NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
533922 |
2l02   |
17026 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l02
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 2073
_Distance_constraint_stats_list.Viol_count 1057
_Distance_constraint_stats_list.Viol_total 2125.529
_Distance_constraint_stats_list.Viol_max 0.821
_Distance_constraint_stats_list.Viol_rms 0.0209
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0026
_Distance_constraint_stats_list.Viol_average_violations_only 0.1005
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 1.304 0.274 17 0 "[ . 1 . 2]"
1 2 ASP 0.189 0.083 17 0 "[ . 1 . 2]"
1 3 LYS 0.774 0.186 11 0 "[ . 1 . 2]"
1 4 LYS 0.191 0.085 6 0 "[ . 1 . 2]"
1 5 ILE 1.976 0.274 17 0 "[ . 1 . 2]"
1 6 VAL 6.122 0.233 16 0 "[ . 1 . 2]"
1 7 GLY 0.001 0.001 3 0 "[ . 1 . 2]"
1 8 ALA 0.627 0.133 12 0 "[ . 1 . 2]"
1 9 ASN 0.040 0.040 7 0 "[ . 1 . 2]"
1 10 ALA 1.720 0.205 5 0 "[ . 1 . 2]"
1 11 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LYS 0.849 0.214 2 0 "[ . 1 . 2]"
1 13 VAL 0.266 0.092 10 0 "[ . 1 . 2]"
1 14 TRP 7.182 0.319 12 0 "[ . 1 . 2]"
1 15 HIS 0.070 0.064 5 0 "[ . 1 . 2]"
1 16 ALA 0.454 0.194 18 0 "[ . 1 . 2]"
1 17 LEU 3.498 0.319 12 0 "[ . 1 . 2]"
1 18 ASN 0.266 0.194 18 0 "[ . 1 . 2]"
1 19 GLU 0.075 0.075 4 0 "[ . 1 . 2]"
1 20 ALA 0.075 0.075 4 0 "[ . 1 . 2]"
1 21 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 ILE 0.029 0.029 13 0 "[ . 1 . 2]"
1 24 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ILE 0.633 0.102 16 0 "[ . 1 . 2]"
1 26 PRO 3.144 0.250 8 0 "[ . 1 . 2]"
1 27 GLU 6.000 0.321 20 0 "[ . 1 . 2]"
1 28 LEU 9.844 0.321 20 0 "[ . 1 . 2]"
1 29 ALA 0.473 0.119 18 0 "[ . 1 . 2]"
1 30 ARG 0.669 0.119 18 0 "[ . 1 . 2]"
1 31 LYS 0.475 0.148 16 0 "[ . 1 . 2]"
1 32 VAL 1.003 0.214 2 0 "[ . 1 . 2]"
1 33 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LEU 1.077 0.145 16 0 "[ . 1 . 2]"
1 35 SER 0.242 0.088 20 0 "[ . 1 . 2]"
1 36 VAL 1.730 0.310 18 0 "[ . 1 . 2]"
1 37 GLU 2.011 0.310 18 0 "[ . 1 . 2]"
1 38 SER 1.319 0.145 16 0 "[ . 1 . 2]"
1 39 THR 0.082 0.036 20 0 "[ . 1 . 2]"
1 40 ALA 0.463 0.130 2 0 "[ . 1 . 2]"
1 41 LEU 5.323 0.397 14 0 "[ . 1 . 2]"
1 42 ALA 1.449 0.233 16 0 "[ . 1 . 2]"
1 43 VAL 2.417 0.397 14 0 "[ . 1 . 2]"
1 44 GLY 0.087 0.077 12 0 "[ . 1 . 2]"
1 45 TRP 2.037 0.198 13 0 "[ . 1 . 2]"
1 46 LEU 3.087 0.224 18 0 "[ . 1 . 2]"
1 47 ALA 0.021 0.021 8 0 "[ . 1 . 2]"
1 48 ARG 2.221 0.198 13 0 "[ . 1 . 2]"
1 49 GLU 0.880 0.194 3 0 "[ . 1 . 2]"
1 50 ASN 0.261 0.174 1 0 "[ . 1 . 2]"
1 51 LYS 1.742 0.171 13 0 "[ . 1 . 2]"
1 52 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 VAL 2.606 0.333 15 0 "[ . 1 . 2]"
1 54 ILE 0.844 0.125 5 0 "[ . 1 . 2]"
1 55 GLU 2.152 0.226 5 0 "[ . 1 . 2]"
1 56 ARG 2.254 0.163 9 0 "[ . 1 . 2]"
1 57 LYS 3.752 0.286 16 0 "[ . 1 . 2]"
1 58 ASN 0.932 0.163 4 0 "[ . 1 . 2]"
1 59 GLY 0.607 0.148 20 0 "[ . 1 . 2]"
1 60 LEU 1.242 0.154 5 0 "[ . 1 . 2]"
1 61 ILE 2.413 0.286 16 0 "[ . 1 . 2]"
1 62 GLU 0.090 0.052 6 0 "[ . 1 . 2]"
1 63 ILE 2.982 0.553 1 1 "[+ . 1 . 2]"
1 64 TYR 3.615 0.553 1 1 "[+ . 1 . 2]"
1 65 ASN 1.153 0.142 10 0 "[ . 1 . 2]"
1 66 GLU 0.699 0.202 1 0 "[ . 1 . 2]"
1 67 GLY 0.192 0.121 18 0 "[ . 1 . 2]"
1 68 HIS 1.147 0.333 15 0 "[ . 1 . 2]"
1 69 PHE 0.785 0.223 12 0 "[ . 1 . 2]"
1 70 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 PHE 0.289 0.132 4 0 "[ . 1 . 2]"
1 72 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 PHE 0.140 0.140 10 0 "[ . 1 . 2]"
1 74 GLY 0.256 0.181 20 0 "[ . 1 . 2]"
1 75 LEU 2.122 0.247 18 0 "[ . 1 . 2]"
1 76 GLU 1.726 0.247 18 0 "[ . 1 . 2]"
2 1 MET 0.553 0.125 7 0 "[ . 1 . 2]"
2 2 ASP 0.170 0.127 6 0 "[ . 1 . 2]"
2 3 LYS 0.638 0.174 1 0 "[ . 1 . 2]"
2 4 LYS 0.151 0.084 20 0 "[ . 1 . 2]"
2 5 ILE 1.747 0.156 16 0 "[ . 1 . 2]"
2 6 VAL 5.867 0.341 5 0 "[ . 1 . 2]"
2 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 8 ALA 0.740 0.156 16 0 "[ . 1 . 2]"
2 9 ASN 0.169 0.119 13 0 "[ . 1 . 2]"
2 10 ALA 1.514 0.156 14 0 "[ . 1 . 2]"
2 11 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 12 LYS 0.370 0.148 11 0 "[ . 1 . 2]"
2 13 VAL 0.107 0.088 4 0 "[ . 1 . 2]"
2 14 TRP 6.183 0.268 13 0 "[ . 1 . 2]"
2 15 HIS 0.099 0.083 13 0 "[ . 1 . 2]"
2 16 ALA 0.511 0.221 11 0 "[ . 1 . 2]"
2 17 LEU 3.386 0.268 13 0 "[ . 1 . 2]"
2 18 ASN 0.313 0.221 11 0 "[ . 1 . 2]"
2 19 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 20 ALA 0.011 0.011 6 0 "[ . 1 . 2]"
2 21 ASP 0.009 0.009 7 0 "[ . 1 . 2]"
2 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 23 ILE 2.337 0.804 2 1 "[ + . 1 . 2]"
2 24 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 25 ILE 1.039 0.179 9 0 "[ . 1 . 2]"
2 26 PRO 3.220 0.223 7 0 "[ . 1 . 2]"
2 27 GLU 6.812 0.450 2 0 "[ . 1 . 2]"
2 28 LEU 12.848 0.821 9 2 "[ - . +1 . 2]"
2 29 ALA 0.210 0.053 5 0 "[ . 1 . 2]"
2 30 ARG 0.362 0.134 6 0 "[ . 1 . 2]"
2 31 LYS 0.349 0.182 15 0 "[ . 1 . 2]"
2 32 VAL 0.540 0.182 15 0 "[ . 1 . 2]"
2 33 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 34 LEU 0.809 0.085 9 0 "[ . 1 . 2]"
2 35 SER 0.178 0.074 12 0 "[ . 1 . 2]"
2 36 VAL 1.198 0.227 9 0 "[ . 1 . 2]"
2 37 GLU 0.067 0.067 14 0 "[ . 1 . 2]"
2 38 SER 0.987 0.085 9 0 "[ . 1 . 2]"
2 39 THR 1.349 0.821 9 1 "[ . +1 . 2]"
2 40 ALA 0.180 0.129 9 0 "[ . 1 . 2]"
2 41 LEU 5.210 0.414 16 0 "[ . 1 . 2]"
2 42 ALA 1.290 0.206 6 0 "[ . 1 . 2]"
2 43 VAL 2.698 0.414 16 0 "[ . 1 . 2]"
2 44 GLY 0.256 0.175 3 0 "[ . 1 . 2]"
2 45 TRP 2.718 0.230 18 0 "[ . 1 . 2]"
2 46 LEU 3.445 0.254 12 0 "[ . 1 . 2]"
2 47 ALA 0.058 0.028 10 0 "[ . 1 . 2]"
2 48 ARG 1.966 0.230 18 0 "[ . 1 . 2]"
2 49 GLU 0.195 0.094 15 0 "[ . 1 . 2]"
2 50 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 51 LYS 0.661 0.096 15 0 "[ . 1 . 2]"
2 52 VAL 0.040 0.040 8 0 "[ . 1 . 2]"
2 53 VAL 1.585 0.181 4 0 "[ . 1 . 2]"
2 54 ILE 1.915 0.247 1 0 "[ . 1 . 2]"
2 55 GLU 3.937 0.247 1 0 "[ . 1 . 2]"
2 56 ARG 3.033 0.292 9 0 "[ . 1 . 2]"
2 57 LYS 3.055 0.225 1 0 "[ . 1 . 2]"
2 58 ASN 0.755 0.150 14 0 "[ . 1 . 2]"
2 59 GLY 0.509 0.167 7 0 "[ . 1 . 2]"
2 60 LEU 1.298 0.150 14 0 "[ . 1 . 2]"
2 61 ILE 2.945 0.292 9 0 "[ . 1 . 2]"
2 62 GLU 0.029 0.029 5 0 "[ . 1 . 2]"
2 63 ILE 2.025 0.259 10 0 "[ . 1 . 2]"
2 64 TYR 2.068 0.259 10 0 "[ . 1 . 2]"
2 65 ASN 1.372 0.196 20 0 "[ . 1 . 2]"
2 66 GLU 1.315 0.417 16 0 "[ . 1 . 2]"
2 67 GLY 0.258 0.100 11 0 "[ . 1 . 2]"
2 68 HIS 0.722 0.417 16 0 "[ . 1 . 2]"
2 69 PHE 1.004 0.195 15 0 "[ . 1 . 2]"
2 70 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 71 PHE 0.260 0.100 20 0 "[ . 1 . 2]"
2 72 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 73 PHE 0.094 0.094 4 0 "[ . 1 . 2]"
2 74 GLY 0.263 0.182 1 0 "[ . 1 . 2]"
2 75 LEU 1.564 0.246 5 0 "[ . 1 . 2]"
2 76 GLU 0.817 0.153 16 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 5 ILE MD 4.840 . 4.840 4.483 2.126 5.114 0.274 17 0 "[ . 1 . 2]" 1
2 1 1 MET QB 1 2 ASP H 5.290 . 5.290 3.088 1.805 4.068 . 0 0 "[ . 1 . 2]" 1
3 1 1 MET QB 1 5 ILE MD 4.770 . 4.770 3.578 2.628 4.757 . 0 0 "[ . 1 . 2]" 1
4 1 1 MET ME 1 5 ILE MD 3.750 . 3.750 2.726 1.762 3.835 0.085 15 0 "[ . 1 . 2]" 1
5 1 1 MET QG 1 2 ASP H 6.300 . 6.300 2.961 1.885 4.272 . 0 0 "[ . 1 . 2]" 1
6 1 1 MET QG 1 3 LYS H 5.790 . 5.790 5.151 3.263 5.976 0.186 11 0 "[ . 1 . 2]" 1
7 1 1 MET QG 1 5 ILE MD 4.600 . 4.600 2.646 1.726 4.704 0.104 15 0 "[ . 1 . 2]" 1
8 1 2 ASP H 1 5 ILE MD 6.300 . 6.300 3.596 1.914 4.811 . 0 0 "[ . 1 . 2]" 1
9 1 2 ASP QB 1 3 LYS H 4.650 . 4.650 3.331 2.588 3.715 . 0 0 "[ . 1 . 2]" 1
10 1 2 ASP QB 1 5 ILE HB 5.180 . 5.180 4.015 2.337 4.793 . 0 0 "[ . 1 . 2]" 1
11 1 2 ASP QB 1 5 ILE MD 4.740 . 4.740 3.214 2.110 4.284 . 0 0 "[ . 1 . 2]" 1
12 1 2 ASP QB 1 5 ILE QG 5.200 . 5.200 3.636 1.834 5.234 0.034 12 0 "[ . 1 . 2]" 1
13 1 2 ASP QB 1 5 ILE MG 5.380 . 5.380 4.662 3.232 5.452 0.072 12 0 "[ . 1 . 2]" 1
14 1 2 ASP HB2 1 3 LYS H 5.420 . 5.420 3.859 2.795 4.540 . 0 0 "[ . 1 . 2]" 1
15 1 2 ASP HB2 1 5 ILE HB 5.870 . 5.870 4.608 3.892 5.953 0.083 17 0 "[ . 1 . 2]" 1
16 1 2 ASP HB2 1 5 ILE MD 5.380 . 5.380 3.744 2.138 5.042 . 0 0 "[ . 1 . 2]" 1
17 1 2 ASP HB3 1 3 LYS H 5.420 . 5.420 3.802 2.636 4.507 . 0 0 "[ . 1 . 2]" 1
18 1 2 ASP HB3 1 5 ILE HB 5.870 . 5.870 4.724 2.355 5.754 . 0 0 "[ . 1 . 2]" 1
19 1 2 ASP HB3 1 5 ILE MD 5.380 . 5.380 3.879 2.126 5.006 . 0 0 "[ . 1 . 2]" 1
20 1 3 LYS H 1 3 LYS QB 3.760 . 3.760 2.320 2.138 2.657 . 0 0 "[ . 1 . 2]" 1
21 1 3 LYS H 1 3 LYS QD 5.430 . 5.430 4.088 3.013 4.786 . 0 0 "[ . 1 . 2]" 1
22 1 3 LYS H 1 3 LYS QE 6.000 . 6.000 4.971 3.734 6.123 0.123 9 0 "[ . 1 . 2]" 1
23 1 3 LYS H 1 3 LYS HG2 4.980 . 4.980 3.889 2.061 4.696 . 0 0 "[ . 1 . 2]" 1
24 1 3 LYS H 1 3 LYS HG3 4.980 . 4.980 4.073 2.244 4.578 . 0 0 "[ . 1 . 2]" 1
25 1 3 LYS H 1 5 ILE MD 5.330 . 5.330 5.140 4.647 5.375 0.045 11 0 "[ . 1 . 2]" 1
26 1 3 LYS HA 1 3 LYS QD 4.680 . 4.680 2.986 1.991 4.299 . 0 0 "[ . 1 . 2]" 1
27 1 3 LYS HA 1 3 LYS QG 3.860 . 3.860 2.732 2.345 3.162 . 0 0 "[ . 1 . 2]" 1
28 1 3 LYS HA 1 5 ILE H 4.980 . 4.980 4.223 3.430 4.900 . 0 0 "[ . 1 . 2]" 1
29 1 3 LYS HA 1 6 VAL MG2 4.630 . 4.630 2.798 1.800 3.887 . 0 0 "[ . 1 . 2]" 1
30 1 3 LYS QB 1 5 ILE H 5.130 . 5.130 4.803 4.621 5.004 . 0 0 "[ . 1 . 2]" 1
31 1 3 LYS QD 1 45 TRP HH2 5.080 . 5.080 3.667 2.059 5.040 . 0 0 "[ . 1 . 2]" 1
32 1 3 LYS QD 1 45 TRP HZ3 5.590 . 5.590 3.841 1.954 5.582 . 0 0 "[ . 1 . 2]" 1
33 1 3 LYS QE 1 45 TRP HH2 5.680 . 5.680 3.945 2.640 5.772 0.092 8 0 "[ . 1 . 2]" 1
34 1 3 LYS QE 2 50 ASN H 5.680 . 5.680 4.618 3.443 5.650 . 0 0 "[ . 1 . 2]" 1
35 1 3 LYS QE 2 50 ASN HA 5.010 . 5.010 3.463 1.801 4.646 . 0 0 "[ . 1 . 2]" 1
36 1 3 LYS QG 1 4 LYS H 5.960 . 5.960 4.116 3.682 4.370 . 0 0 "[ . 1 . 2]" 1
37 1 3 LYS QG 1 45 TRP HH2 5.390 . 5.390 3.695 2.130 5.214 . 0 0 "[ . 1 . 2]" 1
38 1 4 LYS H 1 4 LYS QD 5.300 . 5.300 3.681 2.161 4.508 . 0 0 "[ . 1 . 2]" 1
39 1 4 LYS H 1 4 LYS HG2 4.770 . 4.770 3.055 2.160 4.679 . 0 0 "[ . 1 . 2]" 1
40 1 4 LYS H 1 4 LYS QG 4.030 . 4.030 2.633 2.058 4.114 0.084 6 0 "[ . 1 . 2]" 1
41 1 4 LYS H 1 4 LYS HG3 4.770 . 4.770 3.405 2.075 4.562 . 0 0 "[ . 1 . 2]" 1
42 1 4 LYS H 1 5 ILE H 4.390 . 4.390 2.579 2.307 2.810 . 0 0 "[ . 1 . 2]" 1
43 1 4 LYS HA 1 7 GLY H 5.080 . 5.080 3.526 2.912 4.398 . 0 0 "[ . 1 . 2]" 1
44 1 4 LYS QB 1 5 ILE H 4.450 . 4.450 3.021 2.562 3.861 . 0 0 "[ . 1 . 2]" 1
45 1 4 LYS QB 1 7 GLY H 6.170 . 6.170 4.869 4.221 5.602 . 0 0 "[ . 1 . 2]" 1
46 1 4 LYS QB 1 8 ALA H 6.300 . 6.300 4.733 3.914 5.472 . 0 0 "[ . 1 . 2]" 1
47 1 4 LYS QB 1 8 ALA MB 4.790 . 4.790 4.273 3.549 4.875 0.085 6 0 "[ . 1 . 2]" 1
48 1 5 ILE H 1 5 ILE HB 4.150 . 4.150 2.566 2.483 2.706 . 0 0 "[ . 1 . 2]" 1
49 1 5 ILE H 1 5 ILE MD 4.810 . 4.810 3.602 3.466 3.683 . 0 0 "[ . 1 . 2]" 1
50 1 5 ILE H 1 5 ILE HG12 4.610 . 4.610 3.379 3.234 3.541 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE H 1 5 ILE QG 4.030 . 4.030 2.097 1.929 2.253 . 0 0 "[ . 1 . 2]" 1
52 1 5 ILE H 1 5 ILE HG13 4.610 . 4.610 2.118 1.944 2.279 . 0 0 "[ . 1 . 2]" 1
53 1 5 ILE H 1 5 ILE MG 4.330 . 4.330 3.827 3.801 3.871 . 0 0 "[ . 1 . 2]" 1
54 1 5 ILE H 1 6 VAL MG2 4.870 . 4.870 4.085 3.878 4.312 . 0 0 "[ . 1 . 2]" 1
55 1 5 ILE H 1 7 GLY H 6.300 . 6.300 4.149 3.847 4.672 . 0 0 "[ . 1 . 2]" 1
56 1 5 ILE HA 1 5 ILE MD 4.270 . 4.270 3.899 3.838 3.971 . 0 0 "[ . 1 . 2]" 1
57 1 5 ILE HA 1 8 ALA H 5.220 . 5.220 3.625 3.123 4.007 . 0 0 "[ . 1 . 2]" 1
58 1 5 ILE HA 1 8 ALA MB 4.010 . 4.010 2.864 2.493 3.138 . 0 0 "[ . 1 . 2]" 1
59 1 5 ILE HA 1 9 ASN H 5.750 . 5.750 4.227 3.826 4.491 . 0 0 "[ . 1 . 2]" 1
60 1 5 ILE HB 1 6 VAL H 4.730 . 4.730 2.496 2.129 3.037 . 0 0 "[ . 1 . 2]" 1
61 1 5 ILE HB 1 6 VAL MG1 5.030 . 5.030 3.131 2.653 3.730 . 0 0 "[ . 1 . 2]" 1
62 1 5 ILE HB 1 7 GLY H 6.300 . 6.300 4.915 4.637 5.229 . 0 0 "[ . 1 . 2]" 1
63 1 5 ILE HB 1 8 ALA H 6.300 . 6.300 5.647 5.467 5.845 . 0 0 "[ . 1 . 2]" 1
64 1 5 ILE MD 1 6 VAL MG1 4.980 . 4.980 4.462 3.855 5.071 0.091 4 0 "[ . 1 . 2]" 1
65 1 5 ILE MD 1 9 ASN QD 5.420 . 5.420 4.691 4.349 5.347 . 0 0 "[ . 1 . 2]" 1
66 1 5 ILE MD 2 56 ARG QD 4.810 . 4.810 4.019 2.788 4.928 0.118 17 0 "[ . 1 . 2]" 1
67 1 5 ILE MG 1 6 VAL H 4.550 . 4.550 3.298 3.031 3.812 . 0 0 "[ . 1 . 2]" 1
68 1 5 ILE MG 1 6 VAL HA 5.070 . 5.070 3.379 3.144 3.896 . 0 0 "[ . 1 . 2]" 1
69 1 5 ILE MG 1 6 VAL MG1 4.730 . 4.730 3.355 2.999 4.185 . 0 0 "[ . 1 . 2]" 1
70 1 5 ILE MG 1 7 GLY H 5.650 . 5.650 4.946 4.771 5.168 . 0 0 "[ . 1 . 2]" 1
71 1 5 ILE MG 1 8 ALA H 6.300 . 6.300 4.814 4.505 5.020 . 0 0 "[ . 1 . 2]" 1
72 1 5 ILE MG 1 8 ALA MB 3.920 . 3.920 3.815 3.114 4.053 0.133 12 0 "[ . 1 . 2]" 1
73 1 5 ILE MG 1 9 ASN H 5.580 . 5.580 4.101 3.818 4.322 . 0 0 "[ . 1 . 2]" 1
74 1 5 ILE MG 1 9 ASN HD21 4.770 . 4.770 2.584 2.137 3.851 . 0 0 "[ . 1 . 2]" 1
75 1 5 ILE MG 1 9 ASN QD 4.070 . 4.070 2.156 1.943 2.910 . 0 0 "[ . 1 . 2]" 1
76 1 5 ILE MG 1 9 ASN HD22 4.770 . 4.770 2.368 1.990 3.011 . 0 0 "[ . 1 . 2]" 1
77 1 5 ILE MG 2 56 ARG QD 5.380 . 5.380 3.898 2.966 5.094 . 0 0 "[ . 1 . 2]" 1
78 1 5 ILE MG 2 56 ARG HE 5.740 . 5.740 4.120 2.634 5.783 0.043 18 0 "[ . 1 . 2]" 1
79 1 6 VAL H 1 6 VAL MG1 4.780 . 4.780 2.174 2.046 2.345 . 0 0 "[ . 1 . 2]" 1
80 1 6 VAL H 1 6 VAL MG2 3.940 . 3.940 2.217 2.081 2.420 . 0 0 "[ . 1 . 2]" 1
81 1 6 VAL H 1 7 GLY H 4.770 . 4.770 2.682 2.543 2.915 . 0 0 "[ . 1 . 2]" 1
82 1 6 VAL HA 1 8 ALA H 6.300 . 6.300 4.460 4.176 4.722 . 0 0 "[ . 1 . 2]" 1
83 1 6 VAL HA 1 9 ASN H 5.600 . 5.600 3.575 3.243 3.927 . 0 0 "[ . 1 . 2]" 1
84 1 6 VAL HA 1 9 ASN HB2 5.970 . 5.970 3.324 2.259 4.954 . 0 0 "[ . 1 . 2]" 1
85 1 6 VAL HA 1 9 ASN QB 5.070 . 5.070 3.127 2.244 4.273 . 0 0 "[ . 1 . 2]" 1
86 1 6 VAL HA 1 9 ASN HB3 5.970 . 5.970 4.475 3.849 5.021 . 0 0 "[ . 1 . 2]" 1
87 1 6 VAL HA 1 9 ASN HD21 6.300 . 6.300 3.325 2.278 4.997 . 0 0 "[ . 1 . 2]" 1
88 1 6 VAL HA 1 9 ASN HD22 6.300 . 6.300 4.032 2.118 5.627 . 0 0 "[ . 1 . 2]" 1
89 1 6 VAL HA 1 41 LEU MD1 4.780 . 4.780 3.775 3.115 4.815 0.035 13 0 "[ . 1 . 2]" 1
90 1 6 VAL HA 1 42 ALA H 6.300 . 6.300 5.605 4.522 6.201 . 0 0 "[ . 1 . 2]" 1
91 1 6 VAL HA 1 42 ALA HA 4.890 . 4.890 4.030 3.126 4.479 . 0 0 "[ . 1 . 2]" 1
92 1 6 VAL HA 1 42 ALA MB 5.610 . 5.610 3.754 3.375 4.146 . 0 0 "[ . 1 . 2]" 1
93 1 6 VAL HB 1 7 GLY H 5.170 . 5.170 3.971 3.670 4.098 . 0 0 "[ . 1 . 2]" 1
94 1 6 VAL HB 1 41 LEU MD2 3.990 . 3.990 3.716 2.740 4.177 0.187 20 0 "[ . 1 . 2]" 1
95 1 6 VAL HB 1 45 TRP QB 6.040 . 6.040 2.835 2.038 3.235 . 0 0 "[ . 1 . 2]" 1
96 1 6 VAL HB 1 45 TRP HE3 6.010 . 6.010 4.293 3.760 4.746 . 0 0 "[ . 1 . 2]" 1
97 1 6 VAL MG1 1 7 GLY H 5.350 . 5.350 4.016 3.910 4.111 . 0 0 "[ . 1 . 2]" 1
98 1 6 VAL MG1 1 9 ASN H 6.300 . 6.300 5.333 5.099 5.571 . 0 0 "[ . 1 . 2]" 1
99 1 6 VAL MG1 1 9 ASN QB 6.100 . 6.100 4.580 3.868 5.322 . 0 0 "[ . 1 . 2]" 1
100 1 6 VAL MG1 1 9 ASN HD21 6.300 . 6.300 4.319 3.049 5.801 . 0 0 "[ . 1 . 2]" 1
101 1 6 VAL MG1 1 9 ASN HD22 6.300 . 6.300 4.676 2.649 6.206 . 0 0 "[ . 1 . 2]" 1
102 1 6 VAL MG1 1 10 ALA MB 5.020 . 5.020 5.052 4.784 5.225 0.205 5 0 "[ . 1 . 2]" 1
103 1 6 VAL MG1 1 41 LEU H 6.300 . 6.300 6.208 5.714 6.481 0.181 19 0 "[ . 1 . 2]" 1
104 1 6 VAL MG1 1 41 LEU HB2 5.740 . 5.740 5.137 4.515 5.484 . 0 0 "[ . 1 . 2]" 1
105 1 6 VAL MG1 1 41 LEU HB3 5.740 . 5.740 4.260 3.302 4.828 . 0 0 "[ . 1 . 2]" 1
106 1 6 VAL MG1 1 41 LEU MD1 3.560 . 3.560 1.958 1.670 2.315 . 0 0 "[ . 1 . 2]" 1
107 1 6 VAL MG1 1 41 LEU HG 5.600 . 5.600 3.997 3.742 4.240 . 0 0 "[ . 1 . 2]" 1
108 1 6 VAL MG1 1 42 ALA H 5.890 . 5.890 5.003 4.437 5.368 . 0 0 "[ . 1 . 2]" 1
109 1 6 VAL MG1 1 42 ALA HA 4.260 . 4.260 4.168 3.646 4.493 0.233 16 0 "[ . 1 . 2]" 1
110 1 6 VAL MG1 1 42 ALA MB 4.360 . 4.360 4.322 3.884 4.510 0.150 19 0 "[ . 1 . 2]" 1
111 1 6 VAL MG1 1 45 TRP QB 5.050 . 5.050 3.987 2.983 4.410 . 0 0 "[ . 1 . 2]" 1
112 1 6 VAL MG1 1 45 TRP HE3 4.830 . 4.830 4.595 3.577 4.954 0.124 13 0 "[ . 1 . 2]" 1
113 1 6 VAL MG1 1 45 TRP HZ3 5.820 . 5.820 5.416 4.767 5.871 0.051 13 0 "[ . 1 . 2]" 1
114 1 6 VAL MG1 2 47 ALA MB 4.910 . 4.910 3.796 2.971 4.875 . 0 0 "[ . 1 . 2]" 1
115 1 6 VAL MG2 1 7 GLY H 5.230 . 5.230 2.349 2.038 2.516 . 0 0 "[ . 1 . 2]" 1
116 1 6 VAL MG2 1 8 ALA H 6.300 . 6.300 4.539 4.259 4.679 . 0 0 "[ . 1 . 2]" 1
117 1 6 VAL MG2 1 45 TRP H 6.300 . 6.300 5.339 4.878 5.869 . 0 0 "[ . 1 . 2]" 1
118 1 6 VAL MG2 1 45 TRP HE1 6.030 . 6.030 4.045 3.358 5.056 . 0 0 "[ . 1 . 2]" 1
119 1 6 VAL MG2 1 45 TRP HZ3 4.790 . 4.790 3.542 3.289 4.083 . 0 0 "[ . 1 . 2]" 1
120 1 7 GLY H 1 8 ALA H 4.690 . 4.690 2.657 2.551 2.753 . 0 0 "[ . 1 . 2]" 1
121 1 7 GLY H 1 8 ALA MB 5.830 . 5.830 4.313 4.204 4.395 . 0 0 "[ . 1 . 2]" 1
122 1 7 GLY H 1 10 ALA MB 5.920 . 5.920 4.565 4.321 4.780 . 0 0 "[ . 1 . 2]" 1
123 1 7 GLY QA 1 10 ALA MB 4.320 . 4.320 2.705 2.266 3.194 . 0 0 "[ . 1 . 2]" 1
124 1 7 GLY QA 1 45 TRP HE1 5.470 . 5.470 2.446 1.943 3.065 . 0 0 "[ . 1 . 2]" 1
125 1 7 GLY QA 1 45 TRP HZ2 4.710 . 4.710 3.952 3.348 4.711 0.001 3 0 "[ . 1 . 2]" 1
126 1 7 GLY HA2 1 10 ALA MB 5.060 . 5.060 2.741 2.284 3.255 . 0 0 "[ . 1 . 2]" 1
127 1 7 GLY HA2 1 45 TRP HE1 6.270 . 6.270 2.540 1.968 3.230 . 0 0 "[ . 1 . 2]" 1
128 1 7 GLY HA2 1 45 TRP HZ2 5.410 . 5.410 4.528 3.855 5.394 . 0 0 "[ . 1 . 2]" 1
129 1 7 GLY HA3 1 10 ALA MB 5.060 . 5.060 4.173 3.760 4.641 . 0 0 "[ . 1 . 2]" 1
130 1 7 GLY HA3 1 45 TRP HE1 6.270 . 6.270 3.291 2.801 3.811 . 0 0 "[ . 1 . 2]" 1
131 1 7 GLY HA3 1 45 TRP HZ2 5.410 . 5.410 4.373 3.677 5.194 . 0 0 "[ . 1 . 2]" 1
132 1 8 ALA H 1 8 ALA MB 3.610 . 3.610 2.241 2.214 2.252 . 0 0 "[ . 1 . 2]" 1
133 1 8 ALA H 1 9 ASN H 4.460 . 4.460 2.735 2.658 2.835 . 0 0 "[ . 1 . 2]" 1
134 1 8 ALA H 1 10 ALA H 6.030 . 6.030 4.014 3.861 4.164 . 0 0 "[ . 1 . 2]" 1
135 1 8 ALA MB 1 9 ASN H 4.140 . 4.140 2.478 2.339 2.686 . 0 0 "[ . 1 . 2]" 1
136 1 9 ASN H 1 10 ALA H 4.570 . 4.570 2.618 2.450 2.805 . 0 0 "[ . 1 . 2]" 1
137 1 9 ASN H 1 34 LEU MD1 6.300 . 6.300 4.932 4.575 5.300 . 0 0 "[ . 1 . 2]" 1
138 1 9 ASN HA 1 12 LYS H 5.270 . 5.270 3.511 3.122 3.948 . 0 0 "[ . 1 . 2]" 1
139 1 9 ASN HA 1 12 LYS HB2 5.130 . 5.130 3.783 2.701 5.170 0.040 7 0 "[ . 1 . 2]" 1
140 1 9 ASN HA 1 12 LYS QB 4.480 . 4.480 2.963 2.276 4.073 . 0 0 "[ . 1 . 2]" 1
141 1 9 ASN HA 1 12 LYS HB3 5.130 . 5.130 3.103 2.451 4.263 . 0 0 "[ . 1 . 2]" 1
142 1 9 ASN HA 1 13 VAL QG 6.180 . 6.180 4.063 3.619 4.842 . 0 0 "[ . 1 . 2]" 1
143 1 9 ASN HA 1 34 LEU MD1 5.520 . 5.520 3.137 2.378 3.784 . 0 0 "[ . 1 . 2]" 1
144 1 9 ASN HA 1 34 LEU MD2 6.300 . 6.300 4.308 3.392 5.052 . 0 0 "[ . 1 . 2]" 1
145 1 9 ASN QB 1 34 LEU MD1 4.400 . 4.400 2.159 1.708 2.945 . 0 0 "[ . 1 . 2]" 1
146 1 9 ASN QB 1 34 LEU MD2 6.100 . 6.100 3.631 2.737 4.917 . 0 0 "[ . 1 . 2]" 1
147 1 9 ASN QB 1 42 ALA MB 3.990 . 3.990 2.684 2.036 3.882 . 0 0 "[ . 1 . 2]" 1
148 1 9 ASN HB2 1 10 ALA H 6.030 . 6.030 3.286 2.654 4.240 . 0 0 "[ . 1 . 2]" 1
149 1 9 ASN HB3 1 10 ALA H 6.030 . 6.030 3.987 3.537 4.391 . 0 0 "[ . 1 . 2]" 1
150 1 9 ASN HD21 1 34 LEU MD1 5.680 . 5.680 3.944 2.132 4.732 . 0 0 "[ . 1 . 2]" 1
151 1 9 ASN HD22 1 34 LEU MD1 5.680 . 5.680 4.183 3.289 4.710 . 0 0 "[ . 1 . 2]" 1
152 1 10 ALA H 1 11 GLY H 4.830 . 4.830 2.569 2.475 2.640 . 0 0 "[ . 1 . 2]" 1
153 1 10 ALA HA 1 13 VAL HB 4.870 . 4.870 3.372 2.228 4.962 0.092 10 0 "[ . 1 . 2]" 1
154 1 10 ALA HA 1 13 VAL QG 5.030 . 5.030 2.516 1.696 3.206 . 0 0 "[ . 1 . 2]" 1
155 1 10 ALA HA 1 14 TRP H 6.050 . 6.050 3.932 3.661 4.252 . 0 0 "[ . 1 . 2]" 1
156 1 10 ALA HA 1 42 ALA MB 3.840 . 3.840 2.078 1.917 2.424 . 0 0 "[ . 1 . 2]" 1
157 1 10 ALA HA 1 46 LEU MD1 5.270 . 5.270 3.254 2.942 3.490 . 0 0 "[ . 1 . 2]" 1
158 1 10 ALA MB 1 11 GLY H 4.400 . 4.400 2.693 2.444 2.848 . 0 0 "[ . 1 . 2]" 1
159 1 10 ALA MB 1 14 TRP H 6.300 . 6.300 4.507 4.297 4.747 . 0 0 "[ . 1 . 2]" 1
160 1 10 ALA MB 1 45 TRP QB 5.080 . 5.080 2.384 2.012 2.882 . 0 0 "[ . 1 . 2]" 1
161 1 10 ALA MB 1 45 TRP HD1 4.530 . 4.530 2.089 1.904 2.333 . 0 0 "[ . 1 . 2]" 1
162 1 10 ALA MB 1 45 TRP HE1 5.050 . 5.050 3.777 3.565 4.023 . 0 0 "[ . 1 . 2]" 1
163 1 10 ALA MB 1 46 LEU H 5.280 . 5.280 3.423 3.094 3.867 . 0 0 "[ . 1 . 2]" 1
164 1 10 ALA MB 1 46 LEU HA 4.830 . 4.830 3.864 3.596 4.127 . 0 0 "[ . 1 . 2]" 1
165 1 10 ALA MB 1 46 LEU MD2 3.630 . 3.630 2.167 1.964 2.335 . 0 0 "[ . 1 . 2]" 1
166 1 10 ALA MB 1 46 LEU HG 4.190 . 4.190 2.152 1.914 2.536 . 0 0 "[ . 1 . 2]" 1
167 1 11 GLY H 1 12 LYS H 4.530 . 4.530 2.681 2.567 2.765 . 0 0 "[ . 1 . 2]" 1
168 1 11 GLY H 1 13 VAL H 6.020 . 6.020 4.253 4.117 4.444 . 0 0 "[ . 1 . 2]" 1
169 1 11 GLY QA 1 14 TRP H 5.810 . 5.810 3.668 3.307 3.938 . 0 0 "[ . 1 . 2]" 1
170 1 11 GLY QA 1 14 TRP QB 5.570 . 5.570 2.878 2.475 3.268 . 0 0 "[ . 1 . 2]" 1
171 1 12 LYS H 1 12 LYS HG2 5.350 . 5.350 4.293 2.139 4.611 . 0 0 "[ . 1 . 2]" 1
172 1 12 LYS H 1 12 LYS QG 4.500 . 4.500 3.844 2.108 4.042 . 0 0 "[ . 1 . 2]" 1
173 1 12 LYS H 1 12 LYS HG3 5.350 . 5.350 4.403 3.194 4.579 . 0 0 "[ . 1 . 2]" 1
174 1 12 LYS H 1 13 VAL H 4.600 . 4.600 2.661 2.524 2.882 . 0 0 "[ . 1 . 2]" 1
175 1 12 LYS H 1 13 VAL HA 6.300 . 6.300 5.303 5.205 5.457 . 0 0 "[ . 1 . 2]" 1
176 1 12 LYS H 1 13 VAL QG 5.750 . 5.750 3.974 3.604 4.312 . 0 0 "[ . 1 . 2]" 1
177 1 12 LYS H 1 14 TRP H 6.200 . 6.200 4.126 3.910 4.325 . 0 0 "[ . 1 . 2]" 1
178 1 12 LYS H 1 14 TRP QB 6.300 . 6.300 4.964 4.727 5.201 . 0 0 "[ . 1 . 2]" 1
179 1 12 LYS H 1 15 HIS QB 6.300 . 6.300 4.714 4.424 5.273 . 0 0 "[ . 1 . 2]" 1
180 1 12 LYS H 1 32 VAL MG1 6.300 . 6.300 5.355 4.892 5.871 . 0 0 "[ . 1 . 2]" 1
181 1 12 LYS HA 1 12 LYS QE 5.730 . 5.730 4.603 2.939 5.171 . 0 0 "[ . 1 . 2]" 1
182 1 12 LYS HA 1 15 HIS QB 4.610 . 4.610 2.585 2.207 2.962 . 0 0 "[ . 1 . 2]" 1
183 1 12 LYS HA 1 15 HIS HD2 5.760 . 5.760 4.706 1.939 5.824 0.064 5 0 "[ . 1 . 2]" 1
184 1 12 LYS QB 1 13 VAL QG 5.460 . 5.460 3.359 2.938 4.289 . 0 0 "[ . 1 . 2]" 1
185 1 12 LYS QB 1 32 VAL MG1 5.150 . 5.150 3.708 2.650 4.208 . 0 0 "[ . 1 . 2]" 1
186 1 12 LYS QB 1 32 VAL MG2 4.840 . 4.840 4.482 3.949 5.054 0.214 2 0 "[ . 1 . 2]" 1
187 1 12 LYS QB 1 34 LEU MD1 5.210 . 5.210 3.472 2.097 4.952 . 0 0 "[ . 1 . 2]" 1
188 1 12 LYS HB2 1 34 LEU MD1 6.000 . 6.000 4.689 3.254 5.661 . 0 0 "[ . 1 . 2]" 1
189 1 12 LYS HB3 1 34 LEU MD1 6.000 . 6.000 3.612 2.123 5.467 . 0 0 "[ . 1 . 2]" 1
190 1 12 LYS QD 1 32 VAL HA 4.680 . 4.680 3.372 2.705 4.713 0.033 10 0 "[ . 1 . 2]" 1
191 1 12 LYS QD 1 32 VAL HB 5.150 . 5.150 2.760 1.983 3.441 . 0 0 "[ . 1 . 2]" 1
192 1 12 LYS QD 1 32 VAL MG1 4.700 . 4.700 3.602 2.582 4.287 . 0 0 "[ . 1 . 2]" 1
193 1 12 LYS QD 1 32 VAL MG2 4.890 . 4.890 3.966 3.129 4.596 . 0 0 "[ . 1 . 2]" 1
194 1 12 LYS QD 1 34 LEU MD1 4.870 . 4.870 3.317 2.001 4.530 . 0 0 "[ . 1 . 2]" 1
195 1 12 LYS QD 1 34 LEU MD2 5.410 . 5.410 3.645 2.747 4.654 . 0 0 "[ . 1 . 2]" 1
196 1 12 LYS QE 1 32 VAL HA 4.740 . 4.740 3.510 1.837 4.845 0.105 7 0 "[ . 1 . 2]" 1
197 1 12 LYS QE 1 34 LEU MD1 6.050 . 6.050 4.045 2.547 5.323 . 0 0 "[ . 1 . 2]" 1
198 1 12 LYS QE 1 34 LEU MD2 6.300 . 6.300 3.835 2.481 5.209 . 0 0 "[ . 1 . 2]" 1
199 1 12 LYS QG 1 13 VAL H 6.100 . 6.100 3.530 2.267 3.920 . 0 0 "[ . 1 . 2]" 1
200 1 12 LYS QG 1 32 VAL HB 5.440 . 5.440 2.353 1.762 3.237 . 0 0 "[ . 1 . 2]" 1
201 1 12 LYS HG2 1 32 VAL HA 5.460 . 5.460 3.580 2.849 5.545 0.085 7 0 "[ . 1 . 2]" 1
202 1 12 LYS HG3 1 32 VAL HA 5.460 . 5.460 4.166 3.135 5.092 . 0 0 "[ . 1 . 2]" 1
203 1 13 VAL H 1 13 VAL QG 4.140 . 4.140 2.159 1.980 2.336 . 0 0 "[ . 1 . 2]" 1
204 1 13 VAL H 1 14 TRP H 5.020 . 5.020 2.682 2.595 2.785 . 0 0 "[ . 1 . 2]" 1
205 1 13 VAL H 1 16 ALA MB 6.300 . 6.300 4.974 4.609 5.309 . 0 0 "[ . 1 . 2]" 1
206 1 13 VAL H 1 42 ALA MB 6.300 . 6.300 4.235 3.948 4.665 . 0 0 "[ . 1 . 2]" 1
207 1 13 VAL HA 1 15 HIS H 6.240 . 6.240 4.373 4.227 4.591 . 0 0 "[ . 1 . 2]" 1
208 1 13 VAL HA 1 16 ALA H 5.320 . 5.320 3.468 3.132 3.762 . 0 0 "[ . 1 . 2]" 1
209 1 13 VAL HA 1 16 ALA MB 4.440 . 4.440 2.840 2.378 3.250 . 0 0 "[ . 1 . 2]" 1
210 1 13 VAL HA 1 17 LEU H 6.300 . 6.300 4.606 4.224 5.490 . 0 0 "[ . 1 . 2]" 1
211 1 13 VAL HA 1 32 VAL MG1 4.190 . 4.190 1.897 1.579 2.920 . 0 0 "[ . 1 . 2]" 1
212 1 13 VAL HA 1 32 VAL MG2 5.840 . 5.840 3.582 3.120 4.146 . 0 0 "[ . 1 . 2]" 1
213 1 13 VAL HB 1 14 TRP H 5.160 . 5.160 3.181 2.550 4.074 . 0 0 "[ . 1 . 2]" 1
214 1 13 VAL HB 1 39 THR MG 5.310 . 5.310 3.864 2.779 4.699 . 0 0 "[ . 1 . 2]" 1
215 1 13 VAL HB 1 42 ALA MB 5.480 . 5.480 3.503 2.943 4.587 . 0 0 "[ . 1 . 2]" 1
216 1 13 VAL QG 1 14 TRP H 4.800 . 4.800 2.814 2.173 3.322 . 0 0 "[ . 1 . 2]" 1
217 1 13 VAL QG 1 34 LEU MD1 4.170 . 4.170 2.559 2.088 3.623 . 0 0 "[ . 1 . 2]" 1
218 1 13 VAL QG 1 42 ALA MB 3.530 . 3.530 2.083 1.932 2.420 . 0 0 "[ . 1 . 2]" 1
219 1 13 VAL MG1 1 14 TRP H 5.460 . 5.460 3.429 2.279 4.077 . 0 0 "[ . 1 . 2]" 1
220 1 13 VAL MG2 1 14 TRP H 5.460 . 5.460 3.451 2.182 4.080 . 0 0 "[ . 1 . 2]" 1
221 1 14 TRP H 1 14 TRP HD1 5.630 . 5.630 4.857 4.698 5.133 . 0 0 "[ . 1 . 2]" 1
222 1 14 TRP H 1 15 HIS H 4.900 . 4.900 2.651 2.565 2.722 . 0 0 "[ . 1 . 2]" 1
223 1 14 TRP H 1 16 ALA H 6.300 . 6.300 4.168 3.874 4.518 . 0 0 "[ . 1 . 2]" 1
224 1 14 TRP H 1 16 ALA MB 6.300 . 6.300 4.873 4.591 5.260 . 0 0 "[ . 1 . 2]" 1
225 1 14 TRP H 1 42 ALA MB 6.300 . 6.300 5.167 4.849 5.694 . 0 0 "[ . 1 . 2]" 1
226 1 14 TRP H 1 46 LEU MD1 5.020 . 5.020 2.679 2.453 3.082 . 0 0 "[ . 1 . 2]" 1
227 1 14 TRP H 1 46 LEU MD2 5.920 . 5.920 3.696 3.327 4.173 . 0 0 "[ . 1 . 2]" 1
228 1 14 TRP HA 1 14 TRP HD1 4.550 . 4.550 3.090 2.926 3.354 . 0 0 "[ . 1 . 2]" 1
229 1 14 TRP HA 1 14 TRP HE3 4.660 . 4.660 4.495 4.194 4.702 0.042 19 0 "[ . 1 . 2]" 1
230 1 14 TRP HA 1 17 LEU QB 5.830 . 5.830 2.627 2.010 3.765 . 0 0 "[ . 1 . 2]" 1
231 1 14 TRP HA 1 17 LEU MD1 4.750 . 4.750 2.126 1.657 3.060 . 0 0 "[ . 1 . 2]" 1
232 1 14 TRP HA 1 17 LEU HG 6.220 . 6.220 2.952 2.279 3.654 . 0 0 "[ . 1 . 2]" 1
233 1 14 TRP HA 1 46 LEU MD1 5.280 . 5.280 2.812 2.505 3.061 . 0 0 "[ . 1 . 2]" 1
234 1 14 TRP HA 1 52 VAL MG1 5.040 . 5.040 3.886 3.568 4.132 . 0 0 "[ . 1 . 2]" 1
235 1 14 TRP QB 1 15 HIS H 4.630 . 4.630 2.763 2.637 2.853 . 0 0 "[ . 1 . 2]" 1
236 1 14 TRP QB 1 46 LEU MD1 4.910 . 4.910 2.046 1.948 2.151 . 0 0 "[ . 1 . 2]" 1
237 1 14 TRP QB 1 46 LEU MD2 4.650 . 4.650 2.225 2.010 2.614 . 0 0 "[ . 1 . 2]" 1
238 1 14 TRP HD1 1 17 LEU MD1 4.820 . 4.820 2.632 1.919 3.274 . 0 0 "[ . 1 . 2]" 1
239 1 14 TRP HD1 1 46 LEU QB 5.710 . 5.710 3.202 2.960 4.524 . 0 0 "[ . 1 . 2]" 1
240 1 14 TRP HD1 1 46 LEU MD1 4.980 . 4.980 2.110 1.861 3.403 . 0 0 "[ . 1 . 2]" 1
241 1 14 TRP HD1 1 46 LEU MD2 4.560 . 4.560 2.854 2.310 3.924 . 0 0 "[ . 1 . 2]" 1
242 1 14 TRP HD1 1 51 LYS H 5.520 . 5.520 5.567 5.411 5.691 0.171 13 0 "[ . 1 . 2]" 1
243 1 14 TRP HD1 1 51 LYS QB 4.680 . 4.680 2.681 2.012 3.696 . 0 0 "[ . 1 . 2]" 1
244 1 14 TRP HD1 1 51 LYS QD 6.100 . 6.100 4.441 3.246 5.742 . 0 0 "[ . 1 . 2]" 1
245 1 14 TRP HD1 1 51 LYS QE 5.800 . 5.800 4.361 2.893 5.833 0.033 13 0 "[ . 1 . 2]" 1
246 1 14 TRP HD1 1 52 VAL MG1 5.120 . 5.120 2.419 2.053 3.629 . 0 0 "[ . 1 . 2]" 1
247 1 14 TRP HE1 1 17 LEU MD1 6.300 . 6.300 3.702 2.820 4.515 . 0 0 "[ . 1 . 2]" 1
248 1 14 TRP HE1 1 46 LEU MD1 6.300 . 6.300 4.428 4.215 5.574 . 0 0 "[ . 1 . 2]" 1
249 1 14 TRP HE1 1 46 LEU MD2 6.270 . 6.270 4.389 4.053 5.415 . 0 0 "[ . 1 . 2]" 1
250 1 14 TRP HE1 1 51 LYS QB 5.210 . 5.210 2.291 1.947 3.347 . 0 0 "[ . 1 . 2]" 1
251 1 14 TRP HE1 1 51 LYS HD2 6.300 . 6.300 4.888 2.611 5.944 . 0 0 "[ . 1 . 2]" 1
252 1 14 TRP HE1 1 51 LYS QD 5.550 . 5.550 4.076 2.580 4.966 . 0 0 "[ . 1 . 2]" 1
253 1 14 TRP HE1 1 51 LYS HD3 6.300 . 6.300 4.727 3.617 5.740 . 0 0 "[ . 1 . 2]" 1
254 1 14 TRP HE1 1 51 LYS QE 5.290 . 5.290 3.915 2.607 5.406 0.116 14 0 "[ . 1 . 2]" 1
255 1 14 TRP HE1 1 51 LYS HG2 6.300 . 6.300 4.486 3.502 5.467 . 0 0 "[ . 1 . 2]" 1
256 1 14 TRP HE1 1 51 LYS HG3 6.300 . 6.300 4.986 4.506 5.295 . 0 0 "[ . 1 . 2]" 1
257 1 14 TRP HE1 1 52 VAL MG1 6.300 . 6.300 3.575 2.853 5.523 . 0 0 "[ . 1 . 2]" 1
258 1 14 TRP HE3 1 15 HIS H 5.880 . 5.880 3.654 3.381 3.918 . 0 0 "[ . 1 . 2]" 1
259 1 14 TRP HE3 1 15 HIS HA 4.740 . 4.740 3.366 2.991 3.892 . 0 0 "[ . 1 . 2]" 1
260 1 14 TRP HE3 1 17 LEU MD1 5.210 . 5.210 5.321 4.738 5.529 0.319 12 0 "[ . 1 . 2]" 1
261 1 14 TRP HE3 1 46 LEU MD1 5.210 . 5.210 5.360 5.307 5.434 0.224 18 0 "[ . 1 . 2]" 1
262 1 14 TRP HE3 1 46 LEU MD2 5.340 . 5.340 4.976 4.690 5.292 . 0 0 "[ . 1 . 2]" 1
263 1 14 TRP HE3 1 51 LYS QE 6.300 . 6.300 4.952 3.761 6.310 0.010 6 0 "[ . 1 . 2]" 1
264 1 14 TRP HH2 1 51 LYS QE 6.300 . 6.300 5.028 3.564 6.302 0.002 17 0 "[ . 1 . 2]" 1
265 1 14 TRP HZ2 1 51 LYS QE 5.500 . 5.500 4.248 2.563 5.554 0.054 6 0 "[ . 1 . 2]" 1
266 1 15 HIS H 1 16 ALA H 4.410 . 4.410 2.738 2.622 2.874 . 0 0 "[ . 1 . 2]" 1
267 1 15 HIS H 1 16 ALA MB 6.170 . 6.170 4.406 4.325 4.531 . 0 0 "[ . 1 . 2]" 1
268 1 15 HIS H 1 46 LEU MD1 6.010 . 6.010 4.753 4.627 5.003 . 0 0 "[ . 1 . 2]" 1
269 1 15 HIS H 1 46 LEU MD2 6.150 . 6.150 5.320 4.965 5.652 . 0 0 "[ . 1 . 2]" 1
270 1 15 HIS HA 1 18 ASN H 5.730 . 5.730 3.452 3.133 3.924 . 0 0 "[ . 1 . 2]" 1
271 1 15 HIS HA 1 18 ASN HB2 5.620 . 5.620 3.341 2.709 5.372 . 0 0 "[ . 1 . 2]" 1
272 1 15 HIS HA 1 18 ASN QB 4.850 . 4.850 2.881 2.109 4.107 . 0 0 "[ . 1 . 2]" 1
273 1 15 HIS HA 1 18 ASN HB3 5.620 . 5.620 3.484 2.156 4.718 . 0 0 "[ . 1 . 2]" 1
274 1 15 HIS HA 1 18 ASN QD 5.800 . 5.800 4.656 2.451 5.721 . 0 0 "[ . 1 . 2]" 1
275 1 15 HIS QB 1 16 ALA H 4.590 . 4.590 2.655 2.466 2.882 . 0 0 "[ . 1 . 2]" 1
276 1 16 ALA H 1 17 LEU H 4.770 . 4.770 2.633 2.533 2.767 . 0 0 "[ . 1 . 2]" 1
277 1 16 ALA H 1 17 LEU MD1 5.830 . 5.830 5.289 4.959 5.908 0.078 11 0 "[ . 1 . 2]" 1
278 1 16 ALA H 1 18 ASN QB 5.970 . 5.970 5.055 4.623 6.164 0.194 18 0 "[ . 1 . 2]" 1
279 1 16 ALA H 1 32 VAL MG1 6.070 . 6.070 3.626 3.306 4.011 . 0 0 "[ . 1 . 2]" 1
280 1 16 ALA MB 1 17 LEU H 4.590 . 4.590 2.721 2.596 2.907 . 0 0 "[ . 1 . 2]" 1
281 1 16 ALA MB 1 32 VAL H 6.300 . 6.300 4.375 3.718 4.886 . 0 0 "[ . 1 . 2]" 1
282 1 16 ALA MB 1 32 VAL HA 5.630 . 5.630 4.402 3.597 4.925 . 0 0 "[ . 1 . 2]" 1
283 1 16 ALA MB 1 32 VAL MG1 3.300 . 3.300 2.242 1.861 2.601 . 0 0 "[ . 1 . 2]" 1
284 1 17 LEU H 1 17 LEU MD1 5.260 . 5.260 3.658 3.419 4.075 . 0 0 "[ . 1 . 2]" 1
285 1 17 LEU H 1 17 LEU MD2 5.300 . 5.300 3.609 3.313 4.222 . 0 0 "[ . 1 . 2]" 1
286 1 17 LEU H 1 17 LEU HG 5.100 . 5.100 2.768 2.128 4.580 . 0 0 "[ . 1 . 2]" 1
287 1 17 LEU H 1 18 ASN H 4.910 . 4.910 2.685 2.537 2.906 . 0 0 "[ . 1 . 2]" 1
288 1 17 LEU HA 1 17 LEU MD2 4.000 . 4.000 2.160 2.040 2.321 . 0 0 "[ . 1 . 2]" 1
289 1 17 LEU HA 1 21 ASP QB 6.100 . 6.100 3.602 1.949 5.515 . 0 0 "[ . 1 . 2]" 1
290 1 17 LEU QB 1 65 ASN QB 5.900 . 5.900 3.464 1.849 5.172 . 0 0 "[ . 1 . 2]" 1
291 1 17 LEU HB2 1 18 ASN H 5.780 . 5.780 2.982 2.440 4.152 . 0 0 "[ . 1 . 2]" 1
292 1 17 LEU HB3 1 18 ASN H 5.780 . 5.780 3.525 2.558 4.046 . 0 0 "[ . 1 . 2]" 1
293 1 17 LEU MD1 1 18 ASN H 5.930 . 5.930 4.307 2.885 4.939 . 0 0 "[ . 1 . 2]" 1
294 1 17 LEU MD1 1 52 VAL HB 5.810 . 5.810 3.770 3.472 4.219 . 0 0 "[ . 1 . 2]" 1
295 1 17 LEU MD1 1 65 ASN HA 5.940 . 5.940 2.861 1.815 4.229 . 0 0 "[ . 1 . 2]" 1
296 1 17 LEU MD1 1 65 ASN QB 5.960 . 5.960 3.533 2.178 4.945 . 0 0 "[ . 1 . 2]" 1
297 1 17 LEU MD1 1 65 ASN HD21 6.300 . 6.300 4.309 2.081 6.265 . 0 0 "[ . 1 . 2]" 1
298 1 17 LEU MD1 1 65 ASN HD22 6.300 . 6.300 4.424 2.823 6.401 0.101 4 0 "[ . 1 . 2]" 1
299 1 17 LEU MD1 1 66 GLU H 6.300 . 6.300 4.505 3.290 5.778 . 0 0 "[ . 1 . 2]" 1
300 1 17 LEU MD2 1 18 ASN H 6.300 . 6.300 4.684 4.051 4.887 . 0 0 "[ . 1 . 2]" 1
301 1 17 LEU MD2 1 21 ASP H 5.800 . 5.800 4.740 4.071 5.773 . 0 0 "[ . 1 . 2]" 1
302 1 17 LEU MD2 1 21 ASP HA 4.510 . 4.510 2.605 1.819 3.679 . 0 0 "[ . 1 . 2]" 1
303 1 17 LEU MD2 1 21 ASP QB 4.810 . 4.810 2.983 2.150 4.514 . 0 0 "[ . 1 . 2]" 1
304 1 17 LEU MD2 1 22 GLY H 5.500 . 5.500 3.362 2.754 4.448 . 0 0 "[ . 1 . 2]" 1
305 1 17 LEU MD2 1 23 ILE H 5.900 . 5.900 3.902 3.183 4.743 . 0 0 "[ . 1 . 2]" 1
306 1 17 LEU MD2 1 65 ASN H 6.300 . 6.300 3.895 3.005 4.665 . 0 0 "[ . 1 . 2]" 1
307 1 17 LEU MD2 1 65 ASN QB 5.070 . 5.070 4.081 2.829 5.206 0.136 10 0 "[ . 1 . 2]" 1
308 1 17 LEU MD2 1 65 ASN HD21 6.300 . 6.300 5.013 3.645 6.193 . 0 0 "[ . 1 . 2]" 1
309 1 17 LEU MD2 1 65 ASN HD22 6.300 . 6.300 5.192 3.869 6.367 0.067 18 0 "[ . 1 . 2]" 1
310 1 18 ASN H 1 18 ASN QD 5.590 . 5.590 4.112 2.203 4.567 . 0 0 "[ . 1 . 2]" 1
311 1 18 ASN H 1 65 ASN QD 6.020 . 6.020 4.135 3.089 5.790 . 0 0 "[ . 1 . 2]" 1
312 1 18 ASN HA 1 65 ASN HD21 5.470 . 5.470 3.599 2.016 5.542 0.072 16 0 "[ . 1 . 2]" 1
313 1 18 ASN HA 1 65 ASN HD22 5.470 . 5.470 3.647 2.038 5.138 . 0 0 "[ . 1 . 2]" 1
314 1 19 GLU H 1 19 GLU HG2 5.020 . 5.020 3.829 2.141 4.651 . 0 0 "[ . 1 . 2]" 1
315 1 19 GLU H 1 19 GLU HG3 5.020 . 5.020 3.596 2.025 4.793 . 0 0 "[ . 1 . 2]" 1
316 1 19 GLU H 1 20 ALA MB 5.460 . 5.460 4.703 3.821 5.126 . 0 0 "[ . 1 . 2]" 1
317 1 19 GLU QB 1 20 ALA H 4.590 . 4.590 2.489 2.094 3.183 . 0 0 "[ . 1 . 2]" 1
318 1 19 GLU QB 1 20 ALA MB 4.760 . 4.760 3.407 3.073 3.738 . 0 0 "[ . 1 . 2]" 1
319 1 19 GLU QG 1 20 ALA MB 5.260 . 5.260 4.167 2.462 5.335 0.075 4 0 "[ . 1 . 2]" 1
320 1 19 GLU HG2 1 20 ALA H 5.920 . 5.920 4.467 3.285 5.035 . 0 0 "[ . 1 . 2]" 1
321 1 19 GLU HG3 1 20 ALA H 5.920 . 5.920 4.466 3.396 5.496 . 0 0 "[ . 1 . 2]" 1
322 1 20 ALA H 1 21 ASP H 4.850 . 4.850 3.760 3.530 4.155 . 0 0 "[ . 1 . 2]" 1
323 1 20 ALA H 1 23 ILE MG 6.140 . 6.140 5.078 4.322 5.800 . 0 0 "[ . 1 . 2]" 1
324 1 20 ALA MB 1 21 ASP H 4.050 . 4.050 3.492 3.290 3.663 . 0 0 "[ . 1 . 2]" 1
325 1 20 ALA MB 1 21 ASP HA 5.090 . 5.090 4.424 4.314 4.576 . 0 0 "[ . 1 . 2]" 1
326 1 20 ALA MB 1 23 ILE MD 5.450 . 5.450 3.658 2.451 4.704 . 0 0 "[ . 1 . 2]" 1
327 1 20 ALA MB 1 23 ILE MG 5.240 . 5.240 4.093 2.595 4.913 . 0 0 "[ . 1 . 2]" 1
328 1 20 ALA MB 1 31 LYS QE 5.160 . 5.160 3.751 1.830 5.094 . 0 0 "[ . 1 . 2]" 1
329 1 21 ASP QB 1 22 GLY H 4.550 . 4.550 2.386 2.061 3.751 . 0 0 "[ . 1 . 2]" 1
330 1 21 ASP HB2 1 22 GLY H 5.370 . 5.370 2.492 2.073 4.408 . 0 0 "[ . 1 . 2]" 1
331 1 21 ASP HB2 1 65 ASN H 6.070 . 6.070 2.967 1.912 4.954 . 0 0 "[ . 1 . 2]" 1
332 1 21 ASP HB3 1 22 GLY H 5.370 . 5.370 3.708 3.159 4.062 . 0 0 "[ . 1 . 2]" 1
333 1 21 ASP HB3 1 65 ASN H 6.070 . 6.070 3.500 2.390 4.985 . 0 0 "[ . 1 . 2]" 1
334 1 22 GLY H 1 23 ILE H 5.030 . 5.030 2.658 2.380 2.960 . 0 0 "[ . 1 . 2]" 1
335 1 22 GLY H 1 23 ILE MG 5.610 . 5.610 3.339 2.936 3.597 . 0 0 "[ . 1 . 2]" 1
336 1 22 GLY H 1 64 TYR QD 5.600 . 5.600 3.516 2.588 4.354 . 0 0 "[ . 1 . 2]" 1
337 1 22 GLY H 1 64 TYR QE 6.300 . 6.300 4.471 3.419 5.353 . 0 0 "[ . 1 . 2]" 1
338 1 22 GLY H 1 65 ASN H 6.300 . 6.300 4.287 3.626 5.056 . 0 0 "[ . 1 . 2]" 1
339 1 22 GLY QA 1 64 TYR QD 5.680 . 5.680 3.059 2.091 3.790 . 0 0 "[ . 1 . 2]" 1
340 1 22 GLY QA 1 64 TYR QE 5.420 . 5.420 2.732 2.152 3.190 . 0 0 "[ . 1 . 2]" 1
341 1 23 ILE H 1 23 ILE MD 5.510 . 5.510 4.716 4.390 4.990 . 0 0 "[ . 1 . 2]" 1
342 1 23 ILE H 1 23 ILE MG 4.340 . 4.340 2.206 1.937 2.515 . 0 0 "[ . 1 . 2]" 1
343 1 23 ILE H 1 63 ILE H 5.210 . 5.210 3.324 2.585 4.541 . 0 0 "[ . 1 . 2]" 1
344 1 23 ILE HB 1 24 SER H 5.070 . 5.070 4.144 4.034 4.386 . 0 0 "[ . 1 . 2]" 1
345 1 23 ILE MD 1 24 SER H 5.480 . 5.480 3.855 2.385 4.482 . 0 0 "[ . 1 . 2]" 1
346 1 23 ILE MD 1 27 GLU H 6.300 . 6.300 4.620 4.316 5.004 . 0 0 "[ . 1 . 2]" 1
347 1 23 ILE MD 1 27 GLU HB2 4.450 . 4.450 3.247 2.451 4.479 0.029 13 0 "[ . 1 . 2]" 1
348 1 23 ILE MD 1 27 GLU HB3 4.450 . 4.450 2.563 2.020 3.291 . 0 0 "[ . 1 . 2]" 1
349 1 23 ILE MD 1 28 LEU H 4.840 . 4.840 3.165 2.892 3.669 . 0 0 "[ . 1 . 2]" 1
350 1 23 ILE MD 1 28 LEU HA 4.030 . 4.030 2.657 2.237 3.977 . 0 0 "[ . 1 . 2]" 1
351 1 23 ILE MD 1 28 LEU QB 4.550 . 4.550 2.708 1.852 3.506 . 0 0 "[ . 1 . 2]" 1
352 1 23 ILE MD 1 31 LYS QD 3.810 . 3.810 2.779 1.821 3.787 . 0 0 "[ . 1 . 2]" 1
353 1 23 ILE MD 1 31 LYS QE 4.600 . 4.600 3.221 1.992 4.457 . 0 0 "[ . 1 . 2]" 1
354 1 23 ILE QG 1 27 GLU QB 4.620 . 4.620 2.284 1.967 3.215 . 0 0 "[ . 1 . 2]" 1
355 1 23 ILE QG 1 28 LEU H 5.420 . 5.420 2.825 2.594 3.152 . 0 0 "[ . 1 . 2]" 1
356 1 23 ILE QG 1 28 LEU QB 5.230 . 5.230 2.593 1.815 3.303 . 0 0 "[ . 1 . 2]" 1
357 1 23 ILE HG12 1 24 SER H 5.840 . 5.840 2.988 2.316 4.808 . 0 0 "[ . 1 . 2]" 1
358 1 23 ILE HG12 1 27 GLU H 6.300 . 6.300 4.511 4.042 6.180 . 0 0 "[ . 1 . 2]" 1
359 1 23 ILE HG13 1 24 SER H 5.840 . 5.840 2.793 2.591 3.390 . 0 0 "[ . 1 . 2]" 1
360 1 23 ILE HG13 1 27 GLU H 6.300 . 6.300 5.153 4.622 5.602 . 0 0 "[ . 1 . 2]" 1
361 1 23 ILE MG 1 24 SER H 5.400 . 5.400 3.904 3.605 4.264 . 0 0 "[ . 1 . 2]" 1
362 1 23 ILE MG 1 27 GLU QB 5.430 . 5.430 4.246 3.676 5.121 . 0 0 "[ . 1 . 2]" 1
363 1 23 ILE MG 1 28 LEU H 5.830 . 5.830 4.008 3.478 4.767 . 0 0 "[ . 1 . 2]" 1
364 1 23 ILE MG 1 28 LEU HA 5.510 . 5.510 3.828 2.871 4.739 . 0 0 "[ . 1 . 2]" 1
365 1 23 ILE MG 1 28 LEU QB 4.180 . 4.180 2.359 1.916 2.959 . 0 0 "[ . 1 . 2]" 1
366 1 23 ILE MG 1 63 ILE H 5.590 . 5.590 4.036 3.166 5.485 . 0 0 "[ . 1 . 2]" 1
367 1 24 SER H 1 27 GLU H 6.300 . 6.300 4.640 4.352 4.825 . 0 0 "[ . 1 . 2]" 1
368 1 24 SER H 1 27 GLU QB 4.450 . 4.450 3.136 2.671 3.583 . 0 0 "[ . 1 . 2]" 1
369 1 24 SER QB 1 27 GLU H 5.110 . 5.110 3.196 2.576 4.018 . 0 0 "[ . 1 . 2]" 1
370 1 24 SER QB 1 27 GLU QB 5.130 . 5.130 2.996 2.257 4.130 . 0 0 "[ . 1 . 2]" 1
371 1 24 SER QB 1 27 GLU QG 5.210 . 5.210 3.215 2.021 4.513 . 0 0 "[ . 1 . 2]" 1
372 1 24 SER QB 1 28 LEU H 6.100 . 6.100 4.416 4.037 5.090 . 0 0 "[ . 1 . 2]" 1
373 1 25 ILE H 1 25 ILE MD 5.060 . 5.060 3.565 3.092 3.701 . 0 0 "[ . 1 . 2]" 1
374 1 25 ILE H 1 25 ILE HG12 5.450 . 5.450 3.197 2.083 3.542 . 0 0 "[ . 1 . 2]" 1
375 1 25 ILE H 1 25 ILE QG 4.640 . 4.640 2.066 1.975 2.201 . 0 0 "[ . 1 . 2]" 1
376 1 25 ILE H 1 25 ILE HG13 5.450 . 5.450 2.235 1.991 3.620 . 0 0 "[ . 1 . 2]" 1
377 1 25 ILE H 1 26 PRO QD 5.630 . 5.630 2.443 2.298 2.585 . 0 0 "[ . 1 . 2]" 1
378 1 25 ILE HA 1 27 GLU H 6.100 . 6.100 4.384 4.098 4.633 . 0 0 "[ . 1 . 2]" 1
379 1 25 ILE HA 1 28 LEU QB 5.120 . 5.120 3.038 2.117 4.941 . 0 0 "[ . 1 . 2]" 1
380 1 25 ILE HA 1 28 LEU MD2 4.570 . 4.570 2.516 1.945 2.957 . 0 0 "[ . 1 . 2]" 1
381 1 25 ILE HA 1 28 LEU HG 6.230 . 6.230 4.244 2.886 4.812 . 0 0 "[ . 1 . 2]" 1
382 1 25 ILE HA 1 39 THR HB 4.950 . 4.950 4.679 4.455 4.934 . 0 0 "[ . 1 . 2]" 1
383 1 25 ILE HA 1 39 THR MG 4.340 . 4.340 3.173 2.757 3.505 . 0 0 "[ . 1 . 2]" 1
384 1 25 ILE HA 1 40 ALA MB 5.470 . 5.470 5.044 4.691 5.219 . 0 0 "[ . 1 . 2]" 1
385 1 25 ILE HB 1 26 PRO QD 4.770 . 4.770 2.206 2.035 2.443 . 0 0 "[ . 1 . 2]" 1
386 1 25 ILE MD 1 39 THR HB 5.260 . 5.260 5.028 3.954 5.296 0.036 20 0 "[ . 1 . 2]" 1
387 1 25 ILE MD 1 40 ALA H 4.950 . 4.950 4.142 3.378 4.545 . 0 0 "[ . 1 . 2]" 1
388 1 25 ILE MD 1 40 ALA HA 4.140 . 4.140 2.660 1.991 3.223 . 0 0 "[ . 1 . 2]" 1
389 1 25 ILE MD 1 40 ALA MB 3.720 . 3.720 2.174 1.905 2.879 . 0 0 "[ . 1 . 2]" 1
390 1 25 ILE MD 1 41 LEU H 5.760 . 5.760 5.302 4.864 5.795 0.035 9 0 "[ . 1 . 2]" 1
391 1 25 ILE MD 2 37 GLU HB3 4.270 . 4.270 2.378 1.775 3.746 . 0 0 "[ . 1 . 2]" 1
392 1 25 ILE MD 2 37 GLU QG 4.110 . 4.110 3.019 2.165 4.089 . 0 0 "[ . 1 . 2]" 1
393 1 25 ILE QG 1 28 LEU MD2 5.040 . 5.040 3.569 2.830 4.757 . 0 0 "[ . 1 . 2]" 1
394 1 25 ILE QG 1 40 ALA MB 3.980 . 3.980 3.584 2.529 3.858 . 0 0 "[ . 1 . 2]" 1
395 1 25 ILE HG12 1 40 ALA MB 4.750 . 4.750 3.901 3.367 4.106 . 0 0 "[ . 1 . 2]" 1
396 1 25 ILE HG13 1 40 ALA MB 4.750 . 4.750 4.424 2.555 4.834 0.084 19 0 "[ . 1 . 2]" 1
397 1 25 ILE MG 1 26 PRO HA 5.290 . 5.290 3.463 3.212 3.734 . 0 0 "[ . 1 . 2]" 1
398 1 25 ILE MG 1 26 PRO QB 5.920 . 5.920 4.278 3.894 4.736 . 0 0 "[ . 1 . 2]" 1
399 1 25 ILE MG 1 26 PRO QD 3.930 . 3.930 3.197 2.775 3.405 . 0 0 "[ . 1 . 2]" 1
400 1 25 ILE MG 1 26 PRO HG2 5.750 . 5.750 5.366 5.024 5.608 . 0 0 "[ . 1 . 2]" 1
401 1 25 ILE MG 1 27 GLU H 6.200 . 6.200 4.943 4.799 5.099 . 0 0 "[ . 1 . 2]" 1
402 1 25 ILE MG 1 29 ALA H 6.090 . 6.090 4.247 3.938 4.628 . 0 0 "[ . 1 . 2]" 1
403 1 25 ILE MG 1 29 ALA MB 4.170 . 4.170 3.225 3.001 3.474 . 0 0 "[ . 1 . 2]" 1
404 1 25 ILE MG 1 36 VAL HA 4.870 . 4.870 2.809 2.394 3.115 . 0 0 "[ . 1 . 2]" 1
405 1 25 ILE MG 1 36 VAL HB 4.450 . 4.450 4.417 4.242 4.552 0.102 16 0 "[ . 1 . 2]" 1
406 1 25 ILE MG 1 39 THR H 5.380 . 5.380 4.166 4.016 4.420 . 0 0 "[ . 1 . 2]" 1
407 1 25 ILE MG 1 39 THR HB 5.520 . 5.520 2.547 2.370 2.694 . 0 0 "[ . 1 . 2]" 1
408 1 25 ILE MG 1 40 ALA H 4.810 . 4.810 2.744 2.588 2.948 . 0 0 "[ . 1 . 2]" 1
409 1 25 ILE MG 1 40 ALA MB 3.920 . 3.920 1.819 1.594 2.144 . 0 0 "[ . 1 . 2]" 1
410 1 26 PRO HA 1 28 LEU MD2 5.970 . 5.970 5.902 4.630 6.220 0.250 8 0 "[ . 1 . 2]" 1
411 1 26 PRO HA 1 29 ALA MB 4.970 . 4.970 2.349 2.067 2.659 . 0 0 "[ . 1 . 2]" 1
412 1 26 PRO HA 1 36 VAL MG1 4.510 . 4.510 2.943 2.476 3.670 . 0 0 "[ . 1 . 2]" 1
413 1 26 PRO HA 1 36 VAL MG2 3.870 . 3.870 2.021 1.773 2.451 . 0 0 "[ . 1 . 2]" 1
414 1 26 PRO QB 1 36 VAL MG1 6.100 . 6.100 2.843 2.292 3.845 . 0 0 "[ . 1 . 2]" 1
415 1 26 PRO QB 1 36 VAL MG2 4.450 . 4.450 2.226 2.030 2.557 . 0 0 "[ . 1 . 2]" 1
416 1 26 PRO QD 1 36 VAL MG2 4.940 . 4.940 3.891 3.529 4.296 . 0 0 "[ . 1 . 2]" 1
417 1 26 PRO HG2 1 27 GLU H 4.730 . 4.730 2.749 2.367 4.068 . 0 0 "[ . 1 . 2]" 1
418 1 26 PRO HG2 1 28 LEU H 5.930 . 5.930 5.205 4.755 6.146 0.216 4 0 "[ . 1 . 2]" 1
419 1 26 PRO HG2 1 36 VAL MG2 5.870 . 5.870 4.629 4.111 4.927 . 0 0 "[ . 1 . 2]" 1
420 1 26 PRO HG3 1 36 VAL MG1 4.280 . 4.280 3.794 2.828 4.329 0.049 1 0 "[ . 1 . 2]" 1
421 1 26 PRO HG3 1 36 VAL MG2 4.300 . 4.300 4.038 2.821 4.318 0.018 16 0 "[ . 1 . 2]" 1
422 1 27 GLU H 1 27 GLU QG 4.750 . 4.750 3.024 2.179 4.098 . 0 0 "[ . 1 . 2]" 1
423 1 27 GLU H 1 28 LEU H 4.680 . 4.680 2.494 2.285 2.828 . 0 0 "[ . 1 . 2]" 1
424 1 27 GLU H 1 28 LEU MD2 6.300 . 6.300 5.180 3.448 5.634 . 0 0 "[ . 1 . 2]" 1
425 1 27 GLU H 1 28 LEU HG 6.300 . 6.300 6.175 4.733 6.526 0.226 3 0 "[ . 1 . 2]" 1
426 1 27 GLU H 1 29 ALA H 6.140 . 6.140 3.705 3.601 3.898 . 0 0 "[ . 1 . 2]" 1
427 1 27 GLU H 1 36 VAL MG2 6.230 . 6.230 5.096 4.921 5.446 . 0 0 "[ . 1 . 2]" 1
428 1 27 GLU HA 1 30 ARG QD 5.270 . 5.270 3.555 2.338 5.106 . 0 0 "[ . 1 . 2]" 1
429 1 27 GLU HA 1 30 ARG HE 6.050 . 6.050 4.138 2.084 5.954 . 0 0 "[ . 1 . 2]" 1
430 1 27 GLU QB 1 28 LEU H 4.600 . 4.600 2.340 2.129 2.642 . 0 0 "[ . 1 . 2]" 1
431 1 27 GLU QB 1 28 LEU MD2 5.070 . 5.070 4.995 3.419 5.391 0.321 20 0 "[ . 1 . 2]" 1
432 1 27 GLU HB2 1 28 LEU H 5.420 . 5.420 2.912 2.154 3.884 . 0 0 "[ . 1 . 2]" 1
433 1 27 GLU HB3 1 28 LEU H 5.420 . 5.420 3.030 2.269 3.702 . 0 0 "[ . 1 . 2]" 1
434 1 27 GLU QG 1 29 ALA H 6.300 . 6.300 5.468 5.280 5.814 . 0 0 "[ . 1 . 2]" 1
435 1 27 GLU QG 1 30 ARG H 6.210 . 6.210 5.643 4.945 6.141 . 0 0 "[ . 1 . 2]" 1
436 1 28 LEU H 1 28 LEU MD1 5.180 . 5.180 4.153 4.042 4.215 . 0 0 "[ . 1 . 2]" 1
437 1 28 LEU H 1 28 LEU MD2 5.210 . 5.210 3.687 1.849 4.140 . 0 0 "[ . 1 . 2]" 1
438 1 28 LEU H 1 28 LEU HG 4.700 . 4.700 4.111 2.777 4.446 . 0 0 "[ . 1 . 2]" 1
439 1 28 LEU H 1 29 ALA H 4.650 . 4.650 2.670 2.500 2.810 . 0 0 "[ . 1 . 2]" 1
440 1 28 LEU H 1 39 THR MG 5.670 . 5.670 4.546 4.327 4.805 . 0 0 "[ . 1 . 2]" 1
441 1 28 LEU HA 1 28 LEU MD1 3.910 . 3.910 2.685 2.171 4.095 0.185 7 0 "[ . 1 . 2]" 1
442 1 28 LEU HA 1 29 ALA HA 5.620 . 5.620 4.941 4.890 4.991 . 0 0 "[ . 1 . 2]" 1
443 1 28 LEU HA 1 31 LYS H 5.530 . 5.530 3.399 2.852 3.690 . 0 0 "[ . 1 . 2]" 1
444 1 28 LEU HA 1 31 LYS HA 6.160 . 6.160 5.401 4.963 5.931 . 0 0 "[ . 1 . 2]" 1
445 1 28 LEU HA 1 31 LYS QB 5.180 . 5.180 2.882 2.446 3.402 . 0 0 "[ . 1 . 2]" 1
446 1 28 LEU HA 1 31 LYS QD 5.240 . 5.240 3.164 1.914 4.835 . 0 0 "[ . 1 . 2]" 1
447 1 28 LEU QB 1 39 THR MG 4.430 . 4.430 3.097 2.482 4.158 . 0 0 "[ . 1 . 2]" 1
448 1 28 LEU HB2 1 29 ALA H 5.090 . 5.090 3.988 3.827 4.272 . 0 0 "[ . 1 . 2]" 1
449 1 28 LEU HB3 1 29 ALA H 5.090 . 5.090 2.976 2.489 4.206 . 0 0 "[ . 1 . 2]" 1
450 1 28 LEU MD1 1 29 ALA H 5.320 . 5.320 4.393 3.209 4.661 . 0 0 "[ . 1 . 2]" 1
451 1 28 LEU MD1 1 30 ARG H 6.300 . 6.300 5.688 4.962 6.399 0.099 7 0 "[ . 1 . 2]" 1
452 1 28 LEU MD2 1 29 ALA H 5.820 . 5.820 3.973 2.354 4.441 . 0 0 "[ . 1 . 2]" 1
453 1 28 LEU MD2 1 29 ALA HA 6.090 . 6.090 4.849 4.237 5.172 . 0 0 "[ . 1 . 2]" 1
454 1 28 LEU MD2 1 39 THR HA 5.790 . 5.790 5.122 4.856 5.794 0.004 7 0 "[ . 1 . 2]" 1
455 1 28 LEU MD2 1 39 THR HB 6.300 . 6.300 4.504 4.084 5.035 . 0 0 "[ . 1 . 2]" 1
456 1 28 LEU MD2 1 40 ALA H 6.000 . 6.000 5.653 5.014 6.069 0.069 6 0 "[ . 1 . 2]" 1
457 1 28 LEU HG 1 39 THR MG 4.090 . 4.090 2.339 1.977 2.961 . 0 0 "[ . 1 . 2]" 1
458 1 29 ALA H 1 30 ARG H 4.790 . 4.790 2.796 2.667 2.972 . 0 0 "[ . 1 . 2]" 1
459 1 29 ALA H 1 31 LYS H 6.300 . 6.300 4.206 4.049 4.396 . 0 0 "[ . 1 . 2]" 1
460 1 29 ALA H 1 32 VAL H 6.300 . 6.300 4.930 4.728 5.073 . 0 0 "[ . 1 . 2]" 1
461 1 29 ALA H 1 32 VAL MG2 6.300 . 6.300 4.011 3.844 4.153 . 0 0 "[ . 1 . 2]" 1
462 1 29 ALA H 1 36 VAL MG2 5.720 . 5.720 4.799 4.432 5.145 . 0 0 "[ . 1 . 2]" 1
463 1 29 ALA H 1 39 THR MG 4.860 . 4.860 3.116 2.801 3.435 . 0 0 "[ . 1 . 2]" 1
464 1 29 ALA HA 1 32 VAL H 5.310 . 5.310 3.634 3.419 3.825 . 0 0 "[ . 1 . 2]" 1
465 1 29 ALA HA 1 32 VAL MG1 4.900 . 4.900 4.139 3.934 4.425 . 0 0 "[ . 1 . 2]" 1
466 1 29 ALA HA 1 32 VAL MG2 4.010 . 4.010 2.083 1.984 2.280 . 0 0 "[ . 1 . 2]" 1
467 1 29 ALA HA 1 34 LEU H 5.130 . 5.130 3.494 3.147 3.703 . 0 0 "[ . 1 . 2]" 1
468 1 29 ALA HA 1 34 LEU MD1 6.130 . 6.130 4.492 4.237 4.947 . 0 0 "[ . 1 . 2]" 1
469 1 29 ALA HA 1 39 THR MG 5.320 . 5.320 2.862 2.560 3.338 . 0 0 "[ . 1 . 2]" 1
470 1 29 ALA MB 1 30 ARG H 4.240 . 4.240 2.610 2.490 2.820 . 0 0 "[ . 1 . 2]" 1
471 1 29 ALA MB 1 30 ARG QB 4.430 . 4.430 4.243 3.812 4.528 0.098 3 0 "[ . 1 . 2]" 1
472 1 29 ALA MB 1 30 ARG QG 5.240 . 5.240 3.832 3.042 5.359 0.119 18 0 "[ . 1 . 2]" 1
473 1 29 ALA MB 1 32 VAL H 6.300 . 6.300 4.779 4.595 4.964 . 0 0 "[ . 1 . 2]" 1
474 1 29 ALA MB 1 32 VAL MG2 4.460 . 4.460 3.452 3.342 3.567 . 0 0 "[ . 1 . 2]" 1
475 1 29 ALA MB 1 34 LEU H 5.540 . 5.540 3.881 3.488 4.135 . 0 0 "[ . 1 . 2]" 1
476 1 29 ALA MB 1 35 SER HA 5.400 . 5.400 3.511 2.826 4.030 . 0 0 "[ . 1 . 2]" 1
477 1 29 ALA MB 1 36 VAL H 5.590 . 5.590 3.463 3.247 3.951 . 0 0 "[ . 1 . 2]" 1
478 1 29 ALA MB 1 36 VAL HA 4.220 . 4.220 2.394 2.116 2.875 . 0 0 "[ . 1 . 2]" 1
479 1 29 ALA MB 1 36 VAL MG1 4.120 . 4.120 3.644 3.329 4.026 . 0 0 "[ . 1 . 2]" 1
480 1 29 ALA MB 1 36 VAL MG2 3.750 . 3.750 2.764 2.468 2.978 . 0 0 "[ . 1 . 2]" 1
481 1 29 ALA MB 1 39 THR H 5.650 . 5.650 4.062 3.821 4.308 . 0 0 "[ . 1 . 2]" 1
482 1 29 ALA MB 1 39 THR MG 4.160 . 4.160 2.837 2.514 3.201 . 0 0 "[ . 1 . 2]" 1
483 1 30 ARG H 1 30 ARG QB 3.870 . 3.870 2.412 2.248 2.580 . 0 0 "[ . 1 . 2]" 1
484 1 30 ARG H 1 30 ARG QD 6.220 . 6.220 3.800 2.380 4.848 . 0 0 "[ . 1 . 2]" 1
485 1 30 ARG H 1 30 ARG HG2 5.070 . 5.070 3.455 2.143 4.466 . 0 0 "[ . 1 . 2]" 1
486 1 30 ARG H 1 30 ARG QG 4.350 . 4.350 2.712 2.006 4.011 . 0 0 "[ . 1 . 2]" 1
487 1 30 ARG H 1 30 ARG HG3 5.070 . 5.070 3.130 2.027 4.553 . 0 0 "[ . 1 . 2]" 1
488 1 30 ARG H 1 31 LYS H 4.350 . 4.350 2.640 2.558 2.707 . 0 0 "[ . 1 . 2]" 1
489 1 30 ARG H 1 31 LYS QG 6.100 . 6.100 4.246 3.882 6.162 0.062 13 0 "[ . 1 . 2]" 1
490 1 30 ARG H 1 32 VAL H 6.070 . 6.070 4.241 4.108 4.467 . 0 0 "[ . 1 . 2]" 1
491 1 30 ARG H 1 32 VAL MG2 6.300 . 6.300 4.318 4.204 4.473 . 0 0 "[ . 1 . 2]" 1
492 1 30 ARG H 1 36 VAL MG2 6.300 . 6.300 5.225 4.863 5.799 . 0 0 "[ . 1 . 2]" 1
493 1 30 ARG H 1 39 THR MG 6.300 . 6.300 5.231 4.977 5.539 . 0 0 "[ . 1 . 2]" 1
494 1 30 ARG QB 1 30 ARG HE 4.970 . 4.970 3.120 1.984 4.122 . 0 0 "[ . 1 . 2]" 1
495 1 30 ARG QB 1 31 LYS H 4.740 . 4.740 2.820 2.534 3.610 . 0 0 "[ . 1 . 2]" 1
496 1 30 ARG HG2 1 31 LYS H 5.790 . 5.790 4.614 2.625 5.547 . 0 0 "[ . 1 . 2]" 1
497 1 30 ARG HG3 1 31 LYS H 5.790 . 5.790 4.468 2.814 5.285 . 0 0 "[ . 1 . 2]" 1
498 1 31 LYS H 1 31 LYS QD 4.920 . 4.920 3.975 3.200 4.713 . 0 0 "[ . 1 . 2]" 1
499 1 31 LYS H 1 31 LYS QE 5.500 . 5.500 4.604 3.866 5.222 . 0 0 "[ . 1 . 2]" 1
500 1 31 LYS H 1 31 LYS HG2 5.000 . 5.000 3.242 2.129 4.426 . 0 0 "[ . 1 . 2]" 1
501 1 31 LYS H 1 31 LYS QG 4.280 . 4.280 2.327 2.020 3.985 . 0 0 "[ . 1 . 2]" 1
502 1 31 LYS H 1 31 LYS HG3 5.000 . 5.000 2.590 2.041 4.524 . 0 0 "[ . 1 . 2]" 1
503 1 31 LYS H 1 32 VAL MG1 6.140 . 6.140 4.263 3.997 4.501 . 0 0 "[ . 1 . 2]" 1
504 1 31 LYS H 1 32 VAL MG2 5.660 . 5.660 3.922 3.709 4.152 . 0 0 "[ . 1 . 2]" 1
505 1 31 LYS HA 1 31 LYS QD 4.600 . 4.600 3.905 2.187 4.361 . 0 0 "[ . 1 . 2]" 1
506 1 31 LYS HA 1 31 LYS QE 5.090 . 5.090 4.195 2.760 5.238 0.148 16 0 "[ . 1 . 2]" 1
507 1 31 LYS HA 1 33 ASN H 5.150 . 5.150 4.073 3.806 4.309 . 0 0 "[ . 1 . 2]" 1
508 1 31 LYS QB 1 32 VAL H 4.690 . 4.690 2.572 2.261 2.814 . 0 0 "[ . 1 . 2]" 1
509 1 31 LYS QB 1 32 VAL MG1 4.290 . 4.290 2.735 2.374 3.253 . 0 0 "[ . 1 . 2]" 1
510 1 31 LYS QB 1 33 ASN H 5.670 . 5.670 4.444 4.220 4.602 . 0 0 "[ . 1 . 2]" 1
511 1 31 LYS QD 1 32 VAL H 6.300 . 6.300 4.977 4.355 5.566 . 0 0 "[ . 1 . 2]" 1
512 1 31 LYS QE 1 32 VAL MG1 5.240 . 5.240 4.425 3.546 5.366 0.126 16 0 "[ . 1 . 2]" 1
513 1 31 LYS HG2 1 32 VAL H 6.300 . 6.300 4.796 3.326 5.125 . 0 0 "[ . 1 . 2]" 1
514 1 31 LYS HG3 1 32 VAL H 6.300 . 6.300 4.384 3.993 5.043 . 0 0 "[ . 1 . 2]" 1
515 1 32 VAL H 1 32 VAL MG1 4.210 . 4.210 2.427 2.261 2.698 . 0 0 "[ . 1 . 2]" 1
516 1 32 VAL H 1 32 VAL MG2 3.730 . 3.730 2.095 1.953 2.237 . 0 0 "[ . 1 . 2]" 1
517 1 32 VAL H 1 34 LEU HG 6.300 . 6.300 5.171 4.739 5.412 . 0 0 "[ . 1 . 2]" 1
518 1 32 VAL HA 1 34 LEU MD1 6.300 . 6.300 5.088 4.804 5.404 . 0 0 "[ . 1 . 2]" 1
519 1 32 VAL HA 1 34 LEU MD2 6.300 . 6.300 5.525 5.194 5.871 . 0 0 "[ . 1 . 2]" 1
520 1 32 VAL HB 1 33 ASN H 6.300 . 6.300 4.340 4.237 4.487 . 0 0 "[ . 1 . 2]" 1
521 1 32 VAL HB 1 34 LEU MD1 5.690 . 5.690 3.155 2.790 3.482 . 0 0 "[ . 1 . 2]" 1
522 1 32 VAL HB 1 34 LEU HG 6.300 . 6.300 3.039 2.450 3.565 . 0 0 "[ . 1 . 2]" 1
523 1 32 VAL MG2 1 33 ASN H 5.060 . 5.060 3.024 2.795 3.297 . 0 0 "[ . 1 . 2]" 1
524 1 32 VAL MG2 1 33 ASN QB 6.100 . 6.100 4.428 4.326 4.540 . 0 0 "[ . 1 . 2]" 1
525 1 32 VAL MG2 1 34 LEU H 4.400 . 4.400 2.026 1.725 2.233 . 0 0 "[ . 1 . 2]" 1
526 1 32 VAL MG2 1 34 LEU HA 5.390 . 5.390 4.122 3.989 4.258 . 0 0 "[ . 1 . 2]" 1
527 1 32 VAL MG2 1 34 LEU QB 5.590 . 5.590 2.278 2.083 2.431 . 0 0 "[ . 1 . 2]" 1
528 1 32 VAL MG2 1 34 LEU MD1 3.640 . 3.640 2.343 2.220 2.539 . 0 0 "[ . 1 . 2]" 1
529 1 32 VAL MG2 1 34 LEU HG 4.250 . 4.250 2.213 1.961 2.417 . 0 0 "[ . 1 . 2]" 1
530 1 32 VAL MG2 1 39 THR HA 6.220 . 6.220 3.925 3.201 4.599 . 0 0 "[ . 1 . 2]" 1
531 1 33 ASN H 1 34 LEU H 4.340 . 4.340 2.720 2.610 2.825 . 0 0 "[ . 1 . 2]" 1
532 1 33 ASN HB2 1 34 LEU MD2 6.300 . 6.300 4.678 3.769 5.647 . 0 0 "[ . 1 . 2]" 1
533 1 33 ASN HB3 1 34 LEU MD2 6.300 . 6.300 4.375 3.837 4.874 . 0 0 "[ . 1 . 2]" 1
534 1 34 LEU H 1 34 LEU MD2 5.230 . 5.230 3.541 3.316 3.753 . 0 0 "[ . 1 . 2]" 1
535 1 34 LEU H 1 34 LEU HG 5.380 . 5.380 2.652 2.482 2.866 . 0 0 "[ . 1 . 2]" 1
536 1 34 LEU H 1 35 SER H 5.900 . 5.900 4.581 4.540 4.637 . 0 0 "[ . 1 . 2]" 1
537 1 34 LEU HA 1 34 LEU MD2 3.750 . 3.750 2.178 2.111 2.257 . 0 0 "[ . 1 . 2]" 1
538 1 34 LEU HA 1 38 SER QB 5.570 . 5.570 4.081 3.700 5.098 . 0 0 "[ . 1 . 2]" 1
539 1 34 LEU QB 1 38 SER H 6.100 . 6.100 4.469 4.234 4.613 . 0 0 "[ . 1 . 2]" 1
540 1 34 LEU QB 1 38 SER HA 5.400 . 5.400 4.835 4.647 5.106 . 0 0 "[ . 1 . 2]" 1
541 1 34 LEU QB 1 39 THR H 6.100 . 6.100 3.583 3.302 3.885 . 0 0 "[ . 1 . 2]" 1
542 1 34 LEU HB2 1 35 SER H 5.490 . 5.490 3.617 3.351 3.909 . 0 0 "[ . 1 . 2]" 1
543 1 34 LEU HB2 1 38 SER HA 6.130 . 6.130 6.147 5.846 6.275 0.145 16 0 "[ . 1 . 2]" 1
544 1 34 LEU HB3 1 35 SER H 5.490 . 5.490 2.542 2.256 2.914 . 0 0 "[ . 1 . 2]" 1
545 1 34 LEU HB3 1 38 SER HA 6.130 . 6.130 5.061 4.844 5.425 . 0 0 "[ . 1 . 2]" 1
546 1 34 LEU MD1 1 35 SER H 5.640 . 5.640 4.577 4.337 4.871 . 0 0 "[ . 1 . 2]" 1
547 1 34 LEU MD1 1 38 SER HA 5.080 . 5.080 4.900 4.253 5.117 0.037 15 0 "[ . 1 . 2]" 1
548 1 34 LEU MD1 1 38 SER QB 6.100 . 6.100 3.134 2.488 3.701 . 0 0 "[ . 1 . 2]" 1
549 1 34 LEU MD1 1 39 THR H 6.110 . 6.110 4.308 3.837 4.653 . 0 0 "[ . 1 . 2]" 1
550 1 34 LEU MD1 1 39 THR HA 5.210 . 5.210 3.131 2.635 3.567 . 0 0 "[ . 1 . 2]" 1
551 1 34 LEU MD1 1 39 THR MG 5.210 . 5.210 3.770 3.418 4.253 . 0 0 "[ . 1 . 2]" 1
552 1 34 LEU MD1 1 42 ALA H 6.300 . 6.300 5.162 4.636 5.685 . 0 0 "[ . 1 . 2]" 1
553 1 34 LEU MD1 1 42 ALA MB 5.280 . 5.280 3.348 2.857 3.738 . 0 0 "[ . 1 . 2]" 1
554 1 34 LEU MD2 1 35 SER H 4.600 . 4.600 3.671 3.490 3.873 . 0 0 "[ . 1 . 2]" 1
555 1 34 LEU MD2 1 38 SER HB2 5.420 . 5.420 4.099 3.419 4.926 . 0 0 "[ . 1 . 2]" 1
556 1 34 LEU MD2 1 38 SER QB 4.560 . 4.560 3.455 2.843 4.065 . 0 0 "[ . 1 . 2]" 1
557 1 34 LEU MD2 1 38 SER HB3 5.420 . 5.420 3.771 3.040 4.971 . 0 0 "[ . 1 . 2]" 1
558 1 35 SER H 1 36 VAL H 6.290 . 6.290 4.670 4.594 4.710 . 0 0 "[ . 1 . 2]" 1
559 1 35 SER H 1 38 SER HA 5.710 . 5.710 5.579 5.290 5.798 0.088 20 0 "[ . 1 . 2]" 1
560 1 35 SER H 1 38 SER QB 5.330 . 5.330 2.707 2.368 3.659 . 0 0 "[ . 1 . 2]" 1
561 1 35 SER HA 1 36 VAL HB 5.800 . 5.800 4.969 4.866 5.072 . 0 0 "[ . 1 . 2]" 1
562 1 35 SER HA 1 36 VAL MG2 4.890 . 4.890 3.673 3.546 3.846 . 0 0 "[ . 1 . 2]" 1
563 1 35 SER HA 1 37 GLU H 5.380 . 5.380 4.511 4.205 4.859 . 0 0 "[ . 1 . 2]" 1
564 1 35 SER HA 1 38 SER H 5.970 . 5.970 4.643 4.389 5.024 . 0 0 "[ . 1 . 2]" 1
565 1 35 SER QB 1 36 VAL H 5.220 . 5.220 3.085 2.503 3.588 . 0 0 "[ . 1 . 2]" 1
566 1 35 SER QB 1 37 GLU H 5.800 . 5.800 3.364 2.709 3.799 . 0 0 "[ . 1 . 2]" 1
567 1 36 VAL H 1 36 VAL HB 4.390 . 4.390 2.631 2.538 2.707 . 0 0 "[ . 1 . 2]" 1
568 1 36 VAL H 1 36 VAL MG1 4.640 . 4.640 3.825 3.811 3.842 . 0 0 "[ . 1 . 2]" 1
569 1 36 VAL H 1 36 VAL MG2 3.890 . 3.890 1.958 1.852 2.060 . 0 0 "[ . 1 . 2]" 1
570 1 36 VAL H 1 37 GLU H 4.830 . 4.830 2.863 2.753 3.081 . 0 0 "[ . 1 . 2]" 1
571 1 36 VAL H 1 37 GLU HB2 6.170 . 6.170 5.012 4.861 5.309 . 0 0 "[ . 1 . 2]" 1
572 1 36 VAL H 1 39 THR H 6.300 . 6.300 4.837 4.772 4.907 . 0 0 "[ . 1 . 2]" 1
573 1 36 VAL HA 1 37 GLU HA 5.500 . 5.500 4.896 4.776 4.941 . 0 0 "[ . 1 . 2]" 1
574 1 36 VAL HA 1 38 SER H 6.300 . 6.300 4.601 4.445 4.881 . 0 0 "[ . 1 . 2]" 1
575 1 36 VAL HA 1 39 THR H 5.550 . 5.550 3.683 3.529 3.878 . 0 0 "[ . 1 . 2]" 1
576 1 36 VAL HA 1 39 THR HB 5.610 . 5.610 2.879 2.648 3.087 . 0 0 "[ . 1 . 2]" 1
577 1 36 VAL HA 1 40 ALA H 6.270 . 6.270 4.101 3.955 4.328 . 0 0 "[ . 1 . 2]" 1
578 1 36 VAL HB 1 37 GLU H 4.440 . 4.440 2.468 2.299 2.606 . 0 0 "[ . 1 . 2]" 1
579 1 36 VAL MG1 1 37 GLU H 4.510 . 4.510 3.395 2.979 3.552 . 0 0 "[ . 1 . 2]" 1
580 1 36 VAL MG1 1 37 GLU HA 4.500 . 4.500 3.612 3.243 3.754 . 0 0 "[ . 1 . 2]" 1
581 1 36 VAL MG1 1 37 GLU HG2 4.330 . 4.330 4.372 4.010 4.640 0.310 18 0 "[ . 1 . 2]" 1
582 1 36 VAL MG1 1 37 GLU HG3 4.330 . 4.330 4.038 3.217 4.309 . 0 0 "[ . 1 . 2]" 1
583 1 36 VAL MG1 1 38 SER H 5.650 . 5.650 5.198 4.969 5.355 . 0 0 "[ . 1 . 2]" 1
584 1 36 VAL MG1 1 39 THR H 6.300 . 6.300 4.885 4.729 5.031 . 0 0 "[ . 1 . 2]" 1
585 1 36 VAL MG1 1 39 THR HB 4.840 . 4.840 4.111 3.817 4.372 . 0 0 "[ . 1 . 2]" 1
586 1 36 VAL MG2 1 37 GLU H 4.730 . 4.730 3.760 3.644 3.909 . 0 0 "[ . 1 . 2]" 1
587 1 36 VAL MG2 1 40 ALA MB 5.890 . 5.890 5.381 5.178 5.619 . 0 0 "[ . 1 . 2]" 1
588 1 37 GLU H 1 37 GLU HG2 5.040 . 5.040 3.355 3.131 3.952 . 0 0 "[ . 1 . 2]" 1
589 1 37 GLU H 1 37 GLU QG 4.320 . 4.320 2.150 1.929 3.059 . 0 0 "[ . 1 . 2]" 1
590 1 37 GLU H 1 37 GLU HG3 5.040 . 5.040 2.179 1.947 3.185 . 0 0 "[ . 1 . 2]" 1
591 1 37 GLU H 1 38 SER H 4.970 . 4.970 2.801 2.702 2.868 . 0 0 "[ . 1 . 2]" 1
592 1 37 GLU H 1 40 ALA MB 6.300 . 6.300 4.773 4.421 4.958 . 0 0 "[ . 1 . 2]" 1
593 1 37 GLU HA 1 40 ALA H 5.160 . 5.160 3.698 3.188 3.980 . 0 0 "[ . 1 . 2]" 1
594 1 37 GLU HA 1 40 ALA MB 4.300 . 4.300 2.848 2.243 3.144 . 0 0 "[ . 1 . 2]" 1
595 1 37 GLU HA 1 41 LEU H 6.300 . 6.300 4.086 3.632 4.231 . 0 0 "[ . 1 . 2]" 1
596 1 37 GLU HB2 1 38 SER H 5.240 . 5.240 2.608 2.361 3.014 . 0 0 "[ . 1 . 2]" 1
597 1 37 GLU HB2 1 39 THR H 6.300 . 6.300 5.015 4.815 5.367 . 0 0 "[ . 1 . 2]" 1
598 1 37 GLU HB2 2 61 ILE MD 5.530 . 5.530 3.003 1.997 3.778 . 0 0 "[ . 1 . 2]" 1
599 1 37 GLU HB3 1 38 SER H 5.170 . 5.170 3.672 3.418 3.902 . 0 0 "[ . 1 . 2]" 1
600 1 37 GLU HB3 1 40 ALA MB 5.280 . 5.280 4.716 4.048 5.112 . 0 0 "[ . 1 . 2]" 1
601 1 37 GLU HB3 2 25 ILE MD 4.270 . 4.270 2.312 1.738 4.217 . 0 0 "[ . 1 . 2]" 1
602 1 37 GLU HB3 2 61 ILE MD 4.280 . 4.280 3.268 2.063 4.134 . 0 0 "[ . 1 . 2]" 1
603 1 37 GLU QG 1 40 ALA MB 4.630 . 4.630 4.481 3.701 4.760 0.130 2 0 "[ . 1 . 2]" 1
604 1 37 GLU QG 2 25 ILE MD 4.030 . 4.030 2.921 2.553 4.034 0.004 1 0 "[ . 1 . 2]" 1
605 1 37 GLU HG2 1 38 SER H 5.720 . 5.720 5.027 4.865 5.461 . 0 0 "[ . 1 . 2]" 1
606 1 37 GLU HG2 2 61 ILE MD 5.650 . 5.650 5.091 4.225 5.763 0.113 11 0 "[ . 1 . 2]" 1
607 1 37 GLU HG3 1 38 SER H 5.720 . 5.720 4.320 4.067 5.078 . 0 0 "[ . 1 . 2]" 1
608 1 37 GLU HG3 2 61 ILE MD 5.650 . 5.650 4.982 3.925 5.704 0.054 2 0 "[ . 1 . 2]" 1
609 1 38 SER H 1 39 THR H 4.670 . 4.670 2.657 2.507 2.775 . 0 0 "[ . 1 . 2]" 1
610 1 38 SER H 1 39 THR HA 6.300 . 6.300 5.319 5.183 5.419 . 0 0 "[ . 1 . 2]" 1
611 1 38 SER H 1 40 ALA MB 6.300 . 6.300 5.010 4.750 5.257 . 0 0 "[ . 1 . 2]" 1
612 1 38 SER H 2 61 ILE MD 5.870 . 5.870 3.629 2.617 4.887 . 0 0 "[ . 1 . 2]" 1
613 1 38 SER HA 1 40 ALA MB 5.880 . 5.880 5.321 5.130 5.579 . 0 0 "[ . 1 . 2]" 1
614 1 38 SER HA 1 41 LEU H 6.300 . 6.300 3.956 3.675 4.289 . 0 0 "[ . 1 . 2]" 1
615 1 38 SER HA 1 41 LEU MD1 5.270 . 5.270 3.261 2.756 3.818 . 0 0 "[ . 1 . 2]" 1
616 1 38 SER QB 2 61 ILE MD 5.370 . 5.370 3.506 1.992 4.836 . 0 0 "[ . 1 . 2]" 1
617 1 39 THR H 1 40 ALA H 4.630 . 4.630 2.642 2.513 2.749 . 0 0 "[ . 1 . 2]" 1
618 1 39 THR H 1 40 ALA MB 6.300 . 6.300 4.287 4.178 4.408 . 0 0 "[ . 1 . 2]" 1
619 1 39 THR HA 1 42 ALA H 5.860 . 5.860 3.507 3.233 3.858 . 0 0 "[ . 1 . 2]" 1
620 1 39 THR HA 1 42 ALA MB 4.780 . 4.780 2.597 2.308 2.990 . 0 0 "[ . 1 . 2]" 1
621 1 39 THR HA 1 43 VAL H 6.300 . 6.300 4.233 3.954 4.568 . 0 0 "[ . 1 . 2]" 1
622 1 39 THR HB 1 40 ALA H 4.610 . 4.610 2.580 2.405 2.796 . 0 0 "[ . 1 . 2]" 1
623 1 39 THR HB 1 40 ALA MB 5.230 . 5.230 4.008 3.858 4.146 . 0 0 "[ . 1 . 2]" 1
624 1 39 THR MG 1 40 ALA H 5.060 . 5.060 3.398 3.205 3.658 . 0 0 "[ . 1 . 2]" 1
625 1 39 THR MG 1 43 VAL H 5.840 . 5.840 4.176 3.991 4.524 . 0 0 "[ . 1 . 2]" 1
626 1 40 ALA H 1 41 LEU H 4.670 . 4.670 2.708 2.588 2.787 . 0 0 "[ . 1 . 2]" 1
627 1 40 ALA HA 1 43 VAL H 5.510 . 5.510 3.488 3.308 3.770 . 0 0 "[ . 1 . 2]" 1
628 1 40 ALA HA 1 43 VAL HB 5.310 . 5.310 2.704 2.413 3.119 . 0 0 "[ . 1 . 2]" 1
629 1 40 ALA HA 1 43 VAL MG2 4.210 . 4.210 2.859 2.306 3.321 . 0 0 "[ . 1 . 2]" 1
630 1 40 ALA MB 1 41 LEU H 4.280 . 4.280 2.536 2.265 2.724 . 0 0 "[ . 1 . 2]" 1
631 1 40 ALA MB 1 41 LEU HA 5.590 . 5.590 3.968 3.845 4.077 . 0 0 "[ . 1 . 2]" 1
632 1 40 ALA MB 1 41 LEU QB 5.580 . 5.580 3.733 3.448 3.948 . 0 0 "[ . 1 . 2]" 1
633 1 40 ALA MB 1 42 ALA H 5.750 . 5.750 4.592 4.339 4.789 . 0 0 "[ . 1 . 2]" 1
634 1 40 ALA MB 1 43 VAL H 6.140 . 6.140 4.637 4.519 4.815 . 0 0 "[ . 1 . 2]" 1
635 1 41 LEU H 1 41 LEU MD1 4.630 . 4.630 4.070 3.930 4.338 . 0 0 "[ . 1 . 2]" 1
636 1 41 LEU H 1 41 LEU MD2 4.760 . 4.760 4.272 4.218 4.340 . 0 0 "[ . 1 . 2]" 1
637 1 41 LEU H 1 41 LEU HG 4.850 . 4.850 4.423 4.057 4.612 . 0 0 "[ . 1 . 2]" 1
638 1 41 LEU H 1 42 ALA H 4.730 . 4.730 2.686 2.559 2.806 . 0 0 "[ . 1 . 2]" 1
639 1 41 LEU H 1 42 ALA MB 5.710 . 5.710 4.349 4.230 4.447 . 0 0 "[ . 1 . 2]" 1
640 1 41 LEU H 1 43 VAL H 6.280 . 6.280 4.073 3.867 4.277 . 0 0 "[ . 1 . 2]" 1
641 1 41 LEU H 1 43 VAL MG2 5.700 . 5.700 4.927 4.499 5.234 . 0 0 "[ . 1 . 2]" 1
642 1 41 LEU H 1 44 GLY H 6.300 . 6.300 4.753 4.473 4.936 . 0 0 "[ . 1 . 2]" 1
643 1 41 LEU HA 1 41 LEU MD1 4.260 . 4.260 3.706 3.537 3.949 . 0 0 "[ . 1 . 2]" 1
644 1 41 LEU HA 1 41 LEU MD2 3.840 . 3.840 2.371 2.104 2.506 . 0 0 "[ . 1 . 2]" 1
645 1 41 LEU HA 1 43 VAL H 6.300 . 6.300 4.417 4.270 4.590 . 0 0 "[ . 1 . 2]" 1
646 1 41 LEU HA 1 44 GLY H 4.960 . 4.960 3.451 3.013 3.698 . 0 0 "[ . 1 . 2]" 1
647 1 41 LEU HA 1 44 GLY HA2 5.750 . 5.750 5.363 4.659 5.717 . 0 0 "[ . 1 . 2]" 1
648 1 41 LEU HA 1 44 GLY QA 5.010 . 5.010 3.760 3.089 4.064 . 0 0 "[ . 1 . 2]" 1
649 1 41 LEU HA 1 44 GLY HA3 5.750 . 5.750 3.841 3.135 4.159 . 0 0 "[ . 1 . 2]" 1
650 1 41 LEU QB 1 42 ALA H 4.530 . 4.530 2.595 2.210 2.933 . 0 0 "[ . 1 . 2]" 1
651 1 41 LEU MD1 1 42 ALA H 5.110 . 5.110 3.495 2.824 4.278 . 0 0 "[ . 1 . 2]" 1
652 1 41 LEU MD1 1 42 ALA MB 4.880 . 4.880 3.804 3.083 4.770 . 0 0 "[ . 1 . 2]" 1
653 1 41 LEU MD1 1 43 VAL H 5.880 . 5.880 5.457 4.796 6.277 0.397 14 0 "[ . 1 . 2]" 1
654 1 41 LEU MD2 1 42 ALA H 5.490 . 5.490 4.093 3.631 4.373 . 0 0 "[ . 1 . 2]" 1
655 1 41 LEU MD2 1 44 GLY H 4.600 . 4.600 4.397 4.044 4.677 0.077 12 0 "[ . 1 . 2]" 1
656 1 41 LEU MD2 1 44 GLY QA 5.000 . 5.000 3.954 3.364 4.322 . 0 0 "[ . 1 . 2]" 1
657 1 41 LEU MD2 2 44 GLY HA2 5.710 . 5.710 2.547 2.053 3.287 . 0 0 "[ . 1 . 2]" 1
658 1 41 LEU MD2 2 44 GLY HA3 5.860 . 5.860 3.205 2.657 4.225 . 0 0 "[ . 1 . 2]" 1
659 1 41 LEU MD2 2 47 ALA MB 4.400 . 4.400 2.879 2.359 3.515 . 0 0 "[ . 1 . 2]" 1
660 1 41 LEU HG 1 42 ALA H 5.820 . 5.820 5.007 4.778 5.245 . 0 0 "[ . 1 . 2]" 1
661 1 42 ALA H 1 43 VAL H 4.500 . 4.500 2.677 2.622 2.723 . 0 0 "[ . 1 . 2]" 1
662 1 42 ALA H 1 43 VAL HA 6.300 . 6.300 5.334 5.285 5.368 . 0 0 "[ . 1 . 2]" 1
663 1 42 ALA H 1 43 VAL MG2 5.440 . 5.440 4.224 4.049 4.386 . 0 0 "[ . 1 . 2]" 1
664 1 42 ALA HA 1 45 TRP H 4.890 . 4.890 3.278 3.097 3.496 . 0 0 "[ . 1 . 2]" 1
665 1 42 ALA MB 1 43 VAL H 4.180 . 4.180 2.694 2.491 2.802 . 0 0 "[ . 1 . 2]" 1
666 1 42 ALA MB 1 43 VAL HA 5.540 . 5.540 4.058 3.983 4.125 . 0 0 "[ . 1 . 2]" 1
667 1 42 ALA MB 1 44 GLY H 6.300 . 6.300 4.609 4.412 4.741 . 0 0 "[ . 1 . 2]" 1
668 1 43 VAL H 1 43 VAL MG2 3.830 . 3.830 2.255 2.135 2.440 . 0 0 "[ . 1 . 2]" 1
669 1 43 VAL HA 1 46 LEU H 5.630 . 5.630 3.239 3.041 3.435 . 0 0 "[ . 1 . 2]" 1
670 1 43 VAL HA 1 46 LEU MD1 4.730 . 4.730 2.338 1.933 2.785 . 0 0 "[ . 1 . 2]" 1
671 1 43 VAL HA 1 46 LEU HG 5.630 . 5.630 3.156 2.722 3.533 . 0 0 "[ . 1 . 2]" 1
672 1 43 VAL HA 1 47 ALA H 6.020 . 6.020 4.185 4.032 4.308 . 0 0 "[ . 1 . 2]" 1
673 1 43 VAL HA 1 52 VAL MG2 5.390 . 5.390 3.507 3.060 4.012 . 0 0 "[ . 1 . 2]" 1
674 1 43 VAL HB 1 44 GLY H 5.130 . 5.130 2.771 2.576 2.936 . 0 0 "[ . 1 . 2]" 1
675 1 43 VAL MG1 1 45 TRP H 6.300 . 6.300 5.006 4.882 5.205 . 0 0 "[ . 1 . 2]" 1
676 1 43 VAL MG1 1 47 ALA H 5.730 . 5.730 3.982 3.775 4.258 . 0 0 "[ . 1 . 2]" 1
677 1 43 VAL MG2 1 44 GLY H 5.250 . 5.250 4.000 3.904 4.098 . 0 0 "[ . 1 . 2]" 1
678 1 44 GLY H 1 45 TRP H 4.910 . 4.910 2.718 2.646 2.798 . 0 0 "[ . 1 . 2]" 1
679 1 44 GLY H 1 46 LEU H 6.300 . 6.300 4.170 4.034 4.308 . 0 0 "[ . 1 . 2]" 1
680 1 44 GLY H 1 47 ALA MB 6.130 . 6.130 4.541 4.366 4.723 . 0 0 "[ . 1 . 2]" 1
681 1 44 GLY QA 1 47 ALA H 5.780 . 5.780 3.239 3.136 3.445 . 0 0 "[ . 1 . 2]" 1
682 1 44 GLY QA 1 47 ALA MB 4.440 . 4.440 2.367 2.201 2.566 . 0 0 "[ . 1 . 2]" 1
683 1 44 GLY QA 1 54 ILE MD 5.590 . 5.590 4.423 3.483 5.336 . 0 0 "[ . 1 . 2]" 1
684 1 44 GLY QA 2 41 LEU MD2 5.160 . 5.160 2.506 2.010 3.512 . 0 0 "[ . 1 . 2]" 1
685 1 44 GLY HA2 1 47 ALA MB 5.310 . 5.310 2.393 2.219 2.601 . 0 0 "[ . 1 . 2]" 1
686 1 44 GLY HA2 2 41 LEU MD2 5.860 . 5.860 2.609 2.050 3.665 . 0 0 "[ . 1 . 2]" 1
687 1 44 GLY HA3 1 47 ALA MB 5.310 . 5.310 3.758 3.622 3.928 . 0 0 "[ . 1 . 2]" 1
688 1 44 GLY HA3 2 41 LEU MD2 5.860 . 5.860 3.261 2.472 4.503 . 0 0 "[ . 1 . 2]" 1
689 1 45 TRP H 1 46 LEU H 4.980 . 4.980 2.597 2.536 2.686 . 0 0 "[ . 1 . 2]" 1
690 1 45 TRP H 1 47 ALA H 6.290 . 6.290 3.998 3.926 4.139 . 0 0 "[ . 1 . 2]" 1
691 1 45 TRP H 1 47 ALA MB 5.990 . 5.990 4.577 4.457 4.726 . 0 0 "[ . 1 . 2]" 1
692 1 45 TRP HA 1 48 ARG H 5.450 . 5.450 3.446 3.130 3.937 . 0 0 "[ . 1 . 2]" 1
693 1 45 TRP HA 1 48 ARG QB 4.910 . 4.910 2.985 2.028 3.982 . 0 0 "[ . 1 . 2]" 1
694 1 45 TRP QB 1 47 ALA H 6.100 . 6.100 4.835 4.665 4.984 . 0 0 "[ . 1 . 2]" 1
695 1 45 TRP HB2 1 46 LEU H 5.860 . 5.860 3.981 3.885 4.125 . 0 0 "[ . 1 . 2]" 1
696 1 45 TRP HB3 1 46 LEU H 5.860 . 5.860 2.782 2.569 2.970 . 0 0 "[ . 1 . 2]" 1
697 1 45 TRP HD1 1 46 LEU H 6.130 . 6.130 4.212 3.850 4.599 . 0 0 "[ . 1 . 2]" 1
698 1 45 TRP HD1 1 46 LEU HA 5.160 . 5.160 4.204 3.707 4.740 . 0 0 "[ . 1 . 2]" 1
699 1 45 TRP HD1 1 46 LEU MD2 4.740 . 4.740 3.347 2.813 3.871 . 0 0 "[ . 1 . 2]" 1
700 1 45 TRP HD1 1 46 LEU HG 5.630 . 5.630 4.099 3.516 4.554 . 0 0 "[ . 1 . 2]" 1
701 1 45 TRP HE1 1 48 ARG QD 6.100 . 6.100 4.869 3.595 6.138 0.038 3 0 "[ . 1 . 2]" 1
702 1 45 TRP HE1 1 48 ARG HE 6.300 . 6.300 4.963 3.354 6.314 0.014 15 0 "[ . 1 . 2]" 1
703 1 45 TRP HE3 1 48 ARG H 5.780 . 5.780 5.846 5.609 5.978 0.198 13 0 "[ . 1 . 2]" 1
704 1 45 TRP HE3 2 47 ALA MB 4.440 . 4.440 2.802 1.873 3.716 . 0 0 "[ . 1 . 2]" 1
705 1 45 TRP HZ3 2 47 ALA MB 4.700 . 4.700 3.236 2.294 4.718 0.018 1 0 "[ . 1 . 2]" 1
706 1 46 LEU H 1 46 LEU MD1 5.250 . 5.250 3.673 3.523 3.815 . 0 0 "[ . 1 . 2]" 1
707 1 46 LEU H 1 46 LEU MD2 5.030 . 5.030 3.451 3.267 3.607 . 0 0 "[ . 1 . 2]" 1
708 1 46 LEU H 1 46 LEU HG 4.780 . 4.780 2.420 2.234 2.563 . 0 0 "[ . 1 . 2]" 1
709 1 46 LEU H 1 47 ALA H 4.880 . 4.880 2.629 2.540 2.758 . 0 0 "[ . 1 . 2]" 1
710 1 46 LEU H 1 52 VAL MG1 5.710 . 5.710 4.731 4.373 5.087 . 0 0 "[ . 1 . 2]" 1
711 1 46 LEU H 1 52 VAL MG2 5.690 . 5.690 4.129 3.903 4.391 . 0 0 "[ . 1 . 2]" 1
712 1 46 LEU HA 1 46 LEU MD2 4.020 . 4.020 2.036 1.952 2.128 . 0 0 "[ . 1 . 2]" 1
713 1 46 LEU HA 1 49 GLU H 5.700 . 5.700 3.480 2.978 4.192 . 0 0 "[ . 1 . 2]" 1
714 1 46 LEU HA 1 51 LYS H 6.300 . 6.300 3.995 3.532 4.547 . 0 0 "[ . 1 . 2]" 1
715 1 46 LEU HA 1 51 LYS QB 5.020 . 5.020 3.121 2.515 4.192 . 0 0 "[ . 1 . 2]" 1
716 1 46 LEU HA 1 51 LYS QD 6.100 . 6.100 4.039 2.482 5.688 . 0 0 "[ . 1 . 2]" 1
717 1 46 LEU HA 1 51 LYS QE 6.090 . 6.090 4.947 2.693 6.122 0.032 16 0 "[ . 1 . 2]" 1
718 1 46 LEU HA 1 51 LYS QG 6.100 . 6.100 3.846 2.604 5.422 . 0 0 "[ . 1 . 2]" 1
719 1 46 LEU QB 1 51 LYS H 6.100 . 6.100 3.689 3.360 4.125 . 0 0 "[ . 1 . 2]" 1
720 1 46 LEU QB 1 52 VAL MG1 5.580 . 5.580 2.080 1.913 2.239 . 0 0 "[ . 1 . 2]" 1
721 1 46 LEU QB 1 52 VAL MG2 6.010 . 6.010 2.275 2.009 2.566 . 0 0 "[ . 1 . 2]" 1
722 1 46 LEU HB2 1 47 ALA H 5.600 . 5.600 2.722 2.554 2.880 . 0 0 "[ . 1 . 2]" 1
723 1 46 LEU HB3 1 47 ALA H 5.600 . 5.600 3.684 3.498 3.811 . 0 0 "[ . 1 . 2]" 1
724 1 46 LEU MD2 1 47 ALA H 6.300 . 6.300 4.740 4.685 4.809 . 0 0 "[ . 1 . 2]" 1
725 1 46 LEU MD2 1 51 LYS H 6.300 . 6.300 4.539 4.045 5.083 . 0 0 "[ . 1 . 2]" 1
726 1 46 LEU MD2 1 51 LYS HA 6.300 . 6.300 5.133 4.704 6.161 . 0 0 "[ . 1 . 2]" 1
727 1 46 LEU MD2 1 51 LYS QB 3.820 . 3.820 2.560 2.206 3.496 . 0 0 "[ . 1 . 2]" 1
728 1 46 LEU MD2 1 51 LYS QD 4.690 . 4.690 3.070 1.962 4.708 0.018 16 0 "[ . 1 . 2]" 1
729 1 46 LEU MD2 1 51 LYS QE 5.080 . 5.080 3.245 1.856 4.596 . 0 0 "[ . 1 . 2]" 1
730 1 47 ALA H 1 48 ARG H 4.790 . 4.790 2.813 2.646 2.922 . 0 0 "[ . 1 . 2]" 1
731 1 47 ALA H 1 49 GLU H 6.150 . 6.150 4.345 4.121 4.877 . 0 0 "[ . 1 . 2]" 1
732 1 47 ALA H 1 52 VAL MG1 6.300 . 6.300 4.433 4.079 4.761 . 0 0 "[ . 1 . 2]" 1
733 1 47 ALA H 1 52 VAL MG2 4.750 . 4.750 2.801 2.571 3.118 . 0 0 "[ . 1 . 2]" 1
734 1 47 ALA H 1 54 ILE MD 6.030 . 6.030 4.715 3.874 5.709 . 0 0 "[ . 1 . 2]" 1
735 1 47 ALA HA 1 49 GLU H 5.740 . 5.740 4.256 3.776 4.502 . 0 0 "[ . 1 . 2]" 1
736 1 47 ALA HA 1 50 ASN H 5.210 . 5.210 3.290 2.890 3.771 . 0 0 "[ . 1 . 2]" 1
737 1 47 ALA HA 1 51 LYS H 6.020 . 6.020 3.795 3.211 4.276 . 0 0 "[ . 1 . 2]" 1
738 1 47 ALA HA 1 52 VAL H 4.890 . 4.890 3.333 2.857 3.944 . 0 0 "[ . 1 . 2]" 1
739 1 47 ALA HA 1 52 VAL MG2 3.940 . 3.940 2.537 2.168 2.878 . 0 0 "[ . 1 . 2]" 1
740 1 47 ALA HA 1 54 ILE MD 5.610 . 5.610 4.440 3.713 5.585 . 0 0 "[ . 1 . 2]" 1
741 1 47 ALA MB 1 48 ARG H 4.390 . 4.390 2.760 2.560 2.991 . 0 0 "[ . 1 . 2]" 1
742 1 47 ALA MB 1 48 ARG HA 6.220 . 6.220 4.059 3.896 4.172 . 0 0 "[ . 1 . 2]" 1
743 1 47 ALA MB 1 49 GLU H 5.300 . 5.300 4.647 4.403 4.838 . 0 0 "[ . 1 . 2]" 1
744 1 47 ALA MB 1 50 ASN H 6.300 . 6.300 4.403 4.169 4.741 . 0 0 "[ . 1 . 2]" 1
745 1 47 ALA MB 1 52 VAL MG2 3.800 . 3.800 2.615 2.312 3.011 . 0 0 "[ . 1 . 2]" 1
746 1 47 ALA MB 2 6 VAL MG1 4.910 . 4.910 3.918 2.688 4.808 . 0 0 "[ . 1 . 2]" 1
747 1 47 ALA MB 2 41 LEU MD2 4.400 . 4.400 2.942 2.389 3.500 . 0 0 "[ . 1 . 2]" 1
748 1 47 ALA MB 2 45 TRP HE3 4.440 . 4.440 2.904 2.186 4.061 . 0 0 "[ . 1 . 2]" 1
749 1 47 ALA MB 2 45 TRP HZ3 4.700 . 4.700 3.149 2.088 4.721 0.021 8 0 "[ . 1 . 2]" 1
750 1 48 ARG H 1 49 GLU H 4.740 . 4.740 2.760 2.495 2.863 . 0 0 "[ . 1 . 2]" 1
751 1 48 ARG H 1 49 GLU HG2 6.300 . 6.300 5.552 3.957 6.401 0.101 15 0 "[ . 1 . 2]" 1
752 1 48 ARG H 1 49 GLU HG3 6.300 . 6.300 5.033 4.348 6.494 0.194 3 0 "[ . 1 . 2]" 1
753 1 48 ARG H 1 52 VAL MG2 5.760 . 5.760 4.778 4.587 4.980 . 0 0 "[ . 1 . 2]" 1
754 1 48 ARG HA 1 48 ARG QD 5.090 . 5.090 4.208 3.756 4.611 . 0 0 "[ . 1 . 2]" 1
755 1 48 ARG HA 2 48 ARG HD2 6.300 . 6.300 3.111 1.743 4.939 . 0 0 "[ . 1 . 2]" 1
756 1 48 ARG HA 2 48 ARG QD 5.520 . 5.520 2.841 1.738 4.265 . 0 0 "[ . 1 . 2]" 1
757 1 48 ARG HA 2 48 ARG HD3 6.300 . 6.300 3.816 2.754 4.932 . 0 0 "[ . 1 . 2]" 1
758 1 48 ARG QD 1 49 GLU QG 5.490 . 5.490 3.529 2.065 5.542 0.052 3 0 "[ . 1 . 2]" 1
759 1 48 ARG QD 2 48 ARG HA 5.520 . 5.520 2.641 1.818 4.229 . 0 0 "[ . 1 . 2]" 1
760 1 48 ARG HD2 2 48 ARG HA 6.300 . 6.300 3.088 1.823 4.934 . 0 0 "[ . 1 . 2]" 1
761 1 48 ARG HD3 2 48 ARG HA 6.300 . 6.300 3.459 2.231 5.037 . 0 0 "[ . 1 . 2]" 1
762 1 48 ARG HE 1 49 GLU HG2 5.720 . 5.720 4.173 2.779 4.791 . 0 0 "[ . 1 . 2]" 1
763 1 48 ARG HE 1 49 GLU QG 4.990 . 4.990 3.542 2.700 4.407 . 0 0 "[ . 1 . 2]" 1
764 1 48 ARG HE 1 49 GLU HG3 5.720 . 5.720 4.194 2.751 5.828 0.108 13 0 "[ . 1 . 2]" 1
765 1 48 ARG QG 1 49 GLU H 5.350 . 5.350 3.002 2.151 4.026 . 0 0 "[ . 1 . 2]" 1
766 1 49 GLU H 1 49 GLU HG2 5.350 . 5.350 3.280 2.110 4.148 . 0 0 "[ . 1 . 2]" 1
767 1 49 GLU H 1 49 GLU QG 4.490 . 4.490 2.456 2.060 3.678 . 0 0 "[ . 1 . 2]" 1
768 1 49 GLU H 1 49 GLU HG3 5.350 . 5.350 2.896 2.208 4.110 . 0 0 "[ . 1 . 2]" 1
769 1 49 GLU H 1 50 ASN H 4.600 . 4.600 2.483 2.138 2.684 . 0 0 "[ . 1 . 2]" 1
770 1 49 GLU H 1 50 ASN HA 5.800 . 5.800 4.623 4.276 4.876 . 0 0 "[ . 1 . 2]" 1
771 1 49 GLU H 1 51 LYS QG 6.100 . 6.100 4.221 3.090 5.011 . 0 0 "[ . 1 . 2]" 1
772 1 49 GLU HA 1 51 LYS H 6.300 . 6.300 4.665 4.481 5.067 . 0 0 "[ . 1 . 2]" 1
773 1 49 GLU HA 1 51 LYS QD 6.100 . 6.100 5.356 4.227 6.265 0.165 13 0 "[ . 1 . 2]" 1
774 1 49 GLU QB 1 51 LYS H 5.610 . 5.610 3.112 2.601 4.370 . 0 0 "[ . 1 . 2]" 1
775 1 49 GLU QB 1 51 LYS QD 5.530 . 5.530 2.908 1.942 4.378 . 0 0 "[ . 1 . 2]" 1
776 1 49 GLU QB 1 51 LYS QE 4.740 . 4.740 3.890 1.990 4.695 . 0 0 "[ . 1 . 2]" 1
777 1 49 GLU QB 1 51 LYS QG 4.690 . 4.690 2.188 1.840 3.268 . 0 0 "[ . 1 . 2]" 1
778 1 49 GLU HB2 1 50 ASN H 6.300 . 6.300 3.622 3.082 4.446 . 0 0 "[ . 1 . 2]" 1
779 1 49 GLU HB3 1 50 ASN H 6.300 . 6.300 4.336 4.089 4.630 . 0 0 "[ . 1 . 2]" 1
780 1 49 GLU QG 1 51 LYS H 6.100 . 6.100 4.821 3.180 5.514 . 0 0 "[ . 1 . 2]" 1
781 1 49 GLU HG2 1 50 ASN H 6.300 . 6.300 5.082 4.199 5.872 . 0 0 "[ . 1 . 2]" 1
782 1 49 GLU HG3 1 50 ASN H 6.300 . 6.300 4.884 4.155 5.808 . 0 0 "[ . 1 . 2]" 1
783 1 50 ASN H 2 3 LYS QE 5.680 . 5.680 4.772 3.826 5.714 0.034 8 0 "[ . 1 . 2]" 1
784 1 50 ASN HA 1 52 VAL H 5.200 . 5.200 3.321 2.799 3.585 . 0 0 "[ . 1 . 2]" 1
785 1 50 ASN HA 2 3 LYS QE 5.010 . 5.010 3.693 2.312 5.184 0.174 1 0 "[ . 1 . 2]" 1
786 1 51 LYS H 1 51 LYS QE 6.300 . 6.300 4.874 3.791 5.430 . 0 0 "[ . 1 . 2]" 1
787 1 51 LYS H 1 51 LYS HG2 5.570 . 5.570 3.272 2.254 3.973 . 0 0 "[ . 1 . 2]" 1
788 1 51 LYS H 1 51 LYS QG 4.820 . 4.820 2.481 2.218 2.637 . 0 0 "[ . 1 . 2]" 1
789 1 51 LYS H 1 51 LYS HG3 5.570 . 5.570 2.919 2.287 3.897 . 0 0 "[ . 1 . 2]" 1
790 1 51 LYS H 1 52 VAL H 4.140 . 4.140 2.540 2.370 2.708 . 0 0 "[ . 1 . 2]" 1
791 1 51 LYS H 1 52 VAL MG1 5.750 . 5.750 4.353 3.953 4.642 . 0 0 "[ . 1 . 2]" 1
792 1 51 LYS H 1 52 VAL MG2 5.440 . 5.440 3.755 3.529 4.012 . 0 0 "[ . 1 . 2]" 1
793 1 51 LYS HA 1 51 LYS QE 5.540 . 5.540 4.098 2.019 5.037 . 0 0 "[ . 1 . 2]" 1
794 1 51 LYS HA 1 66 GLU QB 4.460 . 4.460 2.775 1.906 3.777 . 0 0 "[ . 1 . 2]" 1
795 1 51 LYS HA 1 66 GLU QG 5.460 . 5.460 3.594 1.938 5.388 . 0 0 "[ . 1 . 2]" 1
796 1 51 LYS QB 1 52 VAL MG1 4.690 . 4.690 2.950 2.487 3.300 . 0 0 "[ . 1 . 2]" 1
797 1 51 LYS HB2 1 52 VAL H 5.790 . 5.790 3.307 2.902 3.742 . 0 0 "[ . 1 . 2]" 1
798 1 51 LYS HB3 1 52 VAL H 5.790 . 5.790 4.098 3.875 4.361 . 0 0 "[ . 1 . 2]" 1
799 1 51 LYS QG 1 52 VAL H 5.760 . 5.760 4.395 4.096 4.606 . 0 0 "[ . 1 . 2]" 1
800 1 52 VAL H 1 52 VAL MG1 4.730 . 4.730 3.075 2.993 3.179 . 0 0 "[ . 1 . 2]" 1
801 1 52 VAL H 1 52 VAL MG2 4.330 . 4.330 2.285 2.121 2.471 . 0 0 "[ . 1 . 2]" 1
802 1 52 VAL H 1 53 VAL H 6.300 . 6.300 4.451 4.414 4.485 . 0 0 "[ . 1 . 2]" 1
803 1 52 VAL H 1 53 VAL QG 4.830 . 4.830 4.458 4.125 4.800 . 0 0 "[ . 1 . 2]" 1
804 1 52 VAL H 1 66 GLU QB 6.020 . 6.020 4.060 3.060 5.264 . 0 0 "[ . 1 . 2]" 1
805 1 52 VAL HA 1 53 VAL QG 5.510 . 5.510 3.420 3.207 3.612 . 0 0 "[ . 1 . 2]" 1
806 1 52 VAL HA 1 66 GLU H 4.990 . 4.990 3.142 2.598 4.019 . 0 0 "[ . 1 . 2]" 1
807 1 52 VAL HB 1 53 VAL H 4.620 . 4.620 2.751 2.486 2.994 . 0 0 "[ . 1 . 2]" 1
808 1 52 VAL MG1 1 53 VAL H 4.800 . 4.800 3.741 3.638 3.828 . 0 0 "[ . 1 . 2]" 1
809 1 52 VAL MG1 1 65 ASN HA 5.210 . 5.210 3.309 2.691 3.979 . 0 0 "[ . 1 . 2]" 1
810 1 52 VAL MG1 1 66 GLU H 6.300 . 6.300 4.283 3.810 5.094 . 0 0 "[ . 1 . 2]" 1
811 1 53 VAL H 1 53 VAL QG 4.050 . 4.050 2.363 2.131 2.659 . 0 0 "[ . 1 . 2]" 1
812 1 53 VAL H 1 54 ILE H 6.270 . 6.270 4.275 4.120 4.447 . 0 0 "[ . 1 . 2]" 1
813 1 53 VAL H 1 54 ILE MD 6.100 . 6.100 4.192 3.568 5.742 . 0 0 "[ . 1 . 2]" 1
814 1 53 VAL H 1 64 TYR QB 6.100 . 6.100 3.270 2.792 3.873 . 0 0 "[ . 1 . 2]" 1
815 1 53 VAL H 1 65 ASN HA 6.280 . 6.280 3.699 2.949 4.265 . 0 0 "[ . 1 . 2]" 1
816 1 53 VAL H 1 66 GLU H 6.210 . 6.210 4.358 3.794 4.916 . 0 0 "[ . 1 . 2]" 1
817 1 53 VAL HA 1 54 ILE HB 6.300 . 6.300 4.615 4.352 4.765 . 0 0 "[ . 1 . 2]" 1
818 1 53 VAL HA 1 54 ILE MD 5.540 . 5.540 3.693 2.686 5.098 . 0 0 "[ . 1 . 2]" 1
819 1 53 VAL HA 1 54 ILE QG 5.880 . 5.880 4.312 3.211 5.201 . 0 0 "[ . 1 . 2]" 1
820 1 53 VAL HB 1 54 ILE H 5.960 . 5.960 3.820 2.845 4.481 . 0 0 "[ . 1 . 2]" 1
821 1 53 VAL HB 1 64 TYR H 5.900 . 5.900 4.364 2.933 5.551 . 0 0 "[ . 1 . 2]" 1
822 1 53 VAL HB 1 64 TYR HB2 5.300 . 5.300 2.973 1.571 4.315 . 0 0 "[ . 1 . 2]" 1
823 1 53 VAL HB 1 64 TYR QB 4.510 . 4.510 2.907 1.567 4.158 . 0 0 "[ . 1 . 2]" 1
824 1 53 VAL HB 1 64 TYR HB3 5.300 . 5.300 4.326 3.068 5.482 0.182 14 0 "[ . 1 . 2]" 1
825 1 53 VAL HB 1 64 TYR QD 5.330 . 5.330 4.215 2.749 5.379 0.049 19 0 "[ . 1 . 2]" 1
826 1 53 VAL QG 1 54 ILE H 3.960 . 3.960 3.316 2.777 3.634 . 0 0 "[ . 1 . 2]" 1
827 1 53 VAL QG 1 54 ILE HA 4.910 . 4.910 4.194 3.925 4.489 . 0 0 "[ . 1 . 2]" 1
828 1 53 VAL QG 1 55 GLU QG 4.200 . 4.200 3.275 1.819 4.079 . 0 0 "[ . 1 . 2]" 1
829 1 53 VAL QG 1 64 TYR H 5.300 . 5.300 3.689 3.219 4.231 . 0 0 "[ . 1 . 2]" 1
830 1 53 VAL QG 1 64 TYR HB2 4.870 . 4.870 2.358 1.698 3.431 . 0 0 "[ . 1 . 2]" 1
831 1 53 VAL QG 1 64 TYR QB 4.210 . 4.210 2.292 1.683 3.318 . 0 0 "[ . 1 . 2]" 1
832 1 53 VAL QG 1 64 TYR HB3 4.870 . 4.870 3.197 2.590 4.406 . 0 0 "[ . 1 . 2]" 1
833 1 53 VAL QG 1 64 TYR QD 4.550 . 4.550 3.277 2.537 3.871 . 0 0 "[ . 1 . 2]" 1
834 1 53 VAL QG 1 64 TYR QE 5.200 . 5.200 4.743 4.056 5.277 0.077 12 0 "[ . 1 . 2]" 1
835 1 53 VAL QG 1 65 ASN QB 6.230 . 6.230 4.552 4.077 5.096 . 0 0 "[ . 1 . 2]" 1
836 1 53 VAL QG 1 66 GLU H 5.810 . 5.810 3.687 3.277 4.257 . 0 0 "[ . 1 . 2]" 1
837 1 53 VAL QG 1 66 GLU HA 4.080 . 4.080 2.446 1.890 3.248 . 0 0 "[ . 1 . 2]" 1
838 1 53 VAL QG 1 66 GLU QG 4.760 . 4.760 3.865 1.743 4.962 0.202 1 0 "[ . 1 . 2]" 1
839 1 53 VAL QG 1 67 GLY H 5.710 . 5.710 4.002 2.294 5.428 . 0 0 "[ . 1 . 2]" 1
840 1 53 VAL QG 1 68 HIS H 5.370 . 5.370 3.636 2.125 5.175 . 0 0 "[ . 1 . 2]" 1
841 1 53 VAL QG 1 68 HIS QB 5.130 . 5.130 3.305 1.610 5.463 0.333 15 0 "[ . 1 . 2]" 1
842 1 53 VAL QG 1 68 HIS HD2 5.170 . 5.170 3.869 2.059 5.269 0.099 11 0 "[ . 1 . 2]" 1
843 1 53 VAL QG 1 69 PHE H 6.300 . 6.300 3.844 2.661 5.342 . 0 0 "[ . 1 . 2]" 1
844 1 53 VAL QG 1 69 PHE HB2 5.640 . 5.640 4.036 2.018 5.613 . 0 0 "[ . 1 . 2]" 1
845 1 53 VAL QG 1 69 PHE QB 4.940 . 4.940 3.586 1.712 4.853 . 0 0 "[ . 1 . 2]" 1
846 1 53 VAL QG 1 69 PHE HB3 5.640 . 5.640 4.383 1.729 5.863 0.223 12 0 "[ . 1 . 2]" 1
847 1 53 VAL QG 1 69 PHE QD 4.490 . 4.490 2.814 1.833 3.849 . 0 0 "[ . 1 . 2]" 1
848 1 53 VAL QG 1 69 PHE QE 4.970 . 4.970 2.697 1.619 4.937 . 0 0 "[ . 1 . 2]" 1
849 1 54 ILE H 1 54 ILE MD 4.780 . 4.780 2.846 2.063 3.920 . 0 0 "[ . 1 . 2]" 1
850 1 54 ILE H 1 54 ILE HG12 5.400 . 5.400 3.644 2.123 4.427 . 0 0 "[ . 1 . 2]" 1
851 1 54 ILE H 1 54 ILE QG 4.580 . 4.580 3.053 2.109 3.740 . 0 0 "[ . 1 . 2]" 1
852 1 54 ILE H 1 54 ILE HG13 5.400 . 5.400 3.621 2.344 4.085 . 0 0 "[ . 1 . 2]" 1
853 1 54 ILE H 1 55 GLU H 6.300 . 6.300 4.433 4.285 4.560 . 0 0 "[ . 1 . 2]" 1
854 1 54 ILE H 1 55 GLU QG 6.300 . 6.300 4.893 3.929 6.253 . 0 0 "[ . 1 . 2]" 1
855 1 54 ILE HA 1 54 ILE MD 4.730 . 4.730 2.925 2.061 3.926 . 0 0 "[ . 1 . 2]" 1
856 1 54 ILE HB 1 54 ILE MD 3.520 . 3.520 2.681 2.395 3.283 . 0 0 "[ . 1 . 2]" 1
857 1 54 ILE HB 1 55 GLU H 5.760 . 5.760 4.326 4.116 4.482 . 0 0 "[ . 1 . 2]" 1
858 1 54 ILE MD 1 55 GLU H 6.300 . 6.300 4.647 3.753 5.458 . 0 0 "[ . 1 . 2]" 1
859 1 54 ILE MD 1 63 ILE H 6.300 . 6.300 5.826 4.110 6.425 0.125 5 0 "[ . 1 . 2]" 1
860 1 54 ILE MD 1 64 TYR H 6.300 . 6.300 4.288 3.059 5.614 . 0 0 "[ . 1 . 2]" 1
861 1 54 ILE QG 1 55 GLU H 5.330 . 5.330 4.412 4.038 4.857 . 0 0 "[ . 1 . 2]" 1
862 1 54 ILE QG 1 63 ILE HA 5.660 . 5.660 3.577 2.642 5.105 . 0 0 "[ . 1 . 2]" 1
863 1 54 ILE QG 1 64 TYR H 6.100 . 6.100 4.546 3.810 5.903 . 0 0 "[ . 1 . 2]" 1
864 1 54 ILE MG 1 55 GLU H 4.120 . 4.120 2.904 2.618 3.206 . 0 0 "[ . 1 . 2]" 1
865 1 54 ILE MG 1 56 ARG H 6.200 . 6.200 4.117 3.245 4.720 . 0 0 "[ . 1 . 2]" 1
866 1 54 ILE MG 1 56 ARG HA 6.100 . 6.100 4.515 3.853 5.108 . 0 0 "[ . 1 . 2]" 1
867 1 54 ILE MG 1 56 ARG QH1 6.300 . 6.300 4.904 2.289 6.403 0.103 14 0 "[ . 1 . 2]" 1
868 1 54 ILE MG 1 56 ARG QH2 6.300 . 6.300 4.740 2.811 6.178 . 0 0 "[ . 1 . 2]" 1
869 1 55 GLU H 1 56 ARG H 5.350 . 5.350 4.344 4.105 4.573 . 0 0 "[ . 1 . 2]" 1
870 1 55 GLU H 1 56 ARG HA 6.270 . 6.270 4.972 4.735 5.238 . 0 0 "[ . 1 . 2]" 1
871 1 55 GLU H 1 61 ILE HA 6.300 . 6.300 4.792 4.420 5.318 . 0 0 "[ . 1 . 2]" 1
872 1 55 GLU H 1 62 GLU QB 6.100 . 6.100 3.627 2.732 4.284 . 0 0 "[ . 1 . 2]" 1
873 1 55 GLU H 1 64 TYR QD 4.820 . 4.820 3.296 2.687 4.661 . 0 0 "[ . 1 . 2]" 1
874 1 55 GLU H 1 64 TYR QE 5.060 . 5.060 3.646 2.878 4.772 . 0 0 "[ . 1 . 2]" 1
875 1 55 GLU HA 1 56 ARG QG 6.030 . 6.030 4.038 3.587 4.836 . 0 0 "[ . 1 . 2]" 1
876 1 55 GLU HA 1 57 LYS H 6.260 . 6.260 5.629 5.230 6.245 . 0 0 "[ . 1 . 2]" 1
877 1 55 GLU HA 1 57 LYS QD 5.470 . 5.470 4.972 4.170 5.681 0.211 13 0 "[ . 1 . 2]" 1
878 1 55 GLU HA 1 62 GLU H 6.250 . 6.250 5.041 4.707 5.242 . 0 0 "[ . 1 . 2]" 1
879 1 55 GLU QB 1 56 ARG H 4.330 . 4.330 3.318 2.762 3.855 . 0 0 "[ . 1 . 2]" 1
880 1 55 GLU QB 1 57 LYS H 5.600 . 5.600 4.549 3.548 5.520 . 0 0 "[ . 1 . 2]" 1
881 1 55 GLU QB 1 57 LYS QB 4.760 . 4.760 4.383 2.803 4.986 0.226 5 0 "[ . 1 . 2]" 1
882 1 55 GLU QB 1 57 LYS QE 6.100 . 6.100 3.111 1.883 5.162 . 0 0 "[ . 1 . 2]" 1
883 1 55 GLU QB 1 57 LYS QG 4.910 . 4.910 3.785 2.541 5.002 0.092 6 0 "[ . 1 . 2]" 1
884 1 55 GLU QB 1 64 TYR QD 5.150 . 5.150 3.117 2.473 4.085 . 0 0 "[ . 1 . 2]" 1
885 1 55 GLU QB 1 64 TYR QE 4.040 . 4.040 2.187 1.681 3.265 . 0 0 "[ . 1 . 2]" 1
886 1 55 GLU HB2 1 64 TYR QD 5.900 . 5.900 3.179 2.506 4.212 . 0 0 "[ . 1 . 2]" 1
887 1 55 GLU HB3 1 64 TYR QD 5.900 . 5.900 4.587 3.384 5.500 . 0 0 "[ . 1 . 2]" 1
888 1 55 GLU QG 1 56 ARG H 5.080 . 5.080 4.187 2.986 4.894 . 0 0 "[ . 1 . 2]" 1
889 1 55 GLU QG 1 56 ARG QG 6.300 . 6.300 5.839 4.901 6.419 0.119 19 0 "[ . 1 . 2]" 1
890 1 55 GLU QG 1 57 LYS QG 6.100 . 6.100 5.301 3.653 6.187 0.087 4 0 "[ . 1 . 2]" 1
891 1 55 GLU QG 1 64 TYR QD 4.600 . 4.600 3.267 2.220 4.773 0.173 5 0 "[ . 1 . 2]" 1
892 1 55 GLU QG 1 64 TYR QE 5.350 . 5.350 3.258 2.431 4.274 . 0 0 "[ . 1 . 2]" 1
893 1 56 ARG H 1 56 ARG QB 3.770 . 3.770 2.497 2.274 3.034 . 0 0 "[ . 1 . 2]" 1
894 1 56 ARG H 1 56 ARG QG 4.740 . 4.740 2.764 2.078 3.521 . 0 0 "[ . 1 . 2]" 1
895 1 56 ARG HA 1 57 LYS QB 5.810 . 5.810 4.478 4.291 4.683 . 0 0 "[ . 1 . 2]" 1
896 1 56 ARG HA 1 60 LEU H 5.970 . 5.970 4.625 4.049 5.226 . 0 0 "[ . 1 . 2]" 1
897 1 56 ARG HA 1 61 ILE HA 4.990 . 4.990 2.693 2.036 3.192 . 0 0 "[ . 1 . 2]" 1
898 1 56 ARG HA 1 61 ILE MD 5.800 . 5.800 4.845 3.536 5.356 . 0 0 "[ . 1 . 2]" 1
899 1 56 ARG HA 1 61 ILE MG 5.600 . 5.600 4.419 3.355 4.907 . 0 0 "[ . 1 . 2]" 1
900 1 56 ARG HB2 1 57 LYS H 5.780 . 5.780 4.384 3.648 4.545 . 0 0 "[ . 1 . 2]" 1
901 1 56 ARG HB3 1 57 LYS H 5.780 . 5.780 3.730 2.939 4.287 . 0 0 "[ . 1 . 2]" 1
902 1 56 ARG QD 1 57 LYS H 6.300 . 6.300 5.591 4.775 5.884 . 0 0 "[ . 1 . 2]" 1
903 1 56 ARG QD 1 59 GLY QA 4.910 . 4.910 4.353 2.930 5.039 0.129 19 0 "[ . 1 . 2]" 1
904 1 56 ARG QD 1 61 ILE MD 5.500 . 5.500 3.970 2.434 4.955 . 0 0 "[ . 1 . 2]" 1
905 1 56 ARG QD 1 61 ILE MG 5.990 . 5.990 4.852 3.796 5.579 . 0 0 "[ . 1 . 2]" 1
906 1 56 ARG QD 2 5 ILE MD 4.810 . 4.810 3.748 2.190 4.965 0.155 5 0 "[ . 1 . 2]" 1
907 1 56 ARG QD 2 5 ILE MG 5.380 . 5.380 3.553 1.844 4.929 . 0 0 "[ . 1 . 2]" 1
908 1 56 ARG HE 1 61 ILE MD 6.150 . 6.150 3.638 1.858 5.676 . 0 0 "[ . 1 . 2]" 1
909 1 56 ARG HE 1 61 ILE MG 6.280 . 6.280 4.797 2.950 6.195 . 0 0 "[ . 1 . 2]" 1
910 1 56 ARG HE 2 5 ILE MG 5.740 . 5.740 4.226 2.622 5.711 . 0 0 "[ . 1 . 2]" 1
911 1 56 ARG QG 1 57 LYS H 4.970 . 4.970 4.264 3.671 4.525 . 0 0 "[ . 1 . 2]" 1
912 1 56 ARG QG 1 59 GLY H 5.670 . 5.670 5.441 4.543 5.818 0.148 20 0 "[ . 1 . 2]" 1
913 1 56 ARG QG 1 60 LEU H 5.640 . 5.640 5.532 5.080 5.737 0.097 8 0 "[ . 1 . 2]" 1
914 1 56 ARG QG 1 61 ILE HA 5.650 . 5.650 3.032 2.418 4.509 . 0 0 "[ . 1 . 2]" 1
915 1 56 ARG QG 1 61 ILE MD 4.430 . 4.430 3.376 1.843 4.480 0.050 9 0 "[ . 1 . 2]" 1
916 1 56 ARG QG 1 61 ILE QG 4.950 . 4.950 2.421 1.815 3.842 . 0 0 "[ . 1 . 2]" 1
917 1 56 ARG QG 1 61 ILE MG 3.790 . 3.790 3.512 2.866 3.953 0.163 9 0 "[ . 1 . 2]" 1
918 1 56 ARG QH1 1 61 ILE MD 6.270 . 6.270 4.000 2.233 5.933 . 0 0 "[ . 1 . 2]" 1
919 1 56 ARG QH2 1 61 ILE MD 6.300 . 6.300 3.435 1.889 6.321 0.021 5 0 "[ . 1 . 2]" 1
920 1 57 LYS H 1 57 LYS QD 5.210 . 5.210 3.207 1.708 4.912 . 0 0 "[ . 1 . 2]" 1
921 1 57 LYS H 1 57 LYS HG2 5.620 . 5.620 3.483 1.970 4.532 . 0 0 "[ . 1 . 2]" 1
922 1 57 LYS H 1 57 LYS HG3 5.620 . 5.620 3.707 2.585 4.514 . 0 0 "[ . 1 . 2]" 1
923 1 57 LYS H 1 58 ASN H 6.100 . 6.100 4.332 4.037 4.493 . 0 0 "[ . 1 . 2]" 1
924 1 57 LYS H 1 58 ASN QB 6.100 . 6.100 5.233 4.838 5.937 . 0 0 "[ . 1 . 2]" 1
925 1 57 LYS H 1 59 GLY H 5.710 . 5.710 4.107 3.375 4.591 . 0 0 "[ . 1 . 2]" 1
926 1 57 LYS H 1 60 LEU H 4.610 . 4.610 3.570 3.036 4.135 . 0 0 "[ . 1 . 2]" 1
927 1 57 LYS H 1 60 LEU QB 6.110 . 6.110 3.676 3.158 5.338 . 0 0 "[ . 1 . 2]" 1
928 1 57 LYS H 1 60 LEU QD 6.220 . 6.220 4.724 2.967 5.314 . 0 0 "[ . 1 . 2]" 1
929 1 57 LYS H 1 61 ILE MD 6.300 . 6.300 6.054 4.947 6.586 0.286 16 0 "[ . 1 . 2]" 1
930 1 57 LYS H 1 61 ILE QG 6.100 . 6.100 5.295 4.817 6.174 0.074 6 0 "[ . 1 . 2]" 1
931 1 57 LYS HA 1 57 LYS QD 4.960 . 4.960 3.573 2.278 4.577 . 0 0 "[ . 1 . 2]" 1
932 1 57 LYS HA 1 59 GLY H 5.490 . 5.490 3.736 3.337 4.053 . 0 0 "[ . 1 . 2]" 1
933 1 57 LYS QB 1 58 ASN QD 5.440 . 5.440 3.334 2.153 5.603 0.163 4 0 "[ . 1 . 2]" 1
934 1 57 LYS QG 1 58 ASN QD 5.410 . 5.410 4.422 2.902 5.453 0.043 18 0 "[ . 1 . 2]" 1
935 1 57 LYS HG2 1 58 ASN H 5.800 . 5.800 4.952 4.353 5.482 . 0 0 "[ . 1 . 2]" 1
936 1 57 LYS HG3 1 58 ASN H 5.800 . 5.800 4.916 3.861 5.862 0.062 12 0 "[ . 1 . 2]" 1
937 1 58 ASN H 1 59 GLY H 4.620 . 4.620 2.814 2.675 3.009 . 0 0 "[ . 1 . 2]" 1
938 1 58 ASN H 1 59 GLY QA 6.100 . 6.100 4.711 4.575 4.878 . 0 0 "[ . 1 . 2]" 1
939 1 58 ASN H 1 60 LEU H 6.130 . 6.130 4.349 4.186 4.783 . 0 0 "[ . 1 . 2]" 1
940 1 58 ASN HA 1 60 LEU H 5.780 . 5.780 4.383 4.288 4.654 . 0 0 "[ . 1 . 2]" 1
941 1 58 ASN QB 1 59 GLY H 4.700 . 4.700 3.903 3.858 4.102 . 0 0 "[ . 1 . 2]" 1
942 1 58 ASN QB 1 60 LEU QB 5.340 . 5.340 3.876 3.428 5.338 . 0 0 "[ . 1 . 2]" 1
943 1 58 ASN HB2 1 59 GLY H 5.520 . 5.520 4.270 4.181 4.628 . 0 0 "[ . 1 . 2]" 1
944 1 58 ASN HB2 1 60 LEU H 6.010 . 6.010 3.665 3.275 4.903 . 0 0 "[ . 1 . 2]" 1
945 1 58 ASN HB2 1 60 LEU MD1 6.300 . 6.300 3.614 2.259 6.224 . 0 0 "[ . 1 . 2]" 1
946 1 58 ASN HB2 1 60 LEU MD2 6.300 . 6.300 4.280 2.051 6.111 . 0 0 "[ . 1 . 2]" 1
947 1 58 ASN HB3 1 59 GLY H 5.520 . 5.520 4.530 4.214 4.672 . 0 0 "[ . 1 . 2]" 1
948 1 58 ASN HB3 1 60 LEU H 6.010 . 6.010 4.512 3.579 5.226 . 0 0 "[ . 1 . 2]" 1
949 1 58 ASN HB3 1 60 LEU MD1 6.300 . 6.300 4.385 3.094 6.454 0.154 5 0 "[ . 1 . 2]" 1
950 1 58 ASN HB3 1 60 LEU MD2 6.300 . 6.300 4.850 2.986 6.243 . 0 0 "[ . 1 . 2]" 1
951 1 58 ASN QD 1 60 LEU QD 5.430 . 5.430 3.531 2.082 4.733 . 0 0 "[ . 1 . 2]" 1
952 1 58 ASN HD21 1 60 LEU QB 6.300 . 6.300 4.844 4.341 5.668 . 0 0 "[ . 1 . 2]" 1
953 1 58 ASN HD22 1 60 LEU QB 6.300 . 6.300 6.040 3.936 6.436 0.136 3 0 "[ . 1 . 2]" 1
954 1 59 GLY H 1 60 LEU H 4.480 . 4.480 2.826 2.688 3.006 . 0 0 "[ . 1 . 2]" 1
955 1 59 GLY H 1 60 LEU QB 6.060 . 6.060 4.877 4.707 5.232 . 0 0 "[ . 1 . 2]" 1
956 1 60 LEU H 1 60 LEU MD1 5.070 . 5.070 3.377 2.072 4.219 . 0 0 "[ . 1 . 2]" 1
957 1 60 LEU H 1 60 LEU MD2 5.070 . 5.070 3.314 2.056 4.100 . 0 0 "[ . 1 . 2]" 1
958 1 60 LEU H 1 60 LEU HG 4.880 . 4.880 3.141 2.266 4.100 . 0 0 "[ . 1 . 2]" 1
959 1 60 LEU HA 1 60 LEU MD1 4.600 . 4.600 3.401 2.045 4.131 . 0 0 "[ . 1 . 2]" 1
960 1 60 LEU HA 1 60 LEU QD 3.830 . 3.830 2.344 2.014 3.485 . 0 0 "[ . 1 . 2]" 1
961 1 60 LEU HA 1 60 LEU MD2 4.600 . 4.600 2.777 2.067 3.859 . 0 0 "[ . 1 . 2]" 1
962 1 60 LEU HA 1 61 ILE QG 5.740 . 5.740 4.072 3.258 5.835 0.095 2 0 "[ . 1 . 2]" 1
963 1 60 LEU QB 1 61 ILE H 5.220 . 5.220 3.000 2.482 3.593 . 0 0 "[ . 1 . 2]" 1
964 1 60 LEU QD 1 61 ILE H 5.390 . 5.390 3.729 3.326 4.248 . 0 0 "[ . 1 . 2]" 1
965 1 61 ILE H 1 61 ILE HB 4.270 . 4.270 2.568 2.415 3.235 . 0 0 "[ . 1 . 2]" 1
966 1 61 ILE H 1 61 ILE MD 4.680 . 4.680 3.228 1.931 4.719 0.039 2 0 "[ . 1 . 2]" 1
967 1 61 ILE H 1 61 ILE HG12 4.680 . 4.680 3.790 2.103 4.416 . 0 0 "[ . 1 . 2]" 1
968 1 61 ILE H 1 61 ILE QG 4.080 . 4.080 2.853 2.090 4.052 . 0 0 "[ . 1 . 2]" 1
969 1 61 ILE H 1 61 ILE HG13 4.680 . 4.680 3.063 2.257 4.715 0.035 2 0 "[ . 1 . 2]" 1
970 1 61 ILE H 1 61 ILE MG 4.770 . 4.770 3.752 2.082 3.915 . 0 0 "[ . 1 . 2]" 1
971 1 61 ILE HA 1 61 ILE MD 4.700 . 4.700 3.545 2.426 3.908 . 0 0 "[ . 1 . 2]" 1
972 1 61 ILE HB 1 62 GLU H 5.090 . 5.090 4.325 3.962 4.478 . 0 0 "[ . 1 . 2]" 1
973 1 61 ILE MD 1 62 GLU H 6.300 . 6.300 5.046 4.223 5.448 . 0 0 "[ . 1 . 2]" 1
974 1 61 ILE MD 2 37 GLU HB2 5.530 . 5.530 2.619 1.675 3.405 . 0 0 "[ . 1 . 2]" 1
975 1 61 ILE MD 2 37 GLU HB3 4.280 . 4.280 3.088 2.226 4.347 0.067 14 0 "[ . 1 . 2]" 1
976 1 61 ILE MD 2 37 GLU QG 5.600 . 5.600 4.134 2.995 4.893 . 0 0 "[ . 1 . 2]" 1
977 1 61 ILE MD 2 38 SER H 5.870 . 5.870 3.336 2.575 4.104 . 0 0 "[ . 1 . 2]" 1
978 1 61 ILE MD 2 38 SER QB 5.370 . 5.370 3.250 1.903 4.638 . 0 0 "[ . 1 . 2]" 1
979 1 61 ILE QG 1 62 GLU H 5.240 . 5.240 4.226 2.912 4.822 . 0 0 "[ . 1 . 2]" 1
980 1 61 ILE MG 1 62 GLU H 4.230 . 4.230 3.023 2.594 4.268 0.038 2 0 "[ . 1 . 2]" 1
981 1 61 ILE MG 1 62 GLU HA 5.210 . 5.210 3.765 3.348 4.547 . 0 0 "[ . 1 . 2]" 1
982 1 62 GLU HB2 1 64 TYR QE 4.800 . 4.800 2.940 2.050 4.852 0.052 6 0 "[ . 1 . 2]" 1
983 1 62 GLU HB3 1 64 TYR QE 4.800 . 4.800 2.910 2.062 3.698 . 0 0 "[ . 1 . 2]" 1
984 1 62 GLU QG 1 63 ILE H 4.860 . 4.860 3.946 2.384 4.660 . 0 0 "[ . 1 . 2]" 1
985 1 62 GLU HG2 1 63 ILE H 5.700 . 5.700 4.385 2.744 5.122 . 0 0 "[ . 1 . 2]" 1
986 1 62 GLU HG3 1 63 ILE H 5.700 . 5.700 4.701 2.619 5.495 . 0 0 "[ . 1 . 2]" 1
987 1 63 ILE H 1 63 ILE MD 4.760 . 4.760 3.148 1.641 4.593 . 0 0 "[ . 1 . 2]" 1
988 1 63 ILE H 1 63 ILE HG12 5.400 . 5.400 3.682 2.163 4.877 . 0 0 "[ . 1 . 2]" 1
989 1 63 ILE H 1 63 ILE HG13 5.400 . 5.400 3.646 1.904 4.705 . 0 0 "[ . 1 . 2]" 1
990 1 63 ILE HA 1 63 ILE MD 4.180 . 4.180 3.347 2.124 4.236 0.056 9 0 "[ . 1 . 2]" 1
991 1 63 ILE HA 1 64 TYR QD 5.410 . 5.410 3.613 3.015 4.390 . 0 0 "[ . 1 . 2]" 1
992 1 63 ILE HB 1 64 TYR H 6.170 . 6.170 3.890 2.864 4.503 . 0 0 "[ . 1 . 2]" 1
993 1 63 ILE MD 1 64 TYR H 4.670 . 4.670 4.405 2.039 5.223 0.553 1 1 "[+ . 1 . 2]" 1
994 1 63 ILE MG 1 64 TYR H 4.210 . 4.210 3.459 2.501 4.236 0.026 17 0 "[ . 1 . 2]" 1
995 1 64 TYR H 1 64 TYR QD 5.100 . 5.100 2.783 2.319 3.318 . 0 0 "[ . 1 . 2]" 1
996 1 64 TYR HA 1 64 TYR QD 4.510 . 4.510 3.002 2.314 3.260 . 0 0 "[ . 1 . 2]" 1
997 1 64 TYR QD 1 65 ASN H 5.780 . 5.780 3.840 3.384 4.293 . 0 0 "[ . 1 . 2]" 1
998 1 65 ASN QB 1 66 GLU H 5.010 . 5.010 3.061 2.315 3.689 . 0 0 "[ . 1 . 2]" 1
999 1 65 ASN QB 1 67 GLY H 5.940 . 5.940 4.284 2.004 6.061 0.121 18 0 "[ . 1 . 2]" 1
1000 1 65 ASN QB 1 68 HIS H 5.940 . 5.940 4.802 3.124 6.082 0.142 10 0 "[ . 1 . 2]" 1
1001 1 66 GLU H 1 66 GLU QG 5.080 . 5.080 3.241 1.878 4.139 . 0 0 "[ . 1 . 2]" 1
1002 1 66 GLU H 1 67 GLY H 5.020 . 5.020 3.771 2.525 4.686 . 0 0 "[ . 1 . 2]" 1
1003 1 66 GLU HA 1 68 HIS H 5.300 . 5.300 3.513 2.834 4.603 . 0 0 "[ . 1 . 2]" 1
1004 1 66 GLU HA 1 69 PHE H 6.300 . 6.300 4.436 3.601 6.314 0.014 17 0 "[ . 1 . 2]" 1
1005 1 66 GLU HA 1 69 PHE QB 5.580 . 5.580 4.835 3.447 5.708 0.128 7 0 "[ . 1 . 2]" 1
1006 1 66 GLU HB2 1 67 GLY H 5.630 . 5.630 3.913 1.869 4.575 . 0 0 "[ . 1 . 2]" 1
1007 1 66 GLU HB3 1 67 GLY H 5.630 . 5.630 3.846 2.711 4.407 . 0 0 "[ . 1 . 2]" 1
1008 1 66 GLU QG 1 67 GLY H 5.200 . 5.200 3.154 1.817 4.525 . 0 0 "[ . 1 . 2]" 1
1009 1 66 GLU QG 1 68 HIS H 6.010 . 6.010 4.875 3.850 6.052 0.042 15 0 "[ . 1 . 2]" 1
1010 1 67 GLY H 1 68 HIS H 4.530 . 4.530 2.596 1.736 4.061 . 0 0 "[ . 1 . 2]" 1
1011 1 67 GLY QA 1 69 PHE H 6.160 . 6.160 3.923 3.339 5.606 . 0 0 "[ . 1 . 2]" 1
1012 1 68 HIS H 1 68 HIS HD2 6.300 . 6.300 4.140 2.327 5.553 . 0 0 "[ . 1 . 2]" 1
1013 1 68 HIS HA 1 68 HIS HD2 4.980 . 4.980 4.130 2.765 4.870 . 0 0 "[ . 1 . 2]" 1
1014 1 68 HIS QB 1 69 PHE H 4.690 . 4.690 3.215 2.454 3.886 . 0 0 "[ . 1 . 2]" 1
1015 1 68 HIS QB 1 69 PHE QD 5.480 . 5.480 4.053 2.790 5.236 . 0 0 "[ . 1 . 2]" 1
1016 1 68 HIS HB2 1 69 PHE H 5.610 . 5.610 3.755 2.516 4.390 . 0 0 "[ . 1 . 2]" 1
1017 1 68 HIS HB3 1 69 PHE H 5.610 . 5.610 3.758 2.520 4.448 . 0 0 "[ . 1 . 2]" 1
1018 1 69 PHE H 1 69 PHE QB 3.870 . 3.870 2.547 2.314 3.200 . 0 0 "[ . 1 . 2]" 1
1019 1 69 PHE H 1 69 PHE QD 4.660 . 4.660 2.785 1.946 3.550 . 0 0 "[ . 1 . 2]" 1
1020 1 69 PHE H 1 69 PHE QE 5.320 . 5.320 4.596 4.007 5.251 . 0 0 "[ . 1 . 2]" 1
1021 1 69 PHE HA 1 69 PHE QD 4.260 . 4.260 2.964 2.087 3.818 . 0 0 "[ . 1 . 2]" 1
1022 1 69 PHE QB 1 71 PHE H 5.830 . 5.830 4.993 3.252 5.962 0.132 4 0 "[ . 1 . 2]" 1
1023 1 69 PHE HB2 1 70 ASP H 5.100 . 5.100 3.542 1.923 4.625 . 0 0 "[ . 1 . 2]" 1
1024 1 69 PHE HB3 1 70 ASP H 5.100 . 5.100 3.691 2.346 4.610 . 0 0 "[ . 1 . 2]" 1
1025 1 69 PHE QD 1 70 ASP H 5.860 . 5.860 4.089 3.239 4.976 . 0 0 "[ . 1 . 2]" 1
1026 1 70 ASP H 1 70 ASP QB 3.810 . 3.810 2.549 2.276 3.438 . 0 0 "[ . 1 . 2]" 1
1027 1 70 ASP QB 1 71 PHE H 4.590 . 4.590 3.122 2.050 4.005 . 0 0 "[ . 1 . 2]" 1
1028 1 71 PHE H 1 71 PHE HB2 4.390 . 4.390 2.843 2.463 3.943 . 0 0 "[ . 1 . 2]" 1
1029 1 71 PHE H 1 71 PHE QB 3.740 . 3.740 2.560 2.253 3.352 . 0 0 "[ . 1 . 2]" 1
1030 1 71 PHE H 1 71 PHE HB3 4.390 . 4.390 3.224 2.487 4.034 . 0 0 "[ . 1 . 2]" 1
1031 1 71 PHE H 1 71 PHE QD 5.110 . 5.110 3.377 2.064 4.542 . 0 0 "[ . 1 . 2]" 1
1032 1 71 PHE HA 1 71 PHE QD 4.220 . 4.220 2.818 2.294 3.805 . 0 0 "[ . 1 . 2]" 1
1033 1 71 PHE QB 1 72 SER H 4.490 . 4.490 3.380 2.290 4.032 . 0 0 "[ . 1 . 2]" 1
1034 1 71 PHE HB2 1 72 SER H 5.200 . 5.200 4.045 2.332 4.559 . 0 0 "[ . 1 . 2]" 1
1035 1 71 PHE HB3 1 72 SER H 5.200 . 5.200 3.782 2.398 4.513 . 0 0 "[ . 1 . 2]" 1
1036 1 71 PHE QD 1 72 SER H 5.730 . 5.730 4.215 3.374 4.926 . 0 0 "[ . 1 . 2]" 1
1037 1 72 SER QB 1 73 PHE H 4.530 . 4.530 3.367 2.196 4.091 . 0 0 "[ . 1 . 2]" 1
1038 1 72 SER HB2 1 73 PHE H 5.150 . 5.150 3.934 2.499 4.646 . 0 0 "[ . 1 . 2]" 1
1039 1 72 SER HB3 1 73 PHE H 5.150 . 5.150 3.860 2.212 4.583 . 0 0 "[ . 1 . 2]" 1
1040 1 73 PHE H 1 73 PHE HB2 4.350 . 4.350 2.921 2.429 3.972 . 0 0 "[ . 1 . 2]" 1
1041 1 73 PHE H 1 73 PHE QB 3.750 . 3.750 2.608 2.253 3.401 . 0 0 "[ . 1 . 2]" 1
1042 1 73 PHE H 1 73 PHE HB3 4.350 . 4.350 3.204 2.418 4.104 . 0 0 "[ . 1 . 2]" 1
1043 1 73 PHE H 1 73 PHE QD 5.230 . 5.230 3.352 1.971 4.466 . 0 0 "[ . 1 . 2]" 1
1044 1 73 PHE HB2 1 74 GLY H 5.040 . 5.040 3.920 2.392 4.562 . 0 0 "[ . 1 . 2]" 1
1045 1 73 PHE HB3 1 74 GLY H 5.040 . 5.040 3.694 1.914 4.491 . 0 0 "[ . 1 . 2]" 1
1046 1 73 PHE QD 1 74 GLY H 5.820 . 5.820 3.950 2.567 4.845 . 0 0 "[ . 1 . 2]" 1
1047 1 73 PHE QD 1 75 LEU QD 5.050 . 5.050 3.184 2.005 4.664 . 0 0 "[ . 1 . 2]" 1
1048 1 73 PHE QE 1 75 LEU QD 5.190 . 5.190 4.034 2.069 5.330 0.140 10 0 "[ . 1 . 2]" 1
1049 1 74 GLY H 1 75 LEU H 4.000 . 4.000 3.238 1.916 4.181 0.181 20 0 "[ . 1 . 2]" 1
1050 1 75 LEU H 1 75 LEU QB 3.800 . 3.800 2.610 2.224 3.433 . 0 0 "[ . 1 . 2]" 1
1051 1 75 LEU H 1 75 LEU HG 4.660 . 4.660 3.525 1.976 4.530 . 0 0 "[ . 1 . 2]" 1
1052 1 75 LEU H 1 76 GLU H 4.410 . 4.410 3.923 2.513 4.580 0.170 2 0 "[ . 1 . 2]" 1
1053 1 75 LEU HA 1 75 LEU QD 3.720 . 3.720 2.711 1.988 3.516 . 0 0 "[ . 1 . 2]" 1
1054 1 75 LEU QB 1 76 GLU QB 4.940 . 4.940 4.693 3.294 5.187 0.247 18 0 "[ . 1 . 2]" 1
1055 1 75 LEU HB2 1 76 GLU H 5.160 . 5.160 3.867 2.336 4.515 . 0 0 "[ . 1 . 2]" 1
1056 1 75 LEU HB3 1 76 GLU H 5.160 . 5.160 3.654 2.447 4.365 . 0 0 "[ . 1 . 2]" 1
1057 1 75 LEU QD 1 76 GLU H 6.220 . 6.220 4.069 2.274 4.623 . 0 0 "[ . 1 . 2]" 1
1058 1 75 LEU HG 1 76 GLU H 5.610 . 5.610 4.573 2.746 5.765 0.155 17 0 "[ . 1 . 2]" 1
1059 1 76 GLU H 1 76 GLU HG2 5.350 . 5.350 4.064 2.039 5.287 . 0 0 "[ . 1 . 2]" 1
1060 1 76 GLU H 1 76 GLU HG3 5.350 . 5.350 3.848 2.083 4.997 . 0 0 "[ . 1 . 2]" 1
1061 2 1 MET HA 2 5 ILE MD 4.840 . 4.840 4.396 3.013 4.965 0.125 7 0 "[ . 1 . 2]" 1
1062 2 1 MET QB 2 2 ASP H 5.290 . 5.290 3.115 2.115 4.105 . 0 0 "[ . 1 . 2]" 1
1063 2 1 MET QB 2 5 ILE MD 4.770 . 4.770 3.721 2.562 4.772 0.002 14 0 "[ . 1 . 2]" 1
1064 2 1 MET ME 2 5 ILE MD 3.750 . 3.750 2.892 1.989 3.779 0.029 2 0 "[ . 1 . 2]" 1
1065 2 1 MET QG 2 2 ASP H 6.300 . 6.300 3.069 1.785 4.124 . 0 0 "[ . 1 . 2]" 1
1066 2 1 MET QG 2 3 LYS H 5.790 . 5.790 5.085 4.040 5.904 0.114 3 0 "[ . 1 . 2]" 1
1067 2 1 MET QG 2 5 ILE MD 4.600 . 4.600 2.820 1.930 4.653 0.053 18 0 "[ . 1 . 2]" 1
1068 2 2 ASP H 2 5 ILE MD 6.300 . 6.300 3.498 1.872 4.395 . 0 0 "[ . 1 . 2]" 1
1069 2 2 ASP QB 2 3 LYS H 4.650 . 4.650 3.250 2.646 3.733 . 0 0 "[ . 1 . 2]" 1
1070 2 2 ASP QB 2 5 ILE HB 5.180 . 5.180 4.021 3.210 4.771 . 0 0 "[ . 1 . 2]" 1
1071 2 2 ASP QB 2 5 ILE MD 4.740 . 4.740 3.328 2.294 4.002 . 0 0 "[ . 1 . 2]" 1
1072 2 2 ASP QB 2 5 ILE QG 5.200 . 5.200 3.911 1.763 5.173 . 0 0 "[ . 1 . 2]" 1
1073 2 2 ASP QB 2 5 ILE MG 5.380 . 5.380 4.713 3.983 5.507 0.127 6 0 "[ . 1 . 2]" 1
1074 2 2 ASP HB2 2 3 LYS H 5.420 . 5.420 3.885 3.443 4.222 . 0 0 "[ . 1 . 2]" 1
1075 2 2 ASP HB2 2 5 ILE HB 5.870 . 5.870 4.474 3.488 5.883 0.013 16 0 "[ . 1 . 2]" 1
1076 2 2 ASP HB2 2 5 ILE MD 5.380 . 5.380 3.782 2.314 4.782 . 0 0 "[ . 1 . 2]" 1
1077 2 2 ASP HB3 2 3 LYS H 5.420 . 5.420 3.637 2.691 4.275 . 0 0 "[ . 1 . 2]" 1
1078 2 2 ASP HB3 2 5 ILE HB 5.870 . 5.870 4.788 3.283 5.575 . 0 0 "[ . 1 . 2]" 1
1079 2 2 ASP HB3 2 5 ILE MD 5.380 . 5.380 4.000 2.619 4.986 . 0 0 "[ . 1 . 2]" 1
1080 2 3 LYS H 2 3 LYS QB 3.760 . 3.760 2.285 2.087 2.530 . 0 0 "[ . 1 . 2]" 1
1081 2 3 LYS H 2 3 LYS QD 5.430 . 5.430 4.271 3.443 4.789 . 0 0 "[ . 1 . 2]" 1
1082 2 3 LYS H 2 3 LYS QE 6.000 . 6.000 4.242 2.455 5.964 . 0 0 "[ . 1 . 2]" 1
1083 2 3 LYS H 2 3 LYS HG2 4.980 . 4.980 3.982 2.140 4.701 . 0 0 "[ . 1 . 2]" 1
1084 2 3 LYS H 2 3 LYS HG3 4.980 . 4.980 4.141 2.368 4.624 . 0 0 "[ . 1 . 2]" 1
1085 2 3 LYS H 2 5 ILE MD 5.330 . 5.330 5.125 4.841 5.363 0.033 1 0 "[ . 1 . 2]" 1
1086 2 3 LYS HA 2 3 LYS QD 4.680 . 4.680 3.051 2.041 4.342 . 0 0 "[ . 1 . 2]" 1
1087 2 3 LYS HA 2 3 LYS QG 3.860 . 3.860 2.730 2.346 3.070 . 0 0 "[ . 1 . 2]" 1
1088 2 3 LYS HA 2 5 ILE H 4.980 . 4.980 4.316 3.737 4.790 . 0 0 "[ . 1 . 2]" 1
1089 2 3 LYS HA 2 6 VAL MG2 4.630 . 4.630 2.529 1.668 3.930 . 0 0 "[ . 1 . 2]" 1
1090 2 3 LYS QB 2 5 ILE H 5.130 . 5.130 4.834 4.574 5.043 . 0 0 "[ . 1 . 2]" 1
1091 2 3 LYS QD 2 45 TRP HH2 5.080 . 5.080 3.031 2.033 5.111 0.031 8 0 "[ . 1 . 2]" 1
1092 2 3 LYS QD 2 45 TRP HZ3 5.590 . 5.590 3.203 1.901 5.223 . 0 0 "[ . 1 . 2]" 1
1093 2 3 LYS QE 2 45 TRP HH2 5.680 . 5.680 4.104 2.271 5.760 0.080 3 0 "[ . 1 . 2]" 1
1094 2 3 LYS QG 2 4 LYS H 5.960 . 5.960 4.128 3.589 4.728 . 0 0 "[ . 1 . 2]" 1
1095 2 3 LYS QG 2 45 TRP HH2 5.390 . 5.390 3.410 1.955 5.228 . 0 0 "[ . 1 . 2]" 1
1096 2 4 LYS H 2 4 LYS QD 5.300 . 5.300 3.702 2.270 4.556 . 0 0 "[ . 1 . 2]" 1
1097 2 4 LYS H 2 4 LYS HG2 4.770 . 4.770 3.122 2.064 4.610 . 0 0 "[ . 1 . 2]" 1
1098 2 4 LYS H 2 4 LYS QG 4.030 . 4.030 2.687 1.997 4.050 0.020 17 0 "[ . 1 . 2]" 1
1099 2 4 LYS H 2 4 LYS HG3 4.770 . 4.770 3.449 2.020 4.526 . 0 0 "[ . 1 . 2]" 1
1100 2 4 LYS H 2 5 ILE H 4.390 . 4.390 2.543 2.317 2.831 . 0 0 "[ . 1 . 2]" 1
1101 2 4 LYS HA 2 7 GLY H 5.080 . 5.080 3.552 2.953 4.025 . 0 0 "[ . 1 . 2]" 1
1102 2 4 LYS QB 2 5 ILE H 4.450 . 4.450 2.875 2.366 3.800 . 0 0 "[ . 1 . 2]" 1
1103 2 4 LYS QB 2 7 GLY H 6.170 . 6.170 4.909 4.290 5.250 . 0 0 "[ . 1 . 2]" 1
1104 2 4 LYS QB 2 8 ALA H 6.300 . 6.300 4.878 4.292 5.189 . 0 0 "[ . 1 . 2]" 1
1105 2 4 LYS QB 2 8 ALA MB 4.790 . 4.790 4.498 3.808 4.874 0.084 20 0 "[ . 1 . 2]" 1
1106 2 5 ILE H 2 5 ILE HB 4.150 . 4.150 2.569 2.434 2.657 . 0 0 "[ . 1 . 2]" 1
1107 2 5 ILE H 2 5 ILE MD 4.810 . 4.810 3.523 2.152 3.718 . 0 0 "[ . 1 . 2]" 1
1108 2 5 ILE H 2 5 ILE HG12 4.610 . 4.610 3.400 3.247 4.081 . 0 0 "[ . 1 . 2]" 1
1109 2 5 ILE H 2 5 ILE QG 4.030 . 4.030 2.151 1.963 3.477 . 0 0 "[ . 1 . 2]" 1
1110 2 5 ILE H 2 5 ILE HG13 4.610 . 4.610 2.185 1.979 3.767 . 0 0 "[ . 1 . 2]" 1
1111 2 5 ILE H 2 5 ILE MG 4.330 . 4.330 3.826 3.802 3.849 . 0 0 "[ . 1 . 2]" 1
1112 2 5 ILE H 2 6 VAL MG2 4.870 . 4.870 4.081 3.811 4.581 . 0 0 "[ . 1 . 2]" 1
1113 2 5 ILE H 2 7 GLY H 6.300 . 6.300 4.076 3.847 4.289 . 0 0 "[ . 1 . 2]" 1
1114 2 5 ILE HA 2 5 ILE MD 4.270 . 4.270 3.850 2.828 3.946 . 0 0 "[ . 1 . 2]" 1
1115 2 5 ILE HA 2 8 ALA H 5.220 . 5.220 3.625 3.352 3.873 . 0 0 "[ . 1 . 2]" 1
1116 2 5 ILE HA 2 8 ALA MB 4.010 . 4.010 2.958 2.734 3.210 . 0 0 "[ . 1 . 2]" 1
1117 2 5 ILE HA 2 9 ASN H 5.750 . 5.750 4.246 3.743 4.524 . 0 0 "[ . 1 . 2]" 1
1118 2 5 ILE HB 2 6 VAL H 4.730 . 4.730 2.497 2.239 2.737 . 0 0 "[ . 1 . 2]" 1
1119 2 5 ILE HB 2 6 VAL MG1 5.030 . 5.030 3.179 2.777 3.565 . 0 0 "[ . 1 . 2]" 1
1120 2 5 ILE HB 2 7 GLY H 6.300 . 6.300 4.890 4.706 5.124 . 0 0 "[ . 1 . 2]" 1
1121 2 5 ILE HB 2 8 ALA H 6.300 . 6.300 5.700 5.503 5.826 . 0 0 "[ . 1 . 2]" 1
1122 2 5 ILE MD 2 6 VAL MG1 4.980 . 4.980 4.519 4.037 4.962 . 0 0 "[ . 1 . 2]" 1
1123 2 5 ILE MD 2 9 ASN QD 5.420 . 5.420 4.887 4.545 5.539 0.119 13 0 "[ . 1 . 2]" 1
1124 2 5 ILE MG 2 6 VAL H 4.550 . 4.550 3.308 3.001 3.562 . 0 0 "[ . 1 . 2]" 1
1125 2 5 ILE MG 2 6 VAL HA 5.070 . 5.070 3.416 3.013 3.638 . 0 0 "[ . 1 . 2]" 1
1126 2 5 ILE MG 2 6 VAL MG1 4.730 . 4.730 3.408 2.879 3.829 . 0 0 "[ . 1 . 2]" 1
1127 2 5 ILE MG 2 7 GLY H 5.650 . 5.650 4.925 4.791 5.089 . 0 0 "[ . 1 . 2]" 1
1128 2 5 ILE MG 2 8 ALA H 6.300 . 6.300 4.827 4.563 5.052 . 0 0 "[ . 1 . 2]" 1
1129 2 5 ILE MG 2 8 ALA MB 3.920 . 3.920 3.847 3.484 4.076 0.156 16 0 "[ . 1 . 2]" 1
1130 2 5 ILE MG 2 9 ASN H 5.580 . 5.580 4.118 3.780 4.297 . 0 0 "[ . 1 . 2]" 1
1131 2 5 ILE MG 2 9 ASN HD21 4.770 . 4.770 2.853 2.075 4.188 . 0 0 "[ . 1 . 2]" 1
1132 2 5 ILE MG 2 9 ASN QD 4.070 . 4.070 2.317 1.903 2.959 . 0 0 "[ . 1 . 2]" 1
1133 2 5 ILE MG 2 9 ASN HD22 4.770 . 4.770 2.624 1.977 4.452 . 0 0 "[ . 1 . 2]" 1
1134 2 6 VAL H 2 6 VAL MG1 4.780 . 4.780 2.173 1.965 2.383 . 0 0 "[ . 1 . 2]" 1
1135 2 6 VAL H 2 6 VAL MG2 3.940 . 3.940 2.240 2.061 2.665 . 0 0 "[ . 1 . 2]" 1
1136 2 6 VAL H 2 7 GLY H 4.770 . 4.770 2.683 2.612 2.786 . 0 0 "[ . 1 . 2]" 1
1137 2 6 VAL HA 2 8 ALA H 6.300 . 6.300 4.506 4.254 4.743 . 0 0 "[ . 1 . 2]" 1
1138 2 6 VAL HA 2 9 ASN H 5.600 . 5.600 3.484 3.143 4.065 . 0 0 "[ . 1 . 2]" 1
1139 2 6 VAL HA 2 9 ASN HB2 5.970 . 5.970 2.867 2.218 4.916 . 0 0 "[ . 1 . 2]" 1
1140 2 6 VAL HA 2 9 ASN QB 5.070 . 5.070 2.693 2.204 4.246 . 0 0 "[ . 1 . 2]" 1
1141 2 6 VAL HA 2 9 ASN HB3 5.970 . 5.970 4.051 2.268 4.927 . 0 0 "[ . 1 . 2]" 1
1142 2 6 VAL HA 2 9 ASN HD21 6.300 . 6.300 3.395 1.974 4.871 . 0 0 "[ . 1 . 2]" 1
1143 2 6 VAL HA 2 9 ASN HD22 6.300 . 6.300 4.299 2.140 5.770 . 0 0 "[ . 1 . 2]" 1
1144 2 6 VAL HA 2 41 LEU MD1 4.780 . 4.780 3.984 3.053 4.859 0.079 4 0 "[ . 1 . 2]" 1
1145 2 6 VAL HA 2 42 ALA H 6.300 . 6.300 5.632 4.899 6.226 . 0 0 "[ . 1 . 2]" 1
1146 2 6 VAL HA 2 42 ALA HA 4.890 . 4.890 4.049 3.343 4.706 . 0 0 "[ . 1 . 2]" 1
1147 2 6 VAL HA 2 42 ALA MB 5.610 . 5.610 3.711 3.113 4.174 . 0 0 "[ . 1 . 2]" 1
1148 2 6 VAL HB 2 7 GLY H 5.170 . 5.170 4.005 3.903 4.157 . 0 0 "[ . 1 . 2]" 1
1149 2 6 VAL HB 2 41 LEU MD2 3.990 . 3.990 3.551 2.615 4.331 0.341 5 0 "[ . 1 . 2]" 1
1150 2 6 VAL HB 2 45 TRP QB 6.040 . 6.040 2.901 2.132 3.600 . 0 0 "[ . 1 . 2]" 1
1151 2 6 VAL HB 2 45 TRP HE3 6.010 . 6.010 4.384 3.566 5.158 . 0 0 "[ . 1 . 2]" 1
1152 2 6 VAL MG1 2 7 GLY H 5.350 . 5.350 4.024 3.836 4.153 . 0 0 "[ . 1 . 2]" 1
1153 2 6 VAL MG1 2 9 ASN H 6.300 . 6.300 5.279 4.984 5.680 . 0 0 "[ . 1 . 2]" 1
1154 2 6 VAL MG1 2 9 ASN QB 6.100 . 6.100 4.248 3.688 5.245 . 0 0 "[ . 1 . 2]" 1
1155 2 6 VAL MG1 2 9 ASN HD21 6.300 . 6.300 4.302 2.896 5.913 . 0 0 "[ . 1 . 2]" 1
1156 2 6 VAL MG1 2 9 ASN HD22 6.300 . 6.300 4.901 2.666 6.316 0.016 7 0 "[ . 1 . 2]" 1
1157 2 6 VAL MG1 2 10 ALA MB 5.020 . 5.020 5.054 4.583 5.176 0.156 14 0 "[ . 1 . 2]" 1
1158 2 6 VAL MG1 2 41 LEU H 6.300 . 6.300 6.106 5.146 6.468 0.168 15 0 "[ . 1 . 2]" 1
1159 2 6 VAL MG1 2 41 LEU HB2 5.740 . 5.740 5.032 4.035 5.498 . 0 0 "[ . 1 . 2]" 1
1160 2 6 VAL MG1 2 41 LEU HB3 5.740 . 5.740 4.289 2.737 5.584 . 0 0 "[ . 1 . 2]" 1
1161 2 6 VAL MG1 2 41 LEU MD1 3.560 . 3.560 2.079 1.730 3.026 . 0 0 "[ . 1 . 2]" 1
1162 2 6 VAL MG1 2 41 LEU HG 5.600 . 5.600 4.022 3.754 4.343 . 0 0 "[ . 1 . 2]" 1
1163 2 6 VAL MG1 2 42 ALA H 5.890 . 5.890 4.904 3.876 5.332 . 0 0 "[ . 1 . 2]" 1
1164 2 6 VAL MG1 2 42 ALA HA 4.260 . 4.260 4.100 3.502 4.466 0.206 6 0 "[ . 1 . 2]" 1
1165 2 6 VAL MG1 2 42 ALA MB 4.360 . 4.360 4.211 3.463 4.480 0.120 11 0 "[ . 1 . 2]" 1
1166 2 6 VAL MG1 2 45 TRP QB 5.050 . 5.050 4.065 3.482 4.485 . 0 0 "[ . 1 . 2]" 1
1167 2 6 VAL MG1 2 45 TRP HE3 4.830 . 4.830 4.682 4.044 5.004 0.174 18 0 "[ . 1 . 2]" 1
1168 2 6 VAL MG1 2 45 TRP HZ3 5.820 . 5.820 5.501 4.823 5.841 0.021 16 0 "[ . 1 . 2]" 1
1169 2 6 VAL MG2 2 7 GLY H 5.230 . 5.230 2.390 2.293 2.507 . 0 0 "[ . 1 . 2]" 1
1170 2 6 VAL MG2 2 8 ALA H 6.300 . 6.300 4.620 4.521 4.757 . 0 0 "[ . 1 . 2]" 1
1171 2 6 VAL MG2 2 45 TRP H 6.300 . 6.300 5.202 4.370 5.870 . 0 0 "[ . 1 . 2]" 1
1172 2 6 VAL MG2 2 45 TRP HE1 6.030 . 6.030 4.113 3.175 5.165 . 0 0 "[ . 1 . 2]" 1
1173 2 6 VAL MG2 2 45 TRP HZ3 4.790 . 4.790 3.586 3.117 4.017 . 0 0 "[ . 1 . 2]" 1
1174 2 7 GLY H 2 8 ALA H 4.690 . 4.690 2.708 2.632 2.820 . 0 0 "[ . 1 . 2]" 1
1175 2 7 GLY H 2 8 ALA MB 5.830 . 5.830 4.357 4.278 4.458 . 0 0 "[ . 1 . 2]" 1
1176 2 7 GLY H 2 10 ALA MB 5.920 . 5.920 4.601 4.373 4.918 . 0 0 "[ . 1 . 2]" 1
1177 2 7 GLY QA 2 10 ALA MB 4.320 . 4.320 2.755 2.301 3.373 . 0 0 "[ . 1 . 2]" 1
1178 2 7 GLY QA 2 45 TRP HE1 5.470 . 5.470 2.458 1.889 2.879 . 0 0 "[ . 1 . 2]" 1
1179 2 7 GLY QA 2 45 TRP HZ2 4.710 . 4.710 3.980 3.405 4.577 . 0 0 "[ . 1 . 2]" 1
1180 2 7 GLY HA2 2 10 ALA MB 5.060 . 5.060 2.793 2.320 3.442 . 0 0 "[ . 1 . 2]" 1
1181 2 7 GLY HA2 2 45 TRP HE1 6.270 . 6.270 2.553 1.904 3.089 . 0 0 "[ . 1 . 2]" 1
1182 2 7 GLY HA2 2 45 TRP HZ2 5.410 . 5.410 4.545 3.753 5.248 . 0 0 "[ . 1 . 2]" 1
1183 2 7 GLY HA3 2 10 ALA MB 5.060 . 5.060 4.225 3.795 4.838 . 0 0 "[ . 1 . 2]" 1
1184 2 7 GLY HA3 2 45 TRP HE1 6.270 . 6.270 3.286 2.809 3.754 . 0 0 "[ . 1 . 2]" 1
1185 2 7 GLY HA3 2 45 TRP HZ2 5.410 . 5.410 4.411 3.902 5.042 . 0 0 "[ . 1 . 2]" 1
1186 2 8 ALA H 2 8 ALA MB 3.610 . 3.610 2.243 2.221 2.254 . 0 0 "[ . 1 . 2]" 1
1187 2 8 ALA H 2 9 ASN H 4.460 . 4.460 2.694 2.541 2.821 . 0 0 "[ . 1 . 2]" 1
1188 2 8 ALA H 2 10 ALA H 6.030 . 6.030 4.054 3.885 4.283 . 0 0 "[ . 1 . 2]" 1
1189 2 8 ALA MB 2 9 ASN H 4.140 . 4.140 2.522 2.319 2.815 . 0 0 "[ . 1 . 2]" 1
1190 2 9 ASN H 2 10 ALA H 4.570 . 4.570 2.637 2.388 2.829 . 0 0 "[ . 1 . 2]" 1
1191 2 9 ASN H 2 34 LEU MD1 6.300 . 6.300 4.964 4.456 6.094 . 0 0 "[ . 1 . 2]" 1
1192 2 9 ASN HA 2 12 LYS H 5.270 . 5.270 3.575 2.917 3.983 . 0 0 "[ . 1 . 2]" 1
1193 2 9 ASN HA 2 12 LYS HB2 5.130 . 5.130 3.655 2.885 4.430 . 0 0 "[ . 1 . 2]" 1
1194 2 9 ASN HA 2 12 LYS QB 4.480 . 4.480 2.915 2.392 3.486 . 0 0 "[ . 1 . 2]" 1
1195 2 9 ASN HA 2 12 LYS HB3 5.130 . 5.130 3.133 2.518 4.868 . 0 0 "[ . 1 . 2]" 1
1196 2 9 ASN HA 2 13 VAL QG 6.180 . 6.180 4.024 3.586 4.639 . 0 0 "[ . 1 . 2]" 1
1197 2 9 ASN HA 2 34 LEU MD1 5.520 . 5.520 3.118 2.173 4.539 . 0 0 "[ . 1 . 2]" 1
1198 2 9 ASN HA 2 34 LEU MD2 6.300 . 6.300 4.346 3.346 5.372 . 0 0 "[ . 1 . 2]" 1
1199 2 9 ASN QB 2 34 LEU MD1 4.400 . 4.400 2.356 1.725 3.857 . 0 0 "[ . 1 . 2]" 1
1200 2 9 ASN QB 2 34 LEU MD2 6.100 . 6.100 3.843 2.235 4.781 . 0 0 "[ . 1 . 2]" 1
1201 2 9 ASN QB 2 42 ALA MB 3.990 . 3.990 2.543 2.086 3.786 . 0 0 "[ . 1 . 2]" 1
1202 2 9 ASN HB2 2 10 ALA H 6.030 . 6.030 3.155 2.655 4.157 . 0 0 "[ . 1 . 2]" 1
1203 2 9 ASN HB3 2 10 ALA H 6.030 . 6.030 3.802 2.558 4.279 . 0 0 "[ . 1 . 2]" 1
1204 2 9 ASN HD21 2 34 LEU MD1 5.680 . 5.680 3.575 2.176 4.654 . 0 0 "[ . 1 . 2]" 1
1205 2 9 ASN HD22 2 34 LEU MD1 5.680 . 5.680 3.795 1.947 4.555 . 0 0 "[ . 1 . 2]" 1
1206 2 10 ALA H 2 11 GLY H 4.830 . 4.830 2.549 2.473 2.661 . 0 0 "[ . 1 . 2]" 1
1207 2 10 ALA HA 2 13 VAL HB 4.870 . 4.870 3.172 2.207 4.958 0.088 4 0 "[ . 1 . 2]" 1
1208 2 10 ALA HA 2 13 VAL QG 5.030 . 5.030 2.584 1.770 3.108 . 0 0 "[ . 1 . 2]" 1
1209 2 10 ALA HA 2 14 TRP H 6.050 . 6.050 3.943 3.619 4.218 . 0 0 "[ . 1 . 2]" 1
1210 2 10 ALA HA 2 42 ALA MB 3.840 . 3.840 2.167 1.807 2.805 . 0 0 "[ . 1 . 2]" 1
1211 2 10 ALA HA 2 46 LEU MD1 5.270 . 5.270 3.324 3.014 3.604 . 0 0 "[ . 1 . 2]" 1
1212 2 10 ALA MB 2 11 GLY H 4.400 . 4.400 2.686 2.522 2.965 . 0 0 "[ . 1 . 2]" 1
1213 2 10 ALA MB 2 14 TRP H 6.300 . 6.300 4.495 4.157 4.685 . 0 0 "[ . 1 . 2]" 1
1214 2 10 ALA MB 2 45 TRP QB 5.080 . 5.080 2.237 1.991 2.646 . 0 0 "[ . 1 . 2]" 1
1215 2 10 ALA MB 2 45 TRP HD1 4.530 . 4.530 2.097 1.897 2.488 . 0 0 "[ . 1 . 2]" 1
1216 2 10 ALA MB 2 45 TRP HE1 5.050 . 5.050 3.869 3.611 4.338 . 0 0 "[ . 1 . 2]" 1
1217 2 10 ALA MB 2 46 LEU H 5.280 . 5.280 3.363 3.050 3.745 . 0 0 "[ . 1 . 2]" 1
1218 2 10 ALA MB 2 46 LEU HA 4.830 . 4.830 3.826 3.489 4.163 . 0 0 "[ . 1 . 2]" 1
1219 2 10 ALA MB 2 46 LEU MD2 3.630 . 3.630 2.218 2.093 2.425 . 0 0 "[ . 1 . 2]" 1
1220 2 10 ALA MB 2 46 LEU HG 4.190 . 4.190 2.154 1.803 2.533 . 0 0 "[ . 1 . 2]" 1
1221 2 11 GLY H 2 12 LYS H 4.530 . 4.530 2.689 2.561 2.833 . 0 0 "[ . 1 . 2]" 1
1222 2 11 GLY H 2 13 VAL H 6.020 . 6.020 4.261 4.113 4.569 . 0 0 "[ . 1 . 2]" 1
1223 2 11 GLY QA 2 14 TRP H 5.810 . 5.810 3.661 3.331 3.910 . 0 0 "[ . 1 . 2]" 1
1224 2 11 GLY QA 2 14 TRP QB 5.570 . 5.570 2.937 2.616 3.412 . 0 0 "[ . 1 . 2]" 1
1225 2 12 LYS H 2 12 LYS HG2 5.350 . 5.350 4.443 3.497 4.601 . 0 0 "[ . 1 . 2]" 1
1226 2 12 LYS H 2 12 LYS QG 4.500 . 4.500 3.913 2.342 4.019 . 0 0 "[ . 1 . 2]" 1
1227 2 12 LYS H 2 12 LYS HG3 5.350 . 5.350 4.377 2.380 4.563 . 0 0 "[ . 1 . 2]" 1
1228 2 12 LYS H 2 13 VAL H 4.600 . 4.600 2.686 2.531 2.857 . 0 0 "[ . 1 . 2]" 1
1229 2 12 LYS H 2 13 VAL HA 6.300 . 6.300 5.327 5.211 5.470 . 0 0 "[ . 1 . 2]" 1
1230 2 12 LYS H 2 13 VAL QG 5.750 . 5.750 4.006 3.658 4.344 . 0 0 "[ . 1 . 2]" 1
1231 2 12 LYS H 2 14 TRP H 6.200 . 6.200 4.161 3.951 4.304 . 0 0 "[ . 1 . 2]" 1
1232 2 12 LYS H 2 14 TRP QB 6.300 . 6.300 5.037 4.840 5.343 . 0 0 "[ . 1 . 2]" 1
1233 2 12 LYS H 2 15 HIS QB 6.300 . 6.300 4.838 4.537 5.432 . 0 0 "[ . 1 . 2]" 1
1234 2 12 LYS H 2 32 VAL MG1 6.300 . 6.300 5.467 4.837 6.043 . 0 0 "[ . 1 . 2]" 1
1235 2 12 LYS HA 2 12 LYS QE 5.730 . 5.730 4.630 2.955 5.230 . 0 0 "[ . 1 . 2]" 1
1236 2 12 LYS HA 2 15 HIS QB 4.610 . 4.610 2.733 2.368 3.177 . 0 0 "[ . 1 . 2]" 1
1237 2 12 LYS HA 2 15 HIS HD2 5.760 . 5.760 5.098 4.114 5.843 0.083 13 0 "[ . 1 . 2]" 1
1238 2 12 LYS QB 2 13 VAL QG 5.460 . 5.460 3.197 2.856 3.646 . 0 0 "[ . 1 . 2]" 1
1239 2 12 LYS QB 2 32 VAL MG1 5.150 . 5.150 3.785 2.154 4.269 . 0 0 "[ . 1 . 2]" 1
1240 2 12 LYS QB 2 32 VAL MG2 4.840 . 4.840 4.443 3.498 4.863 0.023 9 0 "[ . 1 . 2]" 1
1241 2 12 LYS QB 2 34 LEU MD1 5.210 . 5.210 3.416 2.666 4.155 . 0 0 "[ . 1 . 2]" 1
1242 2 12 LYS HB2 2 34 LEU MD1 6.000 . 6.000 4.612 3.675 5.542 . 0 0 "[ . 1 . 2]" 1
1243 2 12 LYS HB3 2 34 LEU MD1 6.000 . 6.000 3.567 2.710 4.733 . 0 0 "[ . 1 . 2]" 1
1244 2 12 LYS QD 2 32 VAL HA 4.680 . 4.680 3.357 2.368 4.250 . 0 0 "[ . 1 . 2]" 1
1245 2 12 LYS QD 2 32 VAL HB 5.150 . 5.150 2.661 2.012 3.380 . 0 0 "[ . 1 . 2]" 1
1246 2 12 LYS QD 2 32 VAL MG1 4.700 . 4.700 3.714 3.113 4.499 . 0 0 "[ . 1 . 2]" 1
1247 2 12 LYS QD 2 32 VAL MG2 4.890 . 4.890 3.831 3.050 4.429 . 0 0 "[ . 1 . 2]" 1
1248 2 12 LYS QD 2 34 LEU MD1 4.870 . 4.870 3.086 1.850 4.638 . 0 0 "[ . 1 . 2]" 1
1249 2 12 LYS QD 2 34 LEU MD2 5.410 . 5.410 3.503 2.432 5.350 . 0 0 "[ . 1 . 2]" 1
1250 2 12 LYS QE 2 32 VAL HA 4.740 . 4.740 3.660 1.953 4.888 0.148 11 0 "[ . 1 . 2]" 1
1251 2 12 LYS QE 2 34 LEU MD1 6.050 . 6.050 4.375 3.568 5.290 . 0 0 "[ . 1 . 2]" 1
1252 2 12 LYS QE 2 34 LEU MD2 6.300 . 6.300 4.027 2.696 5.241 . 0 0 "[ . 1 . 2]" 1
1253 2 12 LYS QG 2 13 VAL H 6.100 . 6.100 3.657 3.188 4.045 . 0 0 "[ . 1 . 2]" 1
1254 2 12 LYS QG 2 32 VAL HB 5.440 . 5.440 2.504 1.753 3.928 . 0 0 "[ . 1 . 2]" 1
1255 2 12 LYS HG2 2 32 VAL HA 5.460 . 5.460 3.380 2.709 4.495 . 0 0 "[ . 1 . 2]" 1
1256 2 12 LYS HG3 2 32 VAL HA 5.460 . 5.460 4.264 3.290 5.365 . 0 0 "[ . 1 . 2]" 1
1257 2 13 VAL H 2 13 VAL QG 4.140 . 4.140 2.146 1.920 2.376 . 0 0 "[ . 1 . 2]" 1
1258 2 13 VAL H 2 14 TRP H 5.020 . 5.020 2.723 2.607 2.835 . 0 0 "[ . 1 . 2]" 1
1259 2 13 VAL H 2 16 ALA MB 6.300 . 6.300 5.015 4.768 5.640 . 0 0 "[ . 1 . 2]" 1
1260 2 13 VAL H 2 42 ALA MB 6.300 . 6.300 4.248 3.907 4.810 . 0 0 "[ . 1 . 2]" 1
1261 2 13 VAL HA 2 15 HIS H 6.240 . 6.240 4.433 4.302 4.667 . 0 0 "[ . 1 . 2]" 1
1262 2 13 VAL HA 2 16 ALA H 5.320 . 5.320 3.584 3.285 3.933 . 0 0 "[ . 1 . 2]" 1
1263 2 13 VAL HA 2 16 ALA MB 4.440 . 4.440 2.918 2.618 3.581 . 0 0 "[ . 1 . 2]" 1
1264 2 13 VAL HA 2 17 LEU H 6.300 . 6.300 4.690 3.974 5.619 . 0 0 "[ . 1 . 2]" 1
1265 2 13 VAL HA 2 32 VAL MG1 4.190 . 4.190 1.882 1.587 2.947 . 0 0 "[ . 1 . 2]" 1
1266 2 13 VAL HA 2 32 VAL MG2 5.840 . 5.840 3.628 3.045 4.107 . 0 0 "[ . 1 . 2]" 1
1267 2 13 VAL HB 2 14 TRP H 5.160 . 5.160 3.049 2.524 4.222 . 0 0 "[ . 1 . 2]" 1
1268 2 13 VAL HB 2 39 THR MG 5.310 . 5.310 3.966 2.177 4.859 . 0 0 "[ . 1 . 2]" 1
1269 2 13 VAL HB 2 42 ALA MB 5.480 . 5.480 3.525 2.978 4.224 . 0 0 "[ . 1 . 2]" 1
1270 2 13 VAL QG 2 14 TRP H 4.800 . 4.800 2.902 2.295 3.292 . 0 0 "[ . 1 . 2]" 1
1271 2 13 VAL QG 2 34 LEU MD1 4.170 . 4.170 2.601 2.207 3.824 . 0 0 "[ . 1 . 2]" 1
1272 2 13 VAL QG 2 42 ALA MB 3.530 . 3.530 2.128 1.941 2.680 . 0 0 "[ . 1 . 2]" 1
1273 2 13 VAL MG1 2 14 TRP H 5.460 . 5.460 3.448 2.350 4.079 . 0 0 "[ . 1 . 2]" 1
1274 2 13 VAL MG2 2 14 TRP H 5.460 . 5.460 3.531 2.308 4.032 . 0 0 "[ . 1 . 2]" 1
1275 2 14 TRP H 2 14 TRP HD1 5.630 . 5.630 4.862 4.743 4.972 . 0 0 "[ . 1 . 2]" 1
1276 2 14 TRP H 2 15 HIS H 4.900 . 4.900 2.655 2.575 2.807 . 0 0 "[ . 1 . 2]" 1
1277 2 14 TRP H 2 16 ALA H 6.300 . 6.300 4.181 3.981 4.445 . 0 0 "[ . 1 . 2]" 1
1278 2 14 TRP H 2 16 ALA MB 6.300 . 6.300 4.884 4.642 5.223 . 0 0 "[ . 1 . 2]" 1
1279 2 14 TRP H 2 42 ALA MB 6.300 . 6.300 5.268 4.932 5.838 . 0 0 "[ . 1 . 2]" 1
1280 2 14 TRP H 2 46 LEU MD1 5.020 . 5.020 2.680 2.373 2.967 . 0 0 "[ . 1 . 2]" 1
1281 2 14 TRP H 2 46 LEU MD2 5.920 . 5.920 3.586 3.391 3.822 . 0 0 "[ . 1 . 2]" 1
1282 2 14 TRP HA 2 14 TRP HD1 4.550 . 4.550 3.114 2.955 3.314 . 0 0 "[ . 1 . 2]" 1
1283 2 14 TRP HA 2 14 TRP HE3 4.660 . 4.660 4.459 4.246 4.640 . 0 0 "[ . 1 . 2]" 1
1284 2 14 TRP HA 2 17 LEU QB 5.830 . 5.830 2.599 1.971 3.608 . 0 0 "[ . 1 . 2]" 1
1285 2 14 TRP HA 2 17 LEU MD1 4.750 . 4.750 2.214 1.732 3.190 . 0 0 "[ . 1 . 2]" 1
1286 2 14 TRP HA 2 17 LEU HG 6.220 . 6.220 2.967 2.443 4.006 . 0 0 "[ . 1 . 2]" 1
1287 2 14 TRP HA 2 46 LEU MD1 5.280 . 5.280 2.779 2.523 3.003 . 0 0 "[ . 1 . 2]" 1
1288 2 14 TRP HA 2 52 VAL MG1 5.040 . 5.040 3.950 3.482 4.445 . 0 0 "[ . 1 . 2]" 1
1289 2 14 TRP QB 2 15 HIS H 4.630 . 4.630 2.773 2.573 2.888 . 0 0 "[ . 1 . 2]" 1
1290 2 14 TRP QB 2 46 LEU MD1 4.910 . 4.910 2.061 1.990 2.151 . 0 0 "[ . 1 . 2]" 1
1291 2 14 TRP QB 2 46 LEU MD2 4.650 . 4.650 2.126 1.993 2.264 . 0 0 "[ . 1 . 2]" 1
1292 2 14 TRP HD1 2 17 LEU MD1 4.820 . 4.820 2.631 2.219 3.498 . 0 0 "[ . 1 . 2]" 1
1293 2 14 TRP HD1 2 46 LEU QB 5.710 . 5.710 3.137 2.793 3.764 . 0 0 "[ . 1 . 2]" 1
1294 2 14 TRP HD1 2 46 LEU MD1 4.980 . 4.980 2.067 1.692 2.590 . 0 0 "[ . 1 . 2]" 1
1295 2 14 TRP HD1 2 46 LEU MD2 4.560 . 4.560 2.755 2.367 3.319 . 0 0 "[ . 1 . 2]" 1
1296 2 14 TRP HD1 2 51 LYS H 5.520 . 5.520 5.490 5.173 5.616 0.096 15 0 "[ . 1 . 2]" 1
1297 2 14 TRP HD1 2 51 LYS QB 4.680 . 4.680 2.929 2.447 3.649 . 0 0 "[ . 1 . 2]" 1
1298 2 14 TRP HD1 2 51 LYS QD 6.100 . 6.100 4.688 3.230 5.747 . 0 0 "[ . 1 . 2]" 1
1299 2 14 TRP HD1 2 51 LYS QE 5.800 . 5.800 3.666 2.939 5.005 . 0 0 "[ . 1 . 2]" 1
1300 2 14 TRP HD1 2 52 VAL MG1 5.120 . 5.120 2.399 1.957 3.083 . 0 0 "[ . 1 . 2]" 1
1301 2 14 TRP HE1 2 17 LEU MD1 6.300 . 6.300 3.625 2.978 4.368 . 0 0 "[ . 1 . 2]" 1
1302 2 14 TRP HE1 2 46 LEU MD1 6.300 . 6.300 4.395 4.021 4.895 . 0 0 "[ . 1 . 2]" 1
1303 2 14 TRP HE1 2 46 LEU MD2 6.270 . 6.270 4.349 4.011 4.826 . 0 0 "[ . 1 . 2]" 1
1304 2 14 TRP HE1 2 51 LYS QB 5.210 . 5.210 2.102 1.929 2.426 . 0 0 "[ . 1 . 2]" 1
1305 2 14 TRP HE1 2 51 LYS HD2 6.300 . 6.300 4.960 3.923 5.891 . 0 0 "[ . 1 . 2]" 1
1306 2 14 TRP HE1 2 51 LYS QD 5.550 . 5.550 4.335 3.130 4.925 . 0 0 "[ . 1 . 2]" 1
1307 2 14 TRP HE1 2 51 LYS HD3 6.300 . 6.300 5.151 3.180 5.837 . 0 0 "[ . 1 . 2]" 1
1308 2 14 TRP HE1 2 51 LYS QE 5.290 . 5.290 3.421 2.519 4.214 . 0 0 "[ . 1 . 2]" 1
1309 2 14 TRP HE1 2 51 LYS HG2 6.300 . 6.300 4.334 3.312 5.141 . 0 0 "[ . 1 . 2]" 1
1310 2 14 TRP HE1 2 51 LYS HG3 6.300 . 6.300 4.895 3.326 5.276 . 0 0 "[ . 1 . 2]" 1
1311 2 14 TRP HE1 2 52 VAL MG1 6.300 . 6.300 3.485 2.915 4.601 . 0 0 "[ . 1 . 2]" 1
1312 2 14 TRP HE3 2 15 HIS H 5.880 . 5.880 3.634 3.149 3.897 . 0 0 "[ . 1 . 2]" 1
1313 2 14 TRP HE3 2 15 HIS HA 4.740 . 4.740 3.256 2.589 3.628 . 0 0 "[ . 1 . 2]" 1
1314 2 14 TRP HE3 2 17 LEU MD1 5.210 . 5.210 5.321 5.131 5.478 0.268 13 0 "[ . 1 . 2]" 1
1315 2 14 TRP HE3 2 46 LEU MD1 5.210 . 5.210 5.377 5.294 5.464 0.254 12 0 "[ . 1 . 2]" 1
1316 2 14 TRP HE3 2 46 LEU MD2 5.340 . 5.340 4.934 4.639 5.236 . 0 0 "[ . 1 . 2]" 1
1317 2 14 TRP HE3 2 51 LYS QE 6.300 . 6.300 4.618 3.955 5.670 . 0 0 "[ . 1 . 2]" 1
1318 2 14 TRP HH2 2 51 LYS QE 6.300 . 6.300 4.966 3.858 6.191 . 0 0 "[ . 1 . 2]" 1
1319 2 14 TRP HZ2 2 51 LYS QE 5.500 . 5.500 4.045 3.151 5.174 . 0 0 "[ . 1 . 2]" 1
1320 2 15 HIS H 2 16 ALA H 4.410 . 4.410 2.723 2.625 2.832 . 0 0 "[ . 1 . 2]" 1
1321 2 15 HIS H 2 16 ALA MB 6.170 . 6.170 4.392 4.264 4.484 . 0 0 "[ . 1 . 2]" 1
1322 2 15 HIS H 2 46 LEU MD1 6.010 . 6.010 4.756 4.546 4.971 . 0 0 "[ . 1 . 2]" 1
1323 2 15 HIS H 2 46 LEU MD2 6.150 . 6.150 5.219 5.004 5.455 . 0 0 "[ . 1 . 2]" 1
1324 2 15 HIS HA 2 18 ASN H 5.730 . 5.730 3.394 3.128 3.760 . 0 0 "[ . 1 . 2]" 1
1325 2 15 HIS HA 2 18 ASN HB2 5.620 . 5.620 3.408 2.876 5.434 . 0 0 "[ . 1 . 2]" 1
1326 2 15 HIS HA 2 18 ASN QB 4.850 . 4.850 2.871 2.333 4.240 . 0 0 "[ . 1 . 2]" 1
1327 2 15 HIS HA 2 18 ASN HB3 5.620 . 5.620 3.344 2.453 4.679 . 0 0 "[ . 1 . 2]" 1
1328 2 15 HIS HA 2 18 ASN QD 5.800 . 5.800 4.515 1.831 5.623 . 0 0 "[ . 1 . 2]" 1
1329 2 15 HIS QB 2 16 ALA H 4.590 . 4.590 2.683 2.475 2.901 . 0 0 "[ . 1 . 2]" 1
1330 2 16 ALA H 2 17 LEU H 4.770 . 4.770 2.642 2.515 2.797 . 0 0 "[ . 1 . 2]" 1
1331 2 16 ALA H 2 17 LEU MD1 5.830 . 5.830 5.363 4.975 5.949 0.119 3 0 "[ . 1 . 2]" 1
1332 2 16 ALA H 2 18 ASN QB 5.970 . 5.970 5.068 4.694 6.191 0.221 11 0 "[ . 1 . 2]" 1
1333 2 16 ALA H 2 32 VAL MG1 6.070 . 6.070 3.741 3.342 4.116 . 0 0 "[ . 1 . 2]" 1
1334 2 16 ALA MB 2 17 LEU H 4.590 . 4.590 2.758 2.641 2.883 . 0 0 "[ . 1 . 2]" 1
1335 2 16 ALA MB 2 32 VAL H 6.300 . 6.300 4.556 4.090 5.384 . 0 0 "[ . 1 . 2]" 1
1336 2 16 ALA MB 2 32 VAL HA 5.630 . 5.630 4.392 3.821 5.647 0.017 6 0 "[ . 1 . 2]" 1
1337 2 16 ALA MB 2 32 VAL MG1 3.300 . 3.300 2.305 2.045 2.822 . 0 0 "[ . 1 . 2]" 1
1338 2 17 LEU H 2 17 LEU MD1 5.260 . 5.260 3.705 3.527 4.111 . 0 0 "[ . 1 . 2]" 1
1339 2 17 LEU H 2 17 LEU MD2 5.300 . 5.300 3.639 3.147 4.279 . 0 0 "[ . 1 . 2]" 1
1340 2 17 LEU H 2 17 LEU HG 5.100 . 5.100 2.847 2.205 4.614 . 0 0 "[ . 1 . 2]" 1
1341 2 17 LEU H 2 18 ASN H 4.910 . 4.910 2.645 2.512 2.838 . 0 0 "[ . 1 . 2]" 1
1342 2 17 LEU HA 2 17 LEU MD2 4.000 . 4.000 2.137 1.993 2.383 . 0 0 "[ . 1 . 2]" 1
1343 2 17 LEU HA 2 21 ASP QB 6.100 . 6.100 3.950 2.414 5.942 . 0 0 "[ . 1 . 2]" 1
1344 2 17 LEU QB 2 65 ASN QB 5.900 . 5.900 3.462 1.800 5.975 0.075 16 0 "[ . 1 . 2]" 1
1345 2 17 LEU HB2 2 18 ASN H 5.780 . 5.780 2.984 2.427 4.141 . 0 0 "[ . 1 . 2]" 1
1346 2 17 LEU HB3 2 18 ASN H 5.780 . 5.780 3.503 2.782 4.001 . 0 0 "[ . 1 . 2]" 1
1347 2 17 LEU MD1 2 18 ASN H 5.930 . 5.930 4.332 3.059 4.999 . 0 0 "[ . 1 . 2]" 1
1348 2 17 LEU MD1 2 52 VAL HB 5.810 . 5.810 3.778 3.505 4.336 . 0 0 "[ . 1 . 2]" 1
1349 2 17 LEU MD1 2 65 ASN HA 5.940 . 5.940 2.848 1.790 4.109 . 0 0 "[ . 1 . 2]" 1
1350 2 17 LEU MD1 2 65 ASN QB 5.960 . 5.960 3.609 1.993 5.213 . 0 0 "[ . 1 . 2]" 1
1351 2 17 LEU MD1 2 65 ASN HD21 6.300 . 6.300 4.312 1.947 5.979 . 0 0 "[ . 1 . 2]" 1
1352 2 17 LEU MD1 2 65 ASN HD22 6.300 . 6.300 4.472 2.249 6.090 . 0 0 "[ . 1 . 2]" 1
1353 2 17 LEU MD1 2 66 GLU H 6.300 . 6.300 4.412 3.102 5.682 . 0 0 "[ . 1 . 2]" 1
1354 2 17 LEU MD2 2 18 ASN H 6.300 . 6.300 4.661 4.130 4.852 . 0 0 "[ . 1 . 2]" 1
1355 2 17 LEU MD2 2 21 ASP H 5.800 . 5.800 4.773 4.336 5.754 . 0 0 "[ . 1 . 2]" 1
1356 2 17 LEU MD2 2 21 ASP HA 4.510 . 4.510 2.584 1.980 3.685 . 0 0 "[ . 1 . 2]" 1
1357 2 17 LEU MD2 2 21 ASP QB 4.810 . 4.810 3.168 1.997 4.819 0.009 7 0 "[ . 1 . 2]" 1
1358 2 17 LEU MD2 2 22 GLY H 5.500 . 5.500 3.373 2.714 4.647 . 0 0 "[ . 1 . 2]" 1
1359 2 17 LEU MD2 2 23 ILE H 5.900 . 5.900 3.777 2.818 4.539 . 0 0 "[ . 1 . 2]" 1
1360 2 17 LEU MD2 2 65 ASN H 6.300 . 6.300 3.849 2.854 4.595 . 0 0 "[ . 1 . 2]" 1
1361 2 17 LEU MD2 2 65 ASN QB 5.070 . 5.070 4.071 2.987 5.212 0.142 10 0 "[ . 1 . 2]" 1
1362 2 17 LEU MD2 2 65 ASN HD21 6.300 . 6.300 4.848 3.159 6.143 . 0 0 "[ . 1 . 2]" 1
1363 2 17 LEU MD2 2 65 ASN HD22 6.300 . 6.300 4.975 2.627 6.496 0.196 20 0 "[ . 1 . 2]" 1
1364 2 18 ASN H 2 18 ASN QD 5.590 . 5.590 3.844 1.879 4.539 . 0 0 "[ . 1 . 2]" 1
1365 2 18 ASN H 2 65 ASN QD 6.020 . 6.020 3.898 2.893 4.740 . 0 0 "[ . 1 . 2]" 1
1366 2 18 ASN HA 2 65 ASN HD21 5.470 . 5.470 3.109 1.904 4.961 . 0 0 "[ . 1 . 2]" 1
1367 2 18 ASN HA 2 65 ASN HD22 5.470 . 5.470 3.090 1.846 5.088 . 0 0 "[ . 1 . 2]" 1
1368 2 19 GLU H 2 19 GLU HG2 5.020 . 5.020 3.454 1.862 4.633 . 0 0 "[ . 1 . 2]" 1
1369 2 19 GLU H 2 19 GLU HG3 5.020 . 5.020 3.832 2.242 4.619 . 0 0 "[ . 1 . 2]" 1
1370 2 19 GLU H 2 20 ALA MB 5.460 . 5.460 4.664 4.339 4.897 . 0 0 "[ . 1 . 2]" 1
1371 2 19 GLU QB 2 20 ALA H 4.590 . 4.590 2.723 2.099 3.658 . 0 0 "[ . 1 . 2]" 1
1372 2 19 GLU QB 2 20 ALA MB 4.760 . 4.760 3.535 3.183 3.917 . 0 0 "[ . 1 . 2]" 1
1373 2 19 GLU QG 2 20 ALA MB 5.260 . 5.260 3.388 2.545 5.106 . 0 0 "[ . 1 . 2]" 1
1374 2 19 GLU HG2 2 20 ALA H 5.920 . 5.920 3.860 2.735 4.947 . 0 0 "[ . 1 . 2]" 1
1375 2 19 GLU HG3 2 20 ALA H 5.920 . 5.920 3.944 2.558 4.817 . 0 0 "[ . 1 . 2]" 1
1376 2 20 ALA H 2 21 ASP H 4.850 . 4.850 3.856 3.423 4.357 . 0 0 "[ . 1 . 2]" 1
1377 2 20 ALA H 2 23 ILE MG 6.140 . 6.140 5.123 4.441 5.592 . 0 0 "[ . 1 . 2]" 1
1378 2 20 ALA MB 2 21 ASP H 4.050 . 4.050 3.370 2.641 3.651 . 0 0 "[ . 1 . 2]" 1
1379 2 20 ALA MB 2 21 ASP HA 5.090 . 5.090 4.417 4.133 4.604 . 0 0 "[ . 1 . 2]" 1
1380 2 20 ALA MB 2 23 ILE MD 5.450 . 5.450 3.852 2.452 4.719 . 0 0 "[ . 1 . 2]" 1
1381 2 20 ALA MB 2 23 ILE MG 5.240 . 5.240 4.113 2.993 5.033 . 0 0 "[ . 1 . 2]" 1
1382 2 20 ALA MB 2 31 LYS QE 5.160 . 5.160 3.852 2.134 5.171 0.011 6 0 "[ . 1 . 2]" 1
1383 2 21 ASP QB 2 22 GLY H 4.550 . 4.550 2.347 2.047 3.514 . 0 0 "[ . 1 . 2]" 1
1384 2 21 ASP HB2 2 22 GLY H 5.370 . 5.370 2.515 2.072 4.108 . 0 0 "[ . 1 . 2]" 1
1385 2 21 ASP HB2 2 65 ASN H 6.070 . 6.070 3.036 1.961 4.963 . 0 0 "[ . 1 . 2]" 1
1386 2 21 ASP HB3 2 22 GLY H 5.370 . 5.370 3.576 2.076 4.129 . 0 0 "[ . 1 . 2]" 1
1387 2 21 ASP HB3 2 65 ASN H 6.070 . 6.070 3.402 2.529 5.037 . 0 0 "[ . 1 . 2]" 1
1388 2 22 GLY H 2 23 ILE H 5.030 . 5.030 2.677 2.477 3.007 . 0 0 "[ . 1 . 2]" 1
1389 2 22 GLY H 2 23 ILE MG 5.610 . 5.610 3.524 2.984 3.888 . 0 0 "[ . 1 . 2]" 1
1390 2 22 GLY H 2 64 TYR QD 5.600 . 5.600 3.452 2.604 4.111 . 0 0 "[ . 1 . 2]" 1
1391 2 22 GLY H 2 64 TYR QE 6.300 . 6.300 4.346 2.885 5.194 . 0 0 "[ . 1 . 2]" 1
1392 2 22 GLY H 2 65 ASN H 6.300 . 6.300 4.275 3.778 5.155 . 0 0 "[ . 1 . 2]" 1
1393 2 22 GLY QA 2 64 TYR QD 5.680 . 5.680 3.162 2.626 3.665 . 0 0 "[ . 1 . 2]" 1
1394 2 22 GLY QA 2 64 TYR QE 5.420 . 5.420 2.758 2.265 3.378 . 0 0 "[ . 1 . 2]" 1
1395 2 23 ILE H 2 23 ILE MD 5.510 . 5.510 4.626 4.196 4.970 . 0 0 "[ . 1 . 2]" 1
1396 2 23 ILE H 2 23 ILE MG 4.340 . 4.340 2.144 1.879 2.461 . 0 0 "[ . 1 . 2]" 1
1397 2 23 ILE H 2 63 ILE H 5.210 . 5.210 3.397 2.513 4.284 . 0 0 "[ . 1 . 2]" 1
1398 2 23 ILE HB 2 24 SER H 5.070 . 5.070 4.155 4.044 4.368 . 0 0 "[ . 1 . 2]" 1
1399 2 23 ILE MD 2 24 SER H 5.480 . 5.480 3.644 2.141 4.662 . 0 0 "[ . 1 . 2]" 1
1400 2 23 ILE MD 2 27 GLU H 6.300 . 6.300 4.592 4.259 5.047 . 0 0 "[ . 1 . 2]" 1
1401 2 23 ILE MD 2 27 GLU HB2 4.450 . 4.450 2.985 2.316 4.235 . 0 0 "[ . 1 . 2]" 1
1402 2 23 ILE MD 2 27 GLU HB3 4.450 . 4.450 2.484 1.849 3.219 . 0 0 "[ . 1 . 2]" 1
1403 2 23 ILE MD 2 28 LEU H 4.840 . 4.840 3.232 2.903 4.153 . 0 0 "[ . 1 . 2]" 1
1404 2 23 ILE MD 2 28 LEU HA 4.030 . 4.030 2.827 2.119 4.131 0.101 2 0 "[ . 1 . 2]" 1
1405 2 23 ILE MD 2 28 LEU HB2 6.270 . 6.270 3.118 2.522 4.482 . 0 0 "[ . 1 . 2]" 1
1406 2 23 ILE MD 2 28 LEU HB3 4.660 . 4.660 4.063 2.260 5.464 0.804 2 1 "[ + . 1 . 2]" 1
1407 2 23 ILE MD 2 31 LYS QD 3.810 . 3.810 2.733 1.952 3.841 0.031 9 0 "[ . 1 . 2]" 1
1408 2 23 ILE MD 2 31 LYS QE 4.600 . 4.600 3.384 2.141 4.631 0.031 14 0 "[ . 1 . 2]" 1
1409 2 23 ILE QG 2 27 GLU QB 4.620 . 4.620 2.342 2.042 3.327 . 0 0 "[ . 1 . 2]" 1
1410 2 23 ILE QG 2 28 LEU H 5.420 . 5.420 2.779 2.517 3.143 . 0 0 "[ . 1 . 2]" 1
1411 2 23 ILE QG 2 28 LEU HB3 5.390 . 5.390 3.609 2.517 4.255 . 0 0 "[ . 1 . 2]" 1
1412 2 23 ILE HG12 2 24 SER H 5.840 . 5.840 3.247 2.380 4.594 . 0 0 "[ . 1 . 2]" 1
1413 2 23 ILE HG12 2 27 GLU H 6.300 . 6.300 4.710 4.126 6.221 . 0 0 "[ . 1 . 2]" 1
1414 2 23 ILE HG13 2 24 SER H 5.840 . 5.840 2.772 2.520 3.303 . 0 0 "[ . 1 . 2]" 1
1415 2 23 ILE HG13 2 27 GLU H 6.300 . 6.300 4.986 4.188 5.464 . 0 0 "[ . 1 . 2]" 1
1416 2 23 ILE MG 2 24 SER H 5.400 . 5.400 3.940 3.660 4.252 . 0 0 "[ . 1 . 2]" 1
1417 2 23 ILE MG 2 27 GLU QB 5.430 . 5.430 4.328 3.881 5.255 . 0 0 "[ . 1 . 2]" 1
1418 2 23 ILE MG 2 28 LEU H 5.830 . 5.830 4.069 3.600 5.030 . 0 0 "[ . 1 . 2]" 1
1419 2 23 ILE MG 2 28 LEU HA 5.510 . 5.510 3.736 3.367 4.498 . 0 0 "[ . 1 . 2]" 1
1420 2 23 ILE MG 2 28 LEU HB2 5.490 . 5.490 2.499 2.010 3.316 . 0 0 "[ . 1 . 2]" 1
1421 2 23 ILE MG 2 28 LEU HB3 4.340 . 4.340 3.568 2.229 4.691 0.351 7 0 "[ . 1 . 2]" 1
1422 2 23 ILE MG 2 63 ILE H 5.590 . 5.590 3.927 3.300 5.058 . 0 0 "[ . 1 . 2]" 1
1423 2 24 SER H 2 27 GLU H 6.300 . 6.300 4.671 4.295 4.986 . 0 0 "[ . 1 . 2]" 1
1424 2 24 SER H 2 27 GLU QB 4.450 . 4.450 3.213 2.757 3.680 . 0 0 "[ . 1 . 2]" 1
1425 2 24 SER QB 2 27 GLU H 5.110 . 5.110 3.159 2.725 3.948 . 0 0 "[ . 1 . 2]" 1
1426 2 24 SER QB 2 27 GLU QB 5.130 . 5.130 3.046 2.437 3.789 . 0 0 "[ . 1 . 2]" 1
1427 2 24 SER QB 2 27 GLU QG 5.210 . 5.210 2.935 2.056 4.831 . 0 0 "[ . 1 . 2]" 1
1428 2 24 SER QB 2 28 LEU H 6.100 . 6.100 4.300 3.847 5.058 . 0 0 "[ . 1 . 2]" 1
1429 2 25 ILE H 2 25 ILE MD 5.060 . 5.060 3.593 3.360 3.714 . 0 0 "[ . 1 . 2]" 1
1430 2 25 ILE H 2 25 ILE HG12 5.450 . 5.450 3.271 2.184 3.527 . 0 0 "[ . 1 . 2]" 1
1431 2 25 ILE H 2 25 ILE QG 4.640 . 4.640 2.072 1.975 2.240 . 0 0 "[ . 1 . 2]" 1
1432 2 25 ILE H 2 25 ILE HG13 5.450 . 5.450 2.164 1.989 3.613 . 0 0 "[ . 1 . 2]" 1
1433 2 25 ILE H 2 26 PRO QD 5.630 . 5.630 2.447 2.307 2.659 . 0 0 "[ . 1 . 2]" 1
1434 2 25 ILE HA 2 27 GLU H 6.100 . 6.100 4.411 4.250 4.640 . 0 0 "[ . 1 . 2]" 1
1435 2 25 ILE HA 2 28 LEU HB3 5.250 . 5.250 2.760 2.131 4.827 . 0 0 "[ . 1 . 2]" 1
1436 2 25 ILE HA 2 28 LEU MD2 4.570 . 4.570 2.458 1.857 2.811 . 0 0 "[ . 1 . 2]" 1
1437 2 25 ILE HA 2 28 LEU HG 6.230 . 6.230 4.077 2.431 4.570 . 0 0 "[ . 1 . 2]" 1
1438 2 25 ILE HA 2 39 THR HB 4.950 . 4.950 4.668 3.533 4.954 0.004 2 0 "[ . 1 . 2]" 1
1439 2 25 ILE HA 2 39 THR MG 4.340 . 4.340 3.322 2.864 4.519 0.179 9 0 "[ . 1 . 2]" 1
1440 2 25 ILE HA 2 40 ALA MB 5.470 . 5.470 5.071 4.781 5.340 . 0 0 "[ . 1 . 2]" 1
1441 2 25 ILE HB 2 26 PRO QD 4.770 . 4.770 2.237 2.047 2.412 . 0 0 "[ . 1 . 2]" 1
1442 2 25 ILE MD 2 39 THR HB 5.260 . 5.260 5.071 4.221 5.322 0.062 19 0 "[ . 1 . 2]" 1
1443 2 25 ILE MD 2 40 ALA H 4.950 . 4.950 4.166 3.759 4.493 . 0 0 "[ . 1 . 2]" 1
1444 2 25 ILE MD 2 40 ALA HA 4.140 . 4.140 2.643 1.965 3.387 . 0 0 "[ . 1 . 2]" 1
1445 2 25 ILE MD 2 40 ALA MB 3.720 . 3.720 2.171 1.942 2.673 . 0 0 "[ . 1 . 2]" 1
1446 2 25 ILE MD 2 41 LEU H 5.760 . 5.760 5.291 4.928 5.743 . 0 0 "[ . 1 . 2]" 1
1447 2 25 ILE QG 2 28 LEU MD2 5.040 . 5.040 3.361 2.671 4.275 . 0 0 "[ . 1 . 2]" 1
1448 2 25 ILE QG 2 40 ALA MB 3.980 . 3.980 3.653 2.735 3.898 . 0 0 "[ . 1 . 2]" 1
1449 2 25 ILE HG12 2 40 ALA MB 4.750 . 4.750 3.909 3.705 4.194 . 0 0 "[ . 1 . 2]" 1
1450 2 25 ILE HG13 2 40 ALA MB 4.750 . 4.750 4.541 2.772 4.784 0.034 8 0 "[ . 1 . 2]" 1
1451 2 25 ILE MG 2 26 PRO HA 5.290 . 5.290 3.451 3.242 3.629 . 0 0 "[ . 1 . 2]" 1
1452 2 25 ILE MG 2 26 PRO QB 5.920 . 5.920 4.263 4.004 4.699 . 0 0 "[ . 1 . 2]" 1
1453 2 25 ILE MG 2 26 PRO QD 3.930 . 3.930 3.189 2.907 3.356 . 0 0 "[ . 1 . 2]" 1
1454 2 25 ILE MG 2 26 PRO HG2 5.750 . 5.750 5.384 5.154 5.539 . 0 0 "[ . 1 . 2]" 1
1455 2 25 ILE MG 2 27 GLU H 6.200 . 6.200 4.962 4.822 5.138 . 0 0 "[ . 1 . 2]" 1
1456 2 25 ILE MG 2 29 ALA H 6.090 . 6.090 4.194 4.076 4.482 . 0 0 "[ . 1 . 2]" 1
1457 2 25 ILE MG 2 29 ALA MB 4.170 . 4.170 3.209 2.924 3.358 . 0 0 "[ . 1 . 2]" 1
1458 2 25 ILE MG 2 36 VAL HA 4.870 . 4.870 2.842 2.516 3.087 . 0 0 "[ . 1 . 2]" 1
1459 2 25 ILE MG 2 36 VAL HB 4.450 . 4.450 4.445 4.244 4.596 0.146 15 0 "[ . 1 . 2]" 1
1460 2 25 ILE MG 2 39 THR H 5.380 . 5.380 4.199 3.821 4.415 . 0 0 "[ . 1 . 2]" 1
1461 2 25 ILE MG 2 39 THR HB 5.520 . 5.520 2.598 2.187 2.870 . 0 0 "[ . 1 . 2]" 1
1462 2 25 ILE MG 2 40 ALA H 4.810 . 4.810 2.784 2.371 3.089 . 0 0 "[ . 1 . 2]" 1
1463 2 25 ILE MG 2 40 ALA MB 3.920 . 3.920 1.824 1.657 1.996 . 0 0 "[ . 1 . 2]" 1
1464 2 26 PRO HA 2 28 LEU MD2 5.970 . 5.970 6.076 5.599 6.193 0.223 7 0 "[ . 1 . 2]" 1
1465 2 26 PRO HA 2 29 ALA MB 4.970 . 4.970 2.393 2.199 2.837 . 0 0 "[ . 1 . 2]" 1
1466 2 26 PRO HA 2 36 VAL MG1 4.510 . 4.510 2.969 2.453 3.674 . 0 0 "[ . 1 . 2]" 1
1467 2 26 PRO HA 2 36 VAL MG2 3.870 . 3.870 1.985 1.816 2.288 . 0 0 "[ . 1 . 2]" 1
1468 2 26 PRO QB 2 36 VAL MG1 6.100 . 6.100 2.882 2.497 3.955 . 0 0 "[ . 1 . 2]" 1
1469 2 26 PRO QB 2 36 VAL MG2 4.450 . 4.450 2.282 2.065 3.168 . 0 0 "[ . 1 . 2]" 1
1470 2 26 PRO QD 2 36 VAL MG2 4.940 . 4.940 3.920 3.523 4.366 . 0 0 "[ . 1 . 2]" 1
1471 2 26 PRO HG2 2 27 GLU H 4.730 . 4.730 2.664 2.461 4.050 . 0 0 "[ . 1 . 2]" 1
1472 2 26 PRO HG2 2 28 LEU H 5.930 . 5.930 5.083 4.781 6.118 0.188 5 0 "[ . 1 . 2]" 1
1473 2 26 PRO HG2 2 36 VAL MG2 5.870 . 5.870 4.703 4.548 4.833 . 0 0 "[ . 1 . 2]" 1
1474 2 26 PRO HG3 2 36 VAL MG1 4.280 . 4.280 3.968 3.005 4.352 0.072 11 0 "[ . 1 . 2]" 1
1475 2 26 PRO HG3 2 36 VAL MG2 4.300 . 4.300 4.166 3.445 4.398 0.098 14 0 "[ . 1 . 2]" 1
1476 2 27 GLU H 2 27 GLU QG 4.750 . 4.750 2.760 2.114 4.098 . 0 0 "[ . 1 . 2]" 1
1477 2 27 GLU H 2 28 LEU H 4.680 . 4.680 2.455 2.322 2.777 . 0 0 "[ . 1 . 2]" 1
1478 2 27 GLU H 2 28 LEU MD2 6.300 . 6.300 5.405 4.511 5.631 . 0 0 "[ . 1 . 2]" 1
1479 2 27 GLU H 2 28 LEU HG 6.300 . 6.300 6.158 4.001 6.508 0.208 7 0 "[ . 1 . 2]" 1
1480 2 27 GLU H 2 29 ALA H 6.140 . 6.140 3.695 3.618 3.954 . 0 0 "[ . 1 . 2]" 1
1481 2 27 GLU H 2 36 VAL MG2 6.230 . 6.230 5.087 4.925 5.493 . 0 0 "[ . 1 . 2]" 1
1482 2 27 GLU HA 2 30 ARG QD 5.270 . 5.270 3.180 1.989 5.122 . 0 0 "[ . 1 . 2]" 1
1483 2 27 GLU HA 2 30 ARG HE 6.050 . 6.050 4.523 2.522 5.933 . 0 0 "[ . 1 . 2]" 1
1484 2 27 GLU QB 2 28 LEU H 4.600 . 4.600 2.304 2.108 2.697 . 0 0 "[ . 1 . 2]" 1
1485 2 27 GLU QB 2 28 LEU MD2 5.070 . 5.070 5.200 4.239 5.520 0.450 2 0 "[ . 1 . 2]" 1
1486 2 27 GLU HB2 2 28 LEU H 5.420 . 5.420 2.660 2.130 3.679 . 0 0 "[ . 1 . 2]" 1
1487 2 27 GLU HB3 2 28 LEU H 5.420 . 5.420 3.170 2.285 3.762 . 0 0 "[ . 1 . 2]" 1
1488 2 27 GLU QG 2 29 ALA H 6.300 . 6.300 5.497 5.308 5.748 . 0 0 "[ . 1 . 2]" 1
1489 2 27 GLU QG 2 30 ARG H 6.210 . 6.210 5.709 4.812 6.344 0.134 6 0 "[ . 1 . 2]" 1
1490 2 28 LEU H 2 28 LEU MD1 5.180 . 5.180 4.146 3.734 4.310 . 0 0 "[ . 1 . 2]" 1
1491 2 28 LEU H 2 28 LEU MD2 5.210 . 5.210 3.937 3.068 4.101 . 0 0 "[ . 1 . 2]" 1
1492 2 28 LEU H 2 28 LEU HG 4.700 . 4.700 4.149 2.312 4.420 . 0 0 "[ . 1 . 2]" 1
1493 2 28 LEU H 2 29 ALA H 4.650 . 4.650 2.715 2.463 2.806 . 0 0 "[ . 1 . 2]" 1
1494 2 28 LEU H 2 39 THR MG 5.670 . 5.670 4.660 4.430 5.311 . 0 0 "[ . 1 . 2]" 1
1495 2 28 LEU HA 2 28 LEU MD1 3.910 . 3.910 2.513 2.243 3.757 . 0 0 "[ . 1 . 2]" 1
1496 2 28 LEU HA 2 29 ALA HA 5.620 . 5.620 4.938 4.903 4.979 . 0 0 "[ . 1 . 2]" 1
1497 2 28 LEU HA 2 31 LYS H 5.530 . 5.530 3.481 3.232 3.874 . 0 0 "[ . 1 . 2]" 1
1498 2 28 LEU HA 2 31 LYS HA 6.160 . 6.160 5.485 5.060 5.908 . 0 0 "[ . 1 . 2]" 1
1499 2 28 LEU HA 2 31 LYS QB 5.180 . 5.180 2.918 2.437 4.041 . 0 0 "[ . 1 . 2]" 1
1500 2 28 LEU HA 2 31 LYS QD 5.240 . 5.240 3.094 1.967 4.616 . 0 0 "[ . 1 . 2]" 1
1501 2 28 LEU HB2 2 29 ALA H 5.090 . 5.090 3.960 3.831 4.241 . 0 0 "[ . 1 . 2]" 1
1502 2 28 LEU HB2 2 39 THR MG 5.470 . 5.470 4.196 4.013 4.634 . 0 0 "[ . 1 . 2]" 1
1503 2 28 LEU HB3 2 29 ALA H 5.090 . 5.090 2.814 2.513 4.144 . 0 0 "[ . 1 . 2]" 1
1504 2 28 LEU HB3 2 39 THR MG 4.680 . 4.680 3.177 2.716 5.501 0.821 9 1 "[ . +1 . 2]" 1
1505 2 28 LEU MD1 2 29 ALA H 5.320 . 5.320 4.336 2.691 4.576 . 0 0 "[ . 1 . 2]" 1
1506 2 28 LEU MD1 2 30 ARG H 6.300 . 6.300 5.601 4.749 5.833 . 0 0 "[ . 1 . 2]" 1
1507 2 28 LEU MD2 2 29 ALA H 5.820 . 5.820 4.194 3.707 4.369 . 0 0 "[ . 1 . 2]" 1
1508 2 28 LEU MD2 2 29 ALA HA 6.090 . 6.090 4.950 4.736 5.475 . 0 0 "[ . 1 . 2]" 1
1509 2 28 LEU MD2 2 39 THR HA 5.790 . 5.790 5.101 4.842 5.697 . 0 0 "[ . 1 . 2]" 1
1510 2 28 LEU MD2 2 39 THR HB 6.300 . 6.300 4.435 3.847 4.945 . 0 0 "[ . 1 . 2]" 1
1511 2 28 LEU MD2 2 40 ALA H 6.000 . 6.000 5.599 5.118 6.129 0.129 9 0 "[ . 1 . 2]" 1
1512 2 28 LEU HG 2 39 THR MG 4.090 . 4.090 2.339 2.090 3.934 . 0 0 "[ . 1 . 2]" 1
1513 2 29 ALA H 2 30 ARG H 4.790 . 4.790 2.785 2.707 2.893 . 0 0 "[ . 1 . 2]" 1
1514 2 29 ALA H 2 31 LYS H 6.300 . 6.300 4.196 4.040 4.504 . 0 0 "[ . 1 . 2]" 1
1515 2 29 ALA H 2 32 VAL H 6.300 . 6.300 4.865 4.760 5.118 . 0 0 "[ . 1 . 2]" 1
1516 2 29 ALA H 2 32 VAL MG2 6.300 . 6.300 3.981 3.871 4.065 . 0 0 "[ . 1 . 2]" 1
1517 2 29 ALA H 2 36 VAL MG2 5.720 . 5.720 4.714 4.364 4.958 . 0 0 "[ . 1 . 2]" 1
1518 2 29 ALA H 2 39 THR MG 4.860 . 4.860 3.145 2.925 3.647 . 0 0 "[ . 1 . 2]" 1
1519 2 29 ALA HA 2 32 VAL H 5.310 . 5.310 3.595 3.459 3.822 . 0 0 "[ . 1 . 2]" 1
1520 2 29 ALA HA 2 32 VAL MG1 4.900 . 4.900 4.084 3.941 4.244 . 0 0 "[ . 1 . 2]" 1
1521 2 29 ALA HA 2 32 VAL MG2 4.010 . 4.010 2.041 1.926 2.166 . 0 0 "[ . 1 . 2]" 1
1522 2 29 ALA HA 2 34 LEU H 5.130 . 5.130 3.498 3.224 3.617 . 0 0 "[ . 1 . 2]" 1
1523 2 29 ALA HA 2 34 LEU MD1 6.130 . 6.130 4.541 4.193 4.986 . 0 0 "[ . 1 . 2]" 1
1524 2 29 ALA HA 2 39 THR MG 5.320 . 5.320 2.716 1.789 3.365 . 0 0 "[ . 1 . 2]" 1
1525 2 29 ALA MB 2 30 ARG H 4.240 . 4.240 2.584 2.472 2.707 . 0 0 "[ . 1 . 2]" 1
1526 2 29 ALA MB 2 30 ARG QB 4.430 . 4.430 4.219 3.723 4.483 0.053 5 0 "[ . 1 . 2]" 1
1527 2 29 ALA MB 2 30 ARG QG 5.240 . 5.240 3.746 2.992 5.279 0.039 18 0 "[ . 1 . 2]" 1
1528 2 29 ALA MB 2 32 VAL H 6.300 . 6.300 4.736 4.640 4.890 . 0 0 "[ . 1 . 2]" 1
1529 2 29 ALA MB 2 32 VAL MG2 4.460 . 4.460 3.439 3.345 3.553 . 0 0 "[ . 1 . 2]" 1
1530 2 29 ALA MB 2 34 LEU H 5.540 . 5.540 3.889 3.715 4.051 . 0 0 "[ . 1 . 2]" 1
1531 2 29 ALA MB 2 35 SER HA 5.400 . 5.400 3.476 3.125 3.819 . 0 0 "[ . 1 . 2]" 1
1532 2 29 ALA MB 2 36 VAL H 5.590 . 5.590 3.429 3.240 3.696 . 0 0 "[ . 1 . 2]" 1
1533 2 29 ALA MB 2 36 VAL HA 4.220 . 4.220 2.339 2.045 2.649 . 0 0 "[ . 1 . 2]" 1
1534 2 29 ALA MB 2 36 VAL MG1 4.120 . 4.120 3.630 3.264 3.989 . 0 0 "[ . 1 . 2]" 1
1535 2 29 ALA MB 2 36 VAL MG2 3.750 . 3.750 2.712 2.429 2.988 . 0 0 "[ . 1 . 2]" 1
1536 2 29 ALA MB 2 39 THR H 5.650 . 5.650 4.053 3.783 4.309 . 0 0 "[ . 1 . 2]" 1
1537 2 29 ALA MB 2 39 THR MG 4.160 . 4.160 2.851 2.365 3.041 . 0 0 "[ . 1 . 2]" 1
1538 2 30 ARG H 2 30 ARG QB 3.870 . 3.870 2.441 2.213 2.699 . 0 0 "[ . 1 . 2]" 1
1539 2 30 ARG H 2 30 ARG QD 6.220 . 6.220 3.686 2.099 4.777 . 0 0 "[ . 1 . 2]" 1
1540 2 30 ARG H 2 30 ARG HG2 5.070 . 5.070 3.219 1.856 4.504 . 0 0 "[ . 1 . 2]" 1
1541 2 30 ARG H 2 30 ARG QG 4.350 . 4.350 2.542 1.840 3.997 . 0 0 "[ . 1 . 2]" 1
1542 2 30 ARG H 2 30 ARG HG3 5.070 . 5.070 3.112 2.085 4.480 . 0 0 "[ . 1 . 2]" 1
1543 2 30 ARG H 2 31 LYS H 4.350 . 4.350 2.646 2.514 2.796 . 0 0 "[ . 1 . 2]" 1
1544 2 30 ARG H 2 31 LYS QG 6.100 . 6.100 4.176 3.954 4.485 . 0 0 "[ . 1 . 2]" 1
1545 2 30 ARG H 2 32 VAL H 6.070 . 6.070 4.193 4.068 4.324 . 0 0 "[ . 1 . 2]" 1
1546 2 30 ARG H 2 32 VAL MG2 6.300 . 6.300 4.322 4.181 4.441 . 0 0 "[ . 1 . 2]" 1
1547 2 30 ARG H 2 36 VAL MG2 6.300 . 6.300 5.145 4.786 5.739 . 0 0 "[ . 1 . 2]" 1
1548 2 30 ARG H 2 39 THR MG 6.300 . 6.300 5.177 4.803 5.764 . 0 0 "[ . 1 . 2]" 1
1549 2 30 ARG QB 2 30 ARG HE 4.970 . 4.970 3.260 2.040 4.106 . 0 0 "[ . 1 . 2]" 1
1550 2 30 ARG QB 2 31 LYS H 4.740 . 4.740 2.855 2.482 3.674 . 0 0 "[ . 1 . 2]" 1
1551 2 30 ARG HG2 2 31 LYS H 5.790 . 5.790 4.396 2.526 5.213 . 0 0 "[ . 1 . 2]" 1
1552 2 30 ARG HG3 2 31 LYS H 5.790 . 5.790 4.328 2.468 5.237 . 0 0 "[ . 1 . 2]" 1
1553 2 31 LYS H 2 31 LYS QD 4.920 . 4.920 3.879 3.213 4.395 . 0 0 "[ . 1 . 2]" 1
1554 2 31 LYS H 2 31 LYS QE 5.500 . 5.500 4.638 3.689 5.133 . 0 0 "[ . 1 . 2]" 1
1555 2 31 LYS H 2 31 LYS HG2 5.000 . 5.000 3.144 2.106 3.700 . 0 0 "[ . 1 . 2]" 1
1556 2 31 LYS H 2 31 LYS QG 4.280 . 4.280 2.266 2.093 2.440 . 0 0 "[ . 1 . 2]" 1
1557 2 31 LYS H 2 31 LYS HG3 5.000 . 5.000 2.620 2.162 3.775 . 0 0 "[ . 1 . 2]" 1
1558 2 31 LYS H 2 32 VAL MG1 6.140 . 6.140 4.225 4.051 4.408 . 0 0 "[ . 1 . 2]" 1
1559 2 31 LYS H 2 32 VAL MG2 5.660 . 5.660 3.967 3.770 4.166 . 0 0 "[ . 1 . 2]" 1
1560 2 31 LYS HA 2 31 LYS QD 4.600 . 4.600 3.959 2.195 4.625 0.025 10 0 "[ . 1 . 2]" 1
1561 2 31 LYS HA 2 31 LYS QE 5.090 . 5.090 4.137 2.685 4.571 . 0 0 "[ . 1 . 2]" 1
1562 2 31 LYS HA 2 33 ASN H 5.150 . 5.150 4.022 3.868 4.231 . 0 0 "[ . 1 . 2]" 1
1563 2 31 LYS QB 2 32 VAL H 4.690 . 4.690 2.739 2.499 3.721 . 0 0 "[ . 1 . 2]" 1
1564 2 31 LYS QB 2 32 VAL MG1 4.290 . 4.290 2.887 2.550 3.998 . 0 0 "[ . 1 . 2]" 1
1565 2 31 LYS QB 2 33 ASN H 5.670 . 5.670 4.528 4.384 4.957 . 0 0 "[ . 1 . 2]" 1
1566 2 31 LYS QD 2 32 VAL H 6.300 . 6.300 4.996 4.271 5.630 . 0 0 "[ . 1 . 2]" 1
1567 2 31 LYS QE 2 32 VAL MG1 5.240 . 5.240 4.363 3.348 5.422 0.182 15 0 "[ . 1 . 2]" 1
1568 2 31 LYS HG2 2 32 VAL H 6.300 . 6.300 4.723 3.001 5.238 . 0 0 "[ . 1 . 2]" 1
1569 2 31 LYS HG3 2 32 VAL H 6.300 . 6.300 4.289 2.421 5.024 . 0 0 "[ . 1 . 2]" 1
1570 2 32 VAL H 2 32 VAL MG1 4.210 . 4.210 2.436 2.269 2.655 . 0 0 "[ . 1 . 2]" 1
1571 2 32 VAL H 2 32 VAL MG2 3.730 . 3.730 2.131 2.056 2.237 . 0 0 "[ . 1 . 2]" 1
1572 2 32 VAL H 2 34 LEU HG 6.300 . 6.300 5.240 4.954 5.453 . 0 0 "[ . 1 . 2]" 1
1573 2 32 VAL HA 2 34 LEU MD1 6.300 . 6.300 5.080 4.825 5.382 . 0 0 "[ . 1 . 2]" 1
1574 2 32 VAL HA 2 34 LEU MD2 6.300 . 6.300 5.610 5.325 5.852 . 0 0 "[ . 1 . 2]" 1
1575 2 32 VAL HB 2 33 ASN H 6.300 . 6.300 4.378 4.309 4.447 . 0 0 "[ . 1 . 2]" 1
1576 2 32 VAL HB 2 34 LEU MD1 5.690 . 5.690 3.183 2.879 3.485 . 0 0 "[ . 1 . 2]" 1
1577 2 32 VAL HB 2 34 LEU HG 6.300 . 6.300 3.171 2.799 3.458 . 0 0 "[ . 1 . 2]" 1
1578 2 32 VAL MG2 2 33 ASN H 5.060 . 5.060 3.098 2.947 3.308 . 0 0 "[ . 1 . 2]" 1
1579 2 32 VAL MG2 2 33 ASN QB 6.100 . 6.100 4.414 4.319 4.523 . 0 0 "[ . 1 . 2]" 1
1580 2 32 VAL MG2 2 34 LEU H 4.400 . 4.400 2.113 1.906 2.442 . 0 0 "[ . 1 . 2]" 1
1581 2 32 VAL MG2 2 34 LEU HA 5.390 . 5.390 4.151 4.057 4.279 . 0 0 "[ . 1 . 2]" 1
1582 2 32 VAL MG2 2 34 LEU QB 5.590 . 5.590 2.234 2.112 2.419 . 0 0 "[ . 1 . 2]" 1
1583 2 32 VAL MG2 2 34 LEU MD1 3.640 . 3.640 2.362 2.106 2.571 . 0 0 "[ . 1 . 2]" 1
1584 2 32 VAL MG2 2 34 LEU HG 4.250 . 4.250 2.273 1.993 2.480 . 0 0 "[ . 1 . 2]" 1
1585 2 32 VAL MG2 2 39 THR HA 6.220 . 6.220 3.811 3.444 4.529 . 0 0 "[ . 1 . 2]" 1
1586 2 33 ASN H 2 34 LEU H 4.340 . 4.340 2.722 2.644 2.846 . 0 0 "[ . 1 . 2]" 1
1587 2 33 ASN HB2 2 34 LEU MD2 6.300 . 6.300 4.720 3.830 5.572 . 0 0 "[ . 1 . 2]" 1
1588 2 33 ASN HB3 2 34 LEU MD2 6.300 . 6.300 4.217 3.381 4.972 . 0 0 "[ . 1 . 2]" 1
1589 2 34 LEU H 2 34 LEU MD2 5.230 . 5.230 3.592 3.297 3.772 . 0 0 "[ . 1 . 2]" 1
1590 2 34 LEU H 2 34 LEU HG 5.380 . 5.380 2.724 2.527 3.012 . 0 0 "[ . 1 . 2]" 1
1591 2 34 LEU H 2 35 SER H 5.900 . 5.900 4.569 4.495 4.617 . 0 0 "[ . 1 . 2]" 1
1592 2 34 LEU HA 2 34 LEU MD2 3.750 . 3.750 2.170 2.119 2.215 . 0 0 "[ . 1 . 2]" 1
1593 2 34 LEU HA 2 38 SER QB 5.570 . 5.570 4.044 3.717 5.112 . 0 0 "[ . 1 . 2]" 1
1594 2 34 LEU QB 2 38 SER H 6.100 . 6.100 4.482 4.263 4.711 . 0 0 "[ . 1 . 2]" 1
1595 2 34 LEU QB 2 38 SER HA 5.400 . 5.400 4.815 4.557 5.073 . 0 0 "[ . 1 . 2]" 1
1596 2 34 LEU QB 2 39 THR H 6.100 . 6.100 3.552 3.293 4.009 . 0 0 "[ . 1 . 2]" 1
1597 2 34 LEU HB2 2 35 SER H 5.490 . 5.490 3.625 3.379 3.803 . 0 0 "[ . 1 . 2]" 1
1598 2 34 LEU HB2 2 38 SER HA 6.130 . 6.130 6.140 5.920 6.215 0.085 9 0 "[ . 1 . 2]" 1
1599 2 34 LEU HB3 2 35 SER H 5.490 . 5.490 2.536 2.297 2.804 . 0 0 "[ . 1 . 2]" 1
1600 2 34 LEU HB3 2 38 SER HA 6.130 . 6.130 5.035 4.729 5.384 . 0 0 "[ . 1 . 2]" 1
1601 2 34 LEU MD1 2 35 SER H 5.640 . 5.640 4.573 4.339 4.780 . 0 0 "[ . 1 . 2]" 1
1602 2 34 LEU MD1 2 38 SER HA 5.080 . 5.080 4.870 4.444 5.142 0.062 9 0 "[ . 1 . 2]" 1
1603 2 34 LEU MD1 2 38 SER QB 6.100 . 6.100 3.158 2.693 3.612 . 0 0 "[ . 1 . 2]" 1
1604 2 34 LEU MD1 2 39 THR H 6.110 . 6.110 4.277 3.618 4.800 . 0 0 "[ . 1 . 2]" 1
1605 2 34 LEU MD1 2 39 THR HA 5.210 . 5.210 3.092 2.360 4.087 . 0 0 "[ . 1 . 2]" 1
1606 2 34 LEU MD1 2 39 THR MG 5.210 . 5.210 3.640 2.838 4.065 . 0 0 "[ . 1 . 2]" 1
1607 2 34 LEU MD1 2 42 ALA H 6.300 . 6.300 5.141 4.357 5.961 . 0 0 "[ . 1 . 2]" 1
1608 2 34 LEU MD1 2 42 ALA MB 5.280 . 5.280 3.304 2.684 3.865 . 0 0 "[ . 1 . 2]" 1
1609 2 34 LEU MD2 2 35 SER H 4.600 . 4.600 3.648 3.534 3.812 . 0 0 "[ . 1 . 2]" 1
1610 2 34 LEU MD2 2 38 SER HB2 5.420 . 5.420 4.124 3.397 4.660 . 0 0 "[ . 1 . 2]" 1
1611 2 34 LEU MD2 2 38 SER QB 4.560 . 4.560 3.441 2.754 4.073 . 0 0 "[ . 1 . 2]" 1
1612 2 34 LEU MD2 2 38 SER HB3 5.420 . 5.420 3.718 2.911 5.145 . 0 0 "[ . 1 . 2]" 1
1613 2 35 SER H 2 36 VAL H 6.290 . 6.290 4.674 4.631 4.702 . 0 0 "[ . 1 . 2]" 1
1614 2 35 SER H 2 38 SER HA 5.710 . 5.710 5.574 5.368 5.784 0.074 12 0 "[ . 1 . 2]" 1
1615 2 35 SER H 2 38 SER QB 5.330 . 5.330 2.672 2.430 3.697 . 0 0 "[ . 1 . 2]" 1
1616 2 35 SER HA 2 36 VAL HB 5.800 . 5.800 4.945 4.735 5.070 . 0 0 "[ . 1 . 2]" 1
1617 2 35 SER HA 2 36 VAL MG2 4.890 . 4.890 3.693 3.612 3.900 . 0 0 "[ . 1 . 2]" 1
1618 2 35 SER HA 2 37 GLU H 5.380 . 5.380 4.546 4.314 4.834 . 0 0 "[ . 1 . 2]" 1
1619 2 35 SER HA 2 38 SER H 5.970 . 5.970 4.683 4.496 5.050 . 0 0 "[ . 1 . 2]" 1
1620 2 35 SER QB 2 36 VAL H 5.220 . 5.220 3.034 2.441 3.528 . 0 0 "[ . 1 . 2]" 1
1621 2 35 SER QB 2 37 GLU H 5.800 . 5.800 3.330 2.748 3.726 . 0 0 "[ . 1 . 2]" 1
1622 2 36 VAL H 2 36 VAL HB 4.390 . 4.390 2.601 2.475 2.677 . 0 0 "[ . 1 . 2]" 1
1623 2 36 VAL H 2 36 VAL MG1 4.640 . 4.640 3.824 3.789 3.845 . 0 0 "[ . 1 . 2]" 1
1624 2 36 VAL H 2 36 VAL MG2 3.890 . 3.890 1.993 1.900 2.104 . 0 0 "[ . 1 . 2]" 1
1625 2 36 VAL H 2 37 GLU H 4.830 . 4.830 2.880 2.771 3.032 . 0 0 "[ . 1 . 2]" 1
1626 2 36 VAL H 2 37 GLU HB2 6.170 . 6.170 5.045 4.899 5.308 . 0 0 "[ . 1 . 2]" 1
1627 2 36 VAL H 2 39 THR H 6.300 . 6.300 4.853 4.790 5.036 . 0 0 "[ . 1 . 2]" 1
1628 2 36 VAL HA 2 37 GLU HA 5.500 . 5.500 4.898 4.798 4.953 . 0 0 "[ . 1 . 2]" 1
1629 2 36 VAL HA 2 38 SER H 6.300 . 6.300 4.617 4.251 4.834 . 0 0 "[ . 1 . 2]" 1
1630 2 36 VAL HA 2 39 THR H 5.550 . 5.550 3.712 3.445 3.842 . 0 0 "[ . 1 . 2]" 1
1631 2 36 VAL HA 2 39 THR HB 5.610 . 5.610 3.012 2.676 4.552 . 0 0 "[ . 1 . 2]" 1
1632 2 36 VAL HA 2 40 ALA H 6.270 . 6.270 4.124 3.909 4.348 . 0 0 "[ . 1 . 2]" 1
1633 2 36 VAL HB 2 37 GLU H 4.440 . 4.440 2.478 2.281 2.626 . 0 0 "[ . 1 . 2]" 1
1634 2 36 VAL MG1 2 37 GLU H 4.510 . 4.510 3.347 2.997 3.547 . 0 0 "[ . 1 . 2]" 1
1635 2 36 VAL MG1 2 37 GLU HA 4.500 . 4.500 3.559 3.159 3.744 . 0 0 "[ . 1 . 2]" 1
1636 2 36 VAL MG1 2 37 GLU QG . . 4.320 3.670 3.102 3.896 . 0 0 "[ . 1 . 2]" 1
1637 2 36 VAL MG1 2 38 SER H 5.650 . 5.650 5.168 4.848 5.331 . 0 0 "[ . 1 . 2]" 1
1638 2 36 VAL MG1 2 39 THR H 6.300 . 6.300 4.906 4.652 5.042 . 0 0 "[ . 1 . 2]" 1
1639 2 36 VAL MG1 2 39 THR HB 4.840 . 4.840 4.228 3.981 5.067 0.227 9 0 "[ . 1 . 2]" 1
1640 2 36 VAL MG2 2 37 GLU H 4.730 . 4.730 3.798 3.680 3.899 . 0 0 "[ . 1 . 2]" 1
1641 2 36 VAL MG2 2 40 ALA MB 5.890 . 5.890 5.359 5.105 5.552 . 0 0 "[ . 1 . 2]" 1
1642 2 37 GLU H 2 37 GLU QG 4.690 . 4.690 2.233 1.978 3.174 . 0 0 "[ . 1 . 2]" 1
1643 2 37 GLU H 2 38 SER H 4.970 . 4.970 2.785 2.615 2.883 . 0 0 "[ . 1 . 2]" 1
1644 2 37 GLU H 2 40 ALA MB 6.300 . 6.300 4.735 4.504 4.881 . 0 0 "[ . 1 . 2]" 1
1645 2 37 GLU HA 2 40 ALA H 5.160 . 5.160 3.669 3.162 4.120 . 0 0 "[ . 1 . 2]" 1
1646 2 37 GLU HA 2 40 ALA MB 4.300 . 4.300 2.801 2.252 3.170 . 0 0 "[ . 1 . 2]" 1
1647 2 37 GLU HA 2 41 LEU H 6.300 . 6.300 4.085 3.741 4.432 . 0 0 "[ . 1 . 2]" 1
1648 2 37 GLU HB2 2 38 SER H 5.240 . 5.240 2.573 2.325 2.893 . 0 0 "[ . 1 . 2]" 1
1649 2 37 GLU HB2 2 39 THR H 6.300 . 6.300 5.003 4.796 5.273 . 0 0 "[ . 1 . 2]" 1
1650 2 37 GLU HB3 2 38 SER H 5.170 . 5.170 3.652 3.409 3.941 . 0 0 "[ . 1 . 2]" 1
1651 2 37 GLU HB3 2 40 ALA MB 5.280 . 5.280 4.643 3.940 5.094 . 0 0 "[ . 1 . 2]" 1
1652 2 37 GLU QG 2 38 SER H 5.720 . 5.720 4.104 3.891 4.596 . 0 0 "[ . 1 . 2]" 1
1653 2 37 GLU QG 2 40 ALA MB . . 4.880 4.461 3.800 4.840 . 0 0 "[ . 1 . 2]" 1
1654 2 38 SER H 2 39 THR H 4.670 . 4.670 2.673 2.569 2.789 . 0 0 "[ . 1 . 2]" 1
1655 2 38 SER H 2 39 THR HA 6.300 . 6.300 5.335 5.250 5.436 . 0 0 "[ . 1 . 2]" 1
1656 2 38 SER H 2 40 ALA MB 6.300 . 6.300 4.967 4.733 5.170 . 0 0 "[ . 1 . 2]" 1
1657 2 38 SER HA 2 40 ALA MB 5.880 . 5.880 5.302 5.036 5.555 . 0 0 "[ . 1 . 2]" 1
1658 2 38 SER HA 2 41 LEU H 6.300 . 6.300 3.991 3.565 4.613 . 0 0 "[ . 1 . 2]" 1
1659 2 38 SER HA 2 41 LEU MD1 5.270 . 5.270 3.221 2.411 3.657 . 0 0 "[ . 1 . 2]" 1
1660 2 39 THR H 2 40 ALA H 4.630 . 4.630 2.626 2.441 2.741 . 0 0 "[ . 1 . 2]" 1
1661 2 39 THR H 2 40 ALA MB 6.300 . 6.300 4.272 4.145 4.343 . 0 0 "[ . 1 . 2]" 1
1662 2 39 THR HA 2 42 ALA H 5.860 . 5.860 3.508 3.149 4.063 . 0 0 "[ . 1 . 2]" 1
1663 2 39 THR HA 2 42 ALA MB 4.780 . 4.780 2.552 2.239 2.914 . 0 0 "[ . 1 . 2]" 1
1664 2 39 THR HA 2 43 VAL H 6.300 . 6.300 4.245 3.837 4.673 . 0 0 "[ . 1 . 2]" 1
1665 2 39 THR HB 2 40 ALA H 4.610 . 4.610 2.636 2.387 3.507 . 0 0 "[ . 1 . 2]" 1
1666 2 39 THR HB 2 40 ALA MB 5.230 . 5.230 4.039 3.793 4.838 . 0 0 "[ . 1 . 2]" 1
1667 2 39 THR MG 2 40 ALA H 5.060 . 5.060 3.465 3.292 4.123 . 0 0 "[ . 1 . 2]" 1
1668 2 39 THR MG 2 43 VAL H 5.840 . 5.840 4.243 3.998 5.240 . 0 0 "[ . 1 . 2]" 1
1669 2 40 ALA H 2 41 LEU H 4.670 . 4.670 2.736 2.544 2.930 . 0 0 "[ . 1 . 2]" 1
1670 2 40 ALA HA 2 43 VAL H 5.510 . 5.510 3.510 3.273 3.839 . 0 0 "[ . 1 . 2]" 1
1671 2 40 ALA HA 2 43 VAL HB 5.310 . 5.310 2.881 2.354 4.999 . 0 0 "[ . 1 . 2]" 1
1672 2 40 ALA HA 2 43 VAL MG2 4.210 . 4.210 2.806 2.060 3.533 . 0 0 "[ . 1 . 2]" 1
1673 2 40 ALA MB 2 41 LEU H 4.280 . 4.280 2.524 2.328 2.688 . 0 0 "[ . 1 . 2]" 1
1674 2 40 ALA MB 2 41 LEU HA 5.590 . 5.590 3.966 3.849 4.056 . 0 0 "[ . 1 . 2]" 1
1675 2 40 ALA MB 2 41 LEU QB 5.580 . 5.580 3.734 3.499 3.870 . 0 0 "[ . 1 . 2]" 1
1676 2 40 ALA MB 2 42 ALA H 5.750 . 5.750 4.564 4.321 4.779 . 0 0 "[ . 1 . 2]" 1
1677 2 40 ALA MB 2 43 VAL H 6.140 . 6.140 4.645 4.496 4.860 . 0 0 "[ . 1 . 2]" 1
1678 2 41 LEU H 2 41 LEU MD1 4.630 . 4.630 3.911 2.374 4.224 . 0 0 "[ . 1 . 2]" 1
1679 2 41 LEU H 2 41 LEU MD2 4.760 . 4.760 4.276 4.124 4.396 . 0 0 "[ . 1 . 2]" 1
1680 2 41 LEU H 2 41 LEU HG 4.850 . 4.850 4.389 3.965 4.649 . 0 0 "[ . 1 . 2]" 1
1681 2 41 LEU H 2 42 ALA H 4.730 . 4.730 2.668 2.544 2.748 . 0 0 "[ . 1 . 2]" 1
1682 2 41 LEU H 2 42 ALA MB 5.710 . 5.710 4.332 4.246 4.414 . 0 0 "[ . 1 . 2]" 1
1683 2 41 LEU H 2 43 VAL H 6.280 . 6.280 4.088 3.906 4.282 . 0 0 "[ . 1 . 2]" 1
1684 2 41 LEU H 2 43 VAL MG2 5.700 . 5.700 4.887 4.260 5.300 . 0 0 "[ . 1 . 2]" 1
1685 2 41 LEU H 2 44 GLY H 6.300 . 6.300 4.780 4.481 5.203 . 0 0 "[ . 1 . 2]" 1
1686 2 41 LEU HA 2 41 LEU MD1 4.260 . 4.260 3.710 3.516 3.936 . 0 0 "[ . 1 . 2]" 1
1687 2 41 LEU HA 2 41 LEU MD2 3.840 . 3.840 2.523 2.237 3.545 . 0 0 "[ . 1 . 2]" 1
1688 2 41 LEU HA 2 43 VAL H 6.300 . 6.300 4.378 4.041 4.606 . 0 0 "[ . 1 . 2]" 1
1689 2 41 LEU HA 2 44 GLY H 4.960 . 4.960 3.407 3.005 3.621 . 0 0 "[ . 1 . 2]" 1
1690 2 41 LEU HA 2 44 GLY HA2 5.750 . 5.750 5.314 4.791 5.735 . 0 0 "[ . 1 . 2]" 1
1691 2 41 LEU HA 2 44 GLY HA3 5.500 . 5.500 3.819 3.284 4.215 . 0 0 "[ . 1 . 2]" 1
1692 2 41 LEU QB 2 42 ALA H 4.530 . 4.530 2.703 2.279 3.703 . 0 0 "[ . 1 . 2]" 1
1693 2 41 LEU MD1 2 42 ALA H 5.110 . 5.110 3.408 1.898 4.362 . 0 0 "[ . 1 . 2]" 1
1694 2 41 LEU MD1 2 42 ALA MB 4.880 . 4.880 3.792 2.681 4.831 . 0 0 "[ . 1 . 2]" 1
1695 2 41 LEU MD1 2 43 VAL H 5.880 . 5.880 5.411 4.329 6.294 0.414 16 0 "[ . 1 . 2]" 1
1696 2 41 LEU MD2 2 42 ALA H 5.490 . 5.490 4.004 3.321 4.331 . 0 0 "[ . 1 . 2]" 1
1697 2 41 LEU MD2 2 44 GLY H 4.600 . 4.600 4.403 3.954 4.775 0.175 3 0 "[ . 1 . 2]" 1
1698 2 41 LEU MD2 2 44 GLY HA3 5.120 . 5.120 4.102 3.325 4.904 . 0 0 "[ . 1 . 2]" 1
1699 2 41 LEU HG 2 42 ALA H 5.820 . 5.820 4.971 4.551 5.214 . 0 0 "[ . 1 . 2]" 1
1700 2 42 ALA H 2 43 VAL H 4.500 . 4.500 2.686 2.591 2.781 . 0 0 "[ . 1 . 2]" 1
1701 2 42 ALA H 2 43 VAL HA 6.300 . 6.300 5.340 5.256 5.402 . 0 0 "[ . 1 . 2]" 1
1702 2 42 ALA H 2 43 VAL MG2 5.440 . 5.440 4.212 3.994 4.353 . 0 0 "[ . 1 . 2]" 1
1703 2 42 ALA HA 2 45 TRP H 4.890 . 4.890 3.287 3.011 3.798 . 0 0 "[ . 1 . 2]" 1
1704 2 42 ALA MB 2 43 VAL H 4.180 . 4.180 2.695 2.540 2.829 . 0 0 "[ . 1 . 2]" 1
1705 2 42 ALA MB 2 43 VAL HA 5.540 . 5.540 4.055 3.952 4.140 . 0 0 "[ . 1 . 2]" 1
1706 2 42 ALA MB 2 44 GLY H 6.300 . 6.300 4.587 4.430 4.758 . 0 0 "[ . 1 . 2]" 1
1707 2 43 VAL H 2 43 VAL MG2 3.830 . 3.830 2.257 2.028 2.396 . 0 0 "[ . 1 . 2]" 1
1708 2 43 VAL HA 2 46 LEU H 5.630 . 5.630 3.210 3.052 3.427 . 0 0 "[ . 1 . 2]" 1
1709 2 43 VAL HA 2 46 LEU MD1 4.730 . 4.730 2.310 2.028 2.800 . 0 0 "[ . 1 . 2]" 1
1710 2 43 VAL HA 2 46 LEU HG 5.630 . 5.630 3.055 2.506 3.593 . 0 0 "[ . 1 . 2]" 1
1711 2 43 VAL HA 2 47 ALA H 6.020 . 6.020 4.271 4.024 4.746 . 0 0 "[ . 1 . 2]" 1
1712 2 43 VAL HA 2 52 VAL MG2 5.390 . 5.390 3.787 3.055 4.513 . 0 0 "[ . 1 . 2]" 1
1713 2 43 VAL HB 2 44 GLY H 5.130 . 5.130 2.872 2.612 4.031 . 0 0 "[ . 1 . 2]" 1
1714 2 43 VAL MG1 2 45 TRP H 6.300 . 6.300 5.016 4.836 5.437 . 0 0 "[ . 1 . 2]" 1
1715 2 43 VAL MG1 2 47 ALA H 5.730 . 5.730 4.098 3.579 5.741 0.011 5 0 "[ . 1 . 2]" 1
1716 2 43 VAL MG2 2 44 GLY H 5.250 . 5.250 3.932 2.426 4.106 . 0 0 "[ . 1 . 2]" 1
1717 2 44 GLY H 2 45 TRP H 4.910 . 4.910 2.717 2.603 2.866 . 0 0 "[ . 1 . 2]" 1
1718 2 44 GLY H 2 46 LEU H 6.300 . 6.300 4.138 3.979 4.284 . 0 0 "[ . 1 . 2]" 1
1719 2 44 GLY H 2 47 ALA MB 6.130 . 6.130 4.549 4.292 4.934 . 0 0 "[ . 1 . 2]" 1
1720 2 44 GLY HA2 2 47 ALA H 5.950 . 5.950 3.248 3.052 3.536 . 0 0 "[ . 1 . 2]" 1
1721 2 44 GLY HA2 2 47 ALA MB 4.770 . 4.770 2.358 2.084 2.740 . 0 0 "[ . 1 . 2]" 1
1722 2 44 GLY HA2 2 54 ILE MD 5.740 . 5.740 4.530 3.510 5.811 0.071 19 0 "[ . 1 . 2]" 1
1723 2 44 GLY HA3 2 47 ALA MB 5.310 . 5.310 3.706 3.485 3.977 . 0 0 "[ . 1 . 2]" 1
1724 2 45 TRP H 2 46 LEU H 4.980 . 4.980 2.576 2.534 2.649 . 0 0 "[ . 1 . 2]" 1
1725 2 45 TRP H 2 47 ALA H 6.290 . 6.290 3.974 3.828 4.160 . 0 0 "[ . 1 . 2]" 1
1726 2 45 TRP H 2 47 ALA MB 5.990 . 5.990 4.568 4.425 4.744 . 0 0 "[ . 1 . 2]" 1
1727 2 45 TRP HA 2 48 ARG H 5.450 . 5.450 3.384 3.010 3.734 . 0 0 "[ . 1 . 2]" 1
1728 2 45 TRP HA 2 48 ARG QB 4.910 . 4.910 3.120 2.050 4.695 . 0 0 "[ . 1 . 2]" 1
1729 2 45 TRP QB 2 47 ALA H 6.100 . 6.100 4.845 4.762 5.009 . 0 0 "[ . 1 . 2]" 1
1730 2 45 TRP HB2 2 46 LEU H 5.860 . 5.860 4.009 3.889 4.144 . 0 0 "[ . 1 . 2]" 1
1731 2 45 TRP HB3 2 46 LEU H 5.860 . 5.860 2.873 2.720 3.049 . 0 0 "[ . 1 . 2]" 1
1732 2 45 TRP HD1 2 46 LEU H 6.130 . 6.130 4.375 3.860 4.666 . 0 0 "[ . 1 . 2]" 1
1733 2 45 TRP HD1 2 46 LEU HA 5.160 . 5.160 4.348 3.750 4.794 . 0 0 "[ . 1 . 2]" 1
1734 2 45 TRP HD1 2 46 LEU MD2 4.740 . 4.740 3.488 2.591 3.946 . 0 0 "[ . 1 . 2]" 1
1735 2 45 TRP HD1 2 46 LEU HG 5.630 . 5.630 4.308 3.638 4.670 . 0 0 "[ . 1 . 2]" 1
1736 2 45 TRP HE1 2 48 ARG QD 6.100 . 6.100 4.465 3.576 5.734 . 0 0 "[ . 1 . 2]" 1
1737 2 45 TRP HE1 2 48 ARG HE 6.300 . 6.300 4.972 3.091 6.439 0.139 15 0 "[ . 1 . 2]" 1
1738 2 45 TRP HE3 2 48 ARG H 5.780 . 5.780 5.819 5.538 6.010 0.230 18 0 "[ . 1 . 2]" 1
1739 2 46 LEU H 2 46 LEU MD1 5.250 . 5.250 3.675 3.567 3.842 . 0 0 "[ . 1 . 2]" 1
1740 2 46 LEU H 2 46 LEU MD2 5.030 . 5.030 3.445 3.187 3.625 . 0 0 "[ . 1 . 2]" 1
1741 2 46 LEU H 2 46 LEU HG 4.780 . 4.780 2.419 2.231 2.677 . 0 0 "[ . 1 . 2]" 1
1742 2 46 LEU H 2 47 ALA H 4.880 . 4.880 2.582 2.494 2.710 . 0 0 "[ . 1 . 2]" 1
1743 2 46 LEU H 2 52 VAL MG1 5.710 . 5.710 4.709 4.478 5.025 . 0 0 "[ . 1 . 2]" 1
1744 2 46 LEU H 2 52 VAL MG2 5.690 . 5.690 4.235 3.907 4.645 . 0 0 "[ . 1 . 2]" 1
1745 2 46 LEU HA 2 46 LEU MD2 4.020 . 4.020 2.033 1.932 2.116 . 0 0 "[ . 1 . 2]" 1
1746 2 46 LEU HA 2 49 GLU H 5.700 . 5.700 3.406 2.905 3.954 . 0 0 "[ . 1 . 2]" 1
1747 2 46 LEU HA 2 51 LYS H 6.300 . 6.300 4.124 3.789 4.582 . 0 0 "[ . 1 . 2]" 1
1748 2 46 LEU HA 2 51 LYS QB 5.020 . 5.020 3.571 2.711 4.822 . 0 0 "[ . 1 . 2]" 1
1749 2 46 LEU HA 2 51 LYS QD 6.100 . 6.100 4.197 2.816 6.150 0.050 20 0 "[ . 1 . 2]" 1
1750 2 46 LEU HA 2 51 LYS QE 6.090 . 6.090 4.453 2.498 5.627 . 0 0 "[ . 1 . 2]" 1
1751 2 46 LEU HA 2 51 LYS QG 6.100 . 6.100 4.255 2.678 5.324 . 0 0 "[ . 1 . 2]" 1
1752 2 46 LEU QB 2 51 LYS H 6.100 . 6.100 3.741 3.582 4.016 . 0 0 "[ . 1 . 2]" 1
1753 2 46 LEU QB 2 52 VAL MG1 5.580 . 5.580 2.061 1.866 2.485 . 0 0 "[ . 1 . 2]" 1
1754 2 46 LEU QB 2 52 VAL MG2 6.010 . 6.010 2.358 2.058 2.825 . 0 0 "[ . 1 . 2]" 1
1755 2 46 LEU HB2 2 47 ALA H 5.600 . 5.600 2.743 2.597 3.019 . 0 0 "[ . 1 . 2]" 1
1756 2 46 LEU HB3 2 47 ALA H 5.600 . 5.600 3.715 3.598 3.854 . 0 0 "[ . 1 . 2]" 1
1757 2 46 LEU MD2 2 47 ALA H 6.300 . 6.300 4.728 4.630 4.813 . 0 0 "[ . 1 . 2]" 1
1758 2 46 LEU MD2 2 51 LYS H 6.300 . 6.300 4.615 3.994 4.990 . 0 0 "[ . 1 . 2]" 1
1759 2 46 LEU MD2 2 51 LYS HA 6.300 . 6.300 5.510 5.054 6.160 . 0 0 "[ . 1 . 2]" 1
1760 2 46 LEU MD2 2 51 LYS QB 3.820 . 3.820 2.875 2.430 3.839 0.019 12 0 "[ . 1 . 2]" 1
1761 2 46 LEU MD2 2 51 LYS QD 4.690 . 4.690 3.249 1.950 4.628 . 0 0 "[ . 1 . 2]" 1
1762 2 46 LEU MD2 2 51 LYS QE 5.080 . 5.080 2.797 1.977 4.048 . 0 0 "[ . 1 . 2]" 1
1763 2 47 ALA H 2 48 ARG H 4.790 . 4.790 2.824 2.647 3.070 . 0 0 "[ . 1 . 2]" 1
1764 2 47 ALA H 2 49 GLU H 6.150 . 6.150 4.292 4.108 4.493 . 0 0 "[ . 1 . 2]" 1
1765 2 47 ALA H 2 52 VAL MG1 6.300 . 6.300 4.440 3.960 5.026 . 0 0 "[ . 1 . 2]" 1
1766 2 47 ALA H 2 52 VAL MG2 4.750 . 4.750 2.944 2.621 3.340 . 0 0 "[ . 1 . 2]" 1
1767 2 47 ALA H 2 54 ILE MD 6.030 . 6.030 4.785 3.811 5.654 . 0 0 "[ . 1 . 2]" 1
1768 2 47 ALA HA 2 49 GLU H 5.740 . 5.740 4.228 3.904 4.445 . 0 0 "[ . 1 . 2]" 1
1769 2 47 ALA HA 2 50 ASN H 5.210 . 5.210 3.180 2.922 3.424 . 0 0 "[ . 1 . 2]" 1
1770 2 47 ALA HA 2 51 LYS H 6.020 . 6.020 3.873 3.456 4.532 . 0 0 "[ . 1 . 2]" 1
1771 2 47 ALA HA 2 52 VAL H 4.890 . 4.890 3.580 3.017 4.344 . 0 0 "[ . 1 . 2]" 1
1772 2 47 ALA HA 2 52 VAL MG2 3.940 . 3.940 2.553 2.221 2.994 . 0 0 "[ . 1 . 2]" 1
1773 2 47 ALA HA 2 54 ILE MD 5.610 . 5.610 4.603 3.211 5.638 0.028 10 0 "[ . 1 . 2]" 1
1774 2 47 ALA MB 2 48 ARG H 4.390 . 4.390 2.768 2.597 2.929 . 0 0 "[ . 1 . 2]" 1
1775 2 47 ALA MB 2 48 ARG HA 6.220 . 6.220 4.088 3.968 4.180 . 0 0 "[ . 1 . 2]" 1
1776 2 47 ALA MB 2 49 GLU H 5.300 . 5.300 4.630 4.450 4.796 . 0 0 "[ . 1 . 2]" 1
1777 2 47 ALA MB 2 50 ASN H 6.300 . 6.300 4.348 4.142 4.562 . 0 0 "[ . 1 . 2]" 1
1778 2 47 ALA MB 2 52 VAL MG2 3.800 . 3.800 2.723 2.317 3.312 . 0 0 "[ . 1 . 2]" 1
1779 2 48 ARG H 2 49 GLU H 4.740 . 4.740 2.736 2.517 2.890 . 0 0 "[ . 1 . 2]" 1
1780 2 48 ARG H 2 49 GLU HG2 6.300 . 6.300 5.553 3.984 6.339 0.039 9 0 "[ . 1 . 2]" 1
1781 2 48 ARG H 2 49 GLU HG3 6.300 . 6.300 4.948 4.196 6.263 . 0 0 "[ . 1 . 2]" 1
1782 2 48 ARG H 2 52 VAL MG2 5.760 . 5.760 4.876 4.604 5.290 . 0 0 "[ . 1 . 2]" 1
1783 2 48 ARG HA 2 48 ARG QD 5.090 . 5.090 4.260 3.850 4.615 . 0 0 "[ . 1 . 2]" 1
1784 2 48 ARG QD 2 49 GLU QG 5.490 . 5.490 3.358 1.716 4.889 . 0 0 "[ . 1 . 2]" 1
1785 2 48 ARG HE 2 49 GLU HG2 5.720 . 5.720 4.438 3.096 5.740 0.020 15 0 "[ . 1 . 2]" 1
1786 2 48 ARG HE 2 49 GLU QG 4.990 . 4.990 3.792 2.284 5.084 0.094 15 0 "[ . 1 . 2]" 1
1787 2 48 ARG HE 2 49 GLU HG3 5.720 . 5.720 4.420 2.315 5.752 0.032 19 0 "[ . 1 . 2]" 1
1788 2 48 ARG QG 2 49 GLU H 5.350 . 5.350 2.885 2.243 3.913 . 0 0 "[ . 1 . 2]" 1
1789 2 49 GLU H 2 49 GLU HG2 5.350 . 5.350 3.275 2.134 3.957 . 0 0 "[ . 1 . 2]" 1
1790 2 49 GLU H 2 49 GLU QG 4.490 . 4.490 2.395 2.120 2.846 . 0 0 "[ . 1 . 2]" 1
1791 2 49 GLU H 2 49 GLU HG3 5.350 . 5.350 2.836 2.158 3.813 . 0 0 "[ . 1 . 2]" 1
1792 2 49 GLU H 2 50 ASN H 4.600 . 4.600 2.463 2.254 2.592 . 0 0 "[ . 1 . 2]" 1
1793 2 49 GLU H 2 50 ASN HA 5.800 . 5.800 4.639 4.278 4.825 . 0 0 "[ . 1 . 2]" 1
1794 2 49 GLU H 2 51 LYS QG 6.100 . 6.100 4.393 3.510 5.164 . 0 0 "[ . 1 . 2]" 1
1795 2 49 GLU HA 2 51 LYS H 6.300 . 6.300 4.666 4.515 4.811 . 0 0 "[ . 1 . 2]" 1
1796 2 49 GLU HA 2 51 LYS QD 6.100 . 6.100 4.939 4.230 5.652 . 0 0 "[ . 1 . 2]" 1
1797 2 49 GLU QB 2 51 LYS H 5.610 . 5.610 2.981 2.388 3.212 . 0 0 "[ . 1 . 2]" 1
1798 2 49 GLU QB 2 51 LYS QD 5.530 . 5.530 2.532 1.869 3.272 . 0 0 "[ . 1 . 2]" 1
1799 2 49 GLU QB 2 51 LYS QE 4.740 . 4.740 3.432 1.809 4.361 . 0 0 "[ . 1 . 2]" 1
1800 2 49 GLU QB 2 51 LYS QG 4.690 . 4.690 2.171 1.770 2.711 . 0 0 "[ . 1 . 2]" 1
1801 2 49 GLU HB2 2 50 ASN H 6.300 . 6.300 3.459 3.039 3.925 . 0 0 "[ . 1 . 2]" 1
1802 2 49 GLU HB3 2 50 ASN H 6.300 . 6.300 4.259 3.874 4.436 . 0 0 "[ . 1 . 2]" 1
1803 2 49 GLU QG 2 51 LYS H 6.100 . 6.100 4.885 4.202 5.195 . 0 0 "[ . 1 . 2]" 1
1804 2 49 GLU HG2 2 50 ASN H 6.300 . 6.300 5.056 4.266 5.416 . 0 0 "[ . 1 . 2]" 1
1805 2 49 GLU HG3 2 50 ASN H 6.300 . 6.300 4.858 4.414 5.711 . 0 0 "[ . 1 . 2]" 1
1806 2 50 ASN HA 2 52 VAL H 5.200 . 5.200 3.325 3.017 3.641 . 0 0 "[ . 1 . 2]" 1
1807 2 51 LYS H 2 51 LYS QE 6.300 . 6.300 4.517 3.555 5.398 . 0 0 "[ . 1 . 2]" 1
1808 2 51 LYS H 2 51 LYS HG2 5.570 . 5.570 3.467 1.894 4.193 . 0 0 "[ . 1 . 2]" 1
1809 2 51 LYS H 2 51 LYS QG 4.820 . 4.820 2.457 1.881 2.929 . 0 0 "[ . 1 . 2]" 1
1810 2 51 LYS H 2 51 LYS HG3 5.570 . 5.570 2.699 2.247 3.629 . 0 0 "[ . 1 . 2]" 1
1811 2 51 LYS H 2 52 VAL H 4.140 . 4.140 2.562 2.318 2.707 . 0 0 "[ . 1 . 2]" 1
1812 2 51 LYS H 2 52 VAL MG1 5.750 . 5.750 4.213 3.724 4.658 . 0 0 "[ . 1 . 2]" 1
1813 2 51 LYS H 2 52 VAL MG2 5.440 . 5.440 3.622 3.199 3.922 . 0 0 "[ . 1 . 2]" 1
1814 2 51 LYS HA 2 51 LYS QE 5.540 . 5.540 4.223 2.846 4.800 . 0 0 "[ . 1 . 2]" 1
1815 2 51 LYS HA 2 66 GLU QB 4.460 . 4.460 2.576 1.865 4.228 . 0 0 "[ . 1 . 2]" 1
1816 2 51 LYS HA 2 66 GLU QG 5.460 . 5.460 3.499 2.055 5.399 . 0 0 "[ . 1 . 2]" 1
1817 2 51 LYS QB 2 52 VAL MG1 4.690 . 4.690 3.111 2.856 3.948 . 0 0 "[ . 1 . 2]" 1
1818 2 51 LYS HB2 2 52 VAL H 5.790 . 5.790 3.557 3.119 4.413 . 0 0 "[ . 1 . 2]" 1
1819 2 51 LYS HB3 2 52 VAL H 5.790 . 5.790 4.259 4.053 4.580 . 0 0 "[ . 1 . 2]" 1
1820 2 51 LYS QG 2 52 VAL H 5.760 . 5.760 4.372 3.357 4.655 . 0 0 "[ . 1 . 2]" 1
1821 2 52 VAL H 2 52 VAL MG1 4.730 . 4.730 3.083 2.994 3.184 . 0 0 "[ . 1 . 2]" 1
1822 2 52 VAL H 2 52 VAL MG2 4.330 . 4.330 2.254 2.151 2.369 . 0 0 "[ . 1 . 2]" 1
1823 2 52 VAL H 2 53 VAL H 6.300 . 6.300 4.454 4.403 4.496 . 0 0 "[ . 1 . 2]" 1
1824 2 52 VAL H 2 53 VAL QG 4.830 . 4.830 4.580 4.315 4.870 0.040 8 0 "[ . 1 . 2]" 1
1825 2 52 VAL H 2 66 GLU QB 6.020 . 6.020 4.319 3.163 5.810 . 0 0 "[ . 1 . 2]" 1
1826 2 52 VAL HA 2 53 VAL QG 5.510 . 5.510 3.447 3.223 3.788 . 0 0 "[ . 1 . 2]" 1
1827 2 52 VAL HA 2 66 GLU H 4.990 . 4.990 3.366 2.142 3.936 . 0 0 "[ . 1 . 2]" 1
1828 2 52 VAL HB 2 53 VAL H 4.620 . 4.620 2.755 2.337 2.970 . 0 0 "[ . 1 . 2]" 1
1829 2 52 VAL MG1 2 53 VAL H 4.800 . 4.800 3.709 3.549 3.822 . 0 0 "[ . 1 . 2]" 1
1830 2 52 VAL MG1 2 65 ASN HA 5.210 . 5.210 3.517 2.595 4.435 . 0 0 "[ . 1 . 2]" 1
1831 2 52 VAL MG1 2 66 GLU H 6.300 . 6.300 4.371 3.477 5.024 . 0 0 "[ . 1 . 2]" 1
1832 2 53 VAL H 2 53 VAL QG 4.050 . 4.050 2.434 2.064 2.658 . 0 0 "[ . 1 . 2]" 1
1833 2 53 VAL H 2 54 ILE H 6.270 . 6.270 4.308 4.006 4.539 . 0 0 "[ . 1 . 2]" 1
1834 2 53 VAL H 2 54 ILE MD 6.100 . 6.100 4.643 3.664 5.800 . 0 0 "[ . 1 . 2]" 1
1835 2 53 VAL H 2 64 TYR QB 6.100 . 6.100 3.296 2.829 3.884 . 0 0 "[ . 1 . 2]" 1
1836 2 53 VAL H 2 65 ASN HA 6.280 . 6.280 3.894 3.198 4.557 . 0 0 "[ . 1 . 2]" 1
1837 2 53 VAL H 2 66 GLU H 6.210 . 6.210 4.588 3.432 5.307 . 0 0 "[ . 1 . 2]" 1
1838 2 53 VAL HA 2 54 ILE HB 6.300 . 6.300 4.635 4.344 4.916 . 0 0 "[ . 1 . 2]" 1
1839 2 53 VAL HA 2 54 ILE MD 5.540 . 5.540 4.331 2.892 5.217 . 0 0 "[ . 1 . 2]" 1
1840 2 53 VAL HA 2 54 ILE QG 5.880 . 5.880 4.023 3.282 5.180 . 0 0 "[ . 1 . 2]" 1
1841 2 53 VAL HB 2 54 ILE H 5.960 . 5.960 4.079 2.507 4.484 . 0 0 "[ . 1 . 2]" 1
1842 2 53 VAL HB 2 64 TYR H 5.900 . 5.900 3.599 2.723 5.495 . 0 0 "[ . 1 . 2]" 1
1843 2 53 VAL HB 2 64 TYR HB2 5.300 . 5.300 2.261 1.590 4.183 . 0 0 "[ . 1 . 2]" 1
1844 2 53 VAL HB 2 64 TYR QB 4.510 . 4.510 2.230 1.585 4.055 . 0 0 "[ . 1 . 2]" 1
1845 2 53 VAL HB 2 64 TYR HB3 5.300 . 5.300 3.724 2.988 5.451 0.151 9 0 "[ . 1 . 2]" 1
1846 2 53 VAL HB 2 64 TYR QD 5.330 . 5.330 3.624 2.256 5.477 0.147 11 0 "[ . 1 . 2]" 1
1847 2 53 VAL QG 2 54 ILE H 3.960 . 3.960 3.066 2.624 3.621 . 0 0 "[ . 1 . 2]" 1
1848 2 53 VAL QG 2 54 ILE HA 4.910 . 4.910 4.091 3.704 4.487 . 0 0 "[ . 1 . 2]" 1
1849 2 53 VAL QG 2 55 GLU QG 4.200 . 4.200 3.221 2.067 4.355 0.155 13 0 "[ . 1 . 2]" 1
1850 2 53 VAL QG 2 64 TYR H 5.300 . 5.300 3.679 3.062 4.136 . 0 0 "[ . 1 . 2]" 1
1851 2 53 VAL QG 2 64 TYR HB2 4.870 . 4.870 2.571 1.716 3.080 . 0 0 "[ . 1 . 2]" 1
1852 2 53 VAL QG 2 64 TYR QB 4.210 . 4.210 2.493 1.695 2.967 . 0 0 "[ . 1 . 2]" 1
1853 2 53 VAL QG 2 64 TYR HB3 4.870 . 4.870 3.398 2.647 3.880 . 0 0 "[ . 1 . 2]" 1
1854 2 53 VAL QG 2 64 TYR QD 4.550 . 4.550 3.192 2.364 3.708 . 0 0 "[ . 1 . 2]" 1
1855 2 53 VAL QG 2 64 TYR QE 5.200 . 5.200 4.525 3.525 5.184 . 0 0 "[ . 1 . 2]" 1
1856 2 53 VAL QG 2 65 ASN QB 6.230 . 6.230 4.681 4.186 5.069 . 0 0 "[ . 1 . 2]" 1
1857 2 53 VAL QG 2 66 GLU H 5.810 . 5.810 3.859 2.960 4.546 . 0 0 "[ . 1 . 2]" 1
1858 2 53 VAL QG 2 66 GLU HA 4.080 . 4.080 2.693 1.728 3.471 . 0 0 "[ . 1 . 2]" 1
1859 2 53 VAL QG 2 66 GLU QG 4.760 . 4.760 3.997 1.756 4.941 0.181 4 0 "[ . 1 . 2]" 1
1860 2 53 VAL QG 2 67 GLY H 5.710 . 5.710 4.173 2.341 5.538 . 0 0 "[ . 1 . 2]" 1
1861 2 53 VAL QG 2 68 HIS H 5.370 . 5.370 3.806 2.117 5.093 . 0 0 "[ . 1 . 2]" 1
1862 2 53 VAL QG 2 68 HIS QB 5.130 . 5.130 3.568 1.825 5.174 0.044 2 0 "[ . 1 . 2]" 1
1863 2 53 VAL QG 2 68 HIS HD2 5.170 . 5.170 4.131 1.896 5.118 . 0 0 "[ . 1 . 2]" 1
1864 2 53 VAL QG 2 69 PHE H 6.300 . 6.300 3.652 2.197 4.803 . 0 0 "[ . 1 . 2]" 1
1865 2 53 VAL QG 2 69 PHE HB2 5.640 . 5.640 3.747 1.973 5.772 0.132 8 0 "[ . 1 . 2]" 1
1866 2 53 VAL QG 2 69 PHE QB 4.940 . 4.940 3.095 1.561 4.666 . 0 0 "[ . 1 . 2]" 1
1867 2 53 VAL QG 2 69 PHE HB3 5.640 . 5.640 3.556 1.636 5.667 0.027 11 0 "[ . 1 . 2]" 1
1868 2 53 VAL QG 2 69 PHE QD 4.490 . 4.490 2.731 2.210 3.665 . 0 0 "[ . 1 . 2]" 1
1869 2 53 VAL QG 2 69 PHE QE 4.970 . 4.970 3.284 2.007 4.916 . 0 0 "[ . 1 . 2]" 1
1870 2 54 ILE H 2 54 ILE MD 4.780 . 4.780 3.363 1.968 4.077 . 0 0 "[ . 1 . 2]" 1
1871 2 54 ILE H 2 54 ILE HG12 5.400 . 5.400 3.418 2.180 4.452 . 0 0 "[ . 1 . 2]" 1
1872 2 54 ILE H 2 54 ILE QG 4.580 . 4.580 2.811 2.164 3.864 . 0 0 "[ . 1 . 2]" 1
1873 2 54 ILE H 2 54 ILE HG13 5.400 . 5.400 3.461 2.238 4.239 . 0 0 "[ . 1 . 2]" 1
1874 2 54 ILE H 2 55 GLU H 6.300 . 6.300 4.367 4.153 4.500 . 0 0 "[ . 1 . 2]" 1
1875 2 54 ILE H 2 55 GLU QG 6.300 . 6.300 5.150 3.915 6.547 0.247 1 0 "[ . 1 . 2]" 1
1876 2 54 ILE HA 2 54 ILE MD 4.730 . 4.730 2.966 2.079 3.948 . 0 0 "[ . 1 . 2]" 1
1877 2 54 ILE HB 2 54 ILE MD 3.520 . 3.520 2.790 2.433 3.285 . 0 0 "[ . 1 . 2]" 1
1878 2 54 ILE HB 2 55 GLU H 5.760 . 5.760 4.351 4.130 4.484 . 0 0 "[ . 1 . 2]" 1
1879 2 54 ILE MD 2 55 GLU H 6.300 . 6.300 4.617 3.614 5.525 . 0 0 "[ . 1 . 2]" 1
1880 2 54 ILE MD 2 63 ILE H 6.300 . 6.300 5.828 4.318 6.535 0.235 13 0 "[ . 1 . 2]" 1
1881 2 54 ILE MD 2 64 TYR H 6.300 . 6.300 4.717 3.106 6.057 . 0 0 "[ . 1 . 2]" 1
1882 2 54 ILE QG 2 55 GLU H 5.330 . 5.330 4.485 4.088 4.912 . 0 0 "[ . 1 . 2]" 1
1883 2 54 ILE QG 2 63 ILE HA 5.660 . 5.660 4.031 2.971 5.313 . 0 0 "[ . 1 . 2]" 1
1884 2 54 ILE QG 2 64 TYR H 6.100 . 6.100 4.890 3.597 5.967 . 0 0 "[ . 1 . 2]" 1
1885 2 54 ILE MG 2 55 GLU H 4.120 . 4.120 2.997 2.571 3.322 . 0 0 "[ . 1 . 2]" 1
1886 2 54 ILE MG 2 56 ARG H 6.200 . 6.200 4.293 3.748 5.081 . 0 0 "[ . 1 . 2]" 1
1887 2 54 ILE MG 2 56 ARG HA 6.100 . 6.100 4.759 4.300 5.389 . 0 0 "[ . 1 . 2]" 1
1888 2 54 ILE MG 2 56 ARG QH1 6.300 . 6.300 4.982 1.797 6.301 0.001 17 0 "[ . 1 . 2]" 1
1889 2 54 ILE MG 2 56 ARG QH2 6.300 . 6.300 4.527 2.360 6.344 0.044 7 0 "[ . 1 . 2]" 1
1890 2 55 GLU H 2 56 ARG H 5.350 . 5.350 4.326 4.142 4.501 . 0 0 "[ . 1 . 2]" 1
1891 2 55 GLU H 2 56 ARG HA 6.270 . 6.270 4.909 4.672 5.203 . 0 0 "[ . 1 . 2]" 1
1892 2 55 GLU H 2 61 ILE HA 6.300 . 6.300 4.579 3.981 5.103 . 0 0 "[ . 1 . 2]" 1
1893 2 55 GLU H 2 62 GLU QB 6.100 . 6.100 3.834 2.807 4.915 . 0 0 "[ . 1 . 2]" 1
1894 2 55 GLU H 2 64 TYR QD 4.820 . 4.820 3.681 2.788 4.747 . 0 0 "[ . 1 . 2]" 1
1895 2 55 GLU H 2 64 TYR QE 5.060 . 5.060 3.937 3.003 5.019 . 0 0 "[ . 1 . 2]" 1
1896 2 55 GLU HA 2 56 ARG QG 6.030 . 6.030 4.006 3.449 5.806 . 0 0 "[ . 1 . 2]" 1
1897 2 55 GLU HA 2 57 LYS H 6.260 . 6.260 5.561 5.270 5.831 . 0 0 "[ . 1 . 2]" 1
1898 2 55 GLU HA 2 57 LYS QD 5.470 . 5.470 4.987 3.895 5.695 0.225 1 0 "[ . 1 . 2]" 1
1899 2 55 GLU HA 2 62 GLU H 6.250 . 6.250 5.008 4.712 5.690 . 0 0 "[ . 1 . 2]" 1
1900 2 55 GLU QB 2 56 ARG H 4.330 . 4.330 3.371 2.572 3.896 . 0 0 "[ . 1 . 2]" 1
1901 2 55 GLU QB 2 57 LYS H 5.600 . 5.600 4.554 4.035 4.961 . 0 0 "[ . 1 . 2]" 1
1902 2 55 GLU QB 2 57 LYS QB 4.760 . 4.760 4.546 3.589 4.983 0.223 3 0 "[ . 1 . 2]" 1
1903 2 55 GLU QB 2 57 LYS QE 6.100 . 6.100 3.429 1.845 5.323 . 0 0 "[ . 1 . 2]" 1
1904 2 55 GLU QB 2 57 LYS QG 4.910 . 4.910 3.535 2.046 5.122 0.212 8 0 "[ . 1 . 2]" 1
1905 2 55 GLU QB 2 64 TYR QD 5.150 . 5.150 3.365 2.629 4.887 . 0 0 "[ . 1 . 2]" 1
1906 2 55 GLU QB 2 64 TYR QE 4.040 . 4.040 2.453 1.655 4.008 . 0 0 "[ . 1 . 2]" 1
1907 2 55 GLU HB2 2 64 TYR QD 5.900 . 5.900 3.590 2.653 6.039 0.139 19 0 "[ . 1 . 2]" 1
1908 2 55 GLU HB3 2 64 TYR QD 5.900 . 5.900 4.445 3.164 5.456 . 0 0 "[ . 1 . 2]" 1
1909 2 55 GLU QG 2 56 ARG H 5.080 . 5.080 3.952 2.406 4.920 . 0 0 "[ . 1 . 2]" 1
1910 2 55 GLU QG 2 56 ARG QG 6.300 . 6.300 5.646 4.894 6.302 0.002 16 0 "[ . 1 . 2]" 1
1911 2 55 GLU QG 2 57 LYS QG 6.100 . 6.100 4.292 1.731 6.138 0.038 2 0 "[ . 1 . 2]" 1
1912 2 55 GLU QG 2 64 TYR QD 4.600 . 4.600 3.488 2.106 4.793 0.193 7 0 "[ . 1 . 2]" 1
1913 2 55 GLU QG 2 64 TYR QE 5.350 . 5.350 3.207 2.026 4.538 . 0 0 "[ . 1 . 2]" 1
1914 2 56 ARG H 2 56 ARG QB 3.770 . 3.770 2.502 2.275 2.987 . 0 0 "[ . 1 . 2]" 1
1915 2 56 ARG H 2 56 ARG QG 4.740 . 4.740 2.702 1.998 4.015 . 0 0 "[ . 1 . 2]" 1
1916 2 56 ARG HA 2 57 LYS QB 5.810 . 5.810 4.403 4.070 4.718 . 0 0 "[ . 1 . 2]" 1
1917 2 56 ARG HA 2 60 LEU H 5.970 . 5.970 4.551 4.053 5.283 . 0 0 "[ . 1 . 2]" 1
1918 2 56 ARG HA 2 61 ILE HA 4.990 . 4.990 2.604 1.912 3.140 . 0 0 "[ . 1 . 2]" 1
1919 2 56 ARG HA 2 61 ILE MD 5.800 . 5.800 4.154 2.449 5.126 . 0 0 "[ . 1 . 2]" 1
1920 2 56 ARG HA 2 61 ILE MG 5.600 . 5.600 4.240 3.009 4.825 . 0 0 "[ . 1 . 2]" 1
1921 2 56 ARG HB2 2 57 LYS H 5.780 . 5.780 4.375 3.500 4.514 . 0 0 "[ . 1 . 2]" 1
1922 2 56 ARG HB3 2 57 LYS H 5.780 . 5.780 3.871 3.566 4.469 . 0 0 "[ . 1 . 2]" 1
1923 2 56 ARG QD 2 57 LYS H 6.300 . 6.300 5.654 5.341 6.076 . 0 0 "[ . 1 . 2]" 1
1924 2 56 ARG QD 2 59 GLY HA2 5.030 . 5.030 4.110 2.939 5.197 0.167 7 0 "[ . 1 . 2]" 1
1925 2 56 ARG QD 2 61 ILE MD 5.500 . 5.500 3.713 2.773 4.489 . 0 0 "[ . 1 . 2]" 1
1926 2 56 ARG QD 2 61 ILE MG 5.990 . 5.990 5.097 4.051 5.820 . 0 0 "[ . 1 . 2]" 1
1927 2 56 ARG HE 2 61 ILE MD 6.150 . 6.150 3.476 2.066 5.801 . 0 0 "[ . 1 . 2]" 1
1928 2 56 ARG HE 2 61 ILE MG 6.280 . 6.280 4.944 2.758 6.411 0.131 7 0 "[ . 1 . 2]" 1
1929 2 56 ARG QG 2 57 LYS H 4.970 . 4.970 4.268 3.448 4.496 . 0 0 "[ . 1 . 2]" 1
1930 2 56 ARG QG 2 59 GLY H 5.670 . 5.670 5.182 2.963 5.831 0.161 7 0 "[ . 1 . 2]" 1
1931 2 56 ARG QG 2 60 LEU H 5.640 . 5.640 5.400 3.968 5.751 0.111 9 0 "[ . 1 . 2]" 1
1932 2 56 ARG QG 2 61 ILE HA 5.650 . 5.650 3.299 2.292 4.293 . 0 0 "[ . 1 . 2]" 1
1933 2 56 ARG QG 2 61 ILE MD 4.430 . 4.430 2.930 1.867 4.501 0.071 9 0 "[ . 1 . 2]" 1
1934 2 56 ARG QG 2 61 ILE QG 4.950 . 4.950 2.874 1.683 4.253 . 0 0 "[ . 1 . 2]" 1
1935 2 56 ARG QG 2 61 ILE MG 3.790 . 3.790 3.680 3.039 4.082 0.292 9 0 "[ . 1 . 2]" 1
1936 2 56 ARG QH1 2 61 ILE MD 6.270 . 6.270 4.119 2.621 5.791 . 0 0 "[ . 1 . 2]" 1
1937 2 56 ARG QH2 2 61 ILE MD 6.300 . 6.300 3.656 2.329 6.397 0.097 7 0 "[ . 1 . 2]" 1
1938 2 57 LYS H 2 57 LYS QD 5.210 . 5.210 3.367 1.922 4.079 . 0 0 "[ . 1 . 2]" 1
1939 2 57 LYS H 2 57 LYS HG2 5.620 . 5.620 3.890 2.041 4.607 . 0 0 "[ . 1 . 2]" 1
1940 2 57 LYS H 2 57 LYS HG3 5.620 . 5.620 3.508 2.345 4.504 . 0 0 "[ . 1 . 2]" 1
1941 2 57 LYS H 2 58 ASN H 6.100 . 6.100 4.327 4.226 4.465 . 0 0 "[ . 1 . 2]" 1
1942 2 57 LYS H 2 58 ASN QB 6.100 . 6.100 5.208 4.868 5.363 . 0 0 "[ . 1 . 2]" 1
1943 2 57 LYS H 2 59 GLY H 5.710 . 5.710 4.118 3.752 4.520 . 0 0 "[ . 1 . 2]" 1
1944 2 57 LYS H 2 60 LEU H 4.610 . 4.610 3.616 3.075 4.308 . 0 0 "[ . 1 . 2]" 1
1945 2 57 LYS H 2 60 LEU QB 6.110 . 6.110 3.815 3.401 4.313 . 0 0 "[ . 1 . 2]" 1
1946 2 57 LYS H 2 60 LEU QD 6.220 . 6.220 4.785 3.753 5.272 . 0 0 "[ . 1 . 2]" 1
1947 2 57 LYS H 2 61 ILE MD 6.300 . 6.300 5.510 3.869 6.483 0.183 3 0 "[ . 1 . 2]" 1
1948 2 57 LYS H 2 61 ILE QG 6.100 . 6.100 5.378 4.580 6.133 0.033 6 0 "[ . 1 . 2]" 1
1949 2 57 LYS HA 2 57 LYS QD 4.960 . 4.960 3.580 2.231 4.477 . 0 0 "[ . 1 . 2]" 1
1950 2 57 LYS HA 2 59 GLY H 5.490 . 5.490 3.708 3.392 3.985 . 0 0 "[ . 1 . 2]" 1
1951 2 57 LYS QB 2 58 ASN QD 5.440 . 5.440 3.234 2.218 4.058 . 0 0 "[ . 1 . 2]" 1
1952 2 57 LYS QG 2 58 ASN QD 5.410 . 5.410 4.602 3.324 5.497 0.087 7 0 "[ . 1 . 2]" 1
1953 2 57 LYS HG2 2 58 ASN H 5.800 . 5.800 4.933 4.342 5.620 . 0 0 "[ . 1 . 2]" 1
1954 2 57 LYS HG3 2 58 ASN H 5.800 . 5.800 4.823 3.934 5.562 . 0 0 "[ . 1 . 2]" 1
1955 2 58 ASN H 2 59 GLY H 4.620 . 4.620 2.756 2.689 2.839 . 0 0 "[ . 1 . 2]" 1
1956 2 58 ASN H 2 59 GLY HA2 6.300 . 6.300 5.087 4.989 5.193 . 0 0 "[ . 1 . 2]" 1
1957 2 58 ASN H 2 60 LEU H 6.130 . 6.130 4.319 4.101 4.500 . 0 0 "[ . 1 . 2]" 1
1958 2 58 ASN HA 2 60 LEU H 5.780 . 5.780 4.384 4.274 4.465 . 0 0 "[ . 1 . 2]" 1
1959 2 58 ASN QB 2 59 GLY H 4.700 . 4.700 3.876 3.862 3.899 . 0 0 "[ . 1 . 2]" 1
1960 2 58 ASN QB 2 60 LEU QB 5.340 . 5.340 3.620 3.046 4.060 . 0 0 "[ . 1 . 2]" 1
1961 2 58 ASN HB2 2 59 GLY H 5.520 . 5.520 4.209 4.180 4.248 . 0 0 "[ . 1 . 2]" 1
1962 2 58 ASN HB2 2 60 LEU H 6.010 . 6.010 3.484 3.238 3.747 . 0 0 "[ . 1 . 2]" 1
1963 2 58 ASN HB2 2 60 LEU MD1 6.300 . 6.300 3.994 2.430 5.606 . 0 0 "[ . 1 . 2]" 1
1964 2 58 ASN HB2 2 60 LEU MD2 6.300 . 6.300 3.987 2.164 4.897 . 0 0 "[ . 1 . 2]" 1
1965 2 58 ASN HB3 2 59 GLY H 5.520 . 5.520 4.536 4.497 4.565 . 0 0 "[ . 1 . 2]" 1
1966 2 58 ASN HB3 2 60 LEU H 6.010 . 6.010 4.507 4.253 4.780 . 0 0 "[ . 1 . 2]" 1
1967 2 58 ASN HB3 2 60 LEU MD1 6.300 . 6.300 4.793 3.174 6.450 0.150 14 0 "[ . 1 . 2]" 1
1968 2 58 ASN HB3 2 60 LEU MD2 6.300 . 6.300 4.937 3.244 6.310 0.010 15 0 "[ . 1 . 2]" 1
1969 2 58 ASN QD 2 60 LEU QD 5.430 . 5.430 4.030 3.379 4.642 . 0 0 "[ . 1 . 2]" 1
1970 2 58 ASN HD21 2 60 LEU QB 6.300 . 6.300 4.724 4.256 5.089 . 0 0 "[ . 1 . 2]" 1
1971 2 58 ASN HD22 2 60 LEU QB 6.300 . 6.300 6.184 5.731 6.360 0.060 4 0 "[ . 1 . 2]" 1
1972 2 59 GLY H 2 60 LEU H 4.480 . 4.480 2.810 2.573 3.004 . 0 0 "[ . 1 . 2]" 1
1973 2 59 GLY H 2 60 LEU QB 6.060 . 6.060 4.807 4.420 5.055 . 0 0 "[ . 1 . 2]" 1
1974 2 60 LEU H 2 60 LEU MD1 5.070 . 5.070 3.253 2.059 4.425 . 0 0 "[ . 1 . 2]" 1
1975 2 60 LEU H 2 60 LEU MD2 5.070 . 5.070 3.647 2.052 4.498 . 0 0 "[ . 1 . 2]" 1
1976 2 60 LEU H 2 60 LEU HG 4.880 . 4.880 3.859 2.189 4.600 . 0 0 "[ . 1 . 2]" 1
1977 2 60 LEU HA 2 60 LEU MD1 4.600 . 4.600 2.790 2.051 3.966 . 0 0 "[ . 1 . 2]" 1
1978 2 60 LEU HA 2 60 LEU QD 3.830 . 3.830 2.455 2.024 3.225 . 0 0 "[ . 1 . 2]" 1
1979 2 60 LEU HA 2 60 LEU MD2 4.600 . 4.600 3.454 2.111 3.997 . 0 0 "[ . 1 . 2]" 1
1980 2 60 LEU HA 2 61 ILE QG 5.740 . 5.740 4.004 3.142 5.801 0.061 3 0 "[ . 1 . 2]" 1
1981 2 60 LEU QB 2 61 ILE H 5.220 . 5.220 3.172 2.376 3.935 . 0 0 "[ . 1 . 2]" 1
1982 2 60 LEU QD 2 61 ILE H 5.390 . 5.390 3.570 2.290 4.249 . 0 0 "[ . 1 . 2]" 1
1983 2 61 ILE H 2 61 ILE HB 4.270 . 4.270 2.592 2.461 2.841 . 0 0 "[ . 1 . 2]" 1
1984 2 61 ILE H 2 61 ILE MD 4.680 . 4.680 3.175 1.810 4.408 . 0 0 "[ . 1 . 2]" 1
1985 2 61 ILE H 2 61 ILE HG12 4.680 . 4.680 3.380 2.187 4.510 . 0 0 "[ . 1 . 2]" 1
1986 2 61 ILE H 2 61 ILE QG 4.080 . 4.080 2.723 2.124 4.015 . 0 0 "[ . 1 . 2]" 1
1987 2 61 ILE H 2 61 ILE HG13 4.680 . 4.680 3.266 2.153 4.503 . 0 0 "[ . 1 . 2]" 1
1988 2 61 ILE H 2 61 ILE MG 4.770 . 4.770 3.764 1.938 3.970 . 0 0 "[ . 1 . 2]" 1
1989 2 61 ILE HA 2 61 ILE MD 4.700 . 4.700 3.161 2.150 3.982 . 0 0 "[ . 1 . 2]" 1
1990 2 61 ILE HB 2 62 GLU H 5.090 . 5.090 4.266 3.934 4.465 . 0 0 "[ . 1 . 2]" 1
1991 2 61 ILE MD 2 62 GLU H 6.300 . 6.300 4.738 3.804 5.390 . 0 0 "[ . 1 . 2]" 1
1992 2 61 ILE QG 2 62 GLU H 5.240 . 5.240 4.379 3.077 4.932 . 0 0 "[ . 1 . 2]" 1
1993 2 61 ILE MG 2 62 GLU H 4.230 . 4.230 2.927 2.464 4.206 . 0 0 "[ . 1 . 2]" 1
1994 2 61 ILE MG 2 62 GLU HA 5.210 . 5.210 3.754 3.406 4.250 . 0 0 "[ . 1 . 2]" 1
1995 2 62 GLU HB2 2 64 TYR QE 4.800 . 4.800 2.764 2.059 4.388 . 0 0 "[ . 1 . 2]" 1
1996 2 62 GLU HB3 2 64 TYR QE 4.800 . 4.800 3.194 2.277 4.178 . 0 0 "[ . 1 . 2]" 1
1997 2 62 GLU QG 2 63 ILE H 4.860 . 4.860 4.116 2.568 4.806 . 0 0 "[ . 1 . 2]" 1
1998 2 62 GLU HG2 2 63 ILE H 5.700 . 5.700 4.522 4.001 5.285 . 0 0 "[ . 1 . 2]" 1
1999 2 62 GLU HG3 2 63 ILE H 5.700 . 5.700 4.991 2.589 5.729 0.029 5 0 "[ . 1 . 2]" 1
2000 2 63 ILE H 2 63 ILE MD 4.760 . 4.760 3.010 1.646 4.682 . 0 0 "[ . 1 . 2]" 1
2001 2 63 ILE H 2 63 ILE HG12 5.400 . 5.400 3.525 2.270 4.909 . 0 0 "[ . 1 . 2]" 1
2002 2 63 ILE H 2 63 ILE HG13 5.400 . 5.400 3.572 1.927 4.882 . 0 0 "[ . 1 . 2]" 1
2003 2 63 ILE HA 2 63 ILE MD 4.180 . 4.180 3.167 2.059 4.235 0.055 6 0 "[ . 1 . 2]" 1
2004 2 63 ILE HA 2 64 TYR QD 5.410 . 5.410 3.584 2.877 4.564 . 0 0 "[ . 1 . 2]" 1
2005 2 63 ILE HB 2 64 TYR H 6.170 . 6.170 3.873 2.759 4.521 . 0 0 "[ . 1 . 2]" 1
2006 2 63 ILE MD 2 64 TYR H 4.670 . 4.670 4.156 2.079 4.929 0.259 10 0 "[ . 1 . 2]" 1
2007 2 63 ILE MG 2 64 TYR H 4.210 . 4.210 3.507 2.581 4.143 . 0 0 "[ . 1 . 2]" 1
2008 2 64 TYR H 2 64 TYR QD 5.100 . 5.100 2.671 2.262 3.375 . 0 0 "[ . 1 . 2]" 1
2009 2 64 TYR HA 2 64 TYR QD 4.510 . 4.510 3.056 2.392 3.258 . 0 0 "[ . 1 . 2]" 1
2010 2 64 TYR QD 2 65 ASN H 5.780 . 5.780 3.856 3.622 4.131 . 0 0 "[ . 1 . 2]" 1
2011 2 65 ASN QB 2 66 GLU H 5.010 . 5.010 3.062 2.316 3.646 . 0 0 "[ . 1 . 2]" 1
2012 2 65 ASN QB 2 67 GLY H 5.940 . 5.940 4.212 2.487 6.040 0.100 11 0 "[ . 1 . 2]" 1
2013 2 65 ASN QB 2 68 HIS H 5.940 . 5.940 4.473 2.780 6.054 0.114 19 0 "[ . 1 . 2]" 1
2014 2 66 GLU H 2 66 GLU QG 5.080 . 5.080 3.379 1.921 4.081 . 0 0 "[ . 1 . 2]" 1
2015 2 66 GLU H 2 67 GLY H 5.020 . 5.020 3.658 2.563 4.715 . 0 0 "[ . 1 . 2]" 1
2016 2 66 GLU HA 2 68 HIS H 5.300 . 5.300 3.926 2.761 5.717 0.417 16 0 "[ . 1 . 2]" 1
2017 2 66 GLU HA 2 69 PHE H 6.300 . 6.300 4.712 3.093 6.381 0.081 2 0 "[ . 1 . 2]" 1
2018 2 66 GLU HA 2 69 PHE QB 5.580 . 5.580 4.895 2.616 5.775 0.195 15 0 "[ . 1 . 2]" 1
2019 2 66 GLU HB2 2 67 GLY H 5.630 . 5.630 3.848 1.837 4.555 . 0 0 "[ . 1 . 2]" 1
2020 2 66 GLU HB3 2 67 GLY H 5.630 . 5.630 3.597 2.178 4.489 . 0 0 "[ . 1 . 2]" 1
2021 2 66 GLU QG 2 67 GLY H 5.200 . 5.200 3.468 2.229 4.599 . 0 0 "[ . 1 . 2]" 1
2022 2 66 GLU QG 2 68 HIS H 6.010 . 6.010 5.024 3.997 5.756 . 0 0 "[ . 1 . 2]" 1
2023 2 67 GLY H 2 68 HIS H 4.530 . 4.530 2.803 1.849 4.302 . 0 0 "[ . 1 . 2]" 1
2024 2 67 GLY QA 2 69 PHE H 6.160 . 6.160 4.129 3.267 5.672 . 0 0 "[ . 1 . 2]" 1
2025 2 68 HIS H 2 68 HIS HD2 6.300 . 6.300 4.497 2.177 5.260 . 0 0 "[ . 1 . 2]" 1
2026 2 68 HIS HA 2 68 HIS HD2 4.980 . 4.980 4.388 3.307 4.889 . 0 0 "[ . 1 . 2]" 1
2027 2 68 HIS QB 2 69 PHE H 4.690 . 4.690 3.142 2.393 4.090 . 0 0 "[ . 1 . 2]" 1
2028 2 68 HIS QB 2 69 PHE QD 5.480 . 5.480 4.191 2.377 5.513 0.033 15 0 "[ . 1 . 2]" 1
2029 2 68 HIS HB2 2 69 PHE H 5.610 . 5.610 3.904 2.839 4.697 . 0 0 "[ . 1 . 2]" 1
2030 2 68 HIS HB3 2 69 PHE H 5.610 . 5.610 3.534 2.418 4.622 . 0 0 "[ . 1 . 2]" 1
2031 2 69 PHE H 2 69 PHE QB 3.870 . 3.870 2.710 2.282 3.305 . 0 0 "[ . 1 . 2]" 1
2032 2 69 PHE H 2 69 PHE QD 4.660 . 4.660 2.667 1.910 3.603 . 0 0 "[ . 1 . 2]" 1
2033 2 69 PHE H 2 69 PHE QE 5.320 . 5.320 4.410 3.942 4.932 . 0 0 "[ . 1 . 2]" 1
2034 2 69 PHE HA 2 69 PHE QD 4.260 . 4.260 3.236 1.965 3.825 . 0 0 "[ . 1 . 2]" 1
2035 2 69 PHE QB 2 71 PHE H 5.830 . 5.830 5.033 3.277 5.930 0.100 20 0 "[ . 1 . 2]" 1
2036 2 69 PHE HB2 2 70 ASP H 5.100 . 5.100 3.559 2.133 4.548 . 0 0 "[ . 1 . 2]" 1
2037 2 69 PHE HB3 2 70 ASP H 5.100 . 5.100 3.838 2.963 4.650 . 0 0 "[ . 1 . 2]" 1
2038 2 69 PHE QD 2 70 ASP H 5.860 . 5.860 4.024 2.811 4.962 . 0 0 "[ . 1 . 2]" 1
2039 2 70 ASP H 2 70 ASP QB 3.810 . 3.810 2.695 2.333 3.336 . 0 0 "[ . 1 . 2]" 1
2040 2 70 ASP QB 2 71 PHE H 4.590 . 4.590 3.446 2.263 4.100 . 0 0 "[ . 1 . 2]" 1
2041 2 71 PHE H 2 71 PHE HB2 4.390 . 4.390 2.969 2.440 3.932 . 0 0 "[ . 1 . 2]" 1
2042 2 71 PHE H 2 71 PHE QB 3.740 . 3.740 2.581 2.235 3.122 . 0 0 "[ . 1 . 2]" 1
2043 2 71 PHE H 2 71 PHE HB3 4.390 . 4.390 3.092 2.468 3.864 . 0 0 "[ . 1 . 2]" 1
2044 2 71 PHE H 2 71 PHE QD 5.110 . 5.110 3.529 2.112 4.557 . 0 0 "[ . 1 . 2]" 1
2045 2 71 PHE HA 2 71 PHE QD 4.220 . 4.220 2.881 2.353 3.811 . 0 0 "[ . 1 . 2]" 1
2046 2 71 PHE QB 2 72 SER H 4.490 . 4.490 3.391 2.107 4.042 . 0 0 "[ . 1 . 2]" 1
2047 2 71 PHE HB2 2 72 SER H 5.200 . 5.200 4.003 2.932 4.519 . 0 0 "[ . 1 . 2]" 1
2048 2 71 PHE HB3 2 72 SER H 5.200 . 5.200 3.858 2.128 4.611 . 0 0 "[ . 1 . 2]" 1
2049 2 71 PHE QD 2 72 SER H 5.730 . 5.730 3.914 2.911 4.976 . 0 0 "[ . 1 . 2]" 1
2050 2 72 SER QB 2 73 PHE H 4.530 . 4.530 3.127 2.050 4.053 . 0 0 "[ . 1 . 2]" 1
2051 2 72 SER HB2 2 73 PHE H 5.150 . 5.150 3.712 2.143 4.591 . 0 0 "[ . 1 . 2]" 1
2052 2 72 SER HB3 2 73 PHE H 5.150 . 5.150 3.664 2.077 4.519 . 0 0 "[ . 1 . 2]" 1
2053 2 73 PHE H 2 73 PHE HB2 4.350 . 4.350 2.860 2.415 3.698 . 0 0 "[ . 1 . 2]" 1
2054 2 73 PHE H 2 73 PHE QB 3.750 . 3.750 2.469 2.230 3.055 . 0 0 "[ . 1 . 2]" 1
2055 2 73 PHE H 2 73 PHE HB3 4.350 . 4.350 2.980 2.468 3.736 . 0 0 "[ . 1 . 2]" 1
2056 2 73 PHE H 2 73 PHE QD 5.230 . 5.230 3.415 1.997 4.470 . 0 0 "[ . 1 . 2]" 1
2057 2 73 PHE HB2 2 74 GLY H 5.040 . 5.040 3.850 2.236 4.658 . 0 0 "[ . 1 . 2]" 1
2058 2 73 PHE HB3 2 74 GLY H 5.040 . 5.040 3.965 2.179 4.536 . 0 0 "[ . 1 . 2]" 1
2059 2 73 PHE QD 2 74 GLY H 5.820 . 5.820 3.848 2.869 5.004 . 0 0 "[ . 1 . 2]" 1
2060 2 73 PHE QD 2 75 LEU QD 5.050 . 5.050 3.423 2.152 4.888 . 0 0 "[ . 1 . 2]" 1
2061 2 73 PHE QE 2 75 LEU QD 5.190 . 5.190 3.606 2.167 5.284 0.094 4 0 "[ . 1 . 2]" 1
2062 2 74 GLY H 2 75 LEU H 4.000 . 4.000 3.109 1.894 4.182 0.182 1 0 "[ . 1 . 2]" 1
2063 2 75 LEU H 2 75 LEU QB 3.800 . 3.800 2.545 2.215 3.228 . 0 0 "[ . 1 . 2]" 1
2064 2 75 LEU H 2 75 LEU HG 4.660 . 4.660 3.746 2.291 4.906 0.246 5 0 "[ . 1 . 2]" 1
2065 2 75 LEU H 2 76 GLU H 4.410 . 4.410 3.660 1.778 4.563 0.153 16 0 "[ . 1 . 2]" 1
2066 2 75 LEU HA 2 75 LEU QD 3.720 . 3.720 2.482 1.962 3.497 . 0 0 "[ . 1 . 2]" 1
2067 2 75 LEU QB 2 76 GLU QB 4.940 . 4.940 4.423 3.285 4.998 0.058 14 0 "[ . 1 . 2]" 1
2068 2 75 LEU HB2 2 76 GLU H 5.160 . 5.160 3.754 2.239 4.615 . 0 0 "[ . 1 . 2]" 1
2069 2 75 LEU HB3 2 76 GLU H 5.160 . 5.160 3.584 2.005 4.518 . 0 0 "[ . 1 . 2]" 1
2070 2 75 LEU QD 2 76 GLU H 6.220 . 6.220 3.701 1.818 4.411 . 0 0 "[ . 1 . 2]" 1
2071 2 75 LEU HG 2 76 GLU H 5.610 . 5.610 4.695 2.959 5.688 0.078 14 0 "[ . 1 . 2]" 1
2072 2 76 GLU H 2 76 GLU HG2 5.350 . 5.350 4.215 2.169 5.327 . 0 0 "[ . 1 . 2]" 1
2073 2 76 GLU H 2 76 GLU HG3 5.350 . 5.350 4.192 2.122 4.958 . 0 0 "[ . 1 . 2]" 1
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