1 . 2]" 1
849 1 70 ARG H 1 71 GLN H . . 3.080 2.710 2.498 2.824 . 0 0 "[ . 1 . 2]" 1
850 1 70 ARG H 1 72 GLY H . . 4.200 3.896 3.708 4.030 . 0 0 "[ . 1 . 2]" 1
851 1 70 ARG HA 1 71 GLN H . . 3.500 3.551 3.527 3.572 0.072 20 0 "[ . 1 . 2]" 1
852 1 70 ARG QB 1 71 GLN H . . 4.360 2.782 2.445 3.715 . 0 0 "[ . 1 . 2]" 1
853 1 71 GLN H 1 71 GLN HB2 . . 2.620 2.480 2.290 2.678 0.058 20 0 "[ . 1 . 2]" 1
854 1 71 GLN H 1 71 GLN HG2 . . 3.610 2.692 2.201 3.675 0.065 18 0 "[ . 1 . 2]" 1
855 1 71 GLN H 1 71 GLN QG . . 3.390 2.446 2.184 2.741 . 0 0 "[ . 1 . 2]" 1
856 1 71 GLN H 1 71 GLN HG3 . . 3.610 3.232 2.465 3.679 0.069 20 0 "[ . 1 . 2]" 1
857 1 71 GLN H 1 72 GLY H . . 2.900 2.688 2.550 2.807 . 0 0 "[ . 1 . 2]" 1
858 1 71 GLN H 1 73 GLN H . . 4.260 3.892 3.546 4.237 . 0 0 "[ . 1 . 2]" 1
859 1 71 GLN HA 1 71 GLN HG2 . . 4.010 2.755 2.337 3.412 . 0 0 "[ . 1 . 2]" 1
860 1 71 GLN HA 1 71 GLN QG . . 3.650 2.674 2.301 3.204 . 0 0 "[ . 1 . 2]" 1
861 1 71 GLN HA 1 71 GLN HG3 . . 4.010 3.692 3.109 3.893 . 0 0 "[ . 1 . 2]" 1
862 1 71 GLN HA 1 72 GLY H . . 3.520 3.489 3.340 3.586 0.066 8 0 "[ . 1 . 2]" 1
863 1 71 GLN HB2 1 72 GLY H . . 3.890 3.437 3.190 3.720 . 0 0 "[ . 1 . 2]" 1
864 1 71 GLN HB2 1 73 GLN H . . 4.320 3.010 2.526 3.473 . 0 0 "[ . 1 . 2]" 1
865 1 71 GLN HB3 1 73 GLN H . . 4.380 3.962 3.551 4.449 0.069 3 0 "[ . 1 . 2]" 1
866 1 71 GLN QG 1 72 GLY H . . 5.980 4.460 4.293 4.604 . 0 0 "[ . 1 . 2]" 1
867 1 73 GLN H 1 73 GLN HB2 . . 2.860 2.503 2.284 2.692 . 0 0 "[ . 1 . 2]" 1
868 1 73 GLN H 1 73 GLN QG . . 4.860 3.184 2.636 4.006 . 0 0 "[ . 1 . 2]" 1
869 1 73 GLN H 1 74 LEU H . . 2.990 2.219 1.902 2.433 . 0 0 "[ . 1 . 2]" 1
870 1 73 GLN HA 1 73 GLN HB3 . . 3.050 2.564 2.390 2.712 . 0 0 "[ . 1 . 2]" 1
871 1 73 GLN HA 1 73 GLN HG2 . . 4.260 2.766 2.295 3.627 . 0 0 "[ . 1 . 2]" 1
872 1 73 GLN HA 1 73 GLN HG3 . . 4.260 3.081 2.167 3.850 . 0 0 "[ . 1 . 2]" 1
873 1 73 GLN HA 1 75 ASP H . . 5.500 4.016 3.589 4.521 . 0 0 "[ . 1 . 2]" 1
874 1 73 GLN HA 1 76 SER QB . . 4.890 2.488 2.114 2.928 . 0 0 "[ . 1 . 2]" 1
875 1 73 GLN QG 1 74 LEU H . . 6.220 4.638 4.421 5.037 . 0 0 "[ . 1 . 2]" 1
876 1 74 LEU H 1 74 LEU HB2 . . 3.110 2.557 2.457 2.694 . 0 0 "[ . 1 . 2]" 1
877 1 74 LEU H 1 74 LEU HB3 . . 3.020 2.551 2.417 2.682 . 0 0 "[ . 1 . 2]" 1
878 1 74 LEU H 1 75 ASP H . . 3.730 2.744 2.518 3.038 . 0 0 "[ . 1 . 2]" 1
879 1 74 LEU HA 1 74 LEU MD1 . . 3.990 2.187 2.085 3.280 . 0 0 "[ . 1 . 2]" 1
880 1 74 LEU HA 1 74 LEU MD2 . . 4.390 3.773 3.636 3.802 . 0 0 "[ . 1 . 2]" 1
881 1 74 LEU HA 1 77 VAL H . . 3.760 3.582 3.354 3.803 0.043 1 0 "[ . 1 . 2]" 1
882 1 74 LEU HA 1 77 VAL MG2 . . 4.390 2.291 2.022 2.666 . 0 0 "[ . 1 . 2]" 1
883 1 74 LEU HB3 1 75 ASP H . . 3.700 2.641 2.444 2.900 . 0 0 "[ . 1 . 2]" 1
884 1 74 LEU MD1 1 79 GLY H . . 6.160 3.751 3.039 4.895 . 0 0 "[ . 1 . 2]" 1
885 1 74 LEU MD1 1 83 LEU MD1 . . 5.390 2.142 1.994 2.529 . 0 0 "[ . 1 . 2]" 1
886 1 74 LEU MD2 1 80 PHE HA . . 5.290 3.545 2.532 4.045 . 0 0 "[ . 1 . 2]" 1
887 1 74 LEU MD2 1 80 PHE HB2 . . 5.320 2.463 2.122 3.063 . 0 0 "[ . 1 . 2]" 1
888 1 74 LEU MD2 1 80 PHE HB3 . . 5.910 3.929 3.550 4.429 . 0 0 "[ . 1 . 2]" 1
889 1 74 LEU HG 1 79 GLY H . . 5.410 3.751 3.213 4.852 . 0 0 "[ . 1 . 2]" 1
890 1 74 LEU HG 1 79 GLY QA . . 5.170 2.381 2.016 3.527 . 0 0 "[ . 1 . 2]" 1
891 1 75 ASP HA 1 79 GLY H . . 3.110 2.820 2.175 3.169 0.059 6 0 "[ . 1 . 2]" 1
892 1 75 ASP HA 1 79 GLY QA . . 4.640 2.737 2.049 3.522 . 0 0 "[ . 1 . 2]" 1
893 1 76 SER HA 1 78 GLY H . . 3.980 3.863 3.577 4.057 0.077 18 0 "[ . 1 . 2]" 1
894 1 77 VAL H 1 77 VAL HB . . 3.760 3.736 3.590 3.831 0.071 12 0 "[ . 1 . 2]" 1
895 1 77 VAL H 1 77 VAL MG1 . . 4.200 2.571 2.232 2.867 . 0 0 "[ . 1 . 2]" 1
896 1 77 VAL H 1 77 VAL MG2 . . 3.890 2.256 2.012 2.572 . 0 0 "[ . 1 . 2]" 1
897 1 77 VAL H 1 78 GLY H . . 2.930 2.367 1.953 2.658 . 0 0 "[ . 1 . 2]" 1
898 1 77 VAL H 1 79 GLY H . . 3.420 3.289 2.904 3.493 0.073 19 0 "[ . 1 . 2]" 1
899 1 77 VAL HA 1 78 GLY H . . 3.300 3.335 3.144 3.379 0.079 18 0 "[ . 1 . 2]" 1
900 1 77 VAL MG2 1 78 GLY H . . 5.600 3.111 2.705 3.523 . 0 0 "[ . 1 . 2]" 1
901 1 77 VAL MG2 1 79 GLY H . . 4.730 2.738 2.353 3.472 . 0 0 "[ . 1 . 2]" 1
902 1 77 VAL MG2 1 83 LEU MD1 . . 5.850 2.760 2.191 3.785 . 0 0 "[ . 1 . 2]" 1
903 1 77 VAL MG2 1 83 LEU HG . . 5.810 2.845 2.499 3.879 . 0 0 "[ . 1 . 2]" 1
904 1 78 GLY H 1 79 GLY H . . 2.680 2.147 1.922 2.347 . 0 0 "[ . 1 . 2]" 1
905 1 78 GLY H 1 79 GLY QA . . 4.740 3.994 3.845 4.182 . 0 0 "[ . 1 . 2]" 1
906 1 79 GLY H 1 79 GLY HA2 . . 2.960 2.298 2.222 2.416 . 0 0 "[ . 1 . 2]" 1
907 1 79 GLY H 1 79 GLY HA3 . . 2.960 2.898 2.720 2.985 0.025 2 0 "[ . 1 . 2]" 1
908 1 79 GLY QA 1 82 TYR H . . 4.920 3.780 3.436 4.433 . 0 0 "[ . 1 . 2]" 1
909 1 80 PHE HA 1 83 LEU H . . 3.480 3.415 3.326 3.534 0.054 20 0 "[ . 1 . 2]" 1
910 1 80 PHE HA 1 83 LEU MD1 . . 4.880 2.523 2.232 3.192 . 0 0 "[ . 1 . 2]" 1
911 1 80 PHE QE 1 84 ALA MB . . 8.060 2.772 2.190 3.730 . 0 0 "[ . 1 . 2]" 1
912 1 81 ALA HA 1 84 ALA H . . 3.330 3.351 2.790 3.405 0.075 8 0 "[ . 1 . 2]" 1
913 1 81 ALA HA 1 84 ALA MB . . 4.760 2.432 2.067 2.715 . 0 0 "[ . 1 . 2]" 1
914 1 81 ALA HA 1 85 GLU H . . 4.540 4.004 3.750 4.515 . 0 0 "[ . 1 . 2]" 1
915 1 81 ALA MB 1 82 TYR H . . 4.260 2.746 2.261 3.267 . 0 0 "[ . 1 . 2]" 1
916 1 82 TYR H 1 82 TYR HB2 . . 2.800 2.470 2.194 2.750 . 0 0 "[ . 1 . 2]" 1
917 1 82 TYR H 1 82 TYR HB3 . . 2.830 2.606 2.349 2.851 0.021 10 0 "[ . 1 . 2]" 1
918 1 82 TYR H 1 83 LEU H . . 2.770 2.602 2.332 2.761 . 0 0 "[ . 1 . 2]" 1
919 1 82 TYR HA 1 85 GLU H . . 3.330 3.317 3.054 3.407 0.077 9 0 "[ . 1 . 2]" 1
920 1 82 TYR HA 1 85 GLU HB3 . . 3.480 2.711 2.144 3.164 . 0 0 "[ . 1 . 2]" 1
921 1 82 TYR HB2 1 83 LEU H . . 4.510 3.872 3.689 4.011 . 0 0 "[ . 1 . 2]" 1
922 1 82 TYR HB3 1 83 LEU H . . 3.420 2.705 2.428 3.005 . 0 0 "[ . 1 . 2]" 1
923 1 82 TYR QD 1 83 LEU H . . 6.000 3.906 2.921 4.603 . 0 0 "[ . 1 . 2]" 1
924 1 82 TYR QD 1 83 LEU MD2 . . 7.270 3.052 2.389 3.886 . 0 0 "[ . 1 . 2]" 1
925 1 82 TYR QD 1 86 LEU MD1 . . 8.670 2.898 2.295 4.239 . 0 0 "[ . 1 . 2]" 1
926 1 82 TYR QE 1 86 LEU MD1 . . 7.020 2.626 2.176 4.846 . 0 0 "[ . 1 . 2]" 1
927 1 82 TYR QE 1 86 LEU MD2 . . 6.990 3.150 2.509 3.982 . 0 0 "[ . 1 . 2]" 1
928 1 83 LEU H 1 83 LEU HB2 . . 2.930 2.618 2.485 2.771 . 0 0 "[ . 1 . 2]" 1
929 1 83 LEU H 1 83 LEU MD1 . . 5.380 3.635 3.511 3.761 . 0 0 "[ . 1 . 2]" 1
930 1 83 LEU H 1 83 LEU MD2 . . 5.290 3.265 3.058 3.540 . 0 0 "[ . 1 . 2]" 1
931 1 83 LEU H 1 83 LEU HG . . 2.930 2.240 2.076 2.478 . 0 0 "[ . 1 . 2]" 1
932 1 83 LEU H 1 84 ALA H . . 2.930 2.635 2.398 2.765 . 0 0 "[ . 1 . 2]" 1
933 1 83 LEU HA 1 83 LEU MD2 . . 3.950 2.210 2.120 2.379 . 0 0 "[ . 1 . 2]" 1
934 1 83 LEU HA 1 86 LEU H . . 3.640 3.366 3.082 3.563 . 0 0 "[ . 1 . 2]" 1
935 1 83 LEU HA 1 86 LEU MD1 . . 4.360 2.460 2.098 3.522 . 0 0 "[ . 1 . 2]" 1
936 1 83 LEU HA 1 87 SER H . . 4.040 4.045 3.818 4.105 0.065 20 0 "[ . 1 . 2]" 1
937 1 83 LEU HB2 1 84 ALA H . . 2.960 2.566 2.348 2.783 . 0 0 "[ . 1 . 2]" 1
938 1 84 ALA H 1 84 ALA MB . . 3.580 2.220 2.174 2.270 . 0 0 "[ . 1 . 2]" 1
939 1 84 ALA H 1 85 GLU H . . 2.960 2.686 2.500 2.760 . 0 0 "[ . 1 . 2]" 1
940 1 84 ALA HA 1 85 GLU H . . 3.480 3.546 3.494 3.559 0.079 7 0 "[ . 1 . 2]" 1
941 1 84 ALA HA 1 87 SER H . . 3.730 3.424 3.121 3.783 0.053 7 0 "[ . 1 . 2]" 1
942 1 84 ALA HA 1 87 SER QB . . 4.760 2.568 2.121 2.953 . 0 0 "[ . 1 . 2]" 1
943 1 84 ALA MB 1 85 GLU H . . 4.080 2.667 2.431 3.111 . 0 0 "[ . 1 . 2]" 1
944 1 84 ALA MB 1 88 LYS QE . . 7.340 3.308 2.009 4.631 . 0 0 "[ . 1 . 2]" 1
945 1 85 GLU H 1 85 GLU HB2 . . 2.590 2.478 2.155 2.659 0.069 6 0 "[ . 1 . 2]" 1
946 1 85 GLU H 1 86 LEU H . . 2.900 2.741 2.443 2.870 . 0 0 "[ . 1 . 2]" 1
947 1 85 GLU HA 1 85 GLU HG2 . . 4.070 3.507 2.467 4.046 . 0 0 "[ . 1 . 2]" 1
948 1 85 GLU HA 1 85 GLU QG . . 3.670 2.581 2.162 3.224 . 0 0 "[ . 1 . 2]" 1
949 1 85 GLU HA 1 85 GLU HG3 . . 4.070 2.679 2.214 3.388 . 0 0 "[ . 1 . 2]" 1
950 1 85 GLU HA 1 88 LYS H . . 3.640 3.506 3.141 3.716 0.076 9 0 "[ . 1 . 2]" 1
951 1 85 GLU HA 1 88 LYS QB . . 5.070 3.040 2.381 4.387 . 0 0 "[ . 1 . 2]" 1
952 1 85 GLU HA 1 88 LYS QD . . 6.070 3.963 2.393 5.363 . 0 0 "[ . 1 . 2]" 1
953 1 85 GLU HA 1 88 LYS QE . . 6.130 3.961 2.139 4.942 . 0 0 "[ . 1 . 2]" 1
954 1 85 GLU HB3 1 86 LEU H . . 3.050 2.558 2.238 2.938 . 0 0 "[ . 1 . 2]" 1
955 1 86 LEU H 1 86 LEU HB2 . . 2.930 2.529 2.261 2.818 . 0 0 "[ . 1 . 2]" 1
956 1 86 LEU H 1 86 LEU MD1 . . 5.470 3.554 2.187 4.106 . 0 0 "[ . 1 . 2]" 1
957 1 86 LEU H 1 86 LEU MD2 . . 5.380 3.431 2.534 4.076 . 0 0 "[ . 1 . 2]" 1
958 1 86 LEU H 1 86 LEU HG . . 2.830 2.433 2.054 2.912 0.082 8 0 "[ . 1 . 2]" 1
959 1 86 LEU H 1 87 SER H . . 2.990 2.818 2.660 2.945 . 0 0 "[ . 1 . 2]" 1
960 1 86 LEU HA 1 86 LEU MD2 . . 3.890 2.226 2.093 3.231 . 0 0 "[ . 1 . 2]" 1
961 1 86 LEU HA 1 87 SER H . . 3.500 3.559 3.545 3.569 0.069 10 0 "[ . 1 . 2]" 1
962 1 86 LEU HA 1 89 ASN H . . 4.230 3.412 2.962 3.959 . 0 0 "[ . 1 . 2]" 1
963 1 86 LEU HA 1 89 ASN HD21 . . 4.040 3.516 2.558 4.110 0.070 15 0 "[ . 1 . 2]" 1
964 1 86 LEU HA 1 89 ASN HD22 . . 5.190 4.719 2.593 5.263 0.073 10 0 "[ . 1 . 2]" 1
965 1 86 LEU HB2 1 87 SER H . . 2.990 2.486 2.321 2.754 . 0 0 "[ . 1 . 2]" 1
966 1 86 LEU MD1 1 87 SER H . . 6.530 4.375 4.081 4.619 . 0 0 "[ . 1 . 2]" 1
967 1 87 SER H 1 87 SER QB . . 3.800 2.127 2.030 2.213 . 0 0 "[ . 1 . 2]" 1
968 1 87 SER H 1 88 LYS H . . 2.740 2.794 2.683 2.821 0.081 9 0 "[ . 1 . 2]" 1
969 1 87 SER HA 1 89 ASN H . . 4.600 4.115 3.846 4.476 . 0 0 "[ . 1 . 2]" 1
970 1 87 SER QB 1 89 ASN H . . 6.190 4.646 4.421 5.096 . 0 0 "[ . 1 . 2]" 1
971 1 88 LYS H 1 88 LYS QB . . 3.830 2.397 2.105 2.894 . 0 0 "[ . 1 . 2]" 1
972 1 88 LYS HA 1 88 LYS HG2 . . 4.070 3.135 2.372 3.815 . 0 0 "[ . 1 . 2]" 1
973 1 88 LYS HA 1 88 LYS QG . . 3.850 2.480 2.255 3.343 . 0 0 "[ . 1 . 2]" 1
974 1 88 LYS HA 1 88 LYS HG3 . . 4.070 2.716 2.282 3.725 . 0 0 "[ . 1 . 2]" 1
975 1 88 LYS HA 1 89 ASN H . . 3.360 3.319 2.847 3.443 0.083 18 0 "[ . 1 . 2]" 1
976 1 88 LYS HA 1 90 THR H . . 3.610 3.456 3.054 3.681 0.071 5 0 "[ . 1 . 2]" 1
977 1 88 LYS QB 1 89 ASN H . . 4.390 3.384 2.773 3.917 . 0 0 "[ . 1 . 2]" 1
978 1 89 ASN H 1 89 ASN QB . . 3.770 2.435 2.230 2.875 . 0 0 "[ . 1 . 2]" 1
979 1 89 ASN H 1 90 THR H . . 3.080 2.803 2.288 3.134 0.054 20 0 "[ . 1 . 2]" 1
980 1 89 ASN HA 1 90 THR H . . 2.860 2.897 2.668 2.958 0.098 9 0 "[ . 1 . 2]" 1
981 1 90 THR H 1 90 THR HB . . 3.170 2.780 2.412 3.228 0.058 20 0 "[ . 1 . 2]" 1
982 1 90 THR H 1 91 PRO QD . . 6.380 4.147 3.843 4.374 . 0 0 "[ . 1 . 2]" 1
983 1 90 THR HB 1 92 SER H . . 4.570 3.788 2.720 4.634 0.064 20 0 "[ . 1 . 2]" 1
984 1 90 THR MG 1 91 PRO QD . . 5.980 2.531 2.060 4.251 . 0 0 "[ . 1 . 2]" 1
985 1 91 PRO HA 1 92 SER H . . 3.170 2.606 2.217 3.261 0.091 3 0 "[ . 1 . 2]" 1
986 1 91 PRO QB 1 99 TYR QE . . 7.130 4.481 2.665 5.193 . 0 0 "[ . 1 . 2]" 1
987 1 91 PRO HB2 1 99 TYR QE . . 7.380 4.941 2.724 5.682 . 0 0 "[ . 1 . 2]" 1
988 1 91 PRO HB3 1 99 TYR QE . . 7.380 5.192 3.783 6.040 . 0 0 "[ . 1 . 2]" 1
989 1 92 SER QB 1 94 ALA H . . 5.540 3.338 1.936 4.726 . 0 0 "[ . 1 . 2]" 1
990 1 93 ALA HA 1 96 ILE HB . . 3.360 2.883 2.201 3.417 0.057 19 0 "[ . 1 . 2]" 1
991 1 93 ALA HA 1 96 ILE MD . . 5.100 3.302 2.047 4.399 . 0 0 "[ . 1 . 2]" 1
992 1 93 ALA MB 1 96 ILE HB . . 4.790 3.001 2.225 3.940 . 0 0 "[ . 1 . 2]" 1
993 1 93 ALA MB 1 96 ILE MD . . 6.070 2.970 2.179 4.135 . 0 0 "[ . 1 . 2]" 1
994 1 93 ALA MB 1 96 ILE MG . . 6.630 3.043 2.249 4.272 . 0 0 "[ . 1 . 2]" 1
995 1 94 ALA MB 1 99 TYR QE . . 8.350 4.612 2.502 5.717 . 0 0 "[ . 1 . 2]" 1
996 1 95 ASN HA 1 96 ILE H . . 3.110 2.919 2.256 3.177 0.067 16 0 "[ . 1 . 2]" 1
997 1 95 ASN HA 1 97 SER H . . 4.880 3.881 3.349 4.250 . 0 0 "[ . 1 . 2]" 1
998 1 95 ASN HA 1 98 ALA H . . 4.110 3.485 3.105 3.818 . 0 0 "[ . 1 . 2]" 1
999 1 95 ASN HA 1 98 ALA MB . . 4.610 3.442 3.029 3.754 . 0 0 "[ . 1 . 2]" 1
1000 1 95 ASN QB 1 98 ALA MB . . 5.240 2.462 2.024 3.779 . 0 0 "[ . 1 . 2]" 1
1001 1 95 ASN HB2 1 98 ALA MB . . 5.660 3.740 2.796 4.543 . 0 0 "[ . 1 . 2]" 1
1002 1 95 ASN HB2 1 99 TYR QE . . 7.070 3.594 2.473 5.864 . 0 0 "[ . 1 . 2]" 1
1003 1 95 ASN HB3 1 98 ALA MB . . 5.660 2.516 2.056 4.146 . 0 0 "[ . 1 . 2]" 1
1004 1 95 ASN HB3 1 99 TYR QE . . 7.070 4.020 2.421 5.801 . 0 0 "[ . 1 . 2]" 1
1005 1 96 ILE H 1 96 ILE HB . . 2.770 2.239 2.102 2.386 . 0 0 "[ . 1 . 2]" 1
1006 1 96 ILE H 1 96 ILE HG12 . . 4.720 4.358 2.241 4.627 . 0 0 "[ . 1 . 2]" 1
1007 1 96 ILE H 1 96 ILE QG . . 4.410 3.734 2.219 4.047 . 0 0 "[ . 1 . 2]" 1
1008 1 96 ILE H 1 96 ILE HG13 . . 4.720 4.131 2.582 4.559 . 0 0 "[ . 1 . 2]" 1
1009 1 96 ILE H 1 96 ILE MG . . 4.420 2.522 2.134 3.770 . 0 0 "[ . 1 . 2]" 1
1010 1 96 ILE H 1 97 SER H . . 3.110 2.768 2.535 3.050 . 0 0 "[ . 1 . 2]" 1
1011 1 96 ILE HA 1 96 ILE MD . . 4.570 3.458 2.093 3.870 . 0 0 "[ . 1 . 2]" 1
1012 1 96 ILE HA 1 96 ILE HG12 . . 3.830 2.879 2.120 3.771 . 0 0 "[ . 1 . 2]" 1
1013 1 96 ILE HA 1 96 ILE QG . . 3.540 2.328 2.041 3.028 . 0 0 "[ . 1 . 2]" 1
1014 1 96 ILE HA 1 96 ILE HG13 . . 3.830 2.566 2.102 3.744 . 0 0 "[ . 1 . 2]" 1
1015 1 96 ILE HA 1 98 ALA H . . 4.140 4.171 3.965 4.215 0.075 3 0 "[ . 1 . 2]" 1
1016 1 96 ILE HA 1 99 TYR H . . 3.300 3.244 2.909 3.380 0.080 8 0 "[ . 1 . 2]" 1
1017 1 96 ILE HA 1 99 TYR HB2 . . 3.730 2.629 1.968 3.116 . 0 0 "[ . 1 . 2]" 1
1018 1 96 ILE HA 1 99 TYR QD . . 5.440 2.474 2.020 3.997 . 0 0 "[ . 1 . 2]" 1
1019 1 96 ILE HA 1 100 ALA H . . 3.920 3.944 3.713 3.996 0.076 6 0 "[ . 1 . 2]" 1
1020 1 96 ILE HB 1 97 SER H . . 3.480 3.527 2.815 3.580 0.100 14 0 "[ . 1 . 2]" 1
1021 1 96 ILE QG 1 97 SER H . . 6.380 3.900 3.476 4.560 . 0 0 "[ . 1 . 2]" 1
1022 1 96 ILE MG 1 97 SER H . . 4.170 2.079 1.816 3.348 . 0 0 "[ . 1 . 2]" 1
1023 1 96 ILE MG 1 99 TYR QD . . 8.050 5.040 4.454 5.905 . 0 0 "[ . 1 . 2]" 1
1024 1 97 SER H 1 97 SER QB . . 3.520 2.491 2.139 2.861 . 0 0 "[ . 1 . 2]" 1
1025 1 97 SER H 1 98 ALA H . . 2.930 2.811 2.699 2.971 0.041 10 0 "[ . 1 . 2]" 1
1026 1 97 SER HA 1 98 ALA H . . 3.420 3.498 3.488 3.506 0.086 15 0 "[ . 1 . 2]" 1
1027 1 97 SER HA 1 100 ALA H . . 3.480 3.471 3.161 3.559 0.079 5 0 "[ . 1 . 2]" 1
1028 1 97 SER HA 1 100 ALA MB . . 4.790 2.607 2.307 2.839 . 0 0 "[ . 1 . 2]" 1
1029 1 97 SER QB 1 98 ALA H . . 4.210 2.661 2.350 2.973 . 0 0 "[ . 1 . 2]" 1
1030 1 98 ALA H 1 98 ALA HA . . 2.930 2.911 2.862 2.950 0.020 11 0 "[ . 1 . 2]" 1
1031 1 98 ALA H 1 98 ALA MB . . 3.580 2.294 2.195 2.365 . 0 0 "[ . 1 . 2]" 1
1032 1 98 ALA H 1 99 TYR H . . 2.860 2.570 2.391 2.777 . 0 0 "[ . 1 . 2]" 1
1033 1 98 ALA H 1 100 ALA H . . 4.510 4.050 3.792 4.247 . 0 0 "[ . 1 . 2]" 1
1034 1 98 ALA HA 1 99 TYR H . . 3.610 3.605 3.544 3.653 0.043 5 0 "[ . 1 . 2]" 1
1035 1 98 ALA HA 1 101 ASP H . . 3.390 3.315 2.998 3.459 0.069 13 0 "[ . 1 . 2]" 1
1036 1 98 ALA HA 1 101 ASP HB2 . . 3.550 2.569 2.193 3.368 . 0 0 "[ . 1 . 2]" 1
1037 1 98 ALA MB 1 99 TYR H . . 4.300 2.721 2.513 2.960 . 0 0 "[ . 1 . 2]" 1
1038 1 98 ALA MB 1 99 TYR QD . . 8.670 3.983 2.890 4.665 . 0 0 "[ . 1 . 2]" 1
1039 1 98 ALA MB 1 99 TYR QE . . 8.660 4.800 3.718 5.540 . 0 0 "[ . 1 . 2]" 1
1040 1 99 TYR H 1 99 TYR HB2 . . 2.830 2.382 2.250 2.650 . 0 0 "[ . 1 . 2]" 1
1041 1 99 TYR H 1 99 TYR HB3 . . 3.480 3.548 3.522 3.563 0.083 9 0 "[ . 1 . 2]" 1
1042 1 99 TYR H 1 100 ALA H . . 2.960 2.640 2.452 2.791 . 0 0 "[ . 1 . 2]" 1
1043 1 99 TYR HA 1 102 ILE H . . 3.520 3.367 3.089 3.578 0.058 13 0 "[ . 1 . 2]" 1
1044 1 99 TYR HA 1 102 ILE HB . . 3.550 2.884 2.144 3.626 0.076 2 0 "[ . 1 . 2]" 1
1045 1 99 TYR HA 1 102 ILE MD . . 4.390 2.374 2.119 2.981 . 0 0 "[ . 1 . 2]" 1
1046 1 99 TYR HA 1 103 VAL H . . 4.630 4.348 4.047 4.668 0.038 3 0 "[ . 1 . 2]" 1
1047 1 99 TYR HB2 1 100 ALA H . . 3.140 2.626 2.309 2.783 . 0 0 "[ . 1 . 2]" 1
1048 1 99 TYR HB3 1 100 ALA H . . 3.520 3.483 3.234 3.589 0.069 13 0 "[ . 1 . 2]" 1
1049 1 99 TYR QD 1 102 ILE MD . . 6.590 2.941 2.110 3.986 . 0 0 "[ . 1 . 2]" 1
1050 1 99 TYR QE 1 102 ILE MD . . 7.570 4.114 3.182 4.924 . 0 0 "[ . 1 . 2]" 1
1051 1 100 ALA H 1 101 ASP H . . 2.900 2.746 2.643 2.903 0.003 8 0 "[ . 1 . 2]" 1
1052 1 100 ALA HA 1 103 VAL H . . 3.170 3.138 2.958 3.240 0.070 8 0 "[ . 1 . 2]" 1
1053 1 100 ALA HA 1 103 VAL HB . . 3.420 2.638 2.326 2.909 . 0 0 "[ . 1 . 2]" 1
1054 1 100 ALA HA 1 103 VAL MG2 . . 4.140 2.736 2.170 3.146 . 0 0 "[ . 1 . 2]" 1
1055 1 100 ALA HA 1 104 ARG H . . 3.860 3.901 3.777 3.931 0.071 4 0 "[ . 1 . 2]" 1
1056 1 100 ALA MB 1 101 ASP H . . 4.200 2.663 2.469 2.793 . 0 0 "[ . 1 . 2]" 1
1057 1 101 ASP H 1 101 ASP HB2 . . 2.620 2.264 2.073 2.550 . 0 0 "[ . 1 . 2]" 1
1058 1 101 ASP H 1 102 ILE H . . 3.140 2.753 2.633 2.894 . 0 0 "[ . 1 . 2]" 1
1059 1 101 ASP HA 1 104 ARG H . . 3.580 3.478 3.101 3.645 0.065 7 0 "[ . 1 . 2]" 1
1060 1 101 ASP HA 1 105 GLU H . . 4.660 3.907 3.546 4.270 . 0 0 "[ . 1 . 2]" 1
1061 1 101 ASP HB2 1 102 ILE H . . 3.640 3.278 2.663 3.726 0.086 3 0 "[ . 1 . 2]" 1
1062 1 101 ASP HB3 1 102 ILE H . . 4.230 3.109 2.486 3.820 . 0 0 "[ . 1 . 2]" 1
1063 1 102 ILE H 1 102 ILE HB . . 2.680 2.463 2.104 2.741 0.061 3 0 "[ . 1 . 2]" 1
1064 1 102 ILE H 1 102 ILE HG12 . . 4.510 3.739 3.228 4.222 . 0 0 "[ . 1 . 2]" 1
1065 1 102 ILE H 1 102 ILE HG13 . . 3.170 2.420 2.137 3.055 . 0 0 "[ . 1 . 2]" 1
1066 1 102 ILE H 1 103 VAL H . . 2.960 2.725 2.375 2.877 . 0 0 "[ . 1 . 2]" 1
1067 1 102 ILE HA 1 105 GLU H . . 3.730 3.380 3.043 3.793 0.063 15 0 "[ . 1 . 2]" 1
1068 1 102 ILE HB 1 103 VAL H . . 3.080 2.730 2.351 3.041 . 0 0 "[ . 1 . 2]" 1
1069 1 102 ILE HG12 1 103 VAL H . . 5.500 5.148 4.783 5.313 . 0 0 "[ . 1 . 2]" 1
1070 1 102 ILE MG 1 103 VAL H . . 4.820 3.326 2.711 3.669 . 0 0 "[ . 1 . 2]" 1
1071 1 102 ILE MG 1 106 ARG HG2 . . 4.730 2.813 2.426 3.394 . 0 0 "[ . 1 . 2]" 1
1072 1 102 ILE MG 1 106 ARG QG . . 4.460 2.639 2.247 3.183 . 0 0 "[ . 1 . 2]" 1
1073 1 102 ILE MG 1 106 ARG HG3 . . 4.730 3.344 2.352 3.948 . 0 0 "[ . 1 . 2]" 1
1074 1 103 VAL H 1 103 VAL HB . . 2.740 2.535 2.317 2.714 . 0 0 "[ . 1 . 2]" 1
1075 1 103 VAL H 1 103 VAL MG2 . . 3.640 2.151 1.865 2.371 . 0 0 "[ . 1 . 2]" 1
1076 1 103 VAL H 1 104 ARG H . . 3.110 2.812 2.673 3.018 . 0 0 "[ . 1 . 2]" 1
1077 1 103 VAL HA 1 106 ARG H . . 4.140 3.556 3.129 4.052 . 0 0 "[ . 1 . 2]" 1
1078 1 103 VAL HB 1 104 ARG H . . 2.550 2.576 2.452 2.623 0.073 7 0 "[ . 1 . 2]" 1
1079 1 103 VAL MG1 1 104 ARG H . . 5.880 3.417 2.955 3.630 . 0 0 "[ . 1 . 2]" 1
1080 1 103 VAL MG1 1 104 ARG HA . . 5.260 3.628 2.996 3.944 . 0 0 "[ . 1 . 2]" 1
1081 1 103 VAL MG1 1 107 ALA MB . . 7.560 3.427 3.129 3.722 . 0 0 "[ . 1 . 2]" 1
1082 1 103 VAL MG2 1 104 ARG H . . 6.530 3.884 3.681 4.057 . 0 0 "[ . 1 . 2]" 1
1083 1 104 ARG H 1 104 ARG HB2 . . 2.830 2.466 2.317 2.607 . 0 0 "[ . 1 . 2]" 1
1084 1 104 ARG H 1 104 ARG HB3 . . 2.990 2.610 2.287 2.925 . 0 0 "[ . 1 . 2]" 1
1085 1 104 ARG H 1 105 GLU H . . 3.080 2.880 2.780 2.994 . 0 0 "[ . 1 . 2]" 1
1086 1 104 ARG HA 1 104 ARG HD2 . . 4.510 3.527 2.068 4.585 0.075 8 0 "[ . 1 . 2]" 1
1087 1 104 ARG HA 1 104 ARG HD3 . . 4.510 3.601 2.334 4.581 0.071 12 0 "[ . 1 . 2]" 1
1088 1 104 ARG HA 1 107 ALA H . . 4.040 3.346 3.066 3.779 . 0 0 "[ . 1 . 2]" 1
1089 1 104 ARG HA 1 107 ALA MB . . 4.480 2.555 2.327 2.799 . 0 0 "[ . 1 . 2]" 1
1090 1 104 ARG HB3 1 105 GLU H . . 3.140 2.609 2.301 2.913 . 0 0 "[ . 1 . 2]" 1
1091 1 104 ARG QD 1 108 VAL MG2 . . 5.150 2.855 2.003 3.868 . 0 0 "[ . 1 . 2]" 1
1092 1 104 ARG HD2 1 108 VAL MG2 . . 5.380 3.401 2.179 4.552 . 0 0 "[ . 1 . 2]" 1
1093 1 104 ARG HD3 1 108 VAL MG2 . . 5.380 3.544 2.198 4.440 . 0 0 "[ . 1 . 2]" 1
1094 1 104 ARG QG 1 108 VAL MG2 . . 5.700 2.642 2.168 3.590 . 0 0 "[ . 1 . 2]" 1
1095 1 105 GLU H 1 105 GLU HB2 . . 2.520 2.244 2.089 2.427 . 0 0 "[ . 1 . 2]" 1
1096 1 105 GLU H 1 105 GLU HG2 . . 5.340 4.552 4.439 4.655 . 0 0 "[ . 1 . 2]" 1
1097 1 105 GLU H 1 105 GLU QG . . 4.920 3.968 3.770 4.086 . 0 0 "[ . 1 . 2]" 1
1098 1 105 GLU H 1 105 GLU HG3 . . 5.340 4.375 4.034 4.559 . 0 0 "[ . 1 . 2]" 1
1099 1 105 GLU H 1 106 ARG H . . 2.800 2.771 2.624 2.870 0.070 12 0 "[ . 1 . 2]" 1
1100 1 105 GLU HA 1 105 GLU HG2 . . 3.730 3.264 2.389 3.794 0.064 4 0 "[ . 1 . 2]" 1
1101 1 105 GLU HA 1 105 GLU QG . . 3.330 2.430 2.186 2.882 . 0 0 "[ . 1 . 2]" 1
1102 1 105 GLU HA 1 105 GLU HG3 . . 3.730 2.572 2.277 3.160 . 0 0 "[ . 1 . 2]" 1
1103 1 105 GLU HA 1 108 VAL H . . 3.390 3.376 2.966 3.461 0.071 4 0 "[ . 1 . 2]" 1
1104 1 105 GLU HA 1 108 VAL HB . . 3.270 2.592 2.082 3.021 . 0 0 "[ . 1 . 2]" 1
1105 1 105 GLU HA 1 108 VAL MG2 . . 4.420 3.251 2.524 3.641 . 0 0 "[ . 1 . 2]" 1
1106 1 105 GLU HB2 1 106 ARG H . . 3.500 3.564 3.324 3.591 0.091 9 0 "[ . 1 . 2]" 1
1107 1 105 GLU HB3 1 106 ARG H . . 3.500 2.490 2.180 2.880 . 0 0 "[ . 1 . 2]" 1
1108 1 106 ARG H 1 106 ARG HB2 . . 3.140 2.603 2.291 2.838 . 0 0 "[ . 1 . 2]" 1
1109 1 106 ARG H 1 106 ARG HB3 . . 4.110 3.695 3.581 3.801 . 0 0 "[ . 1 . 2]" 1
1110 1 106 ARG H 1 106 ARG QG . . 4.180 2.472 2.200 3.679 . 0 0 "[ . 1 . 2]" 1
1111 1 106 ARG H 1 107 ALA H . . 3.140 2.756 2.591 2.876 . 0 0 "[ . 1 . 2]" 1
1112 1 106 ARG HA 1 106 ARG HD2 . . 4.290 3.347 2.398 4.053 . 0 0 "[ . 1 . 2]" 1
1113 1 106 ARG HA 1 106 ARG QD . . 4.070 2.303 2.014 3.259 . 0 0 "[ . 1 . 2]" 1
1114 1 106 ARG HA 1 106 ARG HD3 . . 4.290 2.426 2.026 3.993 . 0 0 "[ . 1 . 2]" 1
1115 1 106 ARG HA 1 107 ALA H . . 3.580 3.575 3.510 3.609 0.029 2 0 "[ . 1 . 2]" 1
1116 1 106 ARG HA 1 109 VAL H . . 3.610 3.295 2.806 3.636 0.026 14 0 "[ . 1 . 2]" 1
1117 1 106 ARG HA 1 109 VAL HB . . 3.390 2.433 2.044 2.821 . 0 0 "[ . 1 . 2]" 1
1118 1 106 ARG HA 1 109 VAL MG2 . . 4.330 3.217 2.464 3.578 . 0 0 "[ . 1 . 2]" 1
1119 1 106 ARG HB2 1 107 ALA H . . 4.820 2.907 2.605 3.313 . 0 0 "[ . 1 . 2]" 1
1120 1 106 ARG HB3 1 107 ALA H . . 4.630 3.829 3.523 4.263 . 0 0 "[ . 1 . 2]" 1
1121 1 107 ALA H 1 108 VAL H . . 2.930 2.684 2.448 2.821 . 0 0 "[ . 1 . 2]" 1
1122 1 107 ALA HA 1 110 ARG H . . 3.450 3.133 2.827 3.337 . 0 0 "[ . 1 . 2]" 1
1123 1 107 ALA HA 1 110 ARG HB2 . . 3.730 2.943 2.341 3.791 0.061 7 0 "[ . 1 . 2]" 1
1124 1 107 ALA HA 1 110 ARG QB . . 3.530 2.334 2.107 2.789 . 0 0 "[ . 1 . 2]" 1
1125 1 107 ALA HA 1 110 ARG HB3 . . 3.730 2.562 2.136 3.135 . 0 0 "[ . 1 . 2]" 1
1126 1 107 ALA MB 1 108 VAL H . . 4.390 2.602 2.380 2.849 . 0 0 "[ . 1 . 2]" 1
1127 1 107 ALA MB 1 108 VAL MG2 . . 7.560 3.242 3.033 3.551 . 0 0 "[ . 1 . 2]" 1
1128 1 108 VAL H 1 108 VAL HB . . 2.620 2.366 2.235 2.548 . 0 0 "[ . 1 . 2]" 1
1129 1 108 VAL H 1 108 VAL MG2 . . 3.890 2.289 2.202 2.475 . 0 0 "[ . 1 . 2]" 1
1130 1 108 VAL H 1 109 VAL H . . 2.960 2.751 2.561 2.926 . 0 0 "[ . 1 . 2]" 1
1131 1 108 VAL HA 1 108 VAL MG2 . . 3.740 2.329 2.184 2.477 . 0 0 "[ . 1 . 2]" 1
1132 1 108 VAL HA 1 109 VAL H . . 3.520 3.584 3.565 3.594 0.074 17 0 "[ . 1 . 2]" 1
1133 1 108 VAL HA 1 111 GLU H . . 3.580 3.357 2.934 3.662 0.082 20 0 "[ . 1 . 2]" 1
1134 1 108 VAL HB 1 109 VAL H . . 2.900 2.742 2.465 2.970 0.070 16 0 "[ . 1 . 2]" 1
1135 1 109 VAL H 1 109 VAL HB . . 2.800 2.378 2.226 2.595 . 0 0 "[ . 1 . 2]" 1
1136 1 109 VAL H 1 109 VAL MG1 . . 4.730 3.763 3.681 3.821 . 0 0 "[ . 1 . 2]" 1
1137 1 109 VAL H 1 109 VAL MG2 . . 3.860 2.292 2.109 2.593 . 0 0 "[ . 1 . 2]" 1
1138 1 109 VAL H 1 110 ARG H . . 3.210 2.730 2.651 2.818 . 0 0 "[ . 1 . 2]" 1
1139 1 109 VAL HA 1 112 MET H . . 3.860 3.359 3.009 3.662 . 0 0 "[ . 1 . 2]" 1
1140 1 109 VAL HA 1 112 MET QB . . 5.040 2.809 2.097 4.173 . 0 0 "[ . 1 . 2]" 1
1141 1 109 VAL HB 1 110 ARG H . . 3.020 2.988 2.757 3.099 0.079 17 0 "[ . 1 . 2]" 1
1142 1 109 VAL MG1 1 110 ARG H . . 5.810 3.584 3.275 3.880 . 0 0 "[ . 1 . 2]" 1
1143 1 109 VAL MG2 1 110 ARG H . . 6.340 4.142 4.067 4.243 . 0 0 "[ . 1 . 2]" 1
1144 1 110 ARG H 1 110 ARG HB2 . . 3.020 2.513 2.149 2.873 . 0 0 "[ . 1 . 2]" 1
1145 1 110 ARG H 1 110 ARG HB3 . . 3.020 2.593 2.237 3.070 0.050 10 0 "[ . 1 . 2]" 1
1146 1 110 ARG H 1 111 GLU H . . 2.800 2.703 2.530 2.866 0.066 20 0 "[ . 1 . 2]" 1
1147 1 110 ARG HA 1 111 GLU H . . 3.420 3.497 3.469 3.510 0.090 12 0 "[ . 1 . 2]" 1
1148 1 110 ARG HA 1 113 ILE H . . 4.540 4.255 3.429 4.624 0.084 7 0 "[ . 1 . 2]" 1
1149 1 110 ARG QG 1 111 GLU H . . 6.040 4.147 3.417 4.516 . 0 0 "[ . 1 . 2]" 1
1150 1 111 GLU H 1 111 GLU HB3 . . 2.830 2.568 2.203 2.909 0.079 14 0 "[ . 1 . 2]" 1
1151 1 111 GLU H 1 111 GLU HG2 . . 5.040 2.859 1.970 4.380 . 0 0 "[ . 1 . 2]" 1
1152 1 111 GLU H 1 111 GLU QG . . 4.820 2.576 1.953 3.395 . 0 0 "[ . 1 . 2]" 1
1153 1 111 GLU H 1 111 GLU HG3 . . 5.040 3.433 2.588 4.333 . 0 0 "[ . 1 . 2]" 1
1154 1 111 GLU HA 1 111 GLU HB3 . . 2.650 2.510 2.337 2.744 0.094 15 0 "[ . 1 . 2]" 1
1155 1 111 GLU HA 1 112 MET H . . 3.500 3.513 3.367 3.567 0.067 19 0 "[ . 1 . 2]" 1
1156 1 111 GLU HB3 1 112 MET H . . 3.860 3.835 3.115 3.955 0.095 3 0 "[ . 1 . 2]" 1
1157 1 112 MET H 1 112 MET QB . . 3.900 2.396 1.962 2.587 . 0 0 "[ . 1 . 2]" 1
1158 1 112 MET H 1 112 MET HG2 . . 4.690 3.488 2.085 4.421 . 0 0 "[ . 1 . 2]" 1
1159 1 112 MET H 1 112 MET QG . . 4.120 2.686 2.072 3.795 . 0 0 "[ . 1 . 2]" 1
1160 1 112 MET H 1 112 MET HG3 . . 4.690 3.069 2.321 4.159 . 0 0 "[ . 1 . 2]" 1
1161 1 112 MET HA 1 113 ILE H . . 3.330 2.942 2.395 3.396 0.066 20 0 "[ . 1 . 2]" 1
1162 1 112 MET QB 1 113 ILE HA . . 5.510 4.683 4.168 5.009 . 0 0 "[ . 1 . 2]" 1
1163 1 113 ILE H 1 113 ILE HB . . 3.550 3.086 2.216 3.628 0.078 8 0 "[ . 1 . 2]" 1
1164 1 113 ILE H 1 113 ILE HG12 . . 4.200 2.851 1.921 4.253 0.053 3 0 "[ . 1 . 2]" 1
1165 1 113 ILE H 1 113 ILE QG . . 3.790 2.401 1.772 3.182 . 0 0 "[ . 1 . 2]" 1
1166 1 113 ILE H 1 113 ILE HG13 . . 4.200 3.270 1.788 4.265 0.065 16 0 "[ . 1 . 2]" 1
1167 1 113 ILE HA 1 113 ILE HB . . 2.990 2.889 2.406 3.047 0.057 7 0 "[ . 1 . 2]" 1
1168 1 113 ILE HB 1 114 SER H . . 4.570 3.794 2.316 4.573 0.003 16 0 "[ . 1 . 2]" 1
1169 1 113 ILE QG 1 114 SER H . . 6.380 4.194 2.467 4.800 . 0 0 "[ . 1 . 2]" 1
1170 1 113 ILE MG 1 114 SER H . . 6.250 3.520 2.329 4.260 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Tuesday, May 14, 2024 11:31:00 AM GMT (wattos1)