NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
571826 |
2lw5   |
18606 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lw5
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 1109
_Distance_constraint_stats_list.Viol_count 1644
_Distance_constraint_stats_list.Viol_total 1196.244
_Distance_constraint_stats_list.Viol_max 0.326
_Distance_constraint_stats_list.Viol_rms 0.0164
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0027
_Distance_constraint_stats_list.Viol_average_violations_only 0.0364
_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 MET 0.032 0.018 4 0 "[ . 1 . 2]"
1 3 LYS 0.545 0.205 19 0 "[ . 1 . 2]"
1 4 PHE 4.597 0.326 14 0 "[ . 1 . 2]"
1 5 ILE 0.992 0.085 19 0 "[ . 1 . 2]"
1 6 LYS 1.889 0.077 15 0 "[ . 1 . 2]"
1 7 TYR 3.296 0.094 11 0 "[ . 1 . 2]"
1 8 LEU 1.249 0.086 19 0 "[ . 1 . 2]"
1 9 SER 0.941 0.090 11 0 "[ . 1 . 2]"
1 10 THR 1.555 0.134 4 0 "[ . 1 . 2]"
1 11 ALA 0.159 0.066 2 0 "[ . 1 . 2]"
1 12 HIS 1.248 0.268 7 0 "[ . 1 . 2]"
1 13 LEU 1.471 0.268 7 0 "[ . 1 . 2]"
1 14 ASN 0.021 0.021 17 0 "[ . 1 . 2]"
1 15 TYR 0.621 0.121 15 0 "[ . 1 . 2]"
1 16 MET 3.171 0.233 14 0 "[ . 1 . 2]"
1 17 ASN 0.771 0.150 19 0 "[ . 1 . 2]"
1 18 ILE 6.243 0.271 6 0 "[ . 1 . 2]"
1 19 ALA 2.055 0.150 19 0 "[ . 1 . 2]"
1 20 VAL 3.712 0.102 19 0 "[ . 1 . 2]"
1 21 TYR 2.817 0.205 19 0 "[ . 1 . 2]"
1 22 GLU 0.889 0.067 8 0 "[ . 1 . 2]"
1 23 ASN 0.193 0.066 7 0 "[ . 1 . 2]"
1 25 SER 0.113 0.040 17 0 "[ . 1 . 2]"
1 26 LYS 0.151 0.040 17 0 "[ . 1 . 2]"
1 27 ILE 1.381 0.047 20 0 "[ . 1 . 2]"
1 28 LYS 0.101 0.020 12 0 "[ . 1 . 2]"
1 29 ALA 1.593 0.086 7 0 "[ . 1 . 2]"
1 30 ARG 1.016 0.076 19 0 "[ . 1 . 2]"
1 31 VAL 2.757 0.138 10 0 "[ . 1 . 2]"
1 32 GLU 0.800 0.052 9 0 "[ . 1 . 2]"
1 33 ASN 1.588 0.083 12 0 "[ . 1 . 2]"
1 34 VAL 1.245 0.181 15 0 "[ . 1 . 2]"
1 35 VAL 4.336 0.272 1 0 "[ . 1 . 2]"
1 36 ASN 3.346 0.247 6 0 "[ . 1 . 2]"
1 37 GLY 0.225 0.112 15 0 "[ . 1 . 2]"
1 38 LYS 0.735 0.122 15 0 "[ . 1 . 2]"
1 39 SER 0.565 0.103 12 0 "[ . 1 . 2]"
1 40 VAL 2.353 0.122 15 0 "[ . 1 . 2]"
1 41 GLY 1.109 0.061 9 0 "[ . 1 . 2]"
1 42 ALA 1.150 0.138 10 0 "[ . 1 . 2]"
1 43 ARG 0.472 0.108 18 0 "[ . 1 . 2]"
1 44 ASP 0.310 0.070 18 0 "[ . 1 . 2]"
1 45 PHE 0.415 0.023 7 0 "[ . 1 . 2]"
1 46 ASP 0.037 0.015 12 0 "[ . 1 . 2]"
1 47 SER 0.057 0.019 1 0 "[ . 1 . 2]"
1 48 THR 1.288 0.047 20 0 "[ . 1 . 2]"
1 49 GLU 0.005 0.003 6 0 "[ . 1 . 2]"
1 50 GLN 0.072 0.014 14 0 "[ . 1 . 2]"
1 51 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLU 1.035 0.063 12 0 "[ . 1 . 2]"
1 53 SER 0.012 0.012 12 0 "[ . 1 . 2]"
1 54 TRP 1.329 0.055 18 0 "[ . 1 . 2]"
1 55 PHE 1.467 0.093 4 0 "[ . 1 . 2]"
1 56 TYR 2.124 0.205 13 0 "[ . 1 . 2]"
1 57 GLY 2.512 0.205 13 0 "[ . 1 . 2]"
1 58 LEU 1.602 0.095 18 0 "[ . 1 . 2]"
1 59 PRO 0.003 0.003 2 0 "[ . 1 . 2]"
1 60 GLY 0.022 0.022 15 0 "[ . 1 . 2]"
1 61 SER 0.134 0.046 15 0 "[ . 1 . 2]"
1 63 LEU 4.058 0.233 14 0 "[ . 1 . 2]"
1 64 GLY 0.122 0.058 17 0 "[ . 1 . 2]"
1 65 ARG 5.604 0.243 3 0 "[ . 1 . 2]"
1 66 ILE 8.773 0.305 14 0 "[ . 1 . 2]"
1 67 GLU 0.249 0.063 15 0 "[ . 1 . 2]"
1 68 ASN 0.892 0.055 18 0 "[ . 1 . 2]"
1 69 ALA 1.803 0.123 18 0 "[ . 1 . 2]"
1 70 MET 2.439 0.097 9 0 "[ . 1 . 2]"
1 71 ASN 0.150 0.039 14 0 "[ . 1 . 2]"
1 72 GLU 0.921 0.179 18 0 "[ . 1 . 2]"
1 73 ILE 1.465 0.179 18 0 "[ . 1 . 2]"
1 74 SER 1.568 0.109 8 0 "[ . 1 . 2]"
1 75 ARG 1.029 0.173 18 0 "[ . 1 . 2]"
1 76 ARG 0.917 0.173 18 0 "[ . 1 . 2]"
1 77 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 MET HA 1 2 MET QG . . 3.670 2.635 2.089 3.417 . 0 0 "[ . 1 . 2]" 1
2 1 2 MET QB 1 3 LYS H . . 3.170 2.616 1.993 3.188 0.018 4 0 "[ . 1 . 2]" 1
3 1 3 LYS H 1 3 LYS QD . . 4.820 3.152 1.903 4.335 . 0 0 "[ . 1 . 2]" 1
4 1 3 LYS H 1 3 LYS HG2 . . 4.800 3.104 1.949 4.649 . 0 0 "[ . 1 . 2]" 1
5 1 3 LYS H 1 3 LYS QG . . 4.230 2.630 1.918 4.076 . 0 0 "[ . 1 . 2]" 1
6 1 3 LYS H 1 3 LYS HG3 . . 4.800 3.318 2.167 4.508 . 0 0 "[ . 1 . 2]" 1
7 1 3 LYS HA 1 4 PHE H . . 3.370 2.258 2.188 2.308 . 0 0 "[ . 1 . 2]" 1
8 1 3 LYS QB 1 4 PHE HA . . 4.550 4.337 4.189 4.661 0.111 19 0 "[ . 1 . 2]" 1
9 1 3 LYS QE 1 3 LYS HG2 . . 2.820 2.418 1.971 2.767 . 0 0 "[ . 1 . 2]" 1
10 1 3 LYS QE 1 3 LYS QG . . 2.430 2.131 1.939 2.331 . 0 0 "[ . 1 . 2]" 1
11 1 3 LYS QE 1 3 LYS HG3 . . 2.820 2.513 2.115 2.871 0.051 19 0 "[ . 1 . 2]" 1
12 1 3 LYS QG 1 21 TYR QB . . 3.750 3.394 1.966 3.955 0.205 19 0 "[ . 1 . 2]" 1
13 1 4 PHE H 1 4 PHE HB2 . . 4.010 3.524 2.367 3.959 . 0 0 "[ . 1 . 2]" 1
14 1 4 PHE H 1 4 PHE HB3 . . 4.010 3.219 2.803 3.839 . 0 0 "[ . 1 . 2]" 1
15 1 4 PHE H 1 4 PHE QD . . 4.550 3.385 1.922 4.466 . 0 0 "[ . 1 . 2]" 1
16 1 4 PHE H 1 5 ILE H . . 4.760 4.141 3.533 4.390 . 0 0 "[ . 1 . 2]" 1
17 1 4 PHE H 1 21 TYR QB . . 4.530 4.580 4.524 4.688 0.158 7 0 "[ . 1 . 2]" 1
18 1 4 PHE HA 1 4 PHE QD . . 3.370 3.156 2.099 3.696 0.326 14 0 "[ . 1 . 2]" 1
19 1 4 PHE HA 1 5 ILE H . . 3.250 2.193 2.139 2.339 . 0 0 "[ . 1 . 2]" 1
20 1 4 PHE HA 1 22 GLU H . . 4.890 4.258 3.066 4.890 0.000 1 0 "[ . 1 . 2]" 1
21 1 4 PHE HB2 1 5 ILE H . . 4.930 3.686 2.597 4.561 . 0 0 "[ . 1 . 2]" 1
22 1 4 PHE HB3 1 5 ILE H . . 4.930 4.143 3.676 4.381 . 0 0 "[ . 1 . 2]" 1
23 1 4 PHE QD 1 5 ILE H . . 4.600 3.765 2.583 4.625 0.025 4 0 "[ . 1 . 2]" 1
24 1 5 ILE H 1 5 ILE HB . . 3.810 2.831 2.578 2.902 . 0 0 "[ . 1 . 2]" 1
25 1 5 ILE H 1 5 ILE MD . . 4.040 3.705 3.191 3.837 . 0 0 "[ . 1 . 2]" 1
26 1 5 ILE H 1 5 ILE QG . . 3.800 2.682 1.920 2.826 . 0 0 "[ . 1 . 2]" 1
27 1 5 ILE H 1 6 LYS H . . 4.560 4.452 4.415 4.629 0.069 8 0 "[ . 1 . 2]" 1
28 1 5 ILE H 1 20 VAL HB . . 5.470 4.724 4.207 5.193 . 0 0 "[ . 1 . 2]" 1
29 1 5 ILE H 1 21 TYR HA . . 3.870 3.158 2.280 3.557 . 0 0 "[ . 1 . 2]" 1
30 1 5 ILE H 1 21 TYR QB . . 5.080 4.582 3.597 5.074 . 0 0 "[ . 1 . 2]" 1
31 1 5 ILE H 1 21 TYR QD . . 4.540 3.291 2.941 3.905 . 0 0 "[ . 1 . 2]" 1
32 1 5 ILE H 1 22 GLU H . . 4.820 4.529 3.718 4.828 0.008 4 0 "[ . 1 . 2]" 1
33 1 5 ILE HA 1 5 ILE MD . . 3.020 2.117 2.037 2.204 . 0 0 "[ . 1 . 2]" 1
34 1 5 ILE HA 1 5 ILE HG12 . . 3.980 3.104 2.913 3.159 . 0 0 "[ . 1 . 2]" 1
35 1 5 ILE HA 1 5 ILE QG . . 3.300 2.972 2.825 3.011 . 0 0 "[ . 1 . 2]" 1
36 1 5 ILE HA 1 5 ILE HG13 . . 3.980 3.801 3.792 3.809 . 0 0 "[ . 1 . 2]" 1
37 1 5 ILE HA 1 6 LYS HB3 . . 4.670 4.369 4.319 4.431 . 0 0 "[ . 1 . 2]" 1
38 1 5 ILE HB 1 5 ILE MD . . 3.280 3.215 3.207 3.218 . 0 0 "[ . 1 . 2]" 1
39 1 5 ILE HB 1 6 LYS H . . 3.760 3.616 3.560 3.676 . 0 0 "[ . 1 . 2]" 1
40 1 5 ILE HB 1 20 VAL H . . 3.410 2.875 2.656 3.046 . 0 0 "[ . 1 . 2]" 1
41 1 5 ILE HB 1 20 VAL HB . . 3.880 2.163 1.969 2.798 . 0 0 "[ . 1 . 2]" 1
42 1 5 ILE HB 1 20 VAL QG . . 2.960 2.676 1.951 3.004 0.044 13 0 "[ . 1 . 2]" 1
43 1 5 ILE HB 1 21 TYR QB . . 5.500 5.172 5.085 5.287 . 0 0 "[ . 1 . 2]" 1
44 1 5 ILE MD 1 6 LYS H . . 3.540 3.551 3.512 3.577 0.037 19 0 "[ . 1 . 2]" 1
45 1 5 ILE MD 1 6 LYS QE . . 5.060 5.047 4.945 5.088 0.028 13 0 "[ . 1 . 2]" 1
46 1 5 ILE MD 1 20 VAL HB . . 4.240 4.051 3.823 4.325 0.085 19 0 "[ . 1 . 2]" 1
47 1 5 ILE MD 1 21 TYR HA . . 4.810 3.574 3.488 3.814 . 0 0 "[ . 1 . 2]" 1
48 1 5 ILE MD 1 22 GLU H . . 4.190 2.823 2.702 3.012 . 0 0 "[ . 1 . 2]" 1
49 1 5 ILE MD 1 22 GLU QB . . 4.500 2.125 1.899 2.533 . 0 0 "[ . 1 . 2]" 1
50 1 5 ILE QG 1 6 LYS H . . 4.910 4.439 4.381 4.483 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE QG 1 21 TYR HA . . 3.680 1.974 1.929 2.178 . 0 0 "[ . 1 . 2]" 1
52 1 5 ILE QG 1 21 TYR QD . . 5.110 4.028 3.792 4.424 . 0 0 "[ . 1 . 2]" 1
53 1 5 ILE QG 1 22 GLU H . . 3.670 2.344 2.213 2.488 . 0 0 "[ . 1 . 2]" 1
54 1 5 ILE QG 1 22 GLU QG . . 4.870 4.226 2.631 4.789 . 0 0 "[ . 1 . 2]" 1
55 1 5 ILE HG12 1 22 GLU H . . 4.240 2.417 2.252 2.574 . 0 0 "[ . 1 . 2]" 1
56 1 5 ILE HG13 1 22 GLU H . . 4.240 3.179 2.975 3.515 . 0 0 "[ . 1 . 2]" 1
57 1 6 LYS H 1 6 LYS HB3 . . 3.880 2.398 2.325 2.469 . 0 0 "[ . 1 . 2]" 1
58 1 6 LYS H 1 6 LYS QD . . 4.570 2.907 1.871 3.850 . 0 0 "[ . 1 . 2]" 1
59 1 6 LYS H 1 6 LYS QG . . 4.570 2.778 2.246 3.375 . 0 0 "[ . 1 . 2]" 1
60 1 6 LYS H 1 20 VAL H . . 5.100 5.143 5.031 5.177 0.077 15 0 "[ . 1 . 2]" 1
61 1 6 LYS HA 1 6 LYS QG . . 3.690 3.371 3.301 3.431 . 0 0 "[ . 1 . 2]" 1
62 1 6 LYS HA 1 7 TYR H . . 3.350 2.503 2.441 2.628 . 0 0 "[ . 1 . 2]" 1
63 1 6 LYS HA 1 7 TYR HB2 . . 5.300 4.931 4.745 5.144 . 0 0 "[ . 1 . 2]" 1
64 1 6 LYS HB2 1 6 LYS QE . . 4.270 4.170 4.082 4.317 0.047 3 0 "[ . 1 . 2]" 1
65 1 6 LYS HB2 1 7 TYR H . . 4.190 2.374 2.124 2.526 . 0 0 "[ . 1 . 2]" 1
66 1 6 LYS HB3 1 6 LYS QE . . 4.010 3.662 3.498 4.013 0.003 3 0 "[ . 1 . 2]" 1
67 1 6 LYS HB3 1 7 TYR H . . 3.870 3.805 3.634 3.907 0.037 9 0 "[ . 1 . 2]" 1
68 1 6 LYS QD 1 6 LYS QG . . 2.400 2.068 2.042 2.083 . 0 0 "[ . 1 . 2]" 1
69 1 6 LYS QD 1 8 LEU HA . . 5.430 5.182 4.554 5.462 0.032 17 0 "[ . 1 . 2]" 1
70 1 6 LYS QE 1 6 LYS HG2 . . 3.090 2.353 1.970 2.773 . 0 0 "[ . 1 . 2]" 1
71 1 6 LYS QE 1 6 LYS QG . . 2.610 2.089 1.940 2.139 . 0 0 "[ . 1 . 2]" 1
72 1 6 LYS QE 1 6 LYS HG3 . . 3.090 2.523 2.139 2.920 . 0 0 "[ . 1 . 2]" 1
73 1 6 LYS QE 1 8 LEU HA . . 5.080 4.798 4.145 5.107 0.027 17 0 "[ . 1 . 2]" 1
74 1 6 LYS QG 1 8 LEU HA . . 4.780 4.085 4.009 4.190 . 0 0 "[ . 1 . 2]" 1
75 1 6 LYS HG2 1 7 TYR H . . 4.340 3.553 2.667 4.161 . 0 0 "[ . 1 . 2]" 1
76 1 6 LYS HG2 1 8 LEU HA . . 5.500 4.833 4.126 5.506 0.006 16 0 "[ . 1 . 2]" 1
77 1 6 LYS HG3 1 7 TYR H . . 4.340 3.484 2.804 4.185 . 0 0 "[ . 1 . 2]" 1
78 1 6 LYS HG3 1 8 LEU HA . . 5.500 4.807 4.214 5.480 . 0 0 "[ . 1 . 2]" 1
79 1 7 TYR H 1 7 TYR HB3 . . 3.740 3.600 3.577 3.613 . 0 0 "[ . 1 . 2]" 1
80 1 7 TYR H 1 7 TYR QD . . 4.370 2.940 2.594 3.227 . 0 0 "[ . 1 . 2]" 1
81 1 7 TYR H 1 8 LEU H . . 5.230 4.614 4.597 4.621 . 0 0 "[ . 1 . 2]" 1
82 1 7 TYR H 1 19 ALA MB . . 5.500 5.518 5.414 5.555 0.055 17 0 "[ . 1 . 2]" 1
83 1 7 TYR H 1 20 VAL QG . . 5.070 5.117 4.953 5.164 0.094 11 0 "[ . 1 . 2]" 1
84 1 7 TYR HA 1 7 TYR QD . . 3.450 2.381 1.969 2.689 . 0 0 "[ . 1 . 2]" 1
85 1 7 TYR HA 1 8 LEU H . . 3.400 2.319 2.229 2.425 . 0 0 "[ . 1 . 2]" 1
86 1 7 TYR HA 1 8 LEU HA . . 4.620 4.392 4.363 4.423 . 0 0 "[ . 1 . 2]" 1
87 1 7 TYR HA 1 8 LEU MD1 . . 4.980 4.846 4.706 4.957 . 0 0 "[ . 1 . 2]" 1
88 1 7 TYR HA 1 9 SER H . . 5.120 4.870 4.429 5.067 . 0 0 "[ . 1 . 2]" 1
89 1 7 TYR HA 1 18 ILE HB . . 4.890 4.432 4.207 4.627 . 0 0 "[ . 1 . 2]" 1
90 1 7 TYR HA 1 18 ILE MG . . 4.400 4.441 4.342 4.475 0.075 11 0 "[ . 1 . 2]" 1
91 1 7 TYR HA 1 19 ALA HA . . 3.650 2.803 2.586 2.956 . 0 0 "[ . 1 . 2]" 1
92 1 7 TYR HA 1 19 ALA MB . . 4.150 4.104 3.975 4.195 0.045 19 0 "[ . 1 . 2]" 1
93 1 7 TYR HA 1 20 VAL H . . 4.040 3.836 3.586 4.088 0.048 19 0 "[ . 1 . 2]" 1
94 1 7 TYR HA 1 20 VAL QG . . 3.950 3.577 3.447 3.761 . 0 0 "[ . 1 . 2]" 1
95 1 7 TYR HB2 1 8 LEU H . . 4.280 3.784 3.571 3.958 . 0 0 "[ . 1 . 2]" 1
96 1 7 TYR HB2 1 8 LEU HA . . 5.500 4.835 4.709 4.988 . 0 0 "[ . 1 . 2]" 1
97 1 7 TYR HB2 1 9 SER H . . 3.990 3.870 3.336 4.017 0.027 10 0 "[ . 1 . 2]" 1
98 1 7 TYR HB3 1 8 LEU H . . 4.790 2.649 2.377 2.912 . 0 0 "[ . 1 . 2]" 1
99 1 7 TYR HB3 1 9 SER H . . 3.850 3.757 3.311 3.882 0.032 15 0 "[ . 1 . 2]" 1
100 1 7 TYR HB3 1 9 SER QB . . 4.250 3.777 3.482 4.176 . 0 0 "[ . 1 . 2]" 1
101 1 7 TYR QD 1 8 LEU H . . 4.210 3.696 3.380 4.132 . 0 0 "[ . 1 . 2]" 1
102 1 7 TYR QD 1 17 ASN QB . . 3.590 2.755 2.485 3.376 . 0 0 "[ . 1 . 2]" 1
103 1 7 TYR QD 1 19 ALA HA . . 3.800 2.619 2.024 2.838 . 0 0 "[ . 1 . 2]" 1
104 1 7 TYR QD 1 19 ALA MB . . 4.250 2.836 2.593 3.133 . 0 0 "[ . 1 . 2]" 1
105 1 7 TYR QD 1 20 VAL H . . 4.760 4.560 3.728 4.762 0.002 16 0 "[ . 1 . 2]" 1
106 1 7 TYR QE 1 17 ASN QB . . 4.010 3.651 2.970 4.066 0.056 12 0 "[ . 1 . 2]" 1
107 1 7 TYR QE 1 19 ALA HA . . 4.800 3.704 3.257 4.035 . 0 0 "[ . 1 . 2]" 1
108 1 7 TYR QE 1 19 ALA MB . . 3.730 2.216 1.965 2.992 . 0 0 "[ . 1 . 2]" 1
109 1 7 TYR QE 1 34 VAL QG . . 4.480 3.777 2.979 4.524 0.044 19 0 "[ . 1 . 2]" 1
110 1 8 LEU H 1 8 LEU HB2 . . 3.600 2.791 2.680 2.889 . 0 0 "[ . 1 . 2]" 1
111 1 8 LEU H 1 8 LEU MD1 . . 4.280 3.858 3.650 4.009 . 0 0 "[ . 1 . 2]" 1
112 1 8 LEU H 1 8 LEU HG . . 3.670 2.406 2.200 2.626 . 0 0 "[ . 1 . 2]" 1
113 1 8 LEU H 1 9 SER H . . 3.660 3.493 3.203 3.668 0.008 15 0 "[ . 1 . 2]" 1
114 1 8 LEU H 1 17 ASN HA . . 4.730 4.127 3.711 4.484 . 0 0 "[ . 1 . 2]" 1
115 1 8 LEU H 1 18 ILE H . . 3.930 2.262 1.894 2.549 . 0 0 "[ . 1 . 2]" 1
116 1 8 LEU H 1 18 ILE HB . . 4.530 2.583 2.397 2.718 . 0 0 "[ . 1 . 2]" 1
117 1 8 LEU H 1 18 ILE HG13 . . 4.820 4.517 4.278 4.716 . 0 0 "[ . 1 . 2]" 1
118 1 8 LEU H 1 18 ILE MG . . 3.960 3.595 3.349 3.827 . 0 0 "[ . 1 . 2]" 1
119 1 8 LEU H 1 19 ALA HA . . 5.230 4.281 4.001 4.553 . 0 0 "[ . 1 . 2]" 1
120 1 8 LEU H 1 20 VAL H . . 5.500 5.161 4.688 5.494 . 0 0 "[ . 1 . 2]" 1
121 1 8 LEU H 1 20 VAL QG . . 4.170 3.837 3.573 4.071 . 0 0 "[ . 1 . 2]" 1
122 1 8 LEU HA 1 8 LEU MD1 . . 4.060 3.926 3.883 3.984 . 0 0 "[ . 1 . 2]" 1
123 1 8 LEU HA 1 9 SER H . . 3.170 2.462 2.413 2.643 . 0 0 "[ . 1 . 2]" 1
124 1 8 LEU HA 1 18 ILE HB . . 4.430 4.433 4.282 4.509 0.079 4 0 "[ . 1 . 2]" 1
125 1 8 LEU HA 1 20 VAL QG . . 5.500 4.568 4.325 4.719 . 0 0 "[ . 1 . 2]" 1
126 1 8 LEU HB2 1 8 LEU MD1 . . 3.470 2.317 2.171 2.414 . 0 0 "[ . 1 . 2]" 1
127 1 8 LEU HB2 1 18 ILE HB . . 2.770 2.033 1.977 2.319 . 0 0 "[ . 1 . 2]" 1
128 1 8 LEU HB2 1 20 VAL QG . . 4.850 3.962 3.858 4.072 . 0 0 "[ . 1 . 2]" 1
129 1 8 LEU HB3 1 8 LEU MD1 . . 3.330 2.320 2.217 2.444 . 0 0 "[ . 1 . 2]" 1
130 1 8 LEU HB3 1 9 SER H . . 4.380 4.321 4.266 4.466 0.086 19 0 "[ . 1 . 2]" 1
131 1 8 LEU HB3 1 18 ILE HB . . 4.740 3.760 3.687 4.033 . 0 0 "[ . 1 . 2]" 1
132 1 8 LEU HB3 1 18 ILE MD . . 5.340 3.796 3.551 4.104 . 0 0 "[ . 1 . 2]" 1
133 1 8 LEU HB3 1 18 ILE MG . . 4.980 4.198 3.969 4.410 . 0 0 "[ . 1 . 2]" 1
134 1 8 LEU HB3 1 20 VAL QG . . 4.700 4.139 4.036 4.208 . 0 0 "[ . 1 . 2]" 1
135 1 8 LEU MD1 1 18 ILE HB . . 3.640 2.995 2.658 3.299 . 0 0 "[ . 1 . 2]" 1
136 1 8 LEU MD1 1 18 ILE MG . . 3.340 1.973 1.832 2.101 . 0 0 "[ . 1 . 2]" 1
137 1 8 LEU MD1 1 20 VAL QG . . 3.030 1.807 1.746 1.853 . 0 0 "[ . 1 . 2]" 1
138 1 8 LEU MD1 1 29 ALA MB . . 4.820 4.410 4.188 4.613 . 0 0 "[ . 1 . 2]" 1
139 1 8 LEU MD1 1 31 VAL MG1 . . 4.000 3.998 3.879 4.038 0.038 2 0 "[ . 1 . 2]" 1
140 1 8 LEU MD1 1 31 VAL MG2 . . 3.120 2.936 2.669 3.130 0.010 6 0 "[ . 1 . 2]" 1
141 1 8 LEU MD1 1 51 LEU QD . . 5.440 4.076 3.415 4.742 . 0 0 "[ . 1 . 2]" 1
142 1 8 LEU MD1 1 52 GLU HA . . 5.500 5.466 5.153 5.531 0.031 11 0 "[ . 1 . 2]" 1
143 1 8 LEU MD1 1 55 PHE HB2 . . 3.610 3.076 2.761 3.402 . 0 0 "[ . 1 . 2]" 1
144 1 8 LEU MD1 1 55 PHE HB3 . . 4.170 3.925 3.718 4.123 . 0 0 "[ . 1 . 2]" 1
145 1 8 LEU MD1 1 55 PHE QD . . 3.990 3.112 2.601 3.561 . 0 0 "[ . 1 . 2]" 1
146 1 8 LEU MD1 1 55 PHE QE . . 4.380 3.709 3.223 4.215 . 0 0 "[ . 1 . 2]" 1
147 1 8 LEU MD1 1 69 ALA MB . . 4.280 3.902 3.571 4.285 0.005 6 0 "[ . 1 . 2]" 1
148 1 8 LEU HG 1 9 SER H . . 5.240 5.180 5.019 5.263 0.023 11 0 "[ . 1 . 2]" 1
149 1 8 LEU HG 1 18 ILE H . . 4.450 4.177 3.838 4.456 0.006 19 0 "[ . 1 . 2]" 1
150 1 8 LEU HG 1 18 ILE HB . . 3.410 2.780 2.523 3.126 . 0 0 "[ . 1 . 2]" 1
151 1 8 LEU HG 1 18 ILE MG . . 4.400 2.528 2.362 2.779 . 0 0 "[ . 1 . 2]" 1
152 1 8 LEU HG 1 20 VAL QG . . 2.400 2.201 1.967 2.331 . 0 0 "[ . 1 . 2]" 1
153 1 9 SER H 1 9 SER QB . . 3.560 3.018 2.949 3.139 . 0 0 "[ . 1 . 2]" 1
154 1 9 SER H 1 10 THR H . . 4.440 4.377 4.316 4.424 . 0 0 "[ . 1 . 2]" 1
155 1 9 SER H 1 18 ILE H . . 4.890 4.433 3.872 4.803 . 0 0 "[ . 1 . 2]" 1
156 1 9 SER QB 1 10 THR H . . 3.700 2.555 1.987 3.020 . 0 0 "[ . 1 . 2]" 1
157 1 9 SER QB 1 17 ASN HA . . 5.340 2.229 1.898 2.869 . 0 0 "[ . 1 . 2]" 1
158 1 9 SER QB 1 66 ILE MD . . 3.500 2.122 1.901 2.543 . 0 0 "[ . 1 . 2]" 1
159 1 9 SER QB 1 66 ILE QG . . 3.360 3.232 2.727 3.403 0.043 4 0 "[ . 1 . 2]" 1
160 1 9 SER QB 1 66 ILE MG . . 5.340 4.227 3.321 4.593 . 0 0 "[ . 1 . 2]" 1
161 1 9 SER HB2 1 66 ILE MD . . 4.010 2.415 1.932 3.211 . 0 0 "[ . 1 . 2]" 1
162 1 9 SER HB2 1 66 ILE QG . . 3.890 3.523 2.803 3.890 . 0 0 "[ . 1 . 2]" 1
163 1 9 SER HB3 1 66 ILE MD . . 4.010 2.556 2.132 3.234 . 0 0 "[ . 1 . 2]" 1
164 1 9 SER HB3 1 66 ILE QG . . 3.890 3.821 3.423 3.980 0.090 11 0 "[ . 1 . 2]" 1
165 1 10 THR H 1 11 ALA MB . . 5.500 4.512 4.046 5.445 . 0 0 "[ . 1 . 2]" 1
166 1 10 THR H 1 63 LEU HA . . 3.830 3.869 3.689 3.964 0.134 4 0 "[ . 1 . 2]" 1
167 1 10 THR H 1 66 ILE QG . . 4.800 4.508 4.043 4.865 0.065 13 0 "[ . 1 . 2]" 1
168 1 10 THR HA 1 10 THR HB . . 2.970 2.886 2.357 3.025 0.055 17 0 "[ . 1 . 2]" 1
169 1 10 THR HA 1 10 THR MG . . 3.240 2.298 2.036 3.186 . 0 0 "[ . 1 . 2]" 1
170 1 10 THR HB 1 11 ALA H . . 4.280 2.679 1.936 4.006 . 0 0 "[ . 1 . 2]" 1
171 1 10 THR HB 1 11 ALA MB . . 5.500 3.953 3.369 5.254 . 0 0 "[ . 1 . 2]" 1
172 1 11 ALA H 1 11 ALA MB . . 3.470 2.371 2.028 2.876 . 0 0 "[ . 1 . 2]" 1
173 1 11 ALA HA 1 12 HIS H . . 3.120 2.642 2.142 3.182 0.062 7 0 "[ . 1 . 2]" 1
174 1 11 ALA MB 1 12 HIS H . . 3.810 2.751 1.929 3.718 . 0 0 "[ . 1 . 2]" 1
175 1 11 ALA MB 1 63 LEU MD1 . . 4.850 2.883 1.742 4.916 0.066 2 0 "[ . 1 . 2]" 1
176 1 11 ALA MB 1 63 LEU MD2 . . 5.500 4.026 2.554 5.512 0.012 19 0 "[ . 1 . 2]" 1
177 1 12 HIS H 1 12 HIS QB . . 3.260 2.642 2.195 3.356 0.096 7 0 "[ . 1 . 2]" 1
178 1 12 HIS H 1 12 HIS HD2 . . 4.620 3.558 2.234 4.645 0.025 7 0 "[ . 1 . 2]" 1
179 1 12 HIS H 1 13 LEU H . . 4.940 3.493 1.877 4.521 . 0 0 "[ . 1 . 2]" 1
180 1 12 HIS HA 1 63 LEU MD2 . . 5.500 3.865 1.939 5.490 . 0 0 "[ . 1 . 2]" 1
181 1 12 HIS QB 1 13 LEU H . . 3.470 3.377 2.792 3.738 0.268 7 0 "[ . 1 . 2]" 1
182 1 12 HIS QB 1 63 LEU MD1 . . 4.340 3.768 1.915 4.478 0.138 15 0 "[ . 1 . 2]" 1
183 1 13 LEU H 1 13 LEU HB2 . . 3.960 3.054 2.413 3.374 . 0 0 "[ . 1 . 2]" 1
184 1 13 LEU H 1 13 LEU QB . . 3.430 2.596 2.227 2.688 . 0 0 "[ . 1 . 2]" 1
185 1 13 LEU H 1 13 LEU HB3 . . 3.960 2.854 2.534 3.234 . 0 0 "[ . 1 . 2]" 1
186 1 13 LEU H 1 16 MET H . . 3.900 3.141 2.522 4.049 0.149 7 0 "[ . 1 . 2]" 1
187 1 13 LEU H 1 16 MET HB2 . . 4.670 3.318 2.440 4.599 . 0 0 "[ . 1 . 2]" 1
188 1 13 LEU H 1 16 MET QB . . 3.980 3.190 2.424 4.064 0.084 13 0 "[ . 1 . 2]" 1
189 1 13 LEU H 1 16 MET HB3 . . 4.670 4.382 3.748 4.708 0.038 2 0 "[ . 1 . 2]" 1
190 1 13 LEU H 1 63 LEU MD1 . . 4.420 2.627 1.882 3.448 . 0 0 "[ . 1 . 2]" 1
191 1 13 LEU HA 1 13 LEU MD1 . . 4.120 2.390 1.931 3.469 . 0 0 "[ . 1 . 2]" 1
192 1 13 LEU HA 1 13 LEU QD . . 3.460 2.334 1.925 3.148 . 0 0 "[ . 1 . 2]" 1
193 1 13 LEU HA 1 13 LEU MD2 . . 4.120 3.819 3.448 3.964 . 0 0 "[ . 1 . 2]" 1
194 1 13 LEU HA 1 13 LEU HG . . 4.200 2.857 2.387 3.276 . 0 0 "[ . 1 . 2]" 1
195 1 13 LEU HA 1 16 MET H . . 5.420 4.884 4.468 5.528 0.108 16 0 "[ . 1 . 2]" 1
196 1 13 LEU HA 1 63 LEU MD2 . . 4.240 4.021 3.636 4.364 0.124 15 0 "[ . 1 . 2]" 1
197 1 13 LEU QB 1 16 MET QB . . 4.760 3.402 1.890 4.458 . 0 0 "[ . 1 . 2]" 1
198 1 13 LEU QB 1 63 LEU MD2 . . 3.500 2.114 1.800 3.209 . 0 0 "[ . 1 . 2]" 1
199 1 13 LEU QD 1 14 ASN HA . . 5.440 4.425 3.522 5.066 . 0 0 "[ . 1 . 2]" 1
200 1 13 LEU QD 1 14 ASN QB . . 4.020 3.373 2.042 3.918 . 0 0 "[ . 1 . 2]" 1
201 1 13 LEU QD 1 63 LEU QB . . 5.160 3.559 2.086 4.628 . 0 0 "[ . 1 . 2]" 1
202 1 13 LEU HG 1 14 ASN HB2 . . 4.800 3.297 2.728 4.374 . 0 0 "[ . 1 . 2]" 1
203 1 13 LEU HG 1 14 ASN QB . . 4.040 3.164 2.652 3.868 . 0 0 "[ . 1 . 2]" 1
204 1 13 LEU HG 1 14 ASN HB3 . . 4.800 4.445 3.220 4.821 0.021 17 0 "[ . 1 . 2]" 1
205 1 14 ASN QB 1 15 TYR H . . 4.370 3.584 2.561 3.879 . 0 0 "[ . 1 . 2]" 1
206 1 15 TYR H 1 15 TYR QD . . 4.700 3.378 2.760 4.415 . 0 0 "[ . 1 . 2]" 1
207 1 15 TYR H 1 16 MET H . . 3.960 2.914 2.643 3.406 . 0 0 "[ . 1 . 2]" 1
208 1 15 TYR H 1 35 VAL QG . . 4.340 4.280 3.687 4.461 0.121 15 0 "[ . 1 . 2]" 1
209 1 15 TYR QB 1 16 MET H . . 4.390 3.885 3.803 3.997 . 0 0 "[ . 1 . 2]" 1
210 1 15 TYR QB 1 34 VAL QG . . 3.540 2.779 2.076 3.466 . 0 0 "[ . 1 . 2]" 1
211 1 15 TYR QB 1 35 VAL QG . . 3.930 2.563 1.877 3.638 . 0 0 "[ . 1 . 2]" 1
212 1 15 TYR HB2 1 34 VAL QG . . 4.300 3.650 2.106 4.304 0.004 14 0 "[ . 1 . 2]" 1
213 1 15 TYR HB3 1 34 VAL QG . . 4.300 2.977 2.161 4.002 . 0 0 "[ . 1 . 2]" 1
214 1 15 TYR QD 1 34 VAL QG . . 5.000 3.829 1.896 4.955 . 0 0 "[ . 1 . 2]" 1
215 1 15 TYR QD 1 35 VAL QG . . 4.980 3.645 1.930 4.786 . 0 0 "[ . 1 . 2]" 1
216 1 16 MET H 1 16 MET HB2 . . 3.620 2.308 2.072 2.724 . 0 0 "[ . 1 . 2]" 1
217 1 16 MET H 1 16 MET HB3 . . 3.620 3.310 2.990 3.809 0.189 16 0 "[ . 1 . 2]" 1
218 1 16 MET H 1 16 MET HG2 . . 4.730 4.252 2.784 4.910 0.180 13 0 "[ . 1 . 2]" 1
219 1 16 MET H 1 16 MET QG . . 4.090 3.674 2.683 4.213 0.123 13 0 "[ . 1 . 2]" 1
220 1 16 MET H 1 16 MET HG3 . . 4.730 4.150 3.510 4.592 . 0 0 "[ . 1 . 2]" 1
221 1 16 MET H 1 34 VAL QG . . 5.500 4.336 3.514 5.115 . 0 0 "[ . 1 . 2]" 1
222 1 16 MET HA 1 16 MET HG2 . . 3.840 2.984 2.255 3.614 . 0 0 "[ . 1 . 2]" 1
223 1 16 MET HA 1 16 MET QG . . 3.330 2.302 2.048 2.822 . 0 0 "[ . 1 . 2]" 1
224 1 16 MET HA 1 16 MET HG3 . . 3.840 2.706 2.065 3.690 . 0 0 "[ . 1 . 2]" 1
225 1 16 MET HA 1 17 ASN H . . 3.310 2.145 2.142 2.152 . 0 0 "[ . 1 . 2]" 1
226 1 16 MET HA 1 34 VAL H . . 4.750 4.536 4.030 4.783 0.033 4 0 "[ . 1 . 2]" 1
227 1 16 MET HA 1 34 VAL QG . . 3.340 3.240 2.855 3.415 0.075 9 0 "[ . 1 . 2]" 1
228 1 16 MET QB 1 17 ASN H . . 4.150 3.598 3.439 3.773 . 0 0 "[ . 1 . 2]" 1
229 1 16 MET QB 1 63 LEU H . . 5.080 5.159 5.083 5.313 0.233 14 0 "[ . 1 . 2]" 1
230 1 16 MET QB 1 63 LEU MD1 . . 4.300 3.068 1.822 3.935 . 0 0 "[ . 1 . 2]" 1
231 1 16 MET QB 1 66 ILE MD . . 4.670 2.697 1.867 3.977 . 0 0 "[ . 1 . 2]" 1
232 1 16 MET QG 1 34 VAL QG . . 4.890 4.525 3.905 4.916 0.026 16 0 "[ . 1 . 2]" 1
233 1 16 MET QG 1 35 VAL QG . . 4.520 3.136 1.795 4.257 . 0 0 "[ . 1 . 2]" 1
234 1 16 MET QG 1 66 ILE MD . . 4.540 3.049 1.915 4.284 . 0 0 "[ . 1 . 2]" 1
235 1 17 ASN H 1 33 ASN HA . . 4.860 4.185 3.747 4.604 . 0 0 "[ . 1 . 2]" 1
236 1 17 ASN H 1 34 VAL H . . 4.340 3.623 3.055 3.872 . 0 0 "[ . 1 . 2]" 1
237 1 17 ASN H 1 34 VAL QG . . 4.120 2.479 2.106 2.914 . 0 0 "[ . 1 . 2]" 1
238 1 17 ASN H 1 66 ILE MD . . 4.190 3.367 2.749 4.255 0.065 8 0 "[ . 1 . 2]" 1
239 1 17 ASN HA 1 18 ILE HA . . 4.870 4.417 4.387 4.429 . 0 0 "[ . 1 . 2]" 1
240 1 17 ASN HA 1 18 ILE HG13 . . 4.570 3.748 3.548 4.167 . 0 0 "[ . 1 . 2]" 1
241 1 17 ASN HA 1 66 ILE MD . . 4.130 2.850 2.207 3.689 . 0 0 "[ . 1 . 2]" 1
242 1 17 ASN QB 1 18 ILE H . . 4.450 2.889 2.554 3.609 . 0 0 "[ . 1 . 2]" 1
243 1 17 ASN QB 1 19 ALA MB . . 4.810 4.523 4.348 4.960 0.150 19 0 "[ . 1 . 2]" 1
244 1 17 ASN QB 1 34 VAL QG . . 2.400 2.211 1.856 2.494 0.094 12 0 "[ . 1 . 2]" 1
245 1 18 ILE H 1 18 ILE HB . . 3.890 2.603 2.391 2.690 . 0 0 "[ . 1 . 2]" 1
246 1 18 ILE H 1 18 ILE HG12 . . 4.460 4.276 3.956 4.436 . 0 0 "[ . 1 . 2]" 1
247 1 18 ILE H 1 18 ILE HG13 . . 4.280 3.030 2.639 3.184 . 0 0 "[ . 1 . 2]" 1
248 1 18 ILE H 1 66 ILE MD . . 4.680 3.432 3.005 3.845 . 0 0 "[ . 1 . 2]" 1
249 1 18 ILE HA 1 18 ILE HG12 . . 3.420 2.679 2.562 2.806 . 0 0 "[ . 1 . 2]" 1
250 1 18 ILE HA 1 18 ILE HG13 . . 3.310 2.695 2.548 2.824 . 0 0 "[ . 1 . 2]" 1
251 1 18 ILE HA 1 18 ILE MG . . 2.650 2.416 2.339 2.461 . 0 0 "[ . 1 . 2]" 1
252 1 18 ILE HA 1 19 ALA H . . 3.240 2.153 2.141 2.187 . 0 0 "[ . 1 . 2]" 1
253 1 18 ILE HA 1 19 ALA HA . . 5.240 4.414 4.401 4.441 . 0 0 "[ . 1 . 2]" 1
254 1 18 ILE HA 1 19 ALA MB . . 5.320 4.005 3.961 4.072 . 0 0 "[ . 1 . 2]" 1
255 1 18 ILE HA 1 31 VAL MG1 . . 4.350 3.600 3.421 3.731 . 0 0 "[ . 1 . 2]" 1
256 1 18 ILE HA 1 31 VAL MG2 . . 5.400 5.243 4.956 5.414 0.014 19 0 "[ . 1 . 2]" 1
257 1 18 ILE HA 1 32 GLU H . . 4.290 3.505 3.192 3.858 . 0 0 "[ . 1 . 2]" 1
258 1 18 ILE MD 1 66 ILE H . . 3.840 3.972 3.749 4.111 0.271 6 0 "[ . 1 . 2]" 1
259 1 18 ILE MD 1 66 ILE HA . . 4.240 1.876 1.842 1.918 . 0 0 "[ . 1 . 2]" 1
260 1 18 ILE MD 1 66 ILE QG . . 3.290 2.669 1.927 3.469 0.179 5 0 "[ . 1 . 2]" 1
261 1 18 ILE MD 1 67 GLU H . . 5.070 4.732 4.470 4.883 . 0 0 "[ . 1 . 2]" 1
262 1 18 ILE MD 1 70 MET HA . . 5.270 4.119 3.783 4.510 . 0 0 "[ . 1 . 2]" 1
263 1 18 ILE HG12 1 31 VAL HA . . 4.730 4.518 4.080 4.758 0.028 19 0 "[ . 1 . 2]" 1
264 1 18 ILE HG12 1 31 VAL MG1 . . 2.740 2.362 1.974 2.598 . 0 0 "[ . 1 . 2]" 1
265 1 18 ILE HG12 1 33 ASN H . . 5.340 5.189 4.894 5.398 0.058 12 0 "[ . 1 . 2]" 1
266 1 18 ILE HG12 1 33 ASN HB2 . . 4.620 4.643 4.615 4.688 0.068 9 0 "[ . 1 . 2]" 1
267 1 18 ILE HG12 1 70 MET HB2 . . 3.960 3.482 3.196 3.652 . 0 0 "[ . 1 . 2]" 1
268 1 18 ILE HG12 1 70 MET HB3 . . 5.200 5.132 4.838 5.257 0.057 19 0 "[ . 1 . 2]" 1
269 1 18 ILE HG13 1 19 ALA H . . 4.880 4.824 4.674 4.943 0.063 12 0 "[ . 1 . 2]" 1
270 1 18 ILE HG13 1 70 MET HB2 . . 5.320 4.733 4.434 5.057 . 0 0 "[ . 1 . 2]" 1
271 1 18 ILE HG13 1 70 MET ME . . 5.500 4.172 3.171 4.975 . 0 0 "[ . 1 . 2]" 1
272 1 18 ILE MG 1 19 ALA H . . 4.050 3.010 2.886 3.211 . 0 0 "[ . 1 . 2]" 1
273 1 18 ILE MG 1 31 VAL HA . . 2.670 2.185 1.903 2.432 . 0 0 "[ . 1 . 2]" 1
274 1 18 ILE MG 1 33 ASN H . . 4.910 4.900 4.759 4.993 0.083 12 0 "[ . 1 . 2]" 1
275 1 19 ALA H 1 31 VAL MG1 . . 5.220 4.457 4.239 4.732 . 0 0 "[ . 1 . 2]" 1
276 1 19 ALA HA 1 20 VAL H . . 2.640 2.152 2.142 2.183 . 0 0 "[ . 1 . 2]" 1
277 1 19 ALA HA 1 20 VAL QG . . 4.910 3.251 3.154 3.375 . 0 0 "[ . 1 . 2]" 1
278 1 19 ALA MB 1 20 VAL H . . 3.930 3.150 2.963 3.311 . 0 0 "[ . 1 . 2]" 1
279 1 19 ALA MB 1 20 VAL HA . . 4.150 4.135 4.051 4.228 0.078 18 0 "[ . 1 . 2]" 1
280 1 19 ALA MB 1 20 VAL QG . . 5.030 4.013 3.889 4.137 . 0 0 "[ . 1 . 2]" 1
281 1 19 ALA MB 1 21 TYR QD . . 4.690 4.371 4.231 4.502 . 0 0 "[ . 1 . 2]" 1
282 1 19 ALA MB 1 32 GLU HA . . 5.500 4.789 4.659 4.895 . 0 0 "[ . 1 . 2]" 1
283 1 19 ALA MB 1 32 GLU HB2 . . 3.780 3.757 3.544 3.822 0.042 19 0 "[ . 1 . 2]" 1
284 1 19 ALA MB 1 32 GLU HG2 . . 4.020 2.866 2.690 3.290 . 0 0 "[ . 1 . 2]" 1
285 1 19 ALA MB 1 32 GLU HG3 . . 4.260 4.242 4.123 4.296 0.036 15 0 "[ . 1 . 2]" 1
286 1 19 ALA MB 1 33 ASN H . . 5.500 5.482 5.266 5.580 0.080 12 0 "[ . 1 . 2]" 1
287 1 20 VAL H 1 20 VAL HB . . 3.410 3.075 2.849 3.512 0.102 19 0 "[ . 1 . 2]" 1
288 1 20 VAL H 1 20 VAL QG . . 2.950 2.063 1.871 2.324 . 0 0 "[ . 1 . 2]" 1
289 1 20 VAL HA 1 20 VAL QG . . 3.320 2.026 1.945 2.117 . 0 0 "[ . 1 . 2]" 1
290 1 20 VAL HA 1 21 TYR H . . 3.190 2.417 2.395 2.434 . 0 0 "[ . 1 . 2]" 1
291 1 20 VAL HA 1 21 TYR QD . . 4.700 3.542 2.984 3.834 . 0 0 "[ . 1 . 2]" 1
292 1 20 VAL HA 1 29 ALA MB . . 5.470 5.258 5.127 5.470 0.000 19 0 "[ . 1 . 2]" 1
293 1 20 VAL HA 1 30 ARG H . . 4.390 3.122 2.917 3.311 . 0 0 "[ . 1 . 2]" 1
294 1 20 VAL HA 1 30 ARG HB3 . . 5.120 3.582 3.300 3.834 . 0 0 "[ . 1 . 2]" 1
295 1 20 VAL HB 1 21 TYR H . . 4.410 2.978 2.473 3.215 . 0 0 "[ . 1 . 2]" 1
296 1 20 VAL QG 1 21 TYR H . . 3.640 2.174 1.883 2.734 . 0 0 "[ . 1 . 2]" 1
297 1 20 VAL QG 1 21 TYR HA . . 5.380 3.998 3.813 4.268 . 0 0 "[ . 1 . 2]" 1
298 1 20 VAL QG 1 21 TYR QB . . 4.680 4.282 4.046 4.717 0.037 19 0 "[ . 1 . 2]" 1
299 1 20 VAL QG 1 22 GLU H . . 5.150 4.814 4.573 5.217 0.067 8 0 "[ . 1 . 2]" 1
300 1 20 VAL QG 1 29 ALA HA . . 3.190 2.305 1.944 2.992 . 0 0 "[ . 1 . 2]" 1
301 1 20 VAL QG 1 29 ALA MB . . 3.950 2.773 2.599 2.972 . 0 0 "[ . 1 . 2]" 1
302 1 20 VAL QG 1 30 ARG H . . 4.230 2.045 1.856 2.382 . 0 0 "[ . 1 . 2]" 1
303 1 21 TYR H 1 21 TYR QB . . 3.440 2.900 2.796 3.045 . 0 0 "[ . 1 . 2]" 1
304 1 21 TYR H 1 21 TYR QD . . 3.830 3.199 2.766 3.511 . 0 0 "[ . 1 . 2]" 1
305 1 21 TYR H 1 28 LYS HG3 . . 5.500 5.454 5.328 5.508 0.008 19 0 "[ . 1 . 2]" 1
306 1 21 TYR H 1 29 ALA HA . . 4.460 3.371 3.330 3.471 . 0 0 "[ . 1 . 2]" 1
307 1 21 TYR H 1 29 ALA MB . . 4.710 4.766 4.747 4.796 0.086 7 0 "[ . 1 . 2]" 1
308 1 21 TYR H 1 30 ARG H . . 4.870 2.443 2.307 2.701 . 0 0 "[ . 1 . 2]" 1
309 1 21 TYR HA 1 21 TYR QD . . 4.190 2.837 2.567 3.186 . 0 0 "[ . 1 . 2]" 1
310 1 21 TYR HA 1 22 GLU H . . 3.330 2.165 2.163 2.167 . 0 0 "[ . 1 . 2]" 1
311 1 21 TYR HA 1 22 GLU HA . . 4.850 4.379 4.363 4.390 . 0 0 "[ . 1 . 2]" 1
312 1 21 TYR QB 1 22 GLU H . . 3.860 3.096 3.074 3.130 . 0 0 "[ . 1 . 2]" 1
313 1 21 TYR QB 1 28 LYS HG2 . . 4.100 3.472 3.242 3.798 . 0 0 "[ . 1 . 2]" 1
314 1 21 TYR QB 1 28 LYS HG3 . . 5.500 5.041 4.781 5.414 . 0 0 "[ . 1 . 2]" 1
315 1 21 TYR QD 1 22 GLU H . . 4.740 4.336 4.011 4.740 . 0 0 "[ . 1 . 2]" 1
316 1 21 TYR QD 1 30 ARG H . . 4.960 3.882 3.529 4.104 . 0 0 "[ . 1 . 2]" 1
317 1 21 TYR QD 1 30 ARG HB2 . . 3.850 3.461 3.292 3.691 . 0 0 "[ . 1 . 2]" 1
318 1 21 TYR QD 1 30 ARG HB3 . . 3.330 2.013 1.965 2.158 . 0 0 "[ . 1 . 2]" 1
319 1 21 TYR QD 1 30 ARG HG2 . . 4.030 3.931 3.636 4.106 0.076 19 0 "[ . 1 . 2]" 1
320 1 21 TYR QD 1 30 ARG HG3 . . 4.630 4.452 4.202 4.659 0.029 8 0 "[ . 1 . 2]" 1
321 1 22 GLU H 1 22 GLU QG . . 4.170 3.913 3.171 4.138 . 0 0 "[ . 1 . 2]" 1
322 1 22 GLU H 1 23 ASN H . . 5.190 4.537 4.398 4.595 . 0 0 "[ . 1 . 2]" 1
323 1 22 GLU HA 1 22 GLU QB . . 2.660 2.422 2.291 2.527 . 0 0 "[ . 1 . 2]" 1
324 1 22 GLU HA 1 22 GLU QG . . 2.870 2.342 2.104 2.555 . 0 0 "[ . 1 . 2]" 1
325 1 22 GLU HA 1 23 ASN H . . 3.130 2.280 2.154 2.294 . 0 0 "[ . 1 . 2]" 1
326 1 22 GLU HA 1 23 ASN HA . . 5.490 4.363 4.342 4.402 . 0 0 "[ . 1 . 2]" 1
327 1 22 GLU HA 1 23 ASN HB3 . . 4.580 4.551 4.340 4.646 0.066 7 0 "[ . 1 . 2]" 1
328 1 22 GLU HA 1 27 ILE HA . . 4.240 4.092 3.730 4.255 0.015 8 0 "[ . 1 . 2]" 1
329 1 22 GLU HA 1 27 ILE MD . . 4.760 4.660 4.426 4.773 0.013 14 0 "[ . 1 . 2]" 1
330 1 22 GLU HA 1 27 ILE MG . . 4.070 4.055 3.703 4.101 0.031 13 0 "[ . 1 . 2]" 1
331 1 22 GLU QB 1 23 ASN H . . 4.200 3.317 2.764 3.525 . 0 0 "[ . 1 . 2]" 1
332 1 22 GLU QG 1 27 ILE MD . . 2.790 2.476 2.334 2.777 . 0 0 "[ . 1 . 2]" 1
333 1 23 ASN H 1 23 ASN HB2 . . 3.890 2.938 2.723 3.256 . 0 0 "[ . 1 . 2]" 1
334 1 23 ASN H 1 23 ASN HB3 . . 3.600 2.441 2.314 2.547 . 0 0 "[ . 1 . 2]" 1
335 1 23 ASN H 1 27 ILE HA . . 4.230 3.184 2.775 3.601 . 0 0 "[ . 1 . 2]" 1
336 1 23 ASN H 1 27 ILE MG . . 4.520 4.329 3.641 4.531 0.011 16 0 "[ . 1 . 2]" 1
337 1 23 ASN H 1 28 LYS H . . 4.420 2.599 1.898 3.000 . 0 0 "[ . 1 . 2]" 1
338 1 23 ASN HB2 1 28 LYS HB2 . . 3.720 2.831 1.996 3.549 . 0 0 "[ . 1 . 2]" 1
339 1 23 ASN HB2 1 28 LYS QB . . 3.210 2.591 1.909 3.076 . 0 0 "[ . 1 . 2]" 1
340 1 23 ASN HB2 1 28 LYS HB3 . . 3.720 3.093 2.278 3.589 . 0 0 "[ . 1 . 2]" 1
341 1 23 ASN HB2 1 28 LYS QD . . 4.540 3.061 2.053 3.844 . 0 0 "[ . 1 . 2]" 1
342 1 23 ASN HB3 1 26 LYS QB . . 4.900 3.561 2.059 4.313 . 0 0 "[ . 1 . 2]" 1
343 1 23 ASN HB3 1 27 ILE H . . 5.280 4.790 3.710 5.236 . 0 0 "[ . 1 . 2]" 1
344 1 23 ASN HB3 1 28 LYS HB2 . . 3.920 3.070 2.336 3.539 . 0 0 "[ . 1 . 2]" 1
345 1 23 ASN HB3 1 28 LYS QB . . 3.440 2.862 2.271 3.279 . 0 0 "[ . 1 . 2]" 1
346 1 23 ASN HB3 1 28 LYS HB3 . . 3.920 3.490 2.881 3.916 . 0 0 "[ . 1 . 2]" 1
347 1 25 SER HA 1 26 LYS HA . . 5.190 4.558 4.396 4.652 . 0 0 "[ . 1 . 2]" 1
348 1 25 SER HA 1 26 LYS QG . . 4.800 4.443 4.081 4.840 0.040 17 0 "[ . 1 . 2]" 1
349 1 25 SER QB 1 26 LYS H . . 3.940 2.241 1.922 3.688 . 0 0 "[ . 1 . 2]" 1
350 1 25 SER HB2 1 26 LYS H . . 4.480 2.660 1.948 4.374 . 0 0 "[ . 1 . 2]" 1
351 1 25 SER HB3 1 26 LYS H . . 4.480 3.020 1.947 4.047 . 0 0 "[ . 1 . 2]" 1
352 1 26 LYS H 1 26 LYS HB2 . . 4.070 2.536 2.401 2.847 . 0 0 "[ . 1 . 2]" 1
353 1 26 LYS H 1 26 LYS QB . . 3.420 2.494 2.368 2.780 . 0 0 "[ . 1 . 2]" 1
354 1 26 LYS H 1 26 LYS HB3 . . 4.070 3.702 3.609 3.884 . 0 0 "[ . 1 . 2]" 1
355 1 26 LYS H 1 26 LYS QG . . 3.820 2.874 2.351 3.356 . 0 0 "[ . 1 . 2]" 1
356 1 26 LYS HA 1 26 LYS QD . . 3.450 2.588 2.034 3.388 . 0 0 "[ . 1 . 2]" 1
357 1 26 LYS HA 1 26 LYS QG . . 3.140 2.613 2.303 2.847 . 0 0 "[ . 1 . 2]" 1
358 1 26 LYS HA 1 46 ASP HA . . 5.500 4.766 4.216 5.275 . 0 0 "[ . 1 . 2]" 1
359 1 26 LYS QB 1 26 LYS QG . . 2.430 2.021 2.003 2.042 . 0 0 "[ . 1 . 2]" 1
360 1 26 LYS QB 1 27 ILE H . . 3.220 2.083 1.939 2.758 . 0 0 "[ . 1 . 2]" 1
361 1 26 LYS QB 1 46 ASP HA . . 5.300 3.399 2.999 4.037 . 0 0 "[ . 1 . 2]" 1
362 1 26 LYS HB2 1 27 ILE H . . 4.090 3.354 3.141 3.879 . 0 0 "[ . 1 . 2]" 1
363 1 26 LYS HB3 1 27 ILE H . . 4.090 2.106 1.953 2.823 . 0 0 "[ . 1 . 2]" 1
364 1 26 LYS QD 1 46 ASP HA . . 3.620 3.366 2.982 3.635 0.015 12 0 "[ . 1 . 2]" 1
365 1 26 LYS QE 1 26 LYS QG . . 3.310 2.237 2.062 2.531 . 0 0 "[ . 1 . 2]" 1
366 1 26 LYS HE2 1 26 LYS QG . . 3.860 2.736 2.162 3.307 . 0 0 "[ . 1 . 2]" 1
367 1 26 LYS HE3 1 26 LYS QG . . 3.860 2.548 2.167 3.430 . 0 0 "[ . 1 . 2]" 1
368 1 26 LYS QG 1 27 ILE H . . 4.540 4.046 3.880 4.415 . 0 0 "[ . 1 . 2]" 1
369 1 27 ILE H 1 27 ILE HB . . 3.570 2.502 2.461 2.676 . 0 0 "[ . 1 . 2]" 1
370 1 27 ILE H 1 27 ILE MD . . 4.350 3.643 3.543 3.775 . 0 0 "[ . 1 . 2]" 1
371 1 27 ILE H 1 27 ILE HG12 . . 3.980 2.412 2.304 2.782 . 0 0 "[ . 1 . 2]" 1
372 1 27 ILE H 1 27 ILE HG13 . . 4.390 3.716 3.654 4.092 . 0 0 "[ . 1 . 2]" 1
373 1 27 ILE H 1 27 ILE MG . . 4.320 3.783 3.766 3.867 . 0 0 "[ . 1 . 2]" 1
374 1 27 ILE H 1 46 ASP HA . . 4.250 2.999 2.774 3.283 . 0 0 "[ . 1 . 2]" 1
375 1 27 ILE HA 1 27 ILE MD . . 2.840 1.994 1.973 2.030 . 0 0 "[ . 1 . 2]" 1
376 1 27 ILE HA 1 27 ILE HG13 . . 4.220 3.744 3.729 3.758 . 0 0 "[ . 1 . 2]" 1
377 1 27 ILE HA 1 27 ILE MG . . 3.210 2.345 2.297 2.416 . 0 0 "[ . 1 . 2]" 1
378 1 27 ILE HA 1 28 LYS H . . 3.300 2.189 2.142 2.220 . 0 0 "[ . 1 . 2]" 1
379 1 27 ILE HB 1 27 ILE MD . . 3.230 3.221 3.217 3.227 . 0 0 "[ . 1 . 2]" 1
380 1 27 ILE HB 1 27 ILE HG13 . . 2.930 2.397 2.383 2.416 . 0 0 "[ . 1 . 2]" 1
381 1 27 ILE HB 1 45 PHE H . . 4.870 4.109 3.512 4.631 . 0 0 "[ . 1 . 2]" 1
382 1 27 ILE HB 1 45 PHE HB2 . . 4.340 3.155 2.947 3.506 . 0 0 "[ . 1 . 2]" 1
383 1 27 ILE HB 1 45 PHE QB . . 3.500 2.631 2.497 2.831 . 0 0 "[ . 1 . 2]" 1
384 1 27 ILE HB 1 45 PHE HB3 . . 4.340 2.822 2.658 2.988 . 0 0 "[ . 1 . 2]" 1
385 1 27 ILE HB 1 45 PHE QD . . 5.290 4.586 4.389 4.758 . 0 0 "[ . 1 . 2]" 1
386 1 27 ILE HB 1 47 SER H . . 4.580 3.775 3.504 4.006 . 0 0 "[ . 1 . 2]" 1
387 1 27 ILE MD 1 28 LYS H . . 4.870 3.437 3.324 3.755 . 0 0 "[ . 1 . 2]" 1
388 1 27 ILE MD 1 45 PHE HB2 . . 5.070 4.952 4.713 5.089 0.019 5 0 "[ . 1 . 2]" 1
389 1 27 ILE MD 1 45 PHE QB . . 4.430 4.371 4.217 4.453 0.023 7 0 "[ . 1 . 2]" 1
390 1 27 ILE MD 1 45 PHE HB3 . . 5.070 4.865 4.733 4.940 . 0 0 "[ . 1 . 2]" 1
391 1 27 ILE MD 1 45 PHE QD . . 5.500 5.505 5.471 5.521 0.021 13 0 "[ . 1 . 2]" 1
392 1 27 ILE MD 1 48 THR H . . 4.330 2.906 2.507 3.432 . 0 0 "[ . 1 . 2]" 1
393 1 27 ILE MD 1 48 THR HA . . 2.500 2.530 2.519 2.547 0.047 20 0 "[ . 1 . 2]" 1
394 1 27 ILE HG12 1 47 SER HA . . 3.730 3.347 3.147 3.589 . 0 0 "[ . 1 . 2]" 1
395 1 27 ILE HG13 1 45 PHE HB2 . . 5.500 4.930 4.508 5.266 . 0 0 "[ . 1 . 2]" 1
396 1 27 ILE HG13 1 45 PHE QB . . 4.650 3.955 3.671 4.212 . 0 0 "[ . 1 . 2]" 1
397 1 27 ILE HG13 1 45 PHE HB3 . . 5.500 4.165 3.889 4.431 . 0 0 "[ . 1 . 2]" 1
398 1 27 ILE HG13 1 47 SER HA . . 4.090 2.423 2.214 2.749 . 0 0 "[ . 1 . 2]" 1
399 1 27 ILE HG13 1 48 THR H . . 4.320 2.612 2.483 2.965 . 0 0 "[ . 1 . 2]" 1
400 1 27 ILE HG13 1 48 THR HA . . 4.280 3.166 2.887 3.442 . 0 0 "[ . 1 . 2]" 1
401 1 27 ILE HG13 1 49 GLU H . . 5.500 4.834 4.724 5.137 . 0 0 "[ . 1 . 2]" 1
402 1 27 ILE MG 1 28 LYS H . . 4.080 2.283 2.057 2.882 . 0 0 "[ . 1 . 2]" 1
403 1 27 ILE MG 1 47 SER H . . 4.990 4.135 3.781 4.389 . 0 0 "[ . 1 . 2]" 1
404 1 27 ILE MG 1 48 THR HA . . 3.550 2.445 2.118 2.714 . 0 0 "[ . 1 . 2]" 1
405 1 27 ILE MG 1 48 THR HB . . 4.900 4.659 3.603 4.921 0.021 6 0 "[ . 1 . 2]" 1
406 1 27 ILE MG 1 51 LEU H . . 4.400 4.152 3.827 4.374 . 0 0 "[ . 1 . 2]" 1
407 1 28 LYS H 1 28 LYS HB2 . . 3.990 3.297 3.139 3.350 . 0 0 "[ . 1 . 2]" 1
408 1 28 LYS H 1 28 LYS QB . . 3.150 2.556 2.402 2.596 . 0 0 "[ . 1 . 2]" 1
409 1 28 LYS H 1 28 LYS HB3 . . 3.990 2.663 2.493 2.724 . 0 0 "[ . 1 . 2]" 1
410 1 28 LYS HA 1 28 LYS HD2 . . 5.500 4.400 3.922 4.636 . 0 0 "[ . 1 . 2]" 1
411 1 28 LYS HA 1 28 LYS QD . . 4.630 3.805 3.441 4.165 . 0 0 "[ . 1 . 2]" 1
412 1 28 LYS HA 1 28 LYS HD3 . . 5.500 4.272 3.584 4.888 . 0 0 "[ . 1 . 2]" 1
413 1 28 LYS HA 1 28 LYS HG2 . . 3.980 3.585 3.487 3.692 . 0 0 "[ . 1 . 2]" 1
414 1 28 LYS HA 1 29 ALA H . . 3.250 2.202 2.179 2.208 . 0 0 "[ . 1 . 2]" 1
415 1 28 LYS HA 1 29 ALA MB . . 3.890 3.845 3.823 3.895 0.005 4 0 "[ . 1 . 2]" 1
416 1 28 LYS HA 1 44 ASP HA . . 3.110 2.802 2.211 3.130 0.020 12 0 "[ . 1 . 2]" 1
417 1 28 LYS HA 1 45 PHE H . . 3.720 2.445 2.302 2.609 . 0 0 "[ . 1 . 2]" 1
418 1 28 LYS QB 1 28 LYS QD . . 3.200 2.121 1.956 2.260 . 0 0 "[ . 1 . 2]" 1
419 1 28 LYS QB 1 28 LYS QE . . 3.230 2.527 2.093 3.203 . 0 0 "[ . 1 . 2]" 1
420 1 28 LYS QB 1 29 ALA H . . 3.670 3.618 3.606 3.671 0.001 8 0 "[ . 1 . 2]" 1
421 1 28 LYS QB 1 45 PHE H . . 4.830 4.316 4.070 4.541 . 0 0 "[ . 1 . 2]" 1
422 1 28 LYS HB2 1 28 LYS QE . . 4.030 2.790 2.109 3.732 . 0 0 "[ . 1 . 2]" 1
423 1 28 LYS HB2 1 29 ALA H . . 4.350 4.010 3.984 4.072 . 0 0 "[ . 1 . 2]" 1
424 1 28 LYS HB2 1 45 PHE H . . 5.500 4.537 4.232 4.832 . 0 0 "[ . 1 . 2]" 1
425 1 28 LYS HB3 1 28 LYS QE . . 4.030 3.235 2.310 4.029 . 0 0 "[ . 1 . 2]" 1
426 1 28 LYS HB3 1 29 ALA H . . 4.350 4.117 4.057 4.179 . 0 0 "[ . 1 . 2]" 1
427 1 28 LYS HB3 1 45 PHE H . . 5.500 5.412 5.279 5.515 0.015 8 0 "[ . 1 . 2]" 1
428 1 28 LYS QD 1 29 ALA H . . 5.210 4.245 3.918 4.478 . 0 0 "[ . 1 . 2]" 1
429 1 28 LYS HG2 1 29 ALA H . . 4.430 3.449 3.270 3.707 . 0 0 "[ . 1 . 2]" 1
430 1 28 LYS HG2 1 30 ARG H . . 4.490 3.819 3.624 4.245 . 0 0 "[ . 1 . 2]" 1
431 1 28 LYS HG2 1 30 ARG HB2 . . 4.170 3.497 3.284 3.766 . 0 0 "[ . 1 . 2]" 1
432 1 28 LYS HG2 1 44 ASP HA . . 5.500 5.255 4.972 5.475 . 0 0 "[ . 1 . 2]" 1
433 1 28 LYS HG3 1 29 ALA H . . 3.820 2.288 2.200 2.392 . 0 0 "[ . 1 . 2]" 1
434 1 28 LYS HG3 1 43 ARG H . . 4.690 4.298 3.977 4.503 . 0 0 "[ . 1 . 2]" 1
435 1 28 LYS HG3 1 44 ASP HA . . 3.750 3.553 3.312 3.762 0.012 13 0 "[ . 1 . 2]" 1
436 1 29 ALA H 1 29 ALA MB . . 3.460 2.527 2.433 2.585 . 0 0 "[ . 1 . 2]" 1
437 1 29 ALA H 1 43 ARG H . . 4.370 4.069 3.907 4.262 . 0 0 "[ . 1 . 2]" 1
438 1 29 ALA H 1 43 ARG HB2 . . 5.500 4.393 3.844 4.637 . 0 0 "[ . 1 . 2]" 1
439 1 29 ALA H 1 44 ASP H . . 5.440 4.808 4.456 5.103 . 0 0 "[ . 1 . 2]" 1
440 1 29 ALA H 1 44 ASP HA . . 4.510 3.050 2.457 3.541 . 0 0 "[ . 1 . 2]" 1
441 1 29 ALA H 1 45 PHE QD . . 4.630 4.024 3.336 4.377 . 0 0 "[ . 1 . 2]" 1
442 1 29 ALA HA 1 30 ARG H . . 3.230 2.167 2.145 2.172 . 0 0 "[ . 1 . 2]" 1
443 1 29 ALA HA 1 51 LEU QD . . 4.660 3.217 2.930 3.497 . 0 0 "[ . 1 . 2]" 1
444 1 29 ALA HA 1 73 ILE MG . . 5.240 5.251 5.193 5.276 0.036 10 0 "[ . 1 . 2]" 1
445 1 29 ALA MB 1 30 ARG H . . 3.940 3.436 3.329 3.453 . 0 0 "[ . 1 . 2]" 1
446 1 29 ALA MB 1 30 ARG HA . . 4.580 4.123 4.087 4.163 . 0 0 "[ . 1 . 2]" 1
447 1 29 ALA MB 1 31 VAL H . . 5.030 4.564 4.460 4.672 . 0 0 "[ . 1 . 2]" 1
448 1 29 ALA MB 1 31 VAL HA . . 5.500 5.497 5.447 5.525 0.025 14 0 "[ . 1 . 2]" 1
449 1 29 ALA MB 1 43 ARG H . . 5.380 4.306 4.119 4.468 . 0 0 "[ . 1 . 2]" 1
450 1 29 ALA MB 1 44 ASP HA . . 4.830 4.432 3.845 4.839 0.009 17 0 "[ . 1 . 2]" 1
451 1 29 ALA MB 1 45 PHE H . . 4.060 3.838 3.462 4.072 0.012 17 0 "[ . 1 . 2]" 1
452 1 29 ALA MB 1 45 PHE QD . . 4.330 3.064 2.717 3.281 . 0 0 "[ . 1 . 2]" 1
453 1 29 ALA MB 1 45 PHE QE . . 3.650 3.443 2.877 3.655 0.005 12 0 "[ . 1 . 2]" 1
454 1 29 ALA MB 1 51 LEU MD1 . . 3.930 2.374 1.836 3.333 . 0 0 "[ . 1 . 2]" 1
455 1 29 ALA MB 1 51 LEU QD . . 3.410 2.089 1.806 2.647 . 0 0 "[ . 1 . 2]" 1
456 1 29 ALA MB 1 51 LEU MD2 . . 3.930 2.926 1.838 3.637 . 0 0 "[ . 1 . 2]" 1
457 1 29 ALA MB 1 73 ILE MD . . 4.140 3.208 2.399 3.519 . 0 0 "[ . 1 . 2]" 1
458 1 29 ALA MB 1 73 ILE QG . . 4.270 3.930 3.754 4.284 0.014 18 0 "[ . 1 . 2]" 1
459 1 30 ARG H 1 30 ARG HG2 . . 4.460 4.415 4.389 4.478 0.018 9 0 "[ . 1 . 2]" 1
460 1 30 ARG H 1 42 ALA HA . . 5.500 5.481 5.344 5.529 0.029 5 0 "[ . 1 . 2]" 1
461 1 30 ARG H 1 73 ILE MG . . 4.880 4.886 4.841 4.933 0.053 8 0 "[ . 1 . 2]" 1
462 1 30 ARG HA 1 30 ARG HB2 . . 2.480 2.457 2.443 2.496 0.016 9 0 "[ . 1 . 2]" 1
463 1 30 ARG HA 1 30 ARG HG2 . . 2.960 2.832 2.693 2.940 . 0 0 "[ . 1 . 2]" 1
464 1 30 ARG HA 1 30 ARG HG3 . . 3.190 2.829 2.619 2.992 . 0 0 "[ . 1 . 2]" 1
465 1 30 ARG HA 1 31 VAL H . . 3.230 2.159 2.152 2.168 . 0 0 "[ . 1 . 2]" 1
466 1 30 ARG HA 1 31 VAL HB . . 4.820 4.528 4.447 4.556 . 0 0 "[ . 1 . 2]" 1
467 1 30 ARG HA 1 31 VAL MG2 . . 4.570 3.934 3.853 4.128 . 0 0 "[ . 1 . 2]" 1
468 1 30 ARG HA 1 42 ALA HA . . 4.280 2.733 2.622 2.811 . 0 0 "[ . 1 . 2]" 1
469 1 30 ARG HA 1 42 ALA MB . . 4.550 4.294 4.187 4.345 . 0 0 "[ . 1 . 2]" 1
470 1 30 ARG HA 1 43 ARG H . . 4.080 3.006 2.765 3.289 . 0 0 "[ . 1 . 2]" 1
471 1 30 ARG HA 1 73 ILE MG . . 3.150 3.088 2.969 3.179 0.029 6 0 "[ . 1 . 2]" 1
472 1 30 ARG HB2 1 30 ARG HD2 . . 4.200 2.991 2.609 3.479 . 0 0 "[ . 1 . 2]" 1
473 1 30 ARG HB2 1 30 ARG HD3 . . 4.200 3.526 2.450 3.881 . 0 0 "[ . 1 . 2]" 1
474 1 30 ARG HB2 1 31 VAL H . . 4.580 4.433 4.398 4.464 . 0 0 "[ . 1 . 2]" 1
475 1 30 ARG HB2 1 42 ALA HA . . 4.080 3.639 3.521 3.807 . 0 0 "[ . 1 . 2]" 1
476 1 30 ARG HB2 1 42 ALA MB . . 4.650 4.566 4.448 4.643 . 0 0 "[ . 1 . 2]" 1
477 1 30 ARG HB3 1 30 ARG HD2 . . 4.210 2.581 2.133 3.656 . 0 0 "[ . 1 . 2]" 1
478 1 30 ARG HB3 1 30 ARG HD3 . . 4.210 2.851 2.095 3.602 . 0 0 "[ . 1 . 2]" 1
479 1 30 ARG HB3 1 31 VAL H . . 4.620 4.391 4.348 4.417 . 0 0 "[ . 1 . 2]" 1
480 1 30 ARG QD 1 42 ALA MB . . 5.070 4.664 3.905 5.008 . 0 0 "[ . 1 . 2]" 1
481 1 30 ARG HD2 1 39 SER QB . . 5.500 4.966 3.874 5.531 0.031 10 0 "[ . 1 . 2]" 1
482 1 30 ARG HD3 1 39 SER QB . . 5.500 4.183 3.344 5.359 . 0 0 "[ . 1 . 2]" 1
483 1 30 ARG HG2 1 31 VAL H . . 5.500 3.314 3.163 3.464 . 0 0 "[ . 1 . 2]" 1
484 1 30 ARG HG2 1 39 SER QB . . 4.910 4.079 3.575 4.649 . 0 0 "[ . 1 . 2]" 1
485 1 30 ARG HG2 1 42 ALA HA . . 5.070 3.857 3.552 3.986 . 0 0 "[ . 1 . 2]" 1
486 1 30 ARG HG2 1 42 ALA MB . . 4.490 4.460 4.262 4.523 0.033 19 0 "[ . 1 . 2]" 1
487 1 30 ARG HG3 1 31 VAL H . . 5.030 4.092 3.884 4.335 . 0 0 "[ . 1 . 2]" 1
488 1 30 ARG HG3 1 39 SER QB . . 5.500 5.045 4.590 5.506 0.006 10 0 "[ . 1 . 2]" 1
489 1 30 ARG HG3 1 42 ALA HA . . 3.380 2.770 2.451 2.947 . 0 0 "[ . 1 . 2]" 1
490 1 30 ARG HG3 1 42 ALA MB . . 3.420 3.276 3.131 3.437 0.017 10 0 "[ . 1 . 2]" 1
491 1 31 VAL H 1 31 VAL HB . . 3.680 2.399 2.317 2.422 . 0 0 "[ . 1 . 2]" 1
492 1 31 VAL H 1 31 VAL MG1 . . 4.270 3.739 3.693 3.750 . 0 0 "[ . 1 . 2]" 1
493 1 31 VAL H 1 31 VAL MG2 . . 3.740 2.398 2.340 2.627 . 0 0 "[ . 1 . 2]" 1
494 1 31 VAL H 1 41 GLY H . . 5.040 4.836 4.732 4.992 . 0 0 "[ . 1 . 2]" 1
495 1 31 VAL H 1 42 ALA HA . . 4.160 3.839 3.615 3.963 . 0 0 "[ . 1 . 2]" 1
496 1 31 VAL H 1 42 ALA MB . . 5.110 4.988 4.871 5.043 . 0 0 "[ . 1 . 2]" 1
497 1 31 VAL H 1 43 ARG HB2 . . 4.930 4.593 4.401 4.785 . 0 0 "[ . 1 . 2]" 1
498 1 31 VAL H 1 73 ILE HB . . 5.500 3.758 3.593 3.918 . 0 0 "[ . 1 . 2]" 1
499 1 31 VAL H 1 73 ILE QG . . 4.460 3.907 3.740 4.493 0.033 18 0 "[ . 1 . 2]" 1
500 1 31 VAL H 1 73 ILE MG . . 4.230 2.312 2.064 2.407 . 0 0 "[ . 1 . 2]" 1
501 1 31 VAL HA 1 31 VAL MG1 . . 3.510 2.413 2.391 2.503 . 0 0 "[ . 1 . 2]" 1
502 1 31 VAL HA 1 31 VAL MG2 . . 3.640 2.334 2.246 2.371 . 0 0 "[ . 1 . 2]" 1
503 1 31 VAL HA 1 32 GLU H . . 3.200 2.154 2.141 2.178 . 0 0 "[ . 1 . 2]" 1
504 1 31 VAL HA 1 73 ILE QG . . 5.500 4.843 4.762 5.316 . 0 0 "[ . 1 . 2]" 1
505 1 31 VAL HB 1 32 GLU H . . 4.660 4.376 4.216 4.468 . 0 0 "[ . 1 . 2]" 1
506 1 31 VAL HB 1 32 GLU HA . . 5.500 4.917 4.825 5.034 . 0 0 "[ . 1 . 2]" 1
507 1 31 VAL HB 1 41 GLY H . . 4.790 4.607 4.556 4.642 . 0 0 "[ . 1 . 2]" 1
508 1 31 VAL HB 1 41 GLY HA2 . . 3.280 3.299 3.158 3.341 0.061 9 0 "[ . 1 . 2]" 1
509 1 31 VAL HB 1 41 GLY HA3 . . 4.270 1.972 1.952 1.997 . 0 0 "[ . 1 . 2]" 1
510 1 31 VAL HB 1 42 ALA HA . . 5.500 5.529 5.250 5.638 0.138 10 0 "[ . 1 . 2]" 1
511 1 31 VAL HB 1 69 ALA MB . . 5.500 5.251 5.034 5.486 . 0 0 "[ . 1 . 2]" 1
512 1 31 VAL HB 1 70 MET HA . . 3.590 3.140 2.994 3.285 . 0 0 "[ . 1 . 2]" 1
513 1 31 VAL HB 1 73 ILE QG . . 3.620 3.506 3.248 3.627 0.007 20 0 "[ . 1 . 2]" 1
514 1 31 VAL HB 1 73 ILE MG . . 4.290 2.702 2.539 3.017 . 0 0 "[ . 1 . 2]" 1
515 1 31 VAL MG1 1 32 GLU H . . 3.890 2.754 2.279 3.172 . 0 0 "[ . 1 . 2]" 1
516 1 31 VAL MG1 1 32 GLU HA . . 3.820 3.604 3.395 3.740 . 0 0 "[ . 1 . 2]" 1
517 1 31 VAL MG1 1 39 SER HA . . 5.470 5.138 4.816 5.305 . 0 0 "[ . 1 . 2]" 1
518 1 31 VAL MG1 1 40 VAL H . . 4.360 4.085 3.739 4.359 . 0 0 "[ . 1 . 2]" 1
519 1 31 VAL MG1 1 41 GLY H . . 4.740 4.742 4.478 4.777 0.037 11 0 "[ . 1 . 2]" 1
520 1 31 VAL MG1 1 41 GLY HA2 . . 4.550 4.205 4.047 4.307 . 0 0 "[ . 1 . 2]" 1
521 1 31 VAL MG1 1 41 GLY HA3 . . 4.940 3.101 2.982 3.171 . 0 0 "[ . 1 . 2]" 1
522 1 31 VAL MG1 1 69 ALA HA . . 5.500 5.483 5.171 5.623 0.123 18 0 "[ . 1 . 2]" 1
523 1 31 VAL MG1 1 69 ALA MB . . 4.190 3.504 3.418 3.708 . 0 0 "[ . 1 . 2]" 1
524 1 31 VAL MG1 1 70 MET H . . 4.020 3.515 3.251 3.925 . 0 0 "[ . 1 . 2]" 1
525 1 31 VAL MG1 1 70 MET HA . . 2.600 2.135 1.929 2.359 . 0 0 "[ . 1 . 2]" 1
526 1 31 VAL MG1 1 70 MET HB2 . . 3.180 2.350 1.988 2.587 . 0 0 "[ . 1 . 2]" 1
527 1 31 VAL MG1 1 70 MET HB3 . . 3.820 3.647 3.340 3.835 0.015 2 0 "[ . 1 . 2]" 1
528 1 31 VAL MG1 1 70 MET QG . . 4.700 2.086 1.894 2.524 . 0 0 "[ . 1 . 2]" 1
529 1 31 VAL MG1 1 73 ILE HB . . 4.680 3.554 3.449 3.731 . 0 0 "[ . 1 . 2]" 1
530 1 31 VAL MG2 1 32 GLU H . . 4.730 4.012 3.814 4.114 . 0 0 "[ . 1 . 2]" 1
531 1 31 VAL MG2 1 41 GLY HA2 . . 5.240 4.516 4.434 4.623 . 0 0 "[ . 1 . 2]" 1
532 1 31 VAL MG2 1 70 MET H . . 4.600 4.165 3.787 4.522 . 0 0 "[ . 1 . 2]" 1
533 1 31 VAL MG2 1 70 MET HA . . 3.440 2.759 2.557 2.960 . 0 0 "[ . 1 . 2]" 1
534 1 31 VAL MG2 1 70 MET HB2 . . 4.540 4.103 3.713 4.308 . 0 0 "[ . 1 . 2]" 1
535 1 31 VAL MG2 1 70 MET HB3 . . 5.350 5.168 4.868 5.356 0.006 8 0 "[ . 1 . 2]" 1
536 1 31 VAL MG2 1 70 MET QG . . 5.500 4.192 3.960 4.431 . 0 0 "[ . 1 . 2]" 1
537 1 31 VAL MG2 1 73 ILE HB . . 3.290 2.381 2.150 2.799 . 0 0 "[ . 1 . 2]" 1
538 1 31 VAL MG2 1 74 SER H . . 5.460 4.854 4.587 5.258 . 0 0 "[ . 1 . 2]" 1
539 1 32 GLU H 1 32 GLU HB3 . . 2.880 2.545 2.441 2.685 . 0 0 "[ . 1 . 2]" 1
540 1 32 GLU H 1 32 GLU HG2 . . 4.590 4.317 4.203 4.391 . 0 0 "[ . 1 . 2]" 1
541 1 32 GLU H 1 32 GLU HG3 . . 5.080 4.585 4.518 4.704 . 0 0 "[ . 1 . 2]" 1
542 1 32 GLU H 1 33 ASN H . . 4.850 4.243 4.141 4.333 . 0 0 "[ . 1 . 2]" 1
543 1 32 GLU HA 1 32 GLU HB2 . . 2.860 2.382 2.357 2.406 . 0 0 "[ . 1 . 2]" 1
544 1 32 GLU HA 1 32 GLU HG2 . . 3.710 3.483 3.131 3.627 . 0 0 "[ . 1 . 2]" 1
545 1 32 GLU HA 1 32 GLU HG3 . . 3.140 2.593 2.530 2.706 . 0 0 "[ . 1 . 2]" 1
546 1 32 GLU HA 1 33 ASN H . . 3.180 2.140 2.139 2.149 . 0 0 "[ . 1 . 2]" 1
547 1 32 GLU HA 1 39 SER HA . . 3.940 2.452 2.234 2.691 . 0 0 "[ . 1 . 2]" 1
548 1 32 GLU HA 1 39 SER QB . . 2.700 2.433 2.098 2.712 0.012 6 0 "[ . 1 . 2]" 1
549 1 32 GLU HA 1 40 VAL H . . 3.900 2.864 2.782 2.982 . 0 0 "[ . 1 . 2]" 1
550 1 32 GLU HA 1 40 VAL QG . . 5.050 4.100 3.886 4.724 . 0 0 "[ . 1 . 2]" 1
551 1 32 GLU HB2 1 33 ASN H . . 4.470 4.235 4.134 4.290 . 0 0 "[ . 1 . 2]" 1
552 1 32 GLU HB2 1 39 SER HA . . 4.620 3.879 3.588 4.239 . 0 0 "[ . 1 . 2]" 1
553 1 32 GLU HB2 1 40 VAL H . . 4.900 4.915 4.817 4.952 0.052 9 0 "[ . 1 . 2]" 1
554 1 32 GLU HB3 1 33 ASN H . . 4.490 4.384 4.307 4.415 . 0 0 "[ . 1 . 2]" 1
555 1 32 GLU HB3 1 39 SER HA . . 5.310 4.789 4.609 5.053 . 0 0 "[ . 1 . 2]" 1
556 1 32 GLU HG2 1 33 ASN HA . . 5.500 4.494 4.313 4.742 . 0 0 "[ . 1 . 2]" 1
557 1 32 GLU HG2 1 39 SER HA . . 4.470 4.080 3.628 4.441 . 0 0 "[ . 1 . 2]" 1
558 1 32 GLU HG2 1 39 SER QB . . 3.510 3.435 3.340 3.546 0.036 5 0 "[ . 1 . 2]" 1
559 1 32 GLU HG3 1 33 ASN H . . 5.170 3.029 2.824 3.500 . 0 0 "[ . 1 . 2]" 1
560 1 32 GLU HG3 1 39 SER HA . . 4.290 2.477 2.267 2.737 . 0 0 "[ . 1 . 2]" 1
561 1 32 GLU HG3 1 39 SER QB . . 2.950 2.039 1.944 2.201 . 0 0 "[ . 1 . 2]" 1
562 1 33 ASN H 1 33 ASN HB2 . . 3.650 2.601 2.306 3.641 . 0 0 "[ . 1 . 2]" 1
563 1 33 ASN H 1 33 ASN HB3 . . 3.810 2.715 2.388 2.913 . 0 0 "[ . 1 . 2]" 1
564 1 33 ASN H 1 39 SER HA . . 3.980 2.257 1.951 2.431 . 0 0 "[ . 1 . 2]" 1
565 1 33 ASN H 1 39 SER QB . . 3.800 3.632 3.307 3.801 0.001 2 0 "[ . 1 . 2]" 1
566 1 33 ASN H 1 70 MET ME . . 4.620 3.920 3.674 4.404 . 0 0 "[ . 1 . 2]" 1
567 1 33 ASN HA 1 34 VAL H . . 3.280 2.457 2.307 2.600 . 0 0 "[ . 1 . 2]" 1
568 1 33 ASN HA 1 34 VAL QG . . 3.910 3.312 2.945 3.837 . 0 0 "[ . 1 . 2]" 1
569 1 33 ASN HA 1 35 VAL H . . 4.470 4.248 3.843 4.514 0.044 9 0 "[ . 1 . 2]" 1
570 1 33 ASN HA 1 70 MET ME . . 3.970 3.526 2.955 3.983 0.013 13 0 "[ . 1 . 2]" 1
571 1 33 ASN HB2 1 70 MET ME . . 4.150 2.099 1.923 2.555 . 0 0 "[ . 1 . 2]" 1
572 1 33 ASN HB3 1 34 VAL H . . 4.700 3.297 2.746 3.993 . 0 0 "[ . 1 . 2]" 1
573 1 33 ASN HB3 1 35 VAL QG . . 4.480 3.938 3.406 4.518 0.038 2 0 "[ . 1 . 2]" 1
574 1 33 ASN HB3 1 39 SER HA . . 4.260 4.089 3.433 4.311 0.051 12 0 "[ . 1 . 2]" 1
575 1 33 ASN HB3 1 40 VAL H . . 4.340 4.182 3.777 4.393 0.053 9 0 "[ . 1 . 2]" 1
576 1 33 ASN HB3 1 70 MET ME . . 5.500 3.094 1.925 3.568 . 0 0 "[ . 1 . 2]" 1
577 1 34 VAL H 1 34 VAL QG . . 3.170 2.024 1.890 2.365 . 0 0 "[ . 1 . 2]" 1
578 1 34 VAL H 1 35 VAL H . . 3.920 1.918 1.793 2.066 . 0 0 "[ . 1 . 2]" 1
579 1 34 VAL H 1 36 ASN HB2 . . 5.500 5.012 4.336 5.681 0.181 15 0 "[ . 1 . 2]" 1
580 1 34 VAL HA 1 34 VAL QG . . 3.230 2.212 1.999 2.303 . 0 0 "[ . 1 . 2]" 1
581 1 34 VAL HA 1 37 GLY H . . 4.640 3.040 2.722 3.411 . 0 0 "[ . 1 . 2]" 1
582 1 34 VAL HB 1 37 GLY H . . 5.430 4.958 4.280 5.440 0.010 15 0 "[ . 1 . 2]" 1
583 1 34 VAL HB 1 37 GLY QA . . 5.340 4.935 4.154 5.452 0.112 15 0 "[ . 1 . 2]" 1
584 1 34 VAL QG 1 35 VAL H . . 3.970 2.149 1.877 2.957 . 0 0 "[ . 1 . 2]" 1
585 1 34 VAL QG 1 35 VAL HA . . 4.130 3.277 2.981 4.186 0.056 9 0 "[ . 1 . 2]" 1
586 1 35 VAL H 1 35 VAL QG . . 3.510 2.265 1.826 2.724 . 0 0 "[ . 1 . 2]" 1
587 1 35 VAL H 1 36 ASN H . . 3.450 2.765 2.331 3.166 . 0 0 "[ . 1 . 2]" 1
588 1 35 VAL H 1 36 ASN HB2 . . 5.010 4.735 4.333 4.956 . 0 0 "[ . 1 . 2]" 1
589 1 35 VAL H 1 37 GLY H . . 4.830 3.887 3.577 4.017 . 0 0 "[ . 1 . 2]" 1
590 1 35 VAL H 1 70 MET ME . . 5.500 5.125 4.714 5.538 0.038 9 0 "[ . 1 . 2]" 1
591 1 35 VAL HA 1 35 VAL HB . . 2.750 2.668 2.501 3.022 0.272 1 0 "[ . 1 . 2]" 1
592 1 35 VAL HA 1 35 VAL MG1 . . 3.570 2.691 2.111 3.184 . 0 0 "[ . 1 . 2]" 1
593 1 35 VAL HA 1 35 VAL QG . . 2.770 2.121 1.980 2.223 . 0 0 "[ . 1 . 2]" 1
594 1 35 VAL HA 1 35 VAL MG2 . . 3.570 2.520 2.001 3.197 . 0 0 "[ . 1 . 2]" 1
595 1 35 VAL HB 1 36 ASN H . . 3.590 3.462 1.976 3.837 0.247 6 0 "[ . 1 . 2]" 1
596 1 35 VAL HB 1 37 GLY H . . 5.500 5.266 4.277 5.515 0.015 3 0 "[ . 1 . 2]" 1
597 1 35 VAL QG 1 36 ASN H . . 3.910 2.248 1.912 3.360 . 0 0 "[ . 1 . 2]" 1
598 1 35 VAL QG 1 36 ASN HB2 . . 4.050 3.209 2.691 4.168 0.118 15 0 "[ . 1 . 2]" 1
599 1 35 VAL QG 1 36 ASN HB3 . . 5.010 4.363 3.979 5.228 0.218 15 0 "[ . 1 . 2]" 1
600 1 36 ASN H 1 36 ASN HB3 . . 3.450 3.432 3.097 3.531 0.081 7 0 "[ . 1 . 2]" 1
601 1 36 ASN H 1 37 GLY H . . 3.430 2.261 1.891 2.690 . 0 0 "[ . 1 . 2]" 1
602 1 36 ASN H 1 38 LYS H . . 4.660 3.874 3.334 4.233 . 0 0 "[ . 1 . 2]" 1
603 1 36 ASN HB2 1 38 LYS QG . . 5.500 5.300 3.265 5.521 0.021 19 0 "[ . 1 . 2]" 1
604 1 36 ASN HB3 1 37 GLY H . . 4.280 3.616 3.345 3.961 . 0 0 "[ . 1 . 2]" 1
605 1 36 ASN HB3 1 38 LYS H . . 3.820 2.686 2.494 3.074 . 0 0 "[ . 1 . 2]" 1
606 1 36 ASN HB3 1 38 LYS QB . . 3.660 3.072 2.724 3.682 0.022 15 0 "[ . 1 . 2]" 1
607 1 36 ASN HB3 1 38 LYS QG . . 5.020 4.416 2.075 5.005 . 0 0 "[ . 1 . 2]" 1
608 1 37 GLY H 1 38 LYS H . . 3.690 2.598 2.319 2.893 . 0 0 "[ . 1 . 2]" 1
609 1 38 LYS H 1 38 LYS QB . . 3.000 2.546 2.283 3.023 0.023 15 0 "[ . 1 . 2]" 1
610 1 38 LYS H 1 38 LYS QD . . 5.180 4.478 4.068 4.756 . 0 0 "[ . 1 . 2]" 1
611 1 38 LYS H 1 38 LYS QG . . 4.150 3.859 2.308 4.095 . 0 0 "[ . 1 . 2]" 1
612 1 38 LYS H 1 39 SER H . . 5.210 4.205 3.965 4.538 . 0 0 "[ . 1 . 2]" 1
613 1 38 LYS HA 1 38 LYS QB . . 2.630 2.286 2.175 2.321 . 0 0 "[ . 1 . 2]" 1
614 1 38 LYS HA 1 38 LYS QG . . 3.310 3.072 2.585 3.357 0.047 15 0 "[ . 1 . 2]" 1
615 1 38 LYS HA 1 39 SER H . . 3.100 2.202 2.140 2.664 . 0 0 "[ . 1 . 2]" 1
616 1 38 LYS QB 1 39 SER H . . 4.120 3.666 2.085 3.914 . 0 0 "[ . 1 . 2]" 1
617 1 38 LYS QB 1 40 VAL QG . . 4.010 3.461 3.248 3.878 . 0 0 "[ . 1 . 2]" 1
618 1 38 LYS QD 1 38 LYS QE . . 2.400 2.049 1.987 2.091 . 0 0 "[ . 1 . 2]" 1
619 1 38 LYS QD 1 39 SER H . . 5.190 2.788 1.942 4.307 . 0 0 "[ . 1 . 2]" 1
620 1 38 LYS QD 1 39 SER HA . . 5.500 4.728 4.036 5.603 0.103 12 0 "[ . 1 . 2]" 1
621 1 38 LYS QD 1 40 VAL QG . . 4.200 3.537 1.690 4.221 0.021 3 0 "[ . 1 . 2]" 1
622 1 38 LYS QE 1 39 SER QB . . 5.500 5.021 3.454 5.534 0.034 15 0 "[ . 1 . 2]" 1
623 1 38 LYS QG 1 39 SER H . . 4.570 3.316 2.231 3.690 . 0 0 "[ . 1 . 2]" 1
624 1 38 LYS QG 1 40 VAL HB . . 5.350 5.178 4.789 5.472 0.122 15 0 "[ . 1 . 2]" 1
625 1 38 LYS QG 1 40 VAL QG . . 3.830 2.447 2.110 2.797 . 0 0 "[ . 1 . 2]" 1
626 1 39 SER H 1 39 SER QB . . 3.180 2.399 2.124 2.878 . 0 0 "[ . 1 . 2]" 1
627 1 39 SER HA 1 40 VAL H . . 3.200 2.146 2.138 2.182 . 0 0 "[ . 1 . 2]" 1
628 1 39 SER HA 1 40 VAL MG1 . . 5.500 4.349 4.087 5.404 . 0 0 "[ . 1 . 2]" 1
629 1 39 SER HA 1 40 VAL QG . . 4.100 3.323 3.208 3.428 . 0 0 "[ . 1 . 2]" 1
630 1 39 SER HA 1 40 VAL MG2 . . 5.500 3.463 3.320 3.603 . 0 0 "[ . 1 . 2]" 1
631 1 39 SER HA 1 41 GLY H . . 5.300 4.519 4.375 4.858 . 0 0 "[ . 1 . 2]" 1
632 1 39 SER QB 1 40 VAL H . . 3.920 3.363 3.034 3.562 . 0 0 "[ . 1 . 2]" 1
633 1 39 SER QB 1 41 GLY H . . 4.200 3.825 3.587 4.220 0.020 15 0 "[ . 1 . 2]" 1
634 1 40 VAL H 1 40 VAL HB . . 4.200 3.630 2.913 3.790 . 0 0 "[ . 1 . 2]" 1
635 1 40 VAL H 1 40 VAL MG1 . . 4.690 3.331 3.151 3.974 . 0 0 "[ . 1 . 2]" 1
636 1 40 VAL H 1 40 VAL QG . . 3.390 2.073 1.869 2.597 . 0 0 "[ . 1 . 2]" 1
637 1 40 VAL H 1 40 VAL MG2 . . 4.690 2.095 1.882 2.632 . 0 0 "[ . 1 . 2]" 1
638 1 40 VAL H 1 41 GLY H . . 3.380 3.293 3.038 3.431 0.051 8 0 "[ . 1 . 2]" 1
639 1 40 VAL H 1 70 MET ME . . 4.600 4.583 4.259 4.667 0.067 9 0 "[ . 1 . 2]" 1
640 1 40 VAL HB 1 41 GLY H . . 4.520 4.290 4.255 4.377 . 0 0 "[ . 1 . 2]" 1
641 1 40 VAL HB 1 74 SER HB2 . . 4.360 3.291 2.806 3.419 . 0 0 "[ . 1 . 2]" 1
642 1 40 VAL HB 1 74 SER HB3 . . 4.150 4.147 4.068 4.250 0.100 8 0 "[ . 1 . 2]" 1
643 1 40 VAL QG 1 41 GLY H . . 4.110 3.695 3.486 3.740 . 0 0 "[ . 1 . 2]" 1
644 1 40 VAL QG 1 70 MET ME . . 3.750 2.979 2.385 3.707 . 0 0 "[ . 1 . 2]" 1
645 1 40 VAL QG 1 70 MET QG . . 4.360 2.364 2.088 3.177 . 0 0 "[ . 1 . 2]" 1
646 1 40 VAL QG 1 74 SER HB2 . . 4.010 3.484 1.977 3.803 . 0 0 "[ . 1 . 2]" 1
647 1 40 VAL QG 1 74 SER HB3 . . 4.450 4.281 2.780 4.510 0.060 15 0 "[ . 1 . 2]" 1
648 1 40 VAL MG1 1 41 GLY H . . 5.080 4.206 3.659 4.293 . 0 0 "[ . 1 . 2]" 1
649 1 40 VAL MG1 1 74 SER HB2 . . 4.810 4.510 1.981 4.865 0.055 17 0 "[ . 1 . 2]" 1
650 1 40 VAL MG1 1 74 SER HB3 . . 5.210 4.995 2.790 5.259 0.049 18 0 "[ . 1 . 2]" 1
651 1 40 VAL MG2 1 41 GLY H . . 5.080 4.121 4.014 4.385 . 0 0 "[ . 1 . 2]" 1
652 1 40 VAL MG2 1 74 SER HB2 . . 4.810 3.831 3.571 4.379 . 0 0 "[ . 1 . 2]" 1
653 1 40 VAL MG2 1 74 SER HB3 . . 5.210 4.844 4.517 5.255 0.045 10 0 "[ . 1 . 2]" 1
654 1 41 GLY H 1 42 ALA H . . 4.640 4.087 4.052 4.100 . 0 0 "[ . 1 . 2]" 1
655 1 41 GLY H 1 42 ALA HA . . 5.500 4.865 4.859 4.882 . 0 0 "[ . 1 . 2]" 1
656 1 41 GLY HA2 1 42 ALA H . . 2.670 2.148 2.144 2.149 . 0 0 "[ . 1 . 2]" 1
657 1 41 GLY HA2 1 42 ALA MB . . 4.110 3.935 3.886 3.961 . 0 0 "[ . 1 . 2]" 1
658 1 41 GLY HA2 1 73 ILE MG . . 3.730 2.637 2.322 2.869 . 0 0 "[ . 1 . 2]" 1
659 1 41 GLY HA2 1 74 SER HA . . 3.440 2.287 1.997 2.767 . 0 0 "[ . 1 . 2]" 1
660 1 41 GLY HA3 1 73 ILE HB . . 4.400 3.320 3.008 3.479 . 0 0 "[ . 1 . 2]" 1
661 1 42 ALA H 1 43 ARG H . . 4.480 4.059 3.872 4.207 . 0 0 "[ . 1 . 2]" 1
662 1 42 ALA H 1 43 ARG HA . . 5.110 4.897 4.719 4.914 . 0 0 "[ . 1 . 2]" 1
663 1 42 ALA H 1 43 ARG QG . . 4.290 3.816 3.565 4.044 . 0 0 "[ . 1 . 2]" 1
664 1 42 ALA H 1 73 ILE MG . . 3.690 2.098 1.907 2.200 . 0 0 "[ . 1 . 2]" 1
665 1 42 ALA HA 1 43 ARG H . . 3.210 2.147 2.142 2.168 . 0 0 "[ . 1 . 2]" 1
666 1 42 ALA HA 1 43 ARG HB2 . . 4.620 4.241 4.149 4.380 . 0 0 "[ . 1 . 2]" 1
667 1 42 ALA HA 1 73 ILE MG . . 3.410 3.207 3.085 3.332 . 0 0 "[ . 1 . 2]" 1
668 1 42 ALA MB 1 43 ARG H . . 3.440 3.226 3.032 3.390 . 0 0 "[ . 1 . 2]" 1
669 1 42 ALA MB 1 73 ILE MG . . 3.840 3.737 3.686 3.791 . 0 0 "[ . 1 . 2]" 1
670 1 43 ARG H 1 43 ARG HB2 . . 3.180 2.783 2.583 2.800 . 0 0 "[ . 1 . 2]" 1
671 1 43 ARG H 1 44 ASP H . . 5.050 4.379 4.359 4.429 . 0 0 "[ . 1 . 2]" 1
672 1 43 ARG H 1 73 ILE MG . . 3.630 3.218 2.977 3.482 . 0 0 "[ . 1 . 2]" 1
673 1 43 ARG HA 1 43 ARG HD2 . . 5.120 2.997 1.993 4.670 . 0 0 "[ . 1 . 2]" 1
674 1 43 ARG HA 1 43 ARG QD . . 4.360 2.289 1.962 4.073 . 0 0 "[ . 1 . 2]" 1
675 1 43 ARG HA 1 43 ARG HD3 . . 5.120 2.657 1.991 4.486 . 0 0 "[ . 1 . 2]" 1
676 1 43 ARG HA 1 43 ARG QG . . 3.600 2.507 2.037 2.621 . 0 0 "[ . 1 . 2]" 1
677 1 43 ARG HA 1 44 ASP H . . 3.100 2.390 2.314 2.505 . 0 0 "[ . 1 . 2]" 1
678 1 43 ARG HA 1 73 ILE MG . . 5.120 3.723 3.566 3.946 . 0 0 "[ . 1 . 2]" 1
679 1 43 ARG HB2 1 43 ARG HD2 . . 4.210 3.713 3.569 4.160 . 0 0 "[ . 1 . 2]" 1
680 1 43 ARG HB2 1 43 ARG QD . . 3.570 3.280 2.422 3.531 . 0 0 "[ . 1 . 2]" 1
681 1 43 ARG HB2 1 43 ARG HD3 . . 4.210 3.747 2.461 4.227 0.017 5 0 "[ . 1 . 2]" 1
682 1 43 ARG HB2 1 44 ASP H . . 4.370 3.962 3.725 4.112 . 0 0 "[ . 1 . 2]" 1
683 1 43 ARG HB2 1 45 PHE QE . . 4.350 3.912 3.193 4.352 0.002 5 0 "[ . 1 . 2]" 1
684 1 43 ARG HB2 1 73 ILE HA . . 5.020 3.999 3.727 4.531 . 0 0 "[ . 1 . 2]" 1
685 1 43 ARG HB2 1 73 ILE MD . . 3.720 2.408 2.147 3.228 . 0 0 "[ . 1 . 2]" 1
686 1 43 ARG HB2 1 73 ILE MG . . 3.360 2.055 1.896 2.395 . 0 0 "[ . 1 . 2]" 1
687 1 43 ARG HB3 1 43 ARG HD2 . . 4.010 2.743 2.358 3.692 . 0 0 "[ . 1 . 2]" 1
688 1 43 ARG HB3 1 43 ARG QD . . 3.320 2.428 2.153 2.980 . 0 0 "[ . 1 . 2]" 1
689 1 43 ARG HB3 1 43 ARG HD3 . . 4.010 3.121 2.174 3.715 . 0 0 "[ . 1 . 2]" 1
690 1 43 ARG HB3 1 44 ASP HA . . 4.870 4.139 4.007 4.232 . 0 0 "[ . 1 . 2]" 1
691 1 43 ARG HB3 1 45 PHE QE . . 4.220 2.814 2.314 3.262 . 0 0 "[ . 1 . 2]" 1
692 1 43 ARG HB3 1 73 ILE MD . . 3.810 3.111 2.827 3.798 . 0 0 "[ . 1 . 2]" 1
693 1 43 ARG QD 1 73 ILE HA . . 4.420 4.067 1.972 4.432 0.012 17 0 "[ . 1 . 2]" 1
694 1 43 ARG HD2 1 45 PHE QE . . 5.470 3.727 2.769 5.434 . 0 0 "[ . 1 . 2]" 1
695 1 43 ARG HD2 1 73 ILE HA . . 5.100 4.724 2.001 5.131 0.031 12 0 "[ . 1 . 2]" 1
696 1 43 ARG HD3 1 45 PHE QE . . 5.470 4.378 2.012 5.219 . 0 0 "[ . 1 . 2]" 1
697 1 43 ARG HD3 1 73 ILE HA . . 5.100 4.554 2.984 5.114 0.014 8 0 "[ . 1 . 2]" 1
698 1 43 ARG QG 1 45 PHE QE . . 4.130 3.314 2.741 4.045 . 0 0 "[ . 1 . 2]" 1
699 1 43 ARG QG 1 73 ILE HA . . 2.880 2.410 1.991 2.593 . 0 0 "[ . 1 . 2]" 1
700 1 43 ARG QG 1 73 ILE MG . . 5.340 2.053 1.891 2.229 . 0 0 "[ . 1 . 2]" 1
701 1 43 ARG HG2 1 44 ASP H . . 4.430 4.188 3.274 4.407 . 0 0 "[ . 1 . 2]" 1
702 1 43 ARG HG2 1 73 ILE HA . . 3.390 2.841 2.620 3.498 0.108 18 0 "[ . 1 . 2]" 1
703 1 43 ARG HG3 1 44 ASP H . . 4.430 4.410 4.195 4.474 0.044 6 0 "[ . 1 . 2]" 1
704 1 43 ARG HG3 1 73 ILE HA . . 3.390 2.691 2.004 3.189 . 0 0 "[ . 1 . 2]" 1
705 1 44 ASP H 1 44 ASP QB . . 3.280 2.672 2.500 3.098 . 0 0 "[ . 1 . 2]" 1
706 1 44 ASP H 1 45 PHE H . . 5.500 4.129 3.914 4.327 . 0 0 "[ . 1 . 2]" 1
707 1 44 ASP H 1 73 ILE MD . . 5.500 5.264 4.804 5.570 0.070 18 0 "[ . 1 . 2]" 1
708 1 44 ASP H 1 73 ILE MG . . 5.500 5.188 4.925 5.459 . 0 0 "[ . 1 . 2]" 1
709 1 44 ASP HA 1 45 PHE H . . 3.220 2.153 2.138 2.183 . 0 0 "[ . 1 . 2]" 1
710 1 44 ASP QB 1 45 PHE H . . 3.850 3.564 3.107 3.859 0.009 16 0 "[ . 1 . 2]" 1
711 1 45 PHE H 1 45 PHE QD . . 4.120 2.829 2.506 3.080 . 0 0 "[ . 1 . 2]" 1
712 1 45 PHE HA 1 45 PHE QD . . 4.240 2.638 2.548 2.840 . 0 0 "[ . 1 . 2]" 1
713 1 45 PHE HA 1 46 ASP H . . 3.560 2.595 2.587 2.606 . 0 0 "[ . 1 . 2]" 1
714 1 45 PHE QB 1 46 ASP H . . 3.240 2.050 2.005 2.107 . 0 0 "[ . 1 . 2]" 1
715 1 45 PHE QB 1 47 SER H . . 3.750 3.214 2.910 3.401 . 0 0 "[ . 1 . 2]" 1
716 1 45 PHE QB 1 48 THR HA . . 5.340 4.547 4.332 4.759 . 0 0 "[ . 1 . 2]" 1
717 1 45 PHE QB 1 50 GLN HG3 . . 4.930 3.450 3.359 3.547 . 0 0 "[ . 1 . 2]" 1
718 1 45 PHE HB2 1 46 ASP H . . 4.030 3.554 3.490 3.625 . 0 0 "[ . 1 . 2]" 1
719 1 45 PHE HB3 1 46 ASP H . . 4.030 2.063 2.017 2.121 . 0 0 "[ . 1 . 2]" 1
720 1 45 PHE QD 1 46 ASP H . . 4.780 3.492 3.392 3.552 . 0 0 "[ . 1 . 2]" 1
721 1 45 PHE QD 1 47 SER H . . 4.370 4.004 3.822 4.202 . 0 0 "[ . 1 . 2]" 1
722 1 45 PHE QD 1 50 GLN HB2 . . 4.810 3.698 3.531 3.818 . 0 0 "[ . 1 . 2]" 1
723 1 45 PHE QD 1 50 GLN QB . . 4.170 3.571 3.427 3.669 . 0 0 "[ . 1 . 2]" 1
724 1 45 PHE QD 1 50 GLN HB3 . . 4.810 4.717 4.633 4.817 0.007 14 0 "[ . 1 . 2]" 1
725 1 45 PHE QD 1 50 GLN HG2 . . 4.370 3.643 3.566 3.688 . 0 0 "[ . 1 . 2]" 1
726 1 45 PHE QD 1 50 GLN HG3 . . 3.800 1.998 1.991 2.032 . 0 0 "[ . 1 . 2]" 1
727 1 45 PHE QE 1 54 TRP HB2 . . 4.330 2.930 2.673 3.227 . 0 0 "[ . 1 . 2]" 1
728 1 45 PHE QE 1 54 TRP HB3 . . 4.330 3.044 2.772 3.287 . 0 0 "[ . 1 . 2]" 1
729 1 45 PHE QE 1 55 PHE H . . 5.500 5.431 5.239 5.514 0.014 13 0 "[ . 1 . 2]" 1
730 1 46 ASP H 1 46 ASP HB2 . . 4.010 2.787 2.442 3.250 . 0 0 "[ . 1 . 2]" 1
731 1 46 ASP H 1 46 ASP HB3 . . 4.010 3.338 2.597 3.873 . 0 0 "[ . 1 . 2]" 1
732 1 46 ASP H 1 47 SER H . . 3.400 2.077 1.904 2.245 . 0 0 "[ . 1 . 2]" 1
733 1 46 ASP H 1 50 GLN HG2 . . 4.480 4.201 4.072 4.362 . 0 0 "[ . 1 . 2]" 1
734 1 46 ASP QB 1 47 SER H . . 3.760 2.438 2.261 2.576 . 0 0 "[ . 1 . 2]" 1
735 1 46 ASP HB2 1 47 SER H . . 4.450 2.999 2.301 3.919 . 0 0 "[ . 1 . 2]" 1
736 1 46 ASP HB3 1 47 SER H . . 4.450 3.059 2.316 3.813 . 0 0 "[ . 1 . 2]" 1
737 1 47 SER H 1 48 THR HA . . 5.160 5.125 5.028 5.179 0.019 1 0 "[ . 1 . 2]" 1
738 1 47 SER H 1 50 GLN H . . 4.760 4.564 4.456 4.684 . 0 0 "[ . 1 . 2]" 1
739 1 47 SER H 1 50 GLN HB2 . . 5.450 5.341 5.013 5.457 0.007 6 0 "[ . 1 . 2]" 1
740 1 47 SER H 1 50 GLN QB . . 4.790 4.626 4.360 4.759 . 0 0 "[ . 1 . 2]" 1
741 1 47 SER H 1 50 GLN HB3 . . 5.450 5.070 4.792 5.250 . 0 0 "[ . 1 . 2]" 1
742 1 47 SER H 1 50 GLN HG2 . . 3.780 2.901 2.801 3.057 . 0 0 "[ . 1 . 2]" 1
743 1 47 SER H 1 50 GLN HG3 . . 3.860 3.362 3.215 3.487 . 0 0 "[ . 1 . 2]" 1
744 1 47 SER HA 1 49 GLU H . . 4.500 3.985 3.854 4.301 . 0 0 "[ . 1 . 2]" 1
745 1 47 SER QB 1 48 THR H . . 3.880 3.161 2.758 3.594 . 0 0 "[ . 1 . 2]" 1
746 1 47 SER QB 1 49 GLU H . . 3.580 2.903 2.444 3.244 . 0 0 "[ . 1 . 2]" 1
747 1 47 SER QB 1 49 GLU HB3 . . 4.270 3.196 2.923 3.450 . 0 0 "[ . 1 . 2]" 1
748 1 47 SER QB 1 50 GLN H . . 3.510 2.726 2.415 3.164 . 0 0 "[ . 1 . 2]" 1
749 1 47 SER HB2 1 48 THR H . . 4.480 3.994 2.964 4.306 . 0 0 "[ . 1 . 2]" 1
750 1 47 SER HB3 1 48 THR H . . 4.480 3.356 2.809 3.878 . 0 0 "[ . 1 . 2]" 1
751 1 48 THR H 1 48 THR MG . . 4.660 3.417 2.197 3.775 . 0 0 "[ . 1 . 2]" 1
752 1 48 THR H 1 49 GLU H . . 4.310 2.572 2.480 2.664 . 0 0 "[ . 1 . 2]" 1
753 1 48 THR HA 1 48 THR MG . . 3.440 2.280 1.968 3.200 . 0 0 "[ . 1 . 2]" 1
754 1 48 THR HA 1 51 LEU H . . 4.030 3.240 3.138 3.392 . 0 0 "[ . 1 . 2]" 1
755 1 48 THR HA 1 52 GLU H . . 4.310 4.280 3.795 4.351 0.041 14 0 "[ . 1 . 2]" 1
756 1 48 THR HA 1 52 GLU QG . . 5.340 4.546 4.230 4.745 . 0 0 "[ . 1 . 2]" 1
757 1 48 THR MG 1 49 GLU H . . 4.880 3.817 2.160 4.262 . 0 0 "[ . 1 . 2]" 1
758 1 48 THR MG 1 52 GLU H . . 4.810 4.049 3.447 4.799 . 0 0 "[ . 1 . 2]" 1
759 1 48 THR MG 1 52 GLU HG2 . . 4.320 3.742 2.813 4.319 . 0 0 "[ . 1 . 2]" 1
760 1 48 THR MG 1 52 GLU QG . . 3.650 3.189 2.779 3.678 0.028 8 0 "[ . 1 . 2]" 1
761 1 48 THR MG 1 52 GLU HG3 . . 4.320 3.814 2.970 4.360 0.040 11 0 "[ . 1 . 2]" 1
762 1 49 GLU H 1 49 GLU HB2 . . 2.460 2.301 2.155 2.451 . 0 0 "[ . 1 . 2]" 1
763 1 49 GLU H 1 49 GLU HB3 . . 3.720 2.780 2.603 2.987 . 0 0 "[ . 1 . 2]" 1
764 1 49 GLU H 1 49 GLU QG . . 4.040 3.928 3.812 4.007 . 0 0 "[ . 1 . 2]" 1
765 1 49 GLU H 1 50 GLN H . . 3.720 2.923 2.739 2.993 . 0 0 "[ . 1 . 2]" 1
766 1 49 GLU HA 1 49 GLU HB2 . . 2.740 2.565 2.470 2.673 . 0 0 "[ . 1 . 2]" 1
767 1 49 GLU HA 1 49 GLU QG . . 2.400 2.318 2.193 2.401 0.001 14 0 "[ . 1 . 2]" 1
768 1 49 GLU HA 1 52 GLU H . . 4.310 4.057 3.752 4.313 0.003 6 0 "[ . 1 . 2]" 1
769 1 49 GLU HB2 1 50 GLN H . . 4.370 3.541 3.305 3.689 . 0 0 "[ . 1 . 2]" 1
770 1 49 GLU HB3 1 50 GLN H . . 2.830 2.255 2.147 2.369 . 0 0 "[ . 1 . 2]" 1
771 1 49 GLU HB3 1 50 GLN HA . . 4.730 4.053 3.866 4.240 . 0 0 "[ . 1 . 2]" 1
772 1 49 GLU QG 1 50 GLN H . . 4.270 3.675 3.291 4.074 . 0 0 "[ . 1 . 2]" 1
773 1 49 GLU QG 1 50 GLN HA . . 4.740 3.980 3.573 4.611 . 0 0 "[ . 1 . 2]" 1
774 1 50 GLN H 1 50 GLN HG2 . . 2.460 2.087 2.026 2.224 . 0 0 "[ . 1 . 2]" 1
775 1 50 GLN H 1 50 GLN HG3 . . 3.440 2.725 2.646 2.831 . 0 0 "[ . 1 . 2]" 1
776 1 50 GLN H 1 51 LEU H . . 3.660 2.587 2.495 2.709 . 0 0 "[ . 1 . 2]" 1
777 1 50 GLN H 1 52 GLU H . . 4.900 4.814 4.623 4.904 0.004 9 0 "[ . 1 . 2]" 1
778 1 50 GLN HA 1 50 GLN QB . . 2.420 2.177 2.175 2.179 . 0 0 "[ . 1 . 2]" 1
779 1 50 GLN HA 1 50 GLN HG3 . . 3.690 3.681 3.639 3.704 0.014 14 0 "[ . 1 . 2]" 1
780 1 50 GLN QB 1 51 LEU H . . 4.210 3.559 3.468 3.601 . 0 0 "[ . 1 . 2]" 1
781 1 50 GLN HG2 1 51 LEU H . . 4.010 3.341 3.188 3.427 . 0 0 "[ . 1 . 2]" 1
782 1 50 GLN HG3 1 51 LEU H . . 3.800 2.315 2.155 2.426 . 0 0 "[ . 1 . 2]" 1
783 1 50 GLN HG3 1 51 LEU HA . . 4.150 3.553 3.439 3.708 . 0 0 "[ . 1 . 2]" 1
784 1 51 LEU H 1 51 LEU QB . . 3.240 2.151 2.100 2.205 . 0 0 "[ . 1 . 2]" 1
785 1 51 LEU H 1 52 GLU H . . 3.720 2.927 2.716 3.035 . 0 0 "[ . 1 . 2]" 1
786 1 51 LEU H 1 53 SER H . . 4.490 3.870 3.621 4.076 . 0 0 "[ . 1 . 2]" 1
787 1 52 GLU H 1 52 GLU HA . . 2.870 2.825 2.794 2.848 . 0 0 "[ . 1 . 2]" 1
788 1 52 GLU H 1 52 GLU QB . . 3.020 2.552 2.443 2.659 . 0 0 "[ . 1 . 2]" 1
789 1 52 GLU H 1 52 GLU HG2 . . 3.650 2.657 1.944 3.520 . 0 0 "[ . 1 . 2]" 1
790 1 52 GLU H 1 52 GLU HG3 . . 3.650 2.594 1.953 3.641 . 0 0 "[ . 1 . 2]" 1
791 1 52 GLU H 1 53 SER H . . 3.740 2.596 2.511 2.685 . 0 0 "[ . 1 . 2]" 1
792 1 52 GLU H 1 53 SER QB . . 5.150 4.344 4.256 4.436 . 0 0 "[ . 1 . 2]" 1
793 1 52 GLU HA 1 52 GLU QB . . 2.400 2.303 2.172 2.370 . 0 0 "[ . 1 . 2]" 1
794 1 52 GLU HA 1 52 GLU HG2 . . 3.850 3.000 2.449 3.913 0.063 12 0 "[ . 1 . 2]" 1
795 1 52 GLU HA 1 52 GLU QG . . 3.360 2.793 2.404 3.329 . 0 0 "[ . 1 . 2]" 1
796 1 52 GLU HA 1 52 GLU HG3 . . 3.850 3.482 2.920 3.845 . 0 0 "[ . 1 . 2]" 1
797 1 52 GLU HA 1 55 PHE H . . 4.250 3.510 3.364 3.713 . 0 0 "[ . 1 . 2]" 1
798 1 52 GLU HA 1 55 PHE HB2 . . 4.910 4.492 4.311 4.676 . 0 0 "[ . 1 . 2]" 1
799 1 52 GLU HA 1 55 PHE HB3 . . 3.660 3.347 3.213 3.490 . 0 0 "[ . 1 . 2]" 1
800 1 52 GLU HA 1 55 PHE QD . . 4.640 4.602 4.364 4.679 0.039 6 0 "[ . 1 . 2]" 1
801 1 52 GLU HA 1 56 TYR H . . 4.870 4.591 4.360 4.895 0.025 11 0 "[ . 1 . 2]" 1
802 1 52 GLU QB 1 53 SER H . . 3.530 2.882 2.531 3.542 0.012 12 0 "[ . 1 . 2]" 1
803 1 53 SER H 1 53 SER HB2 . . 3.730 2.472 2.226 3.018 . 0 0 "[ . 1 . 2]" 1
804 1 53 SER H 1 53 SER QB . . 3.120 2.231 2.109 2.286 . 0 0 "[ . 1 . 2]" 1
805 1 53 SER H 1 53 SER HB3 . . 3.730 2.637 2.153 2.900 . 0 0 "[ . 1 . 2]" 1
806 1 53 SER H 1 54 TRP H . . 3.750 2.595 2.421 2.767 . 0 0 "[ . 1 . 2]" 1
807 1 53 SER H 1 56 TYR QB . . 4.720 4.422 4.177 4.645 . 0 0 "[ . 1 . 2]" 1
808 1 53 SER HA 1 56 TYR H . . 4.740 3.466 3.327 3.554 . 0 0 "[ . 1 . 2]" 1
809 1 53 SER HA 1 56 TYR HB2 . . 4.810 3.836 3.576 4.053 . 0 0 "[ . 1 . 2]" 1
810 1 53 SER HA 1 56 TYR QB . . 3.980 2.317 2.129 2.443 . 0 0 "[ . 1 . 2]" 1
811 1 53 SER HA 1 56 TYR HB3 . . 4.810 2.336 2.140 2.463 . 0 0 "[ . 1 . 2]" 1
812 1 53 SER QB 1 54 TRP H . . 3.620 2.870 2.472 3.144 . 0 0 "[ . 1 . 2]" 1
813 1 54 TRP H 1 54 TRP HB2 . . 3.500 2.964 2.825 3.026 . 0 0 "[ . 1 . 2]" 1
814 1 54 TRP H 1 54 TRP HB3 . . 3.500 2.197 2.161 2.269 . 0 0 "[ . 1 . 2]" 1
815 1 54 TRP H 1 55 PHE H . . 3.840 2.683 2.588 2.933 . 0 0 "[ . 1 . 2]" 1
816 1 54 TRP HA 1 54 TRP HE3 . . 2.610 2.325 2.174 2.462 . 0 0 "[ . 1 . 2]" 1
817 1 54 TRP QB 1 54 TRP HE3 . . 3.630 2.983 2.913 3.037 . 0 0 "[ . 1 . 2]" 1
818 1 54 TRP HB2 1 55 PHE H . . 4.190 3.947 3.886 4.020 . 0 0 "[ . 1 . 2]" 1
819 1 54 TRP HB3 1 55 PHE H . . 4.190 2.621 2.503 2.753 . 0 0 "[ . 1 . 2]" 1
820 1 54 TRP HD1 1 55 PHE H . . 3.950 3.511 3.430 3.602 . 0 0 "[ . 1 . 2]" 1
821 1 54 TRP HD1 1 55 PHE HA . . 4.540 4.447 4.268 4.557 0.017 1 0 "[ . 1 . 2]" 1
822 1 54 TRP HD1 1 55 PHE HB2 . . 4.020 3.624 3.539 3.725 . 0 0 "[ . 1 . 2]" 1
823 1 54 TRP HD1 1 55 PHE HB3 . . 4.800 4.829 4.816 4.850 0.050 14 0 "[ . 1 . 2]" 1
824 1 54 TRP HE1 1 58 LEU MD2 . . 5.500 5.176 4.741 5.495 . 0 0 "[ . 1 . 2]" 1
825 1 54 TRP HE1 1 72 GLU QB . . 4.680 4.283 3.782 4.603 . 0 0 "[ . 1 . 2]" 1
826 1 54 TRP HE3 1 58 LEU MD2 . . 5.340 3.990 3.476 4.341 . 0 0 "[ . 1 . 2]" 1
827 1 54 TRP HH2 1 58 LEU MD1 . . 4.910 3.553 3.208 4.003 . 0 0 "[ . 1 . 2]" 1
828 1 54 TRP HH2 1 68 ASN QB . . 4.560 4.581 4.546 4.615 0.055 18 0 "[ . 1 . 2]" 1
829 1 54 TRP HH2 1 69 ALA HA . . 3.950 3.097 2.767 3.369 . 0 0 "[ . 1 . 2]" 1
830 1 54 TRP HH2 1 69 ALA MB . . 4.520 4.309 4.121 4.446 . 0 0 "[ . 1 . 2]" 1
831 1 54 TRP HH2 1 72 GLU QB . . 3.440 2.408 2.116 2.741 . 0 0 "[ . 1 . 2]" 1
832 1 54 TRP HZ2 1 58 LEU MD1 . . 4.860 3.272 2.976 3.508 . 0 0 "[ . 1 . 2]" 1
833 1 54 TRP HZ2 1 58 LEU MD2 . . 5.500 3.375 3.012 3.673 . 0 0 "[ . 1 . 2]" 1
834 1 54 TRP HZ2 1 69 ALA HA . . 4.320 1.993 1.976 2.020 . 0 0 "[ . 1 . 2]" 1
835 1 54 TRP HZ2 1 69 ALA MB . . 4.250 2.898 2.670 3.163 . 0 0 "[ . 1 . 2]" 1
836 1 54 TRP HZ2 1 72 GLU QB . . 2.740 2.066 1.917 2.312 . 0 0 "[ . 1 . 2]" 1
837 1 54 TRP HZ2 1 72 GLU QG . . 3.840 3.311 2.715 3.844 0.004 2 0 "[ . 1 . 2]" 1
838 1 54 TRP HZ3 1 69 ALA MB . . 5.500 5.495 5.384 5.544 0.044 14 0 "[ . 1 . 2]" 1
839 1 55 PHE H 1 55 PHE HB2 . . 3.540 2.658 2.587 2.712 . 0 0 "[ . 1 . 2]" 1
840 1 55 PHE H 1 55 PHE HB3 . . 3.550 2.452 2.402 2.515 . 0 0 "[ . 1 . 2]" 1
841 1 55 PHE H 1 55 PHE QD . . 4.420 4.188 4.170 4.199 . 0 0 "[ . 1 . 2]" 1
842 1 55 PHE H 1 56 TYR H . . 4.080 2.543 2.495 2.561 . 0 0 "[ . 1 . 2]" 1
843 1 55 PHE HA 1 55 PHE QD . . 3.450 2.599 2.377 2.810 . 0 0 "[ . 1 . 2]" 1
844 1 55 PHE HA 1 58 LEU H . . 4.830 4.337 3.752 4.861 0.031 20 0 "[ . 1 . 2]" 1
845 1 55 PHE HA 1 58 LEU HB2 . . 5.500 4.043 3.523 4.397 . 0 0 "[ . 1 . 2]" 1
846 1 55 PHE HA 1 58 LEU HB3 . . 5.500 5.342 4.924 5.593 0.093 4 0 "[ . 1 . 2]" 1
847 1 55 PHE HA 1 58 LEU MD1 . . 3.330 2.031 1.907 2.364 . 0 0 "[ . 1 . 2]" 1
848 1 55 PHE HA 1 58 LEU MD2 . . 4.890 4.520 4.380 4.764 . 0 0 "[ . 1 . 2]" 1
849 1 55 PHE HA 1 58 LEU HG . . 3.820 3.581 3.279 3.807 . 0 0 "[ . 1 . 2]" 1
850 1 55 PHE HA 1 65 ARG QG . . 5.340 5.073 4.631 5.395 0.055 14 0 "[ . 1 . 2]" 1
851 1 55 PHE HA 1 69 ALA MB . . 4.070 3.445 3.093 3.739 . 0 0 "[ . 1 . 2]" 1
852 1 55 PHE HB2 1 56 TYR H . . 4.570 4.316 4.282 4.340 . 0 0 "[ . 1 . 2]" 1
853 1 55 PHE HB2 1 69 ALA MB . . 5.500 4.058 3.680 4.324 . 0 0 "[ . 1 . 2]" 1
854 1 55 PHE HB3 1 56 TYR H . . 3.700 3.410 3.394 3.427 . 0 0 "[ . 1 . 2]" 1
855 1 55 PHE QD 1 56 TYR H . . 4.480 4.414 4.245 4.499 0.019 15 0 "[ . 1 . 2]" 1
856 1 55 PHE QD 1 56 TYR HA . . 5.500 4.253 3.932 4.541 . 0 0 "[ . 1 . 2]" 1
857 1 55 PHE QD 1 58 LEU MD1 . . 4.420 2.867 2.639 3.268 . 0 0 "[ . 1 . 2]" 1
858 1 55 PHE QD 1 69 ALA MB . . 3.460 2.581 2.214 2.764 . 0 0 "[ . 1 . 2]" 1
859 1 55 PHE QE 1 65 ARG HD2 . . 4.610 2.972 2.656 3.561 . 0 0 "[ . 1 . 2]" 1
860 1 55 PHE QE 1 65 ARG QD . . 3.910 2.875 2.525 3.298 . 0 0 "[ . 1 . 2]" 1
861 1 55 PHE QE 1 65 ARG HD3 . . 4.610 3.998 3.078 4.617 0.007 18 0 "[ . 1 . 2]" 1
862 1 55 PHE QE 1 65 ARG HG2 . . 5.500 4.076 3.259 4.934 . 0 0 "[ . 1 . 2]" 1
863 1 55 PHE QE 1 65 ARG QG . . 4.650 3.205 2.266 4.364 . 0 0 "[ . 1 . 2]" 1
864 1 55 PHE QE 1 65 ARG HG3 . . 5.500 3.484 2.289 4.971 . 0 0 "[ . 1 . 2]" 1
865 1 55 PHE QE 1 69 ALA MB . . 3.440 3.266 2.755 3.471 0.031 11 0 "[ . 1 . 2]" 1
866 1 55 PHE HZ 1 65 ARG QD . . 5.340 3.210 2.624 4.244 . 0 0 "[ . 1 . 2]" 1
867 1 56 TYR H 1 56 TYR QB . . 3.390 2.357 2.310 2.484 . 0 0 "[ . 1 . 2]" 1
868 1 56 TYR H 1 56 TYR QD . . 4.260 4.098 4.028 4.305 0.045 1 0 "[ . 1 . 2]" 1
869 1 56 TYR H 1 57 GLY H . . 3.820 2.418 1.977 3.983 0.163 4 0 "[ . 1 . 2]" 1
870 1 56 TYR H 1 58 LEU H . . 4.680 4.047 3.627 4.432 . 0 0 "[ . 1 . 2]" 1
871 1 56 TYR HA 1 56 TYR QD . . 3.210 3.018 2.141 3.116 . 0 0 "[ . 1 . 2]" 1
872 1 56 TYR HA 1 58 LEU H . . 4.430 3.760 3.431 4.161 . 0 0 "[ . 1 . 2]" 1
873 1 56 TYR HA 1 65 ARG HD2 . . 5.080 4.743 4.064 5.106 0.026 5 0 "[ . 1 . 2]" 1
874 1 56 TYR HA 1 65 ARG HD3 . . 5.080 4.406 3.756 5.058 . 0 0 "[ . 1 . 2]" 1
875 1 56 TYR QB 1 57 GLY H . . 4.340 3.230 2.921 4.024 . 0 0 "[ . 1 . 2]" 1
876 1 56 TYR QD 1 57 GLY HA2 . . 4.010 3.303 3.109 3.608 . 0 0 "[ . 1 . 2]" 1
877 1 56 TYR QD 1 57 GLY HA3 . . 4.090 3.927 3.590 4.295 0.205 13 0 "[ . 1 . 2]" 1
878 1 56 TYR QE 1 57 GLY HA2 . . 4.320 4.364 4.246 4.481 0.161 6 0 "[ . 1 . 2]" 1
879 1 57 GLY H 1 57 GLY HA2 . . 2.870 2.844 2.591 2.928 0.058 8 0 "[ . 1 . 2]" 1
880 1 57 GLY H 1 58 LEU H . . 3.520 2.559 1.886 3.088 . 0 0 "[ . 1 . 2]" 1
881 1 57 GLY H 1 58 LEU HG . . 4.380 4.161 3.731 4.428 0.048 13 0 "[ . 1 . 2]" 1
882 1 58 LEU H 1 58 LEU HB2 . . 3.540 2.377 2.297 2.548 . 0 0 "[ . 1 . 2]" 1
883 1 58 LEU H 1 58 LEU HB3 . . 3.770 3.586 3.550 3.658 . 0 0 "[ . 1 . 2]" 1
884 1 58 LEU H 1 58 LEU MD1 . . 4.100 3.433 3.077 3.949 . 0 0 "[ . 1 . 2]" 1
885 1 58 LEU H 1 58 LEU MD2 . . 4.280 3.983 3.348 4.307 0.027 20 0 "[ . 1 . 2]" 1
886 1 58 LEU H 1 58 LEU HG . . 3.360 2.787 2.126 3.363 0.003 12 0 "[ . 1 . 2]" 1
887 1 58 LEU H 1 65 ARG QD . . 4.940 4.045 3.301 4.669 . 0 0 "[ . 1 . 2]" 1
888 1 58 LEU HA 1 58 LEU MD1 . . 4.100 3.859 3.822 3.923 . 0 0 "[ . 1 . 2]" 1
889 1 58 LEU HA 1 58 LEU MD2 . . 3.370 2.460 2.237 2.656 . 0 0 "[ . 1 . 2]" 1
890 1 58 LEU HA 1 58 LEU HG . . 3.990 2.709 2.558 3.013 . 0 0 "[ . 1 . 2]" 1
891 1 58 LEU HA 1 59 PRO HD2 . . 3.390 2.430 2.294 2.484 . 0 0 "[ . 1 . 2]" 1
892 1 58 LEU HA 1 59 PRO HD3 . . 3.480 2.313 2.267 2.336 . 0 0 "[ . 1 . 2]" 1
893 1 58 LEU HB2 1 58 LEU MD1 . . 3.410 2.170 2.009 2.309 . 0 0 "[ . 1 . 2]" 1
894 1 58 LEU HB2 1 58 LEU MD2 . . 3.610 3.136 3.099 3.175 . 0 0 "[ . 1 . 2]" 1
895 1 58 LEU HB2 1 59 PRO HD2 . . 3.750 3.628 3.558 3.753 0.003 2 0 "[ . 1 . 2]" 1
896 1 58 LEU HB2 1 59 PRO HD3 . . 4.860 4.699 4.648 4.769 . 0 0 "[ . 1 . 2]" 1
897 1 58 LEU HB2 1 65 ARG QD . . 4.470 2.551 1.962 3.314 . 0 0 "[ . 1 . 2]" 1
898 1 58 LEU HB2 1 68 ASN QB . . 4.510 4.468 4.173 4.553 0.043 10 0 "[ . 1 . 2]" 1
899 1 58 LEU HB2 1 69 ALA H . . 5.490 5.393 5.204 5.525 0.035 2 0 "[ . 1 . 2]" 1
900 1 58 LEU HB3 1 58 LEU MD1 . . 3.450 2.571 2.410 2.715 . 0 0 "[ . 1 . 2]" 1
901 1 58 LEU HB3 1 58 LEU MD2 . . 3.570 2.086 1.990 2.205 . 0 0 "[ . 1 . 2]" 1
902 1 58 LEU HB3 1 59 PRO HD2 . . 3.880 2.022 1.969 2.219 . 0 0 "[ . 1 . 2]" 1
903 1 58 LEU HB3 1 59 PRO HD3 . . 3.810 3.464 3.416 3.634 . 0 0 "[ . 1 . 2]" 1
904 1 58 LEU HB3 1 68 ASN QB . . 3.670 3.255 3.042 3.422 . 0 0 "[ . 1 . 2]" 1
905 1 58 LEU HB3 1 69 ALA H . . 5.050 4.760 4.479 4.996 . 0 0 "[ . 1 . 2]" 1
906 1 58 LEU HB3 1 69 ALA HA . . 5.500 5.433 5.315 5.520 0.020 17 0 "[ . 1 . 2]" 1
907 1 58 LEU MD1 1 65 ARG QD . . 4.200 2.649 2.243 3.139 . 0 0 "[ . 1 . 2]" 1
908 1 58 LEU MD1 1 65 ARG HG2 . . 4.550 3.672 2.006 4.562 0.012 14 0 "[ . 1 . 2]" 1
909 1 58 LEU MD1 1 65 ARG HG3 . . 4.550 3.642 2.795 4.565 0.015 18 0 "[ . 1 . 2]" 1
910 1 58 LEU MD1 1 68 ASN QB . . 3.780 3.057 2.679 3.320 . 0 0 "[ . 1 . 2]" 1
911 1 58 LEU MD1 1 69 ALA H . . 4.140 2.823 2.561 3.230 . 0 0 "[ . 1 . 2]" 1
912 1 58 LEU MD1 1 69 ALA HA . . 3.160 2.513 2.122 2.860 . 0 0 "[ . 1 . 2]" 1
913 1 58 LEU MD1 1 69 ALA MB . . 3.030 1.877 1.719 2.241 . 0 0 "[ . 1 . 2]" 1
914 1 58 LEU MD1 1 70 MET H . . 5.010 4.641 4.466 5.020 0.010 1 0 "[ . 1 . 2]" 1
915 1 58 LEU MD1 1 72 GLU QB . . 4.320 4.240 4.002 4.339 0.019 20 0 "[ . 1 . 2]" 1
916 1 58 LEU MD1 1 72 GLU QG . . 4.890 4.707 3.571 4.938 0.048 13 0 "[ . 1 . 2]" 1
917 1 58 LEU MD2 1 59 PRO HD2 . . 4.140 2.022 1.912 2.440 . 0 0 "[ . 1 . 2]" 1
918 1 58 LEU MD2 1 59 PRO HD3 . . 4.040 3.011 2.724 3.445 . 0 0 "[ . 1 . 2]" 1
919 1 58 LEU MD2 1 68 ASN QB . . 3.850 2.272 1.897 2.855 . 0 0 "[ . 1 . 2]" 1
920 1 58 LEU MD2 1 69 ALA HA . . 4.310 2.714 2.348 3.032 . 0 0 "[ . 1 . 2]" 1
921 1 58 LEU MD2 1 69 ALA MB . . 3.640 3.261 2.802 3.623 . 0 0 "[ . 1 . 2]" 1
922 1 58 LEU MD2 1 72 GLU QB . . 3.630 3.555 3.162 3.725 0.095 18 0 "[ . 1 . 2]" 1
923 1 58 LEU MD2 1 72 GLU QG . . 3.950 3.370 2.388 3.934 . 0 0 "[ . 1 . 2]" 1
924 1 59 PRO QB 1 60 GLY H . . 3.860 3.019 2.841 3.589 . 0 0 "[ . 1 . 2]" 1
925 1 59 PRO HB2 1 60 GLY H . . 4.470 3.126 2.919 3.799 . 0 0 "[ . 1 . 2]" 1
926 1 59 PRO HB3 1 60 GLY H . . 4.470 4.023 3.903 4.413 . 0 0 "[ . 1 . 2]" 1
927 1 60 GLY QA 1 65 ARG H . . 4.480 3.214 2.555 3.933 . 0 0 "[ . 1 . 2]" 1
928 1 60 GLY HA2 1 65 ARG H . . 5.280 4.507 3.792 5.302 0.022 15 0 "[ . 1 . 2]" 1
929 1 60 GLY HA3 1 65 ARG H . . 5.280 3.293 2.597 4.066 . 0 0 "[ . 1 . 2]" 1
930 1 61 SER H 1 61 SER QB . . 3.200 2.944 2.495 3.202 0.002 12 0 "[ . 1 . 2]" 1
931 1 61 SER H 1 64 GLY QA . . 3.580 2.810 2.231 3.592 0.012 17 0 "[ . 1 . 2]" 1
932 1 61 SER H 1 65 ARG H . . 4.390 3.232 2.486 3.741 . 0 0 "[ . 1 . 2]" 1
933 1 61 SER HA 1 65 ARG HB2 . . 5.500 4.918 3.671 5.522 0.022 11 0 "[ . 1 . 2]" 1
934 1 61 SER HA 1 65 ARG QB . . 4.720 3.907 3.372 4.678 . 0 0 "[ . 1 . 2]" 1
935 1 61 SER HA 1 65 ARG HB3 . . 5.500 4.514 3.426 5.546 0.046 15 0 "[ . 1 . 2]" 1
936 1 63 LEU HA 1 63 LEU MD1 . . 3.940 3.413 2.575 3.956 0.016 15 0 "[ . 1 . 2]" 1
937 1 63 LEU HA 1 63 LEU MD2 . . 3.610 3.204 2.339 3.696 0.086 7 0 "[ . 1 . 2]" 1
938 1 63 LEU HA 1 63 LEU HG . . 2.810 2.492 2.152 2.935 0.125 15 0 "[ . 1 . 2]" 1
939 1 63 LEU HA 1 66 ILE H . . 4.160 3.671 3.427 4.049 . 0 0 "[ . 1 . 2]" 1
940 1 63 LEU HA 1 66 ILE HB . . 3.830 3.801 3.313 3.927 0.097 13 0 "[ . 1 . 2]" 1
941 1 63 LEU HA 1 66 ILE MD . . 4.600 2.982 2.128 4.002 . 0 0 "[ . 1 . 2]" 1
942 1 63 LEU HA 1 66 ILE QG . . 2.730 2.050 1.888 2.549 . 0 0 "[ . 1 . 2]" 1
943 1 63 LEU HA 1 66 ILE MG . . 4.670 4.439 4.036 4.693 0.023 7 0 "[ . 1 . 2]" 1
944 1 63 LEU QB 1 64 GLY H . . 4.130 3.255 2.807 3.702 . 0 0 "[ . 1 . 2]" 1
945 1 63 LEU MD2 1 66 ILE HB . . 5.500 4.961 4.430 5.506 0.006 17 0 "[ . 1 . 2]" 1
946 1 63 LEU HG 1 64 GLY H . . 5.270 4.806 4.392 5.113 . 0 0 "[ . 1 . 2]" 1
947 1 64 GLY H 1 65 ARG H . . 3.680 2.422 2.001 2.718 . 0 0 "[ . 1 . 2]" 1
948 1 64 GLY H 1 65 ARG QG . . 4.770 4.127 3.168 4.828 0.058 17 0 "[ . 1 . 2]" 1
949 1 65 ARG H 1 65 ARG HB2 . . 3.680 2.994 2.136 3.598 . 0 0 "[ . 1 . 2]" 1
950 1 65 ARG H 1 65 ARG QB . . 3.200 2.338 2.116 2.628 . 0 0 "[ . 1 . 2]" 1
951 1 65 ARG H 1 65 ARG HB3 . . 3.680 2.931 2.292 3.584 . 0 0 "[ . 1 . 2]" 1
952 1 65 ARG H 1 65 ARG HD2 . . 5.500 4.629 4.043 5.034 . 0 0 "[ . 1 . 2]" 1
953 1 65 ARG H 1 65 ARG QD . . 4.660 4.118 3.751 4.517 . 0 0 "[ . 1 . 2]" 1
954 1 65 ARG H 1 65 ARG HD3 . . 5.500 4.756 3.917 5.400 . 0 0 "[ . 1 . 2]" 1
955 1 65 ARG H 1 65 ARG HG2 . . 4.610 2.975 1.916 4.293 . 0 0 "[ . 1 . 2]" 1
956 1 65 ARG H 1 65 ARG QG . . 3.910 2.492 1.897 3.182 . 0 0 "[ . 1 . 2]" 1
957 1 65 ARG H 1 65 ARG HG3 . . 4.610 3.235 2.157 3.862 . 0 0 "[ . 1 . 2]" 1
958 1 65 ARG H 1 66 ILE H . . 3.570 2.558 2.438 2.697 . 0 0 "[ . 1 . 2]" 1
959 1 65 ARG H 1 66 ILE HA . . 5.140 5.046 4.925 5.202 0.062 14 0 "[ . 1 . 2]" 1
960 1 65 ARG H 1 66 ILE HB . . 4.940 4.942 4.850 5.009 0.069 5 0 "[ . 1 . 2]" 1
961 1 65 ARG H 1 66 ILE QG . . 4.240 3.783 3.308 4.174 . 0 0 "[ . 1 . 2]" 1
962 1 65 ARG H 1 68 ASN H . . 5.240 5.052 4.846 5.275 0.035 14 0 "[ . 1 . 2]" 1
963 1 65 ARG HA 1 65 ARG HG2 . . 3.830 3.145 2.224 3.809 . 0 0 "[ . 1 . 2]" 1
964 1 65 ARG HA 1 65 ARG QG . . 3.100 2.866 2.174 3.343 0.243 3 0 "[ . 1 . 2]" 1
965 1 65 ARG HA 1 65 ARG HG3 . . 3.830 3.379 2.546 3.825 . 0 0 "[ . 1 . 2]" 1
966 1 65 ARG HA 1 67 GLU H . . 4.090 3.737 3.546 4.109 0.019 7 0 "[ . 1 . 2]" 1
967 1 65 ARG HA 1 68 ASN H . . 4.040 2.930 2.784 3.213 . 0 0 "[ . 1 . 2]" 1
968 1 65 ARG HA 1 68 ASN QB . . 3.530 2.336 1.979 2.898 . 0 0 "[ . 1 . 2]" 1
969 1 65 ARG HA 1 69 ALA H . . 3.740 3.447 2.875 3.775 0.035 20 0 "[ . 1 . 2]" 1
970 1 65 ARG QB 1 65 ARG QD . . 2.770 2.172 2.031 2.448 . 0 0 "[ . 1 . 2]" 1
971 1 65 ARG QB 1 65 ARG QG . . 2.280 2.082 2.067 2.087 . 0 0 "[ . 1 . 2]" 1
972 1 65 ARG QB 1 66 ILE H . . 3.510 3.451 3.008 3.711 0.201 12 0 "[ . 1 . 2]" 1
973 1 65 ARG HB2 1 65 ARG HD2 . . 3.870 3.070 2.267 3.744 . 0 0 "[ . 1 . 2]" 1
974 1 65 ARG HB2 1 65 ARG HD3 . . 3.870 3.027 2.383 3.820 . 0 0 "[ . 1 . 2]" 1
975 1 65 ARG HB2 1 66 ILE H . . 4.270 3.810 3.158 4.272 0.002 12 0 "[ . 1 . 2]" 1
976 1 65 ARG HB3 1 65 ARG HD2 . . 3.870 3.092 2.144 3.749 . 0 0 "[ . 1 . 2]" 1
977 1 65 ARG HB3 1 65 ARG HD3 . . 3.870 2.830 2.142 3.700 . 0 0 "[ . 1 . 2]" 1
978 1 65 ARG HB3 1 66 ILE H . . 4.270 4.023 3.760 4.238 . 0 0 "[ . 1 . 2]" 1
979 1 65 ARG QD 1 69 ALA MB . . 4.120 3.844 3.476 4.145 0.025 7 0 "[ . 1 . 2]" 1
980 1 65 ARG HD2 1 69 ALA MB . . 4.780 4.409 3.829 4.840 0.060 17 0 "[ . 1 . 2]" 1
981 1 65 ARG HD3 1 69 ALA MB . . 4.780 4.421 3.612 4.853 0.073 19 0 "[ . 1 . 2]" 1
982 1 65 ARG QG 1 69 ALA MB . . 4.710 3.548 2.795 4.568 . 0 0 "[ . 1 . 2]" 1
983 1 66 ILE H 1 66 ILE HB . . 3.460 2.582 2.484 2.692 . 0 0 "[ . 1 . 2]" 1
984 1 66 ILE H 1 66 ILE QG . . 3.520 2.129 1.896 2.389 . 0 0 "[ . 1 . 2]" 1
985 1 66 ILE H 1 66 ILE MG . . 3.900 3.765 3.757 3.782 . 0 0 "[ . 1 . 2]" 1
986 1 66 ILE H 1 67 GLU H . . 3.820 2.708 2.423 2.816 . 0 0 "[ . 1 . 2]" 1
987 1 66 ILE H 1 67 GLU QB . . 4.950 4.855 4.530 5.013 0.063 15 0 "[ . 1 . 2]" 1
988 1 66 ILE HA 1 66 ILE MD . . 3.340 2.772 1.944 3.645 0.305 14 0 "[ . 1 . 2]" 1
989 1 66 ILE HA 1 66 ILE QG . . 3.020 2.593 2.190 3.064 0.044 9 0 "[ . 1 . 2]" 1
990 1 66 ILE HA 1 66 ILE MG . . 3.720 2.381 2.222 2.507 . 0 0 "[ . 1 . 2]" 1
991 1 66 ILE HA 1 69 ALA MB . . 3.730 3.467 3.149 3.745 0.015 7 0 "[ . 1 . 2]" 1
992 1 66 ILE HA 1 70 MET H . . 4.350 3.716 3.209 4.372 0.022 4 0 "[ . 1 . 2]" 1
993 1 66 ILE HB 1 67 GLU H . . 4.010 2.840 2.622 2.983 . 0 0 "[ . 1 . 2]" 1
994 1 66 ILE QG 1 66 ILE MG . . 3.100 2.418 2.230 2.583 . 0 0 "[ . 1 . 2]" 1
995 1 66 ILE QG 1 67 GLU H . . 4.420 4.044 3.877 4.214 . 0 0 "[ . 1 . 2]" 1
996 1 66 ILE MG 1 67 GLU H . . 3.930 3.622 3.376 3.952 0.022 9 0 "[ . 1 . 2]" 1
997 1 66 ILE MG 1 67 GLU HA . . 4.420 3.599 3.302 4.044 . 0 0 "[ . 1 . 2]" 1
998 1 66 ILE MG 1 67 GLU QB . . 5.260 4.103 3.690 4.595 . 0 0 "[ . 1 . 2]" 1
999 1 66 ILE MG 1 70 MET H . . 5.500 4.306 3.912 4.680 . 0 0 "[ . 1 . 2]" 1
1000 1 66 ILE MG 1 70 MET HB2 . . 4.620 3.340 2.788 3.722 . 0 0 "[ . 1 . 2]" 1
1001 1 66 ILE MG 1 70 MET HB3 . . 4.070 3.828 3.587 4.104 0.034 7 0 "[ . 1 . 2]" 1
1002 1 66 ILE MG 1 70 MET ME . . 3.650 2.325 1.849 2.705 . 0 0 "[ . 1 . 2]" 1
1003 1 67 GLU H 1 68 ASN H . . 3.800 2.310 2.247 2.481 . 0 0 "[ . 1 . 2]" 1
1004 1 67 GLU H 1 70 MET H . . 5.500 4.735 4.562 4.949 . 0 0 "[ . 1 . 2]" 1
1005 1 67 GLU HA 1 67 GLU QB . . 2.400 2.181 2.173 2.258 . 0 0 "[ . 1 . 2]" 1
1006 1 67 GLU HA 1 71 ASN H . . 4.670 3.672 3.400 3.909 . 0 0 "[ . 1 . 2]" 1
1007 1 67 GLU QG 1 68 ASN H . . 3.230 2.150 1.926 3.106 . 0 0 "[ . 1 . 2]" 1
1008 1 67 GLU QG 1 68 ASN QB . . 3.730 3.433 2.911 3.774 0.044 14 0 "[ . 1 . 2]" 1
1009 1 68 ASN H 1 68 ASN QB . . 3.340 2.253 2.110 2.513 . 0 0 "[ . 1 . 2]" 1
1010 1 68 ASN H 1 69 ALA H . . 3.740 2.653 2.436 2.817 . 0 0 "[ . 1 . 2]" 1
1011 1 68 ASN H 1 69 ALA MB . . 4.630 4.239 4.083 4.440 . 0 0 "[ . 1 . 2]" 1
1012 1 68 ASN H 1 71 ASN H . . 4.640 4.563 4.381 4.679 0.039 14 0 "[ . 1 . 2]" 1
1013 1 68 ASN HA 1 71 ASN QB . . 3.750 2.926 2.676 3.136 . 0 0 "[ . 1 . 2]" 1
1014 1 68 ASN QB 1 69 ALA H . . 3.640 2.335 2.225 2.501 . 0 0 "[ . 1 . 2]" 1
1015 1 68 ASN QB 1 69 ALA MB . . 3.640 3.611 3.536 3.665 0.025 1 0 "[ . 1 . 2]" 1
1016 1 68 ASN QB 1 70 MET H . . 5.020 4.644 4.262 4.887 . 0 0 "[ . 1 . 2]" 1
1017 1 69 ALA H 1 69 ALA MB . . 3.020 2.097 2.027 2.225 . 0 0 "[ . 1 . 2]" 1
1018 1 69 ALA H 1 70 MET HB3 . . 4.950 4.921 4.716 5.047 0.097 9 0 "[ . 1 . 2]" 1
1019 1 69 ALA HA 1 72 GLU H . . 4.190 3.558 3.431 3.846 . 0 0 "[ . 1 . 2]" 1
1020 1 69 ALA HA 1 72 GLU QB . . 3.490 2.600 2.136 2.883 . 0 0 "[ . 1 . 2]" 1
1021 1 69 ALA HA 1 72 GLU QG . . 4.450 3.830 2.530 4.385 . 0 0 "[ . 1 . 2]" 1
1022 1 69 ALA HA 1 73 ILE H . . 5.370 4.018 3.792 4.244 . 0 0 "[ . 1 . 2]" 1
1023 1 69 ALA MB 1 70 MET H . . 3.370 2.420 2.155 2.980 . 0 0 "[ . 1 . 2]" 1
1024 1 69 ALA MB 1 70 MET HB2 . . 5.430 3.983 3.782 4.235 . 0 0 "[ . 1 . 2]" 1
1025 1 69 ALA MB 1 70 MET HB3 . . 5.210 4.529 4.404 4.716 . 0 0 "[ . 1 . 2]" 1
1026 1 69 ALA MB 1 70 MET ME . . 5.500 5.227 4.759 5.524 0.024 5 0 "[ . 1 . 2]" 1
1027 1 69 ALA MB 1 72 GLU QB . . 4.140 3.905 3.633 4.117 . 0 0 "[ . 1 . 2]" 1
1028 1 70 MET H 1 70 MET HB2 . . 3.560 2.551 2.366 2.824 . 0 0 "[ . 1 . 2]" 1
1029 1 70 MET H 1 70 MET HB3 . . 3.890 2.519 2.356 2.697 . 0 0 "[ . 1 . 2]" 1
1030 1 70 MET H 1 70 MET ME . . 4.330 4.177 3.837 4.404 0.074 9 0 "[ . 1 . 2]" 1
1031 1 70 MET H 1 70 MET QG . . 3.930 3.967 3.940 3.993 0.063 13 0 "[ . 1 . 2]" 1
1032 1 70 MET H 1 71 ASN H . . 3.720 2.822 2.489 2.929 . 0 0 "[ . 1 . 2]" 1
1033 1 70 MET H 1 71 ASN QB . . 5.340 4.544 4.263 4.720 . 0 0 "[ . 1 . 2]" 1
1034 1 70 MET H 1 72 GLU H . . 5.500 3.867 3.515 4.036 . 0 0 "[ . 1 . 2]" 1
1035 1 70 MET HA 1 70 MET HB2 . . 2.910 2.438 2.390 2.514 . 0 0 "[ . 1 . 2]" 1
1036 1 70 MET HA 1 70 MET HB3 . . 3.000 3.022 3.017 3.024 0.024 8 0 "[ . 1 . 2]" 1
1037 1 70 MET HA 1 73 ILE H . . 4.440 3.446 3.299 3.682 . 0 0 "[ . 1 . 2]" 1
1038 1 70 MET HA 1 73 ILE HB . . 3.460 3.037 2.772 3.448 . 0 0 "[ . 1 . 2]" 1
1039 1 70 MET HA 1 73 ILE QG . . 5.500 3.645 3.298 3.917 . 0 0 "[ . 1 . 2]" 1
1040 1 70 MET HA 1 73 ILE MG . . 5.310 4.456 4.210 4.824 . 0 0 "[ . 1 . 2]" 1
1041 1 70 MET HB2 1 70 MET ME . . 3.780 2.378 1.930 2.800 . 0 0 "[ . 1 . 2]" 1
1042 1 70 MET HB3 1 71 ASN H . . 3.030 2.396 2.291 2.521 . 0 0 "[ . 1 . 2]" 1
1043 1 70 MET ME 1 71 ASN H . . 4.840 4.553 4.242 4.845 0.005 2 0 "[ . 1 . 2]" 1
1044 1 70 MET QG 1 71 ASN H . . 3.650 3.484 3.029 3.682 0.032 17 0 "[ . 1 . 2]" 1
1045 1 70 MET QG 1 74 SER HB2 . . 4.730 2.874 2.476 3.842 . 0 0 "[ . 1 . 2]" 1
1046 1 70 MET QG 1 74 SER HB3 . . 5.500 4.004 3.455 4.396 . 0 0 "[ . 1 . 2]" 1
1047 1 71 ASN H 1 71 ASN HB2 . . 3.680 2.507 2.220 2.684 . 0 0 "[ . 1 . 2]" 1
1048 1 71 ASN H 1 71 ASN QB . . 3.160 2.246 2.152 2.305 . 0 0 "[ . 1 . 2]" 1
1049 1 71 ASN H 1 71 ASN HB3 . . 3.680 2.603 2.387 3.563 . 0 0 "[ . 1 . 2]" 1
1050 1 71 ASN H 1 72 GLU H . . 3.640 2.657 2.573 2.705 . 0 0 "[ . 1 . 2]" 1
1051 1 71 ASN HA 1 74 SER H . . 4.740 3.718 3.528 3.896 . 0 0 "[ . 1 . 2]" 1
1052 1 71 ASN HA 1 74 SER HB3 . . 4.190 2.883 2.599 3.097 . 0 0 "[ . 1 . 2]" 1
1053 1 71 ASN HA 1 75 ARG H . . 5.500 5.018 4.627 5.394 . 0 0 "[ . 1 . 2]" 1
1054 1 71 ASN QB 1 72 GLU H . . 3.640 3.021 2.948 3.162 . 0 0 "[ . 1 . 2]" 1
1055 1 71 ASN HB2 1 72 GLU H . . 4.210 4.083 3.126 4.200 . 0 0 "[ . 1 . 2]" 1
1056 1 71 ASN HB3 1 72 GLU H . . 4.210 3.145 3.019 3.840 . 0 0 "[ . 1 . 2]" 1
1057 1 72 GLU H 1 72 GLU QB . . 3.030 2.221 2.109 2.525 . 0 0 "[ . 1 . 2]" 1
1058 1 72 GLU H 1 72 GLU QG . . 4.090 3.624 2.377 4.084 . 0 0 "[ . 1 . 2]" 1
1059 1 72 GLU H 1 73 ILE H . . 3.310 2.457 2.333 2.514 . 0 0 "[ . 1 . 2]" 1
1060 1 72 GLU H 1 73 ILE HB . . 4.780 4.645 4.572 4.736 . 0 0 "[ . 1 . 2]" 1
1061 1 72 GLU H 1 74 SER HB2 . . 5.500 5.040 4.803 5.609 0.109 8 0 "[ . 1 . 2]" 1
1062 1 72 GLU H 1 74 SER HB3 . . 5.160 4.974 4.417 5.168 0.008 4 0 "[ . 1 . 2]" 1
1063 1 72 GLU HA 1 72 GLU QB . . 2.770 2.474 2.324 2.539 . 0 0 "[ . 1 . 2]" 1
1064 1 72 GLU HA 1 72 GLU QG . . 3.460 2.445 2.048 3.057 . 0 0 "[ . 1 . 2]" 1
1065 1 72 GLU HA 1 74 SER H . . 4.230 4.053 3.890 4.233 0.003 18 0 "[ . 1 . 2]" 1
1066 1 72 GLU HA 1 75 ARG H . . 5.500 3.816 3.627 4.057 . 0 0 "[ . 1 . 2]" 1
1067 1 72 GLU HA 1 75 ARG QB . . 4.950 3.841 3.565 4.166 . 0 0 "[ . 1 . 2]" 1
1068 1 72 GLU HA 1 75 ARG QD . . 4.140 3.920 3.515 4.145 0.005 8 0 "[ . 1 . 2]" 1
1069 1 72 GLU HA 1 75 ARG QG . . 2.450 2.337 2.019 2.460 0.010 4 0 "[ . 1 . 2]" 1
1070 1 72 GLU QB 1 73 ILE H . . 3.640 2.441 2.285 2.750 . 0 0 "[ . 1 . 2]" 1
1071 1 72 GLU QB 1 73 ILE HA . . 4.060 3.846 3.727 4.066 0.006 1 0 "[ . 1 . 2]" 1
1072 1 72 GLU QB 1 74 SER H . . 4.560 4.327 4.239 4.486 . 0 0 "[ . 1 . 2]" 1
1073 1 72 GLU QG 1 73 ILE MD . . 5.500 4.396 2.966 5.679 0.179 18 0 "[ . 1 . 2]" 1
1074 1 72 GLU QG 1 73 ILE QG . . 5.500 4.693 3.830 5.085 . 0 0 "[ . 1 . 2]" 1
1075 1 73 ILE H 1 73 ILE HB . . 3.350 2.540 2.476 2.641 . 0 0 "[ . 1 . 2]" 1
1076 1 73 ILE H 1 73 ILE QG . . 3.390 2.152 1.975 2.345 . 0 0 "[ . 1 . 2]" 1
1077 1 73 ILE H 1 74 SER H . . 3.590 2.542 2.353 2.622 . 0 0 "[ . 1 . 2]" 1
1078 1 73 ILE H 1 75 ARG H . . 4.850 4.095 3.982 4.196 . 0 0 "[ . 1 . 2]" 1
1079 1 73 ILE HA 1 73 ILE MD . . 3.370 2.055 1.947 3.358 . 0 0 "[ . 1 . 2]" 1
1080 1 73 ILE HA 1 73 ILE QG . . 3.640 2.921 2.394 3.044 . 0 0 "[ . 1 . 2]" 1
1081 1 73 ILE HB 1 74 SER H . . 3.830 3.077 2.848 3.198 . 0 0 "[ . 1 . 2]" 1
1082 1 73 ILE MG 1 74 SER H . . 3.910 3.825 3.699 3.948 0.038 8 0 "[ . 1 . 2]" 1
1083 1 73 ILE MG 1 74 SER HA . . 4.490 3.781 3.610 3.942 . 0 0 "[ . 1 . 2]" 1
1084 1 73 ILE MG 1 74 SER HB2 . . 4.980 4.754 4.415 5.036 0.056 10 0 "[ . 1 . 2]" 1
1085 1 74 SER H 1 74 SER HB2 . . 3.780 2.496 2.337 2.992 . 0 0 "[ . 1 . 2]" 1
1086 1 74 SER H 1 74 SER HB3 . . 3.940 2.687 2.229 2.802 . 0 0 "[ . 1 . 2]" 1
1087 1 74 SER H 1 75 ARG H . . 3.780 2.497 2.362 2.584 . 0 0 "[ . 1 . 2]" 1
1088 1 74 SER HB2 1 75 ARG H . . 4.540 4.171 3.932 4.452 . 0 0 "[ . 1 . 2]" 1
1089 1 74 SER HB3 1 75 ARG H . . 4.660 3.436 3.062 3.673 . 0 0 "[ . 1 . 2]" 1
1090 1 75 ARG H 1 75 ARG QB . . 3.390 2.426 2.200 2.556 . 0 0 "[ . 1 . 2]" 1
1091 1 75 ARG H 1 75 ARG QD . . 5.450 3.978 3.382 4.514 . 0 0 "[ . 1 . 2]" 1
1092 1 75 ARG H 1 75 ARG QG . . 3.590 2.374 1.940 2.835 . 0 0 "[ . 1 . 2]" 1
1093 1 75 ARG H 1 76 ARG H . . 4.330 3.597 2.655 4.503 0.173 18 0 "[ . 1 . 2]" 1
1094 1 75 ARG HA 1 75 ARG QD . . 3.420 2.598 1.995 3.435 0.015 4 0 "[ . 1 . 2]" 1
1095 1 75 ARG HA 1 75 ARG QG . . 2.870 2.659 2.195 2.897 0.027 16 0 "[ . 1 . 2]" 1
1096 1 75 ARG QB 1 75 ARG QD . . 3.200 2.335 1.947 2.701 . 0 0 "[ . 1 . 2]" 1
1097 1 75 ARG QB 1 76 ARG H . . 2.670 2.168 1.895 2.671 0.001 19 0 "[ . 1 . 2]" 1
1098 1 76 ARG H 1 76 ARG QB . . 3.850 2.512 2.152 3.258 . 0 0 "[ . 1 . 2]" 1
1099 1 76 ARG H 1 76 ARG QG . . 4.080 3.391 2.489 4.073 . 0 0 "[ . 1 . 2]" 1
1100 1 76 ARG H 1 77 GLU H . . 4.710 3.832 1.962 4.640 . 0 0 "[ . 1 . 2]" 1
1101 1 76 ARG HA 1 76 ARG QB . . 2.550 2.427 2.320 2.492 . 0 0 "[ . 1 . 2]" 1
1102 1 76 ARG HA 1 76 ARG QD . . 3.700 3.071 2.015 3.681 . 0 0 "[ . 1 . 2]" 1
1103 1 76 ARG HA 1 76 ARG QG . . 3.150 2.418 2.195 2.954 . 0 0 "[ . 1 . 2]" 1
1104 1 76 ARG QB 1 76 ARG QD . . 3.110 2.171 1.968 2.757 . 0 0 "[ . 1 . 2]" 1
1105 1 77 GLU H 1 77 GLU QB . . 3.620 2.556 2.156 3.090 . 0 0 "[ . 1 . 2]" 1
1106 1 77 GLU H 1 77 GLU HG2 . . 5.440 3.633 1.951 4.946 . 0 0 "[ . 1 . 2]" 1
1107 1 77 GLU H 1 77 GLU QG . . 4.660 3.160 1.924 4.258 . 0 0 "[ . 1 . 2]" 1
1108 1 77 GLU H 1 77 GLU HG3 . . 5.440 3.757 2.288 4.979 . 0 0 "[ . 1 . 2]" 1
1109 1 77 GLU HA 1 77 GLU QB . . 2.520 2.340 2.173 2.479 . 0 0 "[ . 1 . 2]" 1
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