NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
407652 |
1yel   |
6464 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1yel
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 1232
_Distance_constraint_stats_list.Viol_count 1265
_Distance_constraint_stats_list.Viol_total 1493.657
_Distance_constraint_stats_list.Viol_max 0.234
_Distance_constraint_stats_list.Viol_rms 0.0169
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0030
_Distance_constraint_stats_list.Viol_average_violations_only 0.0590
_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 4 ALA 0.095 0.052 9 0 "[ . 1 . 2]"
1 5 ASP 0.116 0.052 9 0 "[ . 1 . 2]"
1 6 THR 0.818 0.100 2 0 "[ . 1 . 2]"
1 7 GLY 1.706 0.172 4 0 "[ . 1 . 2]"
1 8 GLU 0.986 0.172 4 0 "[ . 1 . 2]"
1 9 VAL 0.170 0.045 5 0 "[ . 1 . 2]"
1 10 GLN 2.644 0.174 3 0 "[ . 1 . 2]"
1 11 PHE 0.860 0.109 18 0 "[ . 1 . 2]"
1 12 MET 0.148 0.034 11 0 "[ . 1 . 2]"
1 13 LYS 0.477 0.078 18 0 "[ . 1 . 2]"
1 14 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 PHE 0.533 0.087 20 0 "[ . 1 . 2]"
1 16 ILE 3.843 0.207 2 0 "[ . 1 . 2]"
1 17 SER 1.434 0.096 6 0 "[ . 1 . 2]"
1 18 GLU 1.447 0.122 3 0 "[ . 1 . 2]"
1 19 LYS 4.083 0.207 2 0 "[ . 1 . 2]"
1 20 SER 0.711 0.078 18 0 "[ . 1 . 2]"
1 21 SER 1.368 0.122 3 0 "[ . 1 . 2]"
1 22 LYS 2.749 0.175 12 0 "[ . 1 . 2]"
1 23 SER 2.556 0.183 6 0 "[ . 1 . 2]"
1 24 LEU 1.369 0.106 3 0 "[ . 1 . 2]"
1 25 GLU 1.489 0.183 2 0 "[ . 1 . 2]"
1 26 ILE 0.864 0.071 2 0 "[ . 1 . 2]"
1 27 PRO 0.238 0.088 20 0 "[ . 1 . 2]"
1 28 LEU 0.433 0.051 17 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 PHE 1.170 0.094 7 0 "[ . 1 . 2]"
1 31 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 TYR 1.081 0.094 7 0 "[ . 1 . 2]"
1 34 PHE 0.630 0.093 14 0 "[ . 1 . 2]"
1 35 PRO 4.733 0.186 18 0 "[ . 1 . 2]"
1 36 ALA 2.270 0.121 8 0 "[ . 1 . 2]"
1 37 PRO 0.355 0.059 18 0 "[ . 1 . 2]"
1 38 PHE 4.313 0.207 4 0 "[ . 1 . 2]"
1 39 PRO 0.827 0.099 20 0 "[ . 1 . 2]"
1 40 ILE 0.587 0.141 16 0 "[ . 1 . 2]"
1 41 THR 0.681 0.159 13 0 "[ . 1 . 2]"
1 42 VAL 0.714 0.159 13 0 "[ . 1 . 2]"
1 43 ASP 0.331 0.093 15 0 "[ . 1 . 2]"
1 44 LEU 0.091 0.054 11 0 "[ . 1 . 2]"
1 45 LEU 0.122 0.044 3 0 "[ . 1 . 2]"
1 46 ASP 2.712 0.200 15 0 "[ . 1 . 2]"
1 47 TYR 0.943 0.095 15 0 "[ . 1 . 2]"
1 48 SER 0.080 0.044 2 0 "[ . 1 . 2]"
1 50 ARG 0.660 0.124 2 0 "[ . 1 . 2]"
1 51 SER 0.328 0.124 2 0 "[ . 1 . 2]"
1 52 TRP 2.814 0.200 15 0 "[ . 1 . 2]"
1 53 THR 0.153 0.038 19 0 "[ . 1 . 2]"
1 54 VAL 0.586 0.106 12 0 "[ . 1 . 2]"
1 55 ARG 1.830 0.179 15 0 "[ . 1 . 2]"
1 56 MET 1.188 0.110 2 0 "[ . 1 . 2]"
1 57 LYS 3.815 0.208 12 0 "[ . 1 . 2]"
1 58 LYS 7.539 0.203 4 0 "[ . 1 . 2]"
1 59 ARG 3.782 0.203 4 0 "[ . 1 . 2]"
1 60 GLY 0.910 0.125 5 0 "[ . 1 . 2]"
1 61 GLU 0.037 0.037 20 0 "[ . 1 . 2]"
1 62 LYS 2.813 0.144 13 0 "[ . 1 . 2]"
1 63 VAL 1.112 0.102 8 0 "[ . 1 . 2]"
1 64 PHE 0.746 0.106 3 0 "[ . 1 . 2]"
1 65 LEU 1.406 0.113 10 0 "[ . 1 . 2]"
1 66 THR 0.660 0.208 12 0 "[ . 1 . 2]"
1 67 VAL 2.771 0.183 6 0 "[ . 1 . 2]"
1 68 GLY 2.660 0.201 14 0 "[ . 1 . 2]"
1 69 TRP 2.555 0.179 16 0 "[ . 1 . 2]"
1 70 GLU 4.499 0.201 14 0 "[ . 1 . 2]"
1 71 ASN 2.272 0.088 14 0 "[ . 1 . 2]"
1 72 PHE 3.779 0.179 9 0 "[ . 1 . 2]"
1 73 VAL 4.978 0.179 16 0 "[ . 1 . 2]"
1 74 LYS 4.044 0.172 18 0 "[ . 1 . 2]"
1 75 ASP 4.491 0.179 9 0 "[ . 1 . 2]"
1 76 ASN 0.137 0.045 1 0 "[ . 1 . 2]"
1 77 ASN 1.391 0.234 13 0 "[ . 1 . 2]"
1 78 LEU 0.398 0.090 7 0 "[ . 1 . 2]"
1 79 GLU 1.371 0.135 6 0 "[ . 1 . 2]"
1 80 ASP 2.516 0.135 6 0 "[ . 1 . 2]"
1 81 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 LYS 0.002 0.002 9 0 "[ . 1 . 2]"
1 83 TYR 1.878 0.144 15 0 "[ . 1 . 2]"
1 84 LEU 0.509 0.087 20 0 "[ . 1 . 2]"
1 85 GLN 0.574 0.165 19 0 "[ . 1 . 2]"
1 86 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ILE 0.279 0.081 4 0 "[ . 1 . 2]"
1 88 TYR 1.074 0.099 3 0 "[ . 1 . 2]"
1 89 ASP 0.557 0.178 5 0 "[ . 1 . 2]"
1 90 ARG 0.068 0.040 13 0 "[ . 1 . 2]"
1 91 ASP 2.771 0.172 14 0 "[ . 1 . 2]"
1 92 ARG 2.262 0.172 14 0 "[ . 1 . 2]"
1 93 THR 1.381 0.178 5 0 "[ . 1 . 2]"
1 94 PHE 0.120 0.055 20 0 "[ . 1 . 2]"
1 95 TYR 0.283 0.081 4 0 "[ . 1 . 2]"
1 96 VAL 0.238 0.055 20 0 "[ . 1 . 2]"
1 97 ILE 0.330 0.165 19 0 "[ . 1 . 2]"
1 98 ILE 2.376 0.156 13 0 "[ . 1 . 2]"
1 99 TYR 0.204 0.082 8 0 "[ . 1 . 2]"
1 100 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 MET 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 4 ALA HA 1 5 ASP H 0.000 . 3.270 2.342 2.101 3.322 0.052 9 0 "[ . 1 . 2]" 1
2 1 4 ALA MB 1 6 THR H 0.000 . 6.530 5.017 3.506 6.371 . 0 0 "[ . 1 . 2]" 1
3 1 5 ASP HA 1 6 THR H 0.000 . 3.390 2.203 2.061 2.551 . 0 0 "[ . 1 . 2]" 1
4 1 5 ASP HA 1 7 GLY H 0.000 . 4.480 3.790 2.987 4.492 0.012 19 0 "[ . 1 . 2]" 1
5 1 6 THR H 1 6 THR HB 0.000 . 3.300 2.609 2.444 3.400 0.100 2 0 "[ . 1 . 2]" 1
6 1 6 THR H 1 7 GLY H 0.000 . 3.420 2.333 1.801 2.814 . 0 0 "[ . 1 . 2]" 1
7 1 6 THR HA 1 7 GLY H 0.000 . 3.450 3.477 3.362 3.523 0.073 9 0 "[ . 1 . 2]" 1
8 1 6 THR HB 1 7 GLY H 0.000 . 3.240 2.714 2.030 3.255 0.015 11 0 "[ . 1 . 2]" 1
9 1 6 THR MG 1 7 GLY H 0.000 . 6.530 3.659 3.068 4.067 . 0 0 "[ . 1 . 2]" 1
10 1 7 GLY QA 1 8 GLU H 0.000 . 3.050 2.248 2.036 2.776 . 0 0 "[ . 1 . 2]" 1
11 1 7 GLY HA2 1 8 GLU H 0.000 . 3.240 2.769 2.082 3.373 0.133 6 0 "[ . 1 . 2]" 1
12 1 7 GLY HA3 1 8 GLU H 0.000 . 3.240 2.648 2.067 3.412 0.172 4 0 "[ . 1 . 2]" 1
13 1 8 GLU HA 1 9 VAL H 0.000 . 2.830 2.200 2.060 2.849 0.019 5 0 "[ . 1 . 2]" 1
14 1 8 GLU QG 1 9 VAL H 0.000 . 5.910 3.719 2.830 4.382 . 0 0 "[ . 1 . 2]" 1
15 1 8 GLU QG 1 10 GLN H 0.000 . 6.350 5.160 4.392 5.778 . 0 0 "[ . 1 . 2]" 1
16 1 9 VAL H 1 9 VAL HB 0.000 . 4.100 3.797 3.683 3.880 . 0 0 "[ . 1 . 2]" 1
17 1 9 VAL H 1 10 GLN H 0.000 . 4.450 4.403 4.241 4.495 0.045 5 0 "[ . 1 . 2]" 1
18 1 9 VAL H 1 87 ILE MG 0.000 . 6.530 3.856 2.917 5.969 . 0 0 "[ . 1 . 2]" 1
19 1 9 VAL H 1 88 TYR H 0.000 . 4.230 3.314 2.928 3.905 . 0 0 "[ . 1 . 2]" 1
20 1 9 VAL H 1 88 TYR QB 0.000 . 6.380 3.755 2.664 5.365 . 0 0 "[ . 1 . 2]" 1
21 1 9 VAL H 1 90 ARG QD 0.000 . 6.380 5.233 4.315 6.369 . 0 0 "[ . 1 . 2]" 1
22 1 9 VAL HA 1 10 GLN H 0.000 . 2.830 2.238 2.134 2.407 . 0 0 "[ . 1 . 2]" 1
23 1 9 VAL HB 1 10 GLN H 0.000 . 3.300 2.857 2.505 3.011 . 0 0 "[ . 1 . 2]" 1
24 1 9 VAL QG 1 10 GLN H 0.000 . 5.030 3.365 3.181 3.449 . 0 0 "[ . 1 . 2]" 1
25 1 9 VAL QG 1 33 TYR QB 0.000 . 8.970 5.152 4.024 6.520 . 0 0 "[ . 1 . 2]" 1
26 1 9 VAL QG 1 33 TYR QD 0.000 . 7.410 3.854 2.496 5.315 . 0 0 "[ . 1 . 2]" 1
27 1 9 VAL QG 1 33 TYR QE 0.000 . 7.770 2.521 1.896 4.173 . 0 0 "[ . 1 . 2]" 1
28 1 9 VAL QG 1 88 TYR H 0.000 . 8.090 3.192 2.844 3.810 . 0 0 "[ . 1 . 2]" 1
29 1 9 VAL QG 1 88 TYR QB 0.000 . 5.930 2.544 1.878 4.070 . 0 0 "[ . 1 . 2]" 1
30 1 9 VAL QG 1 89 ASP H 0.000 . 8.090 4.926 4.559 5.427 . 0 0 "[ . 1 . 2]" 1
31 1 9 VAL QG 1 90 ARG HA 0.000 . 7.060 4.941 3.781 6.130 . 0 0 "[ . 1 . 2]" 1
32 1 9 VAL QG 1 90 ARG QD 0.000 . 5.840 3.673 2.042 4.388 . 0 0 "[ . 1 . 2]" 1
33 1 9 VAL QG 1 90 ARG QG 0.000 . 6.360 4.788 3.411 5.913 . 0 0 "[ . 1 . 2]" 1
34 1 9 VAL QG 1 91 ASP H 0.000 . 8.090 6.203 5.151 7.144 . 0 0 "[ . 1 . 2]" 1
35 1 9 VAL MG1 1 10 GLN H 0.000 . 5.660 3.791 3.618 3.887 . 0 0 "[ . 1 . 2]" 1
36 1 9 VAL MG1 1 33 TYR QD 0.000 . 7.950 4.813 2.519 6.680 . 0 0 "[ . 1 . 2]" 1
37 1 9 VAL MG1 1 33 TYR QE 0.000 . 8.660 3.118 1.954 5.088 . 0 0 "[ . 1 . 2]" 1
38 1 9 VAL MG1 1 88 TYR HB2 0.000 . 7.220 5.871 4.172 7.148 . 0 0 "[ . 1 . 2]" 1
39 1 9 VAL MG1 1 88 TYR HB3 0.000 . 7.220 5.495 4.208 7.244 0.024 7 0 "[ . 1 . 2]" 1
40 1 9 VAL MG1 1 90 ARG HD2 0.000 . 6.530 4.981 3.473 6.355 . 0 0 "[ . 1 . 2]" 1
41 1 9 VAL MG1 1 90 ARG HD3 0.000 . 6.530 5.017 3.702 5.988 . 0 0 "[ . 1 . 2]" 1
42 1 9 VAL MG1 1 90 ARG HG2 0.000 . 8.060 6.296 5.418 7.503 . 0 0 "[ . 1 . 2]" 1
43 1 9 VAL MG1 1 90 ARG HG3 0.000 . 8.060 6.568 5.013 7.815 . 0 0 "[ . 1 . 2]" 1
44 1 9 VAL MG2 1 10 GLN H 0.000 . 5.660 3.772 3.442 3.906 . 0 0 "[ . 1 . 2]" 1
45 1 9 VAL MG2 1 33 TYR QD 0.000 . 7.950 4.153 3.049 5.581 . 0 0 "[ . 1 . 2]" 1
46 1 9 VAL MG2 1 33 TYR QE 0.000 . 8.660 2.967 1.950 4.444 . 0 0 "[ . 1 . 2]" 1
47 1 9 VAL MG2 1 88 TYR HB2 0.000 . 7.220 3.411 1.934 4.813 . 0 0 "[ . 1 . 2]" 1
48 1 9 VAL MG2 1 88 TYR HB3 0.000 . 7.220 3.042 1.898 4.819 . 0 0 "[ . 1 . 2]" 1
49 1 9 VAL MG2 1 90 ARG HD2 0.000 . 6.530 4.372 2.287 5.435 . 0 0 "[ . 1 . 2]" 1
50 1 9 VAL MG2 1 90 ARG HD3 0.000 . 6.530 4.812 2.348 6.149 . 0 0 "[ . 1 . 2]" 1
51 1 9 VAL MG2 1 90 ARG HG2 0.000 . 8.060 5.906 4.311 7.649 . 0 0 "[ . 1 . 2]" 1
52 1 9 VAL MG2 1 90 ARG HG3 0.000 . 8.060 6.019 3.679 7.333 . 0 0 "[ . 1 . 2]" 1
53 1 10 GLN H 1 10 GLN HB2 0.000 . 3.550 3.408 2.433 3.724 0.174 3 0 "[ . 1 . 2]" 1
54 1 10 GLN H 1 10 GLN HB3 0.000 . 3.550 3.121 2.438 3.665 0.115 6 0 "[ . 1 . 2]" 1
55 1 10 GLN H 1 10 GLN QE 0.000 . 6.370 4.149 1.988 6.148 . 0 0 "[ . 1 . 2]" 1
56 1 10 GLN H 1 87 ILE MG 0.000 . 6.530 4.635 3.529 5.222 . 0 0 "[ . 1 . 2]" 1
57 1 10 GLN H 1 88 TYR H 0.000 . 4.790 4.775 4.562 4.889 0.099 3 0 "[ . 1 . 2]" 1
58 1 10 GLN HA 1 11 PHE H 0.000 . 3.390 2.221 2.139 2.428 . 0 0 "[ . 1 . 2]" 1
59 1 10 GLN HA 1 87 ILE MG 0.000 . 6.090 3.647 2.876 3.977 . 0 0 "[ . 1 . 2]" 1
60 1 10 GLN HA 1 88 TYR H 0.000 . 4.350 3.060 2.461 3.377 . 0 0 "[ . 1 . 2]" 1
61 1 10 GLN QB 1 87 ILE HA 0.000 . 5.920 2.921 1.890 4.136 . 0 0 "[ . 1 . 2]" 1
62 1 10 GLN QB 1 87 ILE MG 0.000 . 5.330 2.991 1.940 4.423 . 0 0 "[ . 1 . 2]" 1
63 1 10 GLN HB2 1 10 GLN HE22 0.000 . 5.280 4.579 3.855 5.327 0.047 16 0 "[ . 1 . 2]" 1
64 1 10 GLN HB2 1 87 ILE MG 0.000 . 6.090 4.049 2.378 5.093 . 0 0 "[ . 1 . 2]" 1
65 1 10 GLN HB3 1 10 GLN HE22 0.000 . 5.280 4.285 3.432 5.285 0.005 6 0 "[ . 1 . 2]" 1
66 1 10 GLN HB3 1 87 ILE MG 0.000 . 6.090 3.309 2.016 5.061 . 0 0 "[ . 1 . 2]" 1
67 1 10 GLN QE 1 87 ILE QG 0.000 . 7.240 4.260 2.648 5.604 . 0 0 "[ . 1 . 2]" 1
68 1 10 GLN HE21 1 87 ILE MD 0.000 . 6.530 5.094 3.396 6.556 0.026 15 0 "[ . 1 . 2]" 1
69 1 10 GLN HE21 1 87 ILE MG 0.000 . 6.530 4.961 2.878 6.565 0.035 5 0 "[ . 1 . 2]" 1
70 1 10 GLN HE22 1 87 ILE MD 0.000 . 6.530 5.118 2.705 6.543 0.013 3 0 "[ . 1 . 2]" 1
71 1 10 GLN HE22 1 87 ILE MG 0.000 . 6.530 5.353 3.003 6.566 0.036 18 0 "[ . 1 . 2]" 1
72 1 10 GLN QG 1 11 PHE H 0.000 . 6.070 3.732 2.390 4.181 . 0 0 "[ . 1 . 2]" 1
73 1 10 GLN QG 1 87 ILE MG 0.000 . 5.020 3.950 2.207 4.860 . 0 0 "[ . 1 . 2]" 1
74 1 10 GLN QG 1 88 TYR H 0.000 . 6.380 5.233 3.554 6.196 . 0 0 "[ . 1 . 2]" 1
75 1 11 PHE H 1 85 GLN QE 0.000 . 6.370 5.237 3.992 6.479 0.109 18 0 "[ . 1 . 2]" 1
76 1 11 PHE H 1 86 PHE H 0.000 . 4.290 2.867 2.532 3.352 . 0 0 "[ . 1 . 2]" 1
77 1 11 PHE H 1 86 PHE HB2 0.000 . 5.500 3.538 2.947 4.163 . 0 0 "[ . 1 . 2]" 1
78 1 11 PHE H 1 86 PHE QB 0.000 . 4.790 3.443 2.895 3.998 . 0 0 "[ . 1 . 2]" 1
79 1 11 PHE H 1 86 PHE HB3 0.000 . 5.500 4.737 4.183 5.162 . 0 0 "[ . 1 . 2]" 1
80 1 11 PHE H 1 87 ILE HA 0.000 . 4.790 3.680 3.433 4.012 . 0 0 "[ . 1 . 2]" 1
81 1 11 PHE H 1 88 TYR H 0.000 . 4.720 4.704 4.489 4.789 0.069 1 0 "[ . 1 . 2]" 1
82 1 11 PHE HA 1 12 MET H 0.000 . 3.330 2.283 2.228 2.333 . 0 0 "[ . 1 . 2]" 1
83 1 11 PHE HB2 1 12 MET H 0.000 . 4.040 3.718 2.628 4.074 0.034 11 0 "[ . 1 . 2]" 1
84 1 11 PHE HB3 1 12 MET H 0.000 . 4.040 3.907 3.828 4.029 . 0 0 "[ . 1 . 2]" 1
85 1 11 PHE QD 1 12 MET H 0.000 . 7.190 3.372 2.988 3.969 . 0 0 "[ . 1 . 2]" 1
86 1 11 PHE QD 1 27 PRO HD2 0.000 . 7.620 4.523 3.109 6.151 . 0 0 "[ . 1 . 2]" 1
87 1 11 PHE QD 1 27 PRO QD 0.000 . 7.030 4.203 2.835 5.776 . 0 0 "[ . 1 . 2]" 1
88 1 11 PHE QD 1 27 PRO HD3 0.000 . 7.620 5.085 3.268 7.006 . 0 0 "[ . 1 . 2]" 1
89 1 11 PHE QE 1 13 LYS H 0.000 . 7.620 5.157 4.546 6.008 . 0 0 "[ . 1 . 2]" 1
90 1 11 PHE QE 1 26 ILE MD 0.000 . 7.530 5.065 3.470 7.044 . 0 0 "[ . 1 . 2]" 1
91 1 11 PHE QE 1 26 ILE MG 0.000 . 7.320 4.279 3.152 6.549 . 0 0 "[ . 1 . 2]" 1
92 1 11 PHE QE 1 27 PRO QD 0.000 . 7.630 3.150 2.526 5.934 . 0 0 "[ . 1 . 2]" 1
93 1 11 PHE QE 1 34 PHE QD 0.000 . 9.590 7.887 5.342 9.628 0.038 5 0 "[ . 1 . 2]" 1
94 1 11 PHE QE 1 34 PHE QE 0.000 . 9.220 6.575 3.467 8.599 . 0 0 "[ . 1 . 2]" 1
95 1 12 MET H 1 12 MET HG2 0.000 . 5.380 3.146 2.127 4.758 . 0 0 "[ . 1 . 2]" 1
96 1 12 MET H 1 12 MET QG 0.000 . 4.930 2.837 2.094 4.334 . 0 0 "[ . 1 . 2]" 1
97 1 12 MET H 1 12 MET HG3 0.000 . 5.380 3.524 2.933 4.992 . 0 0 "[ . 1 . 2]" 1
98 1 12 MET HA 1 13 LYS H 0.000 . 3.140 2.254 2.160 2.390 . 0 0 "[ . 1 . 2]" 1
99 1 12 MET HA 1 85 GLN HA 0.000 . 3.480 2.351 1.959 2.831 . 0 0 "[ . 1 . 2]" 1
100 1 12 MET HA 1 86 PHE H 0.000 . 4.320 3.373 2.908 3.841 . 0 0 "[ . 1 . 2]" 1
101 1 12 MET QB 1 86 PHE H 0.000 . 6.380 4.446 3.282 5.383 . 0 0 "[ . 1 . 2]" 1
102 1 12 MET ME 1 85 GLN HA 0.000 . 6.340 4.609 3.393 5.685 . 0 0 "[ . 1 . 2]" 1
103 1 12 MET ME 1 99 TYR QE 0.000 . 7.920 3.199 2.130 4.899 . 0 0 "[ . 1 . 2]" 1
104 1 12 MET QG 1 13 LYS H 0.000 . 5.730 3.750 2.406 4.173 . 0 0 "[ . 1 . 2]" 1
105 1 12 MET QG 1 85 GLN HA 0.000 . 5.330 4.137 2.447 5.172 . 0 0 "[ . 1 . 2]" 1
106 1 12 MET QG 1 99 TYR QE 0.000 . 8.510 4.187 2.100 6.500 . 0 0 "[ . 1 . 2]" 1
107 1 13 LYS H 1 13 LYS HB2 0.000 . 3.950 3.604 2.841 4.028 0.078 18 0 "[ . 1 . 2]" 1
108 1 13 LYS H 1 13 LYS QB 0.000 . 3.760 2.947 2.490 3.249 . 0 0 "[ . 1 . 2]" 1
109 1 13 LYS H 1 13 LYS HB3 0.000 . 3.950 3.168 2.621 3.880 . 0 0 "[ . 1 . 2]" 1
110 1 13 LYS H 1 14 PRO QD 0.000 . 6.380 4.223 3.996 4.344 . 0 0 "[ . 1 . 2]" 1
111 1 13 LYS H 1 24 LEU QD 0.000 . 8.100 5.770 4.979 6.437 . 0 0 "[ . 1 . 2]" 1
112 1 13 LYS H 1 84 LEU H 0.000 . 4.010 3.457 2.795 4.063 0.053 18 0 "[ . 1 . 2]" 1
113 1 13 LYS H 1 84 LEU QB 0.000 . 6.380 4.446 3.482 5.820 . 0 0 "[ . 1 . 2]" 1
114 1 13 LYS H 1 84 LEU QD 0.000 . 8.040 4.278 2.360 5.298 . 0 0 "[ . 1 . 2]" 1
115 1 13 LYS QB 1 84 LEU QD 0.000 . 8.480 4.787 2.877 6.339 . 0 0 "[ . 1 . 2]" 1
116 1 13 LYS HB2 1 14 PRO QD 0.000 . 6.380 2.995 1.984 3.980 . 0 0 "[ . 1 . 2]" 1
117 1 13 LYS HB3 1 14 PRO QD 0.000 . 6.380 3.674 2.728 4.295 . 0 0 "[ . 1 . 2]" 1
118 1 13 LYS QD 1 24 LEU MD1 0.000 . 6.350 4.387 1.933 6.410 0.060 14 0 "[ . 1 . 2]" 1
119 1 13 LYS QD 1 24 LEU QD 0.000 . 5.800 3.439 1.774 4.896 . 0 0 "[ . 1 . 2]" 1
120 1 13 LYS QD 1 24 LEU MD2 0.000 . 6.350 3.764 2.061 5.096 . 0 0 "[ . 1 . 2]" 1
121 1 13 LYS QE 1 24 LEU MD1 0.000 . 7.190 4.102 2.574 6.844 . 0 0 "[ . 1 . 2]" 1
122 1 13 LYS QE 1 24 LEU QD 0.000 . 6.540 3.008 1.948 5.127 . 0 0 "[ . 1 . 2]" 1
123 1 13 LYS QE 1 24 LEU MD2 0.000 . 7.190 3.246 2.000 5.320 . 0 0 "[ . 1 . 2]" 1
124 1 13 LYS QE 1 24 LEU HG 0.000 . 6.380 5.061 3.745 6.409 0.029 14 0 "[ . 1 . 2]" 1
125 1 14 PRO HA 1 15 PHE H 0.000 . 3.450 2.189 2.112 2.257 . 0 0 "[ . 1 . 2]" 1
126 1 15 PHE H 1 15 PHE HB2 0.000 . 3.890 2.864 2.292 3.749 . 0 0 "[ . 1 . 2]" 1
127 1 15 PHE H 1 15 PHE HB3 0.000 . 3.890 2.854 2.347 3.659 . 0 0 "[ . 1 . 2]" 1
128 1 15 PHE H 1 16 ILE H 0.000 . 4.630 4.468 4.190 4.612 . 0 0 "[ . 1 . 2]" 1
129 1 15 PHE H 1 83 TYR HA 0.000 . 4.480 3.756 2.878 4.498 0.018 9 0 "[ . 1 . 2]" 1
130 1 15 PHE H 1 83 TYR QB 0.000 . 6.380 5.084 4.067 6.133 . 0 0 "[ . 1 . 2]" 1
131 1 15 PHE H 1 84 LEU MD1 0.000 . 6.530 4.821 2.728 6.617 0.087 20 0 "[ . 1 . 2]" 1
132 1 15 PHE H 1 84 LEU MD2 0.000 . 6.530 5.453 3.559 6.573 0.043 19 0 "[ . 1 . 2]" 1
133 1 15 PHE HA 1 16 ILE H 0.000 . 3.240 2.240 2.115 2.361 . 0 0 "[ . 1 . 2]" 1
134 1 15 PHE HA 1 84 LEU QD 0.000 . 7.420 4.258 3.188 5.547 . 0 0 "[ . 1 . 2]" 1
135 1 15 PHE QB 1 84 LEU QD 0.000 . 7.430 2.793 1.897 3.910 . 0 0 "[ . 1 . 2]" 1
136 1 15 PHE QB 1 84 LEU HG 0.000 . 6.380 4.288 2.637 6.378 . 0 0 "[ . 1 . 2]" 1
137 1 15 PHE HB2 1 84 LEU MD1 0.000 . 9.670 3.679 1.938 5.637 . 0 0 "[ . 1 . 2]" 1
138 1 15 PHE HB2 1 84 LEU MD2 0.000 . 9.670 3.990 2.205 5.261 . 0 0 "[ . 1 . 2]" 1
139 1 15 PHE HB3 1 84 LEU MD1 0.000 . 9.670 4.330 3.196 5.486 . 0 0 "[ . 1 . 2]" 1
140 1 15 PHE HB3 1 84 LEU MD2 0.000 . 9.670 4.512 2.070 6.032 . 0 0 "[ . 1 . 2]" 1
141 1 15 PHE QD 1 17 SER HA 0.000 . 7.160 4.025 2.522 5.000 . 0 0 "[ . 1 . 2]" 1
142 1 15 PHE QD 1 17 SER QB 0.000 . 8.500 4.627 3.191 6.608 . 0 0 "[ . 1 . 2]" 1
143 1 15 PHE QD 1 73 VAL MG1 0.000 . 7.870 6.384 5.120 7.578 . 0 0 "[ . 1 . 2]" 1
144 1 15 PHE QD 1 73 VAL QG 0.000 . 7.480 4.428 3.466 5.391 . 0 0 "[ . 1 . 2]" 1
145 1 15 PHE QD 1 73 VAL MG2 0.000 . 7.870 4.527 3.510 5.517 . 0 0 "[ . 1 . 2]" 1
146 1 15 PHE QE 1 17 SER HA 0.000 . 6.850 4.115 1.969 6.937 0.087 1 0 "[ . 1 . 2]" 1
147 1 15 PHE QE 1 17 SER QB 0.000 . 8.500 4.657 2.212 8.283 . 0 0 "[ . 1 . 2]" 1
148 1 15 PHE QE 1 73 VAL MG1 0.000 . 7.810 5.509 3.394 7.204 . 0 0 "[ . 1 . 2]" 1
149 1 15 PHE QE 1 73 VAL QG 0.000 . 7.530 3.642 2.354 5.814 . 0 0 "[ . 1 . 2]" 1
150 1 15 PHE QE 1 73 VAL MG2 0.000 . 7.810 3.733 2.362 6.186 . 0 0 "[ . 1 . 2]" 1
151 1 16 ILE H 1 16 ILE HB 0.000 . 3.520 2.545 2.300 3.166 . 0 0 "[ . 1 . 2]" 1
152 1 16 ILE H 1 16 ILE MD 0.000 . 5.160 3.526 2.221 4.384 . 0 0 "[ . 1 . 2]" 1
153 1 16 ILE H 1 16 ILE HG12 0.000 . 5.070 3.861 2.459 4.904 . 0 0 "[ . 1 . 2]" 1
154 1 16 ILE H 1 16 ILE QG 0.000 . 4.910 2.950 2.364 4.100 . 0 0 "[ . 1 . 2]" 1
155 1 16 ILE H 1 16 ILE HG13 0.000 . 5.070 3.208 2.397 4.395 . 0 0 "[ . 1 . 2]" 1
156 1 16 ILE H 1 17 SER H 0.000 . 4.380 4.229 3.981 4.398 0.018 14 0 "[ . 1 . 2]" 1
157 1 16 ILE H 1 19 LYS H 0.000 . 4.350 4.450 4.363 4.557 0.207 2 0 "[ . 1 . 2]" 1
158 1 16 ILE H 1 19 LYS QB 0.000 . 5.480 4.311 3.462 5.412 . 0 0 "[ . 1 . 2]" 1
159 1 16 ILE H 1 20 SER H 0.000 . 4.540 3.802 3.342 4.329 . 0 0 "[ . 1 . 2]" 1
160 1 16 ILE H 1 20 SER HB2 0.000 . 4.790 3.707 2.469 4.843 0.053 8 0 "[ . 1 . 2]" 1
161 1 16 ILE H 1 20 SER QB 0.000 . 4.450 3.183 2.427 3.914 . 0 0 "[ . 1 . 2]" 1
162 1 16 ILE H 1 20 SER HB3 0.000 . 4.790 3.966 3.214 4.848 0.058 14 0 "[ . 1 . 2]" 1
163 1 16 ILE H 1 25 GLU QB 0.000 . 6.380 5.987 4.622 6.496 0.116 18 0 "[ . 1 . 2]" 1
164 1 16 ILE H 1 25 GLU QG 0.000 . 6.380 5.450 3.956 6.563 0.183 2 0 "[ . 1 . 2]" 1
165 1 16 ILE HA 1 16 ILE MD 0.000 . 4.540 3.382 2.044 3.902 . 0 0 "[ . 1 . 2]" 1
166 1 16 ILE HA 1 17 SER H 0.000 . 3.170 2.160 2.081 2.218 . 0 0 "[ . 1 . 2]" 1
167 1 16 ILE HA 1 18 GLU H 0.000 . 4.690 3.786 3.621 4.058 . 0 0 "[ . 1 . 2]" 1
168 1 16 ILE HA 1 80 ASP HA 0.000 . 3.790 3.719 3.069 3.884 0.094 4 0 "[ . 1 . 2]" 1
169 1 16 ILE HB 1 17 SER H 0.000 . 4.540 4.285 4.215 4.376 . 0 0 "[ . 1 . 2]" 1
170 1 16 ILE HB 1 19 LYS H 0.000 . 4.200 3.216 2.916 4.303 0.103 10 0 "[ . 1 . 2]" 1
171 1 16 ILE MD 1 17 SER H 0.000 . 5.630 4.861 2.295 5.477 . 0 0 "[ . 1 . 2]" 1
172 1 16 ILE MD 1 18 GLU H 0.000 . 6.500 5.006 2.743 5.474 . 0 0 "[ . 1 . 2]" 1
173 1 16 ILE MD 1 19 LYS H 0.000 . 5.720 4.840 4.036 5.387 . 0 0 "[ . 1 . 2]" 1
174 1 16 ILE MD 1 19 LYS QE 0.000 . 7.090 4.723 2.351 7.089 . 0 0 "[ . 1 . 2]" 1
175 1 16 ILE MD 1 80 ASP QB 0.000 . 7.400 4.638 2.802 5.706 . 0 0 "[ . 1 . 2]" 1
176 1 16 ILE QG 1 17 SER H 0.000 . 6.380 4.248 3.128 4.827 . 0 0 "[ . 1 . 2]" 1
177 1 16 ILE MG 1 17 SER H 0.000 . 4.790 2.982 2.725 4.144 . 0 0 "[ . 1 . 2]" 1
178 1 16 ILE MG 1 18 GLU H 0.000 . 4.880 2.023 1.718 3.373 . 0 0 "[ . 1 . 2]" 1
179 1 16 ILE MG 1 19 LYS H 0.000 . 4.230 2.528 1.829 2.976 . 0 0 "[ . 1 . 2]" 1
180 1 16 ILE MG 1 19 LYS HA 0.000 . 5.540 4.897 3.861 5.445 . 0 0 "[ . 1 . 2]" 1
181 1 16 ILE MG 1 19 LYS QE 0.000 . 7.400 4.253 2.318 7.155 . 0 0 "[ . 1 . 2]" 1
182 1 16 ILE MG 1 19 LYS QG 0.000 . 5.700 4.444 2.679 5.692 . 0 0 "[ . 1 . 2]" 1
183 1 16 ILE MG 1 20 SER H 0.000 . 5.600 3.851 2.140 4.226 . 0 0 "[ . 1 . 2]" 1
184 1 16 ILE MG 1 80 ASP QB 0.000 . 7.400 3.597 3.229 4.657 . 0 0 "[ . 1 . 2]" 1
185 1 17 SER H 1 18 GLU H 0.000 . 4.350 2.685 2.557 2.875 . 0 0 "[ . 1 . 2]" 1
186 1 17 SER H 1 19 LYS H 0.000 . 4.540 4.484 4.311 4.593 0.053 7 0 "[ . 1 . 2]" 1
187 1 17 SER H 1 20 SER H 0.000 . 5.160 4.748 4.614 5.053 . 0 0 "[ . 1 . 2]" 1
188 1 17 SER H 1 20 SER QB 0.000 . 5.360 4.709 4.197 5.365 0.005 16 0 "[ . 1 . 2]" 1
189 1 17 SER H 1 80 ASP H 0.000 . 4.660 3.253 2.698 4.171 . 0 0 "[ . 1 . 2]" 1
190 1 17 SER H 1 80 ASP QB 0.000 . 6.380 1.882 1.645 2.163 . 0 0 "[ . 1 . 2]" 1
191 1 17 SER HA 1 21 SER H 0.000 . 4.760 3.831 3.156 4.220 . 0 0 "[ . 1 . 2]" 1
192 1 17 SER HA 1 80 ASP H 0.000 . 3.920 3.930 3.480 4.016 0.096 6 0 "[ . 1 . 2]" 1
193 1 17 SER QB 1 20 SER H 0.000 . 6.040 5.149 4.866 5.734 . 0 0 "[ . 1 . 2]" 1
194 1 17 SER QB 1 21 SER H 0.000 . 5.690 5.211 4.500 5.564 . 0 0 "[ . 1 . 2]" 1
195 1 17 SER QB 1 80 ASP H 0.000 . 6.380 2.084 1.681 3.498 . 0 0 "[ . 1 . 2]" 1
196 1 18 GLU H 1 18 GLU HB2 0.000 . 3.580 2.493 2.294 2.670 . 0 0 "[ . 1 . 2]" 1
197 1 18 GLU H 1 18 GLU HB3 0.000 . 3.580 2.790 2.443 3.607 0.027 5 0 "[ . 1 . 2]" 1
198 1 18 GLU H 1 19 LYS H 0.000 . 4.010 2.645 2.398 2.788 . 0 0 "[ . 1 . 2]" 1
199 1 18 GLU H 1 20 SER H 0.000 . 4.970 3.904 3.758 4.066 . 0 0 "[ . 1 . 2]" 1
200 1 18 GLU H 1 21 SER H 0.000 . 4.790 4.846 4.746 4.912 0.122 3 0 "[ . 1 . 2]" 1
201 1 18 GLU HA 1 18 GLU HB2 0.000 . 3.050 2.607 2.416 3.016 . 0 0 "[ . 1 . 2]" 1
202 1 18 GLU HA 1 18 GLU HB3 0.000 . 3.050 2.872 2.399 3.038 . 0 0 "[ . 1 . 2]" 1
203 1 18 GLU QB 1 20 SER H 0.000 . 5.670 4.533 4.336 4.752 . 0 0 "[ . 1 . 2]" 1
204 1 18 GLU HB2 1 19 LYS H 0.000 . 3.920 3.617 2.481 3.990 0.070 13 0 "[ . 1 . 2]" 1
205 1 18 GLU HB3 1 19 LYS H 0.000 . 3.920 2.940 2.548 3.937 0.017 4 0 "[ . 1 . 2]" 1
206 1 18 GLU QG 1 19 LYS H 0.000 . 6.380 3.887 3.446 4.528 . 0 0 "[ . 1 . 2]" 1
207 1 18 GLU QG 1 20 SER H 0.000 . 6.380 5.561 5.216 6.216 . 0 0 "[ . 1 . 2]" 1
208 1 19 LYS H 1 19 LYS HB2 0.000 . 4.010 2.699 2.434 3.740 . 0 0 "[ . 1 . 2]" 1
209 1 19 LYS H 1 19 LYS QB 0.000 . 3.770 2.454 2.238 2.815 . 0 0 "[ . 1 . 2]" 1
210 1 19 LYS H 1 19 LYS HB3 0.000 . 4.010 3.199 2.454 3.816 . 0 0 "[ . 1 . 2]" 1
211 1 19 LYS H 1 19 LYS QE 0.000 . 6.380 4.362 2.533 5.977 . 0 0 "[ . 1 . 2]" 1
212 1 19 LYS H 1 19 LYS HG2 0.000 . 5.100 4.281 2.136 4.793 . 0 0 "[ . 1 . 2]" 1
213 1 19 LYS H 1 19 LYS QG 0.000 . 4.690 3.588 2.111 4.086 . 0 0 "[ . 1 . 2]" 1
214 1 19 LYS H 1 19 LYS HG3 0.000 . 5.100 3.958 2.666 4.634 . 0 0 "[ . 1 . 2]" 1
215 1 19 LYS H 1 20 SER H 0.000 . 3.520 2.123 2.008 2.298 . 0 0 "[ . 1 . 2]" 1
216 1 19 LYS H 1 21 SER H 0.000 . 3.980 3.683 3.409 3.880 . 0 0 "[ . 1 . 2]" 1
217 1 19 LYS HA 1 21 SER H 0.000 . 3.700 3.624 3.405 3.785 0.085 15 0 "[ . 1 . 2]" 1
218 1 19 LYS HA 1 22 LYS H 0.000 . 4.320 4.095 3.846 4.396 0.076 2 0 "[ . 1 . 2]" 1
219 1 19 LYS HB2 1 20 SER H 0.000 . 4.040 3.325 2.545 4.039 . 0 0 "[ . 1 . 2]" 1
220 1 19 LYS HB3 1 20 SER H 0.000 . 4.040 3.295 2.528 4.059 0.019 6 0 "[ . 1 . 2]" 1
221 1 19 LYS QE 1 20 SER H 0.000 . 6.380 5.327 3.847 6.088 . 0 0 "[ . 1 . 2]" 1
222 1 19 LYS QG 1 22 LYS H 0.000 . 5.640 5.299 4.386 5.815 0.175 12 0 "[ . 1 . 2]" 1
223 1 19 LYS HG2 1 20 SER H 0.000 . 5.500 4.691 2.747 5.292 . 0 0 "[ . 1 . 2]" 1
224 1 19 LYS HG3 1 20 SER H 0.000 . 5.500 4.580 2.871 5.109 . 0 0 "[ . 1 . 2]" 1
225 1 20 SER H 1 20 SER HB2 0.000 . 4.010 2.817 2.373 3.579 . 0 0 "[ . 1 . 2]" 1
226 1 20 SER H 1 20 SER HB3 0.000 . 4.010 3.110 2.479 3.618 . 0 0 "[ . 1 . 2]" 1
227 1 20 SER H 1 21 SER H 0.000 . 3.640 2.654 2.558 2.736 . 0 0 "[ . 1 . 2]" 1
228 1 20 SER HA 1 22 LYS H 0.000 . 3.950 3.387 2.886 3.903 . 0 0 "[ . 1 . 2]" 1
229 1 20 SER HA 1 23 SER H 0.000 . 3.550 2.965 2.373 3.389 . 0 0 "[ . 1 . 2]" 1
230 1 20 SER HA 1 69 TRP HE1 0.000 . 5.500 2.866 1.815 3.489 . 0 0 "[ . 1 . 2]" 1
231 1 20 SER QB 1 69 TRP HE1 0.000 . 6.380 2.538 1.983 3.175 . 0 0 "[ . 1 . 2]" 1
232 1 20 SER QB 1 69 TRP HZ2 0.000 . 4.180 3.097 2.186 3.775 . 0 0 "[ . 1 . 2]" 1
233 1 20 SER HB2 1 69 TRP HZ2 0.000 . 4.510 3.904 2.206 4.588 0.078 18 0 "[ . 1 . 2]" 1
234 1 20 SER HB3 1 69 TRP HZ2 0.000 . 4.510 3.685 2.752 4.550 0.040 1 0 "[ . 1 . 2]" 1
235 1 21 SER H 1 73 VAL QG 0.000 . 8.090 4.065 3.714 4.686 . 0 0 "[ . 1 . 2]" 1
236 1 21 SER HA 1 73 VAL QG 0.000 . 7.280 2.204 1.877 2.977 . 0 0 "[ . 1 . 2]" 1
237 1 22 LYS H 1 22 LYS HB2 0.000 . 3.790 3.246 2.681 3.903 0.113 13 0 "[ . 1 . 2]" 1
238 1 22 LYS H 1 22 LYS HB3 0.000 . 3.790 3.152 2.569 3.834 0.044 12 0 "[ . 1 . 2]" 1
239 1 22 LYS H 1 23 SER H 0.000 . 3.170 1.946 1.756 2.229 . 0 0 "[ . 1 . 2]" 1
240 1 22 LYS H 1 69 TRP HD1 0.000 . 5.500 3.851 3.418 4.482 . 0 0 "[ . 1 . 2]" 1
241 1 22 LYS HA 1 69 TRP HD1 0.000 . 4.100 3.642 2.951 4.158 0.058 4 0 "[ . 1 . 2]" 1
242 1 22 LYS HA 1 70 GLU QB 0.000 . 5.880 2.770 1.904 4.371 . 0 0 "[ . 1 . 2]" 1
243 1 22 LYS HA 1 70 GLU HG2 0.000 . 5.500 4.759 3.792 5.553 0.053 4 0 "[ . 1 . 2]" 1
244 1 22 LYS HA 1 70 GLU HG3 0.000 . 5.500 4.286 2.843 5.554 0.054 5 0 "[ . 1 . 2]" 1
245 1 22 LYS QB 1 23 SER H 0.000 . 3.880 3.125 2.538 3.654 . 0 0 "[ . 1 . 2]" 1
246 1 22 LYS HB2 1 23 SER H 0.000 . 4.040 3.779 2.934 4.070 0.030 7 0 "[ . 1 . 2]" 1
247 1 22 LYS HB3 1 23 SER H 0.000 . 4.040 3.557 2.571 4.194 0.154 15 0 "[ . 1 . 2]" 1
248 1 23 SER H 1 69 TRP HD1 0.000 . 5.500 3.309 2.866 3.901 . 0 0 "[ . 1 . 2]" 1
249 1 23 SER H 1 69 TRP HE1 0.000 . 5.500 4.442 3.779 5.205 . 0 0 "[ . 1 . 2]" 1
250 1 23 SER HA 1 67 VAL H 0.000 . 5.250 5.300 5.104 5.433 0.183 6 0 "[ . 1 . 2]" 1
251 1 23 SER HA 1 69 TRP HE1 0.000 . 5.500 5.075 4.576 5.426 . 0 0 "[ . 1 . 2]" 1
252 1 23 SER QB 1 24 LEU H 0.000 . 3.630 2.609 2.283 2.823 . 0 0 "[ . 1 . 2]" 1
253 1 23 SER QB 1 66 THR HA 0.000 . 4.690 2.464 2.072 3.389 . 0 0 "[ . 1 . 2]" 1
254 1 23 SER QB 1 66 THR MG 0.000 . 6.290 3.536 2.249 5.005 . 0 0 "[ . 1 . 2]" 1
255 1 23 SER QB 1 69 TRP HD1 0.000 . 5.050 4.721 4.438 5.014 . 0 0 "[ . 1 . 2]" 1
256 1 23 SER HB2 1 24 LEU H 0.000 . 3.790 3.029 2.305 3.861 0.071 13 0 "[ . 1 . 2]" 1
257 1 23 SER HB2 1 64 PHE QB 0.000 . 6.380 4.020 2.062 6.402 0.022 6 0 "[ . 1 . 2]" 1
258 1 23 SER HB2 1 66 THR HA 0.000 . 5.070 3.313 2.382 4.823 . 0 0 "[ . 1 . 2]" 1
259 1 23 SER HB3 1 24 LEU H 0.000 . 3.790 3.407 2.432 3.855 0.065 8 0 "[ . 1 . 2]" 1
260 1 23 SER HB3 1 64 PHE QB 0.000 . 6.380 4.395 2.544 6.423 0.043 3 0 "[ . 1 . 2]" 1
261 1 23 SER HB3 1 66 THR HA 0.000 . 5.070 2.582 2.163 3.462 . 0 0 "[ . 1 . 2]" 1
262 1 24 LEU H 1 24 LEU HG 0.000 . 5.500 4.248 2.959 5.015 . 0 0 "[ . 1 . 2]" 1
263 1 24 LEU H 1 25 GLU H 0.000 . 4.720 4.318 3.991 4.475 . 0 0 "[ . 1 . 2]" 1
264 1 24 LEU H 1 64 PHE HA 0.000 . 4.940 4.810 4.316 5.046 0.106 3 0 "[ . 1 . 2]" 1
265 1 24 LEU H 1 64 PHE QD 0.000 . 7.620 5.034 4.556 5.818 . 0 0 "[ . 1 . 2]" 1
266 1 24 LEU H 1 65 LEU H 0.000 . 4.290 3.051 2.652 3.336 . 0 0 "[ . 1 . 2]" 1
267 1 24 LEU H 1 65 LEU HB2 0.000 . 5.500 3.186 2.203 4.597 . 0 0 "[ . 1 . 2]" 1
268 1 24 LEU H 1 65 LEU HB3 0.000 . 5.500 3.285 2.290 4.231 . 0 0 "[ . 1 . 2]" 1
269 1 24 LEU H 1 65 LEU QD 0.000 . 8.100 3.462 2.522 4.036 . 0 0 "[ . 1 . 2]" 1
270 1 24 LEU H 1 66 THR HA 0.000 . 4.570 3.961 3.251 4.606 0.036 13 0 "[ . 1 . 2]" 1
271 1 24 LEU H 1 66 THR MG 0.000 . 6.530 5.156 4.233 5.906 . 0 0 "[ . 1 . 2]" 1
272 1 24 LEU H 1 69 TRP QB 0.000 . 6.380 3.469 3.004 3.834 . 0 0 "[ . 1 . 2]" 1
273 1 24 LEU H 1 69 TRP HD1 0.000 . 5.500 4.331 3.480 5.144 . 0 0 "[ . 1 . 2]" 1
274 1 24 LEU HA 1 69 TRP HE1 0.000 . 5.500 4.474 3.357 5.340 . 0 0 "[ . 1 . 2]" 1
275 1 24 LEU QB 1 25 GLU H 0.000 . 5.420 3.542 2.788 3.921 . 0 0 "[ . 1 . 2]" 1
276 1 24 LEU QB 1 65 LEU H 0.000 . 6.380 3.169 2.630 3.969 . 0 0 "[ . 1 . 2]" 1
277 1 24 LEU QB 1 65 LEU QD 0.000 . 8.450 2.128 1.835 2.883 . 0 0 "[ . 1 . 2]" 1
278 1 24 LEU QB 1 69 TRP HE1 0.000 . 6.380 4.521 3.425 5.859 . 0 0 "[ . 1 . 2]" 1
279 1 24 LEU HB2 1 65 LEU HB2 0.000 . 5.500 3.173 1.851 5.377 . 0 0 "[ . 1 . 2]" 1
280 1 24 LEU HB2 1 65 LEU HB3 0.000 . 5.500 3.520 1.806 4.607 . 0 0 "[ . 1 . 2]" 1
281 1 24 LEU HB3 1 65 LEU HB2 0.000 . 5.500 2.834 1.853 4.161 . 0 0 "[ . 1 . 2]" 1
282 1 24 LEU HB3 1 65 LEU HB3 0.000 . 5.500 3.395 1.828 5.402 . 0 0 "[ . 1 . 2]" 1
283 1 24 LEU QD 1 25 GLU H 0.000 . 5.630 2.661 2.048 3.347 . 0 0 "[ . 1 . 2]" 1
284 1 24 LEU QD 1 69 TRP HE1 0.000 . 8.100 4.031 3.062 5.155 . 0 0 "[ . 1 . 2]" 1
285 1 24 LEU QD 1 69 TRP HH2 0.000 . 6.330 3.112 2.645 3.603 . 0 0 "[ . 1 . 2]" 1
286 1 24 LEU QD 1 69 TRP HZ2 0.000 . 4.740 3.248 2.491 4.391 . 0 0 "[ . 1 . 2]" 1
287 1 24 LEU QD 1 69 TRP HZ3 0.000 . 4.910 2.934 2.399 4.017 . 0 0 "[ . 1 . 2]" 1
288 1 24 LEU QD 1 84 LEU QB 0.000 . 7.880 4.445 3.767 5.298 . 0 0 "[ . 1 . 2]" 1
289 1 24 LEU QD 1 84 LEU QD 0.000 . 7.370 3.083 1.846 3.968 . 0 0 "[ . 1 . 2]" 1
290 1 24 LEU QD 1 84 LEU HG 0.000 . 7.350 5.077 3.628 6.383 . 0 0 "[ . 1 . 2]" 1
291 1 24 LEU QD 1 86 PHE QE 0.000 . 7.430 2.537 2.158 2.957 . 0 0 "[ . 1 . 2]" 1
292 1 24 LEU MD1 1 25 GLU H 0.000 . 6.530 4.256 2.212 4.987 . 0 0 "[ . 1 . 2]" 1
293 1 24 LEU MD1 1 69 TRP HZ2 0.000 . 5.570 4.192 2.606 5.493 . 0 0 "[ . 1 . 2]" 1
294 1 24 LEU MD1 1 69 TRP HZ3 0.000 . 5.320 3.163 2.404 4.863 . 0 0 "[ . 1 . 2]" 1
295 1 24 LEU MD1 1 84 LEU HB2 0.000 . 9.670 5.416 4.493 6.749 . 0 0 "[ . 1 . 2]" 1
296 1 24 LEU MD1 1 84 LEU HB3 0.000 . 9.670 5.822 4.600 7.676 . 0 0 "[ . 1 . 2]" 1
297 1 24 LEU MD1 1 84 LEU MD1 0.000 . 9.360 4.389 2.510 6.349 . 0 0 "[ . 1 . 2]" 1
298 1 24 LEU MD1 1 84 LEU MD2 0.000 . 9.360 4.189 3.283 5.796 . 0 0 "[ . 1 . 2]" 1
299 1 24 LEU MD1 1 86 PHE QE 0.000 . 8.650 2.653 2.225 3.448 . 0 0 "[ . 1 . 2]" 1
300 1 24 LEU MD2 1 25 GLU H 0.000 . 6.530 2.818 2.135 4.238 . 0 0 "[ . 1 . 2]" 1
301 1 24 LEU MD2 1 69 TRP HZ2 0.000 . 5.570 3.873 2.497 5.588 0.018 14 0 "[ . 1 . 2]" 1
302 1 24 LEU MD2 1 69 TRP HZ3 0.000 . 5.320 4.591 2.533 5.382 0.062 9 0 "[ . 1 . 2]" 1
303 1 24 LEU MD2 1 84 LEU HB2 0.000 . 9.670 5.551 4.455 7.666 . 0 0 "[ . 1 . 2]" 1
304 1 24 LEU MD2 1 84 LEU HB3 0.000 . 9.670 6.093 5.026 7.935 . 0 0 "[ . 1 . 2]" 1
305 1 24 LEU MD2 1 84 LEU MD1 0.000 . 9.360 4.459 2.521 6.449 . 0 0 "[ . 1 . 2]" 1
306 1 24 LEU MD2 1 84 LEU MD2 0.000 . 9.360 4.228 1.902 6.599 . 0 0 "[ . 1 . 2]" 1
307 1 24 LEU MD2 1 86 PHE QE 0.000 . 8.650 3.494 2.833 4.466 . 0 0 "[ . 1 . 2]" 1
308 1 24 LEU HG 1 25 GLU H 0.000 . 5.440 4.270 2.656 5.137 . 0 0 "[ . 1 . 2]" 1
309 1 24 LEU HG 1 69 TRP HH2 0.000 . 5.380 4.147 3.223 5.437 0.057 6 0 "[ . 1 . 2]" 1
310 1 25 GLU H 1 25 GLU HB2 0.000 . 3.790 3.155 2.239 3.719 . 0 0 "[ . 1 . 2]" 1
311 1 25 GLU H 1 25 GLU HB3 0.000 . 3.790 2.886 2.314 3.685 . 0 0 "[ . 1 . 2]" 1
312 1 25 GLU H 1 64 PHE QD 0.000 . 7.620 4.881 3.820 5.906 . 0 0 "[ . 1 . 2]" 1
313 1 25 GLU H 1 84 LEU QD 0.000 . 8.100 6.445 4.848 7.230 . 0 0 "[ . 1 . 2]" 1
314 1 25 GLU HA 1 26 ILE H 0.000 . 3.360 2.180 2.103 2.325 . 0 0 "[ . 1 . 2]" 1
315 1 25 GLU HA 1 64 PHE HA 0.000 . 3.700 3.243 2.650 3.760 0.060 14 0 "[ . 1 . 2]" 1
316 1 25 GLU HA 1 64 PHE QD 0.000 . 7.620 2.708 1.904 3.795 . 0 0 "[ . 1 . 2]" 1
317 1 25 GLU HA 1 65 LEU H 0.000 . 4.100 3.937 3.329 4.213 0.113 10 0 "[ . 1 . 2]" 1
318 1 25 GLU HG2 1 26 ILE H 0.000 . 5.500 4.827 3.453 5.544 0.044 16 0 "[ . 1 . 2]" 1
319 1 25 GLU HG3 1 26 ILE H 0.000 . 5.500 4.638 3.091 5.321 . 0 0 "[ . 1 . 2]" 1
320 1 26 ILE H 1 26 ILE HB 0.000 . 3.670 2.472 2.345 2.595 . 0 0 "[ . 1 . 2]" 1
321 1 26 ILE H 1 26 ILE MD 0.000 . 5.690 3.725 2.346 4.068 . 0 0 "[ . 1 . 2]" 1
322 1 26 ILE H 1 26 ILE HG12 0.000 . 4.660 3.337 2.440 4.192 . 0 0 "[ . 1 . 2]" 1
323 1 26 ILE H 1 26 ILE QG 0.000 . 4.520 2.648 2.394 3.590 . 0 0 "[ . 1 . 2]" 1
324 1 26 ILE H 1 26 ILE HG13 0.000 . 4.660 3.234 2.430 4.046 . 0 0 "[ . 1 . 2]" 1
325 1 26 ILE H 1 63 VAL HB 0.000 . 5.500 4.718 3.854 5.558 0.058 3 0 "[ . 1 . 2]" 1
326 1 26 ILE H 1 64 PHE HA 0.000 . 4.480 3.135 2.632 3.646 . 0 0 "[ . 1 . 2]" 1
327 1 26 ILE H 1 64 PHE QD 0.000 . 7.620 3.854 1.811 4.879 . 0 0 "[ . 1 . 2]" 1
328 1 26 ILE H 1 65 LEU H 0.000 . 4.540 4.266 3.819 4.587 0.047 11 0 "[ . 1 . 2]" 1
329 1 26 ILE HA 1 26 ILE MD 0.000 . 4.730 3.095 2.055 3.874 . 0 0 "[ . 1 . 2]" 1
330 1 26 ILE HA 1 27 PRO HD2 0.000 . 4.040 2.509 1.947 2.810 . 0 0 "[ . 1 . 2]" 1
331 1 26 ILE HA 1 27 PRO HD3 0.000 . 4.040 2.041 1.893 2.535 . 0 0 "[ . 1 . 2]" 1
332 1 26 ILE HB 1 65 LEU H 0.000 . 5.500 5.105 4.457 5.560 0.060 1 0 "[ . 1 . 2]" 1
333 1 26 ILE MD 1 27 PRO HD2 0.000 . 6.530 4.231 3.280 4.956 . 0 0 "[ . 1 . 2]" 1
334 1 26 ILE MD 1 27 PRO QD 0.000 . 6.060 3.867 2.936 4.594 . 0 0 "[ . 1 . 2]" 1
335 1 26 ILE MD 1 27 PRO HD3 0.000 . 6.530 4.530 3.195 5.680 . 0 0 "[ . 1 . 2]" 1
336 1 26 ILE MD 1 34 PHE QE 0.000 . 6.700 5.027 2.710 6.712 0.012 6 0 "[ . 1 . 2]" 1
337 1 26 ILE MD 1 63 VAL MG1 0.000 . 7.250 3.367 1.877 5.812 . 0 0 "[ . 1 . 2]" 1
338 1 26 ILE MD 1 63 VAL QG 0.000 . 6.740 2.738 1.872 3.732 . 0 0 "[ . 1 . 2]" 1
339 1 26 ILE MD 1 63 VAL MG2 0.000 . 7.250 3.745 2.073 4.974 . 0 0 "[ . 1 . 2]" 1
340 1 26 ILE MD 1 64 PHE H 0.000 . 6.530 5.102 3.772 6.492 . 0 0 "[ . 1 . 2]" 1
341 1 26 ILE MD 1 65 LEU H 0.000 . 5.850 3.994 2.477 4.727 . 0 0 "[ . 1 . 2]" 1
342 1 26 ILE MD 1 65 LEU HG 0.000 . 4.480 4.055 2.162 4.551 0.071 2 0 "[ . 1 . 2]" 1
343 1 26 ILE QG 1 27 PRO QD 0.000 . 4.810 3.781 3.285 4.279 . 0 0 "[ . 1 . 2]" 1
344 1 26 ILE QG 1 34 PHE QE 0.000 . 8.500 6.005 4.437 7.822 . 0 0 "[ . 1 . 2]" 1
345 1 26 ILE QG 1 63 VAL QG 0.000 . 6.890 2.994 2.097 4.170 . 0 0 "[ . 1 . 2]" 1
346 1 26 ILE HG12 1 27 PRO HD2 0.000 . 5.820 4.577 3.475 5.417 . 0 0 "[ . 1 . 2]" 1
347 1 26 ILE HG12 1 27 PRO HD3 0.000 . 5.820 4.651 4.016 5.399 . 0 0 "[ . 1 . 2]" 1
348 1 26 ILE HG13 1 27 PRO HD2 0.000 . 5.820 5.124 3.770 5.469 . 0 0 "[ . 1 . 2]" 1
349 1 26 ILE HG13 1 27 PRO HD3 0.000 . 5.820 5.245 4.051 5.718 . 0 0 "[ . 1 . 2]" 1
350 1 26 ILE MG 1 27 PRO HD2 0.000 . 4.760 2.293 2.018 2.642 . 0 0 "[ . 1 . 2]" 1
351 1 26 ILE MG 1 27 PRO QD 0.000 . 4.300 2.250 1.998 2.571 . 0 0 "[ . 1 . 2]" 1
352 1 26 ILE MG 1 27 PRO HD3 0.000 . 4.760 3.306 3.002 3.661 . 0 0 "[ . 1 . 2]" 1
353 1 26 ILE MG 1 30 PHE H 0.000 . 6.370 4.024 3.480 4.632 . 0 0 "[ . 1 . 2]" 1
354 1 26 ILE MG 1 30 PHE HB2 0.000 . 6.000 3.618 2.099 4.424 . 0 0 "[ . 1 . 2]" 1
355 1 26 ILE MG 1 30 PHE QB 0.000 . 5.300 2.457 2.059 2.949 . 0 0 "[ . 1 . 2]" 1
356 1 26 ILE MG 1 30 PHE HB3 0.000 . 6.000 2.560 2.171 3.040 . 0 0 "[ . 1 . 2]" 1
357 1 26 ILE MG 1 30 PHE QD 0.000 . 6.480 2.255 1.810 4.165 . 0 0 "[ . 1 . 2]" 1
358 1 26 ILE MG 1 34 PHE QD 0.000 . 8.650 5.594 4.593 6.630 . 0 0 "[ . 1 . 2]" 1
359 1 26 ILE MG 1 34 PHE QE 0.000 . 6.670 4.142 2.812 5.573 . 0 0 "[ . 1 . 2]" 1
360 1 27 PRO HA 1 28 LEU H 0.000 . 3.020 2.180 2.100 2.258 . 0 0 "[ . 1 . 2]" 1
361 1 27 PRO QB 1 28 LEU H 0.000 . 4.240 3.045 2.755 3.215 . 0 0 "[ . 1 . 2]" 1
362 1 27 PRO QB 1 29 GLY H 0.000 . 5.760 2.992 2.703 3.406 . 0 0 "[ . 1 . 2]" 1
363 1 27 PRO QB 1 30 PHE H 0.000 . 4.320 2.591 2.064 3.038 . 0 0 "[ . 1 . 2]" 1
364 1 27 PRO QB 1 30 PHE QB 0.000 . 7.130 2.844 1.996 3.799 . 0 0 "[ . 1 . 2]" 1
365 1 27 PRO QB 1 30 PHE QD 0.000 . 8.190 4.453 1.979 5.667 . 0 0 "[ . 1 . 2]" 1
366 1 27 PRO QB 1 31 ASN H 0.000 . 5.360 4.235 3.700 5.005 . 0 0 "[ . 1 . 2]" 1
367 1 27 PRO HB2 1 30 PHE H 0.000 . 4.790 2.623 2.076 3.078 . 0 0 "[ . 1 . 2]" 1
368 1 27 PRO HB3 1 30 PHE H 0.000 . 4.790 4.072 3.294 4.704 . 0 0 "[ . 1 . 2]" 1
369 1 27 PRO QD 1 28 LEU H 0.000 . 5.430 4.966 4.894 5.017 . 0 0 "[ . 1 . 2]" 1
370 1 27 PRO QD 1 30 PHE QD 0.000 . 7.080 3.725 2.455 4.339 . 0 0 "[ . 1 . 2]" 1
371 1 27 PRO QD 1 34 PHE QE 0.000 . 6.920 6.402 4.768 7.008 0.088 20 0 "[ . 1 . 2]" 1
372 1 27 PRO QG 1 30 PHE H 0.000 . 6.380 4.296 3.043 4.715 . 0 0 "[ . 1 . 2]" 1
373 1 28 LEU H 1 28 LEU HG 0.000 . 4.480 4.248 3.510 4.498 0.018 11 0 "[ . 1 . 2]" 1
374 1 28 LEU H 1 29 GLY H 0.000 . 3.890 2.690 2.491 2.890 . 0 0 "[ . 1 . 2]" 1
375 1 28 LEU HA 1 28 LEU HG 0.000 . 3.170 2.769 2.482 3.213 0.043 5 0 "[ . 1 . 2]" 1
376 1 28 LEU HA 1 30 PHE H 0.000 . 4.230 4.068 3.527 4.281 0.051 17 0 "[ . 1 . 2]" 1
377 1 28 LEU HA 1 31 ASN H 0.000 . 4.540 3.231 2.916 3.542 . 0 0 "[ . 1 . 2]" 1
378 1 28 LEU HA 1 31 ASN QD 0.000 . 6.370 3.267 1.625 4.560 . 0 0 "[ . 1 . 2]" 1
379 1 28 LEU QB 1 29 GLY H 0.000 . 5.260 2.718 2.421 3.138 . 0 0 "[ . 1 . 2]" 1
380 1 28 LEU QB 1 31 ASN H 0.000 . 6.250 4.818 4.475 5.089 . 0 0 "[ . 1 . 2]" 1
381 1 28 LEU QD 1 29 GLY H 0.000 . 7.790 3.658 3.218 4.035 . 0 0 "[ . 1 . 2]" 1
382 1 28 LEU QD 1 30 PHE H 0.000 . 8.100 4.879 4.544 5.327 . 0 0 "[ . 1 . 2]" 1
383 1 28 LEU QD 1 31 ASN H 0.000 . 8.100 4.492 3.984 5.238 . 0 0 "[ . 1 . 2]" 1
384 1 28 LEU QD 1 31 ASN QD 0.000 . 6.270 3.558 2.026 5.246 . 0 0 "[ . 1 . 2]" 1
385 1 28 LEU QD 1 61 GLU QB 0.000 . 5.180 2.626 2.082 3.682 . 0 0 "[ . 1 . 2]" 1
386 1 28 LEU QD 1 61 GLU QG 0.000 . 7.490 3.538 2.105 5.312 . 0 0 "[ . 1 . 2]" 1
387 1 28 LEU QD 1 62 LYS H 0.000 . 5.950 4.678 3.814 5.838 . 0 0 "[ . 1 . 2]" 1
388 1 28 LEU QD 1 62 LYS HA 0.000 . 6.920 3.783 2.838 4.727 . 0 0 "[ . 1 . 2]" 1
389 1 28 LEU QD 1 62 LYS QE 0.000 . 7.300 3.585 2.049 5.646 . 0 0 "[ . 1 . 2]" 1
390 1 28 LEU MD1 1 31 ASN HD21 0.000 . 8.260 4.579 2.043 7.302 . 0 0 "[ . 1 . 2]" 1
391 1 28 LEU MD1 1 31 ASN HD22 0.000 . 8.260 5.564 3.457 7.555 . 0 0 "[ . 1 . 2]" 1
392 1 28 LEU MD1 1 61 GLU HB2 0.000 . 6.630 3.873 2.423 6.667 0.037 20 0 "[ . 1 . 2]" 1
393 1 28 LEU MD1 1 61 GLU HB3 0.000 . 6.630 3.702 2.159 6.398 . 0 0 "[ . 1 . 2]" 1
394 1 28 LEU MD1 1 62 LYS H 0.000 . 6.530 5.085 3.857 6.544 0.014 1 0 "[ . 1 . 2]" 1
395 1 28 LEU MD2 1 31 ASN HD21 0.000 . 8.260 4.562 3.145 6.122 . 0 0 "[ . 1 . 2]" 1
396 1 28 LEU MD2 1 31 ASN HD22 0.000 . 8.260 5.550 3.770 7.213 . 0 0 "[ . 1 . 2]" 1
397 1 28 LEU MD2 1 61 GLU HB2 0.000 . 6.630 4.022 2.622 5.804 . 0 0 "[ . 1 . 2]" 1
398 1 28 LEU MD2 1 61 GLU HB3 0.000 . 6.630 3.554 2.325 4.722 . 0 0 "[ . 1 . 2]" 1
399 1 28 LEU MD2 1 62 LYS H 0.000 . 6.530 5.765 4.592 6.573 0.043 5 0 "[ . 1 . 2]" 1
400 1 28 LEU HG 1 29 GLY H 0.000 . 5.380 4.734 3.676 5.302 . 0 0 "[ . 1 . 2]" 1
401 1 28 LEU HG 1 62 LYS QE 0.000 . 6.380 5.159 3.034 6.413 0.033 10 0 "[ . 1 . 2]" 1
402 1 29 GLY H 1 30 PHE H 0.000 . 4.380 2.684 2.540 2.831 . 0 0 "[ . 1 . 2]" 1
403 1 29 GLY H 1 31 ASN H 0.000 . 5.160 4.046 3.866 4.343 . 0 0 "[ . 1 . 2]" 1
404 1 29 GLY QA 1 31 ASN H 0.000 . 5.480 3.986 3.806 4.239 . 0 0 "[ . 1 . 2]" 1
405 1 30 PHE H 1 30 PHE HB2 0.000 . 3.670 2.611 2.353 2.735 . 0 0 "[ . 1 . 2]" 1
406 1 30 PHE H 1 30 PHE QB 0.000 . 3.490 2.287 2.143 2.431 . 0 0 "[ . 1 . 2]" 1
407 1 30 PHE H 1 30 PHE HB3 0.000 . 3.670 2.608 2.267 3.655 . 0 0 "[ . 1 . 2]" 1
408 1 30 PHE H 1 31 ASN H 0.000 . 3.730 2.340 2.164 2.597 . 0 0 "[ . 1 . 2]" 1
409 1 30 PHE H 1 33 TYR QD 0.000 . 7.080 6.451 5.868 6.623 . 0 0 "[ . 1 . 2]" 1
410 1 30 PHE HA 1 33 TYR QD 0.000 . 5.840 4.029 3.586 4.207 . 0 0 "[ . 1 . 2]" 1
411 1 30 PHE HA 1 33 TYR QE 0.000 . 5.830 5.852 5.413 5.924 0.094 7 0 "[ . 1 . 2]" 1
412 1 30 PHE QD 1 31 ASN H 0.000 . 7.620 3.980 2.845 4.601 . 0 0 "[ . 1 . 2]" 1
413 1 30 PHE QD 1 33 TYR QD 0.000 . 8.680 4.073 2.713 5.111 . 0 0 "[ . 1 . 2]" 1
414 1 31 ASN HA 1 34 PHE QD 0.000 . 5.450 4.389 3.543 5.097 . 0 0 "[ . 1 . 2]" 1
415 1 31 ASN HA 1 34 PHE QE 0.000 . 5.730 4.148 2.745 5.446 . 0 0 "[ . 1 . 2]" 1
416 1 31 ASN QB 1 34 PHE QD 0.000 . 7.630 5.901 5.229 6.392 . 0 0 "[ . 1 . 2]" 1
417 1 31 ASN QB 1 63 VAL QG 0.000 . 8.960 2.239 1.886 2.642 . 0 0 "[ . 1 . 2]" 1
418 1 31 ASN QD 1 63 VAL QG 0.000 . 7.140 3.234 1.898 4.226 . 0 0 "[ . 1 . 2]" 1
419 1 31 ASN HD21 1 63 VAL MG1 0.000 . 9.060 5.501 3.141 7.265 . 0 0 "[ . 1 . 2]" 1
420 1 31 ASN HD21 1 63 VAL MG2 0.000 . 9.060 3.989 1.910 5.703 . 0 0 "[ . 1 . 2]" 1
421 1 31 ASN HD22 1 63 VAL MG1 0.000 . 9.060 5.106 2.218 7.041 . 0 0 "[ . 1 . 2]" 1
422 1 31 ASN HD22 1 63 VAL MG2 0.000 . 9.060 4.047 2.423 5.930 . 0 0 "[ . 1 . 2]" 1
423 1 33 TYR H 1 33 TYR HB2 0.000 . 3.670 2.602 2.409 2.783 . 0 0 "[ . 1 . 2]" 1
424 1 33 TYR H 1 33 TYR HB3 0.000 . 3.670 2.416 2.211 2.546 . 0 0 "[ . 1 . 2]" 1
425 1 33 TYR H 1 34 PHE H 0.000 . 3.390 2.536 2.336 2.669 . 0 0 "[ . 1 . 2]" 1
426 1 33 TYR HA 1 33 TYR QE 0.000 . 5.900 4.662 4.513 4.814 . 0 0 "[ . 1 . 2]" 1
427 1 33 TYR QD 1 34 PHE H 0.000 . 7.640 4.066 3.799 4.401 . 0 0 "[ . 1 . 2]" 1
428 1 33 TYR QD 1 90 ARG QD 0.000 . 8.520 6.417 4.485 8.118 . 0 0 "[ . 1 . 2]" 1
429 1 33 TYR QE 1 90 ARG QD 0.000 . 6.960 5.265 2.882 6.849 . 0 0 "[ . 1 . 2]" 1
430 1 34 PHE H 1 35 PRO QD 0.000 . 6.380 3.270 2.738 3.866 . 0 0 "[ . 1 . 2]" 1
431 1 34 PHE QB 1 35 PRO HD2 0.000 . 6.380 3.905 3.208 4.316 . 0 0 "[ . 1 . 2]" 1
432 1 34 PHE QB 1 35 PRO HD3 0.000 . 6.380 4.024 3.680 4.842 . 0 0 "[ . 1 . 2]" 1
433 1 34 PHE QB 1 56 MET ME 0.000 . 6.880 6.161 4.650 6.973 0.093 14 0 "[ . 1 . 2]" 1
434 1 34 PHE QD 1 35 PRO HD2 0.000 . 6.510 5.306 4.671 5.668 . 0 0 "[ . 1 . 2]" 1
435 1 34 PHE QD 1 35 PRO QD 0.000 . 6.390 4.637 4.320 4.784 . 0 0 "[ . 1 . 2]" 1
436 1 34 PHE QD 1 35 PRO HD3 0.000 . 6.510 5.149 4.910 5.473 . 0 0 "[ . 1 . 2]" 1
437 1 34 PHE QD 1 39 PRO QD 0.000 . 7.760 6.772 5.738 7.848 0.088 14 0 "[ . 1 . 2]" 1
438 1 34 PHE QD 1 56 MET ME 0.000 . 7.190 4.711 3.234 5.803 . 0 0 "[ . 1 . 2]" 1
439 1 34 PHE QD 1 63 VAL MG1 0.000 . 8.250 5.953 3.959 7.308 . 0 0 "[ . 1 . 2]" 1
440 1 34 PHE QD 1 63 VAL QG 0.000 . 7.670 4.945 3.384 5.921 . 0 0 "[ . 1 . 2]" 1
441 1 34 PHE QD 1 63 VAL MG2 0.000 . 8.250 5.341 3.675 6.518 . 0 0 "[ . 1 . 2]" 1
442 1 34 PHE QE 1 35 PRO QD 0.000 . 7.600 6.310 6.105 6.414 . 0 0 "[ . 1 . 2]" 1
443 1 34 PHE QE 1 56 MET ME 0.000 . 6.600 3.294 2.079 4.951 . 0 0 "[ . 1 . 2]" 1
444 1 34 PHE QE 1 63 VAL MG1 0.000 . 7.220 4.880 3.171 6.751 . 0 0 "[ . 1 . 2]" 1
445 1 34 PHE QE 1 63 VAL QG 0.000 . 6.600 4.135 2.789 5.722 . 0 0 "[ . 1 . 2]" 1
446 1 34 PHE QE 1 63 VAL MG2 0.000 . 7.220 4.521 3.069 6.181 . 0 0 "[ . 1 . 2]" 1
447 1 35 PRO HB2 1 36 ALA H 0.000 . 3.360 3.362 3.019 3.430 0.070 13 0 "[ . 1 . 2]" 1
448 1 35 PRO HB3 1 36 ALA H 0.000 . 3.360 3.435 3.372 3.481 0.121 8 0 "[ . 1 . 2]" 1
449 1 35 PRO QD 1 58 LYS QE 0.000 . 5.370 5.025 4.651 5.377 0.007 6 0 "[ . 1 . 2]" 1
450 1 35 PRO HD2 1 58 LYS HE2 0.000 . 6.820 6.230 5.422 6.977 0.157 8 0 "[ . 1 . 2]" 1
451 1 35 PRO HD2 1 58 LYS HE3 0.000 . 6.820 6.761 6.183 7.006 0.186 18 0 "[ . 1 . 2]" 1
452 1 35 PRO HD3 1 58 LYS HE2 0.000 . 6.820 6.110 5.438 6.917 0.097 17 0 "[ . 1 . 2]" 1
453 1 35 PRO HD3 1 58 LYS HE3 0.000 . 6.820 6.700 5.292 6.956 0.136 19 0 "[ . 1 . 2]" 1
454 1 35 PRO QG 1 58 LYS QE 0.000 . 7.250 4.668 3.380 5.884 . 0 0 "[ . 1 . 2]" 1
455 1 36 ALA H 1 37 PRO QD 0.000 . 6.380 4.288 4.054 4.347 . 0 0 "[ . 1 . 2]" 1
456 1 36 ALA MB 1 38 PHE H 0.000 . 6.030 5.247 5.095 5.466 . 0 0 "[ . 1 . 2]" 1
457 1 37 PRO QB 1 38 PHE H 0.000 . 3.530 3.126 2.793 3.285 . 0 0 "[ . 1 . 2]" 1
458 1 37 PRO HB2 1 38 PHE H 0.000 . 3.730 3.528 2.914 3.789 0.059 18 0 "[ . 1 . 2]" 1
459 1 37 PRO HB3 1 38 PHE H 0.000 . 3.730 3.558 3.283 3.775 0.045 14 0 "[ . 1 . 2]" 1
460 1 38 PHE H 1 38 PHE HB2 0.000 . 3.300 3.381 2.304 3.507 0.207 4 0 "[ . 1 . 2]" 1
461 1 38 PHE H 1 38 PHE HB3 0.000 . 3.300 2.657 2.389 3.449 0.149 11 0 "[ . 1 . 2]" 1
462 1 38 PHE QB 1 39 PRO QD 0.000 . 4.940 2.924 2.364 3.666 . 0 0 "[ . 1 . 2]" 1
463 1 38 PHE QB 1 58 LYS QB 0.000 . 7.250 2.637 1.876 4.090 . 0 0 "[ . 1 . 2]" 1
464 1 38 PHE HB2 1 39 PRO HD2 0.000 . 5.500 3.266 2.451 4.808 . 0 0 "[ . 1 . 2]" 1
465 1 38 PHE HB2 1 39 PRO HD3 0.000 . 5.500 4.068 3.441 4.787 . 0 0 "[ . 1 . 2]" 1
466 1 38 PHE HB3 1 39 PRO HD2 0.000 . 5.500 4.000 3.417 4.847 . 0 0 "[ . 1 . 2]" 1
467 1 38 PHE HB3 1 39 PRO HD3 0.000 . 5.500 4.395 4.125 4.776 . 0 0 "[ . 1 . 2]" 1
468 1 38 PHE QD 1 56 MET ME 0.000 . 6.880 6.595 5.694 6.990 0.110 2 0 "[ . 1 . 2]" 1
469 1 38 PHE QD 1 58 LYS QE 0.000 . 8.500 6.033 4.725 8.110 . 0 0 "[ . 1 . 2]" 1
470 1 38 PHE QD 1 58 LYS QG 0.000 . 7.350 4.511 2.669 6.385 . 0 0 "[ . 1 . 2]" 1
471 1 38 PHE QE 1 58 LYS H 0.000 . 7.620 5.549 2.892 7.661 0.041 2 0 "[ . 1 . 2]" 1
472 1 39 PRO HA 1 40 ILE H 0.000 . 2.900 2.265 2.161 2.399 . 0 0 "[ . 1 . 2]" 1
473 1 39 PRO QB 1 40 ILE H 0.000 . 3.790 2.887 2.687 3.231 . 0 0 "[ . 1 . 2]" 1
474 1 39 PRO QB 1 41 THR H 0.000 . 5.230 3.235 2.708 3.768 . 0 0 "[ . 1 . 2]" 1
475 1 39 PRO QB 1 42 VAL QG 0.000 . 7.000 2.781 2.278 4.466 . 0 0 "[ . 1 . 2]" 1
476 1 39 PRO QB 1 56 MET ME 0.000 . 5.390 4.559 2.834 5.179 . 0 0 "[ . 1 . 2]" 1
477 1 39 PRO HB2 1 40 ILE H 0.000 . 3.980 3.044 2.773 3.518 . 0 0 "[ . 1 . 2]" 1
478 1 39 PRO HB2 1 42 VAL MG1 0.000 . 8.750 4.112 2.397 5.518 . 0 0 "[ . 1 . 2]" 1
479 1 39 PRO HB2 1 42 VAL MG2 0.000 . 8.750 3.794 2.457 5.455 . 0 0 "[ . 1 . 2]" 1
480 1 39 PRO HB2 1 56 MET ME 0.000 . 5.780 5.099 3.026 5.844 0.064 20 0 "[ . 1 . 2]" 1
481 1 39 PRO HB3 1 40 ILE H 0.000 . 3.980 3.678 3.242 3.990 0.010 20 0 "[ . 1 . 2]" 1
482 1 39 PRO HB3 1 42 VAL MG1 0.000 . 8.750 4.814 2.910 6.323 . 0 0 "[ . 1 . 2]" 1
483 1 39 PRO HB3 1 42 VAL MG2 0.000 . 8.750 4.688 3.072 6.507 . 0 0 "[ . 1 . 2]" 1
484 1 39 PRO HB3 1 56 MET ME 0.000 . 5.780 5.169 3.417 5.809 0.029 5 0 "[ . 1 . 2]" 1
485 1 39 PRO QD 1 56 MET ME 0.000 . 4.920 3.266 2.796 4.024 . 0 0 "[ . 1 . 2]" 1
486 1 39 PRO HD2 1 56 MET ME 0.000 . 5.410 3.603 2.964 4.746 . 0 0 "[ . 1 . 2]" 1
487 1 39 PRO HD3 1 56 MET ME 0.000 . 5.410 3.796 3.162 4.362 . 0 0 "[ . 1 . 2]" 1
488 1 39 PRO QG 1 42 VAL QG 0.000 . 6.610 2.618 2.079 4.483 . 0 0 "[ . 1 . 2]" 1
489 1 39 PRO QG 1 56 MET ME 0.000 . 4.490 3.053 1.873 3.558 . 0 0 "[ . 1 . 2]" 1
490 1 39 PRO QG 1 57 LYS HA 0.000 . 5.390 4.572 3.298 5.489 0.099 20 0 "[ . 1 . 2]" 1
491 1 39 PRO HG2 1 42 VAL MG1 0.000 . 8.590 3.979 2.322 5.307 . 0 0 "[ . 1 . 2]" 1
492 1 39 PRO HG2 1 42 VAL MG2 0.000 . 8.590 3.577 2.127 5.818 . 0 0 "[ . 1 . 2]" 1
493 1 39 PRO HG2 1 56 MET ME 0.000 . 5.100 3.504 2.224 4.250 . 0 0 "[ . 1 . 2]" 1
494 1 39 PRO HG3 1 42 VAL MG1 0.000 . 8.590 4.262 2.362 5.931 . 0 0 "[ . 1 . 2]" 1
495 1 39 PRO HG3 1 42 VAL MG2 0.000 . 8.590 4.116 2.683 5.843 . 0 0 "[ . 1 . 2]" 1
496 1 39 PRO HG3 1 56 MET ME 0.000 . 5.100 3.483 2.016 4.307 . 0 0 "[ . 1 . 2]" 1
497 1 40 ILE H 1 40 ILE HB 0.000 . 3.170 2.530 2.465 2.586 . 0 0 "[ . 1 . 2]" 1
498 1 40 ILE H 1 40 ILE MD 0.000 . 5.230 3.170 2.123 3.594 . 0 0 "[ . 1 . 2]" 1
499 1 40 ILE H 1 40 ILE HG12 0.000 . 4.140 2.628 2.164 4.166 0.026 10 0 "[ . 1 . 2]" 1
500 1 40 ILE H 1 40 ILE HG13 0.000 . 4.140 3.798 3.655 4.082 . 0 0 "[ . 1 . 2]" 1
501 1 40 ILE H 1 40 ILE MG 0.000 . 4.610 3.797 3.764 3.833 . 0 0 "[ . 1 . 2]" 1
502 1 40 ILE H 1 41 THR H 0.000 . 3.730 2.446 2.044 2.827 . 0 0 "[ . 1 . 2]" 1
503 1 40 ILE HA 1 40 ILE MD 0.000 . 4.700 2.186 1.981 3.015 . 0 0 "[ . 1 . 2]" 1
504 1 40 ILE HA 1 40 ILE HG12 0.000 . 4.260 3.216 3.038 3.768 . 0 0 "[ . 1 . 2]" 1
505 1 40 ILE HA 1 40 ILE HG13 0.000 . 4.260 3.570 2.517 3.806 . 0 0 "[ . 1 . 2]" 1
506 1 40 ILE HA 1 41 THR H 0.000 . 3.610 3.544 3.480 3.599 . 0 0 "[ . 1 . 2]" 1
507 1 40 ILE HB 1 41 THR H 0.000 . 3.360 2.523 2.162 2.988 . 0 0 "[ . 1 . 2]" 1
508 1 40 ILE MD 1 41 THR H 0.000 . 6.190 4.504 3.811 4.693 . 0 0 "[ . 1 . 2]" 1
509 1 40 ILE MD 1 57 LYS HA 0.000 . 6.060 5.658 4.397 6.105 0.045 1 0 "[ . 1 . 2]" 1
510 1 40 ILE MD 1 57 LYS QG 0.000 . 5.420 5.025 3.732 5.561 0.141 16 0 "[ . 1 . 2]" 1
511 1 40 ILE HG12 1 41 THR H 0.000 . 5.470 4.320 3.915 5.278 . 0 0 "[ . 1 . 2]" 1
512 1 40 ILE HG13 1 41 THR H 0.000 . 5.470 4.872 4.566 5.230 . 0 0 "[ . 1 . 2]" 1
513 1 40 ILE MG 1 41 THR H 0.000 . 5.040 3.349 3.056 3.732 . 0 0 "[ . 1 . 2]" 1
514 1 41 THR H 1 42 VAL H 0.000 . 4.570 4.356 4.255 4.415 . 0 0 "[ . 1 . 2]" 1
515 1 41 THR HA 1 42 VAL H 0.000 . 3.360 2.252 2.171 2.416 . 0 0 "[ . 1 . 2]" 1
516 1 41 THR HA 1 56 MET H 0.000 . 3.610 3.181 2.522 3.656 0.046 15 0 "[ . 1 . 2]" 1
517 1 41 THR HB 1 42 VAL H 0.000 . 3.420 2.891 2.502 3.579 0.159 13 0 "[ . 1 . 2]" 1
518 1 41 THR MG 1 42 VAL H 0.000 . 5.440 3.171 1.942 3.691 . 0 0 "[ . 1 . 2]" 1
519 1 41 THR MG 1 55 ARG HA 0.000 . 4.330 3.083 2.338 3.814 . 0 0 "[ . 1 . 2]" 1
520 1 41 THR MG 1 55 ARG QD 0.000 . 7.400 4.025 3.028 4.642 . 0 0 "[ . 1 . 2]" 1
521 1 41 THR MG 1 55 ARG QG 0.000 . 5.240 2.848 1.928 4.356 . 0 0 "[ . 1 . 2]" 1
522 1 41 THR MG 1 56 MET H 0.000 . 5.940 4.550 4.017 5.111 . 0 0 "[ . 1 . 2]" 1
523 1 42 VAL H 1 43 ASP H 0.000 . 4.380 4.341 4.242 4.398 0.018 13 0 "[ . 1 . 2]" 1
524 1 42 VAL H 1 53 THR MG 0.000 . 5.380 3.413 2.948 3.897 . 0 0 "[ . 1 . 2]" 1
525 1 42 VAL H 1 54 VAL H 0.000 . 4.420 3.043 2.757 3.344 . 0 0 "[ . 1 . 2]" 1
526 1 42 VAL H 1 54 VAL HB 0.000 . 5.500 5.068 3.730 5.557 0.057 12 0 "[ . 1 . 2]" 1
527 1 42 VAL H 1 54 VAL QG 0.000 . 7.590 3.344 2.936 4.220 . 0 0 "[ . 1 . 2]" 1
528 1 42 VAL H 1 56 MET H 0.000 . 4.720 4.063 3.565 4.613 . 0 0 "[ . 1 . 2]" 1
529 1 42 VAL QG 1 43 ASP H 0.000 . 5.120 2.595 2.088 3.187 . 0 0 "[ . 1 . 2]" 1
530 1 42 VAL QG 1 44 LEU H 0.000 . 8.090 4.382 3.997 4.711 . 0 0 "[ . 1 . 2]" 1
531 1 42 VAL QG 1 54 VAL H 0.000 . 7.130 3.635 2.829 4.293 . 0 0 "[ . 1 . 2]" 1
532 1 42 VAL QG 1 54 VAL HB 0.000 . 6.070 4.222 2.001 5.058 . 0 0 "[ . 1 . 2]" 1
533 1 42 VAL QG 1 56 MET H 0.000 . 8.090 3.077 2.458 3.658 . 0 0 "[ . 1 . 2]" 1
534 1 42 VAL QG 1 56 MET QB 0.000 . 7.260 1.976 1.809 2.262 . 0 0 "[ . 1 . 2]" 1
535 1 42 VAL QG 1 92 ARG HA 0.000 . 6.540 3.050 2.332 3.887 . 0 0 "[ . 1 . 2]" 1
536 1 42 VAL QG 1 92 ARG QB 0.000 . 6.720 2.466 1.797 3.665 . 0 0 "[ . 1 . 2]" 1
537 1 42 VAL QG 1 92 ARG HE 0.000 . 6.380 4.704 2.767 5.766 . 0 0 "[ . 1 . 2]" 1
538 1 42 VAL QG 1 94 PHE QD 0.000 . 6.660 2.588 1.917 3.304 . 0 0 "[ . 1 . 2]" 1
539 1 42 VAL MG1 1 43 ASP H 0.000 . 5.410 2.996 2.096 3.928 . 0 0 "[ . 1 . 2]" 1
540 1 42 VAL MG1 1 92 ARG HB2 0.000 . 8.840 3.967 1.829 6.577 . 0 0 "[ . 1 . 2]" 1
541 1 42 VAL MG1 1 92 ARG HB3 0.000 . 8.840 3.289 2.039 6.204 . 0 0 "[ . 1 . 2]" 1
542 1 42 VAL MG1 1 94 PHE QD 0.000 . 7.040 3.123 1.921 4.422 . 0 0 "[ . 1 . 2]" 1
543 1 42 VAL MG2 1 43 ASP H 0.000 . 5.410 3.531 2.309 4.011 . 0 0 "[ . 1 . 2]" 1
544 1 42 VAL MG2 1 92 ARG HB2 0.000 . 8.840 4.539 1.969 6.502 . 0 0 "[ . 1 . 2]" 1
545 1 42 VAL MG2 1 92 ARG HB3 0.000 . 8.840 3.830 2.231 6.195 . 0 0 "[ . 1 . 2]" 1
546 1 42 VAL MG2 1 94 PHE QD 0.000 . 7.040 3.643 2.001 4.651 . 0 0 "[ . 1 . 2]" 1
547 1 43 ASP H 1 43 ASP HB2 0.000 . 3.830 2.745 2.477 3.130 . 0 0 "[ . 1 . 2]" 1
548 1 43 ASP H 1 43 ASP HB3 0.000 . 3.830 3.393 2.621 3.825 . 0 0 "[ . 1 . 2]" 1
549 1 43 ASP H 1 44 LEU H 0.000 . 4.510 4.371 4.265 4.457 . 0 0 "[ . 1 . 2]" 1
550 1 43 ASP H 1 93 THR HA 0.000 . 3.760 3.108 2.517 3.835 0.075 16 0 "[ . 1 . 2]" 1
551 1 43 ASP H 1 93 THR MG 0.000 . 6.220 4.409 3.079 5.371 . 0 0 "[ . 1 . 2]" 1
552 1 43 ASP HA 1 44 LEU H 0.000 . 3.110 2.115 2.030 2.188 . 0 0 "[ . 1 . 2]" 1
553 1 43 ASP HA 1 53 THR HA 0.000 . 3.610 2.331 2.075 3.264 . 0 0 "[ . 1 . 2]" 1
554 1 43 ASP HA 1 53 THR MG 0.000 . 5.630 3.616 3.113 4.690 . 0 0 "[ . 1 . 2]" 1
555 1 43 ASP HA 1 54 VAL H 0.000 . 4.170 2.986 2.697 3.729 . 0 0 "[ . 1 . 2]" 1
556 1 43 ASP QB 1 44 LEU H 0.000 . 4.100 3.165 2.671 3.688 . 0 0 "[ . 1 . 2]" 1
557 1 43 ASP QB 1 93 THR HA 0.000 . 5.300 3.447 2.526 4.294 . 0 0 "[ . 1 . 2]" 1
558 1 43 ASP QB 1 93 THR MG 0.000 . 5.810 3.338 1.969 4.681 . 0 0 "[ . 1 . 2]" 1
559 1 43 ASP HB2 1 44 LEU H 0.000 . 4.290 4.098 3.851 4.251 . 0 0 "[ . 1 . 2]" 1
560 1 43 ASP HB2 1 93 THR HA 0.000 . 5.440 4.006 2.553 5.493 0.053 13 0 "[ . 1 . 2]" 1
561 1 43 ASP HB2 1 93 THR MG 0.000 . 6.030 3.972 2.284 6.051 0.021 7 0 "[ . 1 . 2]" 1
562 1 43 ASP HB3 1 44 LEU H 0.000 . 4.290 3.340 2.724 4.077 . 0 0 "[ . 1 . 2]" 1
563 1 43 ASP HB3 1 93 THR HA 0.000 . 5.440 4.388 3.156 5.533 0.093 15 0 "[ . 1 . 2]" 1
564 1 43 ASP HB3 1 93 THR MG 0.000 . 6.030 4.091 1.980 6.012 . 0 0 "[ . 1 . 2]" 1
565 1 44 LEU H 1 44 LEU HG 0.000 . 4.940 2.830 2.596 4.244 . 0 0 "[ . 1 . 2]" 1
566 1 44 LEU H 1 52 TRP HB2 0.000 . 5.500 3.670 3.345 4.002 . 0 0 "[ . 1 . 2]" 1
567 1 44 LEU H 1 52 TRP HB3 0.000 . 5.500 4.712 4.492 4.938 . 0 0 "[ . 1 . 2]" 1
568 1 44 LEU H 1 53 THR HA 0.000 . 4.100 3.388 3.034 3.992 . 0 0 "[ . 1 . 2]" 1
569 1 44 LEU H 1 94 PHE QD 0.000 . 7.620 5.829 4.981 6.467 . 0 0 "[ . 1 . 2]" 1
570 1 44 LEU HA 1 45 LEU H 0.000 . 3.270 2.134 2.069 2.242 . 0 0 "[ . 1 . 2]" 1
571 1 44 LEU HA 1 94 PHE H 0.000 . 3.890 3.023 2.628 3.394 . 0 0 "[ . 1 . 2]" 1
572 1 44 LEU HA 1 94 PHE HB2 0.000 . 5.500 2.894 2.136 3.536 . 0 0 "[ . 1 . 2]" 1
573 1 44 LEU HA 1 94 PHE HB3 0.000 . 5.500 4.234 3.530 4.908 . 0 0 "[ . 1 . 2]" 1
574 1 44 LEU HA 1 94 PHE QD 0.000 . 6.350 4.342 3.702 4.972 . 0 0 "[ . 1 . 2]" 1
575 1 44 LEU QB 1 45 LEU H 0.000 . 4.150 3.184 2.990 3.339 . 0 0 "[ . 1 . 2]" 1
576 1 44 LEU QB 1 51 SER HA 0.000 . 6.380 4.287 4.033 4.594 . 0 0 "[ . 1 . 2]" 1
577 1 44 LEU QB 1 52 TRP H 0.000 . 6.380 2.896 2.586 3.205 . 0 0 "[ . 1 . 2]" 1
578 1 44 LEU QB 1 52 TRP HE3 0.000 . 3.850 2.650 2.005 3.380 . 0 0 "[ . 1 . 2]" 1
579 1 44 LEU QB 1 94 PHE QD 0.000 . 6.310 5.285 5.031 5.625 . 0 0 "[ . 1 . 2]" 1
580 1 44 LEU QB 1 96 VAL QG 0.000 . 6.440 2.441 2.054 3.251 . 0 0 "[ . 1 . 2]" 1
581 1 44 LEU HB2 1 45 LEU H 0.000 . 4.510 4.125 3.931 4.301 . 0 0 "[ . 1 . 2]" 1
582 1 44 LEU HB2 1 52 TRP HE3 0.000 . 4.010 2.766 2.062 3.613 . 0 0 "[ . 1 . 2]" 1
583 1 44 LEU HB2 1 94 PHE QD 0.000 . 7.000 6.318 5.921 6.601 . 0 0 "[ . 1 . 2]" 1
584 1 44 LEU HB2 1 96 VAL MG1 0.000 . 8.380 5.015 3.270 5.884 . 0 0 "[ . 1 . 2]" 1
585 1 44 LEU HB2 1 96 VAL MG2 0.000 . 8.380 4.385 3.423 6.216 . 0 0 "[ . 1 . 2]" 1
586 1 44 LEU HB3 1 45 LEU H 0.000 . 4.510 3.313 3.099 3.501 . 0 0 "[ . 1 . 2]" 1
587 1 44 LEU HB3 1 52 TRP HE3 0.000 . 4.010 3.449 2.568 4.064 0.054 11 0 "[ . 1 . 2]" 1
588 1 44 LEU HB3 1 94 PHE QD 0.000 . 7.000 5.671 5.401 6.116 . 0 0 "[ . 1 . 2]" 1
589 1 44 LEU HB3 1 96 VAL MG1 0.000 . 8.380 3.830 2.096 4.726 . 0 0 "[ . 1 . 2]" 1
590 1 44 LEU HB3 1 96 VAL MG2 0.000 . 8.380 3.071 2.096 4.878 . 0 0 "[ . 1 . 2]" 1
591 1 44 LEU QD 1 45 LEU H 0.000 . 7.140 3.681 3.460 3.856 . 0 0 "[ . 1 . 2]" 1
592 1 44 LEU QD 1 54 VAL HB 0.000 . 7.260 3.333 1.988 3.869 . 0 0 "[ . 1 . 2]" 1
593 1 44 LEU QD 1 54 VAL QG 0.000 . 6.870 1.954 1.807 2.178 . 0 0 "[ . 1 . 2]" 1
594 1 44 LEU QD 1 69 TRP HE3 0.000 . 4.290 2.295 1.978 3.204 . 0 0 "[ . 1 . 2]" 1
595 1 44 LEU QD 1 69 TRP HH2 0.000 . 6.240 4.197 3.575 4.667 . 0 0 "[ . 1 . 2]" 1
596 1 44 LEU QD 1 69 TRP HZ3 0.000 . 4.500 2.362 1.905 2.868 . 0 0 "[ . 1 . 2]" 1
597 1 44 LEU QD 1 86 PHE QE 0.000 . 7.050 2.688 1.893 3.686 . 0 0 "[ . 1 . 2]" 1
598 1 44 LEU QD 1 94 PHE H 0.000 . 6.610 3.186 2.677 3.789 . 0 0 "[ . 1 . 2]" 1
599 1 44 LEU QD 1 94 PHE QB 0.000 . 5.870 1.888 1.777 2.010 . 0 0 "[ . 1 . 2]" 1
600 1 44 LEU QD 1 94 PHE QD 0.000 . 6.980 2.687 2.206 3.215 . 0 0 "[ . 1 . 2]" 1
601 1 44 LEU QD 1 95 TYR H 0.000 . 6.580 4.895 4.411 5.426 . 0 0 "[ . 1 . 2]" 1
602 1 44 LEU QD 1 95 TYR QD 0.000 . 10.240 6.054 5.627 6.567 . 0 0 "[ . 1 . 2]" 1
603 1 44 LEU QD 1 96 VAL H 0.000 . 8.100 4.621 4.090 5.063 . 0 0 "[ . 1 . 2]" 1
604 1 44 LEU QD 1 96 VAL QG 0.000 . 7.280 2.423 1.911 3.420 . 0 0 "[ . 1 . 2]" 1
605 1 44 LEU MD1 1 54 VAL MG1 0.000 . 9.500 2.419 1.966 4.423 . 0 0 "[ . 1 . 2]" 1
606 1 44 LEU MD1 1 54 VAL MG2 0.000 . 9.500 2.638 1.922 3.903 . 0 0 "[ . 1 . 2]" 1
607 1 44 LEU MD1 1 69 TRP HE3 0.000 . 5.040 2.345 1.984 4.003 . 0 0 "[ . 1 . 2]" 1
608 1 44 LEU MD1 1 69 TRP HZ3 0.000 . 5.040 2.392 1.911 3.036 . 0 0 "[ . 1 . 2]" 1
609 1 44 LEU MD1 1 86 PHE QE 0.000 . 7.690 3.036 2.073 4.085 . 0 0 "[ . 1 . 2]" 1
610 1 44 LEU MD1 1 94 PHE HB2 0.000 . 8.020 4.251 1.841 4.698 . 0 0 "[ . 1 . 2]" 1
611 1 44 LEU MD1 1 94 PHE HB3 0.000 . 8.020 4.987 2.415 5.591 . 0 0 "[ . 1 . 2]" 1
612 1 44 LEU MD1 1 94 PHE QD 0.000 . 7.600 4.849 3.310 5.346 . 0 0 "[ . 1 . 2]" 1
613 1 44 LEU MD1 1 96 VAL MG1 0.000 . 9.130 3.645 2.455 4.198 . 0 0 "[ . 1 . 2]" 1
614 1 44 LEU MD1 1 96 VAL MG2 0.000 . 9.130 3.025 1.993 4.675 . 0 0 "[ . 1 . 2]" 1
615 1 44 LEU MD2 1 54 VAL MG1 0.000 . 9.500 3.300 2.318 4.738 . 0 0 "[ . 1 . 2]" 1
616 1 44 LEU MD2 1 54 VAL MG2 0.000 . 9.500 3.070 1.990 4.394 . 0 0 "[ . 1 . 2]" 1
617 1 44 LEU MD2 1 69 TRP HE3 0.000 . 5.040 4.114 3.142 4.734 . 0 0 "[ . 1 . 2]" 1
618 1 44 LEU MD2 1 69 TRP HZ3 0.000 . 5.040 3.893 3.449 4.558 . 0 0 "[ . 1 . 2]" 1
619 1 44 LEU MD2 1 86 PHE QE 0.000 . 7.690 3.180 2.187 4.465 . 0 0 "[ . 1 . 2]" 1
620 1 44 LEU MD2 1 94 PHE HB2 0.000 . 8.020 1.985 1.829 3.209 . 0 0 "[ . 1 . 2]" 1
621 1 44 LEU MD2 1 94 PHE HB3 0.000 . 8.020 3.042 2.670 4.354 . 0 0 "[ . 1 . 2]" 1
622 1 44 LEU MD2 1 94 PHE QD 0.000 . 7.600 2.726 2.212 3.604 . 0 0 "[ . 1 . 2]" 1
623 1 44 LEU MD2 1 96 VAL MG1 0.000 . 9.130 4.127 2.483 5.846 . 0 0 "[ . 1 . 2]" 1
624 1 44 LEU MD2 1 96 VAL MG2 0.000 . 9.130 3.283 2.192 4.647 . 0 0 "[ . 1 . 2]" 1
625 1 44 LEU HG 1 54 VAL MG1 0.000 . 5.320 2.697 1.968 4.332 . 0 0 "[ . 1 . 2]" 1
626 1 44 LEU HG 1 54 VAL QG 0.000 . 4.730 2.157 1.961 2.676 . 0 0 "[ . 1 . 2]" 1
627 1 44 LEU HG 1 54 VAL MG2 0.000 . 5.320 2.837 2.008 4.420 . 0 0 "[ . 1 . 2]" 1
628 1 44 LEU HG 1 96 VAL QG 0.000 . 7.590 4.496 3.296 5.601 . 0 0 "[ . 1 . 2]" 1
629 1 45 LEU H 1 45 LEU HB2 0.000 . 3.760 2.518 2.462 2.587 . 0 0 "[ . 1 . 2]" 1
630 1 45 LEU H 1 45 LEU QB 0.000 . 3.560 2.478 2.426 2.542 . 0 0 "[ . 1 . 2]" 1
631 1 45 LEU H 1 45 LEU HB3 0.000 . 3.760 3.686 3.650 3.725 . 0 0 "[ . 1 . 2]" 1
632 1 45 LEU H 1 45 LEU MD1 0.000 . 5.690 3.674 2.451 3.907 . 0 0 "[ . 1 . 2]" 1
633 1 45 LEU H 1 45 LEU QD 0.000 . 5.180 2.380 2.137 3.292 . 0 0 "[ . 1 . 2]" 1
634 1 45 LEU H 1 45 LEU MD2 0.000 . 5.690 2.506 2.156 4.279 . 0 0 "[ . 1 . 2]" 1
635 1 45 LEU H 1 45 LEU HG 0.000 . 4.630 4.177 2.738 4.343 . 0 0 "[ . 1 . 2]" 1
636 1 45 LEU H 1 46 ASP H 0.000 . 4.630 4.441 4.386 4.509 . 0 0 "[ . 1 . 2]" 1
637 1 45 LEU H 1 94 PHE H 0.000 . 4.320 3.830 3.555 4.327 0.007 12 0 "[ . 1 . 2]" 1
638 1 45 LEU H 1 94 PHE QB 0.000 . 6.380 3.928 3.321 4.496 . 0 0 "[ . 1 . 2]" 1
639 1 45 LEU H 1 95 TYR HA 0.000 . 3.890 2.740 2.497 3.042 . 0 0 "[ . 1 . 2]" 1
640 1 45 LEU H 1 95 TYR QD 0.000 . 7.640 4.446 4.111 4.874 . 0 0 "[ . 1 . 2]" 1
641 1 45 LEU H 1 96 VAL H 0.000 . 4.510 3.528 3.135 3.847 . 0 0 "[ . 1 . 2]" 1
642 1 45 LEU H 1 96 VAL QG 0.000 . 6.940 3.370 2.844 3.782 . 0 0 "[ . 1 . 2]" 1
643 1 45 LEU HA 1 45 LEU QD 0.000 . 4.170 2.103 1.991 2.878 . 0 0 "[ . 1 . 2]" 1
644 1 45 LEU HA 1 46 ASP H 0.000 . 3.480 2.144 2.070 2.236 . 0 0 "[ . 1 . 2]" 1
645 1 45 LEU QB 1 46 ASP H 0.000 . 3.830 2.758 2.486 2.953 . 0 0 "[ . 1 . 2]" 1
646 1 45 LEU QB 1 95 TYR HA 0.000 . 4.960 2.634 2.201 3.210 . 0 0 "[ . 1 . 2]" 1
647 1 45 LEU QB 1 95 TYR QD 0.000 . 7.340 2.396 2.035 2.820 . 0 0 "[ . 1 . 2]" 1
648 1 45 LEU QB 1 96 VAL H 0.000 . 6.380 3.879 3.255 4.403 . 0 0 "[ . 1 . 2]" 1
649 1 45 LEU HB2 1 46 ASP H 0.000 . 4.070 3.929 3.620 4.077 0.007 14 0 "[ . 1 . 2]" 1
650 1 45 LEU HB2 1 95 TYR HA 0.000 . 5.160 2.666 2.215 3.262 . 0 0 "[ . 1 . 2]" 1
651 1 45 LEU HB3 1 46 ASP H 0.000 . 4.070 2.818 2.532 3.033 . 0 0 "[ . 1 . 2]" 1
652 1 45 LEU HB3 1 95 TYR HA 0.000 . 5.160 4.135 3.771 4.770 . 0 0 "[ . 1 . 2]" 1
653 1 45 LEU QD 1 46 ASP H 0.000 . 4.970 3.342 3.043 4.001 . 0 0 "[ . 1 . 2]" 1
654 1 45 LEU QD 1 51 SER HA 0.000 . 7.600 3.033 2.472 3.438 . 0 0 "[ . 1 . 2]" 1
655 1 45 LEU QD 1 51 SER QB 0.000 . 5.350 2.168 1.862 2.881 . 0 0 "[ . 1 . 2]" 1
656 1 45 LEU QD 1 52 TRP H 0.000 . 5.320 3.759 3.320 4.013 . 0 0 "[ . 1 . 2]" 1
657 1 45 LEU QD 1 93 THR MG 0.000 . 7.170 2.220 1.812 2.944 . 0 0 "[ . 1 . 2]" 1
658 1 45 LEU QD 1 94 PHE H 0.000 . 6.890 3.175 2.603 4.462 . 0 0 "[ . 1 . 2]" 1
659 1 45 LEU QD 1 95 TYR QD 0.000 . 8.400 3.511 2.992 3.815 . 0 0 "[ . 1 . 2]" 1
660 1 45 LEU QD 1 95 TYR QE 0.000 . 7.890 3.391 2.542 5.176 . 0 0 "[ . 1 . 2]" 1
661 1 45 LEU MD1 1 46 ASP H 0.000 . 5.290 3.494 3.093 4.630 . 0 0 "[ . 1 . 2]" 1
662 1 45 LEU MD1 1 51 SER QB 0.000 . 6.010 2.292 1.873 4.296 . 0 0 "[ . 1 . 2]" 1
663 1 45 LEU MD1 1 52 TRP H 0.000 . 5.910 4.099 3.536 5.954 0.044 3 0 "[ . 1 . 2]" 1
664 1 45 LEU MD1 1 95 TYR QD 0.000 . 8.670 4.587 3.018 4.993 . 0 0 "[ . 1 . 2]" 1
665 1 45 LEU MD1 1 95 TYR QE 0.000 . 8.130 4.359 2.549 5.921 . 0 0 "[ . 1 . 2]" 1
666 1 45 LEU MD2 1 46 ASP H 0.000 . 5.290 4.622 3.466 4.882 . 0 0 "[ . 1 . 2]" 1
667 1 45 LEU MD2 1 51 SER QB 0.000 . 6.010 3.740 2.213 4.357 . 0 0 "[ . 1 . 2]" 1
668 1 45 LEU MD2 1 52 TRP H 0.000 . 5.910 4.646 3.337 5.886 . 0 0 "[ . 1 . 2]" 1
669 1 45 LEU MD2 1 95 TYR QD 0.000 . 8.670 3.737 3.124 4.940 . 0 0 "[ . 1 . 2]" 1
670 1 45 LEU MD2 1 95 TYR QE 0.000 . 8.130 3.665 2.737 5.711 . 0 0 "[ . 1 . 2]" 1
671 1 45 LEU HG 1 46 ASP H 0.000 . 5.500 4.888 4.000 5.130 . 0 0 "[ . 1 . 2]" 1
672 1 45 LEU HG 1 51 SER QB 0.000 . 6.100 4.592 1.969 5.830 . 0 0 "[ . 1 . 2]" 1
673 1 45 LEU HG 1 93 THR MG 0.000 . 4.700 3.937 3.011 4.724 0.024 12 0 "[ . 1 . 2]" 1
674 1 45 LEU HG 1 95 TYR QD 0.000 . 6.650 3.836 2.855 5.535 . 0 0 "[ . 1 . 2]" 1
675 1 45 LEU HG 1 95 TYR QE 0.000 . 6.490 3.333 2.566 5.685 . 0 0 "[ . 1 . 2]" 1
676 1 46 ASP H 1 47 TYR H 0.000 . 4.350 4.394 4.344 4.445 0.095 15 0 "[ . 1 . 2]" 1
677 1 46 ASP H 1 51 SER QB 0.000 . 6.380 3.970 3.411 4.902 . 0 0 "[ . 1 . 2]" 1
678 1 46 ASP H 1 52 TRP H 0.000 . 4.910 4.982 4.918 5.110 0.200 15 0 "[ . 1 . 2]" 1
679 1 46 ASP H 1 95 TYR QD 0.000 . 7.170 5.377 4.642 6.218 . 0 0 "[ . 1 . 2]" 1
680 1 46 ASP H 1 95 TYR QE 0.000 . 7.630 6.486 5.268 7.637 0.007 14 0 "[ . 1 . 2]" 1
681 1 46 ASP HA 1 47 TYR H 0.000 . 3.360 2.223 2.078 2.394 . 0 0 "[ . 1 . 2]" 1
682 1 46 ASP HA 1 96 VAL HB 0.000 . 5.310 4.466 2.956 5.329 0.019 18 0 "[ . 1 . 2]" 1
683 1 46 ASP QB 1 47 TYR H 0.000 . 3.930 3.374 3.206 3.532 . 0 0 "[ . 1 . 2]" 1
684 1 46 ASP HB2 1 47 TYR H 0.000 . 4.100 3.748 3.542 4.050 . 0 0 "[ . 1 . 2]" 1
685 1 46 ASP HB2 1 50 ARG H 0.000 . 4.420 4.144 3.454 4.507 0.087 14 0 "[ . 1 . 2]" 1
686 1 46 ASP HB3 1 47 TYR H 0.000 . 4.100 3.861 3.538 4.128 0.028 17 0 "[ . 1 . 2]" 1
687 1 46 ASP HB3 1 50 ARG H 0.000 . 4.420 2.591 2.155 2.981 . 0 0 "[ . 1 . 2]" 1
688 1 47 TYR QD 1 97 ILE MD 0.000 . 8.670 4.041 2.525 6.064 . 0 0 "[ . 1 . 2]" 1
689 1 47 TYR QD 1 97 ILE QG 0.000 . 7.530 3.817 2.308 6.135 . 0 0 "[ . 1 . 2]" 1
690 1 47 TYR QD 1 97 ILE MG 0.000 . 7.520 4.655 3.539 6.029 . 0 0 "[ . 1 . 2]" 1
691 1 47 TYR QE 1 97 ILE MD 0.000 . 6.950 4.035 2.048 6.603 . 0 0 "[ . 1 . 2]" 1
692 1 47 TYR QE 1 97 ILE HG12 0.000 . 7.630 4.576 2.336 7.355 . 0 0 "[ . 1 . 2]" 1
693 1 47 TYR QE 1 97 ILE QG 0.000 . 6.980 4.078 2.083 6.430 . 0 0 "[ . 1 . 2]" 1
694 1 47 TYR QE 1 97 ILE HG13 0.000 . 7.630 4.974 2.097 7.097 . 0 0 "[ . 1 . 2]" 1
695 1 48 SER H 1 48 SER HB2 0.000 . 3.980 2.615 2.419 2.795 . 0 0 "[ . 1 . 2]" 1
696 1 48 SER H 1 48 SER HB3 0.000 . 3.980 2.929 2.429 3.670 . 0 0 "[ . 1 . 2]" 1
697 1 48 SER H 1 50 ARG H 0.000 . 3.890 3.624 3.157 3.934 0.044 2 0 "[ . 1 . 2]" 1
698 1 48 SER QB 1 50 ARG H 0.000 . 4.890 3.241 2.747 3.681 . 0 0 "[ . 1 . 2]" 1
699 1 50 ARG H 1 50 ARG HB2 0.000 . 4.200 2.514 2.309 2.814 . 0 0 "[ . 1 . 2]" 1
700 1 50 ARG H 1 50 ARG QB 0.000 . 3.790 2.419 2.281 2.608 . 0 0 "[ . 1 . 2]" 1
701 1 50 ARG H 1 50 ARG HB3 0.000 . 4.200 3.463 2.500 3.728 . 0 0 "[ . 1 . 2]" 1
702 1 50 ARG H 1 50 ARG HG2 0.000 . 5.310 3.277 2.404 4.663 . 0 0 "[ . 1 . 2]" 1
703 1 50 ARG H 1 50 ARG QG 0.000 . 4.950 2.768 2.214 4.064 . 0 0 "[ . 1 . 2]" 1
704 1 50 ARG H 1 50 ARG HG3 0.000 . 5.310 3.465 2.245 4.599 . 0 0 "[ . 1 . 2]" 1
705 1 50 ARG H 1 51 SER H 0.000 . 4.910 4.590 4.493 4.658 . 0 0 "[ . 1 . 2]" 1
706 1 50 ARG HA 1 50 ARG HD2 0.000 . 5.500 3.680 2.095 4.697 . 0 0 "[ . 1 . 2]" 1
707 1 50 ARG HA 1 50 ARG HD3 0.000 . 5.500 3.398 1.949 4.919 . 0 0 "[ . 1 . 2]" 1
708 1 50 ARG HA 1 51 SER H 0.000 . 2.930 2.309 2.146 2.396 . 0 0 "[ . 1 . 2]" 1
709 1 50 ARG HB2 1 51 SER H 0.000 . 4.010 3.805 3.539 4.042 0.032 4 0 "[ . 1 . 2]" 1
710 1 50 ARG HB3 1 51 SER H 0.000 . 4.010 2.782 2.291 3.926 . 0 0 "[ . 1 . 2]" 1
711 1 50 ARG HD2 1 51 SER H 0.000 . 5.500 4.448 2.724 5.546 0.046 15 0 "[ . 1 . 2]" 1
712 1 50 ARG HD3 1 51 SER H 0.000 . 5.500 4.371 2.403 5.624 0.124 2 0 "[ . 1 . 2]" 1
713 1 50 ARG QG 1 51 SER H 0.000 . 5.330 3.818 2.083 4.506 . 0 0 "[ . 1 . 2]" 1
714 1 50 ARG HG2 1 51 SER H 0.000 . 5.500 4.273 2.241 5.020 . 0 0 "[ . 1 . 2]" 1
715 1 50 ARG HG3 1 51 SER H 0.000 . 5.500 4.459 2.263 5.157 . 0 0 "[ . 1 . 2]" 1
716 1 51 SER HA 1 52 TRP H 0.000 . 3.550 2.169 2.050 2.321 . 0 0 "[ . 1 . 2]" 1
717 1 51 SER HA 1 52 TRP HE3 0.000 . 4.940 3.178 2.742 3.763 . 0 0 "[ . 1 . 2]" 1
718 1 52 TRP H 1 52 TRP HE3 0.000 . 3.330 2.591 2.239 2.962 . 0 0 "[ . 1 . 2]" 1
719 1 52 TRP H 1 53 THR H 0.000 . 4.380 4.302 4.063 4.418 0.038 19 0 "[ . 1 . 2]" 1
720 1 52 TRP HA 1 52 TRP HD1 0.000 . 4.010 3.326 3.012 3.597 . 0 0 "[ . 1 . 2]" 1
721 1 52 TRP HA 1 53 THR H 0.000 . 3.610 2.145 2.022 2.207 . 0 0 "[ . 1 . 2]" 1
722 1 52 TRP HA 1 71 ASN QD 0.000 . 6.370 4.884 3.939 6.374 0.004 8 0 "[ . 1 . 2]" 1
723 1 52 TRP QB 1 53 THR H 0.000 . 4.340 3.121 2.855 3.396 . 0 0 "[ . 1 . 2]" 1
724 1 52 TRP HB2 1 53 THR H 0.000 . 4.570 4.161 3.914 4.282 . 0 0 "[ . 1 . 2]" 1
725 1 52 TRP HB3 1 53 THR H 0.000 . 4.570 3.227 2.927 3.570 . 0 0 "[ . 1 . 2]" 1
726 1 52 TRP HD1 1 71 ASN HA 0.000 . 4.230 4.284 4.246 4.318 0.088 14 0 "[ . 1 . 2]" 1
727 1 52 TRP HD1 1 71 ASN HB2 0.000 . 3.140 2.501 2.017 3.167 0.027 12 0 "[ . 1 . 2]" 1
728 1 52 TRP HD1 1 71 ASN QB 0.000 . 2.910 2.093 1.865 2.515 . 0 0 "[ . 1 . 2]" 1
729 1 52 TRP HD1 1 71 ASN HB3 0.000 . 3.140 2.288 2.129 2.639 . 0 0 "[ . 1 . 2]" 1
730 1 52 TRP HD1 1 71 ASN QD 0.000 . 4.970 3.807 3.135 4.784 . 0 0 "[ . 1 . 2]" 1
731 1 52 TRP HD1 1 72 PHE H 0.000 . 5.500 3.806 3.525 4.077 . 0 0 "[ . 1 . 2]" 1
732 1 52 TRP HD1 1 72 PHE HA 0.000 . 3.730 3.423 2.631 3.755 0.025 7 0 "[ . 1 . 2]" 1
733 1 52 TRP HD1 1 72 PHE QD 0.000 . 7.060 4.777 4.235 5.116 . 0 0 "[ . 1 . 2]" 1
734 1 52 TRP HE1 1 71 ASN QB 0.000 . 6.380 3.569 2.850 4.570 . 0 0 "[ . 1 . 2]" 1
735 1 52 TRP HE1 1 72 PHE HA 0.000 . 5.500 2.933 2.576 3.290 . 0 0 "[ . 1 . 2]" 1
736 1 52 TRP HE1 1 75 ASP H 0.000 . 5.500 4.084 3.768 4.422 . 0 0 "[ . 1 . 2]" 1
737 1 52 TRP HE1 1 75 ASP HA 0.000 . 5.500 4.828 4.586 5.361 . 0 0 "[ . 1 . 2]" 1
738 1 52 TRP HE3 1 72 PHE QD 0.000 . 6.380 2.790 2.322 3.438 . 0 0 "[ . 1 . 2]" 1
739 1 52 TRP HE3 1 72 PHE QE 0.000 . 6.780 3.592 2.916 4.366 . 0 0 "[ . 1 . 2]" 1
740 1 53 THR H 1 53 THR HB 0.000 . 3.390 2.481 2.352 2.548 . 0 0 "[ . 1 . 2]" 1
741 1 53 THR HA 1 54 VAL H 0.000 . 3.170 2.122 2.065 2.180 . 0 0 "[ . 1 . 2]" 1
742 1 53 THR HB 1 54 VAL H 0.000 . 4.290 4.252 4.185 4.317 0.027 12 0 "[ . 1 . 2]" 1
743 1 53 THR MG 1 54 VAL H 0.000 . 4.420 2.914 2.747 3.043 . 0 0 "[ . 1 . 2]" 1
744 1 54 VAL H 1 54 VAL HB 0.000 . 3.860 3.393 2.554 3.840 . 0 0 "[ . 1 . 2]" 1
745 1 54 VAL HA 1 55 ARG H 0.000 . 3.170 2.344 2.216 2.450 . 0 0 "[ . 1 . 2]" 1
746 1 54 VAL HA 1 65 LEU QD 0.000 . 8.100 4.692 3.738 5.476 . 0 0 "[ . 1 . 2]" 1
747 1 54 VAL HA 1 69 TRP H 0.000 . 4.970 3.809 3.335 4.264 . 0 0 "[ . 1 . 2]" 1
748 1 54 VAL HB 1 55 ARG H 0.000 . 3.860 3.138 2.465 3.938 0.078 12 0 "[ . 1 . 2]" 1
749 1 54 VAL HB 1 65 LEU MD1 0.000 . 6.340 4.691 3.019 6.446 0.106 12 0 "[ . 1 . 2]" 1
750 1 54 VAL HB 1 65 LEU QD 0.000 . 5.740 2.972 1.835 4.494 . 0 0 "[ . 1 . 2]" 1
751 1 54 VAL HB 1 65 LEU MD2 0.000 . 6.340 3.080 1.849 5.090 . 0 0 "[ . 1 . 2]" 1
752 1 54 VAL QG 1 55 ARG H 0.000 . 4.600 2.694 1.995 3.262 . 0 0 "[ . 1 . 2]" 1
753 1 54 VAL QG 1 65 LEU HA 0.000 . 6.820 4.128 2.822 5.109 . 0 0 "[ . 1 . 2]" 1
754 1 54 VAL QG 1 65 LEU QB 0.000 . 8.840 2.996 1.852 4.223 . 0 0 "[ . 1 . 2]" 1
755 1 54 VAL QG 1 65 LEU QD 0.000 . 6.760 1.961 1.751 2.387 . 0 0 "[ . 1 . 2]" 1
756 1 54 VAL QG 1 65 LEU HG 0.000 . 5.640 3.210 1.917 4.328 . 0 0 "[ . 1 . 2]" 1
757 1 54 VAL QG 1 68 GLY QA 0.000 . 7.410 2.839 2.086 3.533 . 0 0 "[ . 1 . 2]" 1
758 1 54 VAL QG 1 69 TRP H 0.000 . 5.050 2.659 1.796 3.448 . 0 0 "[ . 1 . 2]" 1
759 1 54 VAL QG 1 69 TRP HA 0.000 . 4.940 2.355 1.921 3.366 . 0 0 "[ . 1 . 2]" 1
760 1 54 VAL QG 1 69 TRP QB 0.000 . 6.190 2.608 1.939 3.297 . 0 0 "[ . 1 . 2]" 1
761 1 54 VAL MG1 1 55 ARG H 0.000 . 5.190 3.470 2.002 3.899 . 0 0 "[ . 1 . 2]" 1
762 1 54 VAL MG1 1 65 LEU MD1 0.000 . 9.030 3.965 2.466 5.877 . 0 0 "[ . 1 . 2]" 1
763 1 54 VAL MG1 1 65 LEU MD2 0.000 . 9.030 2.717 1.936 3.763 . 0 0 "[ . 1 . 2]" 1
764 1 54 VAL MG1 1 68 GLY HA2 0.000 . 9.490 4.483 3.118 6.748 . 0 0 "[ . 1 . 2]" 1
765 1 54 VAL MG1 1 68 GLY HA3 0.000 . 9.490 3.509 2.125 5.653 . 0 0 "[ . 1 . 2]" 1
766 1 54 VAL MG1 1 69 TRP H 0.000 . 5.500 3.495 1.950 5.366 . 0 0 "[ . 1 . 2]" 1
767 1 54 VAL MG1 1 69 TRP HA 0.000 . 5.320 2.927 1.936 4.600 . 0 0 "[ . 1 . 2]" 1
768 1 54 VAL MG1 1 69 TRP HB2 0.000 . 8.280 3.371 1.978 4.391 . 0 0 "[ . 1 . 2]" 1
769 1 54 VAL MG1 1 69 TRP HB3 0.000 . 8.280 4.452 2.984 5.789 . 0 0 "[ . 1 . 2]" 1
770 1 54 VAL MG1 1 69 TRP HE3 0.000 . 5.160 3.129 2.440 4.126 . 0 0 "[ . 1 . 2]" 1
771 1 54 VAL MG2 1 55 ARG H 0.000 . 5.190 3.113 2.020 3.945 . 0 0 "[ . 1 . 2]" 1
772 1 54 VAL MG2 1 65 LEU MD1 0.000 . 9.030 3.357 1.906 5.296 . 0 0 "[ . 1 . 2]" 1
773 1 54 VAL MG2 1 65 LEU MD2 0.000 . 9.030 2.460 1.870 4.186 . 0 0 "[ . 1 . 2]" 1
774 1 54 VAL MG2 1 68 GLY HA2 0.000 . 9.490 5.171 4.034 6.251 . 0 0 "[ . 1 . 2]" 1
775 1 54 VAL MG2 1 68 GLY HA3 0.000 . 9.490 3.988 2.533 5.124 . 0 0 "[ . 1 . 2]" 1
776 1 54 VAL MG2 1 69 TRP H 0.000 . 5.500 3.720 1.798 4.808 . 0 0 "[ . 1 . 2]" 1
777 1 54 VAL MG2 1 69 TRP HA 0.000 . 5.320 3.459 2.037 4.789 . 0 0 "[ . 1 . 2]" 1
778 1 54 VAL MG2 1 69 TRP HB2 0.000 . 8.280 3.360 2.030 4.502 . 0 0 "[ . 1 . 2]" 1
779 1 54 VAL MG2 1 69 TRP HB3 0.000 . 8.280 4.553 2.796 5.808 . 0 0 "[ . 1 . 2]" 1
780 1 54 VAL MG2 1 69 TRP HE3 0.000 . 5.160 3.301 2.056 4.224 . 0 0 "[ . 1 . 2]" 1
781 1 55 ARG H 1 55 ARG HB2 0.000 . 3.670 2.512 2.218 2.931 . 0 0 "[ . 1 . 2]" 1
782 1 55 ARG H 1 55 ARG QB 0.000 . 3.500 2.322 2.197 2.469 . 0 0 "[ . 1 . 2]" 1
783 1 55 ARG H 1 55 ARG HB3 0.000 . 3.670 3.173 2.398 3.692 0.022 6 0 "[ . 1 . 2]" 1
784 1 55 ARG QB 1 67 VAL H 0.000 . 4.580 3.432 2.725 4.035 . 0 0 "[ . 1 . 2]" 1
785 1 55 ARG HB2 1 67 VAL H 0.000 . 4.760 4.072 2.875 4.939 0.179 15 0 "[ . 1 . 2]" 1
786 1 55 ARG HB3 1 67 VAL H 0.000 . 4.760 4.231 2.764 4.881 0.121 18 0 "[ . 1 . 2]" 1
787 1 55 ARG QD 1 56 MET H 0.000 . 6.380 5.037 4.438 5.594 . 0 0 "[ . 1 . 2]" 1
788 1 55 ARG QG 1 56 MET H 0.000 . 5.360 3.558 2.603 4.294 . 0 0 "[ . 1 . 2]" 1
789 1 56 MET H 1 56 MET ME 0.000 . 6.530 5.406 4.040 5.976 . 0 0 "[ . 1 . 2]" 1
790 1 56 MET H 1 56 MET HG2 0.000 . 5.500 4.428 4.269 4.745 . 0 0 "[ . 1 . 2]" 1
791 1 56 MET H 1 56 MET HG3 0.000 . 5.500 4.727 4.635 4.962 . 0 0 "[ . 1 . 2]" 1
792 1 56 MET H 1 57 LYS H 0.000 . 4.570 4.375 4.187 4.474 . 0 0 "[ . 1 . 2]" 1
793 1 56 MET H 1 65 LEU QD 0.000 . 7.170 4.692 3.914 5.150 . 0 0 "[ . 1 . 2]" 1
794 1 56 MET H 1 66 THR MG 0.000 . 6.530 5.488 3.879 6.577 0.047 14 0 "[ . 1 . 2]" 1
795 1 56 MET HA 1 57 LYS H 0.000 . 3.300 2.239 2.144 2.360 . 0 0 "[ . 1 . 2]" 1
796 1 56 MET HA 1 65 LEU HA 0.000 . 3.920 2.092 1.901 2.459 . 0 0 "[ . 1 . 2]" 1
797 1 56 MET HA 1 65 LEU QD 0.000 . 6.520 3.337 2.182 4.031 . 0 0 "[ . 1 . 2]" 1
798 1 56 MET HA 1 65 LEU HG 0.000 . 5.500 3.267 2.312 4.840 . 0 0 "[ . 1 . 2]" 1
799 1 56 MET HA 1 66 THR H 0.000 . 4.660 2.955 1.952 3.608 . 0 0 "[ . 1 . 2]" 1
800 1 56 MET HA 1 66 THR MG 0.000 . 6.530 4.146 3.011 5.740 . 0 0 "[ . 1 . 2]" 1
801 1 56 MET ME 1 57 LYS H 0.000 . 6.530 4.593 3.651 5.032 . 0 0 "[ . 1 . 2]" 1
802 1 56 MET ME 1 58 LYS H 0.000 . 6.280 4.967 4.110 6.082 . 0 0 "[ . 1 . 2]" 1
803 1 56 MET ME 1 63 VAL MG1 0.000 . 5.760 2.518 1.857 4.553 . 0 0 "[ . 1 . 2]" 1
804 1 56 MET ME 1 63 VAL QG 0.000 . 5.430 2.405 1.836 3.815 . 0 0 "[ . 1 . 2]" 1
805 1 56 MET ME 1 63 VAL MG2 0.000 . 5.760 3.368 2.591 4.678 . 0 0 "[ . 1 . 2]" 1
806 1 56 MET ME 1 64 PHE H 0.000 . 6.530 5.303 3.530 6.349 . 0 0 "[ . 1 . 2]" 1
807 1 56 MET QG 1 57 LYS H 0.000 . 5.050 2.759 2.268 3.082 . 0 0 "[ . 1 . 2]" 1
808 1 56 MET QG 1 63 VAL QG 0.000 . 5.780 2.654 2.086 3.934 . 0 0 "[ . 1 . 2]" 1
809 1 56 MET QG 1 65 LEU H 0.000 . 6.380 4.641 3.641 5.446 . 0 0 "[ . 1 . 2]" 1
810 1 56 MET QG 1 65 LEU QD 0.000 . 6.070 2.801 2.052 4.162 . 0 0 "[ . 1 . 2]" 1
811 1 56 MET QG 1 66 THR H 0.000 . 6.380 4.891 3.746 5.717 . 0 0 "[ . 1 . 2]" 1
812 1 56 MET HG2 1 57 LYS H 0.000 . 5.380 2.995 2.372 3.455 . 0 0 "[ . 1 . 2]" 1
813 1 56 MET HG2 1 63 VAL MG1 0.000 . 7.750 3.230 2.231 5.350 . 0 0 "[ . 1 . 2]" 1
814 1 56 MET HG2 1 63 VAL MG2 0.000 . 7.750 4.523 3.987 4.997 . 0 0 "[ . 1 . 2]" 1
815 1 56 MET HG2 1 65 LEU MD1 0.000 . 8.280 4.538 2.580 6.374 . 0 0 "[ . 1 . 2]" 1
816 1 56 MET HG2 1 65 LEU MD2 0.000 . 8.280 5.138 3.516 6.698 . 0 0 "[ . 1 . 2]" 1
817 1 56 MET HG3 1 57 LYS H 0.000 . 5.380 3.358 2.795 4.575 . 0 0 "[ . 1 . 2]" 1
818 1 56 MET HG3 1 63 VAL MG1 0.000 . 7.750 3.258 2.294 5.854 . 0 0 "[ . 1 . 2]" 1
819 1 56 MET HG3 1 63 VAL MG2 0.000 . 7.750 4.700 4.082 5.108 . 0 0 "[ . 1 . 2]" 1
820 1 56 MET HG3 1 65 LEU MD1 0.000 . 8.280 3.342 2.379 4.942 . 0 0 "[ . 1 . 2]" 1
821 1 56 MET HG3 1 65 LEU MD2 0.000 . 8.280 4.019 2.068 5.548 . 0 0 "[ . 1 . 2]" 1
822 1 57 LYS H 1 57 LYS HB2 0.000 . 3.700 2.892 2.561 3.800 0.100 6 0 "[ . 1 . 2]" 1
823 1 57 LYS H 1 57 LYS HB3 0.000 . 3.700 3.343 2.637 3.768 0.068 10 0 "[ . 1 . 2]" 1
824 1 57 LYS H 1 63 VAL MG1 0.000 . 5.290 3.644 2.958 5.307 0.017 3 0 "[ . 1 . 2]" 1
825 1 57 LYS H 1 63 VAL QG 0.000 . 4.960 3.516 2.941 4.736 . 0 0 "[ . 1 . 2]" 1
826 1 57 LYS H 1 63 VAL MG2 0.000 . 5.290 5.295 5.088 5.386 0.096 1 0 "[ . 1 . 2]" 1
827 1 57 LYS H 1 64 PHE H 0.000 . 4.100 3.182 2.879 4.109 0.009 13 0 "[ . 1 . 2]" 1
828 1 57 LYS H 1 64 PHE QB 0.000 . 6.380 4.092 3.418 4.784 . 0 0 "[ . 1 . 2]" 1
829 1 57 LYS H 1 65 LEU HA 0.000 . 4.260 3.189 2.818 3.590 . 0 0 "[ . 1 . 2]" 1
830 1 57 LYS H 1 65 LEU QD 0.000 . 8.100 4.388 3.293 5.246 . 0 0 "[ . 1 . 2]" 1
831 1 57 LYS H 1 65 LEU HG 0.000 . 5.500 4.861 4.073 5.607 0.107 19 0 "[ . 1 . 2]" 1
832 1 57 LYS H 1 66 THR H 0.000 . 4.230 3.879 3.076 4.260 0.030 10 0 "[ . 1 . 2]" 1
833 1 57 LYS H 1 66 THR MG 0.000 . 6.090 3.903 3.088 4.965 . 0 0 "[ . 1 . 2]" 1
834 1 57 LYS HA 1 57 LYS HD2 0.000 . 4.570 3.619 2.074 4.686 0.116 15 0 "[ . 1 . 2]" 1
835 1 57 LYS HA 1 57 LYS QD 0.000 . 3.890 3.174 1.885 4.047 0.157 11 0 "[ . 1 . 2]" 1
836 1 57 LYS HA 1 57 LYS HD3 0.000 . 4.570 3.875 1.892 4.653 0.083 14 0 "[ . 1 . 2]" 1
837 1 57 LYS HA 1 63 VAL QG 0.000 . 7.220 4.327 3.628 5.327 . 0 0 "[ . 1 . 2]" 1
838 1 57 LYS QB 1 58 LYS H 0.000 . 3.770 3.262 2.381 3.787 0.017 5 0 "[ . 1 . 2]" 1
839 1 57 LYS QB 1 64 PHE H 0.000 . 6.380 3.754 2.986 4.890 . 0 0 "[ . 1 . 2]" 1
840 1 57 LYS QB 1 66 THR MG 0.000 . 5.200 3.246 2.208 4.717 . 0 0 "[ . 1 . 2]" 1
841 1 57 LYS HB2 1 58 LYS H 0.000 . 4.230 4.092 2.453 4.305 0.075 2 0 "[ . 1 . 2]" 1
842 1 57 LYS HB2 1 64 PHE QB 0.000 . 6.380 4.379 2.674 5.702 . 0 0 "[ . 1 . 2]" 1
843 1 57 LYS HB2 1 66 THR MG 0.000 . 5.380 3.532 2.390 5.425 0.045 6 0 "[ . 1 . 2]" 1
844 1 57 LYS HB3 1 58 LYS H 0.000 . 4.230 3.535 2.409 4.238 0.008 5 0 "[ . 1 . 2]" 1
845 1 57 LYS HB3 1 64 PHE QB 0.000 . 6.380 4.552 2.199 6.391 0.011 8 0 "[ . 1 . 2]" 1
846 1 57 LYS HB3 1 66 THR MG 0.000 . 5.380 4.177 2.281 5.405 0.025 1 0 "[ . 1 . 2]" 1
847 1 57 LYS QD 1 66 THR H 0.000 . 6.380 4.945 3.320 6.588 0.208 12 0 "[ . 1 . 2]" 1
848 1 57 LYS QD 1 66 THR MG 0.000 . 5.390 3.349 1.955 5.416 0.026 12 0 "[ . 1 . 2]" 1
849 1 57 LYS QG 1 58 LYS H 0.000 . 6.380 3.548 2.576 4.342 . 0 0 "[ . 1 . 2]" 1
850 1 58 LYS H 1 58 LYS HB2 0.000 . 3.520 2.658 2.372 3.123 . 0 0 "[ . 1 . 2]" 1
851 1 58 LYS H 1 58 LYS HB3 0.000 . 3.520 3.117 2.205 3.630 0.110 18 0 "[ . 1 . 2]" 1
852 1 58 LYS H 1 58 LYS HG2 0.000 . 5.440 3.428 2.353 4.518 . 0 0 "[ . 1 . 2]" 1
853 1 58 LYS H 1 58 LYS QG 0.000 . 4.910 3.124 2.327 4.072 . 0 0 "[ . 1 . 2]" 1
854 1 58 LYS H 1 58 LYS HG3 0.000 . 5.440 3.930 2.725 4.700 . 0 0 "[ . 1 . 2]" 1
855 1 58 LYS H 1 63 VAL QG 0.000 . 8.090 3.823 3.302 4.349 . 0 0 "[ . 1 . 2]" 1
856 1 58 LYS HA 1 59 ARG H 0.000 . 3.020 2.044 1.803 2.208 . 0 0 "[ . 1 . 2]" 1
857 1 58 LYS HA 1 63 VAL HA 0.000 . 3.330 2.504 2.010 3.432 0.102 8 0 "[ . 1 . 2]" 1
858 1 58 LYS HA 1 63 VAL MG1 0.000 . 5.850 2.596 1.800 3.309 . 0 0 "[ . 1 . 2]" 1
859 1 58 LYS HA 1 63 VAL QG 0.000 . 5.230 2.246 1.796 2.699 . 0 0 "[ . 1 . 2]" 1
860 1 58 LYS HA 1 63 VAL MG2 0.000 . 5.850 3.076 2.121 4.831 . 0 0 "[ . 1 . 2]" 1
861 1 58 LYS HA 1 64 PHE H 0.000 . 4.350 3.745 3.098 4.439 0.089 12 0 "[ . 1 . 2]" 1
862 1 58 LYS QB 1 59 ARG H 0.000 . 3.720 3.328 2.954 3.589 . 0 0 "[ . 1 . 2]" 1
863 1 58 LYS QB 1 63 VAL QG 0.000 . 7.790 2.768 1.903 3.776 . 0 0 "[ . 1 . 2]" 1
864 1 58 LYS HB2 1 59 ARG H 0.000 . 3.890 4.015 3.938 4.093 0.203 4 0 "[ . 1 . 2]" 1
865 1 58 LYS HB3 1 59 ARG H 0.000 . 3.890 3.605 3.045 4.065 0.175 14 0 "[ . 1 . 2]" 1
866 1 58 LYS QD 1 63 VAL H 0.000 . 6.380 5.621 4.638 6.449 0.069 17 0 "[ . 1 . 2]" 1
867 1 58 LYS QD 1 63 VAL QG 0.000 . 6.510 2.191 1.698 3.475 . 0 0 "[ . 1 . 2]" 1
868 1 58 LYS HD2 1 63 VAL MG1 0.000 . 8.220 3.363 1.719 5.720 . 0 0 "[ . 1 . 2]" 1
869 1 58 LYS HD2 1 63 VAL MG2 0.000 . 8.220 2.988 1.815 6.557 . 0 0 "[ . 1 . 2]" 1
870 1 58 LYS HD3 1 63 VAL MG1 0.000 . 8.220 3.909 2.711 5.644 . 0 0 "[ . 1 . 2]" 1
871 1 58 LYS HD3 1 63 VAL MG2 0.000 . 8.220 3.708 1.839 6.022 . 0 0 "[ . 1 . 2]" 1
872 1 58 LYS QE 1 63 VAL QG 0.000 . 6.420 3.182 1.866 4.242 . 0 0 "[ . 1 . 2]" 1
873 1 58 LYS HE2 1 63 VAL MG1 0.000 . 8.040 4.795 1.997 6.768 . 0 0 "[ . 1 . 2]" 1
874 1 58 LYS HE2 1 63 VAL MG2 0.000 . 8.040 4.181 2.295 5.753 . 0 0 "[ . 1 . 2]" 1
875 1 58 LYS HE3 1 63 VAL MG1 0.000 . 8.040 4.970 2.451 7.092 . 0 0 "[ . 1 . 2]" 1
876 1 58 LYS HE3 1 63 VAL MG2 0.000 . 8.040 4.384 2.103 6.667 . 0 0 "[ . 1 . 2]" 1
877 1 58 LYS QG 1 59 ARG H 0.000 . 6.130 3.890 2.592 4.817 . 0 0 "[ . 1 . 2]" 1
878 1 58 LYS QG 1 64 PHE H 0.000 . 6.380 5.598 4.730 6.407 0.027 16 0 "[ . 1 . 2]" 1
879 1 59 ARG H 1 59 ARG HB2 0.000 . 3.830 3.150 2.651 3.857 0.027 6 0 "[ . 1 . 2]" 1
880 1 59 ARG H 1 59 ARG HB3 0.000 . 3.830 3.035 2.633 3.853 0.023 17 0 "[ . 1 . 2]" 1
881 1 59 ARG H 1 62 LYS H 0.000 . 4.630 3.879 3.382 4.667 0.037 13 0 "[ . 1 . 2]" 1
882 1 60 GLY HA2 1 62 LYS H 0.000 . 4.540 4.549 4.208 4.665 0.125 5 0 "[ . 1 . 2]" 1
883 1 60 GLY HA3 1 62 LYS H 0.000 . 4.540 3.516 3.005 4.102 . 0 0 "[ . 1 . 2]" 1
884 1 61 GLU H 1 62 LYS H 0.000 . 4.630 2.277 2.032 2.640 . 0 0 "[ . 1 . 2]" 1
885 1 61 GLU QB 1 62 LYS H 0.000 . 4.330 3.354 2.771 3.920 . 0 0 "[ . 1 . 2]" 1
886 1 61 GLU HB2 1 62 LYS H 0.000 . 4.600 3.606 2.833 4.331 . 0 0 "[ . 1 . 2]" 1
887 1 61 GLU HB3 1 62 LYS H 0.000 . 4.600 4.185 3.494 4.479 . 0 0 "[ . 1 . 2]" 1
888 1 61 GLU QG 1 62 LYS H 0.000 . 6.380 4.186 3.081 4.849 . 0 0 "[ . 1 . 2]" 1
889 1 62 LYS H 1 62 LYS HB2 0.000 . 3.610 3.207 2.514 3.754 0.144 13 0 "[ . 1 . 2]" 1
890 1 62 LYS H 1 62 LYS HB3 0.000 . 3.610 3.266 2.463 3.754 0.144 10 0 "[ . 1 . 2]" 1
891 1 62 LYS QB 1 63 VAL H 0.000 . 4.300 2.591 2.093 3.535 . 0 0 "[ . 1 . 2]" 1
892 1 62 LYS HB2 1 63 VAL H 0.000 . 4.450 3.151 2.221 4.194 . 0 0 "[ . 1 . 2]" 1
893 1 62 LYS HB3 1 63 VAL H 0.000 . 4.450 3.277 2.109 4.070 . 0 0 "[ . 1 . 2]" 1
894 1 63 VAL H 1 63 VAL HB 0.000 . 3.860 3.000 2.518 3.848 . 0 0 "[ . 1 . 2]" 1
895 1 63 VAL QG 1 64 PHE H 0.000 . 4.540 2.738 2.245 3.382 . 0 0 "[ . 1 . 2]" 1
896 1 63 VAL MG1 1 64 PHE H 0.000 . 5.100 2.885 2.258 3.860 . 0 0 "[ . 1 . 2]" 1
897 1 63 VAL MG2 1 64 PHE H 0.000 . 5.100 3.924 3.536 4.156 . 0 0 "[ . 1 . 2]" 1
898 1 64 PHE HA 1 65 LEU H 0.000 . 3.210 2.141 2.047 2.294 . 0 0 "[ . 1 . 2]" 1
899 1 65 LEU H 1 65 LEU HG 0.000 . 5.380 3.976 2.517 4.655 . 0 0 "[ . 1 . 2]" 1
900 1 65 LEU QB 1 66 THR H 0.000 . 4.980 3.581 3.260 3.994 . 0 0 "[ . 1 . 2]" 1
901 1 65 LEU QD 1 66 THR H 0.000 . 5.480 3.691 2.588 4.517 . 0 0 "[ . 1 . 2]" 1
902 1 65 LEU QD 1 69 TRP HE3 0.000 . 6.950 3.063 2.129 4.021 . 0 0 "[ . 1 . 2]" 1
903 1 65 LEU QD 1 69 TRP HZ3 0.000 . 7.690 3.945 2.868 4.741 . 0 0 "[ . 1 . 2]" 1
904 1 65 LEU MD1 1 66 THR H 0.000 . 6.530 4.797 3.291 5.379 . 0 0 "[ . 1 . 2]" 1
905 1 65 LEU MD2 1 66 THR H 0.000 . 6.530 4.129 2.597 5.244 . 0 0 "[ . 1 . 2]" 1
906 1 66 THR HB 1 67 VAL H 0.000 . 4.540 2.208 1.609 3.394 . 0 0 "[ . 1 . 2]" 1
907 1 66 THR MG 1 67 VAL H 0.000 . 5.410 3.131 1.610 3.604 . 0 0 "[ . 1 . 2]" 1
908 1 67 VAL H 1 67 VAL HB 0.000 . 4.140 2.891 2.458 3.735 . 0 0 "[ . 1 . 2]" 1
909 1 67 VAL HA 1 68 GLY H 0.000 . 3.360 2.139 1.976 2.263 . 0 0 "[ . 1 . 2]" 1
910 1 67 VAL QG 1 68 GLY H 0.000 . 5.310 2.696 2.156 3.356 . 0 0 "[ . 1 . 2]" 1
911 1 67 VAL QG 1 70 GLU H 0.000 . 8.090 4.260 3.722 5.134 . 0 0 "[ . 1 . 2]" 1
912 1 67 VAL MG1 1 68 GLY H 0.000 . 6.160 3.393 2.237 4.077 . 0 0 "[ . 1 . 2]" 1
913 1 67 VAL MG2 1 68 GLY H 0.000 . 6.160 3.284 2.171 4.008 . 0 0 "[ . 1 . 2]" 1
914 1 68 GLY QA 1 70 GLU H 0.000 . 3.710 3.455 3.263 3.586 . 0 0 "[ . 1 . 2]" 1
915 1 68 GLY QA 1 71 ASN H 0.000 . 5.510 3.472 3.095 3.949 . 0 0 "[ . 1 . 2]" 1
916 1 68 GLY HA2 1 70 GLU H 0.000 . 3.950 3.736 3.436 3.967 0.017 9 0 "[ . 1 . 2]" 1
917 1 68 GLY HA3 1 70 GLU H 0.000 . 3.950 4.081 4.031 4.151 0.201 14 0 "[ . 1 . 2]" 1
918 1 69 TRP H 1 69 TRP HB2 0.000 . 3.980 2.691 2.572 2.809 . 0 0 "[ . 1 . 2]" 1
919 1 69 TRP H 1 69 TRP QB 0.000 . 3.820 2.205 2.121 2.265 . 0 0 "[ . 1 . 2]" 1
920 1 69 TRP H 1 69 TRP HB3 0.000 . 3.980 2.348 2.196 2.441 . 0 0 "[ . 1 . 2]" 1
921 1 69 TRP H 1 69 TRP HE3 0.000 . 5.500 4.913 4.760 5.137 . 0 0 "[ . 1 . 2]" 1
922 1 69 TRP H 1 71 ASN H 0.000 . 5.000 4.269 3.974 4.543 . 0 0 "[ . 1 . 2]" 1
923 1 69 TRP HA 1 69 TRP HE3 0.000 . 3.140 2.789 2.579 2.969 . 0 0 "[ . 1 . 2]" 1
924 1 69 TRP QB 1 69 TRP HD1 0.000 . 3.420 2.461 2.446 2.480 . 0 0 "[ . 1 . 2]" 1
925 1 69 TRP QB 1 69 TRP HE3 0.000 . 3.570 2.735 2.616 2.828 . 0 0 "[ . 1 . 2]" 1
926 1 69 TRP QB 1 70 GLU H 0.000 . 4.090 2.885 2.676 3.042 . 0 0 "[ . 1 . 2]" 1
927 1 69 TRP HB2 1 69 TRP HD1 0.000 . 3.610 3.658 3.630 3.673 0.063 5 0 "[ . 1 . 2]" 1
928 1 69 TRP HB2 1 70 GLU H 0.000 . 4.260 4.083 3.943 4.218 . 0 0 "[ . 1 . 2]" 1
929 1 69 TRP HB3 1 69 TRP HD1 0.000 . 3.610 2.502 2.484 2.522 . 0 0 "[ . 1 . 2]" 1
930 1 69 TRP HB3 1 70 GLU H 0.000 . 4.260 2.950 2.722 3.120 . 0 0 "[ . 1 . 2]" 1
931 1 69 TRP HD1 1 70 GLU H 0.000 . 4.200 4.033 3.722 4.215 0.015 2 0 "[ . 1 . 2]" 1
932 1 69 TRP HD1 1 73 VAL QG 0.000 . 7.680 3.623 3.264 4.139 . 0 0 "[ . 1 . 2]" 1
933 1 69 TRP HE1 1 73 VAL MG1 0.000 . 6.530 3.937 3.585 4.257 . 0 0 "[ . 1 . 2]" 1
934 1 69 TRP HE1 1 73 VAL QG 0.000 . 5.580 3.076 2.193 3.581 . 0 0 "[ . 1 . 2]" 1
935 1 69 TRP HE1 1 73 VAL MG2 0.000 . 6.530 3.239 2.204 3.895 . 0 0 "[ . 1 . 2]" 1
936 1 69 TRP HE3 1 84 LEU QD 0.000 . 7.110 5.216 4.686 5.781 . 0 0 "[ . 1 . 2]" 1
937 1 69 TRP HE3 1 96 VAL QG 0.000 . 7.720 4.931 4.222 5.549 . 0 0 "[ . 1 . 2]" 1
938 1 69 TRP HH2 1 72 PHE QD 0.000 . 7.030 3.593 3.130 4.052 . 0 0 "[ . 1 . 2]" 1
939 1 69 TRP HH2 1 73 VAL QG 0.000 . 6.510 5.217 3.432 5.872 . 0 0 "[ . 1 . 2]" 1
940 1 69 TRP HH2 1 84 LEU MD1 0.000 . 4.790 3.314 1.876 4.349 . 0 0 "[ . 1 . 2]" 1
941 1 69 TRP HH2 1 84 LEU QD 0.000 . 4.290 2.045 1.861 2.729 . 0 0 "[ . 1 . 2]" 1
942 1 69 TRP HH2 1 84 LEU MD2 0.000 . 4.790 2.490 1.872 4.056 . 0 0 "[ . 1 . 2]" 1
943 1 69 TRP HZ2 1 73 VAL HB 0.000 . 4.320 4.305 4.035 4.499 0.179 16 0 "[ . 1 . 2]" 1
944 1 69 TRP HZ2 1 73 VAL QG 0.000 . 5.700 3.719 2.147 4.314 . 0 0 "[ . 1 . 2]" 1
945 1 69 TRP HZ2 1 84 LEU MD1 0.000 . 5.570 4.015 3.169 5.454 . 0 0 "[ . 1 . 2]" 1
946 1 69 TRP HZ2 1 84 LEU QD 0.000 . 4.740 2.963 2.347 3.511 . 0 0 "[ . 1 . 2]" 1
947 1 69 TRP HZ2 1 84 LEU MD2 0.000 . 5.570 3.361 2.381 5.280 . 0 0 "[ . 1 . 2]" 1
948 1 69 TRP HZ3 1 84 LEU MD1 0.000 . 6.000 4.882 2.858 6.062 0.062 14 0 "[ . 1 . 2]" 1
949 1 69 TRP HZ3 1 84 LEU QD 0.000 . 5.430 3.558 2.841 4.403 . 0 0 "[ . 1 . 2]" 1
950 1 69 TRP HZ3 1 84 LEU MD2 0.000 . 6.000 4.128 3.340 5.813 . 0 0 "[ . 1 . 2]" 1
951 1 70 GLU H 1 70 GLU HG2 0.000 . 4.660 3.556 1.935 4.525 . 0 0 "[ . 1 . 2]" 1
952 1 70 GLU H 1 70 GLU QG 0.000 . 4.470 3.120 1.918 4.023 . 0 0 "[ . 1 . 2]" 1
953 1 70 GLU H 1 70 GLU HG3 0.000 . 4.660 3.817 1.988 4.512 . 0 0 "[ . 1 . 2]" 1
954 1 70 GLU H 1 71 ASN H 0.000 . 3.790 2.607 2.455 2.746 . 0 0 "[ . 1 . 2]" 1
955 1 70 GLU H 1 72 PHE H 0.000 . 4.380 4.087 3.850 4.407 0.027 16 0 "[ . 1 . 2]" 1
956 1 70 GLU H 1 73 VAL QG 0.000 . 8.090 4.291 4.020 5.604 . 0 0 "[ . 1 . 2]" 1
957 1 70 GLU HA 1 72 PHE H 0.000 . 4.970 4.003 3.701 4.232 . 0 0 "[ . 1 . 2]" 1
958 1 70 GLU HA 1 73 VAL H 0.000 . 3.790 3.285 2.958 3.650 . 0 0 "[ . 1 . 2]" 1
959 1 70 GLU HA 1 73 VAL HB 0.000 . 3.330 3.386 3.271 3.467 0.137 12 0 "[ . 1 . 2]" 1
960 1 70 GLU HA 1 73 VAL MG1 0.000 . 5.380 2.101 1.771 4.579 . 0 0 "[ . 1 . 2]" 1
961 1 70 GLU HA 1 73 VAL QG 0.000 . 4.940 2.037 1.770 3.935 . 0 0 "[ . 1 . 2]" 1
962 1 70 GLU HA 1 73 VAL MG2 0.000 . 5.380 4.335 4.235 4.420 . 0 0 "[ . 1 . 2]" 1
963 1 70 GLU HA 1 74 LYS H 0.000 . 3.920 3.735 3.583 3.984 0.064 19 0 "[ . 1 . 2]" 1
964 1 70 GLU QB 1 73 VAL MG1 0.000 . 7.400 3.484 2.695 5.897 . 0 0 "[ . 1 . 2]" 1
965 1 70 GLU QB 1 73 VAL MG2 0.000 . 7.400 5.448 4.894 5.833 . 0 0 "[ . 1 . 2]" 1
966 1 70 GLU QB 1 74 LYS H 0.000 . 5.850 4.764 4.059 5.232 . 0 0 "[ . 1 . 2]" 1
967 1 70 GLU QB 1 74 LYS QE 0.000 . 7.250 5.011 2.290 7.264 0.014 8 0 "[ . 1 . 2]" 1
968 1 70 GLU QB 1 74 LYS QG 0.000 . 7.230 4.195 2.764 6.310 . 0 0 "[ . 1 . 2]" 1
969 1 70 GLU QG 1 71 ASN H 0.000 . 5.150 3.359 2.307 4.540 . 0 0 "[ . 1 . 2]" 1
970 1 70 GLU QG 1 74 LYS H 0.000 . 6.380 4.626 3.638 6.279 . 0 0 "[ . 1 . 2]" 1
971 1 70 GLU QG 1 74 LYS QE 0.000 . 7.260 4.774 2.086 6.804 . 0 0 "[ . 1 . 2]" 1
972 1 70 GLU QG 1 74 LYS QG 0.000 . 6.320 3.937 2.500 5.197 . 0 0 "[ . 1 . 2]" 1
973 1 70 GLU HG2 1 71 ASN H 0.000 . 5.470 3.725 2.665 5.020 . 0 0 "[ . 1 . 2]" 1
974 1 70 GLU HG2 1 74 LYS HG2 0.000 . 7.250 5.211 2.755 7.266 0.016 13 0 "[ . 1 . 2]" 1
975 1 70 GLU HG2 1 74 LYS HG3 0.000 . 7.250 5.346 2.700 7.295 0.045 18 0 "[ . 1 . 2]" 1
976 1 70 GLU HG3 1 71 ASN H 0.000 . 5.470 4.029 2.481 5.181 . 0 0 "[ . 1 . 2]" 1
977 1 70 GLU HG3 1 74 LYS HG2 0.000 . 7.250 5.362 3.136 7.260 0.010 7 0 "[ . 1 . 2]" 1
978 1 70 GLU HG3 1 74 LYS HG3 0.000 . 7.250 5.465 3.068 7.312 0.062 18 0 "[ . 1 . 2]" 1
979 1 71 ASN H 1 71 ASN HB2 0.000 . 3.760 2.516 2.425 2.575 . 0 0 "[ . 1 . 2]" 1
980 1 71 ASN H 1 71 ASN HB3 0.000 . 3.760 3.628 3.601 3.669 . 0 0 "[ . 1 . 2]" 1
981 1 71 ASN H 1 72 PHE H 0.000 . 3.610 2.504 2.282 2.666 . 0 0 "[ . 1 . 2]" 1
982 1 71 ASN H 1 74 LYS H 0.000 . 4.720 4.739 4.595 4.807 0.087 2 0 "[ . 1 . 2]" 1
983 1 71 ASN H 1 74 LYS QB 0.000 . 5.850 5.127 4.414 5.927 0.077 17 0 "[ . 1 . 2]" 1
984 1 71 ASN H 1 74 LYS QG 0.000 . 6.380 5.106 3.891 6.432 0.052 7 0 "[ . 1 . 2]" 1
985 1 71 ASN HA 1 71 ASN HD22 0.000 . 5.500 4.568 3.836 4.743 . 0 0 "[ . 1 . 2]" 1
986 1 71 ASN HA 1 73 VAL H 0.000 . 4.660 4.656 4.506 4.713 0.053 6 0 "[ . 1 . 2]" 1
987 1 71 ASN HA 1 74 LYS H 0.000 . 4.100 3.828 3.539 4.086 . 0 0 "[ . 1 . 2]" 1
988 1 71 ASN HA 1 74 LYS QB 0.000 . 4.640 3.253 2.322 4.613 . 0 0 "[ . 1 . 2]" 1
989 1 71 ASN HA 1 75 ASP H 0.000 . 4.040 3.783 3.529 4.040 . 0 0 "[ . 1 . 2]" 1
990 1 71 ASN QB 1 72 PHE H 0.000 . 3.970 2.702 2.500 2.961 . 0 0 "[ . 1 . 2]" 1
991 1 71 ASN HB2 1 72 PHE H 0.000 . 4.170 2.773 2.552 3.071 . 0 0 "[ . 1 . 2]" 1
992 1 71 ASN HB3 1 72 PHE H 0.000 . 4.170 3.738 3.578 3.885 . 0 0 "[ . 1 . 2]" 1
993 1 71 ASN QD 1 72 PHE H 0.000 . 6.370 4.796 3.976 5.389 . 0 0 "[ . 1 . 2]" 1
994 1 72 PHE H 1 73 VAL H 0.000 . 3.920 2.498 2.422 2.589 . 0 0 "[ . 1 . 2]" 1
995 1 72 PHE H 1 74 LYS H 0.000 . 4.820 3.919 3.761 4.037 . 0 0 "[ . 1 . 2]" 1
996 1 72 PHE H 1 75 ASP H 0.000 . 4.230 4.380 4.351 4.409 0.179 9 0 "[ . 1 . 2]" 1
997 1 72 PHE H 1 75 ASP QB 0.000 . 4.710 4.725 4.533 4.804 0.094 7 0 "[ . 1 . 2]" 1
998 1 72 PHE HA 1 75 ASP H 0.000 . 4.140 3.495 3.189 3.696 . 0 0 "[ . 1 . 2]" 1
999 1 72 PHE QD 1 73 VAL H 0.000 . 7.620 3.212 2.942 3.500 . 0 0 "[ . 1 . 2]" 1
1000 1 72 PHE QD 1 76 ASN H 0.000 . 7.620 4.690 4.249 5.168 . 0 0 "[ . 1 . 2]" 1
1001 1 72 PHE QD 1 76 ASN HB2 0.000 . 7.620 4.122 3.447 4.889 . 0 0 "[ . 1 . 2]" 1
1002 1 72 PHE QD 1 76 ASN HB3 0.000 . 7.620 4.633 3.325 6.260 . 0 0 "[ . 1 . 2]" 1
1003 1 72 PHE QD 1 78 LEU QD 0.000 . 9.970 2.713 1.946 3.769 . 0 0 "[ . 1 . 2]" 1
1004 1 72 PHE QD 1 98 ILE MD 0.000 . 8.650 4.907 4.160 6.276 . 0 0 "[ . 1 . 2]" 1
1005 1 72 PHE QE 1 78 LEU QD 0.000 . 9.230 2.135 1.841 3.121 . 0 0 "[ . 1 . 2]" 1
1006 1 72 PHE QE 1 78 LEU HG 0.000 . 7.620 4.096 2.806 5.020 . 0 0 "[ . 1 . 2]" 1
1007 1 72 PHE QE 1 98 ILE MD 0.000 . 8.030 3.223 2.353 4.796 . 0 0 "[ . 1 . 2]" 1
1008 1 73 VAL H 1 73 VAL HB 0.000 . 3.580 2.397 2.331 2.450 . 0 0 "[ . 1 . 2]" 1
1009 1 73 VAL H 1 73 VAL MG1 0.000 . 4.390 2.497 2.186 3.779 . 0 0 "[ . 1 . 2]" 1
1010 1 73 VAL H 1 73 VAL MG2 0.000 . 4.390 3.626 2.432 3.785 . 0 0 "[ . 1 . 2]" 1
1011 1 73 VAL H 1 74 LYS H 0.000 . 3.890 2.607 2.459 2.764 . 0 0 "[ . 1 . 2]" 1
1012 1 73 VAL H 1 75 ASP H 0.000 . 4.510 4.065 3.918 4.200 . 0 0 "[ . 1 . 2]" 1
1013 1 73 VAL HA 1 78 LEU QB 0.000 . 6.380 4.229 2.354 5.330 . 0 0 "[ . 1 . 2]" 1
1014 1 73 VAL HA 1 78 LEU MD1 0.000 . 5.570 2.982 1.827 4.781 . 0 0 "[ . 1 . 2]" 1
1015 1 73 VAL HA 1 78 LEU QD 0.000 . 4.800 2.418 1.735 4.076 . 0 0 "[ . 1 . 2]" 1
1016 1 73 VAL HA 1 78 LEU MD2 0.000 . 5.570 3.562 1.737 5.558 . 0 0 "[ . 1 . 2]" 1
1017 1 73 VAL HA 1 78 LEU HG 0.000 . 4.420 3.359 2.115 4.510 0.090 7 0 "[ . 1 . 2]" 1
1018 1 73 VAL HB 1 74 LYS H 0.000 . 3.520 3.606 3.082 3.692 0.172 18 0 "[ . 1 . 2]" 1
1019 1 73 VAL QG 1 74 LYS H 0.000 . 4.870 2.160 1.933 3.308 . 0 0 "[ . 1 . 2]" 1
1020 1 73 VAL QG 1 75 ASP H 0.000 . 8.090 4.204 4.052 4.694 . 0 0 "[ . 1 . 2]" 1
1021 1 73 VAL QG 1 77 ASN H 0.000 . 8.090 4.338 4.152 4.641 . 0 0 "[ . 1 . 2]" 1
1022 1 73 VAL QG 1 78 LEU QB 0.000 . 7.360 3.590 1.867 4.360 . 0 0 "[ . 1 . 2]" 1
1023 1 73 VAL QG 1 78 LEU QD 0.000 . 8.980 2.320 1.844 4.103 . 0 0 "[ . 1 . 2]" 1
1024 1 73 VAL MG1 1 74 LYS H 0.000 . 5.440 2.183 1.941 3.487 . 0 0 "[ . 1 . 2]" 1
1025 1 73 VAL MG2 1 74 LYS H 0.000 . 5.440 3.816 3.621 4.219 . 0 0 "[ . 1 . 2]" 1
1026 1 74 LYS H 1 74 LYS HG2 0.000 . 4.380 3.211 2.241 4.468 0.088 4 0 "[ . 1 . 2]" 1
1027 1 74 LYS H 1 74 LYS QG 0.000 . 4.230 2.760 2.213 3.950 . 0 0 "[ . 1 . 2]" 1
1028 1 74 LYS H 1 74 LYS HG3 0.000 . 4.380 3.537 2.356 4.439 0.059 2 0 "[ . 1 . 2]" 1
1029 1 74 LYS H 1 75 ASP H 0.000 . 3.610 2.697 2.621 2.757 . 0 0 "[ . 1 . 2]" 1
1030 1 74 LYS HA 1 74 LYS HG2 0.000 . 4.100 3.236 2.419 4.212 0.112 11 0 "[ . 1 . 2]" 1
1031 1 74 LYS HA 1 74 LYS QG 0.000 . 3.940 2.901 2.336 3.541 . 0 0 "[ . 1 . 2]" 1
1032 1 74 LYS HA 1 74 LYS HG3 0.000 . 4.100 3.441 2.546 3.855 . 0 0 "[ . 1 . 2]" 1
1033 1 74 LYS HA 1 77 ASN H 0.000 . 4.010 3.677 3.242 3.953 . 0 0 "[ . 1 . 2]" 1
1034 1 74 LYS QB 1 75 ASP H 0.000 . 4.610 2.924 2.421 3.800 . 0 0 "[ . 1 . 2]" 1
1035 1 74 LYS QB 1 76 ASN H 0.000 . 5.760 5.000 4.703 5.448 . 0 0 "[ . 1 . 2]" 1
1036 1 74 LYS QG 1 75 ASP H 0.000 . 6.380 3.726 2.274 4.426 . 0 0 "[ . 1 . 2]" 1
1037 1 75 ASP H 1 75 ASP QB 0.000 . 3.830 2.328 2.274 2.381 . 0 0 "[ . 1 . 2]" 1
1038 1 75 ASP H 1 76 ASN H 0.000 . 3.640 2.614 2.527 2.774 . 0 0 "[ . 1 . 2]" 1
1039 1 75 ASP HA 1 77 ASN H 0.000 . 3.980 4.012 3.897 4.059 0.079 4 0 "[ . 1 . 2]" 1
1040 1 76 ASN H 1 76 ASN HB2 0.000 . 3.950 2.563 2.391 2.753 . 0 0 "[ . 1 . 2]" 1
1041 1 76 ASN H 1 76 ASN HB3 0.000 . 3.950 3.056 2.476 3.701 . 0 0 "[ . 1 . 2]" 1
1042 1 76 ASN H 1 77 ASN H 0.000 . 3.550 2.238 2.101 2.421 . 0 0 "[ . 1 . 2]" 1
1043 1 76 ASN H 1 98 ILE MD 0.000 . 6.530 6.101 4.993 6.575 0.045 1 0 "[ . 1 . 2]" 1
1044 1 76 ASN HA 1 98 ILE MD 0.000 . 6.530 5.418 4.035 6.266 . 0 0 "[ . 1 . 2]" 1
1045 1 76 ASN QB 1 98 ILE MD 0.000 . 4.760 3.637 2.169 4.209 . 0 0 "[ . 1 . 2]" 1
1046 1 76 ASN HB2 1 98 ILE MD 0.000 . 4.980 4.278 3.036 4.987 0.007 20 0 "[ . 1 . 2]" 1
1047 1 76 ASN HB3 1 98 ILE MD 0.000 . 4.980 3.967 2.221 4.695 . 0 0 "[ . 1 . 2]" 1
1048 1 77 ASN H 1 77 ASN HA 0.000 . 2.860 2.226 2.136 2.268 . 0 0 "[ . 1 . 2]" 1
1049 1 77 ASN H 1 77 ASN HB2 0.000 . 3.580 3.135 2.956 3.490 . 0 0 "[ . 1 . 2]" 1
1050 1 77 ASN H 1 77 ASN HB3 0.000 . 3.580 3.601 3.538 3.814 0.234 13 0 "[ . 1 . 2]" 1
1051 1 77 ASN H 1 78 LEU H 0.000 . 3.580 3.397 3.209 3.589 0.009 15 0 "[ . 1 . 2]" 1
1052 1 77 ASN HA 1 78 LEU H 0.000 . 3.240 2.190 2.108 2.268 . 0 0 "[ . 1 . 2]" 1
1053 1 78 LEU H 1 78 LEU HB2 0.000 . 4.140 3.511 2.496 3.955 . 0 0 "[ . 1 . 2]" 1
1054 1 78 LEU H 1 78 LEU QB 0.000 . 3.720 3.024 2.455 3.359 . 0 0 "[ . 1 . 2]" 1
1055 1 78 LEU H 1 78 LEU HB3 0.000 . 4.140 3.527 3.210 3.822 . 0 0 "[ . 1 . 2]" 1
1056 1 78 LEU H 1 78 LEU MD1 0.000 . 5.160 3.252 1.710 4.329 . 0 0 "[ . 1 . 2]" 1
1057 1 78 LEU H 1 78 LEU QD 0.000 . 4.740 2.683 1.704 3.574 . 0 0 "[ . 1 . 2]" 1
1058 1 78 LEU H 1 78 LEU MD2 0.000 . 5.160 3.608 1.790 4.426 . 0 0 "[ . 1 . 2]" 1
1059 1 78 LEU H 1 78 LEU HG 0.000 . 4.260 3.035 2.400 4.306 0.046 6 0 "[ . 1 . 2]" 1
1060 1 78 LEU H 1 79 GLU H 0.000 . 4.380 4.360 4.215 4.429 0.049 13 0 "[ . 1 . 2]" 1
1061 1 78 LEU HA 1 79 GLU H 0.000 . 3.110 2.250 2.006 2.577 . 0 0 "[ . 1 . 2]" 1
1062 1 78 LEU HB2 1 79 GLU H 0.000 . 4.380 2.942 2.050 4.098 . 0 0 "[ . 1 . 2]" 1
1063 1 78 LEU HB3 1 79 GLU H 0.000 . 4.380 3.401 2.196 3.908 . 0 0 "[ . 1 . 2]" 1
1064 1 78 LEU QD 1 79 GLU H 0.000 . 6.050 3.530 3.018 4.233 . 0 0 "[ . 1 . 2]" 1
1065 1 78 LEU QD 1 82 LYS QG 0.000 . 6.530 4.281 2.394 5.746 . 0 0 "[ . 1 . 2]" 1
1066 1 78 LEU QD 1 83 TYR H 0.000 . 8.040 5.245 4.293 6.506 . 0 0 "[ . 1 . 2]" 1
1067 1 78 LEU QD 1 84 LEU QD 0.000 . 6.150 2.326 1.772 3.593 . 0 0 "[ . 1 . 2]" 1
1068 1 78 LEU QD 1 84 LEU HG 0.000 . 6.490 3.880 2.819 5.263 . 0 0 "[ . 1 . 2]" 1
1069 1 78 LEU QD 1 98 ILE HB 0.000 . 7.600 4.147 2.447 5.537 . 0 0 "[ . 1 . 2]" 1
1070 1 78 LEU QD 1 98 ILE MD 0.000 . 5.900 2.631 1.877 4.285 . 0 0 "[ . 1 . 2]" 1
1071 1 78 LEU QD 1 98 ILE QG 0.000 . 8.940 3.322 2.090 4.025 . 0 0 "[ . 1 . 2]" 1
1072 1 78 LEU QD 1 98 ILE MG 0.000 . 7.080 2.910 1.867 4.462 . 0 0 "[ . 1 . 2]" 1
1073 1 78 LEU MD1 1 82 LYS QG 0.000 . 7.400 5.196 2.400 7.192 . 0 0 "[ . 1 . 2]" 1
1074 1 78 LEU MD1 1 84 LEU MD1 0.000 . 7.560 3.661 2.031 6.224 . 0 0 "[ . 1 . 2]" 1
1075 1 78 LEU MD1 1 84 LEU MD2 0.000 . 7.560 3.215 1.925 4.252 . 0 0 "[ . 1 . 2]" 1
1076 1 78 LEU MD1 1 98 ILE MD 0.000 . 6.630 3.884 1.888 6.482 . 0 0 "[ . 1 . 2]" 1
1077 1 78 LEU MD2 1 82 LYS QG 0.000 . 7.400 4.874 3.629 6.042 . 0 0 "[ . 1 . 2]" 1
1078 1 78 LEU MD2 1 84 LEU MD1 0.000 . 7.560 3.790 1.937 6.165 . 0 0 "[ . 1 . 2]" 1
1079 1 78 LEU MD2 1 84 LEU MD2 0.000 . 7.560 3.231 1.980 4.675 . 0 0 "[ . 1 . 2]" 1
1080 1 78 LEU MD2 1 98 ILE MD 0.000 . 6.630 2.896 1.945 4.644 . 0 0 "[ . 1 . 2]" 1
1081 1 79 GLU H 1 79 GLU HB2 0.000 . 4.170 3.606 2.537 3.876 . 0 0 "[ . 1 . 2]" 1
1082 1 79 GLU H 1 79 GLU HB3 0.000 . 4.170 3.358 2.761 3.768 . 0 0 "[ . 1 . 2]" 1
1083 1 79 GLU H 1 80 ASP H 0.000 . 4.760 4.316 4.248 4.420 . 0 0 "[ . 1 . 2]" 1
1084 1 79 GLU H 1 82 LYS QG 0.000 . 6.380 3.754 2.690 4.925 . 0 0 "[ . 1 . 2]" 1
1085 1 79 GLU HA 1 80 ASP H 0.000 . 3.550 2.448 2.257 2.541 . 0 0 "[ . 1 . 2]" 1
1086 1 79 GLU QB 1 82 LYS QG 0.000 . 7.260 5.228 4.114 6.601 . 0 0 "[ . 1 . 2]" 1
1087 1 79 GLU HB2 1 80 ASP H 0.000 . 3.520 2.437 2.088 3.655 0.135 6 0 "[ . 1 . 2]" 1
1088 1 79 GLU HB3 1 80 ASP H 0.000 . 3.520 3.408 2.358 3.638 0.118 3 0 "[ . 1 . 2]" 1
1089 1 79 GLU QG 1 80 ASP H 0.000 . 6.160 3.451 1.977 4.262 . 0 0 "[ . 1 . 2]" 1
1090 1 79 GLU QG 1 82 LYS H 0.000 . 6.380 4.614 3.479 6.382 0.002 9 0 "[ . 1 . 2]" 1
1091 1 79 GLU QG 1 82 LYS QG 0.000 . 7.250 4.182 2.858 6.372 . 0 0 "[ . 1 . 2]" 1
1092 1 81 GLY H 1 82 LYS H 0.000 . 3.980 2.351 2.005 2.715 . 0 0 "[ . 1 . 2]" 1
1093 1 82 LYS HA 1 83 TYR H 0.000 . 3.080 2.412 2.291 2.591 . 0 0 "[ . 1 . 2]" 1
1094 1 82 LYS HA 1 99 TYR QD 0.000 . 7.080 5.575 4.643 6.124 . 0 0 "[ . 1 . 2]" 1
1095 1 82 LYS QB 1 83 TYR H 0.000 . 5.320 2.622 2.341 3.101 . 0 0 "[ . 1 . 2]" 1
1096 1 82 LYS QB 1 99 TYR QD 0.000 . 8.520 5.490 5.111 6.214 . 0 0 "[ . 1 . 2]" 1
1097 1 82 LYS QG 1 83 TYR H 0.000 . 6.380 3.915 3.482 4.320 . 0 0 "[ . 1 . 2]" 1
1098 1 83 TYR H 1 83 TYR HB2 0.000 . 4.100 2.701 2.423 2.876 . 0 0 "[ . 1 . 2]" 1
1099 1 83 TYR H 1 83 TYR HB3 0.000 . 4.100 3.727 2.626 3.861 . 0 0 "[ . 1 . 2]" 1
1100 1 83 TYR H 1 84 LEU H 0.000 . 4.570 4.354 4.224 4.464 . 0 0 "[ . 1 . 2]" 1
1101 1 83 TYR H 1 98 ILE HA 0.000 . 4.510 4.593 4.529 4.654 0.144 15 0 "[ . 1 . 2]" 1
1102 1 83 TYR H 1 98 ILE MG 0.000 . 6.530 4.433 3.165 6.039 . 0 0 "[ . 1 . 2]" 1
1103 1 83 TYR H 1 99 TYR H 0.000 . 4.320 3.086 2.877 3.648 . 0 0 "[ . 1 . 2]" 1
1104 1 83 TYR H 1 99 TYR QB 0.000 . 6.380 2.875 2.103 4.882 . 0 0 "[ . 1 . 2]" 1
1105 1 83 TYR HA 1 99 TYR QE 0.000 . 5.900 5.616 4.912 5.982 0.082 8 0 "[ . 1 . 2]" 1
1106 1 84 LEU H 1 84 LEU HB2 0.000 . 4.070 3.039 2.555 3.871 . 0 0 "[ . 1 . 2]" 1
1107 1 84 LEU H 1 84 LEU QB 0.000 . 3.880 2.789 2.512 3.255 . 0 0 "[ . 1 . 2]" 1
1108 1 84 LEU H 1 84 LEU HB3 0.000 . 4.070 3.623 3.219 3.817 . 0 0 "[ . 1 . 2]" 1
1109 1 84 LEU H 1 84 LEU HG 0.000 . 4.230 3.427 2.277 4.291 0.061 3 0 "[ . 1 . 2]" 1
1110 1 84 LEU H 1 85 GLN H 0.000 . 4.630 4.328 4.261 4.425 . 0 0 "[ . 1 . 2]" 1
1111 1 84 LEU HA 1 85 GLN H 0.000 . 3.300 2.145 2.059 2.222 . 0 0 "[ . 1 . 2]" 1
1112 1 84 LEU HB2 1 85 GLN H 0.000 . 4.140 3.564 2.523 4.145 0.005 10 0 "[ . 1 . 2]" 1
1113 1 84 LEU HB3 1 85 GLN H 0.000 . 4.140 3.230 2.750 3.938 . 0 0 "[ . 1 . 2]" 1
1114 1 84 LEU QD 1 85 GLN H 0.000 . 6.700 3.883 3.376 4.217 . 0 0 "[ . 1 . 2]" 1
1115 1 84 LEU QD 1 98 ILE HA 0.000 . 6.730 3.494 1.962 5.040 . 0 0 "[ . 1 . 2]" 1
1116 1 84 LEU QD 1 98 ILE MD 0.000 . 6.820 3.467 2.369 4.610 . 0 0 "[ . 1 . 2]" 1
1117 1 84 LEU QD 1 98 ILE QG 0.000 . 8.850 3.130 1.823 4.924 . 0 0 "[ . 1 . 2]" 1
1118 1 84 LEU MD1 1 98 ILE MD 0.000 . 7.560 4.497 2.514 6.343 . 0 0 "[ . 1 . 2]" 1
1119 1 84 LEU MD2 1 98 ILE MD 0.000 . 7.560 3.889 2.665 5.884 . 0 0 "[ . 1 . 2]" 1
1120 1 85 GLN H 1 85 GLN QE 0.000 . 6.370 5.284 3.807 6.122 . 0 0 "[ . 1 . 2]" 1
1121 1 85 GLN H 1 97 ILE H 0.000 . 4.200 2.862 2.525 3.203 . 0 0 "[ . 1 . 2]" 1
1122 1 85 GLN H 1 97 ILE HB 0.000 . 5.310 3.595 2.899 5.277 . 0 0 "[ . 1 . 2]" 1
1123 1 85 GLN H 1 97 ILE MD 0.000 . 6.280 5.170 4.275 5.760 . 0 0 "[ . 1 . 2]" 1
1124 1 85 GLN H 1 99 TYR QE 0.000 . 6.670 3.961 3.228 4.929 . 0 0 "[ . 1 . 2]" 1
1125 1 85 GLN HA 1 86 PHE H 0.000 . 3.330 2.145 2.089 2.222 . 0 0 "[ . 1 . 2]" 1
1126 1 85 GLN HA 1 99 TYR QE 0.000 . 6.520 4.283 2.950 5.652 . 0 0 "[ . 1 . 2]" 1
1127 1 85 GLN QB 1 97 ILE H 0.000 . 6.380 3.358 2.642 4.599 . 0 0 "[ . 1 . 2]" 1
1128 1 85 GLN QB 1 97 ILE HB 0.000 . 4.810 2.720 1.912 4.175 . 0 0 "[ . 1 . 2]" 1
1129 1 85 GLN QB 1 97 ILE MG 0.000 . 7.410 3.343 1.720 4.655 . 0 0 "[ . 1 . 2]" 1
1130 1 85 GLN QB 1 99 TYR QD 0.000 . 7.030 4.325 3.027 5.825 . 0 0 "[ . 1 . 2]" 1
1131 1 85 GLN QB 1 99 TYR QE 0.000 . 5.430 2.846 1.842 4.705 . 0 0 "[ . 1 . 2]" 1
1132 1 85 GLN HB2 1 97 ILE HB 0.000 . 5.190 3.594 1.920 5.355 0.165 19 0 "[ . 1 . 2]" 1
1133 1 85 GLN HB2 1 99 TYR QE 0.000 . 5.710 3.281 1.861 5.516 . 0 0 "[ . 1 . 2]" 1
1134 1 85 GLN HB3 1 97 ILE HB 0.000 . 5.190 3.272 2.018 5.295 0.105 17 0 "[ . 1 . 2]" 1
1135 1 85 GLN HB3 1 99 TYR QE 0.000 . 5.710 3.769 2.369 5.714 0.004 20 0 "[ . 1 . 2]" 1
1136 1 85 GLN QE 1 97 ILE MD 0.000 . 6.870 3.874 1.749 6.021 . 0 0 "[ . 1 . 2]" 1
1137 1 85 GLN QG 1 97 ILE HB 0.000 . 6.380 3.543 1.782 6.184 . 0 0 "[ . 1 . 2]" 1
1138 1 85 GLN QG 1 97 ILE MD 0.000 . 7.380 4.011 2.501 5.834 . 0 0 "[ . 1 . 2]" 1
1139 1 85 GLN QG 1 99 TYR QE 0.000 . 6.370 3.324 1.898 4.568 . 0 0 "[ . 1 . 2]" 1
1140 1 86 PHE H 1 86 PHE HB2 0.000 . 4.070 2.550 2.507 2.602 . 0 0 "[ . 1 . 2]" 1
1141 1 86 PHE H 1 86 PHE HB3 0.000 . 4.070 3.701 3.679 3.735 . 0 0 "[ . 1 . 2]" 1
1142 1 86 PHE QB 1 94 PHE QD 0.000 . 6.970 2.792 2.016 4.451 . 0 0 "[ . 1 . 2]" 1
1143 1 86 PHE HB2 1 94 PHE QD 0.000 . 7.620 4.107 3.262 5.790 . 0 0 "[ . 1 . 2]" 1
1144 1 86 PHE HB3 1 94 PHE QD 0.000 . 7.620 2.852 2.026 4.626 . 0 0 "[ . 1 . 2]" 1
1145 1 86 PHE QD 1 94 PHE H 0.000 . 6.910 6.062 5.578 6.909 . 0 0 "[ . 1 . 2]" 1
1146 1 86 PHE QD 1 94 PHE QD 0.000 . 8.780 3.610 2.861 4.759 . 0 0 "[ . 1 . 2]" 1
1147 1 86 PHE QD 1 95 TYR QB 0.000 . 7.320 5.885 5.137 6.530 . 0 0 "[ . 1 . 2]" 1
1148 1 86 PHE QD 1 96 VAL QG 0.000 . 8.190 2.491 1.914 3.476 . 0 0 "[ . 1 . 2]" 1
1149 1 86 PHE QE 1 96 VAL HB 0.000 . 7.620 4.225 2.534 5.578 . 0 0 "[ . 1 . 2]" 1
1150 1 87 ILE H 1 87 ILE HB 0.000 . 3.670 2.623 2.474 3.669 . 0 0 "[ . 1 . 2]" 1
1151 1 87 ILE H 1 87 ILE MD 0.000 . 4.670 3.602 2.264 3.989 . 0 0 "[ . 1 . 2]" 1
1152 1 87 ILE H 1 87 ILE HG12 0.000 . 4.760 3.657 2.034 4.238 . 0 0 "[ . 1 . 2]" 1
1153 1 87 ILE H 1 87 ILE QG 0.000 . 4.550 2.596 1.994 3.608 . 0 0 "[ . 1 . 2]" 1
1154 1 87 ILE H 1 87 ILE HG13 0.000 . 4.760 2.715 2.271 3.923 . 0 0 "[ . 1 . 2]" 1
1155 1 87 ILE H 1 95 TYR HB2 0.000 . 5.070 3.304 2.792 5.068 . 0 0 "[ . 1 . 2]" 1
1156 1 87 ILE H 1 95 TYR QB 0.000 . 4.800 3.161 2.747 3.558 . 0 0 "[ . 1 . 2]" 1
1157 1 87 ILE H 1 95 TYR HB3 0.000 . 5.070 4.442 3.634 4.778 . 0 0 "[ . 1 . 2]" 1
1158 1 87 ILE H 1 96 VAL HA 0.000 . 4.320 3.557 3.168 3.838 . 0 0 "[ . 1 . 2]" 1
1159 1 87 ILE HB 1 95 TYR H 0.000 . 5.040 3.170 2.519 5.121 0.081 4 0 "[ . 1 . 2]" 1
1160 1 87 ILE HB 1 95 TYR HB2 0.000 . 4.720 2.163 1.819 3.882 . 0 0 "[ . 1 . 2]" 1
1161 1 87 ILE HB 1 95 TYR HB3 0.000 . 4.720 3.595 1.933 4.770 0.050 4 0 "[ . 1 . 2]" 1
1162 1 87 ILE HB 1 95 TYR QD 0.000 . 6.930 2.783 1.975 4.917 . 0 0 "[ . 1 . 2]" 1
1163 1 87 ILE MD 1 95 TYR HB2 0.000 . 6.530 3.003 2.162 4.839 . 0 0 "[ . 1 . 2]" 1
1164 1 87 ILE MD 1 95 TYR QB 0.000 . 6.100 2.778 2.098 3.379 . 0 0 "[ . 1 . 2]" 1
1165 1 87 ILE MD 1 95 TYR HB3 0.000 . 6.530 3.490 2.631 4.054 . 0 0 "[ . 1 . 2]" 1
1166 1 87 ILE MG 1 88 TYR H 0.000 . 4.360 2.905 2.710 3.753 . 0 0 "[ . 1 . 2]" 1
1167 1 87 ILE MG 1 95 TYR HB2 0.000 . 5.570 3.521 3.046 4.552 . 0 0 "[ . 1 . 2]" 1
1168 1 87 ILE MG 1 95 TYR QB 0.000 . 5.380 3.371 2.819 4.154 . 0 0 "[ . 1 . 2]" 1
1169 1 87 ILE MG 1 95 TYR HB3 0.000 . 5.570 4.608 2.885 5.063 . 0 0 "[ . 1 . 2]" 1
1170 1 87 ILE MG 1 95 TYR QD 0.000 . 7.180 3.056 2.348 5.578 . 0 0 "[ . 1 . 2]" 1
1171 1 87 ILE MG 1 95 TYR QE 0.000 . 7.050 4.256 3.384 6.992 . 0 0 "[ . 1 . 2]" 1
1172 1 88 TYR H 1 89 ASP H 0.000 . 4.480 4.370 4.255 4.494 0.014 1 0 "[ . 1 . 2]" 1
1173 1 88 TYR HA 1 94 PHE HA 0.000 . 3.860 3.042 2.604 3.555 . 0 0 "[ . 1 . 2]" 1
1174 1 88 TYR HA 1 95 TYR H 0.000 . 4.320 3.833 3.222 4.398 0.078 5 0 "[ . 1 . 2]" 1
1175 1 88 TYR QB 1 89 ASP H 0.000 . 4.260 3.403 2.513 3.846 . 0 0 "[ . 1 . 2]" 1
1176 1 88 TYR HB2 1 89 ASP H 0.000 . 4.630 3.929 2.547 4.341 . 0 0 "[ . 1 . 2]" 1
1177 1 88 TYR HB3 1 89 ASP H 0.000 . 4.630 3.899 2.933 4.340 . 0 0 "[ . 1 . 2]" 1
1178 1 89 ASP H 1 93 THR H 0.000 . 4.720 4.534 3.770 4.898 0.178 5 0 "[ . 1 . 2]" 1
1179 1 89 ASP H 1 94 PHE HA 0.000 . 5.070 4.218 3.493 5.066 . 0 0 "[ . 1 . 2]" 1
1180 1 90 ARG HA 1 90 ARG QD 0.000 . 3.930 2.554 1.987 3.970 0.040 13 0 "[ . 1 . 2]" 1
1181 1 90 ARG QD 1 91 ASP H 0.000 . 6.130 4.779 4.016 5.573 . 0 0 "[ . 1 . 2]" 1
1182 1 90 ARG QG 1 91 ASP H 0.000 . 6.380 4.571 3.740 5.009 . 0 0 "[ . 1 . 2]" 1
1183 1 91 ASP H 1 91 ASP HB2 0.000 . 3.550 3.094 2.368 3.529 . 0 0 "[ . 1 . 2]" 1
1184 1 91 ASP H 1 91 ASP HB3 0.000 . 3.550 2.847 2.346 3.580 0.030 10 0 "[ . 1 . 2]" 1
1185 1 91 ASP H 1 92 ARG H 0.000 . 3.950 4.063 4.011 4.122 0.172 14 0 "[ . 1 . 2]" 1
1186 1 91 ASP H 1 93 THR H 0.000 . 4.100 3.753 3.313 4.118 0.018 17 0 "[ . 1 . 2]" 1
1187 1 91 ASP QB 1 92 ARG H 0.000 . 3.660 2.542 1.628 2.911 . 0 0 "[ . 1 . 2]" 1
1188 1 91 ASP HB2 1 92 ARG H 0.000 . 3.830 3.418 1.815 3.628 . 0 0 "[ . 1 . 2]" 1
1189 1 91 ASP HB2 1 93 THR H 0.000 . 4.230 4.111 3.362 4.344 0.114 1 0 "[ . 1 . 2]" 1
1190 1 91 ASP HB3 1 92 ARG H 0.000 . 3.830 2.702 1.637 3.359 . 0 0 "[ . 1 . 2]" 1
1191 1 91 ASP HB3 1 93 THR H 0.000 . 4.230 2.691 2.248 4.366 0.136 7 0 "[ . 1 . 2]" 1
1192 1 92 ARG H 1 93 THR H 0.000 . 3.670 2.578 2.245 2.981 . 0 0 "[ . 1 . 2]" 1
1193 1 92 ARG HB2 1 92 ARG HE 0.000 . 5.500 3.374 1.927 4.635 . 0 0 "[ . 1 . 2]" 1
1194 1 92 ARG HB3 1 92 ARG HE 0.000 . 5.500 3.965 2.186 4.652 . 0 0 "[ . 1 . 2]" 1
1195 1 92 ARG QG 1 93 THR H 0.000 . 6.380 4.566 3.299 5.070 . 0 0 "[ . 1 . 2]" 1
1196 1 93 THR H 1 93 THR HB 0.000 . 3.790 2.944 2.434 3.692 . 0 0 "[ . 1 . 2]" 1
1197 1 93 THR HA 1 94 PHE H 0.000 . 3.240 2.179 2.120 2.258 . 0 0 "[ . 1 . 2]" 1
1198 1 93 THR HB 1 94 PHE H 0.000 . 4.570 4.009 3.056 4.333 . 0 0 "[ . 1 . 2]" 1
1199 1 93 THR MG 1 94 PHE H 0.000 . 4.420 3.301 2.646 3.950 . 0 0 "[ . 1 . 2]" 1
1200 1 94 PHE HA 1 95 TYR H 0.000 . 3.080 2.173 2.094 2.254 . 0 0 "[ . 1 . 2]" 1
1201 1 94 PHE QB 1 95 TYR H 0.000 . 4.000 3.002 2.457 3.354 . 0 0 "[ . 1 . 2]" 1
1202 1 94 PHE QB 1 96 VAL H 0.000 . 4.920 4.729 4.437 4.975 0.055 20 0 "[ . 1 . 2]" 1
1203 1 94 PHE HB2 1 95 TYR H 0.000 . 4.320 4.068 3.634 4.307 . 0 0 "[ . 1 . 2]" 1
1204 1 94 PHE HB3 1 95 TYR H 0.000 . 4.320 3.094 2.499 3.499 . 0 0 "[ . 1 . 2]" 1
1205 1 94 PHE QD 1 95 TYR H 0.000 . 6.070 4.196 3.704 4.756 . 0 0 "[ . 1 . 2]" 1
1206 1 95 TYR H 1 96 VAL H 0.000 . 4.540 4.377 4.253 4.477 . 0 0 "[ . 1 . 2]" 1
1207 1 95 TYR HA 1 96 VAL H 0.000 . 3.140 2.183 2.125 2.257 . 0 0 "[ . 1 . 2]" 1
1208 1 95 TYR HA 1 96 VAL QG 0.000 . 7.560 3.444 3.181 3.726 . 0 0 "[ . 1 . 2]" 1
1209 1 95 TYR HB2 1 96 VAL H 0.000 . 4.320 4.198 4.090 4.320 0.000 19 0 "[ . 1 . 2]" 1
1210 1 95 TYR HB3 1 96 VAL H 0.000 . 4.320 3.442 3.110 4.223 . 0 0 "[ . 1 . 2]" 1
1211 1 95 TYR QD 1 96 VAL H 0.000 . 7.330 4.338 3.525 4.657 . 0 0 "[ . 1 . 2]" 1
1212 1 95 TYR QE 1 96 VAL H 0.000 . 7.630 6.303 4.517 6.646 . 0 0 "[ . 1 . 2]" 1
1213 1 96 VAL H 1 96 VAL HB 0.000 . 3.670 2.836 2.575 3.705 0.035 19 0 "[ . 1 . 2]" 1
1214 1 96 VAL H 1 97 ILE H 0.000 . 4.790 4.383 4.277 4.463 . 0 0 "[ . 1 . 2]" 1
1215 1 96 VAL HA 1 97 ILE H 0.000 . 3.450 2.120 2.084 2.188 . 0 0 "[ . 1 . 2]" 1
1216 1 96 VAL HB 1 97 ILE H 0.000 . 4.420 4.004 2.709 4.250 . 0 0 "[ . 1 . 2]" 1
1217 1 96 VAL QG 1 97 ILE H 0.000 . 6.380 2.731 2.442 3.389 . 0 0 "[ . 1 . 2]" 1
1218 1 97 ILE H 1 97 ILE HB 0.000 . 3.670 2.716 2.526 3.354 . 0 0 "[ . 1 . 2]" 1
1219 1 97 ILE H 1 97 ILE MD 0.000 . 5.290 3.930 2.375 4.839 . 0 0 "[ . 1 . 2]" 1
1220 1 97 ILE H 1 97 ILE HG12 0.000 . 5.500 3.876 2.654 4.498 . 0 0 "[ . 1 . 2]" 1
1221 1 97 ILE H 1 97 ILE QG 0.000 . 5.110 3.042 2.578 4.118 . 0 0 "[ . 1 . 2]" 1
1222 1 97 ILE H 1 97 ILE HG13 0.000 . 5.500 3.405 2.624 4.775 . 0 0 "[ . 1 . 2]" 1
1223 1 97 ILE HA 1 98 ILE H 0.000 . 3.080 2.163 2.085 2.263 . 0 0 "[ . 1 . 2]" 1
1224 1 97 ILE MD 1 98 ILE H 0.000 . 6.530 4.807 3.696 5.278 . 0 0 "[ . 1 . 2]" 1
1225 1 97 ILE MG 1 98 ILE H 0.000 . 5.100 2.973 2.419 4.093 . 0 0 "[ . 1 . 2]" 1
1226 1 98 ILE H 1 98 ILE HB 0.000 . 3.390 2.854 2.487 3.546 0.156 13 0 "[ . 1 . 2]" 1
1227 1 98 ILE H 1 98 ILE MD 0.000 . 5.410 3.510 1.991 4.654 . 0 0 "[ . 1 . 2]" 1
1228 1 98 ILE HB 1 98 ILE MD 0.000 . 3.610 2.445 2.401 2.476 . 0 0 "[ . 1 . 2]" 1
1229 1 98 ILE HB 1 99 TYR H 0.000 . 4.720 3.894 2.935 4.304 . 0 0 "[ . 1 . 2]" 1
1230 1 98 ILE MG 1 99 TYR H 0.000 . 6.250 3.183 2.412 4.037 . 0 0 "[ . 1 . 2]" 1
1231 1 99 TYR QD 1 100 GLY H 0.000 . 6.900 4.045 3.257 4.521 . 0 0 "[ . 1 . 2]" 1
1232 1 102 ASN HA 1 103 MET H 0.000 . 3.580 2.472 2.037 3.553 . 0 0 "[ . 1 . 2]" 1
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