NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606122 |
5iaz   |
30020 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5iaz
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 12
_Distance_constraint_stats_list.Viol_count 100
_Distance_constraint_stats_list.Viol_total 48.411
_Distance_constraint_stats_list.Viol_max 0.025
_Distance_constraint_stats_list.Viol_rms 0.0092
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0065
_Distance_constraint_stats_list.Viol_average_violations_only 0.0194
_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 11 CYS 0.476 0.022 25 0 "[ . 1 . 2 .]"
1 43 CYS 0.466 0.023 9 0 "[ . 1 . 2 .]"
1 64 CYS 0.476 0.022 25 0 "[ . 1 . 2 .]"
1 72 CYS 0.470 0.022 8 0 "[ . 1 . 2 .]"
1 85 CYS 0.525 0.025 15 0 "[ . 1 . 2 .]"
1 91 CYS 0.525 0.025 15 0 "[ . 1 . 2 .]"
1 105 CYS 0.470 0.022 8 0 "[ . 1 . 2 .]"
1 118 CYS 0.466 0.023 9 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 11 CYS SG 1 64 CYS SG 0.000 . 2.000 2.019 2.016 2.022 0.022 25 0 "[ . 1 . 2 .]" 1
2 1 11 CYS CB 1 64 CYS SG 0.000 . 3.100 3.021 3.006 3.028 . 0 0 "[ . 1 . 2 .]" 1
3 1 11 CYS SG 1 64 CYS CB 0.000 . 3.100 3.026 3.016 3.035 . 0 0 "[ . 1 . 2 .]" 1
4 1 43 CYS SG 1 118 CYS SG 0.000 . 2.000 2.019 2.015 2.023 0.023 9 0 "[ . 1 . 2 .]" 1
5 1 43 CYS CB 1 118 CYS SG 0.000 . 3.100 3.023 3.006 3.035 . 0 0 "[ . 1 . 2 .]" 1
6 1 43 CYS SG 1 118 CYS CB 0.000 . 3.100 3.022 3.012 3.031 . 0 0 "[ . 1 . 2 .]" 1
7 1 72 CYS SG 1 105 CYS SG 0.000 . 2.000 2.019 2.014 2.022 0.022 8 0 "[ . 1 . 2 .]" 1
8 1 72 CYS CB 1 105 CYS SG 0.000 . 3.100 3.022 2.999 3.033 . 0 0 "[ . 1 . 2 .]" 1
9 1 72 CYS SG 1 105 CYS CB 0.000 . 3.100 3.022 2.999 3.035 . 0 0 "[ . 1 . 2 .]" 1
10 1 85 CYS SG 1 91 CYS SG 0.000 . 2.000 2.021 2.016 2.025 0.025 15 0 "[ . 1 . 2 .]" 1
11 1 85 CYS CB 1 91 CYS SG 0.000 . 3.100 3.029 3.014 3.044 . 0 0 "[ . 1 . 2 .]" 1
12 1 85 CYS SG 1 91 CYS CB 0.000 . 3.100 3.026 3.013 3.036 . 0 0 "[ . 1 . 2 .]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 1705
_Distance_constraint_stats_list.Viol_count 929
_Distance_constraint_stats_list.Viol_total 891.286
_Distance_constraint_stats_list.Viol_max 0.309
_Distance_constraint_stats_list.Viol_rms 0.0080
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0384
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 5 ARG 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 6 THR 0.619 0.134 25 0 "[ . 1 . 2 .]"
1 7 VAL 0.343 0.134 25 0 "[ . 1 . 2 .]"
1 8 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 9 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 10 VAL 1.173 0.099 20 0 "[ . 1 . 2 .]"
1 11 CYS 0.729 0.153 23 0 "[ . 1 . 2 .]"
1 12 ALA 0.073 0.046 23 0 "[ . 1 . 2 .]"
1 13 ASP 0.212 0.061 16 0 "[ . 1 . 2 .]"
1 14 VAL 0.556 0.153 21 0 "[ . 1 . 2 .]"
1 15 SER 0.130 0.057 17 0 "[ . 1 . 2 .]"
1 16 GLU 0.349 0.109 22 0 "[ . 1 . 2 .]"
1 17 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 18 HIS 0.129 0.035 7 0 "[ . 1 . 2 .]"
1 19 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 20 ASN 0.043 0.031 20 0 "[ . 1 . 2 .]"
1 21 ILE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 22 LYS 0.278 0.094 19 0 "[ . 1 . 2 .]"
1 23 ASN 0.551 0.190 19 0 "[ . 1 . 2 .]"
1 24 TRP 1.342 0.190 19 0 "[ . 1 . 2 .]"
1 25 GLN 0.463 0.123 24 0 "[ . 1 . 2 .]"
1 26 ILE 0.562 0.159 13 0 "[ . 1 . 2 .]"
1 27 GLU 0.559 0.159 13 0 "[ . 1 . 2 .]"
1 28 SER 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 29 TYR 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 30 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 31 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 32 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 33 GLU 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 34 PHE 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 35 HIS 0.171 0.078 20 0 "[ . 1 . 2 .]"
1 36 THR 0.113 0.078 20 0 "[ . 1 . 2 .]"
1 37 ALA 0.835 0.091 14 0 "[ . 1 . 2 .]"
1 38 LYS 0.764 0.091 14 0 "[ . 1 . 2 .]"
1 39 VAL 0.320 0.153 21 0 "[ . 1 . 2 .]"
1 40 HIS 0.391 0.103 8 0 "[ . 1 . 2 .]"
1 41 LEU 0.149 0.083 24 0 "[ . 1 . 2 .]"
1 42 LYS 0.545 0.104 16 0 "[ . 1 . 2 .]"
1 43 CYS 1.461 0.150 15 0 "[ . 1 . 2 .]"
1 44 ALA 0.663 0.150 15 0 "[ . 1 . 2 .]"
1 45 PRO 0.056 0.027 5 0 "[ . 1 . 2 .]"
1 46 GLY 0.030 0.030 7 0 "[ . 1 . 2 .]"
1 47 GLN 0.379 0.052 12 0 "[ . 1 . 2 .]"
1 48 THR 1.483 0.108 17 0 "[ . 1 . 2 .]"
1 49 ILE 1.277 0.145 17 0 "[ . 1 . 2 .]"
1 50 SER 0.094 0.038 21 0 "[ . 1 . 2 .]"
1 51 ALA 1.453 0.113 23 0 "[ . 1 . 2 .]"
1 52 ILE 1.444 0.097 25 0 "[ . 1 . 2 .]"
1 53 LYS 0.278 0.056 22 0 "[ . 1 . 2 .]"
1 54 PHE 1.404 0.126 15 0 "[ . 1 . 2 .]"
1 55 ALA 0.219 0.120 12 0 "[ . 1 . 2 .]"
1 56 SER 0.841 0.120 12 0 "[ . 1 . 2 .]"
1 57 PHE 1.615 0.180 4 0 "[ . 1 . 2 .]"
1 58 GLY 1.078 0.203 25 0 "[ . 1 . 2 .]"
1 59 THR 0.519 0.080 25 0 "[ . 1 . 2 .]"
1 60 PRO 0.179 0.059 15 0 "[ . 1 . 2 .]"
1 61 LEU 0.303 0.059 15 0 "[ . 1 . 2 .]"
1 62 GLY 0.058 0.029 9 0 "[ . 1 . 2 .]"
1 63 THR 0.249 0.043 9 0 "[ . 1 . 2 .]"
1 64 CYS 0.284 0.096 16 0 "[ . 1 . 2 .]"
1 65 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 66 THR 0.702 0.096 16 0 "[ . 1 . 2 .]"
1 67 PHE 0.832 0.068 17 0 "[ . 1 . 2 .]"
1 68 GLN 0.316 0.105 23 0 "[ . 1 . 2 .]"
1 69 GLN 0.554 0.134 22 0 "[ . 1 . 2 .]"
1 70 GLY 0.455 0.134 22 0 "[ . 1 . 2 .]"
1 71 GLU 0.058 0.045 7 0 "[ . 1 . 2 .]"
1 72 CYS 0.625 0.088 12 0 "[ . 1 . 2 .]"
1 73 HIS 3.963 0.309 23 0 "[ . 1 . 2 .]"
1 74 SER 0.576 0.100 12 0 "[ . 1 . 2 .]"
1 75 ILE 0.329 0.066 4 0 "[ . 1 . 2 .]"
1 76 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 77 SER 5.830 0.309 23 0 "[ . 1 . 2 .]"
1 78 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 79 SER 0.845 0.117 11 0 "[ . 1 . 2 .]"
1 80 VAL 0.732 0.071 2 0 "[ . 1 . 2 .]"
1 81 LEU 0.757 0.094 24 0 "[ . 1 . 2 .]"
1 82 GLU 1.723 0.117 11 0 "[ . 1 . 2 .]"
1 83 ARG 0.312 0.079 10 0 "[ . 1 . 2 .]"
1 84 LYS 0.225 0.057 23 0 "[ . 1 . 2 .]"
1 85 CYS 0.764 0.067 8 0 "[ . 1 . 2 .]"
1 86 ILE 0.667 0.122 3 0 "[ . 1 . 2 .]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 88 LEU 0.801 0.108 17 0 "[ . 1 . 2 .]"
1 89 GLU 1.080 0.091 14 0 "[ . 1 . 2 .]"
1 90 ARG 1.410 0.104 16 0 "[ . 1 . 2 .]"
1 91 CYS 1.100 0.143 11 0 "[ . 1 . 2 .]"
1 92 VAL 0.286 0.057 22 0 "[ . 1 . 2 .]"
1 93 VAL 0.370 0.103 8 0 "[ . 1 . 2 .]"
1 94 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 95 ILE 0.112 0.085 16 0 "[ . 1 . 2 .]"
1 96 SER 0.830 0.085 16 0 "[ . 1 . 2 .]"
1 97 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 98 SER 0.244 0.070 24 0 "[ . 1 . 2 .]"
1 99 ASN 0.061 0.028 6 0 "[ . 1 . 2 .]"
1 100 PHE 1.028 0.083 5 0 "[ . 1 . 2 .]"
1 101 GLY 0.034 0.021 9 0 "[ . 1 . 2 .]"
1 102 GLY 0.278 0.070 24 0 "[ . 1 . 2 .]"
1 103 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 104 PRO 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 105 CYS 0.311 0.078 13 0 "[ . 1 . 2 .]"
1 106 PRO 0.660 0.145 10 0 "[ . 1 . 2 .]"
1 107 GLU 0.928 0.252 8 0 "[ . 1 . 2 .]"
1 108 VAL 1.134 0.099 18 0 "[ . 1 . 2 .]"
1 109 MET 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 110 LYS 0.705 0.203 25 0 "[ . 1 . 2 .]"
1 111 ARG 0.211 0.057 17 0 "[ . 1 . 2 .]"
1 112 VAL 0.665 0.109 22 0 "[ . 1 . 2 .]"
1 113 ALA 0.715 0.120 10 0 "[ . 1 . 2 .]"
1 114 VAL 0.673 0.126 15 0 "[ . 1 . 2 .]"
1 115 GLU 0.458 0.099 20 0 "[ . 1 . 2 .]"
1 116 ALA 0.813 0.153 23 0 "[ . 1 . 2 .]"
1 117 VAL 1.044 0.082 24 0 "[ . 1 . 2 .]"
1 118 CYS 0.999 0.113 23 0 "[ . 1 . 2 .]"
1 119 SER 1.133 0.145 17 0 "[ . 1 . 2 .]"
1 120 THR 0.766 0.229 20 0 "[ . 1 . 2 .]"
1 121 ALA 0.912 0.229 20 0 "[ . 1 . 2 .]"
1 122 ALA 0.102 0.044 13 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 6 THR HA 1 6 THR HB 0.000 . 3.000 2.911 2.406 3.032 0.032 8 0 "[ . 1 . 2 .]" 2
2 1 10 VAL HA 1 10 VAL HB 0.000 . 3.000 2.875 2.476 3.036 0.036 11 0 "[ . 1 . 2 .]" 2
3 1 10 VAL H 1 10 VAL HB 0.000 . 4.000 2.996 2.407 3.844 . 0 0 "[ . 1 . 2 .]" 2
4 1 10 VAL H 1 10 VAL QG 0.000 . 4.200 2.372 1.794 2.935 . 0 0 "[ . 1 . 2 .]" 2
5 1 14 VAL H 1 14 VAL HB 0.000 . 4.000 2.741 2.453 3.758 . 0 0 "[ . 1 . 2 .]" 2
6 1 15 SER H 1 15 SER QB 0.000 . 3.600 2.423 2.063 2.896 . 0 0 "[ . 1 . 2 .]" 2
7 1 17 TYR H 1 17 TYR QB 0.000 . 3.600 2.518 1.941 3.233 . 0 0 "[ . 1 . 2 .]" 2
8 1 21 ILE H 1 21 ILE HB 0.000 . 4.000 2.933 2.306 3.831 . 0 0 "[ . 1 . 2 .]" 2
9 1 24 TRP HA 1 24 TRP HD1 0.000 . 5.000 3.424 1.854 4.612 . 0 0 "[ . 1 . 2 .]" 2
10 1 24 TRP H 1 24 TRP HD1 0.000 . 6.000 3.834 1.841 5.560 . 0 0 "[ . 1 . 2 .]" 2
11 1 24 TRP H 1 24 TRP HE3 0.000 . 6.000 4.679 1.904 6.060 0.060 17 0 "[ . 1 . 2 .]" 2
12 1 25 GLN H 1 25 GLN HA 0.000 . 3.000 2.845 2.355 3.004 0.004 16 0 "[ . 1 . 2 .]" 2
13 1 26 ILE H 1 26 ILE HB 0.000 . 4.000 2.805 2.180 3.800 . 0 0 "[ . 1 . 2 .]" 2
14 1 31 GLU H 1 31 GLU QG 0.000 . 5.000 3.632 1.873 4.371 . 0 0 "[ . 1 . 2 .]" 2
15 1 33 GLU H 1 33 GLU QB 0.000 . 3.600 2.487 1.952 3.297 . 0 0 "[ . 1 . 2 .]" 2
16 1 34 PHE H 1 34 PHE QB 0.000 . 3.600 2.563 1.949 3.256 . 0 0 "[ . 1 . 2 .]" 2
17 1 38 LYS H 1 38 LYS QB 0.000 . 3.600 2.444 2.184 2.658 . 0 0 "[ . 1 . 2 .]" 2
18 1 38 LYS H 1 38 LYS QE 0.000 . 7.000 5.202 3.731 5.879 . 0 0 "[ . 1 . 2 .]" 2
19 1 39 VAL H 1 39 VAL HB 0.000 . 3.000 2.404 2.239 2.621 . 0 0 "[ . 1 . 2 .]" 2
20 1 40 HIS HA 1 40 HIS HD2 0.000 . 5.000 2.862 1.905 4.840 . 0 0 "[ . 1 . 2 .]" 2
21 1 40 HIS H 1 40 HIS QB 0.000 . 3.600 2.375 2.156 3.077 . 0 0 "[ . 1 . 2 .]" 2
22 1 40 HIS H 1 40 HIS HD2 0.000 . 6.000 5.010 4.420 5.521 . 0 0 "[ . 1 . 2 .]" 2
23 1 41 LEU HA 1 41 LEU HG 0.000 . 4.000 2.556 2.083 3.229 . 0 0 "[ . 1 . 2 .]" 2
24 1 41 LEU H 1 41 LEU HG 0.000 . 4.000 3.211 2.220 3.776 . 0 0 "[ . 1 . 2 .]" 2
25 1 42 LYS H 1 42 LYS QE 0.000 . 7.000 4.690 3.505 6.179 . 0 0 "[ . 1 . 2 .]" 2
26 1 44 ALA H 1 44 ALA MB 0.000 . 3.600 2.027 1.914 2.158 . 0 0 "[ . 1 . 2 .]" 2
27 1 47 GLN H 1 47 GLN HA 0.000 . 3.000 2.979 2.937 3.001 0.001 14 0 "[ . 1 . 2 .]" 2
28 1 47 GLN H 1 47 GLN QG 0.000 . 5.000 2.961 1.876 3.726 . 0 0 "[ . 1 . 2 .]" 2
29 1 48 THR HA 1 48 THR HB 0.000 . 3.000 2.522 2.407 2.701 . 0 0 "[ . 1 . 2 .]" 2
30 1 49 ILE H 1 49 ILE HB 0.000 . 4.000 2.403 2.212 2.573 . 0 0 "[ . 1 . 2 .]" 2
31 1 49 ILE H 1 49 ILE MD 0.000 . 4.500 2.816 1.864 3.439 . 0 0 "[ . 1 . 2 .]" 2
32 1 49 ILE H 1 49 ILE QG 0.000 . 4.000 2.135 1.848 2.775 . 0 0 "[ . 1 . 2 .]" 2
33 1 52 ILE H 1 52 ILE HB 0.000 . 3.000 2.452 2.066 2.603 . 0 0 "[ . 1 . 2 .]" 2
34 1 52 ILE H 1 52 ILE QG 0.000 . 5.000 2.379 1.863 3.672 . 0 0 "[ . 1 . 2 .]" 2
35 1 59 THR H 1 59 THR HG1 0.000 . 5.000 2.902 1.875 3.653 . 0 0 "[ . 1 . 2 .]" 2
36 1 61 LEU HA 1 61 LEU MD2 0.000 . 4.500 2.437 1.859 3.600 . 0 0 "[ . 1 . 2 .]" 2
37 1 61 LEU H 1 61 LEU QB 0.000 . 3.600 2.416 2.068 3.061 . 0 0 "[ . 1 . 2 .]" 2
38 1 61 LEU H 1 61 LEU MD2 0.000 . 5.500 4.161 1.871 4.617 . 0 0 "[ . 1 . 2 .]" 2
39 1 63 THR HA 1 63 THR HB 0.000 . 3.000 2.674 2.401 3.029 0.029 9 0 "[ . 1 . 2 .]" 2
40 1 63 THR H 1 63 THR HB 0.000 . 4.000 3.347 2.426 3.783 . 0 0 "[ . 1 . 2 .]" 2
41 1 63 THR H 1 63 THR MG 0.000 . 4.500 3.087 2.073 3.832 . 0 0 "[ . 1 . 2 .]" 2
42 1 66 THR H 1 66 THR HA 0.000 . 3.000 2.981 2.940 3.002 0.002 24 0 "[ . 1 . 2 .]" 2
43 1 66 THR H 1 66 THR MG 0.000 . 4.500 3.320 1.888 3.971 . 0 0 "[ . 1 . 2 .]" 2
44 1 67 PHE H 1 67 PHE QB 0.000 . 3.600 2.085 1.966 2.370 . 0 0 "[ . 1 . 2 .]" 2
45 1 69 GLN H 1 69 GLN HA 0.000 . 3.000 2.869 2.745 2.994 . 0 0 "[ . 1 . 2 .]" 2
46 1 69 GLN H 1 69 GLN QB 0.000 . 3.100 2.222 1.915 2.549 . 0 0 "[ . 1 . 2 .]" 2
47 1 71 GLU H 1 71 GLU HA 0.000 . 3.000 2.973 2.860 3.005 0.005 7 0 "[ . 1 . 2 .]" 2
48 1 71 GLU H 1 71 GLU QB 0.000 . 3.600 2.434 2.032 3.333 . 0 0 "[ . 1 . 2 .]" 2
49 1 72 CYS H 1 72 CYS HA 0.000 . 3.000 2.988 2.938 3.005 0.005 10 0 "[ . 1 . 2 .]" 2
50 1 72 CYS H 1 72 CYS QB 0.000 . 3.600 2.271 2.032 2.538 . 0 0 "[ . 1 . 2 .]" 2
51 1 74 SER H 1 74 SER QB 0.000 . 3.600 2.329 2.066 2.832 . 0 0 "[ . 1 . 2 .]" 2
52 1 75 ILE HA 1 75 ILE HB 0.000 . 3.000 2.849 2.305 3.031 0.031 21 0 "[ . 1 . 2 .]" 2
53 1 77 SER H 1 77 SER HA 0.000 . 3.000 2.881 2.695 2.983 . 0 0 "[ . 1 . 2 .]" 2
54 1 77 SER H 1 77 SER HG 0.000 . 3.000 2.535 1.864 3.032 0.032 7 0 "[ . 1 . 2 .]" 2
55 1 78 ASN H 1 78 ASN QB 0.000 . 3.600 2.314 1.954 2.789 . 0 0 "[ . 1 . 2 .]" 2
56 1 79 SER H 1 79 SER HA 0.000 . 3.000 2.916 2.808 2.968 . 0 0 "[ . 1 . 2 .]" 2
57 1 79 SER H 1 79 SER QB 0.000 . 3.100 2.245 1.933 2.763 . 0 0 "[ . 1 . 2 .]" 2
58 1 80 VAL H 1 80 VAL HA 0.000 . 3.000 2.917 2.805 2.970 . 0 0 "[ . 1 . 2 .]" 2
59 1 80 VAL H 1 80 VAL HB 0.000 . 2.500 2.345 2.187 2.535 0.035 24 0 "[ . 1 . 2 .]" 2
60 1 80 VAL H 1 80 VAL MG1 0.000 . 4.500 3.700 3.645 3.753 . 0 0 "[ . 1 . 2 .]" 2
61 1 80 VAL H 1 80 VAL MG2 0.000 . 4.000 2.219 1.871 2.545 . 0 0 "[ . 1 . 2 .]" 2
62 1 81 LEU HA 1 81 LEU MD1 0.000 . 4.500 2.043 1.830 3.790 . 0 0 "[ . 1 . 2 .]" 2
63 1 81 LEU HA 1 81 LEU MD2 0.000 . 4.500 2.168 1.836 2.771 . 0 0 "[ . 1 . 2 .]" 2
64 1 81 LEU H 1 81 LEU QB 0.000 . 3.600 2.067 1.913 2.361 . 0 0 "[ . 1 . 2 .]" 2
65 1 81 LEU H 1 81 LEU QD 0.000 . 4.700 2.214 1.805 3.060 . 0 0 "[ . 1 . 2 .]" 2
66 1 81 LEU H 1 81 LEU HG 0.000 . 4.000 3.829 2.179 4.094 0.094 24 0 "[ . 1 . 2 .]" 2
67 1 82 GLU H 1 82 GLU QB 0.000 . 3.600 2.108 1.925 2.322 . 0 0 "[ . 1 . 2 .]" 2
68 1 82 GLU H 1 82 GLU QG 0.000 . 5.000 3.313 2.192 3.995 . 0 0 "[ . 1 . 2 .]" 2
69 1 83 ARG HA 1 83 ARG QD 0.000 . 5.000 3.467 1.862 4.184 . 0 0 "[ . 1 . 2 .]" 2
70 1 83 ARG HA 1 83 ARG QG 0.000 . 4.000 2.255 1.979 3.286 . 0 0 "[ . 1 . 2 .]" 2
71 1 83 ARG H 1 83 ARG HA 0.000 . 3.000 2.962 2.949 2.975 . 0 0 "[ . 1 . 2 .]" 2
72 1 83 ARG H 1 83 ARG QB 0.000 . 3.100 2.175 2.011 2.624 . 0 0 "[ . 1 . 2 .]" 2
73 1 83 ARG H 1 83 ARG QD 0.000 . 6.000 4.077 2.278 4.863 . 0 0 "[ . 1 . 2 .]" 2
74 1 83 ARG H 1 83 ARG QG 0.000 . 5.000 3.406 1.994 4.017 . 0 0 "[ . 1 . 2 .]" 2
75 1 84 LYS HA 1 84 LYS QD 0.000 . 5.000 3.576 2.523 4.430 . 0 0 "[ . 1 . 2 .]" 2
76 1 84 LYS H 1 84 LYS HA 0.000 . 3.000 2.998 2.954 3.007 0.007 25 0 "[ . 1 . 2 .]" 2
77 1 84 LYS H 1 84 LYS QB 0.000 . 3.100 2.428 2.067 2.756 . 0 0 "[ . 1 . 2 .]" 2
78 1 84 LYS H 1 84 LYS QD 0.000 . 6.000 4.378 2.436 5.144 . 0 0 "[ . 1 . 2 .]" 2
79 1 84 LYS H 1 84 LYS QG 0.000 . 5.000 3.826 2.020 4.182 . 0 0 "[ . 1 . 2 .]" 2
80 1 85 CYS H 1 85 CYS QB 0.000 . 3.600 2.685 1.993 2.781 . 0 0 "[ . 1 . 2 .]" 2
81 1 86 ILE HA 1 86 ILE HB 0.000 . 3.000 3.018 3.000 3.030 0.030 18 0 "[ . 1 . 2 .]" 2
82 1 86 ILE H 1 86 ILE HA 0.000 . 3.000 2.881 2.749 3.003 0.003 9 0 "[ . 1 . 2 .]" 2
83 1 86 ILE H 1 86 ILE HB 0.000 . 2.500 2.328 2.088 2.622 0.122 3 0 "[ . 1 . 2 .]" 2
84 1 86 ILE H 1 86 ILE MD 0.000 . 5.500 3.455 1.892 4.294 . 0 0 "[ . 1 . 2 .]" 2
85 1 86 ILE H 1 86 ILE QG 0.000 . 5.000 2.526 1.871 3.883 . 0 0 "[ . 1 . 2 .]" 2
86 1 88 LEU HA 1 88 LEU MD2 0.000 . 4.500 2.373 1.835 3.313 . 0 0 "[ . 1 . 2 .]" 2
87 1 88 LEU HA 1 88 LEU HG 0.000 . 4.000 2.730 2.503 3.086 . 0 0 "[ . 1 . 2 .]" 2
88 1 88 LEU H 1 88 LEU QB 0.000 . 3.600 2.560 2.351 2.745 . 0 0 "[ . 1 . 2 .]" 2
89 1 88 LEU H 1 88 LEU MD1 0.000 . 5.500 3.546 2.331 4.112 . 0 0 "[ . 1 . 2 .]" 2
90 1 88 LEU H 1 88 LEU MD2 0.000 . 5.500 4.094 3.732 4.295 . 0 0 "[ . 1 . 2 .]" 2
91 1 88 LEU H 1 88 LEU HG 0.000 . 3.000 2.927 2.642 3.033 0.033 6 0 "[ . 1 . 2 .]" 2
92 1 89 GLU H 1 89 GLU QB 0.000 . 3.600 2.246 1.930 2.522 . 0 0 "[ . 1 . 2 .]" 2
93 1 90 ARG H 1 90 ARG QB 0.000 . 3.600 2.642 2.182 3.271 . 0 0 "[ . 1 . 2 .]" 2
94 1 90 ARG H 1 90 ARG QD 0.000 . 6.000 4.603 3.615 5.205 . 0 0 "[ . 1 . 2 .]" 2
95 1 90 ARG H 1 90 ARG QG 0.000 . 5.000 3.466 1.838 4.179 . 0 0 "[ . 1 . 2 .]" 2
96 1 92 VAL H 1 92 VAL HB 0.000 . 3.000 2.691 2.282 3.057 0.057 22 0 "[ . 1 . 2 .]" 2
97 1 93 VAL H 1 93 VAL HB 0.000 . 4.000 2.580 2.320 2.896 . 0 0 "[ . 1 . 2 .]" 2
98 1 94 ALA H 1 94 ALA MB 0.000 . 3.600 2.100 1.912 2.309 . 0 0 "[ . 1 . 2 .]" 2
99 1 95 ILE H 1 95 ILE HB 0.000 . 4.000 2.433 2.257 2.600 . 0 0 "[ . 1 . 2 .]" 2
100 1 95 ILE H 1 95 ILE MD 0.000 . 4.500 3.306 2.240 3.721 . 0 0 "[ . 1 . 2 .]" 2
101 1 95 ILE H 1 95 ILE QG 0.000 . 5.000 2.355 1.947 2.778 . 0 0 "[ . 1 . 2 .]" 2
102 1 105 CYS H 1 105 CYS HA 0.000 . 3.000 2.987 2.917 3.009 0.009 7 0 "[ . 1 . 2 .]" 2
103 1 107 GLU H 1 107 GLU HA 0.000 . 2.500 2.383 2.359 2.752 0.252 8 0 "[ . 1 . 2 .]" 2
104 1 108 VAL H 1 108 VAL HA 0.000 . 3.000 2.993 2.969 3.011 0.011 24 0 "[ . 1 . 2 .]" 2
105 1 108 VAL H 1 108 VAL HB 0.000 . 2.500 2.522 2.430 2.599 0.099 18 0 "[ . 1 . 2 .]" 2
106 1 108 VAL H 1 108 VAL MG2 0.000 . 4.000 2.904 2.171 3.192 . 0 0 "[ . 1 . 2 .]" 2
107 1 109 MET H 1 109 MET QB 0.000 . 3.600 2.312 1.921 3.316 . 0 0 "[ . 1 . 2 .]" 2
108 1 111 ARG H 1 111 ARG QB 0.000 . 3.600 2.543 2.140 3.242 . 0 0 "[ . 1 . 2 .]" 2
109 1 112 VAL H 1 112 VAL HB 0.000 . 4.000 2.449 2.238 2.621 . 0 0 "[ . 1 . 2 .]" 2
110 1 114 VAL H 1 114 VAL HB 0.000 . 4.000 2.564 2.335 2.742 . 0 0 "[ . 1 . 2 .]" 2
111 1 117 VAL HA 1 117 VAL HB 0.000 . 3.000 3.028 3.015 3.036 0.036 14 0 "[ . 1 . 2 .]" 2
112 1 117 VAL H 1 117 VAL HB 0.000 . 3.000 2.448 2.269 2.602 . 0 0 "[ . 1 . 2 .]" 2
113 1 117 VAL H 1 117 VAL QG 0.000 . 4.200 2.598 2.204 2.909 . 0 0 "[ . 1 . 2 .]" 2
114 1 118 CYS H 1 118 CYS QB 0.000 . 3.600 2.255 2.093 2.886 . 0 0 "[ . 1 . 2 .]" 2
115 1 122 ALA H 1 122 ALA HA 0.000 . 3.000 2.907 2.370 3.002 0.002 17 0 "[ . 1 . 2 .]" 2
116 1 122 ALA H 1 122 ALA MB 0.000 . 3.600 2.383 1.930 2.863 . 0 0 "[ . 1 . 2 .]" 2
117 1 6 THR HA 1 7 VAL H 0.000 . 2.500 2.339 2.202 2.634 0.134 25 0 "[ . 1 . 2 .]" 2
118 1 6 THR HB 1 7 VAL H 0.000 . 5.000 4.068 2.480 4.652 . 0 0 "[ . 1 . 2 .]" 2
119 1 6 THR MG 1 7 VAL HB 0.000 . 6.500 4.801 3.891 5.488 . 0 0 "[ . 1 . 2 .]" 2
120 1 6 THR MG 1 7 VAL QG 0.000 . 7.900 3.993 3.101 4.631 . 0 0 "[ . 1 . 2 .]" 2
121 1 6 THR MG 1 7 VAL H 0.000 . 6.500 2.928 1.903 4.289 . 0 0 "[ . 1 . 2 .]" 2
122 1 7 VAL HA 1 8 SER H 0.000 . 4.000 2.460 2.218 3.587 . 0 0 "[ . 1 . 2 .]" 2
123 1 8 SER HA 1 9 GLY H 0.000 . 3.000 2.553 2.206 2.975 . 0 0 "[ . 1 . 2 .]" 2
124 1 8 SER QB 1 9 GLY QA 0.000 . 9.000 3.999 3.546 4.621 . 0 0 "[ . 1 . 2 .]" 2
125 1 8 SER QB 1 9 GLY H 0.000 . 5.000 2.962 1.862 4.079 . 0 0 "[ . 1 . 2 .]" 2
126 1 9 GLY QA 1 10 VAL H 0.000 . 3.500 2.254 2.158 2.493 . 0 0 "[ . 1 . 2 .]" 2
127 1 9 GLY H 1 10 VAL H 0.000 . 6.000 3.973 2.499 4.715 . 0 0 "[ . 1 . 2 .]" 2
128 1 10 VAL HA 1 11 CYS H 0.000 . 2.500 2.305 2.184 2.458 . 0 0 "[ . 1 . 2 .]" 2
129 1 10 VAL HB 1 11 CYS H 0.000 . 4.000 3.674 2.693 4.054 0.054 21 0 "[ . 1 . 2 .]" 2
130 1 10 VAL QG 1 11 CYS HA 0.000 . 7.400 3.824 3.434 4.196 . 0 0 "[ . 1 . 2 .]" 2
131 1 10 VAL QG 1 11 CYS H 0.000 . 6.400 2.602 1.863 3.664 . 0 0 "[ . 1 . 2 .]" 2
132 1 10 VAL H 1 11 CYS H 0.000 . 6.000 4.424 4.044 4.573 . 0 0 "[ . 1 . 2 .]" 2
133 1 11 CYS HA 1 12 ALA HA 0.000 . 7.000 4.530 4.463 4.612 . 0 0 "[ . 1 . 2 .]" 2
134 1 11 CYS HA 1 12 ALA MB 0.000 . 6.500 3.825 3.675 3.943 . 0 0 "[ . 1 . 2 .]" 2
135 1 11 CYS HA 1 12 ALA H 0.000 . 3.000 2.299 2.218 2.436 . 0 0 "[ . 1 . 2 .]" 2
136 1 11 CYS QB 1 12 ALA H 0.000 . 6.000 3.217 2.484 3.968 . 0 0 "[ . 1 . 2 .]" 2
137 1 11 CYS H 1 12 ALA H 0.000 . 6.000 4.433 4.264 4.573 . 0 0 "[ . 1 . 2 .]" 2
138 1 12 ALA HA 1 13 ASP QB 0.000 . 7.000 4.252 3.797 4.682 . 0 0 "[ . 1 . 2 .]" 2
139 1 12 ALA HA 1 13 ASP H 0.000 . 2.500 2.244 2.203 2.401 . 0 0 "[ . 1 . 2 .]" 2
140 1 12 ALA MB 1 13 ASP HA 0.000 . 8.500 4.138 3.875 4.237 . 0 0 "[ . 1 . 2 .]" 2
141 1 12 ALA MB 1 13 ASP H 0.000 . 4.500 3.323 2.666 3.568 . 0 0 "[ . 1 . 2 .]" 2
142 1 12 ALA H 1 13 ASP H 0.000 . 6.000 4.134 3.634 4.569 . 0 0 "[ . 1 . 2 .]" 2
143 1 13 ASP HA 1 14 VAL MG2 0.000 . 8.500 3.616 3.295 3.996 . 0 0 "[ . 1 . 2 .]" 2
144 1 13 ASP HA 1 14 VAL H 0.000 . 2.500 2.234 2.201 2.281 . 0 0 "[ . 1 . 2 .]" 2
145 1 13 ASP QB 1 14 VAL H 0.000 . 6.000 3.686 3.114 4.035 . 0 0 "[ . 1 . 2 .]" 2
146 1 13 ASP H 1 14 VAL HA 0.000 . 6.000 4.953 4.475 5.215 . 0 0 "[ . 1 . 2 .]" 2
147 1 13 ASP H 1 14 VAL MG1 0.000 . 7.500 5.567 3.206 6.164 . 0 0 "[ . 1 . 2 .]" 2
148 1 13 ASP H 1 14 VAL MG2 0.000 . 5.500 3.377 2.728 4.382 . 0 0 "[ . 1 . 2 .]" 2
149 1 13 ASP H 1 14 VAL H 0.000 . 5.000 4.204 3.736 4.500 . 0 0 "[ . 1 . 2 .]" 2
150 1 14 VAL HA 1 15 SER QB 0.000 . 7.000 4.226 3.904 4.820 . 0 0 "[ . 1 . 2 .]" 2
151 1 14 VAL HA 1 15 SER H 0.000 . 2.500 2.331 2.183 2.472 . 0 0 "[ . 1 . 2 .]" 2
152 1 14 VAL HB 1 15 SER H 0.000 . 5.000 3.848 2.785 4.402 . 0 0 "[ . 1 . 2 .]" 2
153 1 14 VAL MG1 1 15 SER HA 0.000 . 8.500 4.138 3.613 5.643 . 0 0 "[ . 1 . 2 .]" 2
154 1 14 VAL MG1 1 15 SER QB 0.000 . 8.500 4.071 3.093 5.406 . 0 0 "[ . 1 . 2 .]" 2
155 1 14 VAL MG1 1 15 SER H 0.000 . 4.500 2.379 1.841 3.745 . 0 0 "[ . 1 . 2 .]" 2
156 1 14 VAL MG2 1 15 SER H 0.000 . 5.500 3.966 3.685 4.247 . 0 0 "[ . 1 . 2 .]" 2
157 1 14 VAL H 1 15 SER HA 0.000 . 6.000 4.820 4.556 5.088 . 0 0 "[ . 1 . 2 .]" 2
158 1 14 VAL H 1 15 SER H 0.000 . 5.000 4.408 4.021 4.559 . 0 0 "[ . 1 . 2 .]" 2
159 1 15 SER HA 1 16 GLU H 0.000 . 3.000 2.474 2.215 2.823 . 0 0 "[ . 1 . 2 .]" 2
160 1 15 SER QB 1 16 GLU H 0.000 . 6.000 2.823 2.030 4.076 . 0 0 "[ . 1 . 2 .]" 2
161 1 15 SER H 1 16 GLU H 0.000 . 5.000 4.465 3.009 4.690 . 0 0 "[ . 1 . 2 .]" 2
162 1 16 GLU HA 1 17 TYR H 0.000 . 3.000 2.430 2.219 2.921 . 0 0 "[ . 1 . 2 .]" 2
163 1 16 GLU QB 1 17 TYR H 0.000 . 6.000 3.310 1.920 4.054 . 0 0 "[ . 1 . 2 .]" 2
164 1 16 GLU QG 1 17 TYR H 0.000 . 7.000 2.646 1.837 3.925 . 0 0 "[ . 1 . 2 .]" 2
165 1 16 GLU H 1 17 TYR H 0.000 . 5.000 4.510 3.577 4.742 . 0 0 "[ . 1 . 2 .]" 2
166 1 17 TYR HA 1 18 HIS H 0.000 . 4.000 2.793 2.200 3.604 . 0 0 "[ . 1 . 2 .]" 2
167 1 17 TYR QB 1 18 HIS H 0.000 . 6.000 3.026 1.822 4.050 . 0 0 "[ . 1 . 2 .]" 2
168 1 17 TYR QD 1 18 HIS H 0.000 . 8.000 2.924 2.037 3.941 . 0 0 "[ . 1 . 2 .]" 2
169 1 18 HIS HA 1 19 PRO QD 0.000 . 4.000 2.029 1.870 2.375 . 0 0 "[ . 1 . 2 .]" 2
170 1 18 HIS QB 1 19 PRO QD 0.000 . 8.000 3.347 1.807 3.811 . 0 0 "[ . 1 . 2 .]" 2
171 1 18 HIS HD2 1 19 PRO QD 0.000 . 8.000 3.671 1.868 6.120 . 0 0 "[ . 1 . 2 .]" 2
172 1 20 ASN HA 1 21 ILE H 0.000 . 4.000 2.601 2.209 3.595 . 0 0 "[ . 1 . 2 .]" 2
173 1 20 ASN QB 1 21 ILE QG 0.000 . 9.000 4.492 2.978 5.516 . 0 0 "[ . 1 . 2 .]" 2
174 1 20 ASN QB 1 21 ILE H 0.000 . 7.000 3.461 2.092 4.076 . 0 0 "[ . 1 . 2 .]" 2
175 1 21 ILE HA 1 22 LYS H 0.000 . 4.000 2.646 2.212 3.569 . 0 0 "[ . 1 . 2 .]" 2
176 1 21 ILE MG 1 22 LYS HA 0.000 . 7.500 4.298 3.205 5.982 . 0 0 "[ . 1 . 2 .]" 2
177 1 21 ILE MG 1 22 LYS H 0.000 . 6.500 3.025 1.749 4.278 . 0 0 "[ . 1 . 2 .]" 2
178 1 23 ASN HA 1 24 TRP HD1 0.000 . 7.000 5.498 2.775 7.190 0.190 19 0 "[ . 1 . 2 .]" 2
179 1 23 ASN HA 1 24 TRP H 0.000 . 4.000 2.625 2.176 3.406 . 0 0 "[ . 1 . 2 .]" 2
180 1 23 ASN QB 1 24 TRP H 0.000 . 7.000 3.751 3.080 4.072 . 0 0 "[ . 1 . 2 .]" 2
181 1 24 TRP HA 1 25 GLN H 0.000 . 5.000 3.021 2.208 3.600 . 0 0 "[ . 1 . 2 .]" 2
182 1 24 TRP QB 1 25 GLN HA 0.000 . 7.000 4.528 3.987 5.465 . 0 0 "[ . 1 . 2 .]" 2
183 1 24 TRP QB 1 25 GLN QB 0.000 . 9.000 4.238 3.077 5.298 . 0 0 "[ . 1 . 2 .]" 2
184 1 24 TRP QB 1 25 GLN H 0.000 . 6.000 3.028 1.844 4.064 . 0 0 "[ . 1 . 2 .]" 2
185 1 24 TRP HD1 1 25 GLN HA 0.000 . 7.000 5.659 3.280 7.123 0.123 24 0 "[ . 1 . 2 .]" 2
186 1 24 TRP HD1 1 25 GLN QB 0.000 . 8.000 5.285 1.913 7.088 . 0 0 "[ . 1 . 2 .]" 2
187 1 24 TRP HE3 1 25 GLN HA 0.000 . 7.000 6.409 5.102 7.095 0.095 9 0 "[ . 1 . 2 .]" 2
188 1 24 TRP HE3 1 25 GLN QB 0.000 . 8.000 5.920 2.827 7.323 . 0 0 "[ . 1 . 2 .]" 2
189 1 25 GLN HA 1 26 ILE H 0.000 . 3.000 2.450 2.206 3.003 0.003 11 0 "[ . 1 . 2 .]" 2
190 1 25 GLN QB 1 26 ILE H 0.000 . 5.000 3.391 1.821 4.066 . 0 0 "[ . 1 . 2 .]" 2
191 1 25 GLN H 1 26 ILE H 0.000 . 6.000 3.940 2.232 4.703 . 0 0 "[ . 1 . 2 .]" 2
192 1 26 ILE HA 1 27 GLU HA 0.000 . 6.000 4.525 4.423 4.854 . 0 0 "[ . 1 . 2 .]" 2
193 1 26 ILE HA 1 27 GLU H 0.000 . 3.000 2.662 2.195 3.159 0.159 13 0 "[ . 1 . 2 .]" 2
194 1 26 ILE HB 1 27 GLU H 0.000 . 5.000 3.910 1.875 4.652 . 0 0 "[ . 1 . 2 .]" 2
195 1 26 ILE QG 1 27 GLU H 0.000 . 7.000 4.100 2.126 4.836 . 0 0 "[ . 1 . 2 .]" 2
196 1 26 ILE MG 1 27 GLU HA 0.000 . 7.500 4.232 3.433 5.642 . 0 0 "[ . 1 . 2 .]" 2
197 1 26 ILE MG 1 27 GLU QG 0.000 . 7.500 4.584 3.068 5.554 . 0 0 "[ . 1 . 2 .]" 2
198 1 26 ILE MG 1 27 GLU H 0.000 . 5.500 3.498 1.795 4.125 . 0 0 "[ . 1 . 2 .]" 2
199 1 26 ILE H 1 27 GLU H 0.000 . 5.000 3.539 2.010 4.580 . 0 0 "[ . 1 . 2 .]" 2
200 1 27 GLU HA 1 28 SER H 0.000 . 5.000 3.306 2.469 3.627 . 0 0 "[ . 1 . 2 .]" 2
201 1 27 GLU QB 1 28 SER H 0.000 . 7.000 2.556 1.788 3.970 . 0 0 "[ . 1 . 2 .]" 2
202 1 27 GLU H 1 28 SER H 0.000 . 5.000 3.051 1.864 4.685 . 0 0 "[ . 1 . 2 .]" 2
203 1 28 SER HA 1 29 TYR QD 0.000 . 9.000 4.217 2.414 6.037 . 0 0 "[ . 1 . 2 .]" 2
204 1 28 SER HA 1 29 TYR H 0.000 . 5.000 2.896 2.211 3.576 . 0 0 "[ . 1 . 2 .]" 2
205 1 29 TYR HA 1 30 GLY H 0.000 . 4.000 2.702 2.191 3.592 . 0 0 "[ . 1 . 2 .]" 2
206 1 29 TYR QB 1 30 GLY QA 0.000 . 9.000 3.883 3.538 4.481 . 0 0 "[ . 1 . 2 .]" 2
207 1 30 GLY QA 1 31 GLU QG 0.000 . 8.000 4.750 2.992 5.595 . 0 0 "[ . 1 . 2 .]" 2
208 1 30 GLY QA 1 31 GLU H 0.000 . 5.000 2.347 2.166 2.939 . 0 0 "[ . 1 . 2 .]" 2
209 1 30 GLY H 1 31 GLU H 0.000 . 6.000 3.789 1.858 4.508 . 0 0 "[ . 1 . 2 .]" 2
210 1 31 GLU HA 1 32 PRO QD 0.000 . 3.500 2.126 1.918 3.451 . 0 0 "[ . 1 . 2 .]" 2
211 1 31 GLU QB 1 32 PRO QD 0.000 . 6.000 3.359 1.808 3.816 . 0 0 "[ . 1 . 2 .]" 2
212 1 31 GLU QG 1 32 PRO QD 0.000 . 8.000 3.304 1.824 4.214 . 0 0 "[ . 1 . 2 .]" 2
213 1 32 PRO HA 1 33 GLU H 0.000 . 3.000 2.415 2.218 2.866 . 0 0 "[ . 1 . 2 .]" 2
214 1 32 PRO QB 1 33 GLU H 0.000 . 7.000 3.363 1.918 4.013 . 0 0 "[ . 1 . 2 .]" 2
215 1 32 PRO QG 1 33 GLU H 0.000 . 7.000 4.534 3.603 4.822 . 0 0 "[ . 1 . 2 .]" 2
216 1 33 GLU HA 1 34 PHE QD 0.000 . 9.000 5.041 2.932 6.487 . 0 0 "[ . 1 . 2 .]" 2
217 1 33 GLU HA 1 34 PHE H 0.000 . 4.000 2.813 2.215 3.561 . 0 0 "[ . 1 . 2 .]" 2
218 1 33 GLU QB 1 34 PHE QD 0.000 . 9.000 4.634 3.037 5.764 . 0 0 "[ . 1 . 2 .]" 2
219 1 33 GLU QB 1 34 PHE QE 0.000 . 10.000 6.235 4.343 7.572 . 0 0 "[ . 1 . 2 .]" 2
220 1 33 GLU QB 1 34 PHE H 0.000 . 6.000 3.181 1.819 4.082 . 0 0 "[ . 1 . 2 .]" 2
221 1 33 GLU QG 1 34 PHE QE 0.000 . 10.000 6.552 3.735 8.134 . 0 0 "[ . 1 . 2 .]" 2
222 1 33 GLU QG 1 34 PHE H 0.000 . 7.000 3.652 1.939 4.698 . 0 0 "[ . 1 . 2 .]" 2
223 1 33 GLU H 1 34 PHE H 0.000 . 6.000 3.516 2.204 4.671 . 0 0 "[ . 1 . 2 .]" 2
224 1 35 HIS HA 1 36 THR H 0.000 . 5.000 2.861 2.192 3.588 . 0 0 "[ . 1 . 2 .]" 2
225 1 35 HIS QB 1 36 THR H 0.000 . 6.000 3.197 1.751 4.084 . 0 0 "[ . 1 . 2 .]" 2
226 1 35 HIS HD2 1 36 THR HA 0.000 . 7.000 5.794 3.316 7.078 0.078 20 0 "[ . 1 . 2 .]" 2
227 1 36 THR HA 1 37 ALA H 0.000 . 3.000 2.533 2.203 2.986 . 0 0 "[ . 1 . 2 .]" 2
228 1 36 THR HB 1 37 ALA MB 0.000 . 6.500 4.201 3.431 5.117 . 0 0 "[ . 1 . 2 .]" 2
229 1 36 THR HB 1 37 ALA H 0.000 . 4.000 2.532 1.836 3.876 . 0 0 "[ . 1 . 2 .]" 2
230 1 36 THR MG 1 37 ALA H 0.000 . 6.500 3.503 2.711 4.091 . 0 0 "[ . 1 . 2 .]" 2
231 1 36 THR H 1 37 ALA H 0.000 . 6.000 4.423 4.134 4.699 . 0 0 "[ . 1 . 2 .]" 2
232 1 37 ALA HA 1 38 LYS H 0.000 . 2.500 2.493 2.220 2.591 0.091 14 0 "[ . 1 . 2 .]" 2
233 1 37 ALA MB 1 38 LYS H 0.000 . 4.000 2.486 2.164 3.353 . 0 0 "[ . 1 . 2 .]" 2
234 1 37 ALA H 1 38 LYS H 0.000 . 5.000 4.564 4.420 4.715 . 0 0 "[ . 1 . 2 .]" 2
235 1 38 LYS HA 1 39 VAL MG2 0.000 . 8.500 3.464 3.089 3.987 . 0 0 "[ . 1 . 2 .]" 2
236 1 38 LYS HA 1 39 VAL H 0.000 . 2.500 2.359 2.236 2.458 . 0 0 "[ . 1 . 2 .]" 2
237 1 38 LYS QB 1 39 VAL H 0.000 . 5.000 2.825 2.539 3.200 . 0 0 "[ . 1 . 2 .]" 2
238 1 38 LYS QD 1 39 VAL H 0.000 . 7.000 4.528 3.104 5.355 . 0 0 "[ . 1 . 2 .]" 2
239 1 38 LYS QG 1 39 VAL H 0.000 . 6.000 3.477 2.599 4.052 . 0 0 "[ . 1 . 2 .]" 2
240 1 38 LYS H 1 39 VAL HA 0.000 . 6.000 4.837 4.642 5.117 . 0 0 "[ . 1 . 2 .]" 2
241 1 38 LYS H 1 39 VAL H 0.000 . 5.000 4.459 4.288 4.566 . 0 0 "[ . 1 . 2 .]" 2
242 1 39 VAL HA 1 40 HIS QB 0.000 . 8.000 4.042 3.751 4.506 . 0 0 "[ . 1 . 2 .]" 2
243 1 39 VAL HA 1 40 HIS HD2 0.000 . 7.000 6.481 5.565 7.009 0.009 12 0 "[ . 1 . 2 .]" 2
244 1 39 VAL HA 1 40 HIS H 0.000 . 2.500 2.300 2.236 2.511 0.011 8 0 "[ . 1 . 2 .]" 2
245 1 39 VAL HB 1 40 HIS H 0.000 . 5.000 4.127 3.573 4.504 . 0 0 "[ . 1 . 2 .]" 2
246 1 39 VAL MG1 1 40 HIS QB 0.000 . 9.500 4.140 3.730 4.643 . 0 0 "[ . 1 . 2 .]" 2
247 1 39 VAL MG1 1 40 HIS H 0.000 . 5.500 2.440 1.829 3.129 . 0 0 "[ . 1 . 2 .]" 2
248 1 39 VAL MG2 1 40 HIS H 0.000 . 6.500 3.994 3.706 4.273 . 0 0 "[ . 1 . 2 .]" 2
249 1 40 HIS HA 1 41 LEU H 0.000 . 2.500 2.209 2.176 2.245 . 0 0 "[ . 1 . 2 .]" 2
250 1 40 HIS QB 1 41 LEU H 0.000 . 6.000 3.652 3.079 3.905 . 0 0 "[ . 1 . 2 .]" 2
251 1 40 HIS HD2 1 41 LEU HA 0.000 . 8.000 5.884 4.419 7.497 . 0 0 "[ . 1 . 2 .]" 2
252 1 40 HIS HD2 1 41 LEU H 0.000 . 6.000 3.971 2.541 6.001 0.001 6 0 "[ . 1 . 2 .]" 2
253 1 40 HIS H 1 41 LEU H 0.000 . 5.000 4.224 3.967 4.445 . 0 0 "[ . 1 . 2 .]" 2
254 1 41 LEU HA 1 42 LYS H 0.000 . 2.500 2.281 2.233 2.469 . 0 0 "[ . 1 . 2 .]" 2
255 1 41 LEU QB 1 42 LYS H 0.000 . 6.000 3.430 2.632 3.794 . 0 0 "[ . 1 . 2 .]" 2
256 1 41 LEU QD 1 42 LYS H 0.000 . 6.400 3.525 2.643 4.399 . 0 0 "[ . 1 . 2 .]" 2
257 1 41 LEU H 1 42 LYS H 0.000 . 5.000 4.295 3.990 4.573 . 0 0 "[ . 1 . 2 .]" 2
258 1 42 LYS HA 1 43 CYS H 0.000 . 2.500 2.239 2.185 2.414 . 0 0 "[ . 1 . 2 .]" 2
259 1 42 LYS QB 1 43 CYS H 0.000 . 5.000 3.362 2.509 3.891 . 0 0 "[ . 1 . 2 .]" 2
260 1 42 LYS QG 1 43 CYS H 0.000 . 6.000 3.527 1.844 4.384 . 0 0 "[ . 1 . 2 .]" 2
261 1 42 LYS H 1 43 CYS H 0.000 . 5.000 4.320 3.824 4.568 . 0 0 "[ . 1 . 2 .]" 2
262 1 43 CYS HA 1 44 ALA MB 0.000 . 7.500 4.090 3.902 4.196 . 0 0 "[ . 1 . 2 .]" 2
263 1 43 CYS HA 1 44 ALA H 0.000 . 2.500 2.440 2.255 2.650 0.150 15 0 "[ . 1 . 2 .]" 2
264 1 43 CYS QB 1 44 ALA MB 0.000 . 9.500 3.928 3.579 4.580 . 0 0 "[ . 1 . 2 .]" 2
265 1 43 CYS QB 1 44 ALA H 0.000 . 5.000 2.817 2.183 3.634 . 0 0 "[ . 1 . 2 .]" 2
266 1 43 CYS H 1 44 ALA H 0.000 . 5.000 4.520 4.355 4.663 . 0 0 "[ . 1 . 2 .]" 2
267 1 44 ALA HA 1 45 PRO HA 0.000 . 7.000 4.385 4.377 4.407 . 0 0 "[ . 1 . 2 .]" 2
268 1 44 ALA HA 1 45 PRO QD 0.000 . 5.000 2.121 2.015 2.308 . 0 0 "[ . 1 . 2 .]" 2
269 1 44 ALA HA 1 45 PRO QG 0.000 . 6.000 4.050 3.934 4.242 . 0 0 "[ . 1 . 2 .]" 2
270 1 44 ALA MB 1 45 PRO HA 0.000 . 7.500 4.385 4.296 4.456 . 0 0 "[ . 1 . 2 .]" 2
271 1 44 ALA MB 1 45 PRO QB 0.000 . 8.500 4.513 4.302 4.699 . 0 0 "[ . 1 . 2 .]" 2
272 1 44 ALA MB 1 45 PRO QD 0.000 . 5.500 2.071 1.786 2.339 . 0 0 "[ . 1 . 2 .]" 2
273 1 44 ALA MB 1 45 PRO QG 0.000 . 7.500 3.614 3.340 3.871 . 0 0 "[ . 1 . 2 .]" 2
274 1 44 ALA H 1 45 PRO QD 0.000 . 7.000 4.353 4.293 4.391 . 0 0 "[ . 1 . 2 .]" 2
275 1 45 PRO HA 1 46 GLY H 0.000 . 2.500 2.260 2.215 2.392 . 0 0 "[ . 1 . 2 .]" 2
276 1 45 PRO QB 1 46 GLY H 0.000 . 6.000 3.588 2.947 3.891 . 0 0 "[ . 1 . 2 .]" 2
277 1 45 PRO QG 1 46 GLY H 0.000 . 7.000 4.731 4.452 4.783 . 0 0 "[ . 1 . 2 .]" 2
278 1 46 GLY QA 1 47 GLN H 0.000 . 5.000 2.854 2.693 2.939 . 0 0 "[ . 1 . 2 .]" 2
279 1 46 GLY H 1 47 GLN QB 0.000 . 7.000 4.321 3.980 4.813 . 0 0 "[ . 1 . 2 .]" 2
280 1 46 GLY H 1 47 GLN H 0.000 . 3.000 2.332 1.874 3.030 0.030 7 0 "[ . 1 . 2 .]" 2
281 1 47 GLN HA 1 48 THR MG 0.000 . 8.500 3.633 3.094 4.438 . 0 0 "[ . 1 . 2 .]" 2
282 1 47 GLN HA 1 48 THR H 0.000 . 2.500 2.311 2.208 2.552 0.052 12 0 "[ . 1 . 2 .]" 2
283 1 47 GLN QB 1 48 THR H 0.000 . 5.000 3.173 2.306 3.728 . 0 0 "[ . 1 . 2 .]" 2
284 1 47 GLN QG 1 48 THR H 0.000 . 6.000 3.968 3.373 4.559 . 0 0 "[ . 1 . 2 .]" 2
285 1 47 GLN H 1 48 THR MG 0.000 . 6.500 4.197 3.481 4.802 . 0 0 "[ . 1 . 2 .]" 2
286 1 47 GLN H 1 48 THR H 0.000 . 5.000 4.452 4.200 4.646 . 0 0 "[ . 1 . 2 .]" 2
287 1 48 THR HA 1 49 ILE H 0.000 . 3.000 2.308 2.275 2.468 . 0 0 "[ . 1 . 2 .]" 2
288 1 48 THR HB 1 49 ILE H 0.000 . 3.000 2.989 2.624 3.066 0.066 10 0 "[ . 1 . 2 .]" 2
289 1 48 THR MG 1 49 ILE H 0.000 . 5.500 3.855 3.365 4.096 . 0 0 "[ . 1 . 2 .]" 2
290 1 48 THR H 1 49 ILE H 0.000 . 6.000 4.508 4.364 4.641 . 0 0 "[ . 1 . 2 .]" 2
291 1 49 ILE HA 1 50 SER H 0.000 . 3.000 2.285 2.213 2.456 . 0 0 "[ . 1 . 2 .]" 2
292 1 49 ILE HB 1 50 SER H 0.000 . 6.000 4.117 3.633 4.505 . 0 0 "[ . 1 . 2 .]" 2
293 1 49 ILE QG 1 50 SER H 0.000 . 6.000 4.177 3.847 4.374 . 0 0 "[ . 1 . 2 .]" 2
294 1 49 ILE MG 1 50 SER HA 0.000 . 7.500 3.750 3.427 4.193 . 0 0 "[ . 1 . 2 .]" 2
295 1 49 ILE MG 1 50 SER QB 0.000 . 9.500 4.358 4.064 4.819 . 0 0 "[ . 1 . 2 .]" 2
296 1 49 ILE MG 1 50 SER H 0.000 . 5.500 2.494 1.863 3.287 . 0 0 "[ . 1 . 2 .]" 2
297 1 49 ILE H 1 50 SER H 0.000 . 5.000 4.625 4.273 4.698 . 0 0 "[ . 1 . 2 .]" 2
298 1 50 SER HA 1 51 ALA MB 0.000 . 6.500 4.323 4.119 4.608 . 0 0 "[ . 1 . 2 .]" 2
299 1 50 SER HA 1 51 ALA H 0.000 . 4.000 3.414 3.314 3.561 . 0 0 "[ . 1 . 2 .]" 2
300 1 50 SER QB 1 51 ALA MB 0.000 . 8.500 3.385 2.900 3.950 . 0 0 "[ . 1 . 2 .]" 2
301 1 50 SER QB 1 51 ALA H 0.000 . 6.000 3.469 3.103 3.848 . 0 0 "[ . 1 . 2 .]" 2
302 1 50 SER H 1 51 ALA MB 0.000 . 7.500 3.880 3.648 4.242 . 0 0 "[ . 1 . 2 .]" 2
303 1 50 SER H 1 51 ALA H 0.000 . 3.000 1.971 1.828 2.435 . 0 0 "[ . 1 . 2 .]" 2
304 1 51 ALA HA 1 52 ILE H 0.000 . 2.500 2.270 2.194 2.483 . 0 0 "[ . 1 . 2 .]" 2
305 1 51 ALA MB 1 52 ILE HB 0.000 . 8.500 4.933 4.565 5.235 . 0 0 "[ . 1 . 2 .]" 2
306 1 51 ALA MB 1 52 ILE MD 0.000 . 9.000 4.595 4.084 4.988 . 0 0 "[ . 1 . 2 .]" 2
307 1 51 ALA MB 1 52 ILE H 0.000 . 4.000 2.971 2.378 3.378 . 0 0 "[ . 1 . 2 .]" 2
308 1 51 ALA H 1 52 ILE MD 0.000 . 6.500 4.000 3.342 4.442 . 0 0 "[ . 1 . 2 .]" 2
309 1 51 ALA H 1 52 ILE H 0.000 . 5.000 4.262 4.022 4.428 . 0 0 "[ . 1 . 2 .]" 2
310 1 52 ILE HA 1 53 LYS H 0.000 . 3.000 2.244 2.206 2.366 . 0 0 "[ . 1 . 2 .]" 2
311 1 52 ILE HB 1 53 LYS H 0.000 . 6.000 4.244 3.891 4.546 . 0 0 "[ . 1 . 2 .]" 2
312 1 52 ILE MD 1 53 LYS H 0.000 . 6.500 3.798 3.467 5.033 . 0 0 "[ . 1 . 2 .]" 2
313 1 52 ILE MG 1 53 LYS HA 0.000 . 7.500 4.215 3.680 4.524 . 0 0 "[ . 1 . 2 .]" 2
314 1 52 ILE MG 1 53 LYS H 0.000 . 5.500 2.749 2.175 3.370 . 0 0 "[ . 1 . 2 .]" 2
315 1 52 ILE H 1 53 LYS H 0.000 . 6.000 4.457 4.211 4.577 . 0 0 "[ . 1 . 2 .]" 2
316 1 53 LYS HA 1 54 PHE H 0.000 . 4.000 3.558 3.409 3.585 . 0 0 "[ . 1 . 2 .]" 2
317 1 53 LYS QB 1 54 PHE HA 0.000 . 8.000 4.483 4.137 4.847 . 0 0 "[ . 1 . 2 .]" 2
318 1 53 LYS QB 1 54 PHE QB 0.000 . 9.000 3.294 3.049 3.695 . 0 0 "[ . 1 . 2 .]" 2
319 1 53 LYS QB 1 54 PHE H 0.000 . 5.000 2.736 2.392 3.774 . 0 0 "[ . 1 . 2 .]" 2
320 1 53 LYS QD 1 54 PHE H 0.000 . 6.000 4.783 3.734 5.262 . 0 0 "[ . 1 . 2 .]" 2
321 1 53 LYS QG 1 54 PHE QB 0.000 . 9.000 3.880 2.483 5.183 . 0 0 "[ . 1 . 2 .]" 2
322 1 53 LYS QG 1 54 PHE H 0.000 . 6.000 3.820 1.834 4.512 . 0 0 "[ . 1 . 2 .]" 2
323 1 53 LYS H 1 54 PHE QB 0.000 . 7.000 4.527 4.004 4.754 . 0 0 "[ . 1 . 2 .]" 2
324 1 53 LYS H 1 54 PHE H 0.000 . 2.500 2.413 1.905 2.556 0.056 22 0 "[ . 1 . 2 .]" 2
325 1 54 PHE HA 1 55 ALA MB 0.000 . 7.500 3.707 3.610 3.820 . 0 0 "[ . 1 . 2 .]" 2
326 1 54 PHE HA 1 55 ALA H 0.000 . 2.500 2.384 2.202 2.492 . 0 0 "[ . 1 . 2 .]" 2
327 1 54 PHE QB 1 55 ALA H 0.000 . 5.000 3.384 3.187 3.764 . 0 0 "[ . 1 . 2 .]" 2
328 1 54 PHE QD 1 55 ALA HA 0.000 . 8.000 3.336 2.773 4.049 . 0 0 "[ . 1 . 2 .]" 2
329 1 54 PHE QD 1 55 ALA MB 0.000 . 8.500 4.276 3.934 4.578 . 0 0 "[ . 1 . 2 .]" 2
330 1 54 PHE QD 1 55 ALA H 0.000 . 6.000 2.908 2.521 3.467 . 0 0 "[ . 1 . 2 .]" 2
331 1 54 PHE QE 1 55 ALA HA 0.000 . 8.000 4.175 3.854 4.729 . 0 0 "[ . 1 . 2 .]" 2
332 1 54 PHE H 1 55 ALA HA 0.000 . 6.000 5.136 4.784 5.404 . 0 0 "[ . 1 . 2 .]" 2
333 1 54 PHE H 1 55 ALA H 0.000 . 5.000 4.419 4.106 4.530 . 0 0 "[ . 1 . 2 .]" 2
334 1 54 PHE HZ 1 55 ALA HA 0.000 . 6.000 5.780 5.168 5.994 . 0 0 "[ . 1 . 2 .]" 2
335 1 55 ALA HA 1 56 SER QB 0.000 . 8.000 4.261 3.881 4.768 . 0 0 "[ . 1 . 2 .]" 2
336 1 55 ALA HA 1 56 SER H 0.000 . 2.500 2.291 2.219 2.620 0.120 12 0 "[ . 1 . 2 .]" 2
337 1 55 ALA MB 1 56 SER HA 0.000 . 7.500 4.090 3.976 4.306 . 0 0 "[ . 1 . 2 .]" 2
338 1 55 ALA MB 1 56 SER H 0.000 . 5.500 3.467 2.968 3.726 . 0 0 "[ . 1 . 2 .]" 2
339 1 55 ALA H 1 56 SER HA 0.000 . 6.000 4.614 4.177 4.872 . 0 0 "[ . 1 . 2 .]" 2
340 1 55 ALA H 1 56 SER H 0.000 . 5.000 3.598 2.369 4.383 . 0 0 "[ . 1 . 2 .]" 2
341 1 56 SER HA 1 57 PHE QD 0.000 . 7.000 5.855 5.725 5.962 . 0 0 "[ . 1 . 2 .]" 2
342 1 56 SER HA 1 57 PHE H 0.000 . 3.000 2.237 2.191 2.413 . 0 0 "[ . 1 . 2 .]" 2
343 1 56 SER QB 1 57 PHE H 0.000 . 6.000 3.496 2.521 3.926 . 0 0 "[ . 1 . 2 .]" 2
344 1 56 SER H 1 57 PHE HA 0.000 . 6.000 4.757 4.349 5.259 . 0 0 "[ . 1 . 2 .]" 2
345 1 57 PHE HA 1 58 GLY H 0.000 . 2.500 2.365 2.235 2.574 0.074 17 0 "[ . 1 . 2 .]" 2
346 1 57 PHE QB 1 58 GLY H 0.000 . 6.000 4.024 3.861 4.086 . 0 0 "[ . 1 . 2 .]" 2
347 1 57 PHE QD 1 58 GLY H 0.000 . 6.000 3.733 2.366 4.450 . 0 0 "[ . 1 . 2 .]" 2
348 1 57 PHE H 1 58 GLY H 0.000 . 5.000 3.997 3.380 4.535 . 0 0 "[ . 1 . 2 .]" 2
349 1 58 GLY QA 1 59 THR MG 0.000 . 8.500 3.249 2.865 3.692 . 0 0 "[ . 1 . 2 .]" 2
350 1 58 GLY QA 1 59 THR H 0.000 . 4.000 2.200 2.153 2.312 . 0 0 "[ . 1 . 2 .]" 2
351 1 59 THR HA 1 60 PRO QB 0.000 . 8.000 4.778 4.662 4.954 . 0 0 "[ . 1 . 2 .]" 2
352 1 59 THR HA 1 60 PRO QD 0.000 . 5.000 2.063 1.954 2.269 . 0 0 "[ . 1 . 2 .]" 2
353 1 59 THR HB 1 60 PRO QD 0.000 . 7.000 3.995 3.689 4.278 . 0 0 "[ . 1 . 2 .]" 2
354 1 59 THR MG 1 60 PRO QD 0.000 . 8.500 3.673 3.476 3.800 . 0 0 "[ . 1 . 2 .]" 2
355 1 59 THR H 1 60 PRO QB 0.000 . 7.000 5.128 4.802 5.505 . 0 0 "[ . 1 . 2 .]" 2
356 1 59 THR H 1 60 PRO QD 0.000 . 6.000 3.328 2.776 3.752 . 0 0 "[ . 1 . 2 .]" 2
357 1 59 THR H 1 60 PRO QG 0.000 . 7.000 5.142 4.683 5.546 . 0 0 "[ . 1 . 2 .]" 2
358 1 60 PRO HA 1 61 LEU H 0.000 . 2.500 2.388 2.224 2.559 0.059 15 0 "[ . 1 . 2 .]" 2
359 1 60 PRO QB 1 61 LEU H 0.000 . 4.000 2.822 2.358 3.448 . 0 0 "[ . 1 . 2 .]" 2
360 1 60 PRO QG 1 61 LEU HA 0.000 . 7.000 4.803 4.650 5.033 . 0 0 "[ . 1 . 2 .]" 2
361 1 61 LEU HA 1 62 GLY QA 0.000 . 8.000 4.027 3.976 4.172 . 0 0 "[ . 1 . 2 .]" 2
362 1 61 LEU HA 1 62 GLY H 0.000 . 2.500 2.306 2.205 2.529 0.029 9 0 "[ . 1 . 2 .]" 2
363 1 61 LEU QB 1 62 GLY H 0.000 . 5.000 3.302 2.336 3.948 . 0 0 "[ . 1 . 2 .]" 2
364 1 61 LEU MD2 1 62 GLY H 0.000 . 5.500 3.278 2.224 4.665 . 0 0 "[ . 1 . 2 .]" 2
365 1 61 LEU H 1 62 GLY H 0.000 . 6.000 4.295 3.765 4.565 . 0 0 "[ . 1 . 2 .]" 2
366 1 62 GLY QA 1 63 THR H 0.000 . 3.500 2.290 2.164 2.330 . 0 0 "[ . 1 . 2 .]" 2
367 1 62 GLY H 1 63 THR H 0.000 . 5.000 4.500 4.235 4.676 . 0 0 "[ . 1 . 2 .]" 2
368 1 63 THR HA 1 64 CYS HA 0.000 . 6.000 4.538 4.404 4.741 . 0 0 "[ . 1 . 2 .]" 2
369 1 63 THR HA 1 64 CYS QB 0.000 . 8.000 4.358 3.774 4.916 . 0 0 "[ . 1 . 2 .]" 2
370 1 63 THR HA 1 64 CYS H 0.000 . 5.000 2.982 2.231 3.595 . 0 0 "[ . 1 . 2 .]" 2
371 1 63 THR HB 1 64 CYS HA 0.000 . 7.000 5.105 4.433 6.598 . 0 0 "[ . 1 . 2 .]" 2
372 1 63 THR HB 1 64 CYS H 0.000 . 5.000 2.759 1.858 4.590 . 0 0 "[ . 1 . 2 .]" 2
373 1 63 THR MG 1 64 CYS HA 0.000 . 7.500 4.987 3.722 6.102 . 0 0 "[ . 1 . 2 .]" 2
374 1 63 THR MG 1 64 CYS H 0.000 . 7.500 3.162 1.830 4.329 . 0 0 "[ . 1 . 2 .]" 2
375 1 64 CYS HA 1 65 GLY QA 0.000 . 8.000 3.982 3.967 4.006 . 0 0 "[ . 1 . 2 .]" 2
376 1 64 CYS HA 1 65 GLY H 0.000 . 3.000 2.269 2.191 2.470 . 0 0 "[ . 1 . 2 .]" 2
377 1 64 CYS QB 1 65 GLY H 0.000 . 7.000 3.846 3.549 4.077 . 0 0 "[ . 1 . 2 .]" 2
378 1 65 GLY QA 1 66 THR H 0.000 . 5.000 2.857 2.682 2.939 . 0 0 "[ . 1 . 2 .]" 2
379 1 65 GLY H 1 66 THR H 0.000 . 4.000 2.392 1.966 2.919 . 0 0 "[ . 1 . 2 .]" 2
380 1 66 THR HA 1 67 PHE QD 0.000 . 8.000 5.635 5.128 5.946 . 0 0 "[ . 1 . 2 .]" 2
381 1 66 THR HA 1 67 PHE H 0.000 . 3.000 2.960 2.800 3.068 0.068 17 0 "[ . 1 . 2 .]" 2
382 1 66 THR MG 1 67 PHE HA 0.000 . 8.500 4.788 3.522 5.772 . 0 0 "[ . 1 . 2 .]" 2
383 1 66 THR MG 1 67 PHE H 0.000 . 6.500 4.102 3.333 4.459 . 0 0 "[ . 1 . 2 .]" 2
384 1 66 THR H 1 67 PHE HA 0.000 . 5.000 4.230 4.060 4.438 . 0 0 "[ . 1 . 2 .]" 2
385 1 66 THR H 1 67 PHE QB 0.000 . 6.000 4.210 3.957 4.583 . 0 0 "[ . 1 . 2 .]" 2
386 1 66 THR H 1 67 PHE QD 0.000 . 7.000 4.304 3.398 4.741 . 0 0 "[ . 1 . 2 .]" 2
387 1 66 THR H 1 67 PHE H 0.000 . 2.500 2.425 2.234 2.526 0.026 17 0 "[ . 1 . 2 .]" 2
388 1 67 PHE HA 1 68 GLN H 0.000 . 2.500 2.369 2.207 2.544 0.044 9 0 "[ . 1 . 2 .]" 2
389 1 67 PHE QB 1 68 GLN H 0.000 . 5.000 2.964 2.308 3.842 . 0 0 "[ . 1 . 2 .]" 2
390 1 67 PHE QD 1 68 GLN H 0.000 . 6.000 2.992 2.268 3.681 . 0 0 "[ . 1 . 2 .]" 2
391 1 67 PHE H 1 68 GLN H 0.000 . 5.000 4.608 4.206 4.710 . 0 0 "[ . 1 . 2 .]" 2
392 1 68 GLN HA 1 69 GLN H 0.000 . 2.500 2.353 2.205 2.605 0.105 23 0 "[ . 1 . 2 .]" 2
393 1 68 GLN QB 1 69 GLN H 0.000 . 5.000 3.282 2.376 3.910 . 0 0 "[ . 1 . 2 .]" 2
394 1 68 GLN QG 1 69 GLN H 0.000 . 6.000 2.952 1.841 4.326 . 0 0 "[ . 1 . 2 .]" 2
395 1 68 GLN H 1 69 GLN H 0.000 . 5.000 4.333 3.798 4.556 . 0 0 "[ . 1 . 2 .]" 2
396 1 69 GLN HA 1 70 GLY H 0.000 . 3.000 2.380 2.211 3.134 0.134 22 0 "[ . 1 . 2 .]" 2
397 1 69 GLN QB 1 70 GLY H 0.000 . 6.000 3.411 2.520 3.982 . 0 0 "[ . 1 . 2 .]" 2
398 1 69 GLN H 1 70 GLY H 0.000 . 5.000 4.351 2.704 4.704 . 0 0 "[ . 1 . 2 .]" 2
399 1 70 GLY QA 1 71 GLU HA 0.000 . 7.000 4.033 3.996 4.234 . 0 0 "[ . 1 . 2 .]" 2
400 1 70 GLY QA 1 71 GLU H 0.000 . 4.000 2.251 2.147 2.691 . 0 0 "[ . 1 . 2 .]" 2
401 1 70 GLY H 1 71 GLU H 0.000 . 5.000 3.842 2.329 4.657 . 0 0 "[ . 1 . 2 .]" 2
402 1 71 GLU HA 1 72 CYS HA 0.000 . 7.000 4.613 4.488 4.742 . 0 0 "[ . 1 . 2 .]" 2
403 1 71 GLU HA 1 72 CYS H 0.000 . 4.000 3.483 3.174 3.594 . 0 0 "[ . 1 . 2 .]" 2
404 1 71 GLU QB 1 72 CYS H 0.000 . 4.000 2.957 2.141 3.605 . 0 0 "[ . 1 . 2 .]" 2
405 1 71 GLU QG 1 72 CYS HA 0.000 . 8.000 4.885 3.461 5.961 . 0 0 "[ . 1 . 2 .]" 2
406 1 71 GLU QG 1 72 CYS H 0.000 . 7.000 3.801 1.876 4.660 . 0 0 "[ . 1 . 2 .]" 2
407 1 71 GLU H 1 72 CYS H 0.000 . 4.000 2.114 1.783 2.641 . 0 0 "[ . 1 . 2 .]" 2
408 1 73 HIS HA 1 74 SER H 0.000 . 2.500 2.303 2.216 2.505 0.005 16 0 "[ . 1 . 2 .]" 2
409 1 73 HIS QB 1 74 SER H 0.000 . 6.000 3.618 3.284 3.948 . 0 0 "[ . 1 . 2 .]" 2
410 1 73 HIS HD2 1 74 SER H 0.000 . 5.000 4.501 3.300 5.017 0.017 5 0 "[ . 1 . 2 .]" 2
411 1 74 SER H 1 75 ILE QG 0.000 . 6.000 5.043 4.424 5.473 . 0 0 "[ . 1 . 2 .]" 2
412 1 75 ILE HA 1 76 ASN H 0.000 . 5.000 3.223 2.844 3.573 . 0 0 "[ . 1 . 2 .]" 2
413 1 75 ILE HB 1 76 ASN H 0.000 . 5.000 3.809 2.493 4.619 . 0 0 "[ . 1 . 2 .]" 2
414 1 75 ILE MD 1 76 ASN HA 0.000 . 8.500 5.723 3.955 6.478 . 0 0 "[ . 1 . 2 .]" 2
415 1 75 ILE QG 1 76 ASN H 0.000 . 7.000 3.632 1.864 4.529 . 0 0 "[ . 1 . 2 .]" 2
416 1 75 ILE MG 1 76 ASN HA 0.000 . 7.500 4.765 3.924 5.689 . 0 0 "[ . 1 . 2 .]" 2
417 1 75 ILE MG 1 76 ASN H 0.000 . 6.500 4.168 3.817 4.370 . 0 0 "[ . 1 . 2 .]" 2
418 1 76 ASN HA 1 77 SER H 0.000 . 4.000 3.036 2.723 3.208 . 0 0 "[ . 1 . 2 .]" 2
419 1 76 ASN QB 1 77 SER HA 0.000 . 8.000 4.365 4.155 4.946 . 0 0 "[ . 1 . 2 .]" 2
420 1 76 ASN QB 1 77 SER H 0.000 . 6.000 3.729 3.476 4.092 . 0 0 "[ . 1 . 2 .]" 2
421 1 76 ASN H 1 77 SER HG 0.000 . 6.000 3.634 2.423 4.706 . 0 0 "[ . 1 . 2 .]" 2
422 1 76 ASN H 1 77 SER H 0.000 . 4.000 2.348 1.858 3.277 . 0 0 "[ . 1 . 2 .]" 2
423 1 77 SER HA 1 78 ASN H 0.000 . 4.000 3.487 3.062 3.591 . 0 0 "[ . 1 . 2 .]" 2
424 1 77 SER QB 1 78 ASN HA 0.000 . 8.000 4.062 3.746 4.340 . 0 0 "[ . 1 . 2 .]" 2
425 1 77 SER QB 1 78 ASN H 0.000 . 6.000 2.773 1.831 3.741 . 0 0 "[ . 1 . 2 .]" 2
426 1 77 SER HG 1 78 ASN H 0.000 . 6.000 4.334 2.764 5.136 . 0 0 "[ . 1 . 2 .]" 2
427 1 77 SER H 1 78 ASN QB 0.000 . 7.000 4.523 3.814 5.482 . 0 0 "[ . 1 . 2 .]" 2
428 1 77 SER H 1 78 ASN H 0.000 . 4.000 2.731 2.397 3.477 . 0 0 "[ . 1 . 2 .]" 2
429 1 78 ASN HA 1 79 SER H 0.000 . 4.000 3.398 3.198 3.590 . 0 0 "[ . 1 . 2 .]" 2
430 1 78 ASN QB 1 79 SER HA 0.000 . 7.000 4.163 3.912 4.788 . 0 0 "[ . 1 . 2 .]" 2
431 1 78 ASN QB 1 79 SER QB 0.000 . 9.000 4.406 3.663 5.282 . 0 0 "[ . 1 . 2 .]" 2
432 1 78 ASN QB 1 79 SER H 0.000 . 4.000 3.258 2.341 3.749 . 0 0 "[ . 1 . 2 .]" 2
433 1 78 ASN H 1 79 SER QB 0.000 . 7.000 4.019 3.426 4.423 . 0 0 "[ . 1 . 2 .]" 2
434 1 79 SER HA 1 80 VAL HA 0.000 . 6.000 4.768 4.688 4.948 . 0 0 "[ . 1 . 2 .]" 2
435 1 79 SER HA 1 80 VAL H 0.000 . 4.000 3.519 3.453 3.586 . 0 0 "[ . 1 . 2 .]" 2
436 1 79 SER QB 1 80 VAL HA 0.000 . 7.000 4.167 3.845 4.689 . 0 0 "[ . 1 . 2 .]" 2
437 1 79 SER QB 1 80 VAL HB 0.000 . 7.000 4.769 4.148 5.442 . 0 0 "[ . 1 . 2 .]" 2
438 1 79 SER QB 1 80 VAL MG1 0.000 . 9.500 5.199 4.760 5.816 . 0 0 "[ . 1 . 2 .]" 2
439 1 79 SER QB 1 80 VAL MG2 0.000 . 6.500 3.097 2.591 3.958 . 0 0 "[ . 1 . 2 .]" 2
440 1 79 SER QB 1 80 VAL H 0.000 . 4.000 2.856 1.974 3.538 . 0 0 "[ . 1 . 2 .]" 2
441 1 79 SER H 1 80 VAL HB 0.000 . 5.000 4.565 4.195 4.978 . 0 0 "[ . 1 . 2 .]" 2
442 1 79 SER H 1 80 VAL MG2 0.000 . 6.500 3.861 3.367 4.458 . 0 0 "[ . 1 . 2 .]" 2
443 1 79 SER H 1 80 VAL H 0.000 . 3.000 2.499 2.268 2.805 . 0 0 "[ . 1 . 2 .]" 2
444 1 80 VAL HA 1 81 LEU MD2 0.000 . 7.500 4.226 3.836 4.891 . 0 0 "[ . 1 . 2 .]" 2
445 1 80 VAL HA 1 81 LEU H 0.000 . 5.000 3.513 3.459 3.591 . 0 0 "[ . 1 . 2 .]" 2
446 1 80 VAL HB 1 81 LEU H 0.000 . 3.000 2.831 2.285 3.034 0.034 19 0 "[ . 1 . 2 .]" 2
447 1 80 VAL MG1 1 81 LEU HA 0.000 . 5.500 3.653 3.164 4.133 . 0 0 "[ . 1 . 2 .]" 2
448 1 80 VAL MG1 1 81 LEU MD2 0.000 . 7.000 2.563 1.936 3.689 . 0 0 "[ . 1 . 2 .]" 2
449 1 80 VAL MG1 1 81 LEU H 0.000 . 5.500 3.600 3.065 3.980 . 0 0 "[ . 1 . 2 .]" 2
450 1 80 VAL MG2 1 81 LEU H 0.000 . 5.500 3.923 3.737 4.100 . 0 0 "[ . 1 . 2 .]" 2
451 1 80 VAL H 1 81 LEU QB 0.000 . 6.000 4.186 3.914 4.651 . 0 0 "[ . 1 . 2 .]" 2
452 1 80 VAL H 1 81 LEU QD 0.000 . 8.400 3.527 2.804 4.661 . 0 0 "[ . 1 . 2 .]" 2
453 1 80 VAL H 1 81 LEU H 0.000 . 3.000 2.495 2.292 2.972 . 0 0 "[ . 1 . 2 .]" 2
454 1 81 LEU HA 1 82 GLU H 0.000 . 5.000 3.572 3.458 3.599 . 0 0 "[ . 1 . 2 .]" 2
455 1 81 LEU QB 1 82 GLU HA 0.000 . 8.000 3.876 3.765 4.028 . 0 0 "[ . 1 . 2 .]" 2
456 1 81 LEU QB 1 82 GLU H 0.000 . 6.000 2.494 2.140 3.055 . 0 0 "[ . 1 . 2 .]" 2
457 1 81 LEU QD 1 82 GLU H 0.000 . 7.400 3.751 3.516 3.904 . 0 0 "[ . 1 . 2 .]" 2
458 1 81 LEU H 1 82 GLU QB 0.000 . 7.000 4.217 3.886 4.429 . 0 0 "[ . 1 . 2 .]" 2
459 1 81 LEU H 1 82 GLU QG 0.000 . 7.000 5.466 4.322 6.302 . 0 0 "[ . 1 . 2 .]" 2
460 1 81 LEU H 1 82 GLU H 0.000 . 3.000 2.613 2.300 2.801 . 0 0 "[ . 1 . 2 .]" 2
461 1 82 GLU HA 1 83 ARG H 0.000 . 4.000 3.502 3.447 3.586 . 0 0 "[ . 1 . 2 .]" 2
462 1 82 GLU QB 1 83 ARG H 0.000 . 4.000 2.882 2.508 3.019 . 0 0 "[ . 1 . 2 .]" 2
463 1 82 GLU QG 1 83 ARG H 0.000 . 6.000 4.224 3.698 4.539 . 0 0 "[ . 1 . 2 .]" 2
464 1 82 GLU H 1 83 ARG H 0.000 . 3.000 2.710 2.429 3.045 0.045 10 0 "[ . 1 . 2 .]" 2
465 1 83 ARG HA 1 84 LYS QG 0.000 . 8.000 5.700 4.272 6.308 . 0 0 "[ . 1 . 2 .]" 2
466 1 83 ARG HA 1 84 LYS H 0.000 . 4.000 3.516 3.478 3.601 . 0 0 "[ . 1 . 2 .]" 2
467 1 83 ARG QB 1 84 LYS H 0.000 . 5.000 2.946 2.371 3.645 . 0 0 "[ . 1 . 2 .]" 2
468 1 83 ARG H 1 84 LYS HA 0.000 . 6.000 5.103 5.070 5.146 . 0 0 "[ . 1 . 2 .]" 2
469 1 83 ARG H 1 84 LYS QG 0.000 . 7.000 5.667 3.870 6.155 . 0 0 "[ . 1 . 2 .]" 2
470 1 83 ARG H 1 84 LYS H 0.000 . 3.000 2.365 2.308 2.484 . 0 0 "[ . 1 . 2 .]" 2
471 1 84 LYS HA 1 85 CYS H 0.000 . 4.000 2.924 2.660 3.568 . 0 0 "[ . 1 . 2 .]" 2
472 1 84 LYS QB 1 85 CYS H 0.000 . 5.000 3.796 2.447 4.075 . 0 0 "[ . 1 . 2 .]" 2
473 1 84 LYS QG 1 85 CYS H 0.000 . 6.000 4.370 3.749 4.855 . 0 0 "[ . 1 . 2 .]" 2
474 1 84 LYS H 1 85 CYS HA 0.000 . 6.000 5.014 4.818 5.324 . 0 0 "[ . 1 . 2 .]" 2
475 1 84 LYS H 1 85 CYS H 0.000 . 3.000 2.794 2.070 3.057 0.057 23 0 "[ . 1 . 2 .]" 2
476 1 85 CYS HA 1 86 ILE HA 0.000 . 7.000 4.743 4.433 4.930 . 0 0 "[ . 1 . 2 .]" 2
477 1 85 CYS HA 1 86 ILE H 0.000 . 5.000 3.406 2.547 3.592 . 0 0 "[ . 1 . 2 .]" 2
478 1 85 CYS QB 1 86 ILE HA 0.000 . 8.000 3.972 3.737 4.391 . 0 0 "[ . 1 . 2 .]" 2
479 1 85 CYS QB 1 86 ILE H 0.000 . 6.000 2.688 1.836 3.942 . 0 0 "[ . 1 . 2 .]" 2
480 1 85 CYS H 1 86 ILE HB 0.000 . 5.000 3.774 3.370 4.634 . 0 0 "[ . 1 . 2 .]" 2
481 1 85 CYS H 1 86 ILE MD 0.000 . 6.500 4.660 2.557 5.265 . 0 0 "[ . 1 . 2 .]" 2
482 1 86 ILE HA 1 87 GLY H 0.000 . 4.000 2.235 2.196 2.406 . 0 0 "[ . 1 . 2 .]" 2
483 1 86 ILE MD 1 87 GLY H 0.000 . 6.500 4.981 3.263 5.468 . 0 0 "[ . 1 . 2 .]" 2
484 1 86 ILE QG 1 87 GLY H 0.000 . 6.000 4.171 3.842 4.709 . 0 0 "[ . 1 . 2 .]" 2
485 1 86 ILE MG 1 87 GLY QA 0.000 . 7.500 3.184 3.001 3.444 . 0 0 "[ . 1 . 2 .]" 2
486 1 86 ILE MG 1 87 GLY H 0.000 . 5.500 2.931 2.322 3.570 . 0 0 "[ . 1 . 2 .]" 2
487 1 86 ILE H 1 87 GLY H 0.000 . 6.000 4.414 3.568 4.654 . 0 0 "[ . 1 . 2 .]" 2
488 1 87 GLY QA 1 88 LEU H 0.000 . 4.000 2.922 2.806 2.956 . 0 0 "[ . 1 . 2 .]" 2
489 1 87 GLY H 1 88 LEU HG 0.000 . 6.000 4.402 3.914 4.823 . 0 0 "[ . 1 . 2 .]" 2
490 1 87 GLY H 1 88 LEU H 0.000 . 3.000 2.120 1.852 2.366 . 0 0 "[ . 1 . 2 .]" 2
491 1 88 LEU QB 1 89 GLU H 0.000 . 5.000 3.018 2.659 3.294 . 0 0 "[ . 1 . 2 .]" 2
492 1 88 LEU MD1 1 89 GLU H 0.000 . 6.500 5.076 4.840 5.267 . 0 0 "[ . 1 . 2 .]" 2
493 1 88 LEU MD2 1 89 GLU H 0.000 . 5.500 3.638 3.086 4.462 . 0 0 "[ . 1 . 2 .]" 2
494 1 88 LEU H 1 89 GLU HA 0.000 . 6.000 4.944 4.818 5.254 . 0 0 "[ . 1 . 2 .]" 2
495 1 88 LEU H 1 89 GLU H 0.000 . 5.000 4.432 4.303 4.566 . 0 0 "[ . 1 . 2 .]" 2
496 1 89 GLU HA 1 90 ARG H 0.000 . 4.000 3.445 3.219 3.529 . 0 0 "[ . 1 . 2 .]" 2
497 1 89 GLU QB 1 90 ARG H 0.000 . 5.000 3.118 2.583 3.895 . 0 0 "[ . 1 . 2 .]" 2
498 1 89 GLU QG 1 90 ARG H 0.000 . 7.000 3.669 1.823 4.594 . 0 0 "[ . 1 . 2 .]" 2
499 1 89 GLU H 1 90 ARG HA 0.000 . 6.000 5.245 5.098 5.309 . 0 0 "[ . 1 . 2 .]" 2
500 1 89 GLU H 1 90 ARG H 0.000 . 2.500 2.528 2.343 2.591 0.091 14 0 "[ . 1 . 2 .]" 2
501 1 90 ARG HA 1 91 CYS H 0.000 . 2.500 2.331 2.195 2.497 . 0 0 "[ . 1 . 2 .]" 2
502 1 90 ARG QB 1 91 CYS H 0.000 . 4.000 3.300 2.595 3.784 . 0 0 "[ . 1 . 2 .]" 2
503 1 90 ARG QG 1 91 CYS H 0.000 . 6.000 3.038 1.868 4.461 . 0 0 "[ . 1 . 2 .]" 2
504 1 90 ARG H 1 91 CYS QB 0.000 . 7.000 4.682 3.900 5.261 . 0 0 "[ . 1 . 2 .]" 2
505 1 90 ARG H 1 91 CYS H 0.000 . 5.000 4.358 4.015 4.558 . 0 0 "[ . 1 . 2 .]" 2
506 1 91 CYS HA 1 92 VAL QG 0.000 . 8.400 3.572 3.037 3.911 . 0 0 "[ . 1 . 2 .]" 2
507 1 91 CYS HA 1 92 VAL H 0.000 . 2.500 2.254 2.196 2.331 . 0 0 "[ . 1 . 2 .]" 2
508 1 91 CYS QB 1 92 VAL H 0.000 . 5.000 3.414 2.708 4.017 . 0 0 "[ . 1 . 2 .]" 2
509 1 91 CYS H 1 92 VAL QG 0.000 . 7.400 4.050 3.080 5.196 . 0 0 "[ . 1 . 2 .]" 2
510 1 91 CYS H 1 92 VAL H 0.000 . 5.000 4.328 3.748 4.535 . 0 0 "[ . 1 . 2 .]" 2
511 1 92 VAL HA 1 93 VAL MG2 0.000 . 7.500 3.562 3.042 3.948 . 0 0 "[ . 1 . 2 .]" 2
512 1 92 VAL HA 1 93 VAL H 0.000 . 2.500 2.251 2.202 2.365 . 0 0 "[ . 1 . 2 .]" 2
513 1 92 VAL HB 1 93 VAL H 0.000 . 5.000 4.325 3.769 4.536 . 0 0 "[ . 1 . 2 .]" 2
514 1 92 VAL QG 1 93 VAL HA 0.000 . 7.400 3.587 3.136 4.147 . 0 0 "[ . 1 . 2 .]" 2
515 1 92 VAL QG 1 93 VAL H 0.000 . 5.400 2.708 2.035 3.227 . 0 0 "[ . 1 . 2 .]" 2
516 1 92 VAL H 1 93 VAL MG2 0.000 . 6.500 3.539 3.068 4.184 . 0 0 "[ . 1 . 2 .]" 2
517 1 92 VAL H 1 93 VAL H 0.000 . 5.000 4.253 3.891 4.572 . 0 0 "[ . 1 . 2 .]" 2
518 1 93 VAL HA 1 94 ALA MB 0.000 . 5.500 3.907 3.723 4.002 . 0 0 "[ . 1 . 2 .]" 2
519 1 93 VAL HA 1 94 ALA H 0.000 . 2.500 2.255 2.197 2.430 . 0 0 "[ . 1 . 2 .]" 2
520 1 93 VAL HB 1 94 ALA H 0.000 . 6.000 4.190 3.581 4.458 . 0 0 "[ . 1 . 2 .]" 2
521 1 93 VAL MG1 1 94 ALA MB 0.000 . 8.000 3.836 3.312 4.187 . 0 0 "[ . 1 . 2 .]" 2
522 1 93 VAL MG1 1 94 ALA H 0.000 . 5.500 2.649 1.831 3.285 . 0 0 "[ . 1 . 2 .]" 2
523 1 93 VAL MG2 1 94 ALA MB 0.000 . 9.000 5.217 5.004 5.357 . 0 0 "[ . 1 . 2 .]" 2
524 1 93 VAL MG2 1 94 ALA H 0.000 . 6.500 4.098 3.838 4.322 . 0 0 "[ . 1 . 2 .]" 2
525 1 93 VAL H 1 94 ALA MB 0.000 . 7.500 5.257 4.982 5.490 . 0 0 "[ . 1 . 2 .]" 2
526 1 93 VAL H 1 94 ALA H 0.000 . 5.000 4.319 3.864 4.558 . 0 0 "[ . 1 . 2 .]" 2
527 1 94 ALA HA 1 95 ILE MD 0.000 . 7.500 4.395 3.366 4.972 . 0 0 "[ . 1 . 2 .]" 2
528 1 94 ALA HA 1 95 ILE H 0.000 . 3.000 2.311 2.215 2.495 . 0 0 "[ . 1 . 2 .]" 2
529 1 94 ALA MB 1 95 ILE MG 0.000 . 10.000 5.253 5.053 5.422 . 0 0 "[ . 1 . 2 .]" 2
530 1 94 ALA MB 1 95 ILE H 0.000 . 5.500 2.993 2.448 3.688 . 0 0 "[ . 1 . 2 .]" 2
531 1 95 ILE HA 1 96 SER H 0.000 . 2.500 2.253 2.199 2.585 0.085 16 0 "[ . 1 . 2 .]" 2
532 1 95 ILE HB 1 96 SER H 0.000 . 5.000 4.295 3.847 4.505 . 0 0 "[ . 1 . 2 .]" 2
533 1 95 ILE MD 1 96 SER H 0.000 . 6.500 5.326 4.989 5.505 . 0 0 "[ . 1 . 2 .]" 2
534 1 95 ILE QG 1 96 SER H 0.000 . 7.000 4.292 4.030 4.454 . 0 0 "[ . 1 . 2 .]" 2
535 1 95 ILE MG 1 96 SER H 0.000 . 5.500 2.910 2.208 3.903 . 0 0 "[ . 1 . 2 .]" 2
536 1 95 ILE H 1 96 SER H 0.000 . 5.000 4.360 3.351 4.668 . 0 0 "[ . 1 . 2 .]" 2
537 1 96 SER HA 1 97 PRO QD 0.000 . 6.000 2.153 2.015 2.322 . 0 0 "[ . 1 . 2 .]" 2
538 1 96 SER HA 1 97 PRO QG 0.000 . 7.000 4.101 3.962 4.267 . 0 0 "[ . 1 . 2 .]" 2
539 1 96 SER QB 1 97 PRO QD 0.000 . 8.000 2.064 1.819 3.058 . 0 0 "[ . 1 . 2 .]" 2
540 1 96 SER QB 1 97 PRO QG 0.000 . 9.000 3.865 3.422 4.614 . 0 0 "[ . 1 . 2 .]" 2
541 1 96 SER H 1 97 PRO HA 0.000 . 6.000 4.921 4.778 5.283 . 0 0 "[ . 1 . 2 .]" 2
542 1 97 PRO QG 1 98 SER QB 0.000 . 8.000 3.439 2.916 4.227 . 0 0 "[ . 1 . 2 .]" 2
543 1 98 SER HA 1 99 ASN HA 0.000 . 6.000 4.602 4.448 4.963 . 0 0 "[ . 1 . 2 .]" 2
544 1 98 SER QB 1 99 ASN HA 0.000 . 7.000 4.320 3.906 4.742 . 0 0 "[ . 1 . 2 .]" 2
545 1 98 SER QB 1 99 ASN QB 0.000 . 9.000 4.398 3.868 4.894 . 0 0 "[ . 1 . 2 .]" 2
546 1 99 ASN HA 1 100 PHE H 0.000 . 5.000 3.498 3.314 3.589 . 0 0 "[ . 1 . 2 .]" 2
547 1 99 ASN QB 1 100 PHE HA 0.000 . 6.000 4.155 3.878 4.713 . 0 0 "[ . 1 . 2 .]" 2
548 1 99 ASN QB 1 100 PHE QD 0.000 . 8.000 2.561 1.902 4.702 . 0 0 "[ . 1 . 2 .]" 2
549 1 99 ASN QB 1 100 PHE QE 0.000 . 9.000 3.494 2.762 5.224 . 0 0 "[ . 1 . 2 .]" 2
550 1 99 ASN QB 1 100 PHE H 0.000 . 6.000 2.822 2.347 3.720 . 0 0 "[ . 1 . 2 .]" 2
551 1 99 ASN H 1 100 PHE H 0.000 . 5.000 2.128 1.846 2.857 . 0 0 "[ . 1 . 2 .]" 2
552 1 100 PHE HA 1 101 GLY H 0.000 . 6.000 3.537 3.244 3.603 . 0 0 "[ . 1 . 2 .]" 2
553 1 100 PHE H 1 101 GLY QA 0.000 . 6.000 4.353 4.082 4.580 . 0 0 "[ . 1 . 2 .]" 2
554 1 100 PHE H 1 101 GLY H 0.000 . 5.000 2.622 1.981 3.229 . 0 0 "[ . 1 . 2 .]" 2
555 1 101 GLY QA 1 102 GLY H 0.000 . 5.000 2.691 2.483 2.938 . 0 0 "[ . 1 . 2 .]" 2
556 1 101 GLY H 1 102 GLY H 0.000 . 2.500 2.221 1.861 2.521 0.021 9 0 "[ . 1 . 2 .]" 2
557 1 103 ASP HA 1 104 PRO QB 0.000 . 8.000 4.618 4.517 4.991 . 0 0 "[ . 1 . 2 .]" 2
558 1 103 ASP HA 1 104 PRO QD 0.000 . 7.000 1.969 1.853 2.391 . 0 0 "[ . 1 . 2 .]" 2
559 1 103 ASP QB 1 104 PRO QD 0.000 . 9.000 3.114 2.227 3.809 . 0 0 "[ . 1 . 2 .]" 2
560 1 104 PRO HA 1 105 CYS H 0.000 . 4.000 3.548 3.377 3.606 . 0 0 "[ . 1 . 2 .]" 2
561 1 104 PRO QB 1 105 CYS H 0.000 . 6.000 2.387 1.849 3.679 . 0 0 "[ . 1 . 2 .]" 2
562 1 104 PRO QD 1 105 CYS H 0.000 . 5.000 2.840 2.089 3.434 . 0 0 "[ . 1 . 2 .]" 2
563 1 105 CYS HA 1 106 PRO QB 0.000 . 7.000 4.609 4.508 4.960 . 0 0 "[ . 1 . 2 .]" 2
564 1 105 CYS HA 1 106 PRO QD 0.000 . 6.000 1.942 1.834 2.328 . 0 0 "[ . 1 . 2 .]" 2
565 1 105 CYS HA 1 106 PRO QG 0.000 . 6.000 3.872 3.795 4.239 . 0 0 "[ . 1 . 2 .]" 2
566 1 105 CYS QB 1 106 PRO QD 0.000 . 8.000 3.201 2.343 3.814 . 0 0 "[ . 1 . 2 .]" 2
567 1 105 CYS H 1 106 PRO HA 0.000 . 6.000 5.009 4.493 5.524 . 0 0 "[ . 1 . 2 .]" 2
568 1 105 CYS H 1 106 PRO QD 0.000 . 5.000 4.012 2.742 4.402 . 0 0 "[ . 1 . 2 .]" 2
569 1 106 PRO HA 1 107 GLU H 0.000 . 2.500 2.405 2.193 2.645 0.145 10 0 "[ . 1 . 2 .]" 2
570 1 106 PRO QB 1 107 GLU H 0.000 . 6.000 2.836 2.094 3.892 . 0 0 "[ . 1 . 2 .]" 2
571 1 106 PRO QD 1 107 GLU H 0.000 . 7.000 4.842 4.437 5.001 . 0 0 "[ . 1 . 2 .]" 2
572 1 107 GLU HA 1 108 VAL MG1 0.000 . 8.500 5.883 5.770 6.035 . 0 0 "[ . 1 . 2 .]" 2
573 1 107 GLU HA 1 108 VAL MG2 0.000 . 5.500 4.307 4.163 4.492 . 0 0 "[ . 1 . 2 .]" 2
574 1 107 GLU HA 1 108 VAL H 0.000 . 4.000 3.035 2.788 3.465 . 0 0 "[ . 1 . 2 .]" 2
575 1 107 GLU QB 1 108 VAL MG2 0.000 . 6.500 3.146 2.842 3.917 . 0 0 "[ . 1 . 2 .]" 2
576 1 107 GLU QB 1 108 VAL H 0.000 . 5.000 3.718 3.461 4.059 . 0 0 "[ . 1 . 2 .]" 2
577 1 107 GLU H 1 108 VAL HA 0.000 . 6.000 5.402 4.477 5.586 . 0 0 "[ . 1 . 2 .]" 2
578 1 107 GLU H 1 108 VAL MG2 0.000 . 6.500 4.378 3.776 4.600 . 0 0 "[ . 1 . 2 .]" 2
579 1 107 GLU H 1 108 VAL H 0.000 . 3.000 2.767 1.845 3.080 0.080 24 0 "[ . 1 . 2 .]" 2
580 1 108 VAL HA 1 109 MET H 0.000 . 2.500 2.285 2.217 2.452 . 0 0 "[ . 1 . 2 .]" 2
581 1 108 VAL MG1 1 109 MET HA 0.000 . 7.500 4.187 3.630 4.596 . 0 0 "[ . 1 . 2 .]" 2
582 1 108 VAL MG1 1 109 MET H 0.000 . 5.500 2.635 1.854 3.715 . 0 0 "[ . 1 . 2 .]" 2
583 1 108 VAL MG2 1 109 MET H 0.000 . 6.500 3.986 3.627 4.305 . 0 0 "[ . 1 . 2 .]" 2
584 1 108 VAL H 1 109 MET H 0.000 . 5.000 4.305 3.559 4.629 . 0 0 "[ . 1 . 2 .]" 2
585 1 109 MET HA 1 110 LYS H 0.000 . 3.000 2.392 2.200 2.979 . 0 0 "[ . 1 . 2 .]" 2
586 1 109 MET QB 1 110 LYS H 0.000 . 7.000 3.091 1.849 4.013 . 0 0 "[ . 1 . 2 .]" 2
587 1 109 MET H 1 110 LYS H 0.000 . 6.000 4.504 3.715 4.725 . 0 0 "[ . 1 . 2 .]" 2
588 1 110 LYS HA 1 111 ARG H 0.000 . 3.000 2.308 2.181 2.709 . 0 0 "[ . 1 . 2 .]" 2
589 1 110 LYS QB 1 111 ARG H 0.000 . 7.000 3.398 2.402 3.949 . 0 0 "[ . 1 . 2 .]" 2
590 1 110 LYS QG 1 111 ARG H 0.000 . 6.000 3.923 2.786 4.492 . 0 0 "[ . 1 . 2 .]" 2
591 1 110 LYS H 1 111 ARG H 0.000 . 5.000 4.133 2.491 4.631 . 0 0 "[ . 1 . 2 .]" 2
592 1 111 ARG HA 1 112 VAL H 0.000 . 2.500 2.357 2.222 2.502 0.002 2 0 "[ . 1 . 2 .]" 2
593 1 111 ARG QB 1 112 VAL H 0.000 . 5.000 3.150 2.530 3.837 . 0 0 "[ . 1 . 2 .]" 2
594 1 111 ARG QD 1 112 VAL H 0.000 . 7.000 4.590 2.581 5.438 . 0 0 "[ . 1 . 2 .]" 2
595 1 111 ARG H 1 112 VAL H 0.000 . 6.000 4.384 3.701 4.574 . 0 0 "[ . 1 . 2 .]" 2
596 1 112 VAL HA 1 113 ALA H 0.000 . 2.500 2.226 2.170 2.362 . 0 0 "[ . 1 . 2 .]" 2
597 1 112 VAL HB 1 113 ALA H 0.000 . 5.000 4.311 3.816 4.543 . 0 0 "[ . 1 . 2 .]" 2
598 1 112 VAL MG1 1 113 ALA MB 0.000 . 7.000 4.206 3.827 4.502 . 0 0 "[ . 1 . 2 .]" 2
599 1 112 VAL MG1 1 113 ALA H 0.000 . 4.500 2.853 2.027 3.320 . 0 0 "[ . 1 . 2 .]" 2
600 1 112 VAL MG2 1 113 ALA H 0.000 . 5.500 4.036 3.695 4.339 . 0 0 "[ . 1 . 2 .]" 2
601 1 112 VAL H 1 113 ALA MB 0.000 . 7.500 4.699 4.473 4.880 . 0 0 "[ . 1 . 2 .]" 2
602 1 112 VAL H 1 113 ALA H 0.000 . 5.000 4.326 4.041 4.550 . 0 0 "[ . 1 . 2 .]" 2
603 1 113 ALA HA 1 114 VAL H 0.000 . 2.500 2.259 2.228 2.329 . 0 0 "[ . 1 . 2 .]" 2
604 1 113 ALA MB 1 114 VAL H 0.000 . 5.500 3.265 2.981 3.541 . 0 0 "[ . 1 . 2 .]" 2
605 1 113 ALA H 1 114 VAL MG2 0.000 . 7.500 3.475 2.994 3.943 . 0 0 "[ . 1 . 2 .]" 2
606 1 113 ALA H 1 114 VAL H 0.000 . 6.000 4.318 3.747 4.539 . 0 0 "[ . 1 . 2 .]" 2
607 1 114 VAL HA 1 115 GLU H 0.000 . 2.500 2.309 2.199 2.433 . 0 0 "[ . 1 . 2 .]" 2
608 1 114 VAL HB 1 115 GLU H 0.000 . 6.000 4.019 3.798 4.413 . 0 0 "[ . 1 . 2 .]" 2
609 1 114 VAL MG1 1 115 GLU HA 0.000 . 7.500 3.335 3.123 3.663 . 0 0 "[ . 1 . 2 .]" 2
610 1 114 VAL MG1 1 115 GLU H 0.000 . 5.500 2.159 1.849 2.875 . 0 0 "[ . 1 . 2 .]" 2
611 1 114 VAL MG2 1 115 GLU H 0.000 . 6.500 3.653 3.481 3.925 . 0 0 "[ . 1 . 2 .]" 2
612 1 114 VAL H 1 115 GLU H 0.000 . 6.000 4.429 4.174 4.544 . 0 0 "[ . 1 . 2 .]" 2
613 1 115 GLU HA 1 116 ALA H 0.000 . 3.000 2.274 2.224 2.449 . 0 0 "[ . 1 . 2 .]" 2
614 1 115 GLU QB 1 116 ALA H 0.000 . 5.000 3.638 2.742 3.961 . 0 0 "[ . 1 . 2 .]" 2
615 1 115 GLU QG 1 116 ALA H 0.000 . 5.000 3.261 2.627 4.336 . 0 0 "[ . 1 . 2 .]" 2
616 1 115 GLU H 1 116 ALA H 0.000 . 6.000 4.231 3.798 4.544 . 0 0 "[ . 1 . 2 .]" 2
617 1 116 ALA HA 1 117 VAL QG 0.000 . 6.400 3.339 3.019 3.666 . 0 0 "[ . 1 . 2 .]" 2
618 1 116 ALA HA 1 117 VAL H 0.000 . 2.500 2.363 2.264 2.425 . 0 0 "[ . 1 . 2 .]" 2
619 1 116 ALA MB 1 117 VAL HA 0.000 . 6.500 4.131 4.027 4.207 . 0 0 "[ . 1 . 2 .]" 2
620 1 116 ALA MB 1 117 VAL H 0.000 . 4.500 2.681 2.479 2.943 . 0 0 "[ . 1 . 2 .]" 2
621 1 116 ALA H 1 117 VAL HA 0.000 . 6.000 5.019 4.724 5.157 . 0 0 "[ . 1 . 2 .]" 2
622 1 116 ALA H 1 117 VAL H 0.000 . 6.000 4.541 4.419 4.582 . 0 0 "[ . 1 . 2 .]" 2
623 1 117 VAL HA 1 118 CYS H 0.000 . 2.500 2.247 2.215 2.363 . 0 0 "[ . 1 . 2 .]" 2
624 1 117 VAL HB 1 118 CYS H 0.000 . 5.000 4.346 3.927 4.544 . 0 0 "[ . 1 . 2 .]" 2
625 1 117 VAL QG 1 118 CYS H 0.000 . 5.400 2.867 1.858 3.195 . 0 0 "[ . 1 . 2 .]" 2
626 1 117 VAL MG1 1 118 CYS QB 0.000 . 8.500 4.435 3.874 4.778 . 0 0 "[ . 1 . 2 .]" 2
627 1 117 VAL H 1 118 CYS H 0.000 . 5.000 4.298 4.058 4.554 . 0 0 "[ . 1 . 2 .]" 2
628 1 118 CYS HA 1 119 SER H 0.000 . 2.500 2.246 2.187 2.370 . 0 0 "[ . 1 . 2 .]" 2
629 1 118 CYS QB 1 119 SER H 0.000 . 6.000 3.331 2.792 3.821 . 0 0 "[ . 1 . 2 .]" 2
630 1 118 CYS H 1 119 SER H 0.000 . 5.000 4.475 4.261 4.578 . 0 0 "[ . 1 . 2 .]" 2
631 1 119 SER HA 1 120 THR MG 0.000 . 7.500 3.600 3.121 4.223 . 0 0 "[ . 1 . 2 .]" 2
632 1 119 SER QB 1 120 THR HA 0.000 . 8.000 4.717 4.214 5.597 . 0 0 "[ . 1 . 2 .]" 2
633 1 119 SER QB 1 120 THR MG 0.000 . 9.500 4.000 2.373 4.869 . 0 0 "[ . 1 . 2 .]" 2
634 1 120 THR HA 1 121 ALA H 0.000 . 3.000 2.500 2.208 3.194 0.194 25 0 "[ . 1 . 2 .]" 2
635 1 120 THR HB 1 121 ALA H 0.000 . 4.000 3.244 1.960 4.229 0.229 20 0 "[ . 1 . 2 .]" 2
636 1 121 ALA HA 1 122 ALA MB 0.000 . 8.500 3.976 3.683 4.302 . 0 0 "[ . 1 . 2 .]" 2
637 1 121 ALA HA 1 122 ALA H 0.000 . 2.500 2.381 2.210 2.544 0.044 13 0 "[ . 1 . 2 .]" 2
638 1 121 ALA MB 1 122 ALA H 0.000 . 4.500 3.196 2.497 3.727 . 0 0 "[ . 1 . 2 .]" 2
639 1 121 ALA H 1 122 ALA H 0.000 . 6.000 4.160 3.154 4.688 . 0 0 "[ . 1 . 2 .]" 2
640 1 5 ARG QG 1 7 VAL HB 0.000 . 8.000 6.056 4.113 7.151 . 0 0 "[ . 1 . 2 .]" 2
641 1 7 VAL QG 1 9 GLY QA 0.000 . 9.400 4.696 3.271 5.961 . 0 0 "[ . 1 . 2 .]" 2
642 1 12 ALA HA 1 14 VAL MG2 0.000 . 6.500 4.257 3.874 5.223 . 0 0 "[ . 1 . 2 .]" 2
643 1 12 ALA MB 1 14 VAL MG2 0.000 . 6.000 3.337 2.733 3.920 . 0 0 "[ . 1 . 2 .]" 2
644 1 16 GLU QG 1 18 HIS HD2 0.000 . 8.000 6.441 4.419 7.230 . 0 0 "[ . 1 . 2 .]" 2
645 1 17 TYR QD 1 19 PRO HA 0.000 . 8.000 4.941 3.102 6.463 . 0 0 "[ . 1 . 2 .]" 2
646 1 17 TYR QE 1 19 PRO HA 0.000 . 7.000 4.507 2.263 6.198 . 0 0 "[ . 1 . 2 .]" 2
647 1 17 TYR QE 1 19 PRO QB 0.000 . 9.000 4.117 2.075 6.701 . 0 0 "[ . 1 . 2 .]" 2
648 1 17 TYR QE 1 19 PRO QD 0.000 . 10.000 3.759 2.047 6.334 . 0 0 "[ . 1 . 2 .]" 2
649 1 17 TYR QE 1 21 ILE MD 0.000 . 9.500 5.337 2.894 7.144 . 0 0 "[ . 1 . 2 .]" 2
650 1 18 HIS QB 1 21 ILE MD 0.000 . 7.500 4.720 2.132 5.667 . 0 0 "[ . 1 . 2 .]" 2
651 1 18 HIS HD2 1 20 ASN H 0.000 . 7.000 5.046 2.845 7.031 0.031 20 0 "[ . 1 . 2 .]" 2
652 1 18 HIS HD2 1 21 ILE MD 0.000 . 7.500 4.367 2.289 6.129 . 0 0 "[ . 1 . 2 .]" 2
653 1 18 HIS HD2 1 21 ILE QG 0.000 . 8.000 5.395 2.639 7.208 . 0 0 "[ . 1 . 2 .]" 2
654 1 18 HIS HE1 1 20 ASN HA 0.000 . 7.000 5.119 2.657 6.977 . 0 0 "[ . 1 . 2 .]" 2
655 1 18 HIS HE1 1 20 ASN QB 0.000 . 7.000 5.083 2.433 6.323 . 0 0 "[ . 1 . 2 .]" 2
656 1 21 ILE HB 1 24 TRP QB 0.000 . 7.000 4.554 1.903 5.992 . 0 0 "[ . 1 . 2 .]" 2
657 1 21 ILE MD 1 24 TRP QB 0.000 . 7.500 4.604 3.380 5.495 . 0 0 "[ . 1 . 2 .]" 2
658 1 21 ILE MD 1 24 TRP HD1 0.000 . 8.500 5.497 2.489 7.097 . 0 0 "[ . 1 . 2 .]" 2
659 1 21 ILE MD 1 24 TRP HZ3 0.000 . 8.500 6.292 2.273 7.084 . 0 0 "[ . 1 . 2 .]" 2
660 1 21 ILE MG 1 23 ASN QB 0.000 . 9.500 4.933 2.726 6.858 . 0 0 "[ . 1 . 2 .]" 2
661 1 21 ILE MG 1 24 TRP QB 0.000 . 7.500 3.533 1.936 5.539 . 0 0 "[ . 1 . 2 .]" 2
662 1 21 ILE MG 1 24 TRP HD1 0.000 . 8.500 4.700 2.534 7.054 . 0 0 "[ . 1 . 2 .]" 2
663 1 21 ILE MG 1 24 TRP HE3 0.000 . 8.500 4.661 2.680 6.861 . 0 0 "[ . 1 . 2 .]" 2
664 1 21 ILE MG 1 24 TRP HH2 0.000 . 9.500 6.447 4.175 7.898 . 0 0 "[ . 1 . 2 .]" 2
665 1 21 ILE MG 1 24 TRP HZ2 0.000 . 9.500 6.031 2.045 7.794 . 0 0 "[ . 1 . 2 .]" 2
666 1 22 LYS HA 1 24 TRP HD1 0.000 . 8.000 6.905 4.832 8.094 0.094 19 0 "[ . 1 . 2 .]" 2
667 1 24 TRP HD1 1 26 ILE MD 0.000 . 8.500 5.803 3.090 6.963 . 0 0 "[ . 1 . 2 .]" 2
668 1 25 GLN HA 1 29 TYR QD 0.000 . 9.000 6.143 3.152 7.990 . 0 0 "[ . 1 . 2 .]" 2
669 1 25 GLN QB 1 29 TYR QE 0.000 . 10.000 5.686 2.240 7.732 . 0 0 "[ . 1 . 2 .]" 2
670 1 26 ILE MG 1 28 SER HA 0.000 . 8.500 6.298 4.024 7.097 . 0 0 "[ . 1 . 2 .]" 2
671 1 27 GLU QB 1 29 TYR QE 0.000 . 10.000 4.817 1.762 7.219 . 0 0 "[ . 1 . 2 .]" 2
672 1 27 GLU QG 1 29 TYR QE 0.000 . 9.000 5.287 3.102 7.081 . 0 0 "[ . 1 . 2 .]" 2
673 1 32 PRO HA 1 34 PHE QD 0.000 . 9.000 6.383 3.465 7.999 . 0 0 "[ . 1 . 2 .]" 2
674 1 34 PHE QD 1 36 THR HB 0.000 . 9.000 5.651 3.662 7.635 . 0 0 "[ . 1 . 2 .]" 2
675 1 34 PHE QD 1 36 THR MG 0.000 . 9.500 4.469 1.973 6.321 . 0 0 "[ . 1 . 2 .]" 2
676 1 34 PHE QE 1 36 THR HA 0.000 . 9.000 5.670 3.479 7.666 . 0 0 "[ . 1 . 2 .]" 2
677 1 34 PHE QE 1 36 THR MG 0.000 . 9.500 4.676 3.011 6.226 . 0 0 "[ . 1 . 2 .]" 2
678 1 34 PHE HZ 1 36 THR MG 0.000 . 8.500 6.216 4.130 7.070 . 0 0 "[ . 1 . 2 .]" 2
679 1 38 LYS QB 1 40 HIS H 0.000 . 7.000 5.205 4.502 5.611 . 0 0 "[ . 1 . 2 .]" 2
680 1 38 LYS QB 1 40 HIS HE1 0.000 . 8.000 4.791 1.867 7.023 . 0 0 "[ . 1 . 2 .]" 2
681 1 38 LYS QD 1 40 HIS HE1 0.000 . 8.000 5.631 2.204 7.140 . 0 0 "[ . 1 . 2 .]" 2
682 1 39 VAL MG1 1 41 LEU HG 0.000 . 4.500 2.695 2.090 3.479 . 0 0 "[ . 1 . 2 .]" 2
683 1 40 HIS HD2 1 42 LYS QB 0.000 . 7.000 5.021 3.204 5.944 . 0 0 "[ . 1 . 2 .]" 2
684 1 40 HIS HD2 1 42 LYS QG 0.000 . 8.000 5.433 2.658 6.882 . 0 0 "[ . 1 . 2 .]" 2
685 1 41 LEU QB 1 43 CYS HA 0.000 . 8.000 6.359 5.408 6.990 . 0 0 "[ . 1 . 2 .]" 2
686 1 43 CYS HA 1 47 GLN QB 0.000 . 7.000 4.676 4.088 5.509 . 0 0 "[ . 1 . 2 .]" 2
687 1 43 CYS QB 1 47 GLN HA 0.000 . 8.000 5.106 4.405 5.799 . 0 0 "[ . 1 . 2 .]" 2
688 1 43 CYS QB 1 47 GLN QB 0.000 . 8.000 2.846 2.068 3.839 . 0 0 "[ . 1 . 2 .]" 2
689 1 43 CYS QB 1 47 GLN QG 0.000 . 8.000 4.730 3.759 5.707 . 0 0 "[ . 1 . 2 .]" 2
690 1 43 CYS QB 1 47 GLN H 0.000 . 6.000 4.236 3.761 4.817 . 0 0 "[ . 1 . 2 .]" 2
691 1 43 CYS H 1 47 GLN QB 0.000 . 7.000 5.649 5.023 6.258 . 0 0 "[ . 1 . 2 .]" 2
692 1 44 ALA MB 1 47 GLN QB 0.000 . 7.500 2.865 1.815 3.678 . 0 0 "[ . 1 . 2 .]" 2
693 1 44 ALA MB 1 47 GLN QE 0.000 . 7.500 2.762 1.824 4.162 . 0 0 "[ . 1 . 2 .]" 2
694 1 44 ALA MB 1 47 GLN QG 0.000 . 7.500 3.272 1.806 4.194 . 0 0 "[ . 1 . 2 .]" 2
695 1 44 ALA MB 1 47 GLN H 0.000 . 6.500 3.552 3.022 4.200 . 0 0 "[ . 1 . 2 .]" 2
696 1 44 ALA H 1 47 GLN QB 0.000 . 5.000 3.376 2.845 3.986 . 0 0 "[ . 1 . 2 .]" 2
697 1 44 ALA H 1 47 GLN QG 0.000 . 6.000 4.785 3.500 5.423 . 0 0 "[ . 1 . 2 .]" 2
698 1 44 ALA H 1 47 GLN H 0.000 . 5.000 4.867 4.207 5.035 0.035 7 0 "[ . 1 . 2 .]" 2
699 1 45 PRO HA 1 47 GLN H 0.000 . 4.000 3.740 3.145 4.027 0.027 5 0 "[ . 1 . 2 .]" 2
700 1 49 ILE HA 1 51 ALA H 0.000 . 4.000 3.769 3.349 4.082 0.082 24 0 "[ . 1 . 2 .]" 2
701 1 49 ILE HA 1 52 ILE MD 0.000 . 8.500 5.351 4.892 5.880 . 0 0 "[ . 1 . 2 .]" 2
702 1 49 ILE MG 1 51 ALA HA 0.000 . 6.500 4.155 3.689 4.494 . 0 0 "[ . 1 . 2 .]" 2
703 1 49 ILE MG 1 51 ALA MB 0.000 . 8.000 4.264 4.058 4.510 . 0 0 "[ . 1 . 2 .]" 2
704 1 49 ILE MG 1 51 ALA H 0.000 . 4.500 2.411 1.904 2.902 . 0 0 "[ . 1 . 2 .]" 2
705 1 49 ILE MG 1 52 ILE MD 0.000 . 5.500 2.411 1.999 3.001 . 0 0 "[ . 1 . 2 .]" 2
706 1 49 ILE MG 1 52 ILE QG 0.000 . 7.500 3.614 3.277 4.241 . 0 0 "[ . 1 . 2 .]" 2
707 1 51 ALA MB 1 53 LYS HA 0.000 . 6.500 4.835 4.624 5.171 . 0 0 "[ . 1 . 2 .]" 2
708 1 52 ILE HA 1 54 PHE H 0.000 . 4.000 4.000 3.784 4.073 0.073 22 0 "[ . 1 . 2 .]" 2
709 1 52 ILE HB 1 55 ALA MB 0.000 . 6.500 4.567 3.900 5.318 . 0 0 "[ . 1 . 2 .]" 2
710 1 52 ILE MD 1 54 PHE H 0.000 . 7.500 4.731 4.304 6.031 . 0 0 "[ . 1 . 2 .]" 2
711 1 52 ILE MD 1 55 ALA MB 0.000 . 8.000 4.352 3.710 5.348 . 0 0 "[ . 1 . 2 .]" 2
712 1 52 ILE MG 1 54 PHE HA 0.000 . 7.500 3.923 3.381 4.532 . 0 0 "[ . 1 . 2 .]" 2
713 1 52 ILE MG 1 54 PHE QD 0.000 . 9.500 5.225 5.037 5.608 . 0 0 "[ . 1 . 2 .]" 2
714 1 52 ILE MG 1 54 PHE H 0.000 . 5.500 2.605 2.132 3.243 . 0 0 "[ . 1 . 2 .]" 2
715 1 52 ILE MG 1 55 ALA HA 0.000 . 7.500 4.470 4.165 5.088 . 0 0 "[ . 1 . 2 .]" 2
716 1 52 ILE MG 1 55 ALA MB 0.000 . 6.000 2.504 2.113 3.202 . 0 0 "[ . 1 . 2 .]" 2
717 1 52 ILE MG 1 55 ALA H 0.000 . 6.500 4.516 3.698 5.319 . 0 0 "[ . 1 . 2 .]" 2
718 1 54 PHE QE 1 56 SER QB 0.000 . 8.000 2.761 2.155 3.707 . 0 0 "[ . 1 . 2 .]" 2
719 1 54 PHE QE 1 56 SER H 0.000 . 6.000 3.293 2.191 4.338 . 0 0 "[ . 1 . 2 .]" 2
720 1 54 PHE HZ 1 56 SER HA 0.000 . 6.000 5.206 4.246 5.999 . 0 0 "[ . 1 . 2 .]" 2
721 1 54 PHE HZ 1 56 SER QB 0.000 . 6.000 2.603 1.922 3.551 . 0 0 "[ . 1 . 2 .]" 2
722 1 56 SER H 1 60 PRO QB 0.000 . 7.000 4.675 3.944 5.572 . 0 0 "[ . 1 . 2 .]" 2
723 1 56 SER H 1 60 PRO QG 0.000 . 7.000 5.105 4.189 6.067 . 0 0 "[ . 1 . 2 .]" 2
724 1 58 GLY H 1 60 PRO QD 0.000 . 6.000 3.001 2.097 3.582 . 0 0 "[ . 1 . 2 .]" 2
725 1 63 THR HA 1 67 PHE QD 0.000 . 7.000 4.560 3.628 5.750 . 0 0 "[ . 1 . 2 .]" 2
726 1 63 THR HA 1 67 PHE QE 0.000 . 7.000 3.483 2.635 4.888 . 0 0 "[ . 1 . 2 .]" 2
727 1 63 THR HA 1 67 PHE HZ 0.000 . 5.000 3.848 2.821 5.043 0.043 9 0 "[ . 1 . 2 .]" 2
728 1 63 THR HB 1 67 PHE QD 0.000 . 8.000 6.258 5.547 7.044 . 0 0 "[ . 1 . 2 .]" 2
729 1 63 THR HB 1 67 PHE QE 0.000 . 8.000 5.443 4.546 6.284 . 0 0 "[ . 1 . 2 .]" 2
730 1 63 THR HB 1 67 PHE HZ 0.000 . 7.000 5.785 4.088 7.040 0.040 17 0 "[ . 1 . 2 .]" 2
731 1 63 THR MG 1 67 PHE HA 0.000 . 8.500 6.005 4.790 6.833 . 0 0 "[ . 1 . 2 .]" 2
732 1 63 THR MG 1 67 PHE QD 0.000 . 8.500 5.585 4.732 6.158 . 0 0 "[ . 1 . 2 .]" 2
733 1 63 THR MG 1 67 PHE QE 0.000 . 9.500 4.788 3.422 5.663 . 0 0 "[ . 1 . 2 .]" 2
734 1 63 THR MG 1 67 PHE HZ 0.000 . 7.500 5.210 3.572 6.249 . 0 0 "[ . 1 . 2 .]" 2
735 1 63 THR H 1 66 THR HA 0.000 . 6.000 5.437 4.529 6.010 0.010 3 0 "[ . 1 . 2 .]" 2
736 1 63 THR H 1 66 THR HB 0.000 . 5.000 3.857 2.125 5.026 0.026 19 0 "[ . 1 . 2 .]" 2
737 1 63 THR H 1 66 THR H 0.000 . 4.000 3.465 2.959 3.935 . 0 0 "[ . 1 . 2 .]" 2
738 1 63 THR H 1 67 PHE HA 0.000 . 5.000 4.073 2.781 4.843 . 0 0 "[ . 1 . 2 .]" 2
739 1 63 THR H 1 67 PHE QE 0.000 . 8.000 4.865 3.763 5.448 . 0 0 "[ . 1 . 2 .]" 2
740 1 63 THR H 1 67 PHE H 0.000 . 5.000 4.620 3.724 5.017 0.017 25 0 "[ . 1 . 2 .]" 2
741 1 64 CYS HA 1 66 THR H 0.000 . 4.000 3.822 3.444 4.096 0.096 16 0 "[ . 1 . 2 .]" 2
742 1 64 CYS HA 1 67 PHE QD 0.000 . 7.000 3.302 2.446 4.307 . 0 0 "[ . 1 . 2 .]" 2
743 1 64 CYS HA 1 67 PHE QE 0.000 . 7.000 2.716 1.979 3.674 . 0 0 "[ . 1 . 2 .]" 2
744 1 64 CYS HA 1 67 PHE H 0.000 . 5.000 4.511 3.973 4.995 . 0 0 "[ . 1 . 2 .]" 2
745 1 64 CYS HA 1 67 PHE HZ 0.000 . 5.000 4.027 2.015 5.006 0.006 15 0 "[ . 1 . 2 .]" 2
746 1 64 CYS QB 1 67 PHE QE 0.000 . 9.000 4.002 3.130 5.404 . 0 0 "[ . 1 . 2 .]" 2
747 1 64 CYS QB 1 67 PHE HZ 0.000 . 7.000 4.617 2.996 6.132 . 0 0 "[ . 1 . 2 .]" 2
748 1 65 GLY QA 1 67 PHE H 0.000 . 6.000 4.076 3.650 4.481 . 0 0 "[ . 1 . 2 .]" 2
749 1 65 GLY H 1 67 PHE QD 0.000 . 8.000 3.222 2.536 3.834 . 0 0 "[ . 1 . 2 .]" 2
750 1 65 GLY H 1 67 PHE H 0.000 . 5.000 3.058 2.626 3.626 . 0 0 "[ . 1 . 2 .]" 2
751 1 69 GLN HA 1 73 HIS QB 0.000 . 8.000 4.365 2.899 5.908 . 0 0 "[ . 1 . 2 .]" 2
752 1 69 GLN QB 1 73 HIS QB 0.000 . 8.000 3.737 2.033 5.108 . 0 0 "[ . 1 . 2 .]" 2
753 1 69 GLN QB 1 73 HIS HE1 0.000 . 9.000 6.362 4.408 7.622 . 0 0 "[ . 1 . 2 .]" 2
754 1 69 GLN QE 1 73 HIS HD2 0.000 . 7.000 4.561 2.445 6.287 . 0 0 "[ . 1 . 2 .]" 2
755 1 69 GLN QG 1 73 HIS QB 0.000 . 8.000 3.780 2.121 5.601 . 0 0 "[ . 1 . 2 .]" 2
756 1 69 GLN QG 1 73 HIS HD2 0.000 . 8.000 5.296 3.099 7.049 . 0 0 "[ . 1 . 2 .]" 2
757 1 70 GLY QA 1 72 CYS H 0.000 . 6.000 3.653 2.900 4.369 . 0 0 "[ . 1 . 2 .]" 2
758 1 70 GLY H 1 72 CYS H 0.000 . 6.000 4.606 3.467 6.088 0.088 12 0 "[ . 1 . 2 .]" 2
759 1 73 HIS QB 1 75 ILE HA 0.000 . 7.000 5.208 4.025 6.089 . 0 0 "[ . 1 . 2 .]" 2
760 1 73 HIS HD2 1 75 ILE HA 0.000 . 4.000 3.337 2.471 3.988 . 0 0 "[ . 1 . 2 .]" 2
761 1 73 HIS HD2 1 75 ILE HB 0.000 . 7.000 5.817 4.206 6.541 . 0 0 "[ . 1 . 2 .]" 2
762 1 73 HIS HD2 1 75 ILE MD 0.000 . 8.500 5.571 1.881 7.117 . 0 0 "[ . 1 . 2 .]" 2
763 1 73 HIS HD2 1 75 ILE QG 0.000 . 8.000 4.453 2.585 6.211 . 0 0 "[ . 1 . 2 .]" 2
764 1 73 HIS HD2 1 75 ILE MG 0.000 . 5.500 4.128 2.427 4.544 . 0 0 "[ . 1 . 2 .]" 2
765 1 73 HIS HD2 1 77 SER H 0.000 . 7.000 5.473 4.705 6.054 . 0 0 "[ . 1 . 2 .]" 2
766 1 73 HIS HE1 1 77 SER HA 0.000 . 4.000 4.154 4.032 4.309 0.309 23 0 "[ . 1 . 2 .]" 2
767 1 73 HIS HE1 1 77 SER QB 0.000 . 6.000 1.916 1.806 2.329 . 0 0 "[ . 1 . 2 .]" 2
768 1 73 HIS HE1 1 77 SER H 0.000 . 7.000 3.172 1.988 4.382 . 0 0 "[ . 1 . 2 .]" 2
769 1 74 SER HA 1 76 ASN H 0.000 . 6.000 4.256 3.531 5.064 . 0 0 "[ . 1 . 2 .]" 2
770 1 74 SER HA 1 77 SER H 0.000 . 6.000 5.761 4.891 6.068 0.068 9 0 "[ . 1 . 2 .]" 2
771 1 74 SER QB 1 76 ASN H 0.000 . 7.000 3.021 2.323 3.704 . 0 0 "[ . 1 . 2 .]" 2
772 1 74 SER QB 1 77 SER H 0.000 . 5.000 3.958 3.021 4.525 . 0 0 "[ . 1 . 2 .]" 2
773 1 74 SER H 1 77 SER QB 0.000 . 7.000 4.399 3.327 5.311 . 0 0 "[ . 1 . 2 .]" 2
774 1 74 SER H 1 77 SER HG 0.000 . 4.000 3.320 2.260 4.100 0.100 12 0 "[ . 1 . 2 .]" 2
775 1 74 SER H 1 77 SER H 0.000 . 6.000 4.804 4.219 5.372 . 0 0 "[ . 1 . 2 .]" 2
776 1 75 ILE HB 1 77 SER H 0.000 . 6.000 5.487 4.536 6.066 0.066 4 0 "[ . 1 . 2 .]" 2
777 1 75 ILE QG 1 77 SER H 0.000 . 7.000 5.291 4.319 5.938 . 0 0 "[ . 1 . 2 .]" 2
778 1 75 ILE MG 1 77 SER H 0.000 . 7.500 5.100 4.362 5.585 . 0 0 "[ . 1 . 2 .]" 2
779 1 76 ASN HA 1 79 SER QB 0.000 . 6.000 2.731 1.864 4.000 . 0 0 "[ . 1 . 2 .]" 2
780 1 76 ASN HA 1 79 SER H 0.000 . 5.000 3.295 2.807 3.792 . 0 0 "[ . 1 . 2 .]" 2
781 1 76 ASN HA 1 80 VAL MG2 0.000 . 6.500 4.370 3.566 5.206 . 0 0 "[ . 1 . 2 .]" 2
782 1 76 ASN QB 1 79 SER QB 0.000 . 8.000 3.524 2.045 5.230 . 0 0 "[ . 1 . 2 .]" 2
783 1 76 ASN QB 1 79 SER H 0.000 . 7.000 4.438 3.523 5.044 . 0 0 "[ . 1 . 2 .]" 2
784 1 76 ASN QB 1 80 VAL MG1 0.000 . 9.500 5.471 4.147 6.708 . 0 0 "[ . 1 . 2 .]" 2
785 1 76 ASN QB 1 80 VAL MG2 0.000 . 6.500 3.147 1.826 4.616 . 0 0 "[ . 1 . 2 .]" 2
786 1 76 ASN H 1 78 ASN H 0.000 . 6.000 4.846 4.028 5.885 . 0 0 "[ . 1 . 2 .]" 2
787 1 77 SER HA 1 81 LEU MD2 0.000 . 7.500 4.329 3.486 5.609 . 0 0 "[ . 1 . 2 .]" 2
788 1 77 SER QB 1 81 LEU MD2 0.000 . 9.500 4.791 4.157 5.860 . 0 0 "[ . 1 . 2 .]" 2
789 1 77 SER H 1 79 SER H 0.000 . 6.000 3.941 3.484 4.486 . 0 0 "[ . 1 . 2 .]" 2
790 1 78 ASN HA 1 80 VAL H 0.000 . 5.000 4.120 3.513 4.996 . 0 0 "[ . 1 . 2 .]" 2
791 1 78 ASN HA 1 81 LEU QB 0.000 . 7.000 2.798 2.107 3.500 . 0 0 "[ . 1 . 2 .]" 2
792 1 78 ASN HA 1 81 LEU H 0.000 . 5.000 3.466 2.978 4.012 . 0 0 "[ . 1 . 2 .]" 2
793 1 78 ASN QB 1 81 LEU MD2 0.000 . 8.500 5.247 3.614 6.263 . 0 0 "[ . 1 . 2 .]" 2
794 1 78 ASN QB 1 82 GLU QB 0.000 . 9.000 4.458 3.623 5.425 . 0 0 "[ . 1 . 2 .]" 2
795 1 78 ASN QB 1 82 GLU H 0.000 . 7.000 4.782 4.023 5.396 . 0 0 "[ . 1 . 2 .]" 2
796 1 79 SER HA 1 81 LEU H 0.000 . 5.000 4.289 3.916 5.000 0.000 13 0 "[ . 1 . 2 .]" 2
797 1 79 SER HA 1 82 GLU QB 0.000 . 6.000 3.163 2.496 3.913 . 0 0 "[ . 1 . 2 .]" 2
798 1 79 SER HA 1 82 GLU H 0.000 . 4.000 3.904 3.386 4.117 0.117 11 0 "[ . 1 . 2 .]" 2
799 1 79 SER HA 1 83 ARG H 0.000 . 5.000 4.529 3.941 5.079 0.079 10 0 "[ . 1 . 2 .]" 2
800 1 79 SER QB 1 81 LEU H 0.000 . 7.000 4.749 4.097 5.296 . 0 0 "[ . 1 . 2 .]" 2
801 1 79 SER QB 1 83 ARG QD 0.000 . 8.000 5.207 3.451 6.233 . 0 0 "[ . 1 . 2 .]" 2
802 1 79 SER H 1 81 LEU H 0.000 . 6.000 4.001 3.338 4.747 . 0 0 "[ . 1 . 2 .]" 2
803 1 80 VAL HA 1 82 GLU H 0.000 . 6.000 4.847 4.161 5.267 . 0 0 "[ . 1 . 2 .]" 2
804 1 80 VAL HA 1 83 ARG QB 0.000 . 6.000 3.141 2.331 4.512 . 0 0 "[ . 1 . 2 .]" 2
805 1 80 VAL HA 1 83 ARG QG 0.000 . 7.000 4.599 2.526 5.574 . 0 0 "[ . 1 . 2 .]" 2
806 1 80 VAL HA 1 83 ARG H 0.000 . 4.000 3.860 3.447 4.071 0.071 2 0 "[ . 1 . 2 .]" 2
807 1 80 VAL HA 1 84 LYS QG 0.000 . 8.000 5.808 3.987 7.127 . 0 0 "[ . 1 . 2 .]" 2
808 1 80 VAL HA 1 84 LYS H 0.000 . 5.000 4.481 3.883 4.970 . 0 0 "[ . 1 . 2 .]" 2
809 1 80 VAL MG1 1 83 ARG H 0.000 . 7.500 4.847 4.374 5.228 . 0 0 "[ . 1 . 2 .]" 2
810 1 80 VAL MG1 1 84 LYS HA 0.000 . 8.500 5.806 4.863 6.487 . 0 0 "[ . 1 . 2 .]" 2
811 1 80 VAL MG1 1 84 LYS QB 0.000 . 8.500 3.296 2.326 4.227 . 0 0 "[ . 1 . 2 .]" 2
812 1 80 VAL MG1 1 84 LYS QD 0.000 . 8.500 3.702 1.828 5.733 . 0 0 "[ . 1 . 2 .]" 2
813 1 80 VAL MG1 1 84 LYS QE 0.000 . 6.500 4.236 2.948 4.832 . 0 0 "[ . 1 . 2 .]" 2
814 1 80 VAL MG1 1 84 LYS QG 0.000 . 7.500 4.399 2.721 5.386 . 0 0 "[ . 1 . 2 .]" 2
815 1 80 VAL MG1 1 84 LYS H 0.000 . 6.500 4.426 3.978 4.803 . 0 0 "[ . 1 . 2 .]" 2
816 1 80 VAL H 1 82 GLU H 0.000 . 5.000 4.351 3.604 4.988 . 0 0 "[ . 1 . 2 .]" 2
817 1 81 LEU HA 1 83 ARG H 0.000 . 6.000 4.040 3.720 4.587 . 0 0 "[ . 1 . 2 .]" 2
818 1 81 LEU HA 1 84 LYS HA 0.000 . 6.000 5.693 4.955 6.029 0.029 11 0 "[ . 1 . 2 .]" 2
819 1 81 LEU HA 1 84 LYS QB 0.000 . 7.000 3.606 2.499 4.911 . 0 0 "[ . 1 . 2 .]" 2
820 1 81 LEU HA 1 84 LYS QG 0.000 . 7.000 5.332 2.870 6.140 . 0 0 "[ . 1 . 2 .]" 2
821 1 81 LEU HA 1 84 LYS H 0.000 . 4.000 3.368 3.026 3.745 . 0 0 "[ . 1 . 2 .]" 2
822 1 81 LEU HA 1 85 CYS QB 0.000 . 8.000 2.933 1.964 3.709 . 0 0 "[ . 1 . 2 .]" 2
823 1 81 LEU HA 1 85 CYS H 0.000 . 5.000 4.731 2.681 5.067 0.067 8 0 "[ . 1 . 2 .]" 2
824 1 81 LEU QB 1 83 ARG H 0.000 . 7.000 4.401 4.136 4.950 . 0 0 "[ . 1 . 2 .]" 2
825 1 81 LEU QB 1 85 CYS QB 0.000 . 8.000 3.410 2.859 3.994 . 0 0 "[ . 1 . 2 .]" 2
826 1 81 LEU QD 1 84 LYS H 0.000 . 8.400 4.174 3.780 4.513 . 0 0 "[ . 1 . 2 .]" 2
827 1 81 LEU MD1 1 85 CYS QB 0.000 . 8.500 2.748 2.077 5.042 . 0 0 "[ . 1 . 2 .]" 2
828 1 81 LEU QD 1 85 CYS H 0.000 . 7.400 4.844 3.508 5.278 . 0 0 "[ . 1 . 2 .]" 2
829 1 81 LEU QD 1 83 ARG H 0.000 . 8.400 4.583 4.358 5.024 . 0 0 "[ . 1 . 2 .]" 2
830 1 81 LEU H 1 83 ARG H 0.000 . 5.000 3.868 3.545 4.548 . 0 0 "[ . 1 . 2 .]" 2
831 1 82 GLU HA 1 84 LYS H 0.000 . 6.000 4.387 4.167 4.977 . 0 0 "[ . 1 . 2 .]" 2
832 1 82 GLU HA 1 85 CYS QB 0.000 . 8.000 3.817 3.288 4.403 . 0 0 "[ . 1 . 2 .]" 2
833 1 82 GLU HA 1 85 CYS H 0.000 . 5.000 4.384 3.909 4.868 . 0 0 "[ . 1 . 2 .]" 2
834 1 82 GLU HA 1 86 ILE MD 0.000 . 5.500 2.250 1.747 3.135 . 0 0 "[ . 1 . 2 .]" 2
835 1 82 GLU HA 1 86 ILE QG 0.000 . 5.000 2.747 1.701 3.751 . 0 0 "[ . 1 . 2 .]" 2
836 1 82 GLU QB 1 86 ILE MD 0.000 . 6.500 3.223 2.303 4.136 . 0 0 "[ . 1 . 2 .]" 2
837 1 82 GLU QG 1 86 ILE MD 0.000 . 6.500 2.252 1.716 3.563 . 0 0 "[ . 1 . 2 .]" 2
838 1 82 GLU QG 1 86 ILE QG 0.000 . 8.000 3.527 1.991 4.083 . 0 0 "[ . 1 . 2 .]" 2
839 1 82 GLU QG 1 86 ILE MG 0.000 . 9.500 4.348 2.930 5.432 . 0 0 "[ . 1 . 2 .]" 2
840 1 82 GLU H 1 84 LYS H 0.000 . 6.000 4.208 3.790 4.722 . 0 0 "[ . 1 . 2 .]" 2
841 1 82 GLU H 1 85 CYS H 0.000 . 6.000 5.662 4.679 6.048 0.048 17 0 "[ . 1 . 2 .]" 2
842 1 82 GLU H 1 86 ILE MD 0.000 . 7.500 4.496 3.365 5.335 . 0 0 "[ . 1 . 2 .]" 2
843 1 82 GLU H 1 86 ILE QG 0.000 . 7.000 5.138 4.067 6.230 . 0 0 "[ . 1 . 2 .]" 2
844 1 83 ARG HA 1 85 CYS H 0.000 . 6.000 4.374 3.625 5.328 . 0 0 "[ . 1 . 2 .]" 2
845 1 83 ARG HA 1 86 ILE HB 0.000 . 7.000 4.837 3.782 5.629 . 0 0 "[ . 1 . 2 .]" 2
846 1 83 ARG H 1 85 CYS H 0.000 . 5.000 4.421 3.844 4.765 . 0 0 "[ . 1 . 2 .]" 2
847 1 83 ARG H 1 86 ILE MD 0.000 . 7.500 4.959 4.089 6.015 . 0 0 "[ . 1 . 2 .]" 2
848 1 84 LYS HA 1 88 LEU MD1 0.000 . 7.500 3.757 3.122 4.459 . 0 0 "[ . 1 . 2 .]" 2
849 1 84 LYS H 1 86 ILE HB 0.000 . 6.000 5.510 4.776 5.996 . 0 0 "[ . 1 . 2 .]" 2
850 1 84 LYS H 1 86 ILE H 0.000 . 5.000 4.488 3.979 4.978 . 0 0 "[ . 1 . 2 .]" 2
851 1 85 CYS HA 1 88 LEU QB 0.000 . 7.000 3.483 3.002 4.335 . 0 0 "[ . 1 . 2 .]" 2
852 1 85 CYS HA 1 88 LEU MD1 0.000 . 5.500 2.822 2.222 3.184 . 0 0 "[ . 1 . 2 .]" 2
853 1 85 CYS HA 1 88 LEU MD2 0.000 . 6.500 5.305 4.728 5.497 . 0 0 "[ . 1 . 2 .]" 2
854 1 85 CYS HA 1 88 LEU HG 0.000 . 6.000 4.963 4.206 6.054 0.054 17 0 "[ . 1 . 2 .]" 2
855 1 85 CYS HA 1 88 LEU H 0.000 . 5.000 4.722 4.347 5.050 0.050 3 0 "[ . 1 . 2 .]" 2
856 1 85 CYS QB 1 88 LEU MD1 0.000 . 8.500 4.469 3.847 4.921 . 0 0 "[ . 1 . 2 .]" 2
857 1 85 CYS H 1 88 LEU MD1 0.000 . 6.500 3.698 2.822 4.742 . 0 0 "[ . 1 . 2 .]" 2
858 1 86 ILE HB 1 88 LEU H 0.000 . 6.000 5.665 5.458 6.030 0.030 25 0 "[ . 1 . 2 .]" 2
859 1 86 ILE MG 1 88 LEU H 0.000 . 7.500 4.593 4.243 5.169 . 0 0 "[ . 1 . 2 .]" 2
860 1 88 LEU HA 1 90 ARG H 0.000 . 4.000 3.823 3.582 4.044 0.044 23 0 "[ . 1 . 2 .]" 2
861 1 88 LEU QB 1 90 ARG H 0.000 . 4.000 2.618 2.342 2.890 . 0 0 "[ . 1 . 2 .]" 2
862 1 88 LEU QB 1 91 CYS HA 0.000 . 6.000 3.892 3.692 4.313 . 0 0 "[ . 1 . 2 .]" 2
863 1 88 LEU QB 1 91 CYS QB 0.000 . 7.000 3.631 2.390 4.917 . 0 0 "[ . 1 . 2 .]" 2
864 1 88 LEU MD1 1 90 ARG H 0.000 . 6.500 4.644 4.260 4.945 . 0 0 "[ . 1 . 2 .]" 2
865 1 88 LEU MD1 1 91 CYS HA 0.000 . 5.500 3.790 3.495 4.055 . 0 0 "[ . 1 . 2 .]" 2
866 1 88 LEU MD1 1 91 CYS QB 0.000 . 7.500 3.947 2.349 5.098 . 0 0 "[ . 1 . 2 .]" 2
867 1 88 LEU MD1 1 92 VAL QG 0.000 . 9.900 5.474 4.307 6.074 . 0 0 "[ . 1 . 2 .]" 2
868 1 88 LEU MD1 1 92 VAL H 0.000 . 6.500 4.899 4.423 5.316 . 0 0 "[ . 1 . 2 .]" 2
869 1 88 LEU MD2 1 90 ARG H 0.000 . 5.500 4.118 3.781 4.452 . 0 0 "[ . 1 . 2 .]" 2
870 1 88 LEU MD2 1 91 CYS HA 0.000 . 7.500 5.219 4.364 6.078 . 0 0 "[ . 1 . 2 .]" 2
871 1 88 LEU H 1 90 ARG H 0.000 . 6.000 5.012 4.542 5.459 . 0 0 "[ . 1 . 2 .]" 2
872 1 90 ARG QD 1 92 VAL QG 0.000 . 8.400 3.993 2.579 5.479 . 0 0 "[ . 1 . 2 .]" 2
873 1 92 VAL QG 1 94 ALA HA 0.000 . 7.400 4.432 3.760 4.947 . 0 0 "[ . 1 . 2 .]" 2
874 1 92 VAL QG 1 94 ALA MB 0.000 . 7.900 4.144 3.725 4.616 . 0 0 "[ . 1 . 2 .]" 2
875 1 93 VAL HB 1 95 ILE HA 0.000 . 7.000 5.980 5.301 6.504 . 0 0 "[ . 1 . 2 .]" 2
876 1 94 ALA MB 1 96 SER QB 0.000 . 7.500 3.637 2.892 4.714 . 0 0 "[ . 1 . 2 .]" 2
877 1 96 SER QB 1 99 ASN QB 0.000 . 9.000 3.114 2.254 4.149 . 0 0 "[ . 1 . 2 .]" 2
878 1 96 SER H 1 99 ASN HA 0.000 . 6.000 5.770 5.192 6.028 0.028 6 0 "[ . 1 . 2 .]" 2
879 1 96 SER H 1 99 ASN QB 0.000 . 6.000 2.861 2.374 3.774 . 0 0 "[ . 1 . 2 .]" 2
880 1 96 SER H 1 99 ASN QD 0.000 . 6.000 4.487 2.897 5.412 . 0 0 "[ . 1 . 2 .]" 2
881 1 96 SER H 1 99 ASN H 0.000 . 6.000 4.405 3.771 5.107 . 0 0 "[ . 1 . 2 .]" 2
882 1 96 SER H 1 100 PHE QD 0.000 . 7.000 3.547 2.915 4.353 . 0 0 "[ . 1 . 2 .]" 2
883 1 96 SER H 1 100 PHE H 0.000 . 5.000 4.898 4.406 5.083 0.083 5 0 "[ . 1 . 2 .]" 2
884 1 96 SER H 1 100 PHE HZ 0.000 . 6.000 5.785 4.793 6.048 0.048 11 0 "[ . 1 . 2 .]" 2
885 1 98 SER HA 1 100 PHE H 0.000 . 5.000 4.154 3.559 4.871 . 0 0 "[ . 1 . 2 .]" 2
886 1 98 SER HA 1 101 GLY H 0.000 . 6.000 4.551 3.417 5.305 . 0 0 "[ . 1 . 2 .]" 2
887 1 98 SER HA 1 102 GLY H 0.000 . 4.000 3.762 3.429 4.070 0.070 24 0 "[ . 1 . 2 .]" 2
888 1 100 PHE QB 1 102 GLY H 0.000 . 6.000 3.795 3.062 4.492 . 0 0 "[ . 1 . 2 .]" 2
889 1 100 PHE H 1 102 GLY H 0.000 . 5.000 3.870 3.191 4.659 . 0 0 "[ . 1 . 2 .]" 2
890 1 103 ASP QB 1 105 CYS H 0.000 . 6.000 4.626 3.322 5.381 . 0 0 "[ . 1 . 2 .]" 2
891 1 105 CYS HA 1 108 VAL MG1 0.000 . 8.500 5.282 4.232 6.516 . 0 0 "[ . 1 . 2 .]" 2
892 1 105 CYS HA 1 108 VAL MG2 0.000 . 6.500 4.117 3.133 4.863 . 0 0 "[ . 1 . 2 .]" 2
893 1 105 CYS QB 1 107 GLU H 0.000 . 7.000 5.672 4.107 6.108 . 0 0 "[ . 1 . 2 .]" 2
894 1 105 CYS QB 1 108 VAL HB 0.000 . 6.000 2.827 1.793 4.109 . 0 0 "[ . 1 . 2 .]" 2
895 1 105 CYS QB 1 108 VAL MG2 0.000 . 6.500 2.664 1.811 4.280 . 0 0 "[ . 1 . 2 .]" 2
896 1 105 CYS QB 1 108 VAL H 0.000 . 6.000 4.410 2.656 5.196 . 0 0 "[ . 1 . 2 .]" 2
897 1 105 CYS H 1 108 VAL MG2 0.000 . 7.500 5.143 4.083 6.225 . 0 0 "[ . 1 . 2 .]" 2
898 1 106 PRO HA 1 108 VAL H 0.000 . 4.000 3.535 2.999 4.055 0.055 8 0 "[ . 1 . 2 .]" 2
899 1 106 PRO QD 1 108 VAL MG2 0.000 . 9.500 3.643 2.089 4.919 . 0 0 "[ . 1 . 2 .]" 2
900 1 108 VAL MG1 1 110 LYS H 0.000 . 7.500 4.854 4.197 5.337 . 0 0 "[ . 1 . 2 .]" 2
901 1 111 ARG QB 1 113 ALA MB 0.000 . 9.500 4.210 3.771 4.832 . 0 0 "[ . 1 . 2 .]" 2
902 1 111 ARG QD 1 113 ALA MB 0.000 . 9.500 5.215 3.564 6.702 . 0 0 "[ . 1 . 2 .]" 2
903 1 111 ARG QG 1 113 ALA MB 0.000 . 9.500 4.986 3.279 6.229 . 0 0 "[ . 1 . 2 .]" 2
904 1 112 VAL MG1 1 114 VAL HA 0.000 . 8.500 4.938 4.496 5.183 . 0 0 "[ . 1 . 2 .]" 2
905 1 112 VAL MG1 1 114 VAL MG2 0.000 . 7.000 2.517 2.147 2.821 . 0 0 "[ . 1 . 2 .]" 2
906 1 112 VAL MG1 1 114 VAL H 0.000 . 6.500 4.156 3.402 4.815 . 0 0 "[ . 1 . 2 .]" 2
907 1 114 VAL MG1 1 116 ALA MB 0.000 . 7.000 3.300 2.928 3.738 . 0 0 "[ . 1 . 2 .]" 2
908 1 114 VAL MG1 1 116 ALA H 0.000 . 7.500 3.854 3.254 4.522 . 0 0 "[ . 1 . 2 .]" 2
909 1 6 THR HA 1 119 SER HA 0.000 . 6.000 4.770 2.178 6.011 0.011 9 0 "[ . 1 . 2 .]" 2
910 1 6 THR HA 1 120 THR MG 0.000 . 6.500 4.489 3.183 5.313 . 0 0 "[ . 1 . 2 .]" 2
911 1 6 THR MG 1 119 SER HA 0.000 . 7.500 4.476 2.675 6.033 . 0 0 "[ . 1 . 2 .]" 2
912 1 6 THR MG 1 119 SER QB 0.000 . 8.500 4.379 1.770 6.217 . 0 0 "[ . 1 . 2 .]" 2
913 1 6 THR H 1 120 THR MG 0.000 . 7.500 4.801 2.165 6.239 . 0 0 "[ . 1 . 2 .]" 2
914 1 7 VAL HA 1 119 SER HA 0.000 . 5.000 3.988 2.017 5.040 0.040 2 0 "[ . 1 . 2 .]" 2
915 1 7 VAL HA 1 119 SER QB 0.000 . 7.000 4.840 3.286 6.217 . 0 0 "[ . 1 . 2 .]" 2
916 1 7 VAL HB 1 119 SER HA 0.000 . 6.000 3.665 2.039 5.608 . 0 0 "[ . 1 . 2 .]" 2
917 1 7 VAL HB 1 119 SER QB 0.000 . 6.000 4.414 2.567 5.337 . 0 0 "[ . 1 . 2 .]" 2
918 1 7 VAL QG 1 118 CYS HA 0.000 . 8.400 5.073 3.970 6.156 . 0 0 "[ . 1 . 2 .]" 2
919 1 7 VAL QG 1 118 CYS QB 0.000 . 8.400 3.896 2.170 5.378 . 0 0 "[ . 1 . 2 .]" 2
920 1 7 VAL QG 1 119 SER QB 0.000 . 7.400 3.417 1.954 4.494 . 0 0 "[ . 1 . 2 .]" 2
921 1 7 VAL MG1 1 119 SER HA 0.000 . 5.500 3.384 1.877 4.640 . 0 0 "[ . 1 . 2 .]" 2
922 1 8 SER QB 1 118 CYS H 0.000 . 6.000 4.482 1.808 5.459 . 0 0 "[ . 1 . 2 .]" 2
923 1 9 GLY QA 1 117 VAL HA 0.000 . 6.000 3.282 1.832 5.006 . 0 0 "[ . 1 . 2 .]" 2
924 1 9 GLY QA 1 117 VAL MG2 0.000 . 8.500 4.054 2.832 5.301 . 0 0 "[ . 1 . 2 .]" 2
925 1 9 GLY QA 1 118 CYS H 0.000 . 6.000 3.446 1.866 5.443 . 0 0 "[ . 1 . 2 .]" 2
926 1 10 VAL HA 1 41 LEU MD2 0.000 . 7.500 4.990 4.214 6.031 . 0 0 "[ . 1 . 2 .]" 2
927 1 10 VAL HA 1 116 ALA MB 0.000 . 7.500 5.424 4.634 5.962 . 0 0 "[ . 1 . 2 .]" 2
928 1 10 VAL HA 1 116 ALA H 0.000 . 6.000 5.246 4.538 5.643 . 0 0 "[ . 1 . 2 .]" 2
929 1 10 VAL HB 1 41 LEU MD2 0.000 . 5.500 3.228 2.258 4.101 . 0 0 "[ . 1 . 2 .]" 2
930 1 10 VAL HB 1 42 LYS H 0.000 . 6.000 5.131 3.705 6.084 0.084 11 0 "[ . 1 . 2 .]" 2
931 1 10 VAL HB 1 43 CYS HA 0.000 . 7.000 5.971 4.232 6.919 . 0 0 "[ . 1 . 2 .]" 2
932 1 10 VAL HB 1 116 ALA MB 0.000 . 5.500 3.403 2.055 4.507 . 0 0 "[ . 1 . 2 .]" 2
933 1 10 VAL QG 1 41 LEU HA 0.000 . 6.400 3.621 2.692 4.705 . 0 0 "[ . 1 . 2 .]" 2
934 1 10 VAL QG 1 41 LEU QB 0.000 . 8.400 3.689 2.303 4.645 . 0 0 "[ . 1 . 2 .]" 2
935 1 10 VAL QG 1 41 LEU MD2 0.000 . 6.400 2.421 1.733 3.474 . 0 0 "[ . 1 . 2 .]" 2
936 1 10 VAL QG 1 42 LYS H 0.000 . 6.400 3.340 2.275 4.594 . 0 0 "[ . 1 . 2 .]" 2
937 1 10 VAL QG 1 43 CYS HA 0.000 . 7.400 3.418 2.473 3.957 . 0 0 "[ . 1 . 2 .]" 2
938 1 10 VAL QG 1 43 CYS H 0.000 . 7.400 4.805 3.485 5.460 . 0 0 "[ . 1 . 2 .]" 2
939 1 10 VAL QG 1 44 ALA H 0.000 . 7.400 4.766 3.627 5.333 . 0 0 "[ . 1 . 2 .]" 2
940 1 10 VAL QG 1 49 ILE MD 0.000 . 8.900 4.557 3.747 5.361 . 0 0 "[ . 1 . 2 .]" 2
941 1 10 VAL QG 1 115 GLU HA 0.000 . 8.400 4.513 3.517 5.554 . 0 0 "[ . 1 . 2 .]" 2
942 1 10 VAL QG 1 116 ALA HA 0.000 . 8.400 5.024 3.679 6.240 . 0 0 "[ . 1 . 2 .]" 2
943 1 10 VAL QG 1 116 ALA MB 0.000 . 6.400 2.945 1.860 3.891 . 0 0 "[ . 1 . 2 .]" 2
944 1 10 VAL QG 1 116 ALA H 0.000 . 7.400 3.491 1.848 4.620 . 0 0 "[ . 1 . 2 .]" 2
945 1 10 VAL QG 1 118 CYS QB 0.000 . 9.400 3.096 1.782 4.236 . 0 0 "[ . 1 . 2 .]" 2
946 1 10 VAL H 1 115 GLU HA 0.000 . 5.000 4.921 4.378 5.099 0.099 20 0 "[ . 1 . 2 .]" 2
947 1 10 VAL H 1 115 GLU QG 0.000 . 7.000 4.413 3.498 5.801 . 0 0 "[ . 1 . 2 .]" 2
948 1 10 VAL H 1 116 ALA MB 0.000 . 6.500 3.930 2.852 4.792 . 0 0 "[ . 1 . 2 .]" 2
949 1 10 VAL H 1 116 ALA H 0.000 . 4.000 3.539 2.811 4.055 0.055 16 0 "[ . 1 . 2 .]" 2
950 1 10 VAL H 1 117 VAL HA 0.000 . 5.000 4.026 3.257 4.678 . 0 0 "[ . 1 . 2 .]" 2
951 1 10 VAL H 1 118 CYS H 0.000 . 5.000 4.528 3.658 5.004 0.004 7 0 "[ . 1 . 2 .]" 2
952 1 11 CYS HA 1 41 LEU QD 0.000 . 6.400 3.917 2.500 4.632 . 0 0 "[ . 1 . 2 .]" 2
953 1 11 CYS HA 1 64 CYS HA 0.000 . 7.000 5.561 4.297 6.525 . 0 0 "[ . 1 . 2 .]" 2
954 1 11 CYS HA 1 64 CYS QB 0.000 . 8.000 5.332 4.541 5.920 . 0 0 "[ . 1 . 2 .]" 2
955 1 11 CYS HA 1 67 PHE QD 0.000 . 9.000 5.897 4.094 6.676 . 0 0 "[ . 1 . 2 .]" 2
956 1 11 CYS HA 1 67 PHE QE 0.000 . 9.000 4.476 2.364 5.421 . 0 0 "[ . 1 . 2 .]" 2
957 1 11 CYS HA 1 67 PHE HZ 0.000 . 7.000 6.115 4.262 6.997 . 0 0 "[ . 1 . 2 .]" 2
958 1 11 CYS HA 1 114 VAL MG1 0.000 . 8.500 4.824 3.811 5.683 . 0 0 "[ . 1 . 2 .]" 2
959 1 11 CYS HA 1 114 VAL H 0.000 . 6.000 5.199 4.418 5.979 . 0 0 "[ . 1 . 2 .]" 2
960 1 11 CYS HA 1 115 GLU HA 0.000 . 4.000 2.705 2.068 3.107 . 0 0 "[ . 1 . 2 .]" 2
961 1 11 CYS HA 1 115 GLU QB 0.000 . 7.000 4.275 3.804 4.824 . 0 0 "[ . 1 . 2 .]" 2
962 1 11 CYS HA 1 115 GLU QG 0.000 . 7.000 2.987 2.080 4.389 . 0 0 "[ . 1 . 2 .]" 2
963 1 11 CYS HA 1 116 ALA H 0.000 . 4.000 3.845 3.278 4.153 0.153 23 0 "[ . 1 . 2 .]" 2
964 1 11 CYS QB 1 64 CYS QB 0.000 . 8.000 3.466 2.785 4.213 . 0 0 "[ . 1 . 2 .]" 2
965 1 11 CYS QB 1 67 PHE QE 0.000 . 9.000 3.870 1.989 4.964 . 0 0 "[ . 1 . 2 .]" 2
966 1 11 CYS QB 1 67 PHE HZ 0.000 . 7.000 5.012 3.028 6.297 . 0 0 "[ . 1 . 2 .]" 2
967 1 11 CYS QB 1 115 GLU HA 0.000 . 8.000 4.341 2.470 5.115 . 0 0 "[ . 1 . 2 .]" 2
968 1 11 CYS H 1 41 LEU QD 0.000 . 8.400 4.344 3.299 5.160 . 0 0 "[ . 1 . 2 .]" 2
969 1 11 CYS H 1 115 GLU HA 0.000 . 6.000 5.197 4.706 5.652 . 0 0 "[ . 1 . 2 .]" 2
970 1 11 CYS H 1 116 ALA H 0.000 . 6.000 5.260 4.327 5.622 . 0 0 "[ . 1 . 2 .]" 2
971 1 12 ALA HA 1 41 LEU MD2 0.000 . 6.500 4.343 3.608 5.155 . 0 0 "[ . 1 . 2 .]" 2
972 1 12 ALA MB 1 39 VAL MG1 0.000 . 6.000 2.306 1.794 2.902 . 0 0 "[ . 1 . 2 .]" 2
973 1 12 ALA MB 1 39 VAL MG2 0.000 . 6.000 3.776 2.529 4.015 . 0 0 "[ . 1 . 2 .]" 2
974 1 12 ALA MB 1 40 HIS H 0.000 . 6.500 3.597 2.451 4.739 . 0 0 "[ . 1 . 2 .]" 2
975 1 12 ALA MB 1 113 ALA HA 0.000 . 7.500 4.720 3.930 5.537 . 0 0 "[ . 1 . 2 .]" 2
976 1 12 ALA MB 1 114 VAL HA 0.000 . 8.500 5.154 3.972 6.223 . 0 0 "[ . 1 . 2 .]" 2
977 1 12 ALA MB 1 114 VAL HB 0.000 . 5.500 2.964 1.970 3.846 . 0 0 "[ . 1 . 2 .]" 2
978 1 12 ALA MB 1 114 VAL H 0.000 . 5.500 3.491 2.240 4.437 . 0 0 "[ . 1 . 2 .]" 2
979 1 12 ALA H 1 41 LEU QD 0.000 . 7.400 3.728 2.540 4.393 . 0 0 "[ . 1 . 2 .]" 2
980 1 12 ALA H 1 114 VAL HB 0.000 . 6.000 4.255 3.025 5.270 . 0 0 "[ . 1 . 2 .]" 2
981 1 12 ALA H 1 114 VAL MG1 0.000 . 7.500 4.379 3.407 5.146 . 0 0 "[ . 1 . 2 .]" 2
982 1 12 ALA H 1 114 VAL MG2 0.000 . 7.500 5.459 4.566 6.203 . 0 0 "[ . 1 . 2 .]" 2
983 1 12 ALA H 1 114 VAL H 0.000 . 5.000 3.517 2.682 4.270 . 0 0 "[ . 1 . 2 .]" 2
984 1 12 ALA H 1 115 GLU HA 0.000 . 4.000 3.756 3.062 4.046 0.046 23 0 "[ . 1 . 2 .]" 2
985 1 12 ALA H 1 116 ALA H 0.000 . 6.000 5.242 4.454 5.842 . 0 0 "[ . 1 . 2 .]" 2
986 1 13 ASP HA 1 67 PHE QE 0.000 . 9.000 4.991 4.116 5.729 . 0 0 "[ . 1 . 2 .]" 2
987 1 13 ASP HA 1 67 PHE HZ 0.000 . 5.000 4.348 3.092 5.001 0.001 11 0 "[ . 1 . 2 .]" 2
988 1 13 ASP HA 1 112 VAL H 0.000 . 6.000 5.256 4.565 5.765 . 0 0 "[ . 1 . 2 .]" 2
989 1 13 ASP HA 1 113 ALA HA 0.000 . 5.000 2.730 2.282 3.338 . 0 0 "[ . 1 . 2 .]" 2
990 1 13 ASP HA 1 113 ALA MB 0.000 . 6.500 3.817 3.243 4.406 . 0 0 "[ . 1 . 2 .]" 2
991 1 13 ASP HA 1 114 VAL H 0.000 . 4.000 3.778 3.162 4.061 0.061 16 0 "[ . 1 . 2 .]" 2
992 1 13 ASP QB 1 67 PHE QE 0.000 . 9.000 4.045 2.978 5.146 . 0 0 "[ . 1 . 2 .]" 2
993 1 13 ASP QB 1 67 PHE HZ 0.000 . 5.000 3.215 1.958 4.450 . 0 0 "[ . 1 . 2 .]" 2
994 1 13 ASP QB 1 113 ALA HA 0.000 . 7.000 4.041 2.774 5.174 . 0 0 "[ . 1 . 2 .]" 2
995 1 13 ASP QB 1 113 ALA MB 0.000 . 8.500 4.074 3.036 5.445 . 0 0 "[ . 1 . 2 .]" 2
996 1 13 ASP QB 1 114 VAL H 0.000 . 7.000 4.816 3.897 5.605 . 0 0 "[ . 1 . 2 .]" 2
997 1 13 ASP H 1 39 VAL MG1 0.000 . 7.500 5.056 3.981 6.020 . 0 0 "[ . 1 . 2 .]" 2
998 1 13 ASP H 1 67 PHE HZ 0.000 . 6.000 5.620 4.005 6.048 0.048 18 0 "[ . 1 . 2 .]" 2
999 1 14 VAL HA 1 39 VAL HA 0.000 . 7.000 6.194 5.301 7.153 0.153 21 0 "[ . 1 . 2 .]" 2
1000 1 14 VAL HA 1 95 ILE MD 0.000 . 7.500 5.058 4.583 5.763 . 0 0 "[ . 1 . 2 .]" 2
1001 1 14 VAL HA 1 112 VAL H 0.000 . 6.000 5.314 4.787 5.773 . 0 0 "[ . 1 . 2 .]" 2
1002 1 14 VAL HB 1 39 VAL MG2 0.000 . 5.500 2.884 2.188 4.387 . 0 0 "[ . 1 . 2 .]" 2
1003 1 14 VAL HB 1 95 ILE MD 0.000 . 4.500 2.878 2.150 3.607 . 0 0 "[ . 1 . 2 .]" 2
1004 1 14 VAL MG1 1 37 ALA HA 0.000 . 7.500 4.582 3.628 5.942 . 0 0 "[ . 1 . 2 .]" 2
1005 1 14 VAL MG1 1 37 ALA MB 0.000 . 6.000 2.632 1.844 3.871 . 0 0 "[ . 1 . 2 .]" 2
1006 1 14 VAL MG1 1 38 LYS H 0.000 . 6.500 3.461 2.634 4.609 . 0 0 "[ . 1 . 2 .]" 2
1007 1 14 VAL MG1 1 39 VAL HA 0.000 . 5.500 3.719 3.095 4.283 . 0 0 "[ . 1 . 2 .]" 2
1008 1 14 VAL MG1 1 39 VAL MG2 0.000 . 8.000 3.335 2.453 3.891 . 0 0 "[ . 1 . 2 .]" 2
1009 1 14 VAL MG1 1 40 HIS H 0.000 . 7.500 5.143 4.599 5.944 . 0 0 "[ . 1 . 2 .]" 2
1010 1 14 VAL MG1 1 95 ILE MD 0.000 . 5.500 2.833 2.117 3.860 . 0 0 "[ . 1 . 2 .]" 2
1011 1 14 VAL MG1 1 112 VAL HB 0.000 . 7.500 4.288 3.415 4.805 . 0 0 "[ . 1 . 2 .]" 2
1012 1 14 VAL MG1 1 112 VAL MG2 0.000 . 8.000 4.611 3.722 5.552 . 0 0 "[ . 1 . 2 .]" 2
1013 1 14 VAL MG1 1 112 VAL H 0.000 . 7.500 4.935 3.855 5.852 . 0 0 "[ . 1 . 2 .]" 2
1014 1 14 VAL MG2 1 39 VAL HA 0.000 . 4.500 2.682 1.907 3.537 . 0 0 "[ . 1 . 2 .]" 2
1015 1 14 VAL MG2 1 39 VAL MG1 0.000 . 6.000 3.073 2.468 3.851 . 0 0 "[ . 1 . 2 .]" 2
1016 1 14 VAL MG2 1 39 VAL MG2 0.000 . 6.000 2.754 1.635 3.669 . 0 0 "[ . 1 . 2 .]" 2
1017 1 14 VAL MG2 1 40 HIS H 0.000 . 6.500 3.650 2.760 5.186 . 0 0 "[ . 1 . 2 .]" 2
1018 1 14 VAL MG2 1 95 ILE MD 0.000 . 7.000 3.597 1.975 4.368 . 0 0 "[ . 1 . 2 .]" 2
1019 1 14 VAL MG2 1 112 VAL HB 0.000 . 7.500 4.398 2.189 5.581 . 0 0 "[ . 1 . 2 .]" 2
1020 1 14 VAL MG2 1 112 VAL H 0.000 . 7.500 5.351 3.201 5.964 . 0 0 "[ . 1 . 2 .]" 2
1021 1 14 VAL H 1 39 VAL MG1 0.000 . 7.500 4.844 4.056 5.813 . 0 0 "[ . 1 . 2 .]" 2
1022 1 14 VAL H 1 39 VAL MG2 0.000 . 6.500 4.136 3.299 4.891 . 0 0 "[ . 1 . 2 .]" 2
1023 1 14 VAL H 1 95 ILE MD 0.000 . 6.500 4.430 3.658 5.050 . 0 0 "[ . 1 . 2 .]" 2
1024 1 14 VAL H 1 112 VAL HB 0.000 . 5.000 3.523 2.889 4.123 . 0 0 "[ . 1 . 2 .]" 2
1025 1 14 VAL H 1 112 VAL H 0.000 . 4.000 3.766 2.898 4.070 0.070 22 0 "[ . 1 . 2 .]" 2
1026 1 14 VAL H 1 113 ALA HA 0.000 . 4.000 3.794 3.200 4.093 0.093 5 0 "[ . 1 . 2 .]" 2
1027 1 14 VAL H 1 113 ALA MB 0.000 . 6.500 4.734 4.397 5.056 . 0 0 "[ . 1 . 2 .]" 2
1028 1 14 VAL H 1 113 ALA H 0.000 . 6.000 5.347 5.074 5.673 . 0 0 "[ . 1 . 2 .]" 2
1029 1 14 VAL H 1 114 VAL H 0.000 . 6.000 5.103 4.450 5.658 . 0 0 "[ . 1 . 2 .]" 2
1030 1 15 SER HA 1 111 ARG HA 0.000 . 5.000 2.711 1.855 3.521 . 0 0 "[ . 1 . 2 .]" 2
1031 1 15 SER HA 1 111 ARG H 0.000 . 6.000 5.529 4.487 6.057 0.057 17 0 "[ . 1 . 2 .]" 2
1032 1 15 SER HA 1 112 VAL H 0.000 . 5.000 3.121 2.152 4.303 . 0 0 "[ . 1 . 2 .]" 2
1033 1 15 SER QB 1 111 ARG QG 0.000 . 9.000 3.495 2.070 6.744 . 0 0 "[ . 1 . 2 .]" 2
1034 1 15 SER QB 1 112 VAL H 0.000 . 7.000 4.869 3.304 5.906 . 0 0 "[ . 1 . 2 .]" 2
1035 1 16 GLU HA 1 37 ALA HA 0.000 . 6.000 5.390 4.368 6.053 0.053 7 0 "[ . 1 . 2 .]" 2
1036 1 16 GLU HA 1 37 ALA MB 0.000 . 5.500 2.634 1.721 3.231 . 0 0 "[ . 1 . 2 .]" 2
1037 1 16 GLU HA 1 95 ILE MD 0.000 . 5.500 3.382 2.490 4.070 . 0 0 "[ . 1 . 2 .]" 2
1038 1 16 GLU HA 1 95 ILE MG 0.000 . 5.500 3.271 1.941 4.065 . 0 0 "[ . 1 . 2 .]" 2
1039 1 16 GLU HA 1 112 VAL HB 0.000 . 6.000 5.569 4.290 6.109 0.109 22 0 "[ . 1 . 2 .]" 2
1040 1 16 GLU HA 1 112 VAL MG2 0.000 . 7.500 4.086 2.363 5.671 . 0 0 "[ . 1 . 2 .]" 2
1041 1 16 GLU QB 1 95 ILE MG 0.000 . 6.500 3.262 1.793 4.533 . 0 0 "[ . 1 . 2 .]" 2
1042 1 16 GLU QB 1 112 VAL MG2 0.000 . 9.500 3.648 2.496 5.755 . 0 0 "[ . 1 . 2 .]" 2
1043 1 16 GLU QG 1 95 ILE MD 0.000 . 8.500 4.414 2.850 5.709 . 0 0 "[ . 1 . 2 .]" 2
1044 1 16 GLU QG 1 95 ILE MG 0.000 . 6.500 3.135 2.000 4.583 . 0 0 "[ . 1 . 2 .]" 2
1045 1 16 GLU QG 1 96 SER HA 0.000 . 8.000 5.021 3.136 6.975 . 0 0 "[ . 1 . 2 .]" 2
1046 1 16 GLU QG 1 110 LYS H 0.000 . 7.000 5.209 3.288 6.250 . 0 0 "[ . 1 . 2 .]" 2
1047 1 16 GLU QG 1 112 VAL MG2 0.000 . 8.500 4.370 1.951 5.912 . 0 0 "[ . 1 . 2 .]" 2
1048 1 16 GLU H 1 37 ALA MB 0.000 . 7.500 4.536 3.964 5.153 . 0 0 "[ . 1 . 2 .]" 2
1049 1 16 GLU H 1 95 ILE MD 0.000 . 7.500 4.673 3.204 5.650 . 0 0 "[ . 1 . 2 .]" 2
1050 1 16 GLU H 1 95 ILE MG 0.000 . 7.500 4.599 3.305 5.624 . 0 0 "[ . 1 . 2 .]" 2
1051 1 16 GLU H 1 111 ARG HA 0.000 . 4.000 3.164 2.017 3.749 . 0 0 "[ . 1 . 2 .]" 2
1052 1 16 GLU H 1 111 ARG QB 0.000 . 6.000 4.920 3.372 5.438 . 0 0 "[ . 1 . 2 .]" 2
1053 1 16 GLU H 1 111 ARG H 0.000 . 6.000 5.311 3.551 6.051 0.051 12 0 "[ . 1 . 2 .]" 2
1054 1 16 GLU H 1 112 VAL H 0.000 . 5.000 4.342 2.698 5.064 0.064 16 0 "[ . 1 . 2 .]" 2
1055 1 17 TYR HA 1 37 ALA MB 0.000 . 7.500 4.261 2.831 5.775 . 0 0 "[ . 1 . 2 .]" 2
1056 1 17 TYR QB 1 36 THR HA 0.000 . 7.000 3.719 1.886 6.237 . 0 0 "[ . 1 . 2 .]" 2
1057 1 17 TYR QB 1 37 ALA MB 0.000 . 7.500 2.853 1.825 4.861 . 0 0 "[ . 1 . 2 .]" 2
1058 1 17 TYR QD 1 37 ALA MB 0.000 . 8.500 3.950 1.939 5.188 . 0 0 "[ . 1 . 2 .]" 2
1059 1 17 TYR QE 1 35 HIS HA 0.000 . 8.000 5.139 2.493 7.178 . 0 0 "[ . 1 . 2 .]" 2
1060 1 17 TYR QE 1 36 THR HA 0.000 . 7.000 5.633 3.791 6.547 . 0 0 "[ . 1 . 2 .]" 2
1061 1 17 TYR H 1 37 ALA MB 0.000 . 6.500 2.774 1.791 4.523 . 0 0 "[ . 1 . 2 .]" 2
1062 1 17 TYR H 1 37 ALA H 0.000 . 6.000 3.508 2.376 5.376 . 0 0 "[ . 1 . 2 .]" 2
1063 1 17 TYR H 1 95 ILE MG 0.000 . 7.500 4.615 2.748 5.709 . 0 0 "[ . 1 . 2 .]" 2
1064 1 18 HIS HA 1 36 THR MG 0.000 . 7.500 5.109 3.762 6.283 . 0 0 "[ . 1 . 2 .]" 2
1065 1 18 HIS QB 1 36 THR MG 0.000 . 8.500 4.787 1.811 6.182 . 0 0 "[ . 1 . 2 .]" 2
1066 1 18 HIS HD2 1 35 HIS HA 0.000 . 7.000 5.940 1.874 7.035 0.035 7 0 "[ . 1 . 2 .]" 2
1067 1 24 TRP QB 1 30 GLY QA 0.000 . 9.000 6.160 4.395 7.244 . 0 0 "[ . 1 . 2 .]" 2
1068 1 24 TRP QB 1 31 GLU QB 0.000 . 9.000 5.368 3.309 7.168 . 0 0 "[ . 1 . 2 .]" 2
1069 1 24 TRP HD1 1 31 GLU QB 0.000 . 8.000 5.962 3.481 7.150 . 0 0 "[ . 1 . 2 .]" 2
1070 1 36 THR HA 1 95 ILE HB 0.000 . 6.000 5.287 3.415 6.021 0.021 11 0 "[ . 1 . 2 .]" 2
1071 1 36 THR HA 1 96 SER QB 0.000 . 6.000 5.285 4.963 5.463 . 0 0 "[ . 1 . 2 .]" 2
1072 1 36 THR HB 1 95 ILE H 0.000 . 5.000 4.001 3.165 4.835 . 0 0 "[ . 1 . 2 .]" 2
1073 1 36 THR MG 1 95 ILE MG 0.000 . 10.000 4.485 3.499 5.611 . 0 0 "[ . 1 . 2 .]" 2
1074 1 36 THR MG 1 96 SER HA 0.000 . 8.500 2.876 2.011 3.710 . 0 0 "[ . 1 . 2 .]" 2
1075 1 36 THR MG 1 96 SER QB 0.000 . 6.500 2.458 1.928 2.970 . 0 0 "[ . 1 . 2 .]" 2
1076 1 36 THR MG 1 96 SER H 0.000 . 6.500 4.845 4.207 5.291 . 0 0 "[ . 1 . 2 .]" 2
1077 1 37 ALA HA 1 95 ILE MD 0.000 . 6.500 4.473 3.911 5.229 . 0 0 "[ . 1 . 2 .]" 2
1078 1 37 ALA MB 1 95 ILE HA 0.000 . 7.500 5.518 4.264 6.117 . 0 0 "[ . 1 . 2 .]" 2
1079 1 37 ALA MB 1 95 ILE HB 0.000 . 5.500 2.941 1.801 3.731 . 0 0 "[ . 1 . 2 .]" 2
1080 1 37 ALA MB 1 95 ILE MD 0.000 . 6.000 2.335 1.804 2.863 . 0 0 "[ . 1 . 2 .]" 2
1081 1 37 ALA MB 1 95 ILE MG 0.000 . 8.000 3.578 2.803 4.636 . 0 0 "[ . 1 . 2 .]" 2
1082 1 37 ALA MB 1 95 ILE H 0.000 . 6.500 4.139 2.969 4.742 . 0 0 "[ . 1 . 2 .]" 2
1083 1 37 ALA H 1 95 ILE HB 0.000 . 6.000 3.287 2.362 4.237 . 0 0 "[ . 1 . 2 .]" 2
1084 1 38 LYS HA 1 92 VAL QG 0.000 . 8.400 4.573 3.605 5.260 . 0 0 "[ . 1 . 2 .]" 2
1085 1 38 LYS HA 1 94 ALA HA 0.000 . 6.000 2.329 1.864 2.785 . 0 0 "[ . 1 . 2 .]" 2
1086 1 38 LYS HA 1 94 ALA MB 0.000 . 6.500 3.815 3.233 4.312 . 0 0 "[ . 1 . 2 .]" 2
1087 1 38 LYS HA 1 95 ILE QG 0.000 . 7.000 3.204 2.183 4.533 . 0 0 "[ . 1 . 2 .]" 2
1088 1 38 LYS HA 1 95 ILE H 0.000 . 4.000 2.863 2.098 3.480 . 0 0 "[ . 1 . 2 .]" 2
1089 1 38 LYS QB 1 92 VAL HA 0.000 . 8.000 5.358 4.424 6.174 . 0 0 "[ . 1 . 2 .]" 2
1090 1 38 LYS QB 1 92 VAL QG 0.000 . 6.400 3.212 2.525 3.738 . 0 0 "[ . 1 . 2 .]" 2
1091 1 38 LYS QB 1 93 VAL H 0.000 . 6.000 4.784 4.124 5.214 . 0 0 "[ . 1 . 2 .]" 2
1092 1 38 LYS QB 1 94 ALA MB 0.000 . 7.500 4.337 3.667 4.930 . 0 0 "[ . 1 . 2 .]" 2
1093 1 38 LYS QB 1 95 ILE H 0.000 . 7.000 4.785 4.073 5.372 . 0 0 "[ . 1 . 2 .]" 2
1094 1 38 LYS QD 1 92 VAL QG 0.000 . 7.400 3.261 1.976 4.490 . 0 0 "[ . 1 . 2 .]" 2
1095 1 38 LYS QD 1 94 ALA HA 0.000 . 7.000 3.865 1.877 5.345 . 0 0 "[ . 1 . 2 .]" 2
1096 1 38 LYS QD 1 94 ALA MB 0.000 . 7.500 3.465 1.968 5.068 . 0 0 "[ . 1 . 2 .]" 2
1097 1 38 LYS QE 1 92 VAL QG 0.000 . 7.400 3.578 1.790 4.733 . 0 0 "[ . 1 . 2 .]" 2
1098 1 38 LYS QE 1 94 ALA HA 0.000 . 7.000 4.163 2.812 5.156 . 0 0 "[ . 1 . 2 .]" 2
1099 1 38 LYS QE 1 94 ALA MB 0.000 . 6.500 3.323 1.827 4.617 . 0 0 "[ . 1 . 2 .]" 2
1100 1 38 LYS QG 1 92 VAL QG 0.000 . 7.400 3.627 2.606 4.349 . 0 0 "[ . 1 . 2 .]" 2
1101 1 38 LYS QG 1 93 VAL H 0.000 . 7.000 5.085 3.853 6.037 . 0 0 "[ . 1 . 2 .]" 2
1102 1 38 LYS QG 1 94 ALA HA 0.000 . 6.000 2.181 1.769 3.140 . 0 0 "[ . 1 . 2 .]" 2
1103 1 38 LYS QG 1 94 ALA H 0.000 . 6.000 4.236 3.092 5.036 . 0 0 "[ . 1 . 2 .]" 2
1104 1 38 LYS QG 1 95 ILE QG 0.000 . 8.000 4.535 3.803 5.596 . 0 0 "[ . 1 . 2 .]" 2
1105 1 38 LYS H 1 95 ILE MD 0.000 . 6.500 3.634 2.949 4.404 . 0 0 "[ . 1 . 2 .]" 2
1106 1 38 LYS H 1 95 ILE H 0.000 . 6.000 4.872 4.334 5.480 . 0 0 "[ . 1 . 2 .]" 2
1107 1 39 VAL HA 1 93 VAL MG2 0.000 . 8.500 6.314 5.455 7.044 . 0 0 "[ . 1 . 2 .]" 2
1108 1 39 VAL HA 1 112 VAL MG1 0.000 . 7.500 5.140 4.411 5.961 . 0 0 "[ . 1 . 2 .]" 2
1109 1 39 VAL HB 1 93 VAL HB 0.000 . 4.000 2.816 2.139 3.345 . 0 0 "[ . 1 . 2 .]" 2
1110 1 39 VAL HB 1 93 VAL MG1 0.000 . 5.500 4.151 3.729 4.552 . 0 0 "[ . 1 . 2 .]" 2
1111 1 39 VAL HB 1 93 VAL H 0.000 . 4.000 2.784 2.059 4.029 0.029 7 0 "[ . 1 . 2 .]" 2
1112 1 39 VAL MG1 1 92 VAL HA 0.000 . 8.500 4.329 3.747 5.186 . 0 0 "[ . 1 . 2 .]" 2
1113 1 39 VAL MG1 1 93 VAL HB 0.000 . 6.500 3.725 2.928 4.468 . 0 0 "[ . 1 . 2 .]" 2
1114 1 39 VAL MG1 1 114 VAL H 0.000 . 6.500 4.664 3.931 5.328 . 0 0 "[ . 1 . 2 .]" 2
1115 1 39 VAL MG2 1 93 VAL HB 0.000 . 5.500 3.479 2.599 4.589 . 0 0 "[ . 1 . 2 .]" 2
1116 1 39 VAL MG2 1 93 VAL MG2 0.000 . 8.000 4.543 3.720 5.387 . 0 0 "[ . 1 . 2 .]" 2
1117 1 39 VAL MG2 1 93 VAL H 0.000 . 6.500 4.174 3.546 5.244 . 0 0 "[ . 1 . 2 .]" 2
1118 1 39 VAL MG2 1 94 ALA HA 0.000 . 7.500 4.434 3.538 5.335 . 0 0 "[ . 1 . 2 .]" 2
1119 1 39 VAL MG2 1 95 ILE MD 0.000 . 5.500 1.972 1.591 2.481 . 0 0 "[ . 1 . 2 .]" 2
1120 1 39 VAL MG2 1 95 ILE QG 0.000 . 6.500 2.407 1.889 2.851 . 0 0 "[ . 1 . 2 .]" 2
1121 1 39 VAL MG2 1 95 ILE MG 0.000 . 8.000 4.151 3.649 4.547 . 0 0 "[ . 1 . 2 .]" 2
1122 1 39 VAL MG2 1 95 ILE H 0.000 . 6.500 4.306 3.568 4.854 . 0 0 "[ . 1 . 2 .]" 2
1123 1 39 VAL MG2 1 100 PHE HZ 0.000 . 7.500 5.307 4.543 6.072 . 0 0 "[ . 1 . 2 .]" 2
1124 1 39 VAL MG2 1 112 VAL HA 0.000 . 7.500 5.275 4.700 5.885 . 0 0 "[ . 1 . 2 .]" 2
1125 1 39 VAL MG2 1 112 VAL HB 0.000 . 5.500 3.397 2.766 3.890 . 0 0 "[ . 1 . 2 .]" 2
1126 1 39 VAL MG2 1 112 VAL MG1 0.000 . 6.000 2.277 1.832 2.967 . 0 0 "[ . 1 . 2 .]" 2
1127 1 39 VAL MG2 1 112 VAL MG2 0.000 . 8.000 3.624 2.983 4.329 . 0 0 "[ . 1 . 2 .]" 2
1128 1 39 VAL MG2 1 112 VAL H 0.000 . 7.500 5.307 4.636 5.937 . 0 0 "[ . 1 . 2 .]" 2
1129 1 39 VAL H 1 92 VAL HA 0.000 . 5.000 4.570 3.841 5.042 0.042 15 0 "[ . 1 . 2 .]" 2
1130 1 39 VAL H 1 93 VAL HB 0.000 . 5.000 4.046 3.202 4.740 . 0 0 "[ . 1 . 2 .]" 2
1131 1 39 VAL H 1 94 ALA HA 0.000 . 4.000 3.433 2.758 3.961 . 0 0 "[ . 1 . 2 .]" 2
1132 1 39 VAL H 1 94 ALA MB 0.000 . 6.500 4.801 4.274 5.173 . 0 0 "[ . 1 . 2 .]" 2
1133 1 39 VAL H 1 94 ALA H 0.000 . 6.000 4.886 4.379 5.313 . 0 0 "[ . 1 . 2 .]" 2
1134 1 39 VAL H 1 95 ILE MD 0.000 . 5.500 3.803 3.001 4.510 . 0 0 "[ . 1 . 2 .]" 2
1135 1 39 VAL H 1 95 ILE QG 0.000 . 6.000 3.727 2.819 4.745 . 0 0 "[ . 1 . 2 .]" 2
1136 1 40 HIS HA 1 92 VAL HA 0.000 . 4.000 3.228 2.219 3.867 . 0 0 "[ . 1 . 2 .]" 2
1137 1 40 HIS HA 1 92 VAL QG 0.000 . 6.400 2.910 2.141 3.956 . 0 0 "[ . 1 . 2 .]" 2
1138 1 40 HIS HA 1 93 VAL H 0.000 . 5.000 4.441 2.950 5.103 0.103 8 0 "[ . 1 . 2 .]" 2
1139 1 40 HIS QB 1 92 VAL HA 0.000 . 7.000 5.084 2.011 5.848 . 0 0 "[ . 1 . 2 .]" 2
1140 1 40 HIS QB 1 92 VAL QG 0.000 . 8.400 3.945 1.584 4.816 . 0 0 "[ . 1 . 2 .]" 2
1141 1 40 HIS HD2 1 90 ARG QB 0.000 . 9.000 6.214 4.164 7.826 . 0 0 "[ . 1 . 2 .]" 2
1142 1 40 HIS HD2 1 90 ARG QD 0.000 . 8.000 5.079 2.814 7.139 . 0 0 "[ . 1 . 2 .]" 2
1143 1 40 HIS HD2 1 90 ARG QG 0.000 . 8.000 5.531 3.396 7.143 . 0 0 "[ . 1 . 2 .]" 2
1144 1 40 HIS HD2 1 92 VAL HA 0.000 . 6.000 4.787 2.384 5.911 . 0 0 "[ . 1 . 2 .]" 2
1145 1 40 HIS HD2 1 92 VAL HB 0.000 . 7.000 5.361 3.117 7.048 0.048 6 0 "[ . 1 . 2 .]" 2
1146 1 40 HIS HD2 1 92 VAL QG 0.000 . 5.400 3.043 2.218 3.819 . 0 0 "[ . 1 . 2 .]" 2
1147 1 40 HIS H 1 92 VAL HA 0.000 . 6.000 5.275 4.434 5.611 . 0 0 "[ . 1 . 2 .]" 2
1148 1 40 HIS H 1 92 VAL QG 0.000 . 8.400 4.733 4.007 5.627 . 0 0 "[ . 1 . 2 .]" 2
1149 1 41 LEU HA 1 49 ILE MD 0.000 . 7.500 5.661 5.098 6.122 . 0 0 "[ . 1 . 2 .]" 2
1150 1 41 LEU QB 1 49 ILE MD 0.000 . 7.500 3.416 2.983 3.829 . 0 0 "[ . 1 . 2 .]" 2
1151 1 41 LEU QB 1 91 CYS H 0.000 . 7.000 3.130 2.401 4.112 . 0 0 "[ . 1 . 2 .]" 2
1152 1 41 LEU QD 1 52 ILE HA 0.000 . 8.400 5.865 5.048 6.248 . 0 0 "[ . 1 . 2 .]" 2
1153 1 41 LEU QD 1 52 ILE MD 0.000 . 7.900 4.019 3.363 4.683 . 0 0 "[ . 1 . 2 .]" 2
1154 1 41 LEU QD 1 85 CYS HA 0.000 . 8.400 5.365 4.814 5.880 . 0 0 "[ . 1 . 2 .]" 2
1155 1 41 LEU QD 1 85 CYS QB 0.000 . 9.400 4.247 3.590 4.770 . 0 0 "[ . 1 . 2 .]" 2
1156 1 41 LEU QD 1 114 VAL HA 0.000 . 9.400 4.929 4.608 5.286 . 0 0 "[ . 1 . 2 .]" 2
1157 1 41 LEU QD 1 114 VAL H 0.000 . 8.400 4.713 4.188 5.288 . 0 0 "[ . 1 . 2 .]" 2
1158 1 41 LEU QD 1 115 GLU H 0.000 . 8.400 4.496 3.918 5.094 . 0 0 "[ . 1 . 2 .]" 2
1159 1 41 LEU QD 1 116 ALA HA 0.000 . 8.400 4.426 3.817 4.970 . 0 0 "[ . 1 . 2 .]" 2
1160 1 41 LEU QD 1 116 ALA MB 0.000 . 6.900 2.345 1.869 2.753 . 0 0 "[ . 1 . 2 .]" 2
1161 1 41 LEU QD 1 116 ALA H 0.000 . 7.400 3.430 2.777 4.399 . 0 0 "[ . 1 . 2 .]" 2
1162 1 41 LEU MD1 1 81 LEU MD1 0.000 . 6.000 2.983 2.330 3.526 . 0 0 "[ . 1 . 2 .]" 2
1163 1 41 LEU MD1 1 91 CYS HA 0.000 . 7.500 5.317 3.939 6.136 . 0 0 "[ . 1 . 2 .]" 2
1164 1 41 LEU MD1 1 91 CYS QB 0.000 . 7.500 3.255 1.744 4.956 . 0 0 "[ . 1 . 2 .]" 2
1165 1 41 LEU MD1 1 114 VAL HB 0.000 . 5.500 3.384 2.870 3.970 . 0 0 "[ . 1 . 2 .]" 2
1166 1 41 LEU MD1 1 114 VAL MG1 0.000 . 6.000 2.309 1.980 2.688 . 0 0 "[ . 1 . 2 .]" 2
1167 1 41 LEU MD1 1 114 VAL MG2 0.000 . 6.000 3.798 3.400 4.021 . 0 0 "[ . 1 . 2 .]" 2
1168 1 41 LEU MD2 1 114 VAL HB 0.000 . 5.500 4.074 2.784 4.504 . 0 0 "[ . 1 . 2 .]" 2
1169 1 41 LEU HG 1 114 VAL MG1 0.000 . 5.500 4.370 3.983 4.532 . 0 0 "[ . 1 . 2 .]" 2
1170 1 41 LEU H 1 91 CYS H 0.000 . 4.000 3.612 2.794 4.083 0.083 24 0 "[ . 1 . 2 .]" 2
1171 1 41 LEU H 1 92 VAL HA 0.000 . 4.000 3.414 2.869 3.940 . 0 0 "[ . 1 . 2 .]" 2
1172 1 41 LEU H 1 92 VAL QG 0.000 . 7.400 3.517 2.512 4.917 . 0 0 "[ . 1 . 2 .]" 2
1173 1 41 LEU H 1 93 VAL H 0.000 . 6.000 4.936 4.485 5.519 . 0 0 "[ . 1 . 2 .]" 2
1174 1 42 LYS HA 1 49 ILE MD 0.000 . 7.500 4.639 3.581 5.849 . 0 0 "[ . 1 . 2 .]" 2
1175 1 42 LYS HA 1 90 ARG HA 0.000 . 5.000 2.350 1.924 2.800 . 0 0 "[ . 1 . 2 .]" 2
1176 1 42 LYS HA 1 90 ARG QB 0.000 . 6.000 3.417 2.014 4.263 . 0 0 "[ . 1 . 2 .]" 2
1177 1 42 LYS HA 1 90 ARG QD 0.000 . 6.000 4.223 2.815 5.154 . 0 0 "[ . 1 . 2 .]" 2
1178 1 42 LYS HA 1 90 ARG QG 0.000 . 6.000 3.053 1.927 4.931 . 0 0 "[ . 1 . 2 .]" 2
1179 1 42 LYS HA 1 91 CYS H 0.000 . 4.000 3.457 2.920 4.034 0.034 15 0 "[ . 1 . 2 .]" 2
1180 1 42 LYS QB 1 90 ARG HA 0.000 . 6.000 3.987 2.935 4.916 . 0 0 "[ . 1 . 2 .]" 2
1181 1 42 LYS QG 1 90 ARG HA 0.000 . 7.000 4.376 2.678 5.524 . 0 0 "[ . 1 . 2 .]" 2
1182 1 42 LYS QG 1 90 ARG QB 0.000 . 8.000 4.166 1.793 5.930 . 0 0 "[ . 1 . 2 .]" 2
1183 1 42 LYS QG 1 90 ARG QD 0.000 . 7.000 3.860 2.212 5.523 . 0 0 "[ . 1 . 2 .]" 2
1184 1 42 LYS H 1 90 ARG HA 0.000 . 5.000 4.933 4.749 5.104 0.104 16 0 "[ . 1 . 2 .]" 2
1185 1 43 CYS HA 1 118 CYS QB 0.000 . 8.000 4.470 3.911 5.047 . 0 0 "[ . 1 . 2 .]" 2
1186 1 43 CYS QB 1 48 THR HA 0.000 . 7.000 3.826 3.241 4.567 . 0 0 "[ . 1 . 2 .]" 2
1187 1 43 CYS QB 1 48 THR H 0.000 . 7.000 5.021 4.372 5.863 . 0 0 "[ . 1 . 2 .]" 2
1188 1 43 CYS QB 1 89 GLU HA 0.000 . 7.000 3.331 2.431 4.030 . 0 0 "[ . 1 . 2 .]" 2
1189 1 43 CYS QB 1 90 ARG H 0.000 . 7.000 5.235 4.043 5.905 . 0 0 "[ . 1 . 2 .]" 2
1190 1 43 CYS QB 1 118 CYS QB 0.000 . 8.000 3.465 2.551 4.172 . 0 0 "[ . 1 . 2 .]" 2
1191 1 43 CYS QB 1 118 CYS H 0.000 . 7.000 5.990 4.875 6.295 . 0 0 "[ . 1 . 2 .]" 2
1192 1 43 CYS H 1 49 ILE MD 0.000 . 7.500 4.571 3.822 6.039 . 0 0 "[ . 1 . 2 .]" 2
1193 1 43 CYS H 1 49 ILE QG 0.000 . 7.000 5.051 4.228 6.130 . 0 0 "[ . 1 . 2 .]" 2
1194 1 43 CYS H 1 89 GLU HA 0.000 . 5.000 4.481 4.207 4.961 . 0 0 "[ . 1 . 2 .]" 2
1195 1 43 CYS H 1 89 GLU QG 0.000 . 7.000 4.740 3.227 6.048 . 0 0 "[ . 1 . 2 .]" 2
1196 1 43 CYS H 1 90 ARG HA 0.000 . 4.000 3.111 2.787 3.509 . 0 0 "[ . 1 . 2 .]" 2
1197 1 43 CYS H 1 90 ARG QD 0.000 . 7.000 5.266 4.125 6.279 . 0 0 "[ . 1 . 2 .]" 2
1198 1 43 CYS H 1 90 ARG QG 0.000 . 6.000 4.101 2.929 5.432 . 0 0 "[ . 1 . 2 .]" 2
1199 1 43 CYS H 1 91 CYS H 0.000 . 5.000 5.002 4.715 5.143 0.143 11 0 "[ . 1 . 2 .]" 2
1200 1 43 CYS H 1 118 CYS QB 0.000 . 7.000 5.960 4.751 6.321 . 0 0 "[ . 1 . 2 .]" 2
1201 1 44 ALA H 1 118 CYS QB 0.000 . 6.000 4.620 3.146 5.339 . 0 0 "[ . 1 . 2 .]" 2
1202 1 46 GLY H 1 89 GLU QG 0.000 . 7.000 3.625 1.927 5.506 . 0 0 "[ . 1 . 2 .]" 2
1203 1 47 GLN HA 1 119 SER H 0.000 . 5.000 4.536 3.726 5.039 0.039 23 0 "[ . 1 . 2 .]" 2
1204 1 47 GLN HA 1 120 THR HA 0.000 . 6.000 2.658 1.848 3.448 . 0 0 "[ . 1 . 2 .]" 2
1205 1 47 GLN HA 1 120 THR HB 0.000 . 7.000 4.840 2.904 5.994 . 0 0 "[ . 1 . 2 .]" 2
1206 1 47 GLN HA 1 120 THR MG 0.000 . 5.500 4.125 2.683 4.677 . 0 0 "[ . 1 . 2 .]" 2
1207 1 47 GLN HA 1 121 ALA H 0.000 . 5.000 4.049 3.126 4.992 . 0 0 "[ . 1 . 2 .]" 2
1208 1 47 GLN QB 1 118 CYS HA 0.000 . 8.000 4.308 3.688 4.876 . 0 0 "[ . 1 . 2 .]" 2
1209 1 47 GLN QB 1 118 CYS QB 0.000 . 8.000 2.955 1.870 3.865 . 0 0 "[ . 1 . 2 .]" 2
1210 1 47 GLN QB 1 119 SER H 0.000 . 6.000 3.629 2.885 4.789 . 0 0 "[ . 1 . 2 .]" 2
1211 1 47 GLN QB 1 120 THR HA 0.000 . 7.000 3.931 3.211 4.928 . 0 0 "[ . 1 . 2 .]" 2
1212 1 47 GLN QB 1 120 THR MG 0.000 . 9.500 4.360 3.492 5.218 . 0 0 "[ . 1 . 2 .]" 2
1213 1 47 GLN QE 1 120 THR MG 0.000 . 8.500 3.825 2.250 5.551 . 0 0 "[ . 1 . 2 .]" 2
1214 1 47 GLN QG 1 118 CYS QB 0.000 . 9.000 4.231 2.968 5.383 . 0 0 "[ . 1 . 2 .]" 2
1215 1 47 GLN QG 1 120 THR HA 0.000 . 5.000 2.674 1.859 4.435 . 0 0 "[ . 1 . 2 .]" 2
1216 1 47 GLN QG 1 120 THR MG 0.000 . 7.500 2.843 1.691 3.813 . 0 0 "[ . 1 . 2 .]" 2
1217 1 47 GLN H 1 120 THR MG 0.000 . 7.500 5.741 4.217 6.339 . 0 0 "[ . 1 . 2 .]" 2
1218 1 48 THR HA 1 88 LEU H 0.000 . 5.000 4.699 3.868 5.108 0.108 17 0 "[ . 1 . 2 .]" 2
1219 1 48 THR HA 1 89 GLU HA 0.000 . 4.000 2.559 2.062 3.131 . 0 0 "[ . 1 . 2 .]" 2
1220 1 48 THR HA 1 89 GLU H 0.000 . 5.000 4.654 4.025 5.018 0.018 22 0 "[ . 1 . 2 .]" 2
1221 1 48 THR HA 1 90 ARG H 0.000 . 6.000 5.595 5.195 5.982 . 0 0 "[ . 1 . 2 .]" 2
1222 1 48 THR HB 1 86 ILE MG 0.000 . 8.500 5.471 4.510 6.273 . 0 0 "[ . 1 . 2 .]" 2
1223 1 48 THR HB 1 87 GLY QA 0.000 . 6.000 3.495 2.022 4.288 . 0 0 "[ . 1 . 2 .]" 2
1224 1 48 THR HB 1 87 GLY H 0.000 . 5.000 3.649 2.639 4.431 . 0 0 "[ . 1 . 2 .]" 2
1225 1 48 THR HB 1 88 LEU H 0.000 . 5.000 3.836 3.143 4.533 . 0 0 "[ . 1 . 2 .]" 2
1226 1 48 THR HB 1 89 GLU HA 0.000 . 5.000 4.352 3.842 4.978 . 0 0 "[ . 1 . 2 .]" 2
1227 1 48 THR HB 1 89 GLU H 0.000 . 6.000 5.130 4.423 5.865 . 0 0 "[ . 1 . 2 .]" 2
1228 1 48 THR MG 1 87 GLY QA 0.000 . 7.500 4.104 3.200 4.992 . 0 0 "[ . 1 . 2 .]" 2
1229 1 48 THR MG 1 87 GLY H 0.000 . 6.500 4.840 3.947 5.414 . 0 0 "[ . 1 . 2 .]" 2
1230 1 48 THR MG 1 89 GLU HA 0.000 . 5.500 3.011 2.098 3.979 . 0 0 "[ . 1 . 2 .]" 2
1231 1 48 THR MG 1 89 GLU QB 0.000 . 7.500 3.368 2.157 4.211 . 0 0 "[ . 1 . 2 .]" 2
1232 1 48 THR MG 1 89 GLU QG 0.000 . 8.500 3.256 1.699 5.083 . 0 0 "[ . 1 . 2 .]" 2
1233 1 48 THR H 1 89 GLU HA 0.000 . 6.000 5.175 4.678 5.566 . 0 0 "[ . 1 . 2 .]" 2
1234 1 48 THR H 1 118 CYS HA 0.000 . 5.000 4.712 4.104 5.020 0.020 9 0 "[ . 1 . 2 .]" 2
1235 1 48 THR H 1 118 CYS QB 0.000 . 6.000 4.933 4.185 5.300 . 0 0 "[ . 1 . 2 .]" 2
1236 1 48 THR H 1 119 SER HA 0.000 . 6.000 5.505 4.934 6.050 0.050 25 0 "[ . 1 . 2 .]" 2
1237 1 48 THR H 1 119 SER QB 0.000 . 7.000 5.293 4.433 6.306 . 0 0 "[ . 1 . 2 .]" 2
1238 1 48 THR H 1 119 SER H 0.000 . 4.000 3.545 2.942 4.059 0.059 5 0 "[ . 1 . 2 .]" 2
1239 1 48 THR H 1 120 THR HA 0.000 . 5.000 3.764 2.068 4.915 . 0 0 "[ . 1 . 2 .]" 2
1240 1 48 THR H 1 121 ALA HA 0.000 . 6.000 5.457 4.043 6.028 0.028 16 0 "[ . 1 . 2 .]" 2
1241 1 48 THR H 1 121 ALA H 0.000 . 6.000 4.537 2.546 5.557 . 0 0 "[ . 1 . 2 .]" 2
1242 1 49 ILE HA 1 118 CYS HA 0.000 . 4.000 2.372 1.945 2.704 . 0 0 "[ . 1 . 2 .]" 2
1243 1 49 ILE HA 1 119 SER H 0.000 . 4.000 3.896 3.494 4.145 0.145 17 0 "[ . 1 . 2 .]" 2
1244 1 49 ILE HB 1 85 CYS HA 0.000 . 7.000 4.961 4.456 5.680 . 0 0 "[ . 1 . 2 .]" 2
1245 1 49 ILE HB 1 85 CYS QB 0.000 . 7.000 4.293 3.733 4.955 . 0 0 "[ . 1 . 2 .]" 2
1246 1 49 ILE HB 1 86 ILE HA 0.000 . 5.000 2.589 1.902 3.384 . 0 0 "[ . 1 . 2 .]" 2
1247 1 49 ILE HB 1 86 ILE H 0.000 . 6.000 4.661 3.641 5.381 . 0 0 "[ . 1 . 2 .]" 2
1248 1 49 ILE HB 1 87 GLY H 0.000 . 5.000 3.045 2.528 3.763 . 0 0 "[ . 1 . 2 .]" 2
1249 1 49 ILE HB 1 88 LEU H 0.000 . 4.000 3.467 2.751 4.034 0.034 5 0 "[ . 1 . 2 .]" 2
1250 1 49 ILE HB 1 118 CYS HA 0.000 . 7.000 5.329 4.896 5.685 . 0 0 "[ . 1 . 2 .]" 2
1251 1 49 ILE MD 1 85 CYS HA 0.000 . 6.500 3.521 2.908 4.040 . 0 0 "[ . 1 . 2 .]" 2
1252 1 49 ILE MD 1 85 CYS QB 0.000 . 6.500 3.289 2.434 3.963 . 0 0 "[ . 1 . 2 .]" 2
1253 1 49 ILE MD 1 86 ILE H 0.000 . 6.500 4.591 3.807 5.153 . 0 0 "[ . 1 . 2 .]" 2
1254 1 49 ILE MD 1 88 LEU HA 0.000 . 8.500 5.108 4.429 5.819 . 0 0 "[ . 1 . 2 .]" 2
1255 1 49 ILE MD 1 88 LEU MD1 0.000 . 7.000 4.323 3.587 4.676 . 0 0 "[ . 1 . 2 .]" 2
1256 1 49 ILE MD 1 88 LEU H 0.000 . 5.500 3.439 2.829 4.033 . 0 0 "[ . 1 . 2 .]" 2
1257 1 49 ILE MD 1 89 GLU HA 0.000 . 8.500 4.117 3.245 5.158 . 0 0 "[ . 1 . 2 .]" 2
1258 1 49 ILE MD 1 90 ARG HA 0.000 . 6.500 3.700 3.007 4.625 . 0 0 "[ . 1 . 2 .]" 2
1259 1 49 ILE MD 1 90 ARG H 0.000 . 6.500 4.174 2.985 4.876 . 0 0 "[ . 1 . 2 .]" 2
1260 1 49 ILE MD 1 91 CYS HA 0.000 . 7.500 4.511 3.794 5.527 . 0 0 "[ . 1 . 2 .]" 2
1261 1 49 ILE MD 1 91 CYS QB 0.000 . 6.500 2.668 2.046 3.708 . 0 0 "[ . 1 . 2 .]" 2
1262 1 49 ILE MD 1 91 CYS H 0.000 . 6.500 3.847 3.121 4.698 . 0 0 "[ . 1 . 2 .]" 2
1263 1 49 ILE QG 1 88 LEU H 0.000 . 6.500 4.683 3.802 5.340 . 0 0 "[ . 1 . 2 .]" 2
1264 1 49 ILE QG 1 116 ALA MB 0.000 . 7.500 2.719 1.902 3.597 . 0 0 "[ . 1 . 2 .]" 2
1265 1 49 ILE QG 1 118 CYS HA 0.000 . 8.000 3.649 3.223 4.180 . 0 0 "[ . 1 . 2 .]" 2
1266 1 49 ILE MG 1 85 CYS QB 0.000 . 6.500 3.172 2.424 3.893 . 0 0 "[ . 1 . 2 .]" 2
1267 1 49 ILE MG 1 86 ILE HA 0.000 . 4.500 2.825 2.192 3.337 . 0 0 "[ . 1 . 2 .]" 2
1268 1 49 ILE MG 1 86 ILE MD 0.000 . 6.000 3.515 1.976 4.149 . 0 0 "[ . 1 . 2 .]" 2
1269 1 49 ILE MG 1 86 ILE QG 0.000 . 6.500 2.615 1.835 3.969 . 0 0 "[ . 1 . 2 .]" 2
1270 1 49 ILE MG 1 87 GLY H 0.000 . 6.500 4.106 3.296 4.819 . 0 0 "[ . 1 . 2 .]" 2
1271 1 49 ILE MG 1 116 ALA MB 0.000 . 6.000 2.390 1.821 2.819 . 0 0 "[ . 1 . 2 .]" 2
1272 1 49 ILE MG 1 117 VAL H 0.000 . 6.500 2.701 2.223 3.266 . 0 0 "[ . 1 . 2 .]" 2
1273 1 49 ILE MG 1 118 CYS HA 0.000 . 6.500 3.995 3.580 4.552 . 0 0 "[ . 1 . 2 .]" 2
1274 1 49 ILE MG 1 119 SER H 0.000 . 7.500 5.511 5.097 5.791 . 0 0 "[ . 1 . 2 .]" 2
1275 1 49 ILE H 1 87 GLY H 0.000 . 6.000 3.611 3.106 4.072 . 0 0 "[ . 1 . 2 .]" 2
1276 1 49 ILE H 1 88 LEU H 0.000 . 5.000 3.538 2.894 3.948 . 0 0 "[ . 1 . 2 .]" 2
1277 1 49 ILE H 1 89 GLU HA 0.000 . 5.000 3.773 2.904 4.498 . 0 0 "[ . 1 . 2 .]" 2
1278 1 50 SER HA 1 86 ILE HB 0.000 . 7.000 5.562 4.707 6.876 . 0 0 "[ . 1 . 2 .]" 2
1279 1 50 SER HA 1 86 ILE MD 0.000 . 6.500 4.060 2.819 5.244 . 0 0 "[ . 1 . 2 .]" 2
1280 1 50 SER HA 1 86 ILE MG 0.000 . 5.500 2.782 1.998 4.066 . 0 0 "[ . 1 . 2 .]" 2
1281 1 50 SER HA 1 87 GLY H 0.000 . 5.000 4.386 3.612 4.872 . 0 0 "[ . 1 . 2 .]" 2
1282 1 50 SER QB 1 86 ILE MG 0.000 . 8.500 4.335 3.581 5.610 . 0 0 "[ . 1 . 2 .]" 2
1283 1 50 SER QB 1 117 VAL QG 0.000 . 7.400 4.055 3.367 4.692 . 0 0 "[ . 1 . 2 .]" 2
1284 1 50 SER QB 1 119 SER H 0.000 . 7.000 4.247 3.271 5.310 . 0 0 "[ . 1 . 2 .]" 2
1285 1 50 SER H 1 117 VAL HB 0.000 . 6.000 3.696 3.089 4.203 . 0 0 "[ . 1 . 2 .]" 2
1286 1 50 SER H 1 117 VAL QG 0.000 . 7.400 3.830 2.831 4.425 . 0 0 "[ . 1 . 2 .]" 2
1287 1 50 SER H 1 117 VAL H 0.000 . 6.000 4.085 3.749 4.968 . 0 0 "[ . 1 . 2 .]" 2
1288 1 50 SER H 1 118 CYS HA 0.000 . 4.000 3.446 2.705 4.001 0.001 24 0 "[ . 1 . 2 .]" 2
1289 1 50 SER H 1 119 SER H 0.000 . 5.000 4.398 3.359 5.038 0.038 21 0 "[ . 1 . 2 .]" 2
1290 1 51 ALA HA 1 86 ILE MD 0.000 . 5.500 2.820 2.006 3.724 . 0 0 "[ . 1 . 2 .]" 2
1291 1 51 ALA HA 1 86 ILE MG 0.000 . 6.500 4.441 3.066 5.227 . 0 0 "[ . 1 . 2 .]" 2
1292 1 51 ALA MB 1 86 ILE MD 0.000 . 7.000 4.057 3.383 4.797 . 0 0 "[ . 1 . 2 .]" 2
1293 1 51 ALA MB 1 116 ALA HA 0.000 . 7.500 5.476 5.098 5.720 . 0 0 "[ . 1 . 2 .]" 2
1294 1 51 ALA MB 1 117 VAL HA 0.000 . 6.500 5.280 5.119 5.334 . 0 0 "[ . 1 . 2 .]" 2
1295 1 51 ALA MB 1 117 VAL HB 0.000 . 4.500 2.687 2.452 2.832 . 0 0 "[ . 1 . 2 .]" 2
1296 1 51 ALA MB 1 117 VAL MG2 0.000 . 5.500 3.027 2.714 3.365 . 0 0 "[ . 1 . 2 .]" 2
1297 1 51 ALA MB 1 117 VAL H 0.000 . 6.500 4.236 3.949 4.445 . 0 0 "[ . 1 . 2 .]" 2
1298 1 51 ALA H 1 86 ILE MD 0.000 . 6.500 4.094 3.362 4.678 . 0 0 "[ . 1 . 2 .]" 2
1299 1 51 ALA H 1 116 ALA HA 0.000 . 6.000 5.237 4.952 5.615 . 0 0 "[ . 1 . 2 .]" 2
1300 1 51 ALA H 1 116 ALA MB 0.000 . 6.500 4.857 4.444 5.249 . 0 0 "[ . 1 . 2 .]" 2
1301 1 51 ALA H 1 117 VAL HB 0.000 . 3.000 2.952 2.431 3.082 0.082 24 0 "[ . 1 . 2 .]" 2
1302 1 51 ALA H 1 117 VAL QG 0.000 . 6.400 3.671 3.242 3.803 . 0 0 "[ . 1 . 2 .]" 2
1303 1 51 ALA H 1 117 VAL H 0.000 . 4.000 3.411 3.192 3.753 . 0 0 "[ . 1 . 2 .]" 2
1304 1 51 ALA H 1 118 CYS HA 0.000 . 5.000 5.005 4.646 5.113 0.113 23 0 "[ . 1 . 2 .]" 2
1305 1 52 ILE HA 1 116 ALA HA 0.000 . 4.000 2.562 2.324 2.922 . 0 0 "[ . 1 . 2 .]" 2
1306 1 52 ILE HA 1 116 ALA MB 0.000 . 5.500 3.826 3.318 4.218 . 0 0 "[ . 1 . 2 .]" 2
1307 1 52 ILE HA 1 117 VAL H 0.000 . 4.000 3.384 2.949 3.904 . 0 0 "[ . 1 . 2 .]" 2
1308 1 52 ILE HB 1 78 ASN HA 0.000 . 6.000 5.068 4.268 5.774 . 0 0 "[ . 1 . 2 .]" 2
1309 1 52 ILE HB 1 82 GLU QB 0.000 . 7.000 4.414 3.256 5.359 . 0 0 "[ . 1 . 2 .]" 2
1310 1 52 ILE HB 1 82 GLU H 0.000 . 5.000 4.919 4.302 5.097 0.097 25 0 "[ . 1 . 2 .]" 2
1311 1 52 ILE HB 1 116 ALA HA 0.000 . 7.000 5.399 4.896 5.845 . 0 0 "[ . 1 . 2 .]" 2
1312 1 52 ILE MD 1 78 ASN HA 0.000 . 7.500 5.529 5.029 6.101 . 0 0 "[ . 1 . 2 .]" 2
1313 1 52 ILE MD 1 81 LEU HA 0.000 . 7.500 4.376 3.702 4.962 . 0 0 "[ . 1 . 2 .]" 2
1314 1 52 ILE MD 1 81 LEU QB 0.000 . 7.500 2.590 1.828 3.359 . 0 0 "[ . 1 . 2 .]" 2
1315 1 52 ILE MD 1 81 LEU MD1 0.000 . 7.000 2.975 2.131 3.780 . 0 0 "[ . 1 . 2 .]" 2
1316 1 52 ILE MD 1 81 LEU HG 0.000 . 6.500 4.026 2.980 5.256 . 0 0 "[ . 1 . 2 .]" 2
1317 1 52 ILE MD 1 81 LEU H 0.000 . 7.500 5.433 4.514 6.073 . 0 0 "[ . 1 . 2 .]" 2
1318 1 52 ILE MD 1 82 GLU HA 0.000 . 6.500 3.661 2.195 4.580 . 0 0 "[ . 1 . 2 .]" 2
1319 1 52 ILE MD 1 82 GLU QG 0.000 . 8.500 4.229 3.272 5.630 . 0 0 "[ . 1 . 2 .]" 2
1320 1 52 ILE MD 1 82 GLU H 0.000 . 7.500 4.409 2.970 5.112 . 0 0 "[ . 1 . 2 .]" 2
1321 1 52 ILE MD 1 85 CYS HA 0.000 . 8.500 5.157 4.217 5.827 . 0 0 "[ . 1 . 2 .]" 2
1322 1 52 ILE MD 1 85 CYS QB 0.000 . 7.500 2.709 1.950 3.261 . 0 0 "[ . 1 . 2 .]" 2
1323 1 52 ILE MD 1 85 CYS H 0.000 . 7.500 5.202 4.356 6.007 . 0 0 "[ . 1 . 2 .]" 2
1324 1 52 ILE MD 1 86 ILE HB 0.000 . 6.500 5.150 4.272 5.357 . 0 0 "[ . 1 . 2 .]" 2
1325 1 52 ILE MD 1 86 ILE QG 0.000 . 8.500 2.951 2.557 3.520 . 0 0 "[ . 1 . 2 .]" 2
1326 1 52 ILE MD 1 86 ILE H 0.000 . 7.500 4.378 3.329 5.569 . 0 0 "[ . 1 . 2 .]" 2
1327 1 52 ILE MD 1 114 VAL MG1 0.000 . 7.000 3.598 2.784 4.221 . 0 0 "[ . 1 . 2 .]" 2
1328 1 52 ILE MD 1 114 VAL MG2 0.000 . 8.000 5.143 4.373 5.480 . 0 0 "[ . 1 . 2 .]" 2
1329 1 52 ILE MD 1 116 ALA HA 0.000 . 6.500 2.708 2.201 3.838 . 0 0 "[ . 1 . 2 .]" 2
1330 1 52 ILE MD 1 116 ALA MB 0.000 . 5.500 2.733 2.081 3.239 . 0 0 "[ . 1 . 2 .]" 2
1331 1 52 ILE MD 1 117 VAL H 0.000 . 6.500 3.499 3.079 4.239 . 0 0 "[ . 1 . 2 .]" 2
1332 1 52 ILE QG 1 81 LEU HA 0.000 . 6.000 4.673 3.977 5.117 . 0 0 "[ . 1 . 2 .]" 2
1333 1 52 ILE QG 1 82 GLU HA 0.000 . 7.000 2.888 1.985 4.303 . 0 0 "[ . 1 . 2 .]" 2
1334 1 52 ILE QG 1 82 GLU QG 0.000 . 9.000 3.084 1.740 5.653 . 0 0 "[ . 1 . 2 .]" 2
1335 1 52 ILE QG 1 82 GLU H 0.000 . 5.000 3.415 2.818 4.289 . 0 0 "[ . 1 . 2 .]" 2
1336 1 52 ILE QG 1 86 ILE MD 0.000 . 6.500 2.594 1.965 4.624 . 0 0 "[ . 1 . 2 .]" 2
1337 1 52 ILE MG 1 78 ASN HA 0.000 . 6.500 3.571 2.908 3.972 . 0 0 "[ . 1 . 2 .]" 2
1338 1 52 ILE MG 1 78 ASN QB 0.000 . 8.500 3.954 2.204 4.886 . 0 0 "[ . 1 . 2 .]" 2
1339 1 52 ILE MG 1 78 ASN QD 0.000 . 8.500 3.539 1.818 5.995 . 0 0 "[ . 1 . 2 .]" 2
1340 1 52 ILE MG 1 81 LEU HA 0.000 . 7.500 4.969 4.310 5.687 . 0 0 "[ . 1 . 2 .]" 2
1341 1 52 ILE MG 1 81 LEU QB 0.000 . 6.500 2.513 1.829 3.088 . 0 0 "[ . 1 . 2 .]" 2
1342 1 52 ILE MG 1 81 LEU H 0.000 . 6.500 4.847 4.067 5.278 . 0 0 "[ . 1 . 2 .]" 2
1343 1 52 ILE MG 1 82 GLU H 0.000 . 6.500 4.283 3.527 4.829 . 0 0 "[ . 1 . 2 .]" 2
1344 1 52 ILE MG 1 85 CYS QB 0.000 . 8.500 4.751 3.972 5.465 . 0 0 "[ . 1 . 2 .]" 2
1345 1 52 ILE MG 1 114 VAL HA 0.000 . 8.500 4.637 4.264 5.134 . 0 0 "[ . 1 . 2 .]" 2
1346 1 52 ILE MG 1 114 VAL MG2 0.000 . 7.000 4.251 3.770 4.761 . 0 0 "[ . 1 . 2 .]" 2
1347 1 52 ILE MG 1 115 GLU H 0.000 . 6.500 3.492 3.007 4.028 . 0 0 "[ . 1 . 2 .]" 2
1348 1 52 ILE MG 1 116 ALA HA 0.000 . 6.500 3.414 3.098 3.967 . 0 0 "[ . 1 . 2 .]" 2
1349 1 52 ILE MG 1 116 ALA MB 0.000 . 7.000 3.936 3.482 4.650 . 0 0 "[ . 1 . 2 .]" 2
1350 1 52 ILE MG 1 117 VAL H 0.000 . 7.500 4.937 4.498 5.395 . 0 0 "[ . 1 . 2 .]" 2
1351 1 52 ILE H 1 82 GLU HA 0.000 . 6.000 5.156 4.476 6.009 0.009 20 0 "[ . 1 . 2 .]" 2
1352 1 52 ILE H 1 82 GLU QG 0.000 . 6.000 4.116 3.032 5.226 . 0 0 "[ . 1 . 2 .]" 2
1353 1 52 ILE H 1 86 ILE MD 0.000 . 5.500 3.342 2.288 4.131 . 0 0 "[ . 1 . 2 .]" 2
1354 1 52 ILE H 1 117 VAL QG 0.000 . 8.400 4.566 3.837 5.408 . 0 0 "[ . 1 . 2 .]" 2
1355 1 53 LYS HA 1 117 VAL MG2 0.000 . 6.500 3.985 3.013 5.082 . 0 0 "[ . 1 . 2 .]" 2
1356 1 53 LYS QB 1 115 GLU QB 0.000 . 8.000 2.592 1.697 4.145 . 0 0 "[ . 1 . 2 .]" 2
1357 1 53 LYS QB 1 115 GLU QG 0.000 . 9.000 3.639 1.856 5.628 . 0 0 "[ . 1 . 2 .]" 2
1358 1 53 LYS QE 1 117 VAL HB 0.000 . 7.000 5.515 4.424 6.309 . 0 0 "[ . 1 . 2 .]" 2
1359 1 53 LYS QE 1 117 VAL MG2 0.000 . 7.500 3.010 2.110 4.076 . 0 0 "[ . 1 . 2 .]" 2
1360 1 53 LYS H 1 114 VAL MG1 0.000 . 6.500 5.161 4.629 5.374 . 0 0 "[ . 1 . 2 .]" 2
1361 1 53 LYS H 1 115 GLU QB 0.000 . 7.000 3.460 2.867 4.355 . 0 0 "[ . 1 . 2 .]" 2
1362 1 53 LYS H 1 115 GLU H 0.000 . 6.000 4.597 4.058 5.111 . 0 0 "[ . 1 . 2 .]" 2
1363 1 53 LYS H 1 116 ALA HA 0.000 . 4.000 3.095 2.459 3.627 . 0 0 "[ . 1 . 2 .]" 2
1364 1 53 LYS H 1 116 ALA MB 0.000 . 7.500 4.619 4.078 5.024 . 0 0 "[ . 1 . 2 .]" 2
1365 1 53 LYS H 1 116 ALA H 0.000 . 6.000 4.943 4.181 5.499 . 0 0 "[ . 1 . 2 .]" 2
1366 1 53 LYS H 1 117 VAL QG 0.000 . 8.400 3.027 2.533 3.886 . 0 0 "[ . 1 . 2 .]" 2
1367 1 53 LYS H 1 117 VAL H 0.000 . 6.000 4.232 3.452 5.036 . 0 0 "[ . 1 . 2 .]" 2
1368 1 54 PHE HA 1 115 GLU H 0.000 . 6.000 5.033 4.498 5.419 . 0 0 "[ . 1 . 2 .]" 2
1369 1 54 PHE HA 1 115 GLU QG 0.000 . 8.000 6.279 5.060 6.851 . 0 0 "[ . 1 . 2 .]" 2
1370 1 54 PHE QB 1 67 PHE QB 0.000 . 9.000 3.393 2.443 4.308 . 0 0 "[ . 1 . 2 .]" 2
1371 1 54 PHE QB 1 67 PHE QD 0.000 . 9.000 3.679 2.922 4.742 . 0 0 "[ . 1 . 2 .]" 2
1372 1 54 PHE QB 1 114 VAL HA 0.000 . 8.000 4.021 3.153 4.715 . 0 0 "[ . 1 . 2 .]" 2
1373 1 54 PHE QB 1 115 GLU QB 0.000 . 9.000 2.201 1.779 2.947 . 0 0 "[ . 1 . 2 .]" 2
1374 1 54 PHE QB 1 115 GLU QG 0.000 . 9.000 3.759 2.222 4.806 . 0 0 "[ . 1 . 2 .]" 2
1375 1 54 PHE QB 1 115 GLU H 0.000 . 6.000 3.358 2.246 4.196 . 0 0 "[ . 1 . 2 .]" 2
1376 1 54 PHE QD 1 67 PHE QB 0.000 . 8.000 3.015 2.290 3.609 . 0 0 "[ . 1 . 2 .]" 2
1377 1 54 PHE QD 1 73 HIS HE1 0.000 . 9.000 6.909 5.252 7.665 . 0 0 "[ . 1 . 2 .]" 2
1378 1 54 PHE QD 1 113 ALA MB 0.000 . 7.500 3.399 2.736 4.005 . 0 0 "[ . 1 . 2 .]" 2
1379 1 54 PHE QD 1 114 VAL HA 0.000 . 7.000 3.159 1.973 3.783 . 0 0 "[ . 1 . 2 .]" 2
1380 1 54 PHE QD 1 114 VAL MG1 0.000 . 10.500 4.881 3.852 5.346 . 0 0 "[ . 1 . 2 .]" 2
1381 1 54 PHE QD 1 114 VAL MG2 0.000 . 9.500 4.515 3.800 5.096 . 0 0 "[ . 1 . 2 .]" 2
1382 1 54 PHE QD 1 114 VAL H 0.000 . 8.000 4.712 3.600 5.303 . 0 0 "[ . 1 . 2 .]" 2
1383 1 54 PHE QD 1 115 GLU QB 0.000 . 9.000 3.439 2.763 4.065 . 0 0 "[ . 1 . 2 .]" 2
1384 1 54 PHE QD 1 115 GLU H 0.000 . 7.000 3.914 3.003 4.635 . 0 0 "[ . 1 . 2 .]" 2
1385 1 54 PHE QE 1 60 PRO HA 0.000 . 8.000 4.692 4.018 6.296 . 0 0 "[ . 1 . 2 .]" 2
1386 1 54 PHE QE 1 60 PRO QB 0.000 . 8.000 3.031 2.311 3.869 . 0 0 "[ . 1 . 2 .]" 2
1387 1 54 PHE QE 1 61 LEU H 0.000 . 8.000 5.053 4.463 6.120 . 0 0 "[ . 1 . 2 .]" 2
1388 1 54 PHE QE 1 68 GLN HA 0.000 . 6.000 3.568 2.222 5.031 . 0 0 "[ . 1 . 2 .]" 2
1389 1 54 PHE QE 1 68 GLN H 0.000 . 7.000 4.150 2.855 5.424 . 0 0 "[ . 1 . 2 .]" 2
1390 1 54 PHE QE 1 69 GLN HA 0.000 . 7.000 4.085 2.908 5.243 . 0 0 "[ . 1 . 2 .]" 2
1391 1 54 PHE QE 1 69 GLN H 0.000 . 6.000 3.739 1.946 5.213 . 0 0 "[ . 1 . 2 .]" 2
1392 1 54 PHE QE 1 73 HIS HE1 0.000 . 9.000 6.068 4.063 6.760 . 0 0 "[ . 1 . 2 .]" 2
1393 1 54 PHE QE 1 113 ALA MB 0.000 . 7.500 2.481 1.742 3.015 . 0 0 "[ . 1 . 2 .]" 2
1394 1 54 PHE QE 1 113 ALA H 0.000 . 7.000 4.579 3.743 5.406 . 0 0 "[ . 1 . 2 .]" 2
1395 1 54 PHE H 1 114 VAL HA 0.000 . 5.000 4.887 4.490 5.126 0.126 15 0 "[ . 1 . 2 .]" 2
1396 1 54 PHE H 1 114 VAL MG1 0.000 . 6.500 4.436 3.942 4.752 . 0 0 "[ . 1 . 2 .]" 2
1397 1 54 PHE H 1 115 GLU QB 0.000 . 5.000 2.605 2.056 3.310 . 0 0 "[ . 1 . 2 .]" 2
1398 1 54 PHE H 1 115 GLU QG 0.000 . 7.000 4.529 3.503 5.292 . 0 0 "[ . 1 . 2 .]" 2
1399 1 54 PHE H 1 115 GLU H 0.000 . 4.000 3.253 2.877 3.505 . 0 0 "[ . 1 . 2 .]" 2
1400 1 54 PHE H 1 116 ALA HA 0.000 . 5.000 4.615 3.943 5.023 0.023 9 0 "[ . 1 . 2 .]" 2
1401 1 54 PHE H 1 117 VAL QG 0.000 . 8.400 4.856 4.432 5.390 . 0 0 "[ . 1 . 2 .]" 2
1402 1 54 PHE HZ 1 60 PRO HA 0.000 . 6.000 4.025 3.019 5.633 . 0 0 "[ . 1 . 2 .]" 2
1403 1 54 PHE HZ 1 60 PRO QB 0.000 . 5.000 3.330 2.402 4.352 . 0 0 "[ . 1 . 2 .]" 2
1404 1 54 PHE HZ 1 60 PRO QD 0.000 . 8.000 5.917 5.206 6.930 . 0 0 "[ . 1 . 2 .]" 2
1405 1 54 PHE HZ 1 61 LEU H 0.000 . 6.000 4.555 3.888 5.492 . 0 0 "[ . 1 . 2 .]" 2
1406 1 54 PHE HZ 1 68 GLN HA 0.000 . 6.000 4.324 3.361 5.150 . 0 0 "[ . 1 . 2 .]" 2
1407 1 54 PHE HZ 1 68 GLN H 0.000 . 6.000 3.880 2.566 5.902 . 0 0 "[ . 1 . 2 .]" 2
1408 1 54 PHE HZ 1 69 GLN HA 0.000 . 5.000 3.448 2.507 4.317 . 0 0 "[ . 1 . 2 .]" 2
1409 1 54 PHE HZ 1 69 GLN QB 0.000 . 8.000 4.561 3.191 5.657 . 0 0 "[ . 1 . 2 .]" 2
1410 1 54 PHE HZ 1 69 GLN QG 0.000 . 8.000 4.721 1.915 6.418 . 0 0 "[ . 1 . 2 .]" 2
1411 1 54 PHE HZ 1 69 GLN H 0.000 . 5.000 4.349 3.210 5.061 0.061 22 0 "[ . 1 . 2 .]" 2
1412 1 54 PHE HZ 1 70 GLY H 0.000 . 6.000 5.140 3.895 5.999 . 0 0 "[ . 1 . 2 .]" 2
1413 1 54 PHE HZ 1 73 HIS HE1 0.000 . 7.000 6.413 4.221 7.045 0.045 7 0 "[ . 1 . 2 .]" 2
1414 1 54 PHE HZ 1 113 ALA MB 0.000 . 6.500 4.298 3.104 4.904 . 0 0 "[ . 1 . 2 .]" 2
1415 1 55 ALA HA 1 78 ASN HA 0.000 . 7.000 5.321 4.397 6.071 . 0 0 "[ . 1 . 2 .]" 2
1416 1 55 ALA HA 1 81 LEU QD 0.000 . 8.400 4.554 3.486 5.144 . 0 0 "[ . 1 . 2 .]" 2
1417 1 55 ALA HA 1 113 ALA H 0.000 . 5.000 4.787 4.000 5.051 0.051 5 0 "[ . 1 . 2 .]" 2
1418 1 55 ALA HA 1 114 VAL HA 0.000 . 5.000 2.350 1.912 2.780 . 0 0 "[ . 1 . 2 .]" 2
1419 1 55 ALA HA 1 114 VAL MG2 0.000 . 6.500 2.346 1.826 2.907 . 0 0 "[ . 1 . 2 .]" 2
1420 1 55 ALA HA 1 114 VAL H 0.000 . 6.000 4.897 4.276 5.401 . 0 0 "[ . 1 . 2 .]" 2
1421 1 55 ALA HA 1 115 GLU H 0.000 . 5.000 3.862 3.528 4.132 . 0 0 "[ . 1 . 2 .]" 2
1422 1 55 ALA MB 1 73 HIS HE1 0.000 . 7.500 4.772 3.890 5.662 . 0 0 "[ . 1 . 2 .]" 2
1423 1 55 ALA MB 1 77 SER QB 0.000 . 6.500 2.942 1.765 3.683 . 0 0 "[ . 1 . 2 .]" 2
1424 1 55 ALA MB 1 77 SER H 0.000 . 7.500 5.159 4.119 6.031 . 0 0 "[ . 1 . 2 .]" 2
1425 1 55 ALA MB 1 78 ASN HA 0.000 . 4.500 2.446 1.770 3.078 . 0 0 "[ . 1 . 2 .]" 2
1426 1 55 ALA MB 1 78 ASN QB 0.000 . 7.500 3.196 1.688 4.222 . 0 0 "[ . 1 . 2 .]" 2
1427 1 55 ALA MB 1 78 ASN QD 0.000 . 8.500 3.368 1.883 4.592 . 0 0 "[ . 1 . 2 .]" 2
1428 1 55 ALA MB 1 78 ASN H 0.000 . 6.500 3.762 2.468 4.658 . 0 0 "[ . 1 . 2 .]" 2
1429 1 55 ALA MB 1 81 LEU HA 0.000 . 7.500 5.367 4.783 6.005 . 0 0 "[ . 1 . 2 .]" 2
1430 1 55 ALA MB 1 81 LEU QB 0.000 . 7.500 3.182 2.632 3.943 . 0 0 "[ . 1 . 2 .]" 2
1431 1 55 ALA MB 1 81 LEU QD 0.000 . 7.900 2.903 2.053 3.512 . 0 0 "[ . 1 . 2 .]" 2
1432 1 55 ALA MB 1 81 LEU HG 0.000 . 5.500 2.725 1.935 3.882 . 0 0 "[ . 1 . 2 .]" 2
1433 1 55 ALA MB 1 100 PHE QE 0.000 . 9.500 4.593 3.454 5.522 . 0 0 "[ . 1 . 2 .]" 2
1434 1 55 ALA MB 1 100 PHE HZ 0.000 . 8.500 5.361 4.091 5.997 . 0 0 "[ . 1 . 2 .]" 2
1435 1 55 ALA MB 1 114 VAL HA 0.000 . 6.500 3.306 2.779 3.912 . 0 0 "[ . 1 . 2 .]" 2
1436 1 55 ALA H 1 78 ASN QB 0.000 . 7.000 5.031 2.810 6.194 . 0 0 "[ . 1 . 2 .]" 2
1437 1 55 ALA H 1 78 ASN QD 0.000 . 6.000 4.388 2.735 5.354 . 0 0 "[ . 1 . 2 .]" 2
1438 1 55 ALA H 1 114 VAL HA 0.000 . 5.000 4.456 3.799 4.831 . 0 0 "[ . 1 . 2 .]" 2
1439 1 55 ALA H 1 114 VAL MG2 0.000 . 6.500 4.823 4.318 5.304 . 0 0 "[ . 1 . 2 .]" 2
1440 1 55 ALA H 1 115 GLU H 0.000 . 6.000 4.988 4.429 5.434 . 0 0 "[ . 1 . 2 .]" 2
1441 1 56 SER HA 1 73 HIS HE1 0.000 . 4.000 2.381 1.840 3.378 . 0 0 "[ . 1 . 2 .]" 2
1442 1 56 SER HA 1 74 SER H 0.000 . 5.000 4.595 3.754 5.021 0.021 2 0 "[ . 1 . 2 .]" 2
1443 1 56 SER HA 1 77 SER HA 0.000 . 5.000 4.186 2.919 4.743 . 0 0 "[ . 1 . 2 .]" 2
1444 1 56 SER HA 1 77 SER QB 0.000 . 6.000 2.102 1.750 3.065 . 0 0 "[ . 1 . 2 .]" 2
1445 1 56 SER HA 1 77 SER H 0.000 . 5.000 4.696 3.776 5.045 0.045 24 0 "[ . 1 . 2 .]" 2
1446 1 56 SER QB 1 69 GLN HA 0.000 . 8.000 3.899 3.025 4.809 . 0 0 "[ . 1 . 2 .]" 2
1447 1 56 SER QB 1 69 GLN H 0.000 . 7.000 5.646 4.131 6.285 . 0 0 "[ . 1 . 2 .]" 2
1448 1 56 SER QB 1 73 HIS QB 0.000 . 9.000 4.352 2.966 5.530 . 0 0 "[ . 1 . 2 .]" 2
1449 1 56 SER QB 1 73 HIS HE1 0.000 . 7.000 3.557 2.225 5.248 . 0 0 "[ . 1 . 2 .]" 2
1450 1 56 SER QB 1 77 SER HA 0.000 . 8.000 5.928 4.760 6.469 . 0 0 "[ . 1 . 2 .]" 2
1451 1 56 SER QB 1 77 SER QB 0.000 . 9.000 3.686 3.017 4.355 . 0 0 "[ . 1 . 2 .]" 2
1452 1 56 SER QB 1 113 ALA MB 0.000 . 8.500 3.734 2.584 4.914 . 0 0 "[ . 1 . 2 .]" 2
1453 1 56 SER H 1 73 HIS HE1 0.000 . 7.000 5.091 4.351 6.252 . 0 0 "[ . 1 . 2 .]" 2
1454 1 56 SER H 1 77 SER HA 0.000 . 6.000 5.687 4.962 6.063 0.063 7 0 "[ . 1 . 2 .]" 2
1455 1 56 SER H 1 77 SER QB 0.000 . 7.000 3.750 2.844 4.424 . 0 0 "[ . 1 . 2 .]" 2
1456 1 56 SER H 1 112 VAL HA 0.000 . 6.000 5.026 4.308 5.818 . 0 0 "[ . 1 . 2 .]" 2
1457 1 56 SER H 1 112 VAL MG1 0.000 . 6.500 4.673 3.832 5.231 . 0 0 "[ . 1 . 2 .]" 2
1458 1 56 SER H 1 113 ALA MB 0.000 . 6.500 3.533 2.846 3.903 . 0 0 "[ . 1 . 2 .]" 2
1459 1 56 SER H 1 113 ALA H 0.000 . 4.000 3.493 3.053 4.120 0.120 10 0 "[ . 1 . 2 .]" 2
1460 1 56 SER H 1 114 VAL HA 0.000 . 4.000 3.908 3.662 4.047 0.047 7 0 "[ . 1 . 2 .]" 2
1461 1 56 SER H 1 114 VAL MG2 0.000 . 6.500 3.385 2.775 4.263 . 0 0 "[ . 1 . 2 .]" 2
1462 1 56 SER H 1 114 VAL H 0.000 . 6.000 5.468 5.123 5.807 . 0 0 "[ . 1 . 2 .]" 2
1463 1 56 SER H 1 115 GLU H 0.000 . 6.000 5.834 5.528 6.009 0.009 8 0 "[ . 1 . 2 .]" 2
1464 1 57 PHE HA 1 74 SER H 0.000 . 6.000 5.633 5.084 6.001 0.001 1 0 "[ . 1 . 2 .]" 2
1465 1 57 PHE HA 1 100 PHE QE 0.000 . 9.000 5.201 4.194 5.894 . 0 0 "[ . 1 . 2 .]" 2
1466 1 57 PHE HA 1 111 ARG H 0.000 . 6.000 4.948 4.182 5.760 . 0 0 "[ . 1 . 2 .]" 2
1467 1 57 PHE HA 1 112 VAL HA 0.000 . 5.000 2.921 2.465 3.259 . 0 0 "[ . 1 . 2 .]" 2
1468 1 57 PHE HA 1 112 VAL HB 0.000 . 7.000 5.553 4.936 5.925 . 0 0 "[ . 1 . 2 .]" 2
1469 1 57 PHE HA 1 112 VAL MG1 0.000 . 7.500 3.785 2.864 4.459 . 0 0 "[ . 1 . 2 .]" 2
1470 1 57 PHE HA 1 112 VAL MG2 0.000 . 5.500 3.151 2.597 3.650 . 0 0 "[ . 1 . 2 .]" 2
1471 1 57 PHE HA 1 112 VAL H 0.000 . 6.000 5.512 4.990 6.013 0.013 6 0 "[ . 1 . 2 .]" 2
1472 1 57 PHE HA 1 113 ALA H 0.000 . 4.000 3.955 3.669 4.058 0.058 16 0 "[ . 1 . 2 .]" 2
1473 1 57 PHE QB 1 74 SER H 0.000 . 6.000 3.660 3.121 4.271 . 0 0 "[ . 1 . 2 .]" 2
1474 1 57 PHE QB 1 77 SER HA 0.000 . 8.000 3.426 2.558 4.362 . 0 0 "[ . 1 . 2 .]" 2
1475 1 57 PHE QB 1 77 SER H 0.000 . 7.000 4.885 4.397 5.522 . 0 0 "[ . 1 . 2 .]" 2
1476 1 57 PHE QB 1 100 PHE QD 0.000 . 9.000 3.536 2.159 4.637 . 0 0 "[ . 1 . 2 .]" 2
1477 1 57 PHE QB 1 112 VAL HA 0.000 . 8.000 4.520 3.992 5.108 . 0 0 "[ . 1 . 2 .]" 2
1478 1 57 PHE QB 1 112 VAL MG2 0.000 . 7.500 3.812 2.841 4.308 . 0 0 "[ . 1 . 2 .]" 2
1479 1 57 PHE QD 1 74 SER HA 0.000 . 8.000 5.407 3.867 6.988 . 0 0 "[ . 1 . 2 .]" 2
1480 1 57 PHE QD 1 74 SER QB 0.000 . 8.000 3.057 1.837 4.733 . 0 0 "[ . 1 . 2 .]" 2
1481 1 57 PHE QD 1 95 ILE HA 0.000 . 8.000 5.114 4.156 5.824 . 0 0 "[ . 1 . 2 .]" 2
1482 1 57 PHE QD 1 95 ILE MG 0.000 . 8.500 3.350 2.326 4.058 . 0 0 "[ . 1 . 2 .]" 2
1483 1 57 PHE QD 1 97 PRO HA 0.000 . 7.000 5.811 4.949 6.389 . 0 0 "[ . 1 . 2 .]" 2
1484 1 57 PHE QD 1 100 PHE QB 0.000 . 9.000 3.787 2.535 5.062 . 0 0 "[ . 1 . 2 .]" 2
1485 1 57 PHE QD 1 100 PHE H 0.000 . 8.000 5.836 4.097 7.353 . 0 0 "[ . 1 . 2 .]" 2
1486 1 57 PHE QD 1 103 ASP HA 0.000 . 9.000 5.533 3.997 7.798 . 0 0 "[ . 1 . 2 .]" 2
1487 1 57 PHE QD 1 110 LYS QB 0.000 . 9.000 4.967 3.661 7.010 . 0 0 "[ . 1 . 2 .]" 2
1488 1 57 PHE QD 1 111 ARG H 0.000 . 8.000 4.880 3.522 6.658 . 0 0 "[ . 1 . 2 .]" 2
1489 1 57 PHE QD 1 112 VAL HA 0.000 . 7.000 3.673 2.828 4.997 . 0 0 "[ . 1 . 2 .]" 2
1490 1 57 PHE QD 1 112 VAL HB 0.000 . 8.000 5.057 4.420 6.223 . 0 0 "[ . 1 . 2 .]" 2
1491 1 57 PHE QD 1 112 VAL MG1 0.000 . 8.500 3.585 2.479 4.394 . 0 0 "[ . 1 . 2 .]" 2
1492 1 57 PHE QD 1 112 VAL MG2 0.000 . 6.000 2.269 1.743 3.404 . 0 0 "[ . 1 . 2 .]" 2
1493 1 57 PHE QD 1 112 VAL H 0.000 . 8.000 5.482 4.716 6.823 . 0 0 "[ . 1 . 2 .]" 2
1494 1 57 PHE QE 1 74 SER HA 0.000 . 9.000 6.920 5.214 8.242 . 0 0 "[ . 1 . 2 .]" 2
1495 1 57 PHE QE 1 95 ILE QG 0.000 . 8.000 4.479 3.042 5.508 . 0 0 "[ . 1 . 2 .]" 2
1496 1 57 PHE QE 1 95 ILE MG 0.000 . 7.500 2.390 1.758 3.188 . 0 0 "[ . 1 . 2 .]" 2
1497 1 57 PHE QE 1 97 PRO QG 0.000 . 9.000 6.206 5.430 6.711 . 0 0 "[ . 1 . 2 .]" 2
1498 1 57 PHE QE 1 103 ASP HA 0.000 . 8.000 4.439 2.456 5.974 . 0 0 "[ . 1 . 2 .]" 2
1499 1 57 PHE QE 1 104 PRO QD 0.000 . 8.000 3.418 1.913 5.251 . 0 0 "[ . 1 . 2 .]" 2
1500 1 57 PHE QE 1 111 ARG H 0.000 . 8.000 4.959 3.704 6.888 . 0 0 "[ . 1 . 2 .]" 2
1501 1 57 PHE QE 1 112 VAL HA 0.000 . 8.000 5.159 4.204 5.713 . 0 0 "[ . 1 . 2 .]" 2
1502 1 57 PHE QE 1 112 VAL MG2 0.000 . 7.500 2.769 2.103 3.585 . 0 0 "[ . 1 . 2 .]" 2
1503 1 57 PHE H 1 73 HIS HA 0.000 . 5.000 4.200 3.434 4.897 . 0 0 "[ . 1 . 2 .]" 2
1504 1 57 PHE H 1 73 HIS HE1 0.000 . 6.000 3.369 2.666 4.282 . 0 0 "[ . 1 . 2 .]" 2
1505 1 57 PHE H 1 74 SER QB 0.000 . 6.000 3.767 2.966 4.884 . 0 0 "[ . 1 . 2 .]" 2
1506 1 57 PHE H 1 74 SER H 0.000 . 4.000 3.373 2.960 3.988 . 0 0 "[ . 1 . 2 .]" 2
1507 1 57 PHE H 1 77 SER HA 0.000 . 4.000 3.945 3.423 4.180 0.180 4 0 "[ . 1 . 2 .]" 2
1508 1 57 PHE H 1 77 SER QB 0.000 . 6.000 2.775 1.842 3.761 . 0 0 "[ . 1 . 2 .]" 2
1509 1 57 PHE H 1 77 SER HG 0.000 . 5.000 2.685 1.876 4.695 . 0 0 "[ . 1 . 2 .]" 2
1510 1 57 PHE H 1 77 SER H 0.000 . 5.000 4.805 4.284 5.072 0.072 6 0 "[ . 1 . 2 .]" 2
1511 1 57 PHE HZ 1 95 ILE HA 0.000 . 7.000 5.633 3.532 6.781 . 0 0 "[ . 1 . 2 .]" 2
1512 1 57 PHE HZ 1 95 ILE MG 0.000 . 7.500 3.421 2.219 4.555 . 0 0 "[ . 1 . 2 .]" 2
1513 1 57 PHE HZ 1 96 SER HA 0.000 . 7.000 4.802 3.504 5.893 . 0 0 "[ . 1 . 2 .]" 2
1514 1 57 PHE HZ 1 97 PRO HA 0.000 . 6.000 4.182 2.726 5.677 . 0 0 "[ . 1 . 2 .]" 2
1515 1 57 PHE HZ 1 97 PRO QB 0.000 . 8.000 4.932 4.257 5.604 . 0 0 "[ . 1 . 2 .]" 2
1516 1 57 PHE HZ 1 97 PRO QD 0.000 . 8.000 4.996 4.128 5.640 . 0 0 "[ . 1 . 2 .]" 2
1517 1 57 PHE HZ 1 97 PRO QG 0.000 . 7.000 5.999 5.326 6.296 . 0 0 "[ . 1 . 2 .]" 2
1518 1 58 GLY QA 1 72 CYS H 0.000 . 7.000 4.916 3.826 5.273 . 0 0 "[ . 1 . 2 .]" 2
1519 1 58 GLY QA 1 73 HIS HA 0.000 . 7.000 3.450 2.496 4.103 . 0 0 "[ . 1 . 2 .]" 2
1520 1 58 GLY QA 1 74 SER H 0.000 . 6.000 4.510 3.770 5.269 . 0 0 "[ . 1 . 2 .]" 2
1521 1 58 GLY QA 1 108 VAL MG1 0.000 . 8.500 4.153 2.815 5.372 . 0 0 "[ . 1 . 2 .]" 2
1522 1 58 GLY QA 1 110 LYS HA 0.000 . 8.000 3.457 2.370 4.660 . 0 0 "[ . 1 . 2 .]" 2
1523 1 58 GLY QA 1 111 ARG H 0.000 . 7.000 3.424 2.842 4.074 . 0 0 "[ . 1 . 2 .]" 2
1524 1 58 GLY H 1 73 HIS HA 0.000 . 6.000 5.229 4.486 5.841 . 0 0 "[ . 1 . 2 .]" 2
1525 1 58 GLY H 1 110 LYS HA 0.000 . 5.000 4.936 4.351 5.203 0.203 25 0 "[ . 1 . 2 .]" 2
1526 1 58 GLY H 1 111 ARG H 0.000 . 4.000 3.546 2.806 4.028 0.028 8 0 "[ . 1 . 2 .]" 2
1527 1 58 GLY H 1 112 VAL HA 0.000 . 4.000 3.757 3.115 4.060 0.060 2 0 "[ . 1 . 2 .]" 2
1528 1 58 GLY H 1 112 VAL MG2 0.000 . 6.500 4.226 3.394 4.780 . 0 0 "[ . 1 . 2 .]" 2
1529 1 58 GLY H 1 112 VAL H 0.000 . 6.000 5.527 4.759 5.886 . 0 0 "[ . 1 . 2 .]" 2
1530 1 58 GLY H 1 113 ALA H 0.000 . 5.000 4.613 4.192 5.028 0.028 21 0 "[ . 1 . 2 .]" 2
1531 1 59 THR HA 1 111 ARG QG 0.000 . 8.000 4.736 2.567 6.526 . 0 0 "[ . 1 . 2 .]" 2
1532 1 59 THR HA 1 111 ARG H 0.000 . 6.000 4.181 3.030 5.381 . 0 0 "[ . 1 . 2 .]" 2
1533 1 59 THR HA 1 113 ALA MB 0.000 . 7.500 5.994 5.631 6.254 . 0 0 "[ . 1 . 2 .]" 2
1534 1 59 THR HB 1 71 GLU QB 0.000 . 8.000 5.189 3.712 6.235 . 0 0 "[ . 1 . 2 .]" 2
1535 1 59 THR HB 1 71 GLU H 0.000 . 5.000 4.259 3.537 5.045 0.045 7 0 "[ . 1 . 2 .]" 2
1536 1 59 THR HB 1 72 CYS H 0.000 . 5.000 4.681 3.838 5.038 0.038 2 0 "[ . 1 . 2 .]" 2
1537 1 59 THR HG1 1 71 GLU H 0.000 . 4.000 2.774 1.960 3.666 . 0 0 "[ . 1 . 2 .]" 2
1538 1 59 THR HG1 1 72 CYS H 0.000 . 3.000 2.672 1.899 3.010 0.010 12 0 "[ . 1 . 2 .]" 2
1539 1 59 THR MG 1 72 CYS QB 0.000 . 6.500 3.097 2.246 4.037 . 0 0 "[ . 1 . 2 .]" 2
1540 1 59 THR MG 1 72 CYS H 0.000 . 5.500 4.099 3.307 4.519 . 0 0 "[ . 1 . 2 .]" 2
1541 1 59 THR MG 1 108 VAL HB 0.000 . 6.500 4.379 3.751 4.954 . 0 0 "[ . 1 . 2 .]" 2
1542 1 59 THR MG 1 108 VAL MG1 0.000 . 5.500 2.240 1.737 2.687 . 0 0 "[ . 1 . 2 .]" 2
1543 1 59 THR MG 1 108 VAL MG2 0.000 . 7.000 4.096 3.268 4.797 . 0 0 "[ . 1 . 2 .]" 2
1544 1 59 THR MG 1 108 VAL H 0.000 . 7.500 5.972 5.548 6.345 . 0 0 "[ . 1 . 2 .]" 2
1545 1 59 THR MG 1 109 MET H 0.000 . 7.500 4.086 3.143 5.242 . 0 0 "[ . 1 . 2 .]" 2
1546 1 59 THR MG 1 111 ARG H 0.000 . 6.500 4.149 3.344 4.952 . 0 0 "[ . 1 . 2 .]" 2
1547 1 59 THR H 1 72 CYS QB 0.000 . 5.000 3.439 2.034 4.272 . 0 0 "[ . 1 . 2 .]" 2
1548 1 59 THR H 1 72 CYS H 0.000 . 4.000 3.891 2.950 4.080 0.080 25 0 "[ . 1 . 2 .]" 2
1549 1 59 THR H 1 108 VAL MG1 0.000 . 7.500 4.787 3.807 5.899 . 0 0 "[ . 1 . 2 .]" 2
1550 1 60 PRO HA 1 70 GLY QA 0.000 . 7.000 3.830 2.576 5.537 . 0 0 "[ . 1 . 2 .]" 2
1551 1 60 PRO HA 1 113 ALA MB 0.000 . 7.500 4.618 3.767 5.619 . 0 0 "[ . 1 . 2 .]" 2
1552 1 60 PRO QB 1 67 PHE QB 0.000 . 7.000 4.121 2.927 5.033 . 0 0 "[ . 1 . 2 .]" 2
1553 1 60 PRO QB 1 67 PHE QD 0.000 . 9.000 2.840 1.929 3.892 . 0 0 "[ . 1 . 2 .]" 2
1554 1 60 PRO QB 1 68 GLN H 0.000 . 6.000 3.876 2.601 5.336 . 0 0 "[ . 1 . 2 .]" 2
1555 1 60 PRO QB 1 113 ALA MB 0.000 . 6.500 2.502 1.901 3.402 . 0 0 "[ . 1 . 2 .]" 2
1556 1 60 PRO QD 1 111 ARG QG 0.000 . 9.000 3.686 2.028 4.849 . 0 0 "[ . 1 . 2 .]" 2
1557 1 60 PRO QD 1 111 ARG H 0.000 . 7.000 3.692 2.617 4.710 . 0 0 "[ . 1 . 2 .]" 2
1558 1 60 PRO QD 1 113 ALA MB 0.000 . 8.500 3.757 3.444 4.006 . 0 0 "[ . 1 . 2 .]" 2
1559 1 60 PRO QG 1 111 ARG QD 0.000 . 9.000 3.896 2.269 6.555 . 0 0 "[ . 1 . 2 .]" 2
1560 1 60 PRO QG 1 113 ALA MB 0.000 . 6.500 2.192 1.776 2.751 . 0 0 "[ . 1 . 2 .]" 2
1561 1 61 LEU QB 1 68 GLN QG 0.000 . 8.000 3.818 2.135 6.124 . 0 0 "[ . 1 . 2 .]" 2
1562 1 61 LEU QB 1 68 GLN H 0.000 . 6.000 3.701 2.615 5.309 . 0 0 "[ . 1 . 2 .]" 2
1563 1 61 LEU QB 1 69 GLN H 0.000 . 7.000 5.196 4.205 6.290 . 0 0 "[ . 1 . 2 .]" 2
1564 1 61 LEU QD 1 70 GLY QA 0.000 . 8.400 2.291 1.645 3.626 . 0 0 "[ . 1 . 2 .]" 2
1565 1 61 LEU MD1 1 68 GLN QB 0.000 . 6.500 3.493 2.159 4.502 . 0 0 "[ . 1 . 2 .]" 2
1566 1 61 LEU MD1 1 68 GLN QG 0.000 . 6.500 4.174 3.043 4.697 . 0 0 "[ . 1 . 2 .]" 2
1567 1 61 LEU MD1 1 68 GLN H 0.000 . 7.500 5.113 3.203 5.816 . 0 0 "[ . 1 . 2 .]" 2
1568 1 61 LEU MD1 1 69 GLN H 0.000 . 7.500 5.444 4.118 6.119 . 0 0 "[ . 1 . 2 .]" 2
1569 1 61 LEU MD1 1 70 GLY QA 0.000 . 6.500 2.386 1.647 4.138 . 0 0 "[ . 1 . 2 .]" 2
1570 1 61 LEU MD1 1 70 GLY H 0.000 . 7.500 4.206 2.518 5.998 . 0 0 "[ . 1 . 2 .]" 2
1571 1 61 LEU H 1 67 PHE HA 0.000 . 5.000 4.169 3.102 5.019 0.019 1 0 "[ . 1 . 2 .]" 2
1572 1 61 LEU H 1 67 PHE QD 0.000 . 7.000 3.692 2.186 4.925 . 0 0 "[ . 1 . 2 .]" 2
1573 1 61 LEU H 1 68 GLN QB 0.000 . 6.000 3.534 2.345 4.832 . 0 0 "[ . 1 . 2 .]" 2
1574 1 61 LEU H 1 68 GLN H 0.000 . 4.000 2.745 1.981 3.984 . 0 0 "[ . 1 . 2 .]" 2
1575 1 61 LEU H 1 69 GLN HA 0.000 . 5.000 4.514 3.617 5.017 0.017 12 0 "[ . 1 . 2 .]" 2
1576 1 61 LEU H 1 70 GLY QA 0.000 . 6.000 4.326 3.460 5.426 . 0 0 "[ . 1 . 2 .]" 2
1577 1 61 LEU H 1 70 GLY H 0.000 . 5.000 4.353 3.260 5.012 0.012 9 0 "[ . 1 . 2 .]" 2
1578 1 62 GLY QA 1 67 PHE HA 0.000 . 7.000 2.962 2.121 3.805 . 0 0 "[ . 1 . 2 .]" 2
1579 1 62 GLY QA 1 67 PHE QD 0.000 . 9.000 3.889 2.880 4.517 . 0 0 "[ . 1 . 2 .]" 2
1580 1 62 GLY QA 1 68 GLN H 0.000 . 6.000 4.056 2.104 5.090 . 0 0 "[ . 1 . 2 .]" 2
1581 1 62 GLY H 1 67 PHE HA 0.000 . 6.000 4.904 4.325 5.354 . 0 0 "[ . 1 . 2 .]" 2
1582 1 62 GLY H 1 67 PHE QD 0.000 . 7.000 4.796 4.193 5.304 . 0 0 "[ . 1 . 2 .]" 2
1583 1 64 CYS HA 1 113 ALA MB 0.000 . 8.500 5.834 4.947 6.958 . 0 0 "[ . 1 . 2 .]" 2
1584 1 67 PHE QD 1 113 ALA MB 0.000 . 8.500 3.275 2.622 4.000 . 0 0 "[ . 1 . 2 .]" 2
1585 1 67 PHE QD 1 114 VAL H 0.000 . 8.000 5.492 3.943 6.491 . 0 0 "[ . 1 . 2 .]" 2
1586 1 67 PHE QD 1 115 GLU HA 0.000 . 8.000 5.396 3.714 6.465 . 0 0 "[ . 1 . 2 .]" 2
1587 1 67 PHE QD 1 115 GLU QB 0.000 . 8.000 3.404 1.931 4.627 . 0 0 "[ . 1 . 2 .]" 2
1588 1 67 PHE QD 1 115 GLU QG 0.000 . 9.000 3.645 2.297 4.867 . 0 0 "[ . 1 . 2 .]" 2
1589 1 67 PHE QE 1 113 ALA MB 0.000 . 9.500 2.636 1.968 3.277 . 0 0 "[ . 1 . 2 .]" 2
1590 1 67 PHE QE 1 114 VAL H 0.000 . 7.000 4.360 3.596 4.949 . 0 0 "[ . 1 . 2 .]" 2
1591 1 67 PHE QE 1 115 GLU HA 0.000 . 9.000 4.925 3.618 5.736 . 0 0 "[ . 1 . 2 .]" 2
1592 1 67 PHE QE 1 115 GLU QG 0.000 . 9.000 3.761 2.462 5.586 . 0 0 "[ . 1 . 2 .]" 2
1593 1 67 PHE HZ 1 113 ALA HA 0.000 . 6.000 4.117 3.287 5.028 . 0 0 "[ . 1 . 2 .]" 2
1594 1 67 PHE HZ 1 113 ALA MB 0.000 . 6.500 3.003 2.136 4.120 . 0 0 "[ . 1 . 2 .]" 2
1595 1 67 PHE HZ 1 114 VAL H 0.000 . 5.000 4.645 3.528 5.020 0.020 2 0 "[ . 1 . 2 .]" 2
1596 1 72 CYS HA 1 105 CYS QB 0.000 . 7.000 4.594 3.792 5.742 . 0 0 "[ . 1 . 2 .]" 2
1597 1 72 CYS HA 1 108 VAL MG2 0.000 . 8.500 5.944 4.616 6.962 . 0 0 "[ . 1 . 2 .]" 2
1598 1 72 CYS QB 1 105 CYS HA 0.000 . 7.000 5.114 3.902 6.085 . 0 0 "[ . 1 . 2 .]" 2
1599 1 72 CYS QB 1 105 CYS H 0.000 . 7.000 4.579 3.091 6.377 . 0 0 "[ . 1 . 2 .]" 2
1600 1 72 CYS QB 1 108 VAL HB 0.000 . 7.000 4.618 3.736 5.393 . 0 0 "[ . 1 . 2 .]" 2
1601 1 72 CYS QB 1 108 VAL MG1 0.000 . 7.500 3.079 1.941 4.169 . 0 0 "[ . 1 . 2 .]" 2
1602 1 72 CYS QB 1 108 VAL MG2 0.000 . 8.500 4.014 2.131 5.256 . 0 0 "[ . 1 . 2 .]" 2
1603 1 72 CYS H 1 105 CYS QB 0.000 . 7.000 5.799 4.998 6.372 . 0 0 "[ . 1 . 2 .]" 2
1604 1 72 CYS H 1 108 VAL MG1 0.000 . 7.500 4.938 3.656 6.168 . 0 0 "[ . 1 . 2 .]" 2
1605 1 73 HIS HE1 1 100 PHE QE 0.000 . 9.000 6.249 5.270 7.212 . 0 0 "[ . 1 . 2 .]" 2
1606 1 74 SER HA 1 104 PRO QB 0.000 . 6.000 2.882 2.291 4.219 . 0 0 "[ . 1 . 2 .]" 2
1607 1 74 SER HA 1 105 CYS H 0.000 . 6.000 5.802 5.306 6.078 0.078 13 0 "[ . 1 . 2 .]" 2
1608 1 74 SER QB 1 105 CYS H 0.000 . 7.000 5.512 4.264 6.163 . 0 0 "[ . 1 . 2 .]" 2
1609 1 74 SER H 1 104 PRO QB 0.000 . 6.000 4.332 3.018 5.343 . 0 0 "[ . 1 . 2 .]" 2
1610 1 76 ASN HA 1 100 PHE QD 0.000 . 9.000 5.070 4.293 6.287 . 0 0 "[ . 1 . 2 .]" 2
1611 1 76 ASN QB 1 100 PHE QD 0.000 . 9.000 3.235 1.988 4.655 . 0 0 "[ . 1 . 2 .]" 2
1612 1 76 ASN QB 1 101 GLY QA 0.000 . 9.000 4.176 2.805 6.083 . 0 0 "[ . 1 . 2 .]" 2
1613 1 76 ASN QD 1 101 GLY QA 0.000 . 7.000 3.763 1.869 5.320 . 0 0 "[ . 1 . 2 .]" 2
1614 1 77 SER HA 1 100 PHE QD 0.000 . 5.000 3.097 2.341 3.750 . 0 0 "[ . 1 . 2 .]" 2
1615 1 77 SER HA 1 100 PHE QE 0.000 . 6.000 2.470 1.905 3.578 . 0 0 "[ . 1 . 2 .]" 2
1616 1 77 SER HA 1 100 PHE HZ 0.000 . 6.000 4.522 3.750 5.031 . 0 0 "[ . 1 . 2 .]" 2
1617 1 77 SER HA 1 114 VAL MG2 0.000 . 8.500 5.571 4.972 6.156 . 0 0 "[ . 1 . 2 .]" 2
1618 1 77 SER QB 1 100 PHE QD 0.000 . 9.000 4.745 3.321 5.538 . 0 0 "[ . 1 . 2 .]" 2
1619 1 77 SER QB 1 100 PHE QE 0.000 . 9.000 4.041 2.993 4.870 . 0 0 "[ . 1 . 2 .]" 2
1620 1 77 SER H 1 100 PHE QD 0.000 . 7.000 4.579 3.882 5.815 . 0 0 "[ . 1 . 2 .]" 2
1621 1 77 SER H 1 100 PHE QE 0.000 . 7.000 5.042 4.537 6.191 . 0 0 "[ . 1 . 2 .]" 2
1622 1 78 ASN HA 1 100 PHE QE 0.000 . 9.000 5.507 4.265 6.341 . 0 0 "[ . 1 . 2 .]" 2
1623 1 80 VAL HA 1 93 VAL MG1 0.000 . 8.500 5.474 4.704 6.303 . 0 0 "[ . 1 . 2 .]" 2
1624 1 80 VAL HA 1 100 PHE HA 0.000 . 6.000 5.748 5.130 6.071 0.071 2 0 "[ . 1 . 2 .]" 2
1625 1 80 VAL HA 1 100 PHE QD 0.000 . 8.000 5.821 4.739 6.599 . 0 0 "[ . 1 . 2 .]" 2
1626 1 80 VAL HA 1 100 PHE QE 0.000 . 8.000 5.575 4.892 6.348 . 0 0 "[ . 1 . 2 .]" 2
1627 1 80 VAL HA 1 100 PHE HZ 0.000 . 7.000 6.722 5.875 7.055 0.055 22 0 "[ . 1 . 2 .]" 2
1628 1 80 VAL HB 1 100 PHE QD 0.000 . 7.000 3.912 2.412 4.873 . 0 0 "[ . 1 . 2 .]" 2
1629 1 80 VAL HB 1 100 PHE QE 0.000 . 7.000 2.959 1.966 3.919 . 0 0 "[ . 1 . 2 .]" 2
1630 1 80 VAL HB 1 100 PHE HZ 0.000 . 6.000 3.921 2.967 4.377 . 0 0 "[ . 1 . 2 .]" 2
1631 1 80 VAL MG1 1 93 VAL MG1 0.000 . 6.000 2.566 1.855 3.183 . 0 0 "[ . 1 . 2 .]" 2
1632 1 80 VAL MG1 1 93 VAL MG2 0.000 . 7.000 3.452 2.183 4.345 . 0 0 "[ . 1 . 2 .]" 2
1633 1 80 VAL MG1 1 99 ASN HA 0.000 . 8.500 5.225 3.768 6.239 . 0 0 "[ . 1 . 2 .]" 2
1634 1 80 VAL MG1 1 99 ASN QB 0.000 . 8.500 4.215 2.932 5.033 . 0 0 "[ . 1 . 2 .]" 2
1635 1 80 VAL MG1 1 100 PHE HA 0.000 . 7.500 3.855 2.790 4.362 . 0 0 "[ . 1 . 2 .]" 2
1636 1 80 VAL MG1 1 100 PHE QD 0.000 . 8.500 3.815 3.299 4.338 . 0 0 "[ . 1 . 2 .]" 2
1637 1 80 VAL MG1 1 100 PHE QE 0.000 . 8.500 3.178 2.071 3.884 . 0 0 "[ . 1 . 2 .]" 2
1638 1 80 VAL MG1 1 100 PHE H 0.000 . 7.500 5.445 4.661 5.948 . 0 0 "[ . 1 . 2 .]" 2
1639 1 80 VAL MG1 1 100 PHE HZ 0.000 . 7.500 3.560 2.481 4.086 . 0 0 "[ . 1 . 2 .]" 2
1640 1 80 VAL MG2 1 99 ASN HA 0.000 . 7.500 5.296 3.811 6.107 . 0 0 "[ . 1 . 2 .]" 2
1641 1 80 VAL MG2 1 99 ASN QB 0.000 . 9.500 4.621 3.555 5.510 . 0 0 "[ . 1 . 2 .]" 2
1642 1 80 VAL MG2 1 100 PHE HA 0.000 . 4.500 2.424 1.842 2.930 . 0 0 "[ . 1 . 2 .]" 2
1643 1 80 VAL MG2 1 100 PHE QB 0.000 . 8.500 3.593 2.574 4.029 . 0 0 "[ . 1 . 2 .]" 2
1644 1 80 VAL MG2 1 100 PHE QD 0.000 . 6.500 2.591 1.989 3.370 . 0 0 "[ . 1 . 2 .]" 2
1645 1 80 VAL MG2 1 100 PHE QE 0.000 . 7.500 3.113 2.630 3.749 . 0 0 "[ . 1 . 2 .]" 2
1646 1 80 VAL MG2 1 100 PHE H 0.000 . 7.500 4.697 3.823 5.277 . 0 0 "[ . 1 . 2 .]" 2
1647 1 80 VAL H 1 100 PHE QD 0.000 . 8.000 4.642 2.982 5.977 . 0 0 "[ . 1 . 2 .]" 2
1648 1 80 VAL H 1 100 PHE QE 0.000 . 7.000 4.277 3.448 5.166 . 0 0 "[ . 1 . 2 .]" 2
1649 1 81 LEU HA 1 93 VAL MG1 0.000 . 7.500 4.356 3.439 5.277 . 0 0 "[ . 1 . 2 .]" 2
1650 1 81 LEU HA 1 93 VAL MG2 0.000 . 6.500 3.476 2.954 4.104 . 0 0 "[ . 1 . 2 .]" 2
1651 1 81 LEU HA 1 100 PHE QE 0.000 . 9.000 6.195 4.877 7.016 . 0 0 "[ . 1 . 2 .]" 2
1652 1 81 LEU QD 1 93 VAL MG1 0.000 . 6.900 2.638 2.045 3.294 . 0 0 "[ . 1 . 2 .]" 2
1653 1 81 LEU MD1 1 114 VAL HA 0.000 . 8.500 5.215 4.113 5.792 . 0 0 "[ . 1 . 2 .]" 2
1654 1 81 LEU MD1 1 114 VAL MG1 0.000 . 7.000 2.342 1.769 2.829 . 0 0 "[ . 1 . 2 .]" 2
1655 1 81 LEU MD2 1 100 PHE QD 0.000 . 7.500 4.930 4.147 5.647 . 0 0 "[ . 1 . 2 .]" 2
1656 1 81 LEU MD2 1 100 PHE QE 0.000 . 6.000 3.279 2.407 4.130 . 0 0 "[ . 1 . 2 .]" 2
1657 1 81 LEU MD2 1 100 PHE HZ 0.000 . 4.500 3.210 2.532 3.681 . 0 0 "[ . 1 . 2 .]" 2
1658 1 81 LEU HG 1 100 PHE HZ 0.000 . 7.000 5.612 3.688 6.428 . 0 0 "[ . 1 . 2 .]" 2
1659 1 81 LEU H 1 93 VAL MG1 0.000 . 8.500 5.346 4.834 6.041 . 0 0 "[ . 1 . 2 .]" 2
1660 1 81 LEU H 1 100 PHE QD 0.000 . 8.000 6.146 4.723 7.352 . 0 0 "[ . 1 . 2 .]" 2
1661 1 81 LEU H 1 100 PHE QE 0.000 . 7.000 4.863 3.622 6.058 . 0 0 "[ . 1 . 2 .]" 2
1662 1 84 LYS HA 1 93 VAL MG2 0.000 . 7.500 5.403 4.647 6.256 . 0 0 "[ . 1 . 2 .]" 2
1663 1 84 LYS QB 1 93 VAL MG2 0.000 . 7.500 3.138 2.389 4.156 . 0 0 "[ . 1 . 2 .]" 2
1664 1 84 LYS QD 1 93 VAL MG2 0.000 . 7.500 3.851 2.289 5.357 . 0 0 "[ . 1 . 2 .]" 2
1665 1 84 LYS QE 1 93 VAL MG1 0.000 . 8.500 4.681 2.528 6.182 . 0 0 "[ . 1 . 2 .]" 2
1666 1 84 LYS QE 1 93 VAL MG2 0.000 . 8.500 4.440 1.757 6.161 . 0 0 "[ . 1 . 2 .]" 2
1667 1 84 LYS QG 1 92 VAL H 0.000 . 7.000 5.238 3.989 6.275 . 0 0 "[ . 1 . 2 .]" 2
1668 1 84 LYS QG 1 93 VAL HA 0.000 . 7.000 5.128 4.156 6.233 . 0 0 "[ . 1 . 2 .]" 2
1669 1 84 LYS QG 1 93 VAL MG1 0.000 . 8.500 4.760 3.715 5.895 . 0 0 "[ . 1 . 2 .]" 2
1670 1 84 LYS QG 1 93 VAL MG2 0.000 . 7.500 3.822 2.476 4.812 . 0 0 "[ . 1 . 2 .]" 2
1671 1 84 LYS H 1 93 VAL MG2 0.000 . 6.500 5.002 4.160 5.484 . 0 0 "[ . 1 . 2 .]" 2
1672 1 85 CYS HA 1 91 CYS QB 0.000 . 6.000 3.072 1.775 4.343 . 0 0 "[ . 1 . 2 .]" 2
1673 1 85 CYS QB 1 91 CYS QB 0.000 . 7.000 3.893 3.255 4.208 . 0 0 "[ . 1 . 2 .]" 2
1674 1 85 CYS QB 1 116 ALA MB 0.000 . 8.500 4.445 3.774 5.078 . 0 0 "[ . 1 . 2 .]" 2
1675 1 85 CYS H 1 93 VAL MG2 0.000 . 7.500 5.598 4.441 6.131 . 0 0 "[ . 1 . 2 .]" 2
1676 1 93 VAL HB 1 100 PHE QE 0.000 . 8.000 5.623 4.824 6.395 . 0 0 "[ . 1 . 2 .]" 2
1677 1 93 VAL HB 1 100 PHE HZ 0.000 . 6.000 5.310 4.489 5.969 . 0 0 "[ . 1 . 2 .]" 2
1678 1 93 VAL MG1 1 99 ASN QB 0.000 . 8.500 4.495 3.461 5.361 . 0 0 "[ . 1 . 2 .]" 2
1679 1 93 VAL MG1 1 99 ASN QD 0.000 . 7.500 3.729 2.226 5.404 . 0 0 "[ . 1 . 2 .]" 2
1680 1 93 VAL MG1 1 100 PHE QD 0.000 . 7.500 4.920 4.150 5.573 . 0 0 "[ . 1 . 2 .]" 2
1681 1 93 VAL MG1 1 100 PHE QE 0.000 . 6.500 3.404 2.384 4.089 . 0 0 "[ . 1 . 2 .]" 2
1682 1 93 VAL MG1 1 100 PHE HZ 0.000 . 4.500 3.286 2.450 3.726 . 0 0 "[ . 1 . 2 .]" 2
1683 1 93 VAL MG2 1 100 PHE QE 0.000 . 8.500 5.378 4.365 6.076 . 0 0 "[ . 1 . 2 .]" 2
1684 1 93 VAL MG2 1 100 PHE HZ 0.000 . 7.500 5.210 4.175 5.774 . 0 0 "[ . 1 . 2 .]" 2
1685 1 94 ALA MB 1 99 ASN QB 0.000 . 9.500 4.241 2.941 5.260 . 0 0 "[ . 1 . 2 .]" 2
1686 1 94 ALA MB 1 99 ASN HD21 0.000 . 6.500 3.944 1.738 5.243 . 0 0 "[ . 1 . 2 .]" 2
1687 1 94 ALA MB 1 99 ASN HD22 0.000 . 6.500 3.609 2.136 5.296 . 0 0 "[ . 1 . 2 .]" 2
1688 1 94 ALA H 1 99 ASN QD 0.000 . 7.000 4.009 2.570 5.612 . 0 0 "[ . 1 . 2 .]" 2
1689 1 95 ILE HA 1 100 PHE QD 0.000 . 7.000 4.419 3.590 4.995 . 0 0 "[ . 1 . 2 .]" 2
1690 1 95 ILE HA 1 100 PHE QE 0.000 . 6.000 3.061 2.487 3.774 . 0 0 "[ . 1 . 2 .]" 2
1691 1 95 ILE HA 1 100 PHE HZ 0.000 . 6.000 4.782 3.979 5.195 . 0 0 "[ . 1 . 2 .]" 2
1692 1 95 ILE HB 1 112 VAL MG2 0.000 . 6.500 3.663 2.939 4.246 . 0 0 "[ . 1 . 2 .]" 2
1693 1 95 ILE MD 1 100 PHE QE 0.000 . 9.500 5.389 4.479 6.029 . 0 0 "[ . 1 . 2 .]" 2
1694 1 95 ILE MD 1 112 VAL H 0.000 . 5.500 4.083 3.268 4.473 . 0 0 "[ . 1 . 2 .]" 2
1695 1 95 ILE QG 1 112 VAL MG2 0.000 . 6.500 2.192 1.804 2.808 . 0 0 "[ . 1 . 2 .]" 2
1696 1 95 ILE MG 1 100 PHE QE 0.000 . 8.500 3.797 2.547 4.653 . 0 0 "[ . 1 . 2 .]" 2
1697 1 95 ILE MG 1 100 PHE HZ 0.000 . 8.500 4.888 4.092 5.669 . 0 0 "[ . 1 . 2 .]" 2
1698 1 95 ILE MG 1 112 VAL HB 0.000 . 7.500 3.678 2.571 4.385 . 0 0 "[ . 1 . 2 .]" 2
1699 1 95 ILE MG 1 112 VAL MG2 0.000 . 5.500 1.794 1.591 2.332 . 0 0 "[ . 1 . 2 .]" 2
1700 1 95 ILE H 1 112 VAL MG2 0.000 . 6.500 5.099 4.548 5.304 . 0 0 "[ . 1 . 2 .]" 2
1701 1 97 PRO QB 1 103 ASP QB 0.000 . 9.000 4.232 2.058 5.359 . 0 0 "[ . 1 . 2 .]" 2
1702 1 100 PHE QE 1 112 VAL HA 0.000 . 9.000 6.245 5.418 7.008 . 0 0 "[ . 1 . 2 .]" 2
1703 1 100 PHE QE 1 112 VAL MG2 0.000 . 8.500 4.243 3.237 5.367 . 0 0 "[ . 1 . 2 .]" 2
1704 1 100 PHE HZ 1 112 VAL MG2 0.000 . 7.500 4.588 3.265 5.465 . 0 0 "[ . 1 . 2 .]" 2
1705 1 100 PHE HZ 1 114 VAL MG2 0.000 . 8.500 4.477 3.744 5.137 . 0 0 "[ . 1 . 2 .]" 2
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