Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
539398 | 2lqh RC | 18314 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lqh
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 2648
_Distance_constraint_stats_list.Viol_count 3550
_Distance_constraint_stats_list.Viol_total 3604.558
_Distance_constraint_stats_list.Viol_max 0.328
_Distance_constraint_stats_list.Viol_rms 0.0176
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0034
_Distance_constraint_stats_list.Viol_average_violations_only 0.0508
_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 GLY 0.392 0.096 12 0 "[ . 1 . 2]"
1 2 VAL 1.445 0.123 20 0 "[ . 1 . 2]"
1 3 ARG 3.308 0.129 4 0 "[ . 1 . 2]"
1 4 LYS 4.385 0.172 20 0 "[ . 1 . 2]"
1 5 GLY 0.150 0.049 11 0 "[ . 1 . 2]"
1 6 TRP 1.690 0.102 5 0 "[ . 1 . 2]"
1 7 HIS 1.156 0.096 7 0 "[ . 1 . 2]"
1 8 GLU 0.543 0.088 2 0 "[ . 1 . 2]"
1 9 HIS 0.994 0.088 2 0 "[ . 1 . 2]"
1 10 VAL 5.363 0.328 12 0 "[ . 1 . 2]"
1 11 THR 1.865 0.105 4 0 "[ . 1 . 2]"
1 12 GLN 2.121 0.105 4 0 "[ . 1 . 2]"
1 13 ASP 0.445 0.052 20 0 "[ . 1 . 2]"
1 14 LEU 10.608 0.164 8 0 "[ . 1 . 2]"
1 15 ARG 4.978 0.162 20 0 "[ . 1 . 2]"
1 16 SER 1.291 0.079 17 0 "[ . 1 . 2]"
1 17 HIS 2.397 0.138 12 0 "[ . 1 . 2]"
1 18 LEU 7.862 0.201 12 0 "[ . 1 . 2]"
1 19 VAL 5.014 0.127 3 0 "[ . 1 . 2]"
1 20 HIS 1.336 0.086 9 0 "[ . 1 . 2]"
1 21 LYS 6.411 0.195 2 0 "[ . 1 . 2]"
1 22 LEU 3.721 0.127 3 0 "[ . 1 . 2]"
1 23 VAL 5.852 0.131 16 0 "[ . 1 . 2]"
1 24 GLN 3.532 0.159 13 0 "[ . 1 . 2]"
1 25 ALA 3.242 0.137 9 0 "[ . 1 . 2]"
1 26 ILE 6.421 0.221 9 0 "[ . 1 . 2]"
1 27 PHE 3.923 0.136 20 0 "[ . 1 . 2]"
1 28 PRO 2.678 0.175 9 0 "[ . 1 . 2]"
1 29 THR 2.433 0.175 9 0 "[ . 1 . 2]"
1 30 PRO 1.448 0.138 8 0 "[ . 1 . 2]"
1 31 ASP 2.815 0.114 4 0 "[ . 1 . 2]"
1 32 PRO 2.288 0.108 7 0 "[ . 1 . 2]"
1 33 ALA 2.346 0.155 18 0 "[ . 1 . 2]"
1 34 ALA 1.295 0.097 3 0 "[ . 1 . 2]"
1 35 LEU 7.724 0.159 13 0 "[ . 1 . 2]"
1 36 LYS 0.921 0.112 19 0 "[ . 1 . 2]"
1 37 ASP 4.208 0.234 17 0 "[ . 1 . 2]"
1 38 ARG 5.550 0.234 17 0 "[ . 1 . 2]"
1 39 ARG 0.982 0.097 3 0 "[ . 1 . 2]"
1 40 MET 6.515 0.189 19 0 "[ . 1 . 2]"
1 41 GLU 4.248 0.179 12 0 "[ . 1 . 2]"
1 42 ASN 1.094 0.064 11 0 "[ . 1 . 2]"
1 43 LEU 7.892 0.150 6 0 "[ . 1 . 2]"
1 44 VAL 2.145 0.189 19 0 "[ . 1 . 2]"
1 45 ALA 4.663 0.179 12 0 "[ . 1 . 2]"
1 46 TYR 10.921 0.319 18 0 "[ . 1 . 2]"
1 47 ALA 0.632 0.090 1 0 "[ . 1 . 2]"
1 48 LYS 3.025 0.117 14 0 "[ . 1 . 2]"
1 49 LYS 6.456 0.264 7 0 "[ . 1 . 2]"
1 50 VAL 0.427 0.035 2 0 "[ . 1 . 2]"
1 51 GLU 3.478 0.112 6 0 "[ . 1 . 2]"
1 52 GLY 0.431 0.057 5 0 "[ . 1 . 2]"
1 53 ASP 2.021 0.187 3 0 "[ . 1 . 2]"
1 54 MET 6.438 0.194 3 0 "[ . 1 . 2]"
1 55 TYR 0.399 0.049 8 0 "[ . 1 . 2]"
1 56 GLU 1.467 0.194 3 0 "[ . 1 . 2]"
1 57 SER 2.739 0.149 3 0 "[ . 1 . 2]"
1 58 ALA 1.345 0.116 8 0 "[ . 1 . 2]"
1 59 ASN 2.654 0.122 4 0 "[ . 1 . 2]"
1 60 SER 3.347 0.174 9 0 "[ . 1 . 2]"
1 61 ARG 7.133 0.328 12 0 "[ . 1 . 2]"
1 62 ASP 2.782 0.210 15 0 "[ . 1 . 2]"
1 63 GLU 2.755 0.111 2 0 "[ . 1 . 2]"
1 64 TYR 5.997 0.201 12 0 "[ . 1 . 2]"
1 65 TYR 10.714 0.281 12 0 "[ . 1 . 2]"
1 66 HIS 0.506 0.103 9 0 "[ . 1 . 2]"
1 67 LEU 2.276 0.096 4 0 "[ . 1 . 2]"
1 68 LEU 3.703 0.134 13 0 "[ . 1 . 2]"
1 69 ALA 7.094 0.190 2 0 "[ . 1 . 2]"
1 70 GLU 1.867 0.155 6 0 "[ . 1 . 2]"
1 71 LYS 2.412 0.138 4 0 "[ . 1 . 2]"
1 72 ILE 8.451 0.138 4 0 "[ . 1 . 2]"
1 73 TYR 3.787 0.155 6 0 "[ . 1 . 2]"
1 74 LYS 1.613 0.119 3 0 "[ . 1 . 2]"
1 75 ILE 5.909 0.128 6 0 "[ . 1 . 2]"
1 76 GLN 6.260 0.105 19 0 "[ . 1 . 2]"
1 77 LYS 9.499 0.254 18 0 "[ . 1 . 2]"
1 78 GLU 4.607 0.186 13 0 "[ . 1 . 2]"
1 79 LEU 2.509 0.136 20 0 "[ . 1 . 2]"
1 80 GLU 2.122 0.136 20 0 "[ . 1 . 2]"
1 81 GLU 0.251 0.092 18 0 "[ . 1 . 2]"
1 82 LYS 3.088 0.203 13 0 "[ . 1 . 2]"
1 83 ARG 1.616 0.203 13 0 "[ . 1 . 2]"
1 84 ARG 2.034 0.134 3 0 "[ . 1 . 2]"
1 85 SER 2.890 0.202 10 0 "[ . 1 . 2]"
1 86 ARG 1.850 0.202 10 0 "[ . 1 . 2]"
1 87 LEU 0.956 0.093 19 0 "[ . 1 . 2]"
2 5 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 6 TYR 0.410 0.109 12 0 "[ . 1 . 2]"
2 7 GLY 1.291 0.176 4 0 "[ . 1 . 2]"
2 8 ASN 5.060 0.176 4 0 "[ . 1 . 2]"
2 9 GLN 2.704 0.156 4 0 "[ . 1 . 2]"
2 10 THR 0.982 0.096 10 0 "[ . 1 . 2]"
2 11 LEU 2.984 0.254 18 0 "[ . 1 . 2]"
2 12 GLN 2.298 0.119 1 0 "[ . 1 . 2]"
2 13 ASP 0.016 0.009 3 0 "[ . 1 . 2]"
2 14 LEU 0.203 0.036 8 0 "[ . 1 . 2]"
2 15 LEU 6.005 0.281 12 0 "[ . 1 . 2]"
2 16 THR 0.001 0.001 1 0 "[ . 1 . 2]"
2 17 SER 1.443 0.152 20 0 "[ . 1 . 2]"
2 18 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 20 LEU 1.436 0.110 11 0 "[ . 1 . 2]"
2 21 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 36 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 37 LEU 1.048 0.144 18 0 "[ . 1 . 2]"
2 38 GLU 1.464 0.116 9 0 "[ . 1 . 2]"
2 39 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 40 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 41 MET 1.888 0.171 14 0 "[ . 1 . 2]"
2 42 GLU 2.909 0.221 9 0 "[ . 1 . 2]"
2 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 44 ILE 5.468 0.186 13 0 "[ . 1 . 2]"
2 45 ILE 2.482 0.150 6 0 "[ . 1 . 2]"
2 46 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
2 47 SER 0.188 0.047 20 0 "[ . 1 . 2]"
2 48 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 49 LEU 1.413 0.110 15 0 "[ . 1 . 2]"
2 50 MET 0.000 0.000 . 0 "[ . 1 . 2]"
2 51 ASP 0.023 0.020 10 0 "[ . 1 . 2]"
2 52 ALA 0.023 0.020 10 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 GLY QA 1 2 VAL MG2 4.690 . 4.990 3.586 3.203 4.200 . 0 0 "[ . 1 . 2]" 1
2 1 1 GLY QA 1 2 VAL QG 3.850 . 4.150 3.286 3.039 3.684 . 0 0 "[ . 1 . 2]" 1
3 1 1 GLY QA 1 2 VAL HB 5.480 . 5.780 5.027 4.251 5.676 . 0 0 "[ . 1 . 2]" 1
4 1 1 GLY QA 1 2 VAL HA 4.680 . 4.980 3.940 3.838 4.093 . 0 0 "[ . 1 . 2]" 1
5 1 1 GLY QA 1 2 VAL MG1 4.690 . 4.990 4.141 3.307 5.019 0.029 13 0 "[ . 1 . 2]" 1
6 1 1 GLY QA 1 3 ARG QD 5.500 . 5.800 5.173 3.327 5.896 0.096 12 0 "[ . 1 . 2]" 1
7 1 2 VAL HA 1 2 VAL QG 2.780 . 3.080 2.240 2.130 2.378 . 0 0 "[ . 1 . 2]" 1
8 1 2 VAL HA 1 2 VAL MG1 3.300 . 3.600 2.363 2.238 2.447 . 0 0 "[ . 1 . 2]" 1
9 1 2 VAL HA 1 2 VAL MG2 3.300 . 3.600 2.948 2.347 3.242 . 0 0 "[ . 1 . 2]" 1
10 1 2 VAL H 1 3 ARG HA 5.500 . 5.800 5.034 4.556 5.405 . 0 0 "[ . 1 . 2]" 1
11 1 2 VAL HA 1 3 ARG QB 4.590 . 4.890 4.224 3.751 4.608 . 0 0 "[ . 1 . 2]" 1
12 1 2 VAL HA 1 3 ARG QD 4.240 . 4.540 3.681 2.983 4.642 0.102 11 0 "[ . 1 . 2]" 1
13 1 2 VAL HA 1 3 ARG H 2.560 . 2.860 2.168 1.937 2.554 . 0 0 "[ . 1 . 2]" 1
14 1 2 VAL HB 1 3 ARG H 3.900 . 4.200 3.363 2.199 4.323 0.123 20 0 "[ . 1 . 2]" 1
15 1 2 VAL HB 1 3 ARG HA 4.800 . 5.100 4.677 4.262 5.134 0.034 9 0 "[ . 1 . 2]" 1
16 1 2 VAL MG1 1 3 ARG QD 5.500 . 5.800 4.761 4.255 5.885 0.085 1 0 "[ . 1 . 2]" 1
17 1 2 VAL MG2 1 3 ARG QD 5.500 . 5.800 5.206 4.544 5.920 0.120 11 0 "[ . 1 . 2]" 1
18 1 2 VAL QG 1 3 ARG H 3.300 . 3.600 3.180 2.428 3.625 0.025 15 0 "[ . 1 . 2]" 1
19 1 2 VAL QG 1 3 ARG HA 3.970 . 4.270 3.869 3.413 4.250 . 0 0 "[ . 1 . 2]" 1
20 1 2 VAL HB 1 4 LYS QE 4.980 . 5.280 3.618 2.139 5.170 . 0 0 "[ . 1 . 2]" 1
21 1 2 VAL QG 1 4 LYS QG 3.460 . 3.760 2.582 2.096 3.311 . 0 0 "[ . 1 . 2]" 1
22 1 2 VAL QG 1 4 LYS QE 3.670 . 3.970 2.483 1.901 3.988 0.018 4 0 "[ . 1 . 2]" 1
23 1 2 VAL QG 1 4 LYS QD 3.650 . 3.950 3.406 2.422 3.995 0.045 13 0 "[ . 1 . 2]" 1
24 1 2 VAL QG 1 56 GLU HA 5.440 . 5.740 4.326 1.944 5.773 0.033 9 0 "[ . 1 . 2]" 1
25 1 3 ARG H 1 3 ARG QD 5.110 . 5.410 2.348 1.738 3.813 0.062 8 0 "[ . 1 . 2]" 1
26 1 3 ARG H 1 3 ARG QG 4.280 . 4.580 3.281 1.800 4.038 0.000 4 0 "[ . 1 . 2]" 1
27 1 3 ARG H 1 3 ARG QB 2.600 . 2.900 2.719 2.108 3.019 0.119 20 0 "[ . 1 . 2]" 1
28 1 3 ARG HA 1 3 ARG QD 3.740 . 4.040 3.297 1.797 4.169 0.129 4 0 "[ . 1 . 2]" 1
29 1 3 ARG HA 1 3 ARG QG 3.560 . 3.860 3.279 2.373 3.599 . 0 0 "[ . 1 . 2]" 1
30 1 3 ARG QB 1 3 ARG QD 2.950 . 3.250 2.416 2.038 2.899 . 0 0 "[ . 1 . 2]" 1
31 1 3 ARG H 1 4 LYS QE 5.350 . 5.650 5.001 3.058 5.738 0.088 19 0 "[ . 1 . 2]" 1
32 1 3 ARG H 1 4 LYS H 3.990 . 4.290 3.881 2.180 4.390 0.100 12 0 "[ . 1 . 2]" 1
33 1 3 ARG HA 1 4 LYS QG 4.700 . 5.000 3.675 3.078 4.321 . 0 0 "[ . 1 . 2]" 1
34 1 3 ARG HA 1 4 LYS QE 5.500 . 5.800 5.443 4.762 5.833 0.033 15 0 "[ . 1 . 2]" 1
35 1 3 ARG HA 1 4 LYS H 2.870 . 3.170 2.158 1.932 3.001 . 0 0 "[ . 1 . 2]" 1
36 1 3 ARG QB 1 4 LYS H 4.080 . 4.380 3.587 3.009 3.994 . 0 0 "[ . 1 . 2]" 1
37 1 3 ARG QB 1 4 LYS HA 4.790 . 5.090 4.554 4.213 4.891 . 0 0 "[ . 1 . 2]" 1
38 1 3 ARG QD 1 4 LYS H 5.320 . 5.620 4.507 3.298 5.279 . 0 0 "[ . 1 . 2]" 1
39 1 3 ARG QG 1 4 LYS HA 4.750 . 5.050 4.398 3.511 5.135 0.085 14 0 "[ . 1 . 2]" 1
40 1 3 ARG QG 1 4 LYS H 4.410 . 4.710 4.032 3.143 4.627 . 0 0 "[ . 1 . 2]" 1
41 1 4 LYS H 1 4 LYS QD 4.740 . 5.040 4.167 3.531 4.854 . 0 0 "[ . 1 . 2]" 1
42 1 4 LYS H 1 4 LYS QE 4.660 . 4.960 4.492 3.651 5.017 0.057 5 0 "[ . 1 . 2]" 1
43 1 4 LYS H 1 4 LYS HG2 3.750 . 4.050 3.088 1.812 4.073 0.023 8 0 "[ . 1 . 2]" 1
44 1 4 LYS H 1 4 LYS HG3 3.750 . 4.050 2.770 1.825 3.287 . 0 0 "[ . 1 . 2]" 1
45 1 4 LYS H 1 4 LYS HB3 3.750 . 4.050 3.539 2.929 3.834 . 0 0 "[ . 1 . 2]" 1
46 1 4 LYS HA 1 4 LYS HG3 3.940 . 4.240 3.484 2.853 3.919 . 0 0 "[ . 1 . 2]" 1
47 1 4 LYS HA 1 4 LYS HG2 3.940 . 4.240 3.130 2.471 3.767 . 0 0 "[ . 1 . 2]" 1
48 1 4 LYS HA 1 4 LYS QE 4.800 . 5.100 4.571 3.949 5.272 0.172 20 0 "[ . 1 . 2]" 1
49 1 4 LYS HB2 1 4 LYS QD 3.430 . 3.730 2.436 2.262 2.850 . 0 0 "[ . 1 . 2]" 1
50 1 4 LYS HB2 1 4 LYS QE 3.960 . 4.260 3.522 2.044 4.120 . 0 0 "[ . 1 . 2]" 1
51 1 4 LYS QE 1 4 LYS HG2 3.650 . 3.950 2.485 2.110 3.358 . 0 0 "[ . 1 . 2]" 1
52 1 4 LYS QE 1 4 LYS HG3 3.650 . 3.950 2.902 2.413 3.383 . 0 0 "[ . 1 . 2]" 1
53 1 4 LYS HA 1 5 GLY QA 4.600 . 4.900 3.869 3.752 3.999 . 0 0 "[ . 1 . 2]" 1
54 1 4 LYS HB2 1 5 GLY QA 5.340 . 5.640 4.816 4.587 5.100 . 0 0 "[ . 1 . 2]" 1
55 1 4 LYS HB2 1 5 GLY H 4.680 . 4.980 3.923 3.332 4.412 . 0 0 "[ . 1 . 2]" 1
56 1 4 LYS QG 1 5 GLY QA 5.180 . 5.480 5.148 4.479 5.510 0.030 9 0 "[ . 1 . 2]" 1
57 1 4 LYS HA 1 6 TRP HD1 4.870 . 5.170 4.146 3.333 4.835 . 0 0 "[ . 1 . 2]" 1
58 1 4 LYS HA 1 6 TRP HE1 4.490 . 4.790 4.624 4.115 4.835 0.045 18 0 "[ . 1 . 2]" 1
59 1 4 LYS HB2 1 6 TRP H 4.340 . 4.640 3.495 3.005 4.196 . 0 0 "[ . 1 . 2]" 1
60 1 4 LYS HB2 1 6 TRP HD1 4.670 . 4.970 3.180 2.334 4.217 . 0 0 "[ . 1 . 2]" 1
61 1 4 LYS HB2 1 6 TRP HE1 3.810 . 4.110 2.654 2.115 3.313 . 0 0 "[ . 1 . 2]" 1
62 1 4 LYS HB3 1 6 TRP H 4.740 . 5.040 3.945 3.200 4.877 . 0 0 "[ . 1 . 2]" 1
63 1 4 LYS HB3 1 6 TRP HE1 4.470 . 4.770 2.664 1.978 3.329 . 0 0 "[ . 1 . 2]" 1
64 1 4 LYS HD2 1 6 TRP HD1 5.500 . 5.800 5.175 4.092 5.832 0.032 3 0 "[ . 1 . 2]" 1
65 1 4 LYS HD2 1 6 TRP HZ2 5.110 . 5.410 2.810 2.274 3.388 . 0 0 "[ . 1 . 2]" 1
66 1 4 LYS HD3 1 6 TRP HZ2 5.110 . 5.410 2.852 2.117 4.200 . 0 0 "[ . 1 . 2]" 1
67 1 4 LYS HD3 1 6 TRP HD1 5.500 . 5.800 4.253 3.945 5.561 . 0 0 "[ . 1 . 2]" 1
68 1 4 LYS HG2 1 6 TRP HZ2 5.500 . 5.800 5.155 4.798 5.400 . 0 0 "[ . 1 . 2]" 1
69 1 4 LYS HG3 1 6 TRP HZ2 5.500 . 5.800 4.645 3.866 5.560 . 0 0 "[ . 1 . 2]" 1
70 1 4 LYS QD 1 6 TRP HZ2 4.470 . 4.770 2.363 2.050 2.799 . 0 0 "[ . 1 . 2]" 1
71 1 4 LYS QD 1 6 TRP HE1 3.840 . 4.140 1.936 1.775 2.333 0.025 14 0 "[ . 1 . 2]" 1
72 1 4 LYS QD 1 6 TRP HD1 4.770 . 5.070 3.978 3.775 4.193 . 0 0 "[ . 1 . 2]" 1
73 1 4 LYS QE 1 6 TRP HZ2 5.350 . 5.650 3.758 3.109 4.541 . 0 0 "[ . 1 . 2]" 1
74 1 4 LYS QE 1 6 TRP HD1 5.500 . 5.800 5.289 4.481 5.862 0.062 19 0 "[ . 1 . 2]" 1
75 1 4 LYS QG 1 6 TRP HZ2 4.730 . 5.030 4.297 3.717 4.812 . 0 0 "[ . 1 . 2]" 1
76 1 4 LYS QG 1 6 TRP HD1 5.270 . 5.570 4.412 3.957 4.710 . 0 0 "[ . 1 . 2]" 1
77 1 4 LYS HB2 1 7 HIS H 4.620 . 4.920 3.940 3.167 4.366 . 0 0 "[ . 1 . 2]" 1
78 1 4 LYS HB3 1 7 HIS H 5.500 . 5.800 5.031 4.045 5.870 0.070 12 0 "[ . 1 . 2]" 1
79 1 4 LYS QD 1 7 HIS H 5.340 . 5.640 5.264 4.587 5.671 0.031 8 0 "[ . 1 . 2]" 1
80 1 4 LYS QG 1 7 HIS H 5.190 . 5.490 4.715 3.449 5.547 0.057 14 0 "[ . 1 . 2]" 1
81 1 4 LYS HD2 1 56 GLU HA 4.380 . 4.680 3.387 2.449 4.642 . 0 0 "[ . 1 . 2]" 1
82 1 4 LYS HD3 1 56 GLU HA 4.380 . 4.680 4.410 3.825 4.756 0.076 5 0 "[ . 1 . 2]" 1
83 1 4 LYS QD 1 56 GLU QB 4.740 . 5.040 4.710 3.873 5.108 0.068 3 0 "[ . 1 . 2]" 1
84 1 4 LYS QD 1 56 GLU HA 3.830 . 4.130 3.252 2.422 4.085 . 0 0 "[ . 1 . 2]" 1
85 1 4 LYS QE 1 56 GLU HA 4.440 . 4.740 3.265 2.285 4.195 . 0 0 "[ . 1 . 2]" 1
86 1 4 LYS QE 1 56 GLU QG 5.340 . 5.640 4.677 3.666 5.319 . 0 0 "[ . 1 . 2]" 1
87 1 4 LYS QE 1 57 SER H 5.500 . 5.800 5.451 4.421 5.949 0.149 3 0 "[ . 1 . 2]" 1
88 1 4 LYS HB2 1 59 ASN HA 4.930 . 5.230 4.773 4.049 5.310 0.080 8 0 "[ . 1 . 2]" 1
89 1 4 LYS HB3 1 59 ASN QB 5.180 . 5.480 5.350 4.988 5.598 0.118 17 0 "[ . 1 . 2]" 1
90 1 4 LYS HD2 1 59 ASN HA 5.000 . 5.300 4.746 3.179 5.422 0.122 4 0 "[ . 1 . 2]" 1
91 1 4 LYS HD3 1 59 ASN HA 5.000 . 5.300 3.529 2.627 4.243 . 0 0 "[ . 1 . 2]" 1
92 1 4 LYS QD 1 59 ASN HA 3.880 . 4.180 3.376 2.597 3.864 . 0 0 "[ . 1 . 2]" 1
93 1 4 LYS QE 1 59 ASN HA 5.310 . 5.610 4.242 3.236 5.231 . 0 0 "[ . 1 . 2]" 1
94 1 5 GLY H 1 6 TRP H 4.280 . 4.580 2.826 2.594 2.951 . 0 0 "[ . 1 . 2]" 1
95 1 5 GLY QA 1 7 HIS H 4.320 . 4.620 3.361 3.075 3.616 . 0 0 "[ . 1 . 2]" 1
96 1 5 GLY QA 1 7 HIS QB 5.180 . 5.480 4.750 3.415 5.529 0.049 11 0 "[ . 1 . 2]" 1
97 1 5 GLY HA2 1 8 GLU QG 4.960 . 5.260 3.857 3.299 4.419 . 0 0 "[ . 1 . 2]" 1
98 1 5 GLY HA3 1 8 GLU QG 4.960 . 5.260 4.848 4.287 5.286 0.026 18 0 "[ . 1 . 2]" 1
99 1 5 GLY QA 1 8 GLU H 5.060 . 5.360 4.033 3.771 4.309 . 0 0 "[ . 1 . 2]" 1
100 1 6 TRP H 1 6 TRP HB2 3.740 . 4.040 3.632 3.598 3.678 . 0 0 "[ . 1 . 2]" 1
101 1 6 TRP H 1 6 TRP HD1 3.230 . 3.530 2.527 2.399 2.661 . 0 0 "[ . 1 . 2]" 1
102 1 6 TRP H 1 6 TRP HE1 4.670 . 4.970 4.417 4.212 4.666 . 0 0 "[ . 1 . 2]" 1
103 1 6 TRP H 1 6 TRP HB3 3.260 . 3.560 2.681 2.531 2.834 . 0 0 "[ . 1 . 2]" 1
104 1 6 TRP HA 1 6 TRP HD1 4.810 . 5.110 4.433 4.349 4.553 . 0 0 "[ . 1 . 2]" 1
105 1 6 TRP HB3 1 6 TRP HE1 4.920 . 5.220 4.741 4.714 4.775 . 0 0 "[ . 1 . 2]" 1
106 1 6 TRP H 1 7 HIS H 3.580 . 3.880 2.670 2.337 2.832 . 0 0 "[ . 1 . 2]" 1
107 1 6 TRP H 1 7 HIS HD2 5.500 . 5.800 4.501 3.793 5.862 0.062 7 0 "[ . 1 . 2]" 1
108 1 6 TRP H 1 7 HIS QB 4.850 . 5.150 4.715 3.759 5.055 . 0 0 "[ . 1 . 2]" 1
109 1 6 TRP H 1 7 HIS HB3 5.000 . 5.300 4.935 4.698 5.266 . 0 0 "[ . 1 . 2]" 1
110 1 6 TRP HB2 1 7 HIS HA 5.220 . 5.520 4.686 4.322 5.023 . 0 0 "[ . 1 . 2]" 1
111 1 6 TRP HB3 1 7 HIS H 4.760 . 5.060 4.368 4.217 4.496 . 0 0 "[ . 1 . 2]" 1
112 1 6 TRP HE3 1 7 HIS HA 5.070 . 5.370 3.120 2.671 3.653 . 0 0 "[ . 1 . 2]" 1
113 1 6 TRP HZ3 1 7 HIS HA 5.050 . 5.350 3.865 3.434 4.350 . 0 0 "[ . 1 . 2]" 1
114 1 6 TRP HA 1 8 GLU QB 4.890 . 5.190 4.536 4.054 5.258 0.068 5 0 "[ . 1 . 2]" 1
115 1 6 TRP HA 1 8 GLU H 4.170 . 4.470 3.489 3.267 3.636 . 0 0 "[ . 1 . 2]" 1
116 1 6 TRP H 1 9 HIS H 5.500 . 5.800 5.532 5.404 5.734 . 0 0 "[ . 1 . 2]" 1
117 1 6 TRP HA 1 9 HIS H 4.480 . 4.780 3.427 3.237 3.759 . 0 0 "[ . 1 . 2]" 1
118 1 6 TRP HA 1 9 HIS HD2 3.900 . 4.200 2.273 1.932 2.796 . 0 0 "[ . 1 . 2]" 1
119 1 6 TRP HA 1 9 HIS HB3 5.000 . 5.300 4.702 4.300 5.293 . 0 0 "[ . 1 . 2]" 1
120 1 6 TRP HE3 1 10 VAL HB 5.290 . 5.590 3.506 2.566 5.097 . 0 0 "[ . 1 . 2]" 1
121 1 6 TRP HE3 1 10 VAL QG 3.550 . 3.850 2.412 2.062 2.753 . 0 0 "[ . 1 . 2]" 1
122 1 6 TRP HZ3 1 10 VAL QG 3.360 . 3.660 2.004 1.880 2.321 . 0 0 "[ . 1 . 2]" 1
123 1 6 TRP HZ3 1 10 VAL HB 4.920 . 5.220 3.586 3.003 4.441 . 0 0 "[ . 1 . 2]" 1
124 1 6 TRP HZ2 1 55 TYR HA 4.550 . 4.850 4.100 3.665 4.847 . 0 0 "[ . 1 . 2]" 1
125 1 6 TRP HZ3 1 55 TYR HA 4.820 . 5.120 4.258 3.984 4.509 . 0 0 "[ . 1 . 2]" 1
126 1 6 TRP HZ2 1 56 GLU QG 5.340 . 5.640 5.587 5.092 5.721 0.081 2 0 "[ . 1 . 2]" 1
127 1 6 TRP HZ2 1 56 GLU HA 4.050 . 4.350 3.814 3.267 4.148 . 0 0 "[ . 1 . 2]" 1
128 1 6 TRP HZ2 1 58 ALA MB 3.740 . 4.040 3.199 2.806 3.729 . 0 0 "[ . 1 . 2]" 1
129 1 6 TRP HZ2 1 58 ALA HA 5.500 . 5.800 5.081 4.754 5.357 . 0 0 "[ . 1 . 2]" 1
130 1 6 TRP HZ3 1 58 ALA MB 5.030 . 5.330 4.748 4.475 5.096 . 0 0 "[ . 1 . 2]" 1
131 1 6 TRP HB3 1 59 ASN HA 5.500 . 5.800 5.734 4.927 5.842 0.042 15 0 "[ . 1 . 2]" 1
132 1 6 TRP HD1 1 59 ASN HA 4.280 . 4.580 3.721 3.027 3.915 . 0 0 "[ . 1 . 2]" 1
133 1 6 TRP HE1 1 59 ASN QB 4.870 . 5.170 4.064 3.664 4.486 . 0 0 "[ . 1 . 2]" 1
134 1 6 TRP HE1 1 59 ASN HA 3.290 . 3.590 2.336 2.030 2.584 . 0 0 "[ . 1 . 2]" 1
135 1 6 TRP HB2 1 60 SER HA 4.490 . 4.790 2.866 2.346 3.235 . 0 0 "[ . 1 . 2]" 1
136 1 6 TRP HB3 1 60 SER HA 4.180 . 4.480 3.159 2.621 3.560 . 0 0 "[ . 1 . 2]" 1
137 1 6 TRP HD1 1 60 SER H 5.410 . 5.710 4.997 4.602 5.296 . 0 0 "[ . 1 . 2]" 1
138 1 6 TRP HD1 1 60 SER QB 5.300 . 5.600 5.034 4.116 5.602 0.002 15 0 "[ . 1 . 2]" 1
139 1 6 TRP HD1 1 60 SER HA 4.240 . 4.540 3.706 2.941 4.068 . 0 0 "[ . 1 . 2]" 1
140 1 6 TRP HE1 1 60 SER HA 4.860 . 5.160 4.272 3.775 4.759 . 0 0 "[ . 1 . 2]" 1
141 1 6 TRP HE1 1 60 SER H 4.260 . 4.560 4.096 3.842 4.450 . 0 0 "[ . 1 . 2]" 1
142 1 6 TRP HE1 1 60 SER QB 5.500 . 5.800 5.621 5.174 5.846 0.046 1 0 "[ . 1 . 2]" 1
143 1 6 TRP HA 1 61 ARG H 5.330 . 5.630 5.307 4.669 5.644 0.014 13 0 "[ . 1 . 2]" 1
144 1 6 TRP HB2 1 61 ARG HD2 5.500 . 5.800 3.126 2.273 4.556 . 0 0 "[ . 1 . 2]" 1
145 1 6 TRP HB2 1 61 ARG HA 5.500 . 5.800 5.092 4.526 5.602 . 0 0 "[ . 1 . 2]" 1
146 1 6 TRP HB2 1 61 ARG H 4.240 . 4.540 2.939 2.309 3.334 . 0 0 "[ . 1 . 2]" 1
147 1 6 TRP HB2 1 61 ARG QD 4.820 . 5.120 3.032 2.228 4.413 . 0 0 "[ . 1 . 2]" 1
148 1 6 TRP HB2 1 61 ARG HD3 5.500 . 5.800 4.136 3.205 5.902 0.102 5 0 "[ . 1 . 2]" 1
149 1 6 TRP HE3 1 61 ARG HG2 5.210 . 5.510 4.938 4.078 5.310 . 0 0 "[ . 1 . 2]" 1
150 1 6 TRP HE3 1 61 ARG HB2 5.000 . 5.300 3.858 3.391 4.642 . 0 0 "[ . 1 . 2]" 1
151 1 6 TRP HE3 1 61 ARG HA 4.630 . 4.930 3.481 3.171 3.826 . 0 0 "[ . 1 . 2]" 1
152 1 6 TRP HE3 1 61 ARG HB3 4.700 . 5.000 2.250 1.920 3.060 . 0 0 "[ . 1 . 2]" 1
153 1 6 TRP HZ3 1 61 ARG HA 4.840 . 5.140 2.779 2.534 3.181 . 0 0 "[ . 1 . 2]" 1
154 1 6 TRP HZ3 1 64 TYR HB2 5.500 . 5.800 4.877 4.627 5.219 . 0 0 "[ . 1 . 2]" 1
155 1 6 TRP HZ3 1 64 TYR HB3 4.980 . 5.280 3.916 3.646 4.197 . 0 0 "[ . 1 . 2]" 1
156 1 6 TRP HA 1 7 HIS H 5.000 . 5.300 3.352 3.161 3.484 . 0 0 "[ . 1 . 2]" 1
157 1 7 HIS H 1 7 HIS HD2 5.100 . 5.400 2.784 2.066 4.345 . 0 0 "[ . 1 . 2]" 1
158 1 7 HIS H 1 7 HIS QB 3.110 . 3.410 2.530 1.990 2.928 . 0 0 "[ . 1 . 2]" 1
159 1 7 HIS H 1 8 GLU QG 4.580 . 4.880 4.037 3.856 4.531 . 0 0 "[ . 1 . 2]" 1
160 1 7 HIS H 1 8 GLU QB 5.500 . 5.800 4.767 4.587 4.995 . 0 0 "[ . 1 . 2]" 1
161 1 7 HIS H 1 8 GLU H 3.340 . 3.640 2.678 2.578 2.880 . 0 0 "[ . 1 . 2]" 1
162 1 7 HIS QB 1 8 GLU H 3.890 . 4.190 3.676 2.592 3.941 . 0 0 "[ . 1 . 2]" 1
163 1 7 HIS HA 1 9 HIS HB2 5.500 . 5.800 4.958 4.422 5.441 . 0 0 "[ . 1 . 2]" 1
164 1 7 HIS HA 1 9 HIS H 4.620 . 4.920 3.537 3.063 3.770 . 0 0 "[ . 1 . 2]" 1
165 1 7 HIS QB 1 9 HIS H 5.050 . 5.350 4.746 4.352 4.945 . 0 0 "[ . 1 . 2]" 1
166 1 7 HIS HA 1 10 VAL QG . . 4.050 2.024 1.887 2.176 . 0 0 "[ . 1 . 2]" 1
167 1 7 HIS HA 1 10 VAL H 3.960 . 4.260 3.686 3.313 3.927 . 0 0 "[ . 1 . 2]" 1
168 1 7 HIS HA 1 10 VAL HB 4.000 . 4.300 4.280 4.008 4.396 0.096 7 0 "[ . 1 . 2]" 1
169 1 7 HIS QB 1 10 VAL QG 4.300 . 4.600 3.300 2.872 3.912 . 0 0 "[ . 1 . 2]" 1
170 1 7 HIS QB 1 10 VAL H 5.260 . 5.560 4.942 4.650 5.119 . 0 0 "[ . 1 . 2]" 1
171 1 7 HIS HA 1 55 TYR QE 4.570 . 4.870 3.730 3.077 4.321 . 0 0 "[ . 1 . 2]" 1
172 1 7 HIS HA 1 8 GLU H 4.500 . 4.800 3.375 3.117 3.510 . 0 0 "[ . 1 . 2]" 1
173 1 8 GLU H 1 8 GLU QB 2.990 . 3.290 2.470 2.336 2.756 . 0 0 "[ . 1 . 2]" 1
174 1 8 GLU H 1 8 GLU QG 3.290 . 3.590 2.257 1.938 2.506 . 0 0 "[ . 1 . 2]" 1
175 1 8 GLU HA 1 8 GLU QG 3.020 . 3.320 2.709 2.395 3.336 0.016 15 0 "[ . 1 . 2]" 1
176 1 8 GLU H 1 9 HIS H 3.440 . 3.740 2.396 2.282 2.530 . 0 0 "[ . 1 . 2]" 1
177 1 8 GLU H 1 9 HIS HA 5.330 . 5.630 4.974 4.882 5.139 . 0 0 "[ . 1 . 2]" 1
178 1 8 GLU HA 1 9 HIS HA 5.030 . 5.330 4.610 4.421 4.723 . 0 0 "[ . 1 . 2]" 1
179 1 8 GLU HA 1 9 HIS HD2 5.260 . 5.560 4.992 4.646 5.543 . 0 0 "[ . 1 . 2]" 1
180 1 8 GLU HB2 1 9 HIS HD2 4.660 . 4.960 3.225 2.374 4.969 0.009 17 0 "[ . 1 . 2]" 1
181 1 8 GLU HB3 1 9 HIS HD2 4.660 . 4.960 4.435 3.763 4.986 0.026 17 0 "[ . 1 . 2]" 1
182 1 8 GLU QB 1 9 HIS HA 5.030 . 5.330 4.160 3.894 4.606 . 0 0 "[ . 1 . 2]" 1
183 1 8 GLU QB 1 9 HIS H 3.870 . 4.170 3.321 2.927 3.820 . 0 0 "[ . 1 . 2]" 1
184 1 8 GLU QG 1 9 HIS H 4.360 . 4.660 3.944 2.579 4.449 . 0 0 "[ . 1 . 2]" 1
185 1 8 GLU QG 1 9 HIS HD2 4.820 . 5.120 3.951 1.952 4.867 . 0 0 "[ . 1 . 2]" 1
186 1 8 GLU QG 1 9 HIS HA 5.500 . 5.800 5.373 3.526 5.888 0.088 2 0 "[ . 1 . 2]" 1
187 1 8 GLU H 1 10 VAL QG 4.610 . 4.910 4.067 3.884 4.203 . 0 0 "[ . 1 . 2]" 1
188 1 8 GLU HA 1 10 VAL H 4.150 . 4.450 3.657 3.333 4.361 . 0 0 "[ . 1 . 2]" 1
189 1 8 GLU HA 1 10 VAL QG 4.510 . 4.810 4.390 4.111 4.639 . 0 0 "[ . 1 . 2]" 1
190 1 8 GLU QB 1 10 VAL H 4.820 . 5.120 4.648 4.459 4.838 . 0 0 "[ . 1 . 2]" 1
191 1 8 GLU HA 1 9 HIS H 4.500 . 4.800 3.323 3.214 3.441 . 0 0 "[ . 1 . 2]" 1
192 1 9 HIS H 1 9 HIS HB2 3.740 . 4.040 2.434 2.366 2.492 . 0 0 "[ . 1 . 2]" 1
193 1 9 HIS H 1 9 HIS HD2 4.130 . 4.430 2.780 2.322 3.003 . 0 0 "[ . 1 . 2]" 1
194 1 9 HIS H 1 9 HIS HB3 3.630 . 3.930 3.652 3.615 3.702 . 0 0 "[ . 1 . 2]" 1
195 1 9 HIS H 1 10 VAL HB 5.500 . 5.800 4.591 4.250 5.188 . 0 0 "[ . 1 . 2]" 1
196 1 9 HIS H 1 10 VAL QG 4.230 . 4.530 3.074 2.896 3.376 . 0 0 "[ . 1 . 2]" 1
197 1 9 HIS HA 1 10 VAL H 3.450 . 3.750 3.194 3.060 3.456 . 0 0 "[ . 1 . 2]" 1
198 1 9 HIS HA 1 10 VAL QG 4.810 . 5.110 4.534 4.128 4.769 . 0 0 "[ . 1 . 2]" 1
199 1 9 HIS HA 1 10 VAL HA 5.200 . 5.500 4.450 4.358 4.573 . 0 0 "[ . 1 . 2]" 1
200 1 9 HIS HB2 1 10 VAL QG 4.410 . 4.710 3.735 2.850 4.136 . 0 0 "[ . 1 . 2]" 1
201 1 9 HIS HB2 1 10 VAL H 4.020 . 4.320 3.558 2.890 3.824 . 0 0 "[ . 1 . 2]" 1
202 1 9 HIS HB3 1 10 VAL QG 5.010 . 5.310 4.520 3.785 4.810 . 0 0 "[ . 1 . 2]" 1
203 1 9 HIS HB3 1 10 VAL H 4.310 . 4.610 4.196 3.781 4.334 . 0 0 "[ . 1 . 2]" 1
204 1 9 HIS HB3 1 10 VAL HA 4.800 . 5.100 4.695 4.423 4.893 . 0 0 "[ . 1 . 2]" 1
205 1 9 HIS HD2 1 10 VAL H 5.440 . 5.740 4.952 4.567 5.245 . 0 0 "[ . 1 . 2]" 1
206 1 9 HIS HA 1 61 ARG HG3 5.250 . 5.550 5.274 4.861 5.568 0.018 20 0 "[ . 1 . 2]" 1
207 1 9 HIS HB2 1 61 ARG HD2 . . 5.300 2.823 2.306 4.467 . 0 0 "[ . 1 . 2]" 1
208 1 9 HIS HB2 1 61 ARG HD3 5.000 . 5.300 4.325 3.853 5.221 . 0 0 "[ . 1 . 2]" 1
209 1 9 HIS HB3 1 61 ARG HG3 3.570 . 3.870 3.872 3.393 3.928 0.058 8 0 "[ . 1 . 2]" 1
210 1 10 VAL H 1 10 VAL QG . . 3.310 2.205 1.922 2.353 . 0 0 "[ . 1 . 2]" 1
211 1 10 VAL H 1 10 VAL HB 3.410 . 3.710 3.153 2.773 3.310 . 0 0 "[ . 1 . 2]" 1
212 1 10 VAL HA 1 10 VAL QG . . 3.230 2.311 2.134 2.378 . 0 0 "[ . 1 . 2]" 1
213 1 10 VAL HA 1 11 THR H 2.850 . 3.150 2.088 2.030 2.175 . 0 0 "[ . 1 . 2]" 1
214 1 10 VAL HA 1 11 THR HB 5.500 . 5.800 4.871 4.545 5.493 . 0 0 "[ . 1 . 2]" 1
215 1 10 VAL HB 1 11 THR H 4.360 . 4.660 4.224 3.894 4.409 . 0 0 "[ . 1 . 2]" 1
216 1 10 VAL QG 1 11 THR H 3.440 . 3.740 3.009 2.749 3.250 . 0 0 "[ . 1 . 2]" 1
217 1 10 VAL QG 1 11 THR HA 5.090 . 5.390 4.006 3.603 4.531 . 0 0 "[ . 1 . 2]" 1
218 1 10 VAL QG 1 12 GLN HA 5.440 . 5.740 4.445 4.044 5.131 . 0 0 "[ . 1 . 2]" 1
219 1 10 VAL HA 1 14 LEU MD1 5.000 . 5.300 3.718 3.254 4.123 . 0 0 "[ . 1 . 2]" 1
220 1 10 VAL HA 1 14 LEU HG 4.400 . 4.700 4.042 3.929 4.188 . 0 0 "[ . 1 . 2]" 1
221 1 10 VAL HA 1 14 LEU QD 3.830 . 4.130 3.650 3.227 3.997 . 0 0 "[ . 1 . 2]" 1
222 1 10 VAL HA 1 14 LEU H 5.500 . 5.800 5.540 5.183 5.805 0.005 16 0 "[ . 1 . 2]" 1
223 1 10 VAL HA 1 14 LEU HB3 4.690 . 4.990 3.799 3.492 4.019 . 0 0 "[ . 1 . 2]" 1
224 1 10 VAL HA 1 14 LEU HB2 4.890 . 5.190 4.573 4.251 4.764 . 0 0 "[ . 1 . 2]" 1
225 1 10 VAL HA 1 14 LEU MD2 5.000 . 5.300 5.367 5.306 5.423 0.123 10 0 "[ . 1 . 2]" 1
226 1 10 VAL HB 1 14 LEU QD 4.770 . 5.070 3.966 3.689 4.207 . 0 0 "[ . 1 . 2]" 1
227 1 10 VAL HB 1 14 LEU MD1 5.000 . 5.300 4.010 3.726 4.262 . 0 0 "[ . 1 . 2]" 1
228 1 10 VAL QG 1 14 LEU HA 5.190 . 5.490 5.061 4.677 5.349 . 0 0 "[ . 1 . 2]" 1
229 1 10 VAL QG 1 14 LEU QD 3.100 . 3.400 1.908 1.817 2.099 . 0 0 "[ . 1 . 2]" 1
230 1 10 VAL QG 1 14 LEU HB2 3.970 . 4.270 4.023 3.432 4.303 0.033 7 0 "[ . 1 . 2]" 1
231 1 10 VAL QG 1 14 LEU HB3 3.790 . 4.090 2.750 2.220 3.073 . 0 0 "[ . 1 . 2]" 1
232 1 10 VAL HB 1 15 ARG HB3 5.500 . 5.800 5.044 3.198 5.666 . 0 0 "[ . 1 . 2]" 1
233 1 10 VAL QG 1 15 ARG QD . . 3.860 2.577 2.361 3.183 . 0 0 "[ . 1 . 2]" 1
234 1 10 VAL QG 1 15 ARG HA 4.270 . 4.570 3.738 3.197 4.009 . 0 0 "[ . 1 . 2]" 1
235 1 10 VAL QG 1 15 ARG QG 4.460 . 4.760 3.328 3.162 3.649 . 0 0 "[ . 1 . 2]" 1
236 1 10 VAL QG 1 15 ARG H 4.010 . 4.310 3.152 2.755 3.507 . 0 0 "[ . 1 . 2]" 1
237 1 10 VAL QG 1 15 ARG HB3 4.270 . 4.570 2.533 2.219 2.802 . 0 0 "[ . 1 . 2]" 1
238 1 10 VAL HB 1 55 TYR QE 4.000 . 4.300 3.949 2.293 4.326 0.026 10 0 "[ . 1 . 2]" 1
239 1 10 VAL QG 1 55 TYR QE . . 3.850 1.994 1.830 2.918 . 0 0 "[ . 1 . 2]" 1
240 1 10 VAL QG 1 55 TYR QD . . 4.150 3.120 2.811 3.381 . 0 0 "[ . 1 . 2]" 1
241 1 10 VAL QG 1 55 TYR HA 5.440 . 5.740 4.883 4.601 5.129 . 0 0 "[ . 1 . 2]" 1
242 1 10 VAL QG 1 55 TYR HB2 5.370 . 5.670 4.973 4.594 5.228 . 0 0 "[ . 1 . 2]" 1
243 1 10 VAL QG 1 60 SER QB 5.440 . 5.740 5.726 5.206 5.905 0.165 3 0 "[ . 1 . 2]" 1
244 1 10 VAL HA 1 61 ARG HB2 5.440 . 5.740 4.203 3.837 4.647 . 0 0 "[ . 1 . 2]" 1
245 1 10 VAL HA 1 61 ARG HB3 4.610 . 4.910 4.180 3.713 4.582 . 0 0 "[ . 1 . 2]" 1
246 1 10 VAL HA 1 61 ARG HG2 5.500 . 5.800 4.604 2.461 5.367 . 0 0 "[ . 1 . 2]" 1
247 1 10 VAL HB 1 61 ARG HA 5.450 . 5.750 4.456 3.890 5.828 0.078 5 0 "[ . 1 . 2]" 1
248 1 10 VAL HB 1 61 ARG HG3 4.420 . 4.720 2.807 2.091 4.786 0.066 5 0 "[ . 1 . 2]" 1
249 1 10 VAL HB 1 61 ARG HB3 3.140 . 3.440 2.346 1.867 3.768 0.328 12 0 "[ . 1 . 2]" 1
250 1 10 VAL QG 1 61 ARG HG3 . . 4.630 2.850 2.015 3.141 . 0 0 "[ . 1 . 2]" 1
251 1 10 VAL QG 1 61 ARG HD2 5.000 . 5.300 3.608 2.389 3.926 . 0 0 "[ . 1 . 2]" 1
252 1 10 VAL QG 1 61 ARG HD3 5.000 . 5.300 4.466 3.552 4.736 . 0 0 "[ . 1 . 2]" 1
253 1 10 VAL QG 1 61 ARG HA . . 3.700 3.474 3.111 3.670 . 0 0 "[ . 1 . 2]" 1
254 1 10 VAL QG 1 61 ARG HB2 . . 3.860 2.296 2.114 2.468 . 0 0 "[ . 1 . 2]" 1
255 1 10 VAL QG 1 61 ARG HB3 4.790 . 5.090 2.390 1.682 2.687 0.118 9 0 "[ . 1 . 2]" 1
256 1 10 VAL QG 1 61 ARG HG2 4.780 . 5.080 3.616 2.104 4.028 . 0 0 "[ . 1 . 2]" 1
257 1 10 VAL QG 1 61 ARG QD 4.100 . 4.400 3.446 2.358 3.746 . 0 0 "[ . 1 . 2]" 1
258 1 10 VAL QG 1 64 TYR QD . . 4.790 3.269 3.108 3.459 . 0 0 "[ . 1 . 2]" 1
259 1 10 VAL QG 1 64 TYR QE 4.720 . 5.020 2.185 2.002 2.345 . 0 0 "[ . 1 . 2]" 1
260 1 10 VAL QG 1 65 TYR QB 5.440 . 5.740 4.515 4.227 4.789 . 0 0 "[ . 1 . 2]" 1
261 1 11 THR H 1 11 THR MG 3.520 . 3.820 3.540 2.889 3.772 . 0 0 "[ . 1 . 2]" 1
262 1 11 THR H 1 11 THR HB 4.050 . 4.350 2.815 2.529 3.413 . 0 0 "[ . 1 . 2]" 1
263 1 11 THR HA 1 11 THR MG 2.830 . 3.130 2.189 1.979 2.290 . 0 0 "[ . 1 . 2]" 1
264 1 11 THR H 1 12 GLN H 4.610 . 4.910 4.538 4.436 4.631 . 0 0 "[ . 1 . 2]" 1
265 1 11 THR HA 1 12 GLN HA 5.020 . 5.320 4.330 4.199 4.419 . 0 0 "[ . 1 . 2]" 1
266 1 11 THR HA 1 12 GLN HB3 4.970 . 5.270 4.782 4.609 4.968 . 0 0 "[ . 1 . 2]" 1
267 1 11 THR HA 1 12 GLN H 3.270 . 3.570 2.298 2.226 2.419 . 0 0 "[ . 1 . 2]" 1
268 1 11 THR HB 1 12 GLN H 3.360 . 3.660 3.363 2.224 3.701 0.041 9 0 "[ . 1 . 2]" 1
269 1 11 THR HB 1 12 GLN HB3 5.190 . 5.490 4.994 3.811 5.528 0.038 15 0 "[ . 1 . 2]" 1
270 1 11 THR HB 1 12 GLN HE21 5.430 . 5.730 5.583 4.307 5.835 0.105 4 0 "[ . 1 . 2]" 1
271 1 11 THR MG 1 12 GLN QG 5.500 . 5.800 5.077 4.683 5.890 0.090 2 0 "[ . 1 . 2]" 1
272 1 11 THR MG 1 12 GLN H 3.740 . 4.040 2.275 1.922 2.927 . 0 0 "[ . 1 . 2]" 1
273 1 11 THR MG 1 12 GLN HB3 4.240 . 4.540 3.561 2.995 4.611 0.071 17 0 "[ . 1 . 2]" 1
274 1 11 THR H 1 13 ASP H 5.130 . 5.430 5.193 4.830 5.403 . 0 0 "[ . 1 . 2]" 1
275 1 11 THR HA 1 13 ASP H 4.140 . 4.440 4.204 3.958 4.451 0.011 20 0 "[ . 1 . 2]" 1
276 1 11 THR HB 1 13 ASP HB2 5.130 . 5.430 3.785 2.706 5.306 . 0 0 "[ . 1 . 2]" 1
277 1 11 THR HB 1 13 ASP H 3.130 . 3.430 2.961 2.311 3.310 . 0 0 "[ . 1 . 2]" 1
278 1 11 THR HB 1 13 ASP HA 4.890 . 5.190 5.102 4.765 5.235 0.045 12 0 "[ . 1 . 2]" 1
279 1 11 THR HB 1 13 ASP QB 4.330 . 4.630 3.276 2.679 4.088 . 0 0 "[ . 1 . 2]" 1
280 1 11 THR HB 1 13 ASP HB3 5.130 . 5.430 4.281 2.716 4.988 . 0 0 "[ . 1 . 2]" 1
281 1 11 THR MG 1 13 ASP H 3.760 . 4.060 2.490 1.829 4.099 0.039 20 0 "[ . 1 . 2]" 1
282 1 11 THR H 1 14 LEU HB3 4.040 . 4.340 2.907 2.687 3.332 . 0 0 "[ . 1 . 2]" 1
283 1 11 THR H 1 14 LEU HA 5.500 . 5.800 5.578 5.430 5.762 . 0 0 "[ . 1 . 2]" 1
284 1 11 THR H 1 14 LEU H 5.500 . 5.800 3.883 3.648 4.082 . 0 0 "[ . 1 . 2]" 1
285 1 11 THR H 1 14 LEU HB2 3.680 . 3.980 3.379 3.138 3.599 . 0 0 "[ . 1 . 2]" 1
286 1 11 THR HA 1 14 LEU H 5.500 . 5.800 4.530 4.287 4.886 . 0 0 "[ . 1 . 2]" 1
287 1 11 THR HB 1 14 LEU HB3 5.500 . 5.800 3.565 2.725 5.170 . 0 0 "[ . 1 . 2]" 1
288 1 11 THR HB 1 14 LEU H 4.060 . 4.360 2.631 1.904 3.760 . 0 0 "[ . 1 . 2]" 1
289 1 11 THR H 1 15 ARG QD 4.710 . 5.010 4.971 4.640 5.075 0.065 15 0 "[ . 1 . 2]" 1
290 1 11 THR H 1 15 ARG QG 5.500 . 5.800 4.989 4.808 5.334 . 0 0 "[ . 1 . 2]" 1
291 1 11 THR HA 1 15 ARG QD 5.500 . 5.800 4.567 4.090 4.848 . 0 0 "[ . 1 . 2]" 1
292 1 11 THR MG 1 15 ARG QD 5.500 . 5.800 5.175 5.075 5.272 . 0 0 "[ . 1 . 2]" 1
293 1 11 THR H 1 61 ARG HG3 5.500 . 5.800 5.052 4.582 5.865 0.065 5 0 "[ . 1 . 2]" 1
294 1 12 GLN H 1 12 GLN QG 4.710 . 5.010 3.989 3.890 4.055 . 0 0 "[ . 1 . 2]" 1
295 1 12 GLN H 1 12 GLN HB3 3.350 . 3.650 2.507 2.392 2.628 . 0 0 "[ . 1 . 2]" 1
296 1 12 GLN H 1 12 GLN HB2 3.670 . 3.970 2.515 2.364 2.714 . 0 0 "[ . 1 . 2]" 1
297 1 12 GLN HA 1 12 GLN QG 3.530 . 3.830 2.475 2.383 2.578 . 0 0 "[ . 1 . 2]" 1
298 1 12 GLN HE22 1 12 GLN QG 3.510 . 3.810 3.469 3.286 3.511 . 0 0 "[ . 1 . 2]" 1
299 1 12 GLN H 1 13 ASP H 3.540 . 3.840 2.752 2.603 2.901 . 0 0 "[ . 1 . 2]" 1
300 1 12 GLN HB3 1 13 ASP QB 5.180 . 5.480 4.562 4.014 4.966 . 0 0 "[ . 1 . 2]" 1
301 1 12 GLN HB3 1 13 ASP H 3.320 . 3.620 2.689 2.323 2.908 . 0 0 "[ . 1 . 2]" 1
302 1 12 GLN HE21 1 13 ASP H 4.920 . 5.220 2.789 2.302 3.453 . 0 0 "[ . 1 . 2]" 1
303 1 12 GLN HE22 1 13 ASP H 4.660 . 4.960 4.149 3.647 5.012 0.052 20 0 "[ . 1 . 2]" 1
304 1 12 GLN QG 1 13 ASP H 5.080 . 5.380 4.033 3.436 4.348 . 0 0 "[ . 1 . 2]" 1
305 1 12 GLN QG 1 13 ASP HA 4.590 . 4.890 4.295 3.447 4.895 0.005 6 0 "[ . 1 . 2]" 1
306 1 12 GLN HA 1 14 LEU H 4.810 . 5.110 4.116 3.891 4.353 . 0 0 "[ . 1 . 2]" 1
307 1 12 GLN H 1 15 ARG QD 4.990 . 5.290 4.038 3.765 4.225 . 0 0 "[ . 1 . 2]" 1
308 1 12 GLN HA 1 15 ARG QD . . 4.210 2.106 1.863 2.244 . 0 0 "[ . 1 . 2]" 1
309 1 12 GLN HA 1 15 ARG QG 3.570 . 3.870 2.059 1.959 2.269 . 0 0 "[ . 1 . 2]" 1
310 1 12 GLN HA 1 15 ARG H 4.010 . 4.310 3.703 3.519 4.002 . 0 0 "[ . 1 . 2]" 1
311 1 12 GLN HB2 1 15 ARG QG 4.830 . 5.130 4.199 4.048 4.431 . 0 0 "[ . 1 . 2]" 1
312 1 12 GLN HE21 1 15 ARG QG 5.500 . 5.800 5.028 4.224 5.567 . 0 0 "[ . 1 . 2]" 1
313 1 12 GLN QG 1 15 ARG HB2 5.250 . 5.550 5.546 5.310 5.631 0.081 10 0 "[ . 1 . 2]" 1
314 1 12 GLN HA 1 16 SER H 4.190 . 4.490 3.781 3.578 3.996 . 0 0 "[ . 1 . 2]" 1
315 1 12 GLN HB3 1 16 SER QB 5.340 . 5.640 4.904 4.461 5.633 . 0 0 "[ . 1 . 2]" 1
316 1 12 GLN HE21 1 16 SER QB 5.200 . 5.500 4.092 2.638 5.027 . 0 0 "[ . 1 . 2]" 1
317 1 12 GLN HE22 1 16 SER QB 4.670 . 4.970 4.150 3.504 5.049 0.079 17 0 "[ . 1 . 2]" 1
318 1 12 GLN QG 1 16 SER HB2 4.760 . 5.060 3.100 2.456 4.442 . 0 0 "[ . 1 . 2]" 1
319 1 12 GLN QG 1 16 SER H 4.750 . 5.050 4.013 3.471 4.470 . 0 0 "[ . 1 . 2]" 1
320 1 12 GLN QG 1 16 SER HB3 4.760 . 5.060 4.004 2.908 4.967 . 0 0 "[ . 1 . 2]" 1
321 1 12 GLN QG 1 16 SER QB 4.100 . 4.400 2.996 2.333 4.146 . 0 0 "[ . 1 . 2]" 1
322 1 13 ASP H 1 13 ASP HB2 3.550 . 3.850 2.670 2.378 3.656 . 0 0 "[ . 1 . 2]" 1
323 1 13 ASP H 1 13 ASP QB 2.930 . 3.230 2.417 2.211 2.717 . 0 0 "[ . 1 . 2]" 1
324 1 13 ASP H 1 13 ASP HB3 3.550 . 3.850 3.207 2.496 3.669 . 0 0 "[ . 1 . 2]" 1
325 1 13 ASP H 1 14 LEU H 3.250 . 3.550 2.737 2.593 2.905 . 0 0 "[ . 1 . 2]" 1
326 1 13 ASP H 1 14 LEU HB2 5.050 . 5.350 5.050 4.865 5.265 . 0 0 "[ . 1 . 2]" 1
327 1 13 ASP QB 1 14 LEU H 3.210 . 3.510 2.926 2.484 3.553 0.043 17 0 "[ . 1 . 2]" 1
328 1 13 ASP QB 1 14 LEU HB3 5.340 . 5.640 4.884 4.425 5.593 . 0 0 "[ . 1 . 2]" 1
329 1 13 ASP QB 1 14 LEU QD 5.000 . 5.300 4.793 4.387 5.143 . 0 0 "[ . 1 . 2]" 1
330 1 13 ASP H 1 15 ARG QG 4.920 . 5.220 4.180 3.991 4.285 . 0 0 "[ . 1 . 2]" 1
331 1 13 ASP H 1 15 ARG QD 5.340 . 5.640 5.133 4.910 5.301 . 0 0 "[ . 1 . 2]" 1
332 1 13 ASP H 1 16 SER QB 4.650 . 4.950 4.621 4.460 4.931 . 0 0 "[ . 1 . 2]" 1
333 1 13 ASP HA 1 16 SER H 4.040 . 4.340 3.709 3.374 4.009 . 0 0 "[ . 1 . 2]" 1
334 1 13 ASP HA 1 16 SER HB2 4.200 . 4.500 3.973 2.814 4.474 . 0 0 "[ . 1 . 2]" 1
335 1 13 ASP HA 1 16 SER HB3 4.200 . 4.500 2.921 2.397 4.518 0.018 16 0 "[ . 1 . 2]" 1
336 1 13 ASP HA 1 16 SER QB 3.500 . 3.800 2.782 2.361 3.141 . 0 0 "[ . 1 . 2]" 1
337 1 13 ASP QB 1 16 SER QB 5.170 . 5.470 4.541 4.152 4.868 . 0 0 "[ . 1 . 2]" 1
338 1 13 ASP HA 1 17 HIS H 4.780 . 5.080 4.005 3.798 4.264 . 0 0 "[ . 1 . 2]" 1
339 1 13 ASP QB 1 17 HIS H 5.340 . 5.640 4.920 4.642 5.376 . 0 0 "[ . 1 . 2]" 1
340 1 14 LEU H 1 14 LEU QD 3.800 . 4.100 3.719 3.685 3.747 . 0 0 "[ . 1 . 2]" 1
341 1 14 LEU H 1 14 LEU MD1 4.360 . 4.660 4.122 4.041 4.206 . 0 0 "[ . 1 . 2]" 1
342 1 14 LEU H 1 14 LEU HB3 3.210 . 3.510 2.434 2.368 2.503 . 0 0 "[ . 1 . 2]" 1
343 1 14 LEU H 1 14 LEU MD2 4.360 . 4.660 4.234 4.154 4.315 . 0 0 "[ . 1 . 2]" 1
344 1 14 LEU H 1 14 LEU HB2 3.030 . 3.330 2.609 2.506 2.703 . 0 0 "[ . 1 . 2]" 1
345 1 14 LEU HA 1 14 LEU QD 2.900 . 3.200 2.182 2.131 2.258 . 0 0 "[ . 1 . 2]" 1
346 1 14 LEU HA 1 14 LEU MD2 3.580 . 3.880 2.216 2.154 2.299 . 0 0 "[ . 1 . 2]" 1
347 1 14 LEU HA 1 14 LEU HG 3.980 . 4.280 3.855 3.788 3.912 . 0 0 "[ . 1 . 2]" 1
348 1 14 LEU HA 1 14 LEU MD1 3.580 . 3.880 3.275 3.197 3.411 . 0 0 "[ . 1 . 2]" 1
349 1 14 LEU HB3 1 14 LEU HG 2.970 . 3.270 2.548 2.515 2.597 . 0 0 "[ . 1 . 2]" 1
350 1 14 LEU HB3 1 14 LEU MD2 3.330 . 3.630 3.207 3.186 3.223 . 0 0 "[ . 1 . 2]" 1
351 1 14 LEU HB3 1 14 LEU QD 2.910 . 3.210 2.261 2.221 2.303 . 0 0 "[ . 1 . 2]" 1
352 1 14 LEU HB3 1 14 LEU MD1 3.330 . 3.630 2.311 2.264 2.361 . 0 0 "[ . 1 . 2]" 1
353 1 14 LEU H 1 15 ARG QD 4.390 . 4.690 4.806 4.737 4.852 0.162 20 0 "[ . 1 . 2]" 1
354 1 14 LEU H 1 15 ARG H 3.430 . 3.730 2.435 2.337 2.580 . 0 0 "[ . 1 . 2]" 1
355 1 14 LEU H 1 15 ARG QG 4.140 . 4.440 3.420 3.332 3.637 . 0 0 "[ . 1 . 2]" 1
356 1 14 LEU HA 1 15 ARG QG 4.900 . 5.200 5.025 4.938 5.095 . 0 0 "[ . 1 . 2]" 1
357 1 14 LEU HB2 1 15 ARG H 3.970 . 4.270 3.698 3.585 3.779 . 0 0 "[ . 1 . 2]" 1
358 1 14 LEU HB3 1 15 ARG H 3.790 . 4.090 2.343 2.180 2.490 . 0 0 "[ . 1 . 2]" 1
359 1 14 LEU QD 1 15 ARG QG 4.220 . 4.520 4.096 3.980 4.303 . 0 0 "[ . 1 . 2]" 1
360 1 14 LEU QD 1 15 ARG HA 4.960 . 5.260 2.696 2.568 2.825 . 0 0 "[ . 1 . 2]" 1
361 1 14 LEU QD 1 15 ARG H 4.710 . 5.010 2.985 2.781 3.156 . 0 0 "[ . 1 . 2]" 1
362 1 14 LEU QD 1 15 ARG QD 4.760 . 5.060 4.520 4.323 4.784 . 0 0 "[ . 1 . 2]" 1
363 1 14 LEU H 1 16 SER QB 4.930 . 5.230 4.753 4.553 4.979 . 0 0 "[ . 1 . 2]" 1
364 1 14 LEU H 1 16 SER H 4.490 . 4.790 3.843 3.693 4.022 . 0 0 "[ . 1 . 2]" 1
365 1 14 LEU HA 1 16 SER QB 5.340 . 5.640 5.389 5.193 5.550 . 0 0 "[ . 1 . 2]" 1
366 1 14 LEU HB3 1 16 SER H 4.840 . 5.140 4.906 4.771 5.031 . 0 0 "[ . 1 . 2]" 1
367 1 14 LEU H 1 17 HIS H 4.880 . 5.180 4.445 4.353 4.599 . 0 0 "[ . 1 . 2]" 1
368 1 14 LEU H 1 17 HIS HB2 5.500 . 5.800 4.987 4.407 5.333 . 0 0 "[ . 1 . 2]" 1
369 1 14 LEU HA 1 17 HIS HB2 3.820 . 4.120 3.134 2.550 3.391 . 0 0 "[ . 1 . 2]" 1
370 1 14 LEU HA 1 17 HIS HB3 3.420 . 3.720 3.023 2.846 3.382 . 0 0 "[ . 1 . 2]" 1
371 1 14 LEU HA 1 17 HIS H 3.820 . 4.120 3.545 3.334 3.703 . 0 0 "[ . 1 . 2]" 1
372 1 14 LEU MD1 1 17 HIS HB3 5.000 . 5.300 4.366 4.206 4.567 . 0 0 "[ . 1 . 2]" 1
373 1 14 LEU MD1 1 17 HIS HB2 5.000 . 5.300 5.315 4.965 5.372 0.072 10 0 "[ . 1 . 2]" 1
374 1 14 LEU MD2 1 17 HIS HB2 5.000 . 5.300 4.203 3.684 4.347 . 0 0 "[ . 1 . 2]" 1
375 1 14 LEU MD2 1 17 HIS HB3 5.000 . 5.300 3.309 2.921 3.532 . 0 0 "[ . 1 . 2]" 1
376 1 14 LEU QD 1 17 HIS HD2 4.040 . 4.340 4.353 4.037 4.478 0.138 12 0 "[ . 1 . 2]" 1
377 1 14 LEU QD 1 17 HIS HB2 3.810 . 4.110 4.051 3.590 4.157 0.047 6 0 "[ . 1 . 2]" 1
378 1 14 LEU QD 1 17 HIS HA 5.440 . 5.740 5.503 5.254 5.652 . 0 0 "[ . 1 . 2]" 1
379 1 14 LEU QD 1 17 HIS HB3 3.800 . 4.100 3.211 2.876 3.405 . 0 0 "[ . 1 . 2]" 1
380 1 14 LEU QD 1 17 HIS H 4.760 . 5.060 4.175 4.020 4.354 . 0 0 "[ . 1 . 2]" 1
381 1 14 LEU HA 1 18 LEU H 4.580 . 4.880 4.359 4.141 4.479 . 0 0 "[ . 1 . 2]" 1
382 1 14 LEU HA 1 18 LEU QD 3.840 . 4.140 3.576 3.360 3.742 . 0 0 "[ . 1 . 2]" 1
383 1 14 LEU HB3 1 18 LEU QD 3.750 . 4.050 4.094 4.049 4.116 0.066 10 0 "[ . 1 . 2]" 1
384 1 14 LEU HG 1 18 LEU QD 3.870 . 4.170 3.991 3.869 4.126 . 0 0 "[ . 1 . 2]" 1
385 1 14 LEU MD1 1 18 LEU MD1 5.000 . 5.300 2.799 2.267 3.260 . 0 0 "[ . 1 . 2]" 1
386 1 14 LEU MD2 1 18 LEU MD1 5.000 . 5.300 2.583 2.157 3.198 . 0 0 "[ . 1 . 2]" 1
387 1 14 LEU QD 1 18 LEU QD 3.030 . 3.330 1.790 1.749 1.841 0.051 3 0 "[ . 1 . 2]" 1
388 1 14 LEU QD 1 18 LEU HG 4.360 . 4.660 3.873 3.781 3.930 . 0 0 "[ . 1 . 2]" 1
389 1 14 LEU QD 1 18 LEU H 4.440 . 4.740 3.658 3.512 3.839 . 0 0 "[ . 1 . 2]" 1
390 1 14 LEU QD 1 18 LEU HB3 5.440 . 5.740 4.758 4.496 5.088 . 0 0 "[ . 1 . 2]" 1
391 1 14 LEU QD 1 61 ARG HA 5.440 . 5.740 5.123 4.835 5.401 . 0 0 "[ . 1 . 2]" 1
392 1 14 LEU MD1 1 64 TYR QE 6.000 . 6.300 2.791 2.493 3.285 . 0 0 "[ . 1 . 2]" 1
393 1 14 LEU MD2 1 64 TYR QE 6.000 . 6.300 5.131 4.879 5.514 . 0 0 "[ . 1 . 2]" 1
394 1 14 LEU QD 1 64 TYR QE 4.780 . 5.080 2.778 2.486 3.261 . 0 0 "[ . 1 . 2]" 1
395 1 14 LEU MD1 1 65 TYR HA 5.500 . 5.800 4.584 4.418 4.743 . 0 0 "[ . 1 . 2]" 1
396 1 14 LEU MD2 1 65 TYR HA 5.500 . 5.800 5.915 5.855 5.964 0.164 8 0 "[ . 1 . 2]" 1
397 1 14 LEU QD 1 65 TYR HD2 4.970 . 5.270 3.035 2.169 4.381 . 0 0 "[ . 1 . 2]" 1
398 1 14 LEU QD 1 65 TYR QB 4.200 . 4.500 3.298 3.029 3.564 . 0 0 "[ . 1 . 2]" 1
399 1 14 LEU QD 1 65 TYR HA 4.850 . 5.150 4.436 4.296 4.562 . 0 0 "[ . 1 . 2]" 1
400 1 14 LEU QD 1 65 TYR HE2 3.980 . 4.280 3.381 2.579 4.279 . 0 0 "[ . 1 . 2]" 1
401 1 14 LEU QB 2 20 LEU MD2 3.830 . 4.130 3.485 2.504 4.104 . 0 0 "[ . 1 . 2]" 1
402 1 14 LEU MD1 2 20 LEU HG 4.740 . 5.040 5.088 4.894 5.150 0.110 11 0 "[ . 1 . 2]" 1
403 1 14 LEU MD2 2 20 LEU MD1 3.460 . 3.760 3.572 3.069 3.822 0.062 8 0 "[ . 1 . 2]" 1
404 1 14 LEU MD2 2 20 LEU HA 4.220 . 4.520 3.723 3.169 4.577 0.057 20 0 "[ . 1 . 2]" 1
405 1 14 LEU MD2 2 20 LEU HG 3.860 . 4.160 2.869 2.509 3.157 . 0 0 "[ . 1 . 2]" 1
406 1 14 LEU MD2 2 20 LEU MD2 3.640 . 3.940 2.223 2.056 2.601 . 0 0 "[ . 1 . 2]" 1
407 1 15 ARG H 1 15 ARG QD . . 3.980 3.410 3.279 3.500 . 0 0 "[ . 1 . 2]" 1
408 1 15 ARG H 1 15 ARG HB3 3.590 . 3.890 2.715 2.614 2.890 . 0 0 "[ . 1 . 2]" 1
409 1 15 ARG H 1 15 ARG QG 3.300 . 3.600 1.904 1.841 1.987 . 0 0 "[ . 1 . 2]" 1
410 1 15 ARG HA 1 15 ARG QD 3.980 . 4.280 4.318 4.283 4.336 0.056 8 0 "[ . 1 . 2]" 1
411 1 15 ARG H 1 16 SER H 3.410 . 3.710 2.730 2.629 2.909 . 0 0 "[ . 1 . 2]" 1
412 1 15 ARG HB2 1 16 SER HA 5.090 . 5.390 4.288 3.994 4.468 . 0 0 "[ . 1 . 2]" 1
413 1 15 ARG HB2 1 16 SER H 3.640 . 3.940 3.566 3.290 3.654 . 0 0 "[ . 1 . 2]" 1
414 1 15 ARG HB2 1 16 SER QB 4.700 . 5.000 4.771 4.637 5.067 0.067 16 0 "[ . 1 . 2]" 1
415 1 15 ARG HB2 1 16 SER HB2 5.500 . 5.800 5.061 4.872 5.535 . 0 0 "[ . 1 . 2]" 1
416 1 15 ARG HB2 1 16 SER HB3 5.500 . 5.800 5.848 5.813 5.876 0.076 16 0 "[ . 1 . 2]" 1
417 1 15 ARG HB3 1 16 SER H 4.170 . 4.470 4.062 4.000 4.120 . 0 0 "[ . 1 . 2]" 1
418 1 15 ARG QD 1 16 SER H 5.160 . 5.460 4.145 4.080 4.220 . 0 0 "[ . 1 . 2]" 1
419 1 15 ARG QG 1 16 SER QB 4.250 . 4.550 3.125 2.958 3.812 . 0 0 "[ . 1 . 2]" 1
420 1 15 ARG QG 1 16 SER HA 4.680 . 4.980 3.659 3.542 3.751 . 0 0 "[ . 1 . 2]" 1
421 1 15 ARG QG 1 16 SER H 3.460 . 3.760 2.248 2.187 2.328 . 0 0 "[ . 1 . 2]" 1
422 1 15 ARG QG 1 16 SER HB2 4.970 . 5.270 3.251 3.044 4.040 . 0 0 "[ . 1 . 2]" 1
423 1 15 ARG QG 1 16 SER HB3 4.970 . 5.270 4.065 3.914 4.676 . 0 0 "[ . 1 . 2]" 1
424 1 15 ARG H 1 17 HIS H 4.430 . 4.730 3.916 3.824 4.083 . 0 0 "[ . 1 . 2]" 1
425 1 15 ARG QG 1 17 HIS H 4.820 . 5.120 4.316 4.183 4.424 . 0 0 "[ . 1 . 2]" 1
426 1 15 ARG H 1 18 LEU QD 5.440 . 5.740 3.880 3.669 4.128 . 0 0 "[ . 1 . 2]" 1
427 1 15 ARG HA 1 18 LEU MD1 4.000 . 4.300 3.813 3.302 4.328 0.028 20 0 "[ . 1 . 2]" 1
428 1 15 ARG HA 1 18 LEU MD2 4.000 . 4.300 2.222 1.910 2.642 . 0 0 "[ . 1 . 2]" 1
429 1 15 ARG HA 1 18 LEU QD 2.920 . 3.220 2.200 1.902 2.597 . 0 0 "[ . 1 . 2]" 1
430 1 15 ARG HB3 1 18 LEU HB2 5.300 . 5.600 4.995 4.602 5.504 . 0 0 "[ . 1 . 2]" 1
431 1 15 ARG QD 1 18 LEU QD 5.240 . 5.540 5.256 5.016 5.538 . 0 0 "[ . 1 . 2]" 1
432 1 15 ARG QG 1 18 LEU QD 4.530 . 4.830 4.555 4.328 4.855 0.025 3 0 "[ . 1 . 2]" 1
433 1 15 ARG HA 1 19 VAL MG2 5.160 . 5.460 4.116 4.016 4.250 . 0 0 "[ . 1 . 2]" 1
434 1 15 ARG HB2 1 19 VAL MG2 4.390 . 4.690 3.609 3.419 3.982 . 0 0 "[ . 1 . 2]" 1
435 1 15 ARG HB2 1 51 GLU QG 5.160 . 5.460 3.091 2.801 3.891 . 0 0 "[ . 1 . 2]" 1
436 1 15 ARG QD 1 55 TYR QE 5.000 . 5.300 3.153 2.729 4.100 . 0 0 "[ . 1 . 2]" 1
437 1 15 ARG HA 1 68 LEU MD2 5.020 . 5.320 4.317 4.183 4.622 . 0 0 "[ . 1 . 2]" 1
438 1 16 SER H 1 16 SER QB 2.920 . 3.220 2.228 2.181 2.421 . 0 0 "[ . 1 . 2]" 1
439 1 16 SER H 1 17 HIS HB2 4.920 . 5.220 4.688 4.227 4.829 . 0 0 "[ . 1 . 2]" 1
440 1 16 SER H 1 17 HIS HB3 5.360 . 5.660 4.965 4.713 5.120 . 0 0 "[ . 1 . 2]" 1
441 1 16 SER H 1 17 HIS HA 5.500 . 5.800 5.109 5.056 5.183 . 0 0 "[ . 1 . 2]" 1
442 1 16 SER H 1 17 HIS H 3.310 . 3.610 2.527 2.453 2.596 . 0 0 "[ . 1 . 2]" 1
443 1 16 SER QB 1 17 HIS H 3.480 . 3.780 2.903 2.778 3.035 . 0 0 "[ . 1 . 2]" 1
444 1 16 SER H 1 18 LEU H 4.670 . 4.970 4.159 4.019 4.320 . 0 0 "[ . 1 . 2]" 1
445 1 16 SER H 1 18 LEU QD 4.610 . 4.910 4.585 4.370 4.856 . 0 0 "[ . 1 . 2]" 1
446 1 16 SER H 1 19 VAL MG2 5.460 . 5.760 4.033 3.919 4.285 . 0 0 "[ . 1 . 2]" 1
447 1 16 SER H 1 19 VAL HB 5.030 . 5.330 5.019 4.909 5.356 0.026 3 0 "[ . 1 . 2]" 1
448 1 16 SER HA 1 19 VAL MG1 . . 4.210 3.595 3.483 3.980 . 0 0 "[ . 1 . 2]" 1
449 1 16 SER HA 1 19 VAL MG2 . . 4.280 2.168 2.026 2.434 . 0 0 "[ . 1 . 2]" 1
450 1 16 SER HA 1 19 VAL HB 3.000 . 3.300 2.356 2.211 2.770 . 0 0 "[ . 1 . 2]" 1
451 1 16 SER HA 1 19 VAL H 3.940 . 4.240 3.117 2.931 3.377 . 0 0 "[ . 1 . 2]" 1
452 1 16 SER HB2 1 19 VAL HB 5.500 . 5.800 4.590 4.400 4.973 . 0 0 "[ . 1 . 2]" 1
453 1 16 SER HB3 1 19 VAL HB 5.500 . 5.800 4.760 3.716 5.267 . 0 0 "[ . 1 . 2]" 1
454 1 16 SER QB 1 19 VAL HB 4.740 . 5.040 4.145 3.603 4.548 . 0 0 "[ . 1 . 2]" 1
455 1 16 SER HA 1 20 HIS H 4.470 . 4.770 3.995 3.837 4.236 . 0 0 "[ . 1 . 2]" 1
456 1 17 HIS H 1 17 HIS HD2 5.450 . 5.750 5.121 5.020 5.249 . 0 0 "[ . 1 . 2]" 1
457 1 17 HIS H 1 17 HIS HB2 3.240 . 3.540 2.394 2.145 2.462 . 0 0 "[ . 1 . 2]" 1
458 1 17 HIS H 1 17 HIS HB3 3.140 . 3.440 2.654 2.513 2.741 . 0 0 "[ . 1 . 2]" 1
459 1 17 HIS H 1 18 LEU QD 4.340 . 4.640 3.765 3.611 3.931 . 0 0 "[ . 1 . 2]" 1
460 1 17 HIS H 1 18 LEU MD2 5.500 . 5.800 4.516 3.764 5.114 . 0 0 "[ . 1 . 2]" 1
461 1 17 HIS H 1 18 LEU H 3.370 . 3.670 2.576 2.471 2.690 . 0 0 "[ . 1 . 2]" 1
462 1 17 HIS H 1 18 LEU MD1 5.500 . 5.800 4.168 3.869 4.687 . 0 0 "[ . 1 . 2]" 1
463 1 17 HIS H 1 18 LEU HB2 4.960 . 5.260 4.654 4.329 5.121 . 0 0 "[ . 1 . 2]" 1
464 1 17 HIS HA 1 18 LEU QD 5.440 . 5.740 4.471 4.267 4.608 . 0 0 "[ . 1 . 2]" 1
465 1 17 HIS HB2 1 18 LEU QD 5.010 . 5.310 4.045 3.857 4.191 . 0 0 "[ . 1 . 2]" 1
466 1 17 HIS HB2 1 18 LEU H 4.000 . 4.300 3.724 3.483 3.814 . 0 0 "[ . 1 . 2]" 1
467 1 17 HIS HB3 1 18 LEU MD1 4.900 . 5.200 2.736 2.465 3.073 . 0 0 "[ . 1 . 2]" 1
468 1 17 HIS HB3 1 18 LEU H 3.880 . 4.180 2.546 2.340 2.716 . 0 0 "[ . 1 . 2]" 1
469 1 17 HIS HB3 1 18 LEU HA 4.070 . 4.370 4.152 4.033 4.225 . 0 0 "[ . 1 . 2]" 1
470 1 17 HIS HB3 1 18 LEU HG 5.380 . 5.680 5.570 5.203 5.748 0.068 18 0 "[ . 1 . 2]" 1
471 1 17 HIS HB3 1 18 LEU QD 4.080 . 4.380 2.672 2.446 2.851 . 0 0 "[ . 1 . 2]" 1
472 1 17 HIS HB3 1 18 LEU MD2 4.900 . 5.200 4.115 3.268 4.882 . 0 0 "[ . 1 . 2]" 1
473 1 17 HIS HD2 1 18 LEU MD1 5.400 . 5.700 2.832 2.256 3.300 . 0 0 "[ . 1 . 2]" 1
474 1 17 HIS HD2 1 18 LEU QD 4.460 . 4.760 2.817 2.248 3.263 . 0 0 "[ . 1 . 2]" 1
475 1 17 HIS HD2 1 18 LEU MD2 5.400 . 5.700 5.128 4.284 5.742 0.042 3 0 "[ . 1 . 2]" 1
476 1 17 HIS H 1 19 VAL H 4.360 . 4.660 3.902 3.706 3.980 . 0 0 "[ . 1 . 2]" 1
477 1 17 HIS H 1 19 VAL HB 5.130 . 5.430 4.762 4.608 4.954 . 0 0 "[ . 1 . 2]" 1
478 1 17 HIS HA 1 19 VAL MG1 5.500 . 5.800 5.723 5.520 5.857 0.057 13 0 "[ . 1 . 2]" 1
479 1 17 HIS H 1 20 HIS HB2 5.500 . 5.800 5.461 5.137 5.801 0.001 12 0 "[ . 1 . 2]" 1
480 1 17 HIS HA 1 20 HIS H 4.070 . 4.370 3.222 2.983 3.440 . 0 0 "[ . 1 . 2]" 1
481 1 17 HIS HA 1 20 HIS HB2 3.980 . 4.280 3.174 2.699 3.747 . 0 0 "[ . 1 . 2]" 1
482 1 17 HIS HA 1 20 HIS HB3 3.960 . 4.260 2.538 2.058 3.297 . 0 0 "[ . 1 . 2]" 1
483 1 17 HIS HA 1 21 LYS H 4.760 . 5.060 4.180 3.965 4.383 . 0 0 "[ . 1 . 2]" 1
484 1 17 HIS HB3 1 21 LYS QD 4.540 . 4.840 4.504 4.122 4.849 0.009 9 0 "[ . 1 . 2]" 1
485 1 17 HIS HD2 1 21 LYS HG2 5.500 . 5.800 4.753 4.345 5.330 . 0 0 "[ . 1 . 2]" 1
486 1 17 HIS HD2 1 21 LYS QD 4.810 . 5.110 2.425 2.061 2.727 . 0 0 "[ . 1 . 2]" 1
487 1 18 LEU H 1 18 LEU HB2 3.670 . 3.970 2.399 2.195 2.710 . 0 0 "[ . 1 . 2]" 1
488 1 18 LEU H 1 18 LEU HB3 3.790 . 4.090 3.599 3.485 3.744 . 0 0 "[ . 1 . 2]" 1
489 1 18 LEU H 1 18 LEU HG 3.900 . 4.200 4.200 4.117 4.242 0.042 3 0 "[ . 1 . 2]" 1
490 1 18 LEU H 1 18 LEU QD 3.410 . 3.710 2.197 1.997 2.404 . 0 0 "[ . 1 . 2]" 1
491 1 18 LEU H 1 18 LEU MD2 3.960 . 4.260 2.898 2.066 3.481 . 0 0 "[ . 1 . 2]" 1
492 1 18 LEU H 1 18 LEU MD1 3.960 . 4.260 2.380 2.056 2.649 . 0 0 "[ . 1 . 2]" 1
493 1 18 LEU HA 1 18 LEU QD 3.160 . 3.460 2.147 2.067 2.264 . 0 0 "[ . 1 . 2]" 1
494 1 18 LEU HA 1 18 LEU MD2 4.050 . 4.350 3.767 3.544 3.898 . 0 0 "[ . 1 . 2]" 1
495 1 18 LEU HA 1 18 LEU MD1 4.050 . 4.350 2.160 2.076 2.278 . 0 0 "[ . 1 . 2]" 1
496 1 18 LEU HA 1 18 LEU HG 3.610 . 3.910 3.225 2.906 3.674 . 0 0 "[ . 1 . 2]" 1
497 1 18 LEU HB2 1 18 LEU QD 3.060 . 3.360 2.086 2.006 2.134 . 0 0 "[ . 1 . 2]" 1
498 1 18 LEU HB3 1 18 LEU QD 2.950 . 3.250 2.536 2.468 2.632 . 0 0 "[ . 1 . 2]" 1
499 1 18 LEU H 1 19 VAL HB 4.700 . 5.000 4.741 4.632 4.860 . 0 0 "[ . 1 . 2]" 1
500 1 18 LEU HB3 1 19 VAL H 3.880 . 4.180 3.523 3.342 3.759 . 0 0 "[ . 1 . 2]" 1
501 1 18 LEU QD 1 19 VAL H 3.850 . 4.150 3.784 3.550 3.949 . 0 0 "[ . 1 . 2]" 1
502 1 18 LEU HA 1 20 HIS H 4.810 . 5.110 4.362 4.095 4.568 . 0 0 "[ . 1 . 2]" 1
503 1 18 LEU H 1 21 LYS QD 4.840 . 5.140 4.811 4.301 5.101 . 0 0 "[ . 1 . 2]" 1
504 1 18 LEU HA 1 21 LYS H 3.730 . 4.030 3.186 3.024 3.341 . 0 0 "[ . 1 . 2]" 1
505 1 18 LEU HA 1 21 LYS QD 3.540 . 3.840 3.087 2.757 3.250 . 0 0 "[ . 1 . 2]" 1
506 1 18 LEU HA 1 21 LYS HB2 3.750 . 4.050 2.558 2.262 2.807 . 0 0 "[ . 1 . 2]" 1
507 1 18 LEU HA 1 21 LYS QE 4.950 . 5.250 4.910 4.250 5.272 0.022 14 0 "[ . 1 . 2]" 1
508 1 18 LEU HB2 1 21 LYS QD 5.500 . 5.800 5.705 5.437 5.874 0.074 13 0 "[ . 1 . 2]" 1
509 1 18 LEU MD1 1 21 LYS QD 5.000 . 5.300 3.185 2.827 3.765 . 0 0 "[ . 1 . 2]" 1
510 1 18 LEU MD2 1 21 LYS QD 5.000 . 5.300 5.370 5.160 5.495 0.195 2 0 "[ . 1 . 2]" 1
511 1 18 LEU QD 1 21 LYS QD 3.570 . 3.870 3.159 2.816 3.698 . 0 0 "[ . 1 . 2]" 1
512 1 18 LEU QD 1 21 LYS H 5.360 . 5.660 4.546 4.368 4.726 . 0 0 "[ . 1 . 2]" 1
513 1 18 LEU HA 1 22 LEU QD 4.360 . 4.660 4.582 4.478 4.684 0.024 1 0 "[ . 1 . 2]" 1
514 1 18 LEU HB3 1 22 LEU H 5.500 . 5.800 4.757 4.474 5.143 . 0 0 "[ . 1 . 2]" 1
515 1 18 LEU HB3 1 22 LEU QD 4.510 . 4.810 3.539 3.347 3.697 . 0 0 "[ . 1 . 2]" 1
516 1 18 LEU HB2 1 51 GLU QG 3.460 . 3.760 3.460 3.281 3.663 . 0 0 "[ . 1 . 2]" 1
517 1 18 LEU HG 1 51 GLU QG 5.340 . 5.640 5.406 5.124 5.667 0.027 1 0 "[ . 1 . 2]" 1
518 1 18 LEU QD 1 51 GLU QG 5.280 . 5.580 3.745 3.473 3.965 . 0 0 "[ . 1 . 2]" 1
519 1 18 LEU MD1 1 64 TYR QE 4.670 . 4.970 5.024 4.764 5.171 0.201 12 0 "[ . 1 . 2]" 1
520 1 18 LEU MD2 1 64 TYR QE 4.670 . 4.970 2.943 2.722 3.095 . 0 0 "[ . 1 . 2]" 1
521 1 18 LEU QD 1 64 TYR QE 3.940 . 4.240 2.924 2.711 3.066 . 0 0 "[ . 1 . 2]" 1
522 1 18 LEU HG 1 65 TYR QB . . 5.440 4.520 4.275 4.799 . 0 0 "[ . 1 . 2]" 1
523 1 18 LEU HG 1 65 TYR HA 3.920 . 4.220 3.602 3.251 3.850 . 0 0 "[ . 1 . 2]" 1
524 1 18 LEU MD1 1 65 TYR HE2 5.000 . 5.300 3.954 2.942 4.979 . 0 0 "[ . 1 . 2]" 1
525 1 18 LEU MD2 1 65 TYR HE2 5.000 . 5.300 4.490 3.555 5.355 0.055 12 0 "[ . 1 . 2]" 1
526 1 18 LEU QD 1 65 TYR HD2 5.440 . 5.740 3.224 2.110 4.705 . 0 0 "[ . 1 . 2]" 1
527 1 18 LEU QD 1 65 TYR H 5.440 . 5.740 4.422 3.887 4.980 . 0 0 "[ . 1 . 2]" 1
528 1 18 LEU QD 1 65 TYR QB 4.360 . 4.660 2.980 2.455 3.592 . 0 0 "[ . 1 . 2]" 1
529 1 18 LEU HA 1 68 LEU MD1 4.240 . 4.540 3.718 3.584 3.926 . 0 0 "[ . 1 . 2]" 1
530 1 18 LEU HA 1 68 LEU MD2 4.840 . 5.140 4.506 4.216 4.722 . 0 0 "[ . 1 . 2]" 1
531 1 18 LEU HB2 1 68 LEU MD1 3.870 . 4.170 3.621 3.127 4.021 . 0 0 "[ . 1 . 2]" 1
532 1 18 LEU HB2 1 68 LEU HG 5.500 . 5.800 5.405 5.064 5.701 . 0 0 "[ . 1 . 2]" 1
533 1 18 LEU HB2 1 68 LEU MD2 4.320 . 4.620 3.023 2.785 3.292 . 0 0 "[ . 1 . 2]" 1
534 1 18 LEU HB3 1 68 LEU MD2 3.950 . 4.250 2.436 2.056 2.815 . 0 0 "[ . 1 . 2]" 1
535 1 18 LEU HB3 1 68 LEU MD1 4.040 . 4.340 2.242 1.940 2.534 . 0 0 "[ . 1 . 2]" 1
536 1 18 LEU HG 1 68 LEU MD1 3.610 . 3.910 2.472 2.160 2.839 . 0 0 "[ . 1 . 2]" 1
537 1 18 LEU HG 1 68 LEU MD2 3.880 . 4.180 2.353 1.854 3.045 . 0 0 "[ . 1 . 2]" 1
538 1 18 LEU MD1 1 68 LEU MD2 3.840 . 4.140 3.682 3.348 4.084 . 0 0 "[ . 1 . 2]" 1
539 1 18 LEU MD2 1 68 LEU MD2 3.840 . 4.140 1.993 1.794 2.426 0.006 1 0 "[ . 1 . 2]" 1
540 1 18 LEU QD 1 68 LEU MD1 3.510 . 3.810 3.058 2.733 3.317 . 0 0 "[ . 1 . 2]" 1
541 1 18 LEU HG 1 69 ALA MB 4.240 . 4.540 4.582 4.343 4.678 0.138 9 0 "[ . 1 . 2]" 1
542 1 18 LEU HB3 1 72 ILE MG 5.500 . 5.800 5.294 4.629 5.756 . 0 0 "[ . 1 . 2]" 1
543 1 18 LEU HG 2 15 LEU QD 5.400 . 5.700 2.680 2.111 3.340 . 0 0 "[ . 1 . 2]" 1
544 1 18 LEU QB 2 15 LEU QD 4.470 . 4.770 3.609 3.290 3.840 . 0 0 "[ . 1 . 2]" 1
545 1 18 LEU MD1 2 15 LEU QB 3.470 . 3.770 3.235 2.373 3.635 . 0 0 "[ . 1 . 2]" 1
546 1 18 LEU MD1 2 15 LEU HB3 3.320 . 3.620 3.301 2.396 3.722 0.102 5 0 "[ . 1 . 2]" 1
547 1 18 LEU MD1 2 15 LEU HG 4.270 . 4.570 4.395 4.035 4.665 0.095 11 0 "[ . 1 . 2]" 1
548 1 19 VAL H 1 19 VAL HB 3.180 . 3.480 2.576 2.512 2.634 . 0 0 "[ . 1 . 2]" 1
549 1 19 VAL H 1 19 VAL MG2 3.370 . 3.670 2.098 2.019 2.197 . 0 0 "[ . 1 . 2]" 1
550 1 19 VAL H 1 19 VAL MG1 3.840 . 4.140 3.773 3.736 3.811 . 0 0 "[ . 1 . 2]" 1
551 1 19 VAL HA 1 19 VAL MG1 3.240 . 3.540 2.455 2.430 2.484 . 0 0 "[ . 1 . 2]" 1
552 1 19 VAL HA 1 19 VAL MG2 2.970 . 3.270 2.398 2.367 2.430 . 0 0 "[ . 1 . 2]" 1
553 1 19 VAL H 1 20 HIS H 3.200 . 3.500 2.770 2.700 2.849 . 0 0 "[ . 1 . 2]" 1
554 1 19 VAL HB 1 20 HIS H 3.390 . 3.690 2.399 2.254 2.618 . 0 0 "[ . 1 . 2]" 1
555 1 19 VAL HB 1 20 HIS HB2 5.020 . 5.320 4.234 4.078 4.352 . 0 0 "[ . 1 . 2]" 1
556 1 19 VAL HB 1 20 HIS HB3 5.500 . 5.800 4.713 4.461 5.158 . 0 0 "[ . 1 . 2]" 1
557 1 19 VAL MG1 1 20 HIS HD2 5.500 . 5.800 5.597 4.842 5.885 0.085 7 0 "[ . 1 . 2]" 1
558 1 19 VAL MG1 1 20 HIS H 3.630 . 3.930 3.260 3.124 3.448 . 0 0 "[ . 1 . 2]" 1
559 1 19 VAL MG1 1 20 HIS HA 3.570 . 3.870 3.435 3.302 3.555 . 0 0 "[ . 1 . 2]" 1
560 1 19 VAL MG1 1 20 HIS HB2 4.720 . 5.020 4.429 4.214 4.562 . 0 0 "[ . 1 . 2]" 1
561 1 19 VAL MG2 1 20 HIS H 4.190 . 4.490 3.733 3.641 3.841 . 0 0 "[ . 1 . 2]" 1
562 1 19 VAL H 1 21 LYS H 4.500 . 4.800 4.169 4.043 4.321 . 0 0 "[ . 1 . 2]" 1
563 1 19 VAL HA 1 22 LEU HB2 3.580 . 3.880 2.577 2.283 2.775 . 0 0 "[ . 1 . 2]" 1
564 1 19 VAL HA 1 22 LEU QD 2.920 . 3.220 1.929 1.883 1.982 . 0 0 "[ . 1 . 2]" 1
565 1 19 VAL HA 1 22 LEU H 4.330 . 4.630 3.406 3.310 3.517 . 0 0 "[ . 1 . 2]" 1
566 1 19 VAL HA 1 22 LEU HG . . 4.300 3.280 3.176 3.511 . 0 0 "[ . 1 . 2]" 1
567 1 19 VAL HA 1 22 LEU MD1 4.000 . 4.300 1.931 1.885 1.985 . 0 0 "[ . 1 . 2]" 1
568 1 19 VAL HA 1 22 LEU HB3 4.000 . 4.300 4.098 3.803 4.272 . 0 0 "[ . 1 . 2]" 1
569 1 19 VAL HA 1 22 LEU MD2 4.000 . 4.300 4.402 4.380 4.427 0.127 3 0 "[ . 1 . 2]" 1
570 1 19 VAL HB 1 22 LEU QD 4.570 . 4.870 4.568 4.519 4.621 . 0 0 "[ . 1 . 2]" 1
571 1 19 VAL MG1 1 22 LEU H 4.790 . 5.090 4.667 4.610 4.734 . 0 0 "[ . 1 . 2]" 1
572 1 19 VAL MG1 1 23 VAL H 4.090 . 4.390 4.107 3.912 4.277 . 0 0 "[ . 1 . 2]" 1
573 1 19 VAL MG1 1 44 VAL HA 3.830 . 4.130 3.325 3.045 3.510 . 0 0 "[ . 1 . 2]" 1
574 1 19 VAL HA 1 47 ALA MB 4.110 . 4.410 2.474 2.326 2.674 . 0 0 "[ . 1 . 2]" 1
575 1 19 VAL MG1 1 47 ALA H 5.240 . 5.540 4.139 3.952 4.260 . 0 0 "[ . 1 . 2]" 1
576 1 19 VAL MG1 1 47 ALA MB 2.710 . 3.010 1.879 1.815 1.958 . 0 0 "[ . 1 . 2]" 1
577 1 19 VAL MG2 1 47 ALA MB 4.000 . 4.300 3.316 3.109 3.496 . 0 0 "[ . 1 . 2]" 1
578 1 19 VAL MG2 1 47 ALA HA 4.870 . 5.170 4.742 4.591 4.961 . 0 0 "[ . 1 . 2]" 1
579 1 19 VAL HB 1 48 LYS HG2 5.500 . 5.800 4.973 4.698 5.266 . 0 0 "[ . 1 . 2]" 1
580 1 19 VAL HB 1 48 LYS HG3 5.480 . 5.780 5.090 4.681 5.456 . 0 0 "[ . 1 . 2]" 1
581 1 19 VAL MG1 1 48 LYS HG2 3.300 . 3.600 2.832 2.572 3.124 . 0 0 "[ . 1 . 2]" 1
582 1 19 VAL MG1 1 48 LYS H 3.980 . 4.280 3.037 2.840 3.322 . 0 0 "[ . 1 . 2]" 1
583 1 19 VAL MG1 1 48 LYS QB 4.370 . 4.670 3.899 3.662 4.103 . 0 0 "[ . 1 . 2]" 1
584 1 19 VAL MG1 1 48 LYS HD3 5.000 . 5.300 4.728 4.529 4.933 . 0 0 "[ . 1 . 2]" 1
585 1 19 VAL MG1 1 48 LYS HG3 3.910 . 4.210 2.514 2.176 2.805 . 0 0 "[ . 1 . 2]" 1
586 1 19 VAL MG1 1 48 LYS HE2 3.670 . 3.970 3.480 3.237 3.776 . 0 0 "[ . 1 . 2]" 1
587 1 19 VAL MG1 1 48 LYS HA 3.660 . 3.960 3.031 2.772 3.305 . 0 0 "[ . 1 . 2]" 1
588 1 19 VAL MG2 1 48 LYS HA 3.250 . 3.550 2.736 2.568 2.942 . 0 0 "[ . 1 . 2]" 1
589 1 19 VAL MG2 1 48 LYS QB 5.000 . 5.300 4.191 4.033 4.329 . 0 0 "[ . 1 . 2]" 1
590 1 19 VAL MG2 1 48 LYS H 4.250 . 4.550 4.227 4.078 4.378 . 0 0 "[ . 1 . 2]" 1
591 1 19 VAL MG2 1 48 LYS HD3 5.000 . 5.300 5.299 5.162 5.401 0.101 17 0 "[ . 1 . 2]" 1
592 1 19 VAL MG2 1 48 LYS HG3 4.310 . 4.610 3.719 3.494 4.018 . 0 0 "[ . 1 . 2]" 1
593 1 19 VAL MG2 1 48 LYS HG2 4.030 . 4.330 3.163 2.995 3.314 . 0 0 "[ . 1 . 2]" 1
594 1 19 VAL MG2 1 48 LYS HE2 4.950 . 5.250 4.844 4.595 5.259 0.009 18 0 "[ . 1 . 2]" 1
595 1 19 VAL MG2 1 50 VAL HB 5.500 . 5.800 5.462 5.219 5.734 . 0 0 "[ . 1 . 2]" 1
596 1 19 VAL H 1 51 GLU QG 4.470 . 4.770 3.405 3.078 3.607 . 0 0 "[ . 1 . 2]" 1
597 1 19 VAL HA 1 51 GLU HA 5.290 . 5.590 5.555 5.436 5.620 0.030 16 0 "[ . 1 . 2]" 1
598 1 19 VAL HB 1 51 GLU QG 4.680 . 4.980 4.274 4.210 4.362 . 0 0 "[ . 1 . 2]" 1
599 1 19 VAL MG1 1 51 GLU HG3 5.000 . 5.300 4.157 4.057 4.224 . 0 0 "[ . 1 . 2]" 1
600 1 19 VAL MG1 1 51 GLU HG2 5.000 . 5.300 5.386 5.353 5.412 0.112 6 0 "[ . 1 . 2]" 1
601 1 19 VAL MG2 1 51 GLU HA 4.260 . 4.560 4.361 4.265 4.507 . 0 0 "[ . 1 . 2]" 1
602 1 19 VAL MG2 1 51 GLU HB2 4.140 . 4.440 2.265 2.131 2.508 . 0 0 "[ . 1 . 2]" 1
603 1 19 VAL MG2 1 51 GLU HG3 4.180 . 4.480 1.868 1.829 1.921 . 0 0 "[ . 1 . 2]" 1
604 1 19 VAL MG2 1 51 GLU HB3 4.220 . 4.520 2.653 2.488 2.897 . 0 0 "[ . 1 . 2]" 1
605 1 19 VAL MG2 1 51 GLU HG2 4.180 . 4.480 3.197 3.128 3.304 . 0 0 "[ . 1 . 2]" 1
606 1 19 VAL MG2 1 51 GLU QG 3.450 . 3.750 1.856 1.819 1.905 . 0 0 "[ . 1 . 2]" 1
607 1 19 VAL MG2 1 51 GLU H 4.240 . 4.540 3.983 3.862 4.140 . 0 0 "[ . 1 . 2]" 1
608 1 19 VAL MG2 1 52 GLY H 4.550 . 4.850 4.678 4.556 4.866 0.016 16 0 "[ . 1 . 2]" 1
609 1 19 VAL HA 1 68 LEU MD1 4.840 . 5.140 4.804 4.616 5.050 . 0 0 "[ . 1 . 2]" 1
610 1 20 HIS H 1 20 HIS HD2 5.260 . 5.560 5.041 4.840 5.135 . 0 0 "[ . 1 . 2]" 1
611 1 20 HIS H 1 20 HIS HB3 3.340 . 3.640 2.448 2.284 2.678 . 0 0 "[ . 1 . 2]" 1
612 1 20 HIS H 1 20 HIS HB2 3.210 . 3.510 2.563 2.392 2.690 . 0 0 "[ . 1 . 2]" 1
613 1 20 HIS HA 1 20 HIS HD2 4.180 . 4.480 2.900 2.581 3.279 . 0 0 "[ . 1 . 2]" 1
614 1 20 HIS H 1 21 LYS H 3.380 . 3.680 2.794 2.601 2.912 . 0 0 "[ . 1 . 2]" 1
615 1 20 HIS H 1 21 LYS HB2 5.120 . 5.420 4.885 4.630 5.096 . 0 0 "[ . 1 . 2]" 1
616 1 20 HIS HB2 1 21 LYS HA 5.480 . 5.780 5.616 5.507 5.683 . 0 0 "[ . 1 . 2]" 1
617 1 20 HIS HB3 1 21 LYS HG3 4.980 . 5.280 4.411 3.681 5.305 0.025 13 0 "[ . 1 . 2]" 1
618 1 20 HIS HB3 1 21 LYS H 3.630 . 3.930 2.590 2.422 2.909 . 0 0 "[ . 1 . 2]" 1
619 1 20 HIS HB3 1 21 LYS HA 4.560 . 4.860 4.433 4.143 4.580 . 0 0 "[ . 1 . 2]" 1
620 1 20 HIS HB3 1 21 LYS QD 5.050 . 5.350 4.077 2.322 5.221 . 0 0 "[ . 1 . 2]" 1
621 1 20 HIS HE1 1 21 LYS QD 5.500 . 5.800 5.611 4.926 5.886 0.086 9 0 "[ . 1 . 2]" 1
622 1 20 HIS HE1 1 21 LYS QE 5.500 . 5.800 4.931 3.472 5.872 0.072 18 0 "[ . 1 . 2]" 1
623 1 20 HIS HE1 1 21 LYS HA 5.500 . 5.800 5.407 4.800 5.845 0.045 12 0 "[ . 1 . 2]" 1
624 1 20 HIS H 1 22 LEU H 4.750 . 5.050 4.132 4.030 4.235 . 0 0 "[ . 1 . 2]" 1
625 1 20 HIS H 1 22 LEU HB2 5.500 . 5.800 4.954 4.731 5.065 . 0 0 "[ . 1 . 2]" 1
626 1 20 HIS HA 1 23 VAL MG2 4.000 . 4.300 3.289 2.708 3.913 . 0 0 "[ . 1 . 2]" 1
627 1 20 HIS HA 1 23 VAL QG 4.080 . 4.380 3.132 2.647 3.573 . 0 0 "[ . 1 . 2]" 1
628 1 20 HIS HA 1 23 VAL MG1 4.880 . 5.180 4.020 3.699 4.566 . 0 0 "[ . 1 . 2]" 1
629 1 20 HIS HA 1 23 VAL H 3.880 . 4.180 3.583 3.306 3.824 . 0 0 "[ . 1 . 2]" 1
630 1 20 HIS HA 1 23 VAL HB 3.000 . 3.300 2.779 2.428 3.222 . 0 0 "[ . 1 . 2]" 1
631 1 20 HIS HA 1 24 GLN H . . 4.800 4.329 4.114 4.516 . 0 0 "[ . 1 . 2]" 1
632 1 20 HIS HB3 1 24 GLN QG 5.340 . 5.640 4.909 4.327 5.424 . 0 0 "[ . 1 . 2]" 1
633 1 20 HIS HA 1 44 VAL QG 4.470 . 4.770 4.064 3.651 4.327 . 0 0 "[ . 1 . 2]" 1
634 1 20 HIS H 1 47 ALA MB 5.500 . 5.800 4.689 4.567 4.848 . 0 0 "[ . 1 . 2]" 1
635 1 21 LYS H 1 21 LYS QD 3.830 . 4.130 3.152 2.045 3.861 . 0 0 "[ . 1 . 2]" 1
636 1 21 LYS H 1 21 LYS HB2 3.150 . 3.450 2.332 2.245 2.446 . 0 0 "[ . 1 . 2]" 1
637 1 21 LYS H 1 21 LYS HB3 3.680 . 3.980 3.589 3.518 3.673 . 0 0 "[ . 1 . 2]" 1
638 1 21 LYS HA 1 21 LYS HG3 3.800 . 4.100 2.407 2.158 2.725 . 0 0 "[ . 1 . 2]" 1
639 1 21 LYS HA 1 21 LYS QD 3.950 . 4.250 3.522 2.730 3.976 . 0 0 "[ . 1 . 2]" 1
640 1 21 LYS HA 1 21 LYS HG2 3.810 . 4.110 2.983 2.413 3.571 . 0 0 "[ . 1 . 2]" 1
641 1 21 LYS HA 1 21 LYS QE 5.020 . 5.320 4.279 2.557 4.821 . 0 0 "[ . 1 . 2]" 1
642 1 21 LYS HB2 1 21 LYS QE 4.300 . 4.600 3.966 3.318 4.144 . 0 0 "[ . 1 . 2]" 1
643 1 21 LYS HB2 1 21 LYS QD 3.450 . 3.750 2.320 2.180 2.397 . 0 0 "[ . 1 . 2]" 1
644 1 21 LYS HB3 1 21 LYS QE 4.890 . 5.190 4.190 3.868 4.528 . 0 0 "[ . 1 . 2]" 1
645 1 21 LYS H 1 22 LEU QD 5.440 . 5.740 4.860 4.756 4.968 . 0 0 "[ . 1 . 2]" 1
646 1 21 LYS HB2 1 22 LEU H 3.580 . 3.880 3.024 2.810 3.205 . 0 0 "[ . 1 . 2]" 1
647 1 21 LYS HB3 1 22 LEU H 4.640 . 4.940 3.523 3.309 3.763 . 0 0 "[ . 1 . 2]" 1
648 1 21 LYS HG2 1 22 LEU H 5.500 . 5.800 5.272 5.069 5.534 . 0 0 "[ . 1 . 2]" 1
649 1 21 LYS HA 1 24 GLN QG 2.990 . 3.290 2.830 2.122 3.274 . 0 0 "[ . 1 . 2]" 1
650 1 21 LYS HA 1 24 GLN QE 5.340 . 5.640 4.909 4.428 5.465 . 0 0 "[ . 1 . 2]" 1
651 1 21 LYS HB3 1 24 GLN QG 5.340 . 5.640 5.230 4.536 5.668 0.028 6 0 "[ . 1 . 2]" 1
652 1 21 LYS HG2 1 24 GLN HG3 5.000 . 5.300 5.237 4.680 5.410 0.110 12 0 "[ . 1 . 2]" 1
653 1 21 LYS HG2 1 24 GLN QG 5.340 . 5.640 5.050 4.476 5.225 . 0 0 "[ . 1 . 2]" 1
654 1 21 LYS HG3 1 24 GLN QG 4.550 . 4.850 4.273 3.552 4.921 0.071 5 0 "[ . 1 . 2]" 1
655 1 21 LYS HG2 1 25 ALA MB 5.430 . 5.730 5.405 4.941 5.794 0.064 11 0 "[ . 1 . 2]" 1
656 1 21 LYS H 1 72 ILE MD 4.610 . 4.910 4.584 4.410 4.734 . 0 0 "[ . 1 . 2]" 1
657 1 21 LYS HB2 1 72 ILE MD 3.640 . 3.940 3.329 3.130 3.586 . 0 0 "[ . 1 . 2]" 1
658 1 21 LYS HB2 1 72 ILE MG 4.690 . 4.990 4.773 4.542 5.026 0.036 18 0 "[ . 1 . 2]" 1
659 1 21 LYS HB3 1 72 ILE MD 4.050 . 4.350 2.422 2.172 2.600 . 0 0 "[ . 1 . 2]" 1
660 1 21 LYS HB3 1 72 ILE MG 3.910 . 4.210 4.088 3.897 4.282 0.072 16 0 "[ . 1 . 2]" 1
661 1 21 LYS HG2 1 72 ILE MG 5.380 . 5.680 5.594 5.068 5.800 0.120 9 0 "[ . 1 . 2]" 1
662 1 21 LYS HG2 1 72 ILE MD 4.240 . 4.540 4.064 3.671 4.401 . 0 0 "[ . 1 . 2]" 1
663 1 21 LYS QD 1 72 ILE MD 4.850 . 5.150 4.222 3.520 4.952 . 0 0 "[ . 1 . 2]" 1
664 1 21 LYS HD2 2 15 LEU HA 5.500 . 5.800 4.195 2.385 5.909 0.109 13 0 "[ . 1 . 2]" 1
665 1 21 LYS HG2 2 15 LEU HA 4.470 . 4.770 4.402 3.627 4.885 0.115 6 0 "[ . 1 . 2]" 1
666 1 21 LYS HG3 2 15 LEU HA 5.500 . 5.800 5.283 4.694 5.797 . 0 0 "[ . 1 . 2]" 1
667 1 21 LYS HG3 2 15 LEU QD 3.640 . 3.940 3.902 3.500 4.047 0.107 18 0 "[ . 1 . 2]" 1
668 1 21 LYS QB 2 15 LEU QD 3.280 . 3.580 2.667 2.343 2.974 . 0 0 "[ . 1 . 2]" 1
669 1 21 LYS QD 2 15 LEU HA 4.070 . 4.370 3.190 2.243 4.308 . 0 0 "[ . 1 . 2]" 1
670 1 21 LYS QE 2 15 LEU HA 5.500 . 5.800 3.099 1.922 5.619 . 0 0 "[ . 1 . 2]" 1
671 1 22 LEU H 1 22 LEU QD 3.890 . 4.190 3.197 3.142 3.286 . 0 0 "[ . 1 . 2]" 1
672 1 22 LEU H 1 22 LEU HB2 3.570 . 3.870 2.432 2.340 2.468 . 0 0 "[ . 1 . 2]" 1
673 1 22 LEU H 1 22 LEU HG 3.890 . 4.190 2.467 2.360 2.689 . 0 0 "[ . 1 . 2]" 1
674 1 22 LEU H 1 22 LEU MD2 4.430 . 4.730 3.595 3.489 3.790 . 0 0 "[ . 1 . 2]" 1
675 1 22 LEU H 1 22 LEU MD1 4.430 . 4.730 3.584 3.541 3.629 . 0 0 "[ . 1 . 2]" 1
676 1 22 LEU HA 1 22 LEU MD2 3.770 . 4.070 2.078 2.043 2.117 . 0 0 "[ . 1 . 2]" 1
677 1 22 LEU HA 1 22 LEU HG 3.550 . 3.850 2.931 2.804 2.999 . 0 0 "[ . 1 . 2]" 1
678 1 22 LEU HA 1 22 LEU MD1 3.770 . 4.070 3.892 3.866 3.908 . 0 0 "[ . 1 . 2]" 1
679 1 22 LEU HA 1 22 LEU QD 2.950 . 3.250 2.070 2.036 2.108 . 0 0 "[ . 1 . 2]" 1
680 1 22 LEU HB2 1 22 LEU QD 2.740 . 3.040 2.238 2.222 2.252 . 0 0 "[ . 1 . 2]" 1
681 1 22 LEU HB2 1 22 LEU HG 2.970 . 3.270 2.550 2.526 2.582 . 0 0 "[ . 1 . 2]" 1
682 1 22 LEU HB2 1 22 LEU MD2 3.160 . 3.460 3.156 3.143 3.169 . 0 0 "[ . 1 . 2]" 1
683 1 22 LEU HB2 1 22 LEU MD1 3.160 . 3.460 2.290 2.271 2.305 . 0 0 "[ . 1 . 2]" 1
684 1 22 LEU HB3 1 22 LEU MD1 3.250 . 3.550 2.442 2.416 2.466 . 0 0 "[ . 1 . 2]" 1
685 1 22 LEU HB3 1 22 LEU MD2 3.250 . 3.550 2.267 2.225 2.300 . 0 0 "[ . 1 . 2]" 1
686 1 22 LEU H 1 23 VAL HB 5.010 . 5.310 4.680 4.519 4.973 . 0 0 "[ . 1 . 2]" 1
687 1 22 LEU HA 1 23 VAL HA 4.850 . 5.150 4.826 4.753 4.907 . 0 0 "[ . 1 . 2]" 1
688 1 22 LEU HB2 1 23 VAL H 3.720 . 4.020 2.512 2.405 2.589 . 0 0 "[ . 1 . 2]" 1
689 1 22 LEU HB2 1 23 VAL HB 4.920 . 5.220 4.734 4.542 4.984 . 0 0 "[ . 1 . 2]" 1
690 1 22 LEU HB3 1 23 VAL H 3.800 . 4.100 3.394 3.211 3.467 . 0 0 "[ . 1 . 2]" 1
691 1 22 LEU HB3 1 23 VAL HA 4.720 . 5.020 4.385 4.160 4.520 . 0 0 "[ . 1 . 2]" 1
692 1 22 LEU HG 1 23 VAL H 5.150 . 5.450 4.474 4.360 4.621 . 0 0 "[ . 1 . 2]" 1
693 1 22 LEU H 1 25 ALA H 4.870 . 5.170 4.738 4.677 4.854 . 0 0 "[ . 1 . 2]" 1
694 1 22 LEU HA 1 25 ALA H 3.950 . 4.250 3.557 3.351 3.717 . 0 0 "[ . 1 . 2]" 1
695 1 22 LEU HA 1 25 ALA MB 3.160 . 3.460 2.753 2.625 3.029 . 0 0 "[ . 1 . 2]" 1
696 1 22 LEU HA 1 26 ILE H 3.870 . 4.170 4.000 3.854 4.126 . 0 0 "[ . 1 . 2]" 1
697 1 22 LEU HA 1 26 ILE HB 4.920 . 5.220 4.888 4.550 5.212 . 0 0 "[ . 1 . 2]" 1
698 1 22 LEU HB3 1 26 ILE H 5.130 . 5.430 4.981 4.769 5.143 . 0 0 "[ . 1 . 2]" 1
699 1 22 LEU QD 1 46 TYR QD 4.680 . 4.980 4.275 4.117 4.509 . 0 0 "[ . 1 . 2]" 1
700 1 22 LEU QD 1 46 TYR HE1 5.440 . 5.740 3.675 3.271 5.391 . 0 0 "[ . 1 . 2]" 1
701 1 22 LEU HB2 1 47 ALA HA 5.010 . 5.310 3.513 3.195 3.844 . 0 0 "[ . 1 . 2]" 1
702 1 22 LEU HB3 1 47 ALA HA 4.480 . 4.780 3.107 2.824 3.439 . 0 0 "[ . 1 . 2]" 1
703 1 22 LEU HB3 1 47 ALA H 5.470 . 5.770 5.110 4.909 5.304 . 0 0 "[ . 1 . 2]" 1
704 1 22 LEU MD1 1 47 ALA HA 4.000 . 4.300 2.538 2.348 2.799 . 0 0 "[ . 1 . 2]" 1
705 1 22 LEU MD2 1 47 ALA HA 4.000 . 4.300 3.986 3.717 4.165 . 0 0 "[ . 1 . 2]" 1
706 1 22 LEU QD 1 47 ALA HA 3.350 . 3.650 2.510 2.331 2.744 . 0 0 "[ . 1 . 2]" 1
707 1 22 LEU MD2 1 50 VAL HB 4.000 . 4.300 3.876 3.551 4.206 . 0 0 "[ . 1 . 2]" 1
708 1 22 LEU QD 1 50 VAL QG 3.820 . 4.120 2.200 2.050 2.473 . 0 0 "[ . 1 . 2]" 1
709 1 22 LEU QD 1 50 VAL HB 3.630 . 3.930 2.591 2.289 2.818 . 0 0 "[ . 1 . 2]" 1
710 1 22 LEU MD1 1 51 GLU HA 4.630 . 4.930 3.156 2.995 3.300 . 0 0 "[ . 1 . 2]" 1
711 1 22 LEU MD1 1 51 GLU HB2 4.750 . 5.050 2.438 2.165 2.691 . 0 0 "[ . 1 . 2]" 1
712 1 22 LEU MD2 1 51 GLU HB2 4.750 . 5.050 4.771 4.467 5.032 . 0 0 "[ . 1 . 2]" 1
713 1 22 LEU MD2 1 51 GLU HA 4.630 . 4.930 4.821 4.616 4.946 0.016 9 0 "[ . 1 . 2]" 1
714 1 22 LEU QD 1 51 GLU HB2 3.790 . 4.090 2.430 2.161 2.681 . 0 0 "[ . 1 . 2]" 1
715 1 22 LEU QD 1 51 GLU H 4.580 . 4.880 3.014 2.883 3.154 . 0 0 "[ . 1 . 2]" 1
716 1 22 LEU QD 1 51 GLU HA 3.450 . 3.750 3.117 2.960 3.253 . 0 0 "[ . 1 . 2]" 1
717 1 22 LEU QD 1 51 GLU QG 3.740 . 4.040 3.279 3.031 3.470 . 0 0 "[ . 1 . 2]" 1
718 1 22 LEU HG 1 68 LEU MD1 3.560 . 3.860 2.821 2.518 3.093 . 0 0 "[ . 1 . 2]" 1
719 1 22 LEU MD1 1 68 LEU MD2 4.710 . 5.010 3.406 3.091 3.675 . 0 0 "[ . 1 . 2]" 1
720 1 22 LEU MD1 1 68 LEU HA 5.000 . 5.300 5.209 5.042 5.316 0.016 12 0 "[ . 1 . 2]" 1
721 1 22 LEU MD1 1 68 LEU HB2 4.280 . 4.580 3.513 3.282 3.673 . 0 0 "[ . 1 . 2]" 1
722 1 22 LEU MD2 1 68 LEU HB2 4.280 . 4.580 3.291 2.846 3.465 . 0 0 "[ . 1 . 2]" 1
723 1 22 LEU MD2 1 68 LEU MD2 4.710 . 5.010 4.060 3.756 4.241 . 0 0 "[ . 1 . 2]" 1
724 1 22 LEU MD2 1 68 LEU HA 5.000 . 5.300 4.274 4.063 4.472 . 0 0 "[ . 1 . 2]" 1
725 1 22 LEU QD 1 68 LEU MD2 3.680 . 3.980 3.238 2.955 3.450 . 0 0 "[ . 1 . 2]" 1
726 1 22 LEU QD 1 68 LEU MD1 2.880 . 3.180 2.163 1.956 2.443 . 0 0 "[ . 1 . 2]" 1
727 1 22 LEU QD 1 68 LEU HA 5.110 . 5.410 4.088 3.903 4.251 . 0 0 "[ . 1 . 2]" 1
728 1 22 LEU MD1 1 71 LYS QE 4.800 . 5.100 4.335 3.868 5.005 . 0 0 "[ . 1 . 2]" 1
729 1 22 LEU MD2 1 71 LYS QE 4.800 . 5.100 3.104 2.410 3.847 . 0 0 "[ . 1 . 2]" 1
730 1 22 LEU QD 1 71 LYS QE 3.650 . 3.950 3.035 2.387 3.729 . 0 0 "[ . 1 . 2]" 1
731 1 22 LEU H 1 72 ILE MD 4.890 . 5.190 3.114 3.000 3.178 . 0 0 "[ . 1 . 2]" 1
732 1 22 LEU HA 1 72 ILE MD 3.600 . 3.900 2.140 1.970 2.332 . 0 0 "[ . 1 . 2]" 1
733 1 22 LEU HA 1 72 ILE QG 3.020 . 3.320 2.481 2.251 2.633 . 0 0 "[ . 1 . 2]" 1
734 1 22 LEU HA 1 72 ILE MG 4.290 . 4.590 4.245 4.082 4.353 . 0 0 "[ . 1 . 2]" 1
735 1 22 LEU HA 1 72 ILE HA 5.370 . 5.670 4.782 4.530 5.140 . 0 0 "[ . 1 . 2]" 1
736 1 22 LEU HB2 1 72 ILE MD 5.000 . 5.300 4.245 4.107 4.388 . 0 0 "[ . 1 . 2]" 1
737 1 22 LEU HB3 1 72 ILE MD 4.260 . 4.560 4.136 3.941 4.319 . 0 0 "[ . 1 . 2]" 1
738 1 22 LEU HG 1 72 ILE MD 4.900 . 5.200 2.958 2.760 3.209 . 0 0 "[ . 1 . 2]" 1
739 1 22 LEU HG 1 72 ILE MG 3.950 . 4.250 4.328 4.292 4.349 0.099 3 0 "[ . 1 . 2]" 1
740 1 22 LEU QD 1 72 ILE HA 5.030 . 5.330 3.408 3.283 3.608 . 0 0 "[ . 1 . 2]" 1
741 1 22 LEU QD 1 72 ILE MD 3.580 . 3.880 2.260 2.008 2.588 . 0 0 "[ . 1 . 2]" 1
742 1 23 VAL H 1 23 VAL MG2 3.890 . 4.190 2.409 2.185 2.715 . 0 0 "[ . 1 . 2]" 1
743 1 23 VAL H 1 23 VAL MG1 3.890 . 4.190 3.718 3.658 3.783 . 0 0 "[ . 1 . 2]" 1
744 1 23 VAL H 1 23 VAL QG 2.980 . 3.280 2.378 2.172 2.646 . 0 0 "[ . 1 . 2]" 1
745 1 23 VAL H 1 23 VAL HB 3.330 . 3.630 2.372 2.254 2.564 . 0 0 "[ . 1 . 2]" 1
746 1 23 VAL HA 1 23 VAL MG2 3.240 . 3.540 2.213 2.095 2.314 . 0 0 "[ . 1 . 2]" 1
747 1 23 VAL HA 1 23 VAL MG1 3.240 . 3.540 2.586 2.300 2.753 . 0 0 "[ . 1 . 2]" 1
748 1 23 VAL HA 1 23 VAL QG 2.790 . 3.090 2.087 2.034 2.122 . 0 0 "[ . 1 . 2]" 1
749 1 23 VAL HA 1 24 GLN HA 5.500 . 5.800 4.717 4.537 4.908 . 0 0 "[ . 1 . 2]" 1
750 1 23 VAL HB 1 24 GLN HA 5.500 . 5.800 4.532 4.270 4.833 . 0 0 "[ . 1 . 2]" 1
751 1 23 VAL QG 1 24 GLN HA 3.390 . 3.690 2.916 2.771 3.209 . 0 0 "[ . 1 . 2]" 1
752 1 23 VAL QG 1 24 GLN QG 4.460 . 4.760 2.979 2.520 3.529 . 0 0 "[ . 1 . 2]" 1
753 1 23 VAL QG 1 24 GLN H 3.740 . 4.040 2.852 2.588 3.129 . 0 0 "[ . 1 . 2]" 1
754 1 23 VAL H 1 25 ALA H 4.770 . 5.070 4.133 4.028 4.273 . 0 0 "[ . 1 . 2]" 1
755 1 23 VAL HA 1 25 ALA H 4.760 . 4.800 4.290 4.163 4.490 . 0 0 "[ . 1 . 2]" 1
756 1 23 VAL QG 1 25 ALA H 4.960 . 5.260 4.345 4.221 4.495 . 0 0 "[ . 1 . 2]" 1
757 1 23 VAL H 1 26 ILE H 5.390 . 5.690 4.749 4.635 4.820 . 0 0 "[ . 1 . 2]" 1
758 1 23 VAL H 1 26 ILE HB 5.500 . 5.800 5.798 5.558 5.864 0.064 17 0 "[ . 1 . 2]" 1
759 1 23 VAL HA 1 26 ILE HB 4.000 . 4.300 4.220 4.052 4.304 0.004 3 0 "[ . 1 . 2]" 1
760 1 23 VAL HA 1 26 ILE H 4.160 . 4.460 3.604 3.396 3.732 . 0 0 "[ . 1 . 2]" 1
761 1 23 VAL HA 1 26 ILE MD 4.000 . 4.300 4.259 4.121 4.347 0.047 2 0 "[ . 1 . 2]" 1
762 1 23 VAL HA 1 26 ILE MG 3.830 . 4.130 1.938 1.848 2.037 . 0 0 "[ . 1 . 2]" 1
763 1 23 VAL HB 1 26 ILE MG 4.680 . 4.980 4.453 4.373 4.531 . 0 0 "[ . 1 . 2]" 1
764 1 23 VAL QG 1 26 ILE H 5.110 . 5.410 4.425 4.285 4.535 . 0 0 "[ . 1 . 2]" 1
765 1 23 VAL HA 1 27 PHE HB2 4.630 . 4.930 4.298 3.796 4.634 . 0 0 "[ . 1 . 2]" 1
766 1 23 VAL HA 1 27 PHE QD 5.110 . 5.410 5.276 4.903 5.447 0.037 18 0 "[ . 1 . 2]" 1
767 1 23 VAL HA 1 27 PHE H 4.160 . 4.460 3.854 3.655 4.048 . 0 0 "[ . 1 . 2]" 1
768 1 23 VAL MG2 1 27 PHE HB2 5.000 . 5.300 4.925 4.298 5.326 0.026 2 0 "[ . 1 . 2]" 1
769 1 23 VAL MG2 1 27 PHE QD 5.000 . 5.300 5.338 5.294 5.382 0.082 18 0 "[ . 1 . 2]" 1
770 1 23 VAL MG2 1 27 PHE HB3 5.000 . 5.300 5.053 4.787 5.431 0.131 16 0 "[ . 1 . 2]" 1
771 1 23 VAL QG 1 27 PHE HB2 4.110 . 4.410 3.524 3.083 3.874 . 0 0 "[ . 1 . 2]" 1
772 1 23 VAL QG 1 27 PHE HB3 4.560 . 4.860 3.178 2.686 4.062 . 0 0 "[ . 1 . 2]" 1
773 1 23 VAL QG 1 35 LEU QB 3.930 . 4.230 3.593 3.258 4.264 0.034 18 0 "[ . 1 . 2]" 1
774 1 23 VAL H 1 40 MET ME 5.500 . 5.800 5.471 5.159 5.801 0.001 10 0 "[ . 1 . 2]" 1
775 1 23 VAL HA 1 40 MET ME 5.150 . 5.450 4.465 4.236 4.858 . 0 0 "[ . 1 . 2]" 1
776 1 23 VAL HB 1 40 MET ME 4.180 . 4.480 3.704 3.329 4.083 . 0 0 "[ . 1 . 2]" 1
777 1 23 VAL MG1 1 40 MET HA 5.500 . 5.800 4.290 3.766 4.681 . 0 0 "[ . 1 . 2]" 1
778 1 23 VAL MG1 1 40 MET ME 3.650 . 3.950 1.806 1.762 1.888 0.038 11 0 "[ . 1 . 2]" 1
779 1 23 VAL MG2 1 40 MET HA 5.500 . 5.800 4.577 4.221 5.230 . 0 0 "[ . 1 . 2]" 1
780 1 23 VAL MG2 1 40 MET ME 3.650 . 3.950 2.461 2.104 3.031 . 0 0 "[ . 1 . 2]" 1
781 1 23 VAL QG 1 40 MET HA 4.350 . 4.650 3.919 3.622 4.156 . 0 0 "[ . 1 . 2]" 1
782 1 23 VAL QG 1 40 MET ME 2.930 . 3.230 1.753 1.718 1.860 0.082 12 0 "[ . 1 . 2]" 1
783 1 23 VAL HA 1 43 LEU MD1 5.000 . 5.300 4.184 3.797 4.772 . 0 0 "[ . 1 . 2]" 1
784 1 23 VAL HA 1 43 LEU HB2 5.300 . 5.600 4.678 4.449 4.978 . 0 0 "[ . 1 . 2]" 1
785 1 23 VAL HA 1 43 LEU MD2 5.000 . 5.300 4.159 3.849 4.535 . 0 0 "[ . 1 . 2]" 1
786 1 23 VAL HA 1 43 LEU HA 4.690 . 4.990 5.062 5.009 5.112 0.122 19 0 "[ . 1 . 2]" 1
787 1 23 VAL HB 1 43 LEU HB2 5.500 . 5.800 5.648 5.115 5.849 0.049 10 0 "[ . 1 . 2]" 1
788 1 23 VAL MG1 1 43 LEU HA 5.210 . 5.510 5.033 4.259 5.417 . 0 0 "[ . 1 . 2]" 1
789 1 23 VAL MG2 1 43 LEU HA 5.210 . 5.510 3.980 3.711 4.352 . 0 0 "[ . 1 . 2]" 1
790 1 23 VAL QG 1 43 LEU HB2 3.590 . 3.890 2.723 2.439 2.904 . 0 0 "[ . 1 . 2]" 1
791 1 23 VAL QG 1 43 LEU HA 4.430 . 4.730 3.825 3.612 4.080 . 0 0 "[ . 1 . 2]" 1
792 1 23 VAL QG 1 43 LEU HB3 4.730 . 5.030 2.290 1.879 2.693 . 0 0 "[ . 1 . 2]" 1
793 1 23 VAL HB 1 44 VAL QG 4.160 . 4.460 4.417 3.875 4.556 0.096 1 0 "[ . 1 . 2]" 1
794 1 23 VAL QG 1 44 VAL HA 3.110 . 3.410 2.381 2.138 2.520 . 0 0 "[ . 1 . 2]" 1
795 1 23 VAL QG 1 46 TYR QD 5.320 . 5.620 3.947 3.624 4.188 . 0 0 "[ . 1 . 2]" 1
796 1 23 VAL H 1 47 ALA MB 4.020 . 4.320 3.062 2.973 3.230 . 0 0 "[ . 1 . 2]" 1
797 1 23 VAL HB 1 47 ALA MB 3.880 . 4.180 4.103 3.852 4.221 0.041 18 0 "[ . 1 . 2]" 1
798 1 23 VAL MG1 1 47 ALA MB 5.000 . 5.300 4.378 4.073 4.662 . 0 0 "[ . 1 . 2]" 1
799 1 23 VAL QG 1 47 ALA HA 5.220 . 5.520 4.415 4.265 4.695 . 0 0 "[ . 1 . 2]" 1
800 1 23 VAL QG 1 47 ALA MB 2.910 . 3.210 2.174 2.054 2.389 . 0 0 "[ . 1 . 2]" 1
801 1 23 VAL QG 1 47 ALA H 3.990 . 4.290 3.763 3.590 3.934 . 0 0 "[ . 1 . 2]" 1
802 1 24 GLN H 1 24 GLN QG 3.140 . 3.440 2.303 2.074 2.483 . 0 0 "[ . 1 . 2]" 1
803 1 24 GLN H 1 24 GLN QB 3.060 . 3.360 2.539 2.339 2.690 . 0 0 "[ . 1 . 2]" 1
804 1 24 GLN H 1 24 GLN HG3 3.600 . 3.900 2.527 2.100 3.622 . 0 0 "[ . 1 . 2]" 1
805 1 24 GLN H 1 24 GLN HG2 3.600 . 3.900 3.095 2.249 3.424 . 0 0 "[ . 1 . 2]" 1
806 1 24 GLN HA 1 24 GLN QG 3.160 . 3.460 2.484 2.251 2.711 . 0 0 "[ . 1 . 2]" 1
807 1 24 GLN HA 1 24 GLN HG2 3.960 . 4.260 2.561 2.300 2.782 . 0 0 "[ . 1 . 2]" 1
808 1 24 GLN HA 1 24 GLN HG3 3.960 . 4.260 3.365 3.159 3.759 . 0 0 "[ . 1 . 2]" 1
809 1 24 GLN HA 1 24 GLN HE22 5.500 . 5.800 5.458 4.308 5.834 0.034 18 0 "[ . 1 . 2]" 1
810 1 24 GLN HA 1 24 GLN HE21 5.500 . 5.800 4.442 3.718 5.140 . 0 0 "[ . 1 . 2]" 1
811 1 24 GLN H 1 25 ALA MB 4.430 . 4.730 4.301 4.136 4.447 . 0 0 "[ . 1 . 2]" 1
812 1 24 GLN H 1 25 ALA H 3.280 . 3.580 2.676 2.581 2.869 . 0 0 "[ . 1 . 2]" 1
813 1 24 GLN QB 1 25 ALA H 3.370 . 3.670 2.936 2.705 3.203 . 0 0 "[ . 1 . 2]" 1
814 1 24 GLN QB 1 25 ALA MB 4.160 . 4.460 3.933 3.738 4.215 . 0 0 "[ . 1 . 2]" 1
815 1 24 GLN QB 1 25 ALA HA 4.580 . 4.880 4.024 3.895 4.210 . 0 0 "[ . 1 . 2]" 1
816 1 24 GLN QG 1 25 ALA H 4.280 . 4.580 4.183 3.967 4.352 . 0 0 "[ . 1 . 2]" 1
817 1 24 GLN H 1 26 ILE MG 4.580 . 4.880 4.241 4.106 4.356 . 0 0 "[ . 1 . 2]" 1
818 1 24 GLN H 1 26 ILE H 4.570 . 4.870 4.306 4.222 4.410 . 0 0 "[ . 1 . 2]" 1
819 1 24 GLN QB 1 26 ILE H 5.500 . 5.800 5.000 4.848 5.124 . 0 0 "[ . 1 . 2]" 1
820 1 24 GLN HA 1 27 PHE H 3.870 . 4.170 3.612 3.248 3.905 . 0 0 "[ . 1 . 2]" 1
821 1 24 GLN HA 1 27 PHE HB3 4.950 . 5.250 3.987 3.368 5.077 . 0 0 "[ . 1 . 2]" 1
822 1 24 GLN HA 1 28 PRO HA 4.000 . 4.300 4.107 3.402 4.340 0.040 9 0 "[ . 1 . 2]" 1
823 1 24 GLN HA 1 28 PRO QD 5.500 . 5.800 5.284 4.723 5.722 . 0 0 "[ . 1 . 2]" 1
824 1 24 GLN QB 1 28 PRO HA 5.000 . 5.300 4.384 3.562 4.993 . 0 0 "[ . 1 . 2]" 1
825 1 24 GLN HA 1 29 THR MG 3.980 . 4.280 3.766 2.968 4.307 0.027 9 0 "[ . 1 . 2]" 1
826 1 24 GLN HA 1 29 THR H 4.420 . 4.720 3.920 3.156 4.707 . 0 0 "[ . 1 . 2]" 1
827 1 24 GLN HE21 1 29 THR MG 4.990 . 5.290 3.816 2.433 5.164 . 0 0 "[ . 1 . 2]" 1
828 1 24 GLN HE22 1 29 THR MG 4.990 . 5.290 4.377 2.810 5.312 0.022 4 0 "[ . 1 . 2]" 1
829 1 24 GLN QB 1 29 THR H 4.620 . 4.920 4.457 3.504 4.944 0.024 13 0 "[ . 1 . 2]" 1
830 1 24 GLN QB 1 29 THR MG 5.500 . 5.800 4.055 3.438 4.823 . 0 0 "[ . 1 . 2]" 1
831 1 24 GLN QG 1 29 THR MG 5.340 . 5.640 3.608 2.631 4.511 . 0 0 "[ . 1 . 2]" 1
832 1 24 GLN QE 1 32 PRO HA 5.340 . 5.640 5.286 4.270 5.694 0.054 17 0 "[ . 1 . 2]" 1
833 1 24 GLN QB 1 35 LEU QD 3.810 . 4.110 4.122 4.047 4.190 0.080 4 0 "[ . 1 . 2]" 1
834 1 24 GLN QG 1 35 LEU QD 4.120 . 4.420 2.765 2.445 3.129 . 0 0 "[ . 1 . 2]" 1
835 1 24 GLN QG 1 35 LEU QB 4.590 . 4.890 4.942 4.775 5.049 0.159 13 0 "[ . 1 . 2]" 1
836 1 24 GLN HA 1 40 MET ME 5.500 . 5.800 5.573 5.300 5.834 0.034 16 0 "[ . 1 . 2]" 1
837 1 24 GLN QG 1 72 ILE MD 5.340 . 5.640 5.441 4.988 5.713 0.073 6 0 "[ . 1 . 2]" 1
838 1 25 ALA H 1 25 ALA MB 2.820 . 3.120 2.160 2.093 2.243 . 0 0 "[ . 1 . 2]" 1
839 1 25 ALA H 1 26 ILE H 3.130 . 3.430 2.512 2.441 2.575 . 0 0 "[ . 1 . 2]" 1
840 1 25 ALA H 1 26 ILE MG 4.040 . 4.340 3.782 3.649 3.996 . 0 0 "[ . 1 . 2]" 1
841 1 25 ALA H 1 26 ILE HB 5.070 . 5.370 5.024 4.832 5.146 . 0 0 "[ . 1 . 2]" 1
842 1 25 ALA HA 1 26 ILE MG 5.500 . 5.800 5.146 5.086 5.262 . 0 0 "[ . 1 . 2]" 1
843 1 25 ALA MB 1 26 ILE HB 3.900 . 4.200 3.944 3.814 4.144 . 0 0 "[ . 1 . 2]" 1
844 1 25 ALA MB 1 26 ILE QG 5.190 . 5.490 5.014 4.923 5.157 . 0 0 "[ . 1 . 2]" 1
845 1 25 ALA MB 1 26 ILE H 3.560 . 3.860 2.422 2.307 2.554 . 0 0 "[ . 1 . 2]" 1
846 1 25 ALA MB 1 26 ILE HA 3.960 . 4.260 3.732 3.651 3.822 . 0 0 "[ . 1 . 2]" 1
847 1 25 ALA H 1 27 PHE H 4.140 . 4.440 3.756 3.626 3.971 . 0 0 "[ . 1 . 2]" 1
848 1 25 ALA HA 1 27 PHE H 4.390 . 4.690 4.290 4.190 4.481 . 0 0 "[ . 1 . 2]" 1
849 1 25 ALA MB 1 27 PHE H 4.570 . 4.870 4.235 4.087 4.398 . 0 0 "[ . 1 . 2]" 1
850 1 25 ALA HA 1 28 PRO HA 5.410 . 5.710 4.792 4.237 5.171 . 0 0 "[ . 1 . 2]" 1
851 1 25 ALA HA 1 28 PRO QD 5.120 . 5.420 4.241 3.678 5.080 . 0 0 "[ . 1 . 2]" 1
852 1 25 ALA H 1 72 ILE QG 4.400 . 4.700 4.025 3.869 4.208 . 0 0 "[ . 1 . 2]" 1
853 1 25 ALA H 1 72 ILE MG 5.500 . 5.800 5.885 5.818 5.937 0.137 9 0 "[ . 1 . 2]" 1
854 1 25 ALA HA 1 72 ILE QG 4.550 . 4.850 4.274 4.069 4.432 . 0 0 "[ . 1 . 2]" 1
855 1 25 ALA HA 1 72 ILE MD 4.770 . 5.070 4.169 4.064 4.302 . 0 0 "[ . 1 . 2]" 1
856 1 25 ALA MB 1 72 ILE HB 4.710 . 5.010 4.089 3.929 4.202 . 0 0 "[ . 1 . 2]" 1
857 1 25 ALA MB 1 72 ILE MG 3.680 . 3.980 3.711 3.555 3.809 . 0 0 "[ . 1 . 2]" 1
858 1 25 ALA MB 1 72 ILE HA 3.780 . 4.080 3.741 3.500 3.924 . 0 0 "[ . 1 . 2]" 1
859 1 25 ALA MB 1 72 ILE QG 2.560 . 2.860 1.957 1.872 2.058 . 0 0 "[ . 1 . 2]" 1
860 1 25 ALA MB 1 72 ILE MD 3.260 . 3.560 1.991 1.904 2.115 . 0 0 "[ . 1 . 2]" 1
861 1 25 ALA MB 1 73 TYR HA 4.700 . 5.000 5.024 4.609 5.117 0.117 15 0 "[ . 1 . 2]" 1
862 1 25 ALA HA 1 75 ILE MG 4.570 . 4.870 4.213 3.895 4.483 . 0 0 "[ . 1 . 2]" 1
863 1 25 ALA MB 1 75 ILE HB 4.550 . 4.850 3.913 3.688 4.215 . 0 0 "[ . 1 . 2]" 1
864 1 25 ALA MB 1 75 ILE MG 3.440 . 3.740 2.477 2.085 2.781 . 0 0 "[ . 1 . 2]" 1
865 1 25 ALA HA 1 76 GLN HE21 4.960 . 5.260 4.180 3.759 4.449 . 0 0 "[ . 1 . 2]" 1
866 1 25 ALA HA 1 76 GLN HA 4.230 . 4.530 4.386 4.117 4.551 0.021 16 0 "[ . 1 . 2]" 1
867 1 25 ALA HA 1 76 GLN HG3 5.010 . 5.310 4.412 4.068 4.644 . 0 0 "[ . 1 . 2]" 1
868 1 25 ALA HA 1 76 GLN HB3 5.110 . 5.410 4.673 4.357 4.890 . 0 0 "[ . 1 . 2]" 1
869 1 25 ALA HA 1 76 GLN HB2 5.500 . 5.800 5.684 5.346 5.881 0.081 3 0 "[ . 1 . 2]" 1
870 1 25 ALA MB 1 76 GLN HB2 4.500 . 4.800 4.354 4.257 4.410 . 0 0 "[ . 1 . 2]" 1
871 1 25 ALA MB 1 76 GLN HA 3.790 . 4.090 3.608 3.475 3.908 . 0 0 "[ . 1 . 2]" 1
872 1 25 ALA MB 1 76 GLN HE21 4.720 . 5.020 2.290 2.052 2.422 . 0 0 "[ . 1 . 2]" 1
873 1 25 ALA MB 1 76 GLN HG3 4.120 . 4.420 2.658 2.478 2.787 . 0 0 "[ . 1 . 2]" 1
874 1 25 ALA MB 1 76 GLN H 4.110 . 4.410 3.780 3.603 3.928 . 0 0 "[ . 1 . 2]" 1
875 1 25 ALA MB 1 76 GLN HG2 4.200 . 4.500 1.876 1.810 1.973 . 0 0 "[ . 1 . 2]" 1
876 1 25 ALA MB 1 76 GLN HE22 4.990 . 5.290 3.092 2.822 3.317 . 0 0 "[ . 1 . 2]" 1
877 1 25 ALA MB 1 76 GLN HB3 4.170 . 4.470 4.128 4.049 4.243 . 0 0 "[ . 1 . 2]" 1
878 1 25 ALA MB 2 11 LEU MD1 4.000 . 4.300 4.282 4.102 4.367 0.067 3 0 "[ . 1 . 2]" 1
879 1 26 ILE H 1 26 ILE HB 3.380 . 3.680 2.652 2.538 2.724 . 0 0 "[ . 1 . 2]" 1
880 1 26 ILE H 1 26 ILE MG 3.470 . 3.770 2.109 2.027 2.249 . 0 0 "[ . 1 . 2]" 1
881 1 26 ILE H 1 26 ILE QG 4.160 . 4.460 3.996 3.961 4.030 . 0 0 "[ . 1 . 2]" 1
882 1 26 ILE HA 1 26 ILE MD 3.870 . 4.170 3.850 3.444 3.924 . 0 0 "[ . 1 . 2]" 1
883 1 26 ILE HA 1 26 ILE MG 3.260 . 3.560 3.244 3.228 3.272 . 0 0 "[ . 1 . 2]" 1
884 1 26 ILE HB 1 26 ILE MD 3.200 . 3.500 2.583 2.509 3.160 . 0 0 "[ . 1 . 2]" 1
885 1 26 ILE MD 1 26 ILE MG 2.430 . 2.730 1.809 1.781 1.874 0.019 9 0 "[ . 1 . 2]" 1
886 1 26 ILE H 1 27 PHE HB2 4.960 . 5.260 4.817 4.385 5.144 . 0 0 "[ . 1 . 2]" 1
887 1 26 ILE H 1 27 PHE H 3.120 . 3.420 2.426 2.354 2.499 . 0 0 "[ . 1 . 2]" 1
888 1 26 ILE HA 1 27 PHE HB2 5.500 . 5.800 5.188 5.082 5.342 . 0 0 "[ . 1 . 2]" 1
889 1 26 ILE HB 1 27 PHE H 4.140 . 4.440 3.975 3.884 4.030 . 0 0 "[ . 1 . 2]" 1
890 1 26 ILE MD 1 27 PHE QD 4.970 . 5.270 4.305 2.496 5.329 0.059 1 0 "[ . 1 . 2]" 1
891 1 26 ILE MD 1 27 PHE HA 5.020 . 5.320 5.018 3.653 5.220 . 0 0 "[ . 1 . 2]" 1
892 1 26 ILE MD 1 27 PHE H 4.640 . 4.940 4.526 3.771 4.700 . 0 0 "[ . 1 . 2]" 1
893 1 26 ILE QG 1 27 PHE H 4.560 . 4.860 3.883 3.759 4.354 . 0 0 "[ . 1 . 2]" 1
894 1 26 ILE MG 1 27 PHE HB3 4.100 . 4.400 3.268 2.820 3.866 . 0 0 "[ . 1 . 2]" 1
895 1 26 ILE MG 1 27 PHE HA 4.470 . 4.770 3.687 3.583 3.761 . 0 0 "[ . 1 . 2]" 1
896 1 26 ILE MG 1 27 PHE QD 4.380 . 4.680 3.443 1.928 4.376 . 0 0 "[ . 1 . 2]" 1
897 1 26 ILE MG 1 27 PHE HB2 4.010 . 4.310 2.340 2.184 2.717 . 0 0 "[ . 1 . 2]" 1
898 1 26 ILE MG 1 27 PHE H 3.680 . 3.980 2.309 2.188 2.399 . 0 0 "[ . 1 . 2]" 1
899 1 26 ILE HA 1 28 PRO QD 4.760 . 5.060 3.977 3.654 4.428 . 0 0 "[ . 1 . 2]" 1
900 1 26 ILE MD 1 46 TYR HB2 4.630 . 4.930 4.196 3.569 4.449 . 0 0 "[ . 1 . 2]" 1
901 1 26 ILE MD 1 46 TYR HE1 4.190 . 4.490 2.998 2.547 3.912 . 0 0 "[ . 1 . 2]" 1
902 1 26 ILE MD 1 46 TYR QD 3.780 . 4.080 3.036 2.713 3.237 . 0 0 "[ . 1 . 2]" 1
903 1 26 ILE MD 1 46 TYR HA 5.500 . 5.800 5.726 5.184 5.909 0.109 12 0 "[ . 1 . 2]" 1
904 1 26 ILE MD 1 46 TYR HB3 4.030 . 4.330 3.747 3.122 4.051 . 0 0 "[ . 1 . 2]" 1
905 1 26 ILE MG 1 46 TYR HE1 5.500 . 5.800 3.321 2.743 5.816 0.016 13 0 "[ . 1 . 2]" 1
906 1 26 ILE MG 1 47 ALA H 5.500 . 5.800 4.903 4.240 5.226 . 0 0 "[ . 1 . 2]" 1
907 1 26 ILE MD 1 50 VAL QG 4.710 . 5.010 4.680 4.354 5.030 0.020 10 0 "[ . 1 . 2]" 1
908 1 26 ILE H 1 72 ILE QG 4.120 . 4.420 4.230 3.999 4.436 0.016 14 0 "[ . 1 . 2]" 1
909 1 26 ILE HA 1 75 ILE MG 3.720 . 4.020 2.596 1.970 3.223 . 0 0 "[ . 1 . 2]" 1
910 1 26 ILE MD 2 38 GLU HB3 5.000 . 5.300 5.372 5.305 5.416 0.116 9 0 "[ . 1 . 2]" 1
911 1 26 ILE MD 2 42 GLU HA 4.220 . 4.520 4.512 4.126 4.609 0.089 19 0 "[ . 1 . 2]" 1
912 1 26 ILE MD 2 42 GLU QG 4.150 . 4.450 4.373 3.948 4.522 0.072 2 0 "[ . 1 . 2]" 1
913 1 26 ILE MG 2 42 GLU QG 5.370 . 5.670 5.772 5.702 5.891 0.221 9 0 "[ . 1 . 2]" 1
914 1 26 ILE MD 2 45 ILE HA 4.080 . 4.380 3.846 3.589 4.266 . 0 0 "[ . 1 . 2]" 1
915 1 26 ILE QG 2 45 ILE MG 3.690 . 3.990 3.018 2.770 3.244 . 0 0 "[ . 1 . 2]" 1
916 1 26 ILE MG 2 45 ILE QG 5.040 . 5.340 4.521 4.010 4.778 . 0 0 "[ . 1 . 2]" 1
917 1 26 ILE MD 2 49 LEU HA 5.480 . 5.780 5.732 5.503 5.884 0.104 4 0 "[ . 1 . 2]" 1
918 1 26 ILE MD 2 49 LEU QB 4.330 . 4.630 4.080 3.724 4.536 . 0 0 "[ . 1 . 2]" 1
919 1 27 PHE H 1 27 PHE HB3 3.660 . 3.960 2.830 2.404 3.518 . 0 0 "[ . 1 . 2]" 1
920 1 27 PHE H 1 27 PHE HB2 3.450 . 3.750 2.808 2.423 3.060 . 0 0 "[ . 1 . 2]" 1
921 1 27 PHE H 1 27 PHE QD 4.140 . 4.440 3.940 3.280 4.261 . 0 0 "[ . 1 . 2]" 1
922 1 27 PHE HA 1 27 PHE QD 3.910 . 4.210 2.661 2.373 2.954 . 0 0 "[ . 1 . 2]" 1
923 1 27 PHE H 1 28 PRO HA 4.670 . 4.970 4.701 4.537 4.861 . 0 0 "[ . 1 . 2]" 1
924 1 27 PHE H 1 28 PRO QD 4.400 . 4.700 3.434 3.213 3.762 . 0 0 "[ . 1 . 2]" 1
925 1 27 PHE HA 1 28 PRO HG2 4.280 . 4.580 3.789 3.519 4.092 . 0 0 "[ . 1 . 2]" 1
926 1 27 PHE HA 1 28 PRO QD 3.240 . 3.540 1.944 1.867 2.044 . 0 0 "[ . 1 . 2]" 1
927 1 27 PHE HA 1 28 PRO HG3 4.440 . 4.740 4.493 4.389 4.585 . 0 0 "[ . 1 . 2]" 1
928 1 27 PHE HB2 1 28 PRO QD 4.490 . 4.790 4.304 4.191 4.444 . 0 0 "[ . 1 . 2]" 1
929 1 27 PHE HB3 1 28 PRO HG2 5.500 . 5.800 5.885 5.807 5.936 0.136 20 0 "[ . 1 . 2]" 1
930 1 27 PHE HB3 1 28 PRO QD 4.350 . 4.650 4.265 3.829 4.373 . 0 0 "[ . 1 . 2]" 1
931 1 27 PHE QD 1 28 PRO QD 4.390 . 4.690 3.914 3.190 4.322 . 0 0 "[ . 1 . 2]" 1
932 1 27 PHE HB3 1 29 THR HA 5.420 . 5.720 4.720 3.733 5.263 . 0 0 "[ . 1 . 2]" 1
933 1 27 PHE HB2 1 40 MET ME 5.000 . 5.300 5.031 4.549 5.356 0.056 18 0 "[ . 1 . 2]" 1
934 1 27 PHE HB3 1 40 MET ME 5.000 . 5.300 4.763 4.286 5.338 0.038 9 0 "[ . 1 . 2]" 1
935 1 27 PHE H 1 43 LEU QD 5.140 . 5.440 4.018 3.779 4.211 . 0 0 "[ . 1 . 2]" 1
936 1 27 PHE HA 1 43 LEU MD1 5.000 . 5.300 4.366 4.060 4.727 . 0 0 "[ . 1 . 2]" 1
937 1 27 PHE HA 1 43 LEU QD 4.580 . 4.880 3.950 3.451 4.282 . 0 0 "[ . 1 . 2]" 1
938 1 27 PHE HA 1 43 LEU MD2 5.000 . 5.300 4.522 3.735 4.990 . 0 0 "[ . 1 . 2]" 1
939 1 27 PHE HB2 1 43 LEU MD1 3.970 . 4.270 2.277 2.031 2.671 . 0 0 "[ . 1 . 2]" 1
940 1 27 PHE HB2 1 43 LEU HB3 4.450 . 4.750 3.940 3.218 4.319 . 0 0 "[ . 1 . 2]" 1
941 1 27 PHE HB2 1 43 LEU QD 3.480 . 3.780 2.168 1.883 2.558 . 0 0 "[ . 1 . 2]" 1
942 1 27 PHE HB2 1 43 LEU MD2 3.970 . 4.270 2.777 2.114 3.321 . 0 0 "[ . 1 . 2]" 1
943 1 27 PHE HB3 1 43 LEU MD1 4.070 . 4.370 2.792 2.532 3.113 . 0 0 "[ . 1 . 2]" 1
944 1 27 PHE HB3 1 43 LEU MD2 4.070 . 4.370 3.974 3.569 4.374 0.004 4 0 "[ . 1 . 2]" 1
945 1 27 PHE HB3 1 43 LEU QD 3.420 . 3.720 2.738 2.487 3.049 . 0 0 "[ . 1 . 2]" 1
946 1 27 PHE QD 1 43 LEU MD2 3.930 . 4.230 3.243 2.479 3.870 . 0 0 "[ . 1 . 2]" 1
947 1 27 PHE QD 1 43 LEU MD1 3.930 . 4.230 2.778 2.597 2.959 . 0 0 "[ . 1 . 2]" 1
948 1 28 PRO HA 1 29 THR H 2.840 . 3.140 2.187 2.087 2.359 . 0 0 "[ . 1 . 2]" 1
949 1 28 PRO HA 1 29 THR HB 5.500 . 5.800 4.854 4.438 5.548 . 0 0 "[ . 1 . 2]" 1
950 1 28 PRO HA 1 29 THR MG 4.970 . 5.270 3.979 3.663 4.955 . 0 0 "[ . 1 . 2]" 1
951 1 28 PRO HB2 1 29 THR H 3.890 . 4.190 3.948 3.474 4.203 0.013 1 0 "[ . 1 . 2]" 1
952 1 28 PRO HB2 1 29 THR MG 5.500 . 5.800 5.421 5.237 5.656 . 0 0 "[ . 1 . 2]" 1
953 1 28 PRO HB3 1 29 THR H 4.340 . 4.640 4.205 3.166 4.500 . 0 0 "[ . 1 . 2]" 1
954 1 28 PRO HB3 1 29 THR MG 5.500 . 5.800 5.782 5.555 5.975 0.175 9 0 "[ . 1 . 2]" 1
955 1 28 PRO HB2 1 30 PRO QD 5.360 . 5.660 5.045 3.637 5.682 0.022 4 0 "[ . 1 . 2]" 1
956 1 28 PRO HA 1 79 LEU QD 4.810 . 5.110 4.683 4.064 4.981 . 0 0 "[ . 1 . 2]" 1
957 1 28 PRO HA 1 79 LEU MD2 5.500 . 5.800 5.337 4.488 5.798 . 0 0 "[ . 1 . 2]" 1
958 1 28 PRO HA 1 79 LEU MD1 5.500 . 5.800 5.205 4.644 5.731 . 0 0 "[ . 1 . 2]" 1
959 1 28 PRO HB3 1 79 LEU QD 3.560 . 3.860 3.488 2.795 3.895 0.035 9 0 "[ . 1 . 2]" 1
960 1 28 PRO HG3 1 79 LEU QD 4.540 . 4.840 2.573 2.160 3.380 . 0 0 "[ . 1 . 2]" 1
961 1 28 PRO HG3 1 79 LEU HB2 5.500 . 5.800 4.719 3.895 5.641 . 0 0 "[ . 1 . 2]" 1
962 1 28 PRO QD 1 79 LEU QD 3.860 . 4.160 2.471 2.182 2.768 . 0 0 "[ . 1 . 2]" 1
963 1 28 PRO QB 2 37 LEU QD 4.110 . 4.410 2.854 2.285 3.462 . 0 0 "[ . 1 . 2]" 1
964 1 28 PRO QG 2 37 LEU QD 4.000 . 4.300 2.579 1.943 3.398 . 0 0 "[ . 1 . 2]" 1
965 1 29 THR H 1 29 THR MG 3.220 . 3.520 2.436 2.136 3.589 0.069 9 0 "[ . 1 . 2]" 1
966 1 29 THR H 1 29 THR HB 3.410 . 3.710 2.730 2.384 3.423 . 0 0 "[ . 1 . 2]" 1
967 1 29 THR HA 1 29 THR MG 3.250 . 3.550 2.798 1.948 3.233 . 0 0 "[ . 1 . 2]" 1
968 1 29 THR H 1 30 PRO QD 4.510 . 4.810 4.207 3.955 4.342 . 0 0 "[ . 1 . 2]" 1
969 1 29 THR HA 1 30 PRO HA 4.610 . 4.910 4.451 4.372 4.613 . 0 0 "[ . 1 . 2]" 1
970 1 29 THR HA 1 30 PRO HG3 4.530 . 4.830 4.381 4.277 4.511 . 0 0 "[ . 1 . 2]" 1
971 1 29 THR HA 1 30 PRO HG2 4.340 . 4.640 4.297 4.154 4.398 . 0 0 "[ . 1 . 2]" 1
972 1 29 THR HA 1 30 PRO HB2 5.500 . 5.800 5.486 5.363 5.599 . 0 0 "[ . 1 . 2]" 1
973 1 29 THR HA 1 30 PRO QD 2.870 . 3.170 1.968 1.878 2.035 . 0 0 "[ . 1 . 2]" 1
974 1 29 THR HB 1 30 PRO QD 3.720 . 4.020 3.614 3.386 4.085 0.065 9 0 "[ . 1 . 2]" 1
975 1 29 THR MG 1 30 PRO QD 4.060 . 4.360 3.404 2.528 3.889 . 0 0 "[ . 1 . 2]" 1
976 1 29 THR MG 1 30 PRO HA 4.900 . 5.200 4.701 4.342 5.338 0.138 8 0 "[ . 1 . 2]" 1
977 1 29 THR HA 1 31 ASP H 4.740 . 5.040 3.597 2.956 3.932 . 0 0 "[ . 1 . 2]" 1
978 1 29 THR MG 1 31 ASP HB3 5.500 . 5.800 5.223 4.389 5.803 0.003 2 0 "[ . 1 . 2]" 1
979 1 29 THR MG 1 31 ASP HB2 5.500 . 5.800 5.466 4.906 5.847 0.047 17 0 "[ . 1 . 2]" 1
980 1 29 THR MG 1 31 ASP H 3.830 . 4.130 3.186 2.452 3.564 . 0 0 "[ . 1 . 2]" 1
981 1 29 THR MG 1 31 ASP HA 5.160 . 5.460 4.353 3.782 5.191 . 0 0 "[ . 1 . 2]" 1
982 1 29 THR MG 1 32 PRO HB3 5.390 . 5.690 4.416 3.616 5.165 . 0 0 "[ . 1 . 2]" 1
983 1 29 THR MG 1 32 PRO HA 3.940 . 4.240 2.984 2.509 3.454 . 0 0 "[ . 1 . 2]" 1
984 1 29 THR HA 1 34 ALA MB 4.780 . 5.080 3.672 3.217 4.021 . 0 0 "[ . 1 . 2]" 1
985 1 29 THR HB 1 34 ALA MB 4.620 . 4.920 3.955 3.491 4.943 0.023 9 0 "[ . 1 . 2]" 1
986 1 29 THR MG 1 34 ALA MB 3.740 . 4.040 3.479 2.142 3.948 . 0 0 "[ . 1 . 2]" 1
987 1 29 THR H 1 35 LEU QD 5.440 . 5.740 4.051 3.508 4.855 . 0 0 "[ . 1 . 2]" 1
988 1 29 THR HA 1 35 LEU MD1 5.500 . 5.800 5.498 4.613 5.828 0.028 6 0 "[ . 1 . 2]" 1
989 1 29 THR HA 1 35 LEU MD2 5.500 . 5.800 4.221 3.515 4.581 . 0 0 "[ . 1 . 2]" 1
990 1 29 THR HA 1 35 LEU HG 5.500 . 5.800 5.289 4.626 5.640 . 0 0 "[ . 1 . 2]" 1
991 1 29 THR HB 1 35 LEU QD 4.450 . 4.750 2.718 2.181 3.822 . 0 0 "[ . 1 . 2]" 1
992 1 29 THR MG 1 35 LEU HA 4.700 . 5.000 4.823 3.921 5.031 0.031 7 0 "[ . 1 . 2]" 1
993 1 29 THR MG 1 35 LEU QB 4.290 . 4.590 4.175 3.811 4.356 . 0 0 "[ . 1 . 2]" 1
994 1 29 THR MG 1 35 LEU MD2 3.590 . 3.890 1.984 1.862 2.124 . 0 0 "[ . 1 . 2]" 1
995 1 29 THR MG 1 35 LEU QD 3.140 . 3.440 1.823 1.763 1.868 0.037 16 0 "[ . 1 . 2]" 1
996 1 29 THR MG 1 35 LEU HG 4.650 . 4.950 2.630 2.057 2.879 . 0 0 "[ . 1 . 2]" 1
997 1 29 THR MG 1 35 LEU MD1 3.590 . 3.890 2.146 2.000 2.367 . 0 0 "[ . 1 . 2]" 1
998 1 29 THR MG 1 40 MET ME 5.000 . 5.300 5.081 4.446 5.375 0.075 14 0 "[ . 1 . 2]" 1
999 1 29 THR HA 1 43 LEU QD 5.440 . 5.740 5.604 5.174 5.827 0.087 9 0 "[ . 1 . 2]" 1
1000 1 30 PRO HA 1 31 ASP QB 5.120 . 5.420 4.855 4.493 5.373 . 0 0 "[ . 1 . 2]" 1
1001 1 30 PRO HB2 1 31 ASP QB 5.340 . 5.640 3.678 3.261 4.438 . 0 0 "[ . 1 . 2]" 1
1002 1 30 PRO HB2 1 31 ASP H 3.630 . 3.930 3.500 3.241 3.767 . 0 0 "[ . 1 . 2]" 1
1003 1 30 PRO HG2 1 31 ASP HB2 5.290 . 5.590 3.470 2.904 3.992 . 0 0 "[ . 1 . 2]" 1
1004 1 30 PRO HG2 1 31 ASP H 3.360 . 3.660 2.516 2.283 2.798 . 0 0 "[ . 1 . 2]" 1
1005 1 30 PRO HG2 1 31 ASP QB 4.540 . 4.840 3.163 2.874 3.466 . 0 0 "[ . 1 . 2]" 1
1006 1 30 PRO HG2 1 31 ASP HB3 5.290 . 5.590 3.962 3.154 4.981 . 0 0 "[ . 1 . 2]" 1
1007 1 30 PRO HG2 1 31 ASP HA 5.500 . 5.800 4.757 4.531 5.015 . 0 0 "[ . 1 . 2]" 1
1008 1 30 PRO HG3 1 31 ASP QB 5.340 . 5.640 4.708 4.360 4.987 . 0 0 "[ . 1 . 2]" 1
1009 1 30 PRO HG3 1 31 ASP H 4.400 . 4.700 3.933 3.782 4.137 . 0 0 "[ . 1 . 2]" 1
1010 1 30 PRO QD 1 31 ASP H 3.720 . 4.020 2.404 1.969 2.696 . 0 0 "[ . 1 . 2]" 1
1011 1 30 PRO HB2 1 34 ALA MB 4.540 . 4.840 4.685 4.067 4.883 0.043 3 0 "[ . 1 . 2]" 1
1012 1 30 PRO HG2 1 34 ALA HA 5.490 . 5.790 5.429 4.964 5.648 . 0 0 "[ . 1 . 2]" 1
1013 1 30 PRO HG2 1 34 ALA MB 3.590 . 3.890 2.799 2.375 2.982 . 0 0 "[ . 1 . 2]" 1
1014 1 30 PRO QD 1 34 ALA MB 4.920 . 5.220 2.463 2.201 2.769 . 0 0 "[ . 1 . 2]" 1
1015 1 30 PRO QD 1 35 LEU MD2 5.500 . 5.800 4.663 3.823 5.148 . 0 0 "[ . 1 . 2]" 1
1016 1 30 PRO QD 1 35 LEU QD 4.770 . 5.070 4.445 3.720 4.713 . 0 0 "[ . 1 . 2]" 1
1017 1 30 PRO QD 1 35 LEU MD1 5.500 . 5.800 5.644 5.100 5.843 0.043 20 0 "[ . 1 . 2]" 1
1018 1 31 ASP H 1 31 ASP QB 3.270 . 3.570 2.727 2.543 2.949 . 0 0 "[ . 1 . 2]" 1
1019 1 31 ASP H 1 32 PRO QD 4.410 . 4.710 4.167 3.937 4.329 . 0 0 "[ . 1 . 2]" 1
1020 1 31 ASP HA 1 32 PRO HG2 4.850 . 5.150 4.290 4.081 4.481 . 0 0 "[ . 1 . 2]" 1
1021 1 31 ASP HA 1 32 PRO HG3 4.630 . 4.930 4.515 4.453 4.617 . 0 0 "[ . 1 . 2]" 1
1022 1 31 ASP HA 1 32 PRO QD 2.850 . 3.150 2.026 1.930 2.148 . 0 0 "[ . 1 . 2]" 1
1023 1 31 ASP HA 1 32 PRO HB3 5.170 . 5.470 5.148 4.984 5.263 . 0 0 "[ . 1 . 2]" 1
1024 1 31 ASP HB2 1 32 PRO QD 4.360 . 4.660 3.798 3.655 4.037 . 0 0 "[ . 1 . 2]" 1
1025 1 31 ASP HB3 1 32 PRO QD 4.360 . 4.660 3.322 2.269 3.897 . 0 0 "[ . 1 . 2]" 1
1026 1 31 ASP QB 1 32 PRO HG2 4.420 . 4.720 4.459 3.594 4.765 0.045 11 0 "[ . 1 . 2]" 1
1027 1 31 ASP QB 1 32 PRO HB2 5.270 . 5.570 5.464 5.013 5.678 0.108 7 0 "[ . 1 . 2]" 1
1028 1 31 ASP QB 1 32 PRO QD 3.790 . 4.090 3.052 2.249 3.477 . 0 0 "[ . 1 . 2]" 1
1029 1 31 ASP H 1 33 ALA H 4.720 . 5.020 4.731 4.488 4.945 . 0 0 "[ . 1 . 2]" 1
1030 1 31 ASP HA 1 33 ALA H 4.070 . 4.370 3.879 3.588 4.083 . 0 0 "[ . 1 . 2]" 1
1031 1 31 ASP HB2 1 33 ALA MB 4.800 . 5.100 4.181 3.053 4.898 . 0 0 "[ . 1 . 2]" 1
1032 1 31 ASP HB2 1 33 ALA H 4.110 . 4.410 3.855 2.922 4.371 . 0 0 "[ . 1 . 2]" 1
1033 1 31 ASP HB3 1 33 ALA MB 4.800 . 5.100 3.246 2.607 3.836 . 0 0 "[ . 1 . 2]" 1
1034 1 31 ASP HB3 1 33 ALA H 4.110 . 4.410 2.672 2.022 3.146 . 0 0 "[ . 1 . 2]" 1
1035 1 31 ASP QB 1 33 ALA MB 4.160 . 4.460 3.132 2.471 3.705 . 0 0 "[ . 1 . 2]" 1
1036 1 31 ASP QB 1 33 ALA H 3.590 . 3.890 2.624 2.003 3.078 . 0 0 "[ . 1 . 2]" 1
1037 1 31 ASP H 1 34 ALA MB 3.840 . 4.140 2.992 2.691 3.257 . 0 0 "[ . 1 . 2]" 1
1038 1 31 ASP HA 1 34 ALA H 4.750 . 5.050 4.709 4.248 4.918 . 0 0 "[ . 1 . 2]" 1
1039 1 31 ASP HA 1 34 ALA MB 5.140 . 5.440 4.833 4.313 5.106 . 0 0 "[ . 1 . 2]" 1
1040 1 31 ASP HB2 1 34 ALA MB 4.370 . 4.670 3.757 2.071 4.617 . 0 0 "[ . 1 . 2]" 1
1041 1 31 ASP HB3 1 34 ALA MB 4.370 . 4.670 3.458 2.529 4.441 . 0 0 "[ . 1 . 2]" 1
1042 1 31 ASP QB 1 34 ALA MB 3.750 . 4.050 2.935 2.056 3.332 . 0 0 "[ . 1 . 2]" 1
1043 1 31 ASP QB 1 34 ALA H 3.730 . 4.030 2.778 2.321 3.063 . 0 0 "[ . 1 . 2]" 1
1044 1 31 ASP H 1 35 LEU QD 4.400 . 4.700 4.685 4.508 4.802 0.102 16 0 "[ . 1 . 2]" 1
1045 1 31 ASP HA 1 35 LEU QD 5.060 . 5.360 5.328 5.215 5.457 0.097 15 0 "[ . 1 . 2]" 1
1046 1 31 ASP QB 1 35 LEU QD 4.850 . 5.150 5.117 4.855 5.264 0.114 4 0 "[ . 1 . 2]" 1
1047 1 32 PRO HA 1 33 ALA H 3.490 . 3.790 3.498 3.361 3.571 . 0 0 "[ . 1 . 2]" 1
1048 1 32 PRO HA 1 33 ALA MB 5.170 . 5.470 5.013 4.923 5.071 . 0 0 "[ . 1 . 2]" 1
1049 1 32 PRO HB2 1 33 ALA H 3.930 . 4.230 3.458 3.235 3.717 . 0 0 "[ . 1 . 2]" 1
1050 1 32 PRO HB2 1 33 ALA HA 4.790 . 5.090 4.015 3.782 4.225 . 0 0 "[ . 1 . 2]" 1
1051 1 32 PRO HB2 1 33 ALA MB 5.150 . 5.450 4.314 4.072 4.652 . 0 0 "[ . 1 . 2]" 1
1052 1 32 PRO HG2 1 33 ALA H 3.670 . 3.970 2.991 2.796 3.151 . 0 0 "[ . 1 . 2]" 1
1053 1 32 PRO HG2 1 33 ALA MB 3.750 . 4.050 3.882 3.621 4.078 0.028 1 0 "[ . 1 . 2]" 1
1054 1 32 PRO HG2 1 33 ALA HA 4.930 . 5.230 4.706 4.400 4.975 . 0 0 "[ . 1 . 2]" 1
1055 1 32 PRO HG3 1 33 ALA H 4.470 . 4.770 4.404 4.238 4.574 . 0 0 "[ . 1 . 2]" 1
1056 1 32 PRO QD 1 33 ALA H 3.150 . 3.450 3.044 2.528 3.321 . 0 0 "[ . 1 . 2]" 1
1057 1 32 PRO QD 1 34 ALA H 4.590 . 4.890 4.645 4.315 4.831 . 0 0 "[ . 1 . 2]" 1
1058 1 32 PRO QD 1 34 ALA MB 5.170 . 5.470 5.216 4.895 5.442 . 0 0 "[ . 1 . 2]" 1
1059 1 32 PRO HA 1 35 LEU HG 4.000 . 4.300 2.715 2.550 3.087 . 0 0 "[ . 1 . 2]" 1
1060 1 32 PRO HA 1 35 LEU QD 3.300 . 3.600 1.982 1.856 2.250 . 0 0 "[ . 1 . 2]" 1
1061 1 32 PRO HA 1 35 LEU MD2 3.870 . 4.170 3.852 3.731 4.105 . 0 0 "[ . 1 . 2]" 1
1062 1 32 PRO HA 1 35 LEU MD1 3.870 . 4.170 1.989 1.858 2.269 . 0 0 "[ . 1 . 2]" 1
1063 1 32 PRO HB2 1 35 LEU QD 4.170 . 4.470 3.276 2.933 3.461 . 0 0 "[ . 1 . 2]" 1
1064 1 32 PRO HB3 1 35 LEU QD 3.780 . 4.080 2.939 2.799 3.175 . 0 0 "[ . 1 . 2]" 1
1065 1 32 PRO HB3 1 35 LEU MD2 5.000 . 5.300 5.346 5.322 5.375 0.075 13 0 "[ . 1 . 2]" 1
1066 1 32 PRO HG2 1 35 LEU QD 4.940 . 5.240 4.831 4.628 4.985 . 0 0 "[ . 1 . 2]" 1
1067 1 32 PRO HB2 1 36 LYS QE 4.810 . 5.110 4.386 3.811 4.996 . 0 0 "[ . 1 . 2]" 1
1068 1 33 ALA H 1 33 ALA MB 2.410 . 2.710 2.300 2.258 2.338 . 0 0 "[ . 1 . 2]" 1
1069 1 33 ALA H 1 34 ALA H 2.650 . 2.950 2.528 2.439 2.629 . 0 0 "[ . 1 . 2]" 1
1070 1 33 ALA MB 1 34 ALA MB 4.340 . 4.640 4.138 3.945 4.224 . 0 0 "[ . 1 . 2]" 1
1071 1 33 ALA MB 1 34 ALA H 3.380 . 3.680 3.168 3.023 3.273 . 0 0 "[ . 1 . 2]" 1
1072 1 33 ALA H 1 35 LEU H 4.240 . 4.540 4.026 3.869 4.176 . 0 0 "[ . 1 . 2]" 1
1073 1 33 ALA H 1 35 LEU HG 5.500 . 5.800 4.785 4.565 5.298 . 0 0 "[ . 1 . 2]" 1
1074 1 33 ALA HA 1 35 LEU QD 4.060 . 4.360 4.465 4.422 4.515 0.155 18 0 "[ . 1 . 2]" 1
1075 1 33 ALA H 1 36 LYS QD 5.500 . 5.800 5.462 4.775 5.812 0.012 1 0 "[ . 1 . 2]" 1
1076 1 33 ALA H 1 36 LYS QE 5.000 . 5.300 4.928 4.439 5.313 0.013 4 0 "[ . 1 . 2]" 1
1077 1 33 ALA HA 1 36 LYS QD 3.430 . 3.730 3.026 2.470 3.476 . 0 0 "[ . 1 . 2]" 1
1078 1 33 ALA HA 1 36 LYS HB3 4.750 . 5.050 4.387 4.121 4.613 . 0 0 "[ . 1 . 2]" 1
1079 1 33 ALA HA 1 36 LYS HB2 5.000 . 5.300 5.212 4.688 5.340 0.040 10 0 "[ . 1 . 2]" 1
1080 1 33 ALA HA 1 36 LYS HG2 4.040 . 4.340 2.340 2.050 2.509 . 0 0 "[ . 1 . 2]" 1
1081 1 33 ALA HA 1 36 LYS QE 4.210 . 4.510 2.559 2.151 3.325 . 0 0 "[ . 1 . 2]" 1
1082 1 33 ALA MB 1 36 LYS QE 4.290 . 4.590 3.596 3.033 4.391 . 0 0 "[ . 1 . 2]" 1
1083 1 33 ALA MB 1 36 LYS QD 3.410 . 3.710 2.929 2.674 3.260 . 0 0 "[ . 1 . 2]" 1
1084 1 33 ALA MB 1 37 ASP QB 5.500 . 5.800 4.959 4.084 5.381 . 0 0 "[ . 1 . 2]" 1
1085 1 30 PRO HG3 1 34 ALA H 6.000 . 6.300 6.301 6.127 6.348 0.048 2 0 "[ . 1 . 2]" 1
1086 1 31 ASP HB3 1 34 ALA H 5.000 . 5.300 3.040 2.408 3.694 . 0 0 "[ . 1 . 2]" 1
1087 1 31 ASP HB2 1 34 ALA H 5.000 . 5.300 3.977 2.480 4.839 . 0 0 "[ . 1 . 2]" 1
1088 1 32 PRO HA 1 34 ALA H 4.500 . 4.800 3.785 3.530 3.913 . 0 0 "[ . 1 . 2]" 1
1089 1 34 ALA H 1 34 ALA MB 2.520 . 2.820 2.263 2.231 2.312 . 0 0 "[ . 1 . 2]" 1
1090 1 34 ALA H 1 35 LEU QD 4.170 . 4.470 4.014 3.909 4.087 . 0 0 "[ . 1 . 2]" 1
1091 1 34 ALA H 1 35 LEU H 2.780 . 3.080 2.378 2.270 2.501 . 0 0 "[ . 1 . 2]" 1
1092 1 34 ALA H 1 35 LEU HG 4.180 . 4.480 3.460 3.368 3.695 . 0 0 "[ . 1 . 2]" 1
1093 1 34 ALA HA 1 35 LEU QD 4.700 . 5.000 4.997 4.911 5.088 0.088 13 0 "[ . 1 . 2]" 1
1094 1 34 ALA MB 1 35 LEU H 3.540 . 3.840 3.086 2.915 3.188 . 0 0 "[ . 1 . 2]" 1
1095 1 34 ALA MB 1 35 LEU HG 3.710 . 4.010 3.341 2.906 3.491 . 0 0 "[ . 1 . 2]" 1
1096 1 34 ALA MB 1 35 LEU QD 3.820 . 4.120 3.462 3.283 3.617 . 0 0 "[ . 1 . 2]" 1
1097 1 34 ALA HA 1 37 ASP H 4.360 . 4.660 3.612 3.424 4.197 . 0 0 "[ . 1 . 2]" 1
1098 1 34 ALA HA 1 37 ASP QB 3.820 . 4.120 2.373 2.001 2.910 . 0 0 "[ . 1 . 2]" 1
1099 1 34 ALA MB 1 37 ASP QB 4.770 . 5.070 3.425 3.241 3.896 . 0 0 "[ . 1 . 2]" 1
1100 1 34 ALA HA 1 39 ARG QB 5.500 . 5.800 5.456 4.111 5.882 0.082 1 0 "[ . 1 . 2]" 1
1101 1 34 ALA MB 1 39 ARG QD 5.500 . 5.800 4.795 3.513 5.897 0.097 3 0 "[ . 1 . 2]" 1
1102 1 32 PRO HA 1 35 LEU H 4.500 . 4.800 3.784 3.596 3.895 . 0 0 "[ . 1 . 2]" 1
1103 1 35 LEU H 1 35 LEU QD 3.310 . 3.610 3.043 2.871 3.104 . 0 0 "[ . 1 . 2]" 1
1104 1 35 LEU H 1 35 LEU QB 3.440 . 3.740 2.470 2.404 2.566 . 0 0 "[ . 1 . 2]" 1
1105 1 35 LEU H 1 35 LEU MD2 3.830 . 4.130 3.486 3.354 3.717 . 0 0 "[ . 1 . 2]" 1
1106 1 35 LEU H 1 35 LEU MD1 3.830 . 4.130 3.370 3.008 3.514 . 0 0 "[ . 1 . 2]" 1
1107 1 35 LEU H 1 35 LEU HG 2.810 . 3.110 2.248 2.157 2.330 . 0 0 "[ . 1 . 2]" 1
1108 1 35 LEU HA 1 35 LEU HG 3.790 . 4.090 3.074 2.838 3.189 . 0 0 "[ . 1 . 2]" 1
1109 1 35 LEU H 1 36 LYS H 3.060 . 3.360 2.470 2.367 2.564 . 0 0 "[ . 1 . 2]" 1
1110 1 35 LEU H 1 36 LYS HG2 3.970 . 4.270 3.533 3.306 3.746 . 0 0 "[ . 1 . 2]" 1
1111 1 35 LEU HA 1 36 LYS H 3.180 . 3.480 3.258 3.199 3.306 . 0 0 "[ . 1 . 2]" 1
1112 1 35 LEU HG 1 36 LYS H 4.860 . 5.160 4.488 4.309 4.580 . 0 0 "[ . 1 . 2]" 1
1113 1 35 LEU QD 1 36 LYS H 4.230 . 4.530 4.342 4.245 4.378 . 0 0 "[ . 1 . 2]" 1
1114 1 35 LEU QD 1 36 LYS QE 4.890 . 5.190 4.505 3.862 5.197 0.007 1 0 "[ . 1 . 2]" 1
1115 1 35 LEU HA 1 37 ASP H 4.580 . 4.880 3.752 3.620 3.929 . 0 0 "[ . 1 . 2]" 1
1116 1 35 LEU H 1 40 MET ME 4.810 . 5.110 4.446 4.297 4.635 . 0 0 "[ . 1 . 2]" 1
1117 1 35 LEU HA 1 40 MET HG2 4.530 . 4.830 3.817 3.435 4.221 . 0 0 "[ . 1 . 2]" 1
1118 1 35 LEU HA 1 40 MET ME 4.060 . 4.360 2.016 1.915 2.218 . 0 0 "[ . 1 . 2]" 1
1119 1 35 LEU HA 1 40 MET HB2 3.560 . 3.860 2.914 2.661 3.178 . 0 0 "[ . 1 . 2]" 1
1120 1 35 LEU HA 1 40 MET HG3 5.480 . 5.780 5.171 4.607 5.582 . 0 0 "[ . 1 . 2]" 1
1121 1 35 LEU HA 1 40 MET HB3 5.000 . 5.300 4.527 4.284 4.856 . 0 0 "[ . 1 . 2]" 1
1122 1 35 LEU HB2 1 40 MET ME 4.130 . 4.430 3.898 3.617 4.501 0.071 16 0 "[ . 1 . 2]" 1
1123 1 35 LEU HB3 1 40 MET ME 4.130 . 4.430 2.631 2.300 3.495 . 0 0 "[ . 1 . 2]" 1
1124 1 35 LEU HG 1 40 MET ME 4.790 . 5.090 4.300 4.039 4.500 . 0 0 "[ . 1 . 2]" 1
1125 1 35 LEU QB 1 40 MET ME 3.380 . 3.680 2.589 2.275 3.375 . 0 0 "[ . 1 . 2]" 1
1126 1 35 LEU QB 1 40 MET HB2 4.120 . 4.420 4.415 4.209 4.503 0.083 11 0 "[ . 1 . 2]" 1
1127 1 35 LEU HA 1 43 LEU QD 4.150 . 4.450 4.271 3.948 4.497 0.047 6 0 "[ . 1 . 2]" 1
1128 1 33 ALA HA 1 36 LYS H 4.500 . 4.800 3.671 3.315 3.806 . 0 0 "[ . 1 . 2]" 1
1129 1 36 LYS H 1 36 LYS HG2 3.470 . 3.770 2.282 1.986 2.457 . 0 0 "[ . 1 . 2]" 1
1130 1 36 LYS H 1 36 LYS QD 4.890 . 5.190 4.323 4.162 4.445 . 0 0 "[ . 1 . 2]" 1
1131 1 36 LYS H 1 36 LYS HG3 3.290 . 3.590 3.129 2.860 3.360 . 0 0 "[ . 1 . 2]" 1
1132 1 36 LYS H 1 36 LYS HB3 3.630 . 3.930 3.276 3.207 3.386 . 0 0 "[ . 1 . 2]" 1
1133 1 36 LYS H 1 36 LYS HB2 3.940 . 4.240 3.833 3.801 3.867 . 0 0 "[ . 1 . 2]" 1
1134 1 36 LYS HA 1 36 LYS HG2 3.830 . 4.130 3.696 3.505 3.792 . 0 0 "[ . 1 . 2]" 1
1135 1 36 LYS HA 1 36 LYS QD 4.560 . 4.860 4.547 4.507 4.574 . 0 0 "[ . 1 . 2]" 1
1136 1 36 LYS HA 1 36 LYS HG3 4.110 . 4.410 3.804 3.744 3.869 . 0 0 "[ . 1 . 2]" 1
1137 1 36 LYS HA 1 36 LYS QE 5.030 . 5.330 4.431 4.112 5.199 . 0 0 "[ . 1 . 2]" 1
1138 1 36 LYS HB2 1 36 LYS QD 2.930 . 3.230 2.496 2.387 2.618 . 0 0 "[ . 1 . 2]" 1
1139 1 36 LYS QE 1 36 LYS HG2 3.500 . 3.800 2.389 2.339 2.461 . 0 0 "[ . 1 . 2]" 1
1140 1 36 LYS H 1 37 ASP HA 4.790 . 5.090 4.278 4.195 4.431 . 0 0 "[ . 1 . 2]" 1
1141 1 36 LYS H 1 37 ASP QB 4.310 . 4.610 3.409 3.200 3.552 . 0 0 "[ . 1 . 2]" 1
1142 1 36 LYS HA 1 37 ASP HA 4.610 . 4.910 4.711 4.599 4.763 . 0 0 "[ . 1 . 2]" 1
1143 1 36 LYS HB2 1 37 ASP HA 4.910 . 5.210 4.990 4.852 5.099 . 0 0 "[ . 1 . 2]" 1
1144 1 36 LYS HG3 1 37 ASP HA 4.990 . 5.290 4.103 3.868 4.347 . 0 0 "[ . 1 . 2]" 1
1145 1 36 LYS QD 1 37 ASP HA 5.500 . 5.800 5.683 5.415 5.838 0.038 13 0 "[ . 1 . 2]" 1
1146 1 36 LYS HA 1 40 MET ME 4.330 . 4.630 4.272 3.978 4.739 0.109 19 0 "[ . 1 . 2]" 1
1147 1 36 LYS HA 1 40 MET HB2 3.820 . 4.120 3.547 3.045 3.872 . 0 0 "[ . 1 . 2]" 1
1148 1 36 LYS HA 1 40 MET HG2 4.060 . 4.360 2.523 2.231 2.820 . 0 0 "[ . 1 . 2]" 1
1149 1 36 LYS HA 1 40 MET HG3 4.650 . 4.950 3.794 3.452 4.544 . 0 0 "[ . 1 . 2]" 1
1150 1 36 LYS HG2 1 40 MET HG2 5.500 . 5.800 5.794 5.509 5.912 0.112 19 0 "[ . 1 . 2]" 1
1151 1 37 ASP H 1 38 ARG H 4.470 . 4.770 4.539 4.499 4.580 . 0 0 "[ . 1 . 2]" 1
1152 1 37 ASP H 1 38 ARG QD 5.500 . 5.800 5.703 5.541 5.851 0.051 16 0 "[ . 1 . 2]" 1
1153 1 37 ASP HA 1 38 ARG QB 5.280 . 5.580 4.302 4.108 4.540 . 0 0 "[ . 1 . 2]" 1
1154 1 37 ASP HA 1 38 ARG QD 4.890 . 5.190 4.188 3.862 4.619 . 0 0 "[ . 1 . 2]" 1
1155 1 37 ASP HA 1 38 ARG H 3.440 . 3.740 2.560 2.501 2.762 . 0 0 "[ . 1 . 2]" 1
1156 1 37 ASP QB 1 38 ARG QB 4.310 . 4.610 4.807 4.726 4.844 0.234 17 0 "[ . 1 . 2]" 1
1157 1 37 ASP QB 1 38 ARG HA 4.700 . 5.000 4.703 4.369 4.942 . 0 0 "[ . 1 . 2]" 1
1158 1 37 ASP QB 1 38 ARG H 3.670 . 3.970 3.119 2.832 3.258 . 0 0 "[ . 1 . 2]" 1
1159 1 37 ASP H 1 39 ARG QB 4.900 . 5.200 4.954 4.489 5.232 0.032 17 0 "[ . 1 . 2]" 1
1160 1 37 ASP HA 1 39 ARG H 4.750 . 5.050 4.244 4.112 4.386 . 0 0 "[ . 1 . 2]" 1
1161 1 37 ASP QB 1 39 ARG QG 5.180 . 5.480 4.717 4.253 5.172 . 0 0 "[ . 1 . 2]" 1
1162 1 37 ASP QB 1 39 ARG H 4.270 . 4.570 2.777 2.360 3.127 . 0 0 "[ . 1 . 2]" 1
1163 1 37 ASP H 1 40 MET HB3 3.870 . 4.170 2.848 2.413 3.269 . 0 0 "[ . 1 . 2]" 1
1164 1 37 ASP H 1 40 MET ME 5.160 . 5.460 4.136 3.970 4.299 . 0 0 "[ . 1 . 2]" 1
1165 1 37 ASP HA 1 40 MET H 4.660 . 4.800 4.516 4.384 4.643 . 0 0 "[ . 1 . 2]" 1
1166 1 37 ASP QB 1 40 MET H 4.490 . 4.790 2.804 2.196 3.191 . 0 0 "[ . 1 . 2]" 1
1167 1 37 ASP QB 1 40 MET HB2 5.250 . 5.550 3.513 3.239 4.080 . 0 0 "[ . 1 . 2]" 1
1168 1 37 ASP QB 1 40 MET HB3 4.240 . 4.540 3.624 2.900 4.288 . 0 0 "[ . 1 . 2]" 1
1169 1 37 ASP QB 1 41 GLU H 5.250 . 5.550 5.258 4.735 5.561 0.011 18 0 "[ . 1 . 2]" 1
1170 1 38 ARG H 1 38 ARG QD 4.740 . 5.040 2.076 1.754 2.343 0.046 12 0 "[ . 1 . 2]" 1
1171 1 38 ARG H 1 38 ARG QB 3.410 . 3.710 2.207 2.041 2.428 . 0 0 "[ . 1 . 2]" 1
1172 1 38 ARG H 1 38 ARG QG 3.690 . 3.990 3.416 3.175 3.569 . 0 0 "[ . 1 . 2]" 1
1173 1 38 ARG HA 1 38 ARG QG 3.560 . 3.860 3.449 3.353 3.524 . 0 0 "[ . 1 . 2]" 1
1174 1 38 ARG HA 1 38 ARG QD 4.340 . 4.640 3.761 3.664 3.863 . 0 0 "[ . 1 . 2]" 1
1175 1 38 ARG QD 1 39 ARG QB 3.480 . 3.780 3.084 2.745 3.638 . 0 0 "[ . 1 . 2]" 1
1176 1 38 ARG QD 1 39 ARG HA 4.640 . 4.940 4.001 3.482 4.585 . 0 0 "[ . 1 . 2]" 1
1177 1 38 ARG QD 1 39 ARG H 4.280 . 4.580 2.108 1.875 2.627 . 0 0 "[ . 1 . 2]" 1
1178 1 38 ARG QG 1 39 ARG H 3.230 . 3.530 2.949 2.517 3.217 . 0 0 "[ . 1 . 2]" 1
1179 1 38 ARG QG 1 39 ARG QB 3.420 . 3.720 3.602 3.294 3.787 0.067 8 0 "[ . 1 . 2]" 1
1180 1 38 ARG QG 1 39 ARG HA 3.840 . 4.140 3.313 3.057 3.548 . 0 0 "[ . 1 . 2]" 1
1181 1 38 ARG H 1 40 MET H 4.790 . 5.090 3.915 3.802 4.061 . 0 0 "[ . 1 . 2]" 1
1182 1 38 ARG HA 1 41 GLU HG3 5.000 . 5.300 5.086 3.331 5.405 0.105 1 0 "[ . 1 . 2]" 1
1183 1 38 ARG HA 1 41 GLU HG2 5.000 . 5.300 3.694 3.264 4.501 . 0 0 "[ . 1 . 2]" 1
1184 1 38 ARG HA 1 41 GLU H 4.230 . 4.530 3.453 3.180 3.688 . 0 0 "[ . 1 . 2]" 1
1185 1 38 ARG QD 1 41 GLU H 5.500 . 5.800 5.819 5.667 5.917 0.117 12 0 "[ . 1 . 2]" 1
1186 1 38 ARG QG 1 41 GLU QG 5.340 . 5.640 4.483 3.967 4.765 . 0 0 "[ . 1 . 2]" 1
1187 1 39 ARG H 1 39 ARG QB 3.110 . 3.410 2.206 2.082 2.300 . 0 0 "[ . 1 . 2]" 1
1188 1 39 ARG HA 1 39 ARG QG 3.050 . 3.350 2.504 2.387 2.642 . 0 0 "[ . 1 . 2]" 1
1189 1 39 ARG HA 1 39 ARG QD 4.520 . 4.820 4.167 3.945 4.316 . 0 0 "[ . 1 . 2]" 1
1190 1 39 ARG H 1 40 MET HB3 4.750 . 5.050 4.472 4.298 4.714 . 0 0 "[ . 1 . 2]" 1
1191 1 39 ARG H 1 40 MET H 3.590 . 3.890 2.448 2.352 2.577 . 0 0 "[ . 1 . 2]" 1
1192 1 39 ARG H 1 40 MET HA 5.500 . 5.800 4.998 4.880 5.137 . 0 0 "[ . 1 . 2]" 1
1193 1 39 ARG QB 1 40 MET HB3 4.710 . 5.010 4.899 4.579 5.016 0.006 10 0 "[ . 1 . 2]" 1
1194 1 39 ARG QB 1 40 MET H 3.580 . 3.880 2.967 2.704 3.121 . 0 0 "[ . 1 . 2]" 1
1195 1 39 ARG QG 1 40 MET HA 4.250 . 4.550 3.929 3.568 4.340 . 0 0 "[ . 1 . 2]" 1
1196 1 39 ARG QG 1 40 MET H 4.480 . 4.780 3.983 3.704 4.237 . 0 0 "[ . 1 . 2]" 1
1197 1 39 ARG H 1 41 GLU H 4.200 . 4.500 4.446 4.264 4.537 0.037 1 0 "[ . 1 . 2]" 1
1198 1 39 ARG HA 1 41 GLU H 4.680 . 4.980 4.207 3.944 4.404 . 0 0 "[ . 1 . 2]" 1
1199 1 39 ARG HA 1 41 GLU QG 4.240 . 4.540 4.048 3.697 4.520 . 0 0 "[ . 1 . 2]" 1
1200 1 39 ARG H 1 42 ASN H 5.500 . 5.800 5.335 5.205 5.516 . 0 0 "[ . 1 . 2]" 1
1201 1 39 ARG HA 1 42 ASN QB 3.710 . 4.010 2.841 2.554 3.182 . 0 0 "[ . 1 . 2]" 1
1202 1 39 ARG HA 1 42 ASN H 3.950 . 4.250 3.549 3.349 3.742 . 0 0 "[ . 1 . 2]" 1
1203 1 39 ARG HA 1 42 ASN HB3 4.540 . 4.840 2.932 2.648 3.283 . 0 0 "[ . 1 . 2]" 1
1204 1 39 ARG HA 1 42 ASN HB2 4.540 . 4.840 3.829 3.354 4.276 . 0 0 "[ . 1 . 2]" 1
1205 1 39 ARG QB 1 42 ASN QB 4.920 . 5.220 4.348 4.074 4.624 . 0 0 "[ . 1 . 2]" 1
1206 1 39 ARG QB 1 42 ASN H 5.500 . 5.800 5.113 4.970 5.263 . 0 0 "[ . 1 . 2]" 1
1207 1 39 ARG QD 1 42 ASN HD22 5.500 . 5.800 5.338 4.675 5.864 0.064 11 0 "[ . 1 . 2]" 1
1208 1 39 ARG QG 1 42 ASN HD22 5.500 . 5.800 4.180 3.738 4.690 . 0 0 "[ . 1 . 2]" 1
1209 1 39 ARG QG 1 42 ASN QB 5.010 . 5.310 3.203 2.900 3.592 . 0 0 "[ . 1 . 2]" 1
1210 1 39 ARG QG 1 42 ASN H 4.560 . 4.860 4.531 4.350 4.690 . 0 0 "[ . 1 . 2]" 1
1211 1 39 ARG QD 1 43 LEU QD 4.240 . 4.540 2.572 2.046 3.138 . 0 0 "[ . 1 . 2]" 1
1212 1 39 ARG QD 1 43 LEU H 5.500 . 5.800 5.608 5.213 5.857 0.057 11 0 "[ . 1 . 2]" 1
1213 1 40 MET H 1 40 MET HB3 3.510 . 3.810 2.292 2.169 2.449 . 0 0 "[ . 1 . 2]" 1
1214 1 40 MET H 1 40 MET HG2 4.510 . 4.810 4.606 4.509 4.645 . 0 0 "[ . 1 . 2]" 1
1215 1 40 MET H 1 40 MET HG3 3.990 . 4.290 4.274 4.102 4.400 0.110 19 0 "[ . 1 . 2]" 1
1216 1 40 MET H 1 40 MET HB2 3.360 . 3.660 2.857 2.626 2.970 . 0 0 "[ . 1 . 2]" 1
1217 1 40 MET HA 1 40 MET HG3 3.950 . 4.250 3.523 2.966 3.646 . 0 0 "[ . 1 . 2]" 1
1218 1 40 MET HA 1 40 MET HG2 4.240 . 4.540 3.889 3.824 3.979 . 0 0 "[ . 1 . 2]" 1
1219 1 40 MET HA 1 40 MET ME 3.610 . 3.910 2.086 1.831 2.198 . 0 0 "[ . 1 . 2]" 1
1220 1 40 MET HB2 1 40 MET ME 3.240 . 3.540 2.122 1.979 2.324 . 0 0 "[ . 1 . 2]" 1
1221 1 40 MET HB3 1 40 MET ME 3.470 . 3.770 3.446 3.367 3.537 . 0 0 "[ . 1 . 2]" 1
1222 1 40 MET ME 1 40 MET HG2 3.490 . 3.790 2.734 2.539 3.366 . 0 0 "[ . 1 . 2]" 1
1223 1 40 MET ME 1 40 MET HG3 3.480 . 3.780 3.349 2.902 3.416 . 0 0 "[ . 1 . 2]" 1
1224 1 40 MET H 1 41 GLU H 3.300 . 3.600 2.749 2.633 2.814 . 0 0 "[ . 1 . 2]" 1
1225 1 40 MET H 1 41 GLU QG 4.670 . 4.970 4.346 4.033 4.756 . 0 0 "[ . 1 . 2]" 1
1226 1 40 MET H 1 41 GLU HA 5.500 . 5.800 5.270 5.174 5.357 . 0 0 "[ . 1 . 2]" 1
1227 1 40 MET HG3 1 41 GLU QB 4.320 . 4.620 4.184 3.823 4.566 . 0 0 "[ . 1 . 2]" 1
1228 1 40 MET HG3 1 41 GLU H 4.700 . 5.000 3.441 3.208 3.733 . 0 0 "[ . 1 . 2]" 1
1229 1 40 MET ME 1 41 GLU HA 5.500 . 5.800 5.218 4.502 5.458 . 0 0 "[ . 1 . 2]" 1
1230 1 40 MET HA 1 42 ASN H 4.200 . 4.500 4.055 3.886 4.261 . 0 0 "[ . 1 . 2]" 1
1231 1 40 MET HG3 1 42 ASN H 5.290 . 5.590 5.267 5.104 5.450 . 0 0 "[ . 1 . 2]" 1
1232 1 40 MET ME 1 42 ASN H 5.500 . 5.800 5.525 5.071 5.779 . 0 0 "[ . 1 . 2]" 1
1233 1 40 MET H 1 43 LEU QD 4.390 . 4.690 4.071 3.901 4.201 . 0 0 "[ . 1 . 2]" 1
1234 1 40 MET HA 1 43 LEU QD 3.460 . 3.760 2.454 2.217 2.592 . 0 0 "[ . 1 . 2]" 1
1235 1 40 MET HA 1 43 LEU HB2 4.790 . 5.090 2.523 2.370 2.695 . 0 0 "[ . 1 . 2]" 1
1236 1 40 MET HA 1 43 LEU HG . . 3.780 3.390 3.051 3.659 . 0 0 "[ . 1 . 2]" 1
1237 1 40 MET HA 1 43 LEU MD1 4.310 . 4.610 2.464 2.222 2.604 . 0 0 "[ . 1 . 2]" 1
1238 1 40 MET HA 1 43 LEU HA 5.480 . 5.780 5.184 5.030 5.318 . 0 0 "[ . 1 . 2]" 1
1239 1 40 MET HA 1 43 LEU H 3.890 . 4.190 3.143 3.061 3.286 . 0 0 "[ . 1 . 2]" 1
1240 1 40 MET HA 1 43 LEU MD2 4.310 . 4.610 4.645 4.426 4.755 0.145 16 0 "[ . 1 . 2]" 1
1241 1 40 MET HA 1 43 LEU HB3 4.620 . 4.920 4.192 4.014 4.346 . 0 0 "[ . 1 . 2]" 1
1242 1 40 MET HB2 1 43 LEU HB2 4.850 . 5.150 4.565 4.370 4.755 . 0 0 "[ . 1 . 2]" 1
1243 1 40 MET HG2 1 43 LEU QD 5.440 . 5.740 5.374 5.161 5.747 0.007 16 0 "[ . 1 . 2]" 1
1244 1 40 MET ME 1 43 LEU MD2 5.000 . 5.300 4.542 4.080 4.782 . 0 0 "[ . 1 . 2]" 1
1245 1 40 MET ME 1 43 LEU MD1 5.000 . 5.300 2.608 2.236 2.753 . 0 0 "[ . 1 . 2]" 1
1246 1 40 MET ME 1 43 LEU HG 4.000 . 4.300 4.302 3.844 4.409 0.109 13 0 "[ . 1 . 2]" 1
1247 1 40 MET ME 1 43 LEU QD 3.150 . 3.450 2.592 2.226 2.735 . 0 0 "[ . 1 . 2]" 1
1248 1 40 MET ME 1 43 LEU HB2 3.800 . 4.100 2.678 2.077 2.865 . 0 0 "[ . 1 . 2]" 1
1249 1 40 MET HA 1 44 VAL QG 5.310 . 5.610 4.202 3.381 4.441 . 0 0 "[ . 1 . 2]" 1
1250 1 40 MET HA 1 44 VAL H 4.330 . 4.630 3.583 3.454 3.676 . 0 0 "[ . 1 . 2]" 1
1251 1 40 MET HG2 1 44 VAL MG2 5.500 . 5.800 5.069 3.911 5.372 . 0 0 "[ . 1 . 2]" 1
1252 1 40 MET HG2 1 44 VAL QG 4.340 . 4.640 4.061 3.055 4.447 . 0 0 "[ . 1 . 2]" 1
1253 1 40 MET HG2 1 44 VAL MG1 5.000 . 5.300 4.281 3.189 4.791 . 0 0 "[ . 1 . 2]" 1
1254 1 40 MET HG3 1 44 VAL QG 4.130 . 4.430 3.047 2.005 3.482 . 0 0 "[ . 1 . 2]" 1
1255 1 40 MET HG3 1 44 VAL MG2 5.100 . 5.400 4.498 2.656 4.960 . 0 0 "[ . 1 . 2]" 1
1256 1 40 MET HG3 1 44 VAL HB 3.930 . 4.230 3.788 3.344 4.419 0.189 19 0 "[ . 1 . 2]" 1
1257 1 40 MET HG3 1 44 VAL MG1 5.000 . 5.300 3.102 2.074 3.587 . 0 0 "[ . 1 . 2]" 1
1258 1 40 MET ME 1 44 VAL QG 3.310 . 3.610 3.549 2.697 3.717 0.107 11 0 "[ . 1 . 2]" 1
1259 1 40 MET ME 1 44 VAL H 3.740 . 4.040 3.714 2.822 3.870 . 0 0 "[ . 1 . 2]" 1
1260 1 40 MET ME 1 45 ALA H 5.500 . 5.800 5.802 5.067 5.930 0.130 18 0 "[ . 1 . 2]" 1
1261 1 41 GLU H 1 41 GLU QB 3.090 . 3.390 2.512 2.451 2.663 . 0 0 "[ . 1 . 2]" 1
1262 1 41 GLU H 1 41 GLU QG 3.470 . 3.770 2.344 2.125 2.596 . 0 0 "[ . 1 . 2]" 1
1263 1 41 GLU H 1 42 ASN QB 4.920 . 5.220 4.232 4.041 4.347 . 0 0 "[ . 1 . 2]" 1
1264 1 41 GLU HG2 1 42 ASN HA 5.500 . 5.800 4.548 4.298 5.570 . 0 0 "[ . 1 . 2]" 1
1265 1 41 GLU HG3 1 42 ASN HA 5.500 . 5.800 3.588 3.204 4.795 . 0 0 "[ . 1 . 2]" 1
1266 1 41 GLU QB 1 42 ASN HA 4.830 . 5.130 4.543 4.428 4.689 . 0 0 "[ . 1 . 2]" 1
1267 1 41 GLU QB 1 42 ASN H 3.520 . 3.820 3.516 3.409 3.608 . 0 0 "[ . 1 . 2]" 1
1268 1 41 GLU QG 1 42 ASN HA 4.650 . 4.950 3.446 3.143 4.530 . 0 0 "[ . 1 . 2]" 1
1269 1 41 GLU QG 1 42 ASN H 3.900 . 4.200 2.340 2.091 2.816 . 0 0 "[ . 1 . 2]" 1
1270 1 41 GLU HA 1 43 LEU H 4.840 . 5.140 4.481 4.291 4.662 . 0 0 "[ . 1 . 2]" 1
1271 1 41 GLU HA 1 44 VAL QG 3.390 . 3.690 1.950 1.821 2.115 . 0 0 "[ . 1 . 2]" 1
1272 1 41 GLU HA 1 44 VAL H 4.380 . 4.680 3.614 3.427 3.861 . 0 0 "[ . 1 . 2]" 1
1273 1 41 GLU HA 1 44 VAL MG2 4.430 . 4.730 4.539 1.825 4.780 0.050 9 0 "[ . 1 . 2]" 1
1274 1 41 GLU HA 1 44 VAL MG1 4.000 . 4.300 2.048 1.843 3.729 . 0 0 "[ . 1 . 2]" 1
1275 1 41 GLU HG2 1 45 ALA MB 5.000 . 5.300 5.426 5.375 5.479 0.179 12 0 "[ . 1 . 2]" 1
1276 1 41 GLU HG3 1 45 ALA MB 5.000 . 5.300 4.413 4.110 5.398 0.098 7 0 "[ . 1 . 2]" 1
1277 1 41 GLU QG 1 45 ALA MB 4.470 . 4.770 4.211 3.993 4.820 0.050 7 0 "[ . 1 . 2]" 1
1278 1 42 ASN H 1 42 ASN QB 2.950 . 3.250 2.161 2.101 2.223 . 0 0 "[ . 1 . 2]" 1
1279 1 42 ASN H 1 42 ASN HD22 5.500 . 5.800 5.516 5.433 5.623 . 0 0 "[ . 1 . 2]" 1
1280 1 42 ASN H 1 42 ASN HB3 3.440 . 3.740 2.266 2.178 2.364 . 0 0 "[ . 1 . 2]" 1
1281 1 42 ASN H 1 42 ASN HB2 3.440 . 3.740 2.735 2.595 2.856 . 0 0 "[ . 1 . 2]" 1
1282 1 42 ASN H 1 42 ASN HD21 4.870 . 5.170 4.188 4.059 4.357 . 0 0 "[ . 1 . 2]" 1
1283 1 42 ASN HA 1 42 ASN HD21 4.580 . 4.880 4.153 4.012 4.219 . 0 0 "[ . 1 . 2]" 1
1284 1 42 ASN HA 1 42 ASN HD22 4.670 . 4.970 4.665 4.499 4.756 . 0 0 "[ . 1 . 2]" 1
1285 1 42 ASN QB 1 42 ASN HD22 3.520 . 3.820 3.266 3.250 3.292 . 0 0 "[ . 1 . 2]" 1
1286 1 42 ASN H 1 43 LEU H 3.190 . 3.490 2.557 2.499 2.619 . 0 0 "[ . 1 . 2]" 1
1287 1 42 ASN H 1 43 LEU QD 4.300 . 4.600 4.605 4.513 4.656 0.056 9 0 "[ . 1 . 2]" 1
1288 1 42 ASN HA 1 43 LEU HA 4.970 . 5.270 4.802 4.763 4.838 . 0 0 "[ . 1 . 2]" 1
1289 1 42 ASN HA 1 43 LEU QD 4.810 . 5.110 5.087 5.012 5.148 0.038 13 0 "[ . 1 . 2]" 1
1290 1 42 ASN HB2 1 43 LEU H 4.110 . 4.410 3.903 3.685 4.013 . 0 0 "[ . 1 . 2]" 1
1291 1 42 ASN HB3 1 43 LEU H 4.110 . 4.410 2.550 2.270 2.702 . 0 0 "[ . 1 . 2]" 1
1292 1 42 ASN HD21 1 43 LEU HG 4.770 . 5.070 2.455 2.189 2.734 . 0 0 "[ . 1 . 2]" 1
1293 1 42 ASN HD21 1 43 LEU HA 4.780 . 5.080 3.395 2.991 3.619 . 0 0 "[ . 1 . 2]" 1
1294 1 42 ASN HD21 1 43 LEU HB3 4.790 . 5.090 4.753 4.529 4.920 . 0 0 "[ . 1 . 2]" 1
1295 1 42 ASN HD21 1 43 LEU HB2 5.120 . 5.420 4.549 4.376 4.732 . 0 0 "[ . 1 . 2]" 1
1296 1 42 ASN HD22 1 43 LEU HB3 5.500 . 5.800 5.803 5.567 5.847 0.047 6 0 "[ . 1 . 2]" 1
1297 1 42 ASN QB 1 43 LEU HB2 5.340 . 5.640 4.703 4.481 4.932 . 0 0 "[ . 1 . 2]" 1
1298 1 42 ASN QB 1 43 LEU H 3.460 . 3.760 2.518 2.250 2.662 . 0 0 "[ . 1 . 2]" 1
1299 1 42 ASN QB 1 43 LEU HG 5.340 . 5.640 3.221 2.882 3.372 . 0 0 "[ . 1 . 2]" 1
1300 1 42 ASN QB 1 43 LEU QD 3.830 . 4.130 3.699 3.455 3.843 . 0 0 "[ . 1 . 2]" 1
1301 1 42 ASN QB 1 43 LEU HB3 5.340 . 5.640 5.518 5.221 5.645 0.005 10 0 "[ . 1 . 2]" 1
1302 1 42 ASN H 1 44 VAL H 4.460 . 4.760 4.050 3.917 4.234 . 0 0 "[ . 1 . 2]" 1
1303 1 42 ASN HA 1 44 VAL H 4.980 . 5.280 4.663 4.554 4.749 . 0 0 "[ . 1 . 2]" 1
1304 1 42 ASN HD21 1 44 VAL H 5.270 . 5.570 5.392 5.231 5.506 . 0 0 "[ . 1 . 2]" 1
1305 1 42 ASN H 1 45 ALA MB 5.150 . 5.450 4.418 4.328 4.515 . 0 0 "[ . 1 . 2]" 1
1306 1 42 ASN H 1 45 ALA H 4.870 . 5.170 4.448 4.359 4.555 . 0 0 "[ . 1 . 2]" 1
1307 1 42 ASN HA 1 45 ALA H 3.930 . 4.230 3.642 3.453 3.825 . 0 0 "[ . 1 . 2]" 1
1308 1 42 ASN HA 1 45 ALA MB 3.130 . 3.430 2.614 2.438 2.832 . 0 0 "[ . 1 . 2]" 1
1309 1 42 ASN HB2 1 45 ALA MB 5.000 . 5.300 4.630 4.414 4.869 . 0 0 "[ . 1 . 2]" 1
1310 1 42 ASN HB3 1 45 ALA MB 5.000 . 5.300 5.036 4.879 5.229 . 0 0 "[ . 1 . 2]" 1
1311 1 42 ASN QB 1 45 ALA MB 4.470 . 4.770 4.279 4.106 4.463 . 0 0 "[ . 1 . 2]" 1
1312 1 42 ASN HA 1 46 TYR H 5.300 . 5.600 4.093 3.896 4.316 . 0 0 "[ . 1 . 2]" 1
1313 1 42 ASN HD21 1 46 TYR H 5.480 . 5.780 5.662 5.364 5.802 0.022 11 0 "[ . 1 . 2]" 1
1314 1 43 LEU H 1 43 LEU HG 4.090 . 4.390 2.220 2.098 2.344 . 0 0 "[ . 1 . 2]" 1
1315 1 43 LEU H 1 43 LEU HB2 3.010 . 3.310 2.485 2.378 2.571 . 0 0 "[ . 1 . 2]" 1
1316 1 43 LEU H 1 43 LEU QD 3.460 . 3.760 3.049 2.995 3.099 . 0 0 "[ . 1 . 2]" 1
1317 1 43 LEU H 1 43 LEU HB3 3.610 . 3.910 3.568 3.537 3.594 . 0 0 "[ . 1 . 2]" 1
1318 1 43 LEU HA 1 43 LEU HB3 2.750 . 3.050 2.404 2.361 2.443 . 0 0 "[ . 1 . 2]" 1
1319 1 43 LEU HA 1 43 LEU QD 3.030 . 3.330 2.046 1.965 2.137 . 0 0 "[ . 1 . 2]" 1
1320 1 43 LEU HB2 1 43 LEU QD 2.750 . 3.050 2.236 2.210 2.266 . 0 0 "[ . 1 . 2]" 1
1321 1 43 LEU HB3 1 43 LEU QD 2.920 . 3.220 2.087 2.059 2.119 . 0 0 "[ . 1 . 2]" 1
1322 1 43 LEU H 1 44 VAL HA 5.500 . 5.800 5.194 5.115 5.248 . 0 0 "[ . 1 . 2]" 1
1323 1 43 LEU H 1 44 VAL QG 4.050 . 4.350 4.040 3.636 4.133 . 0 0 "[ . 1 . 2]" 1
1324 1 43 LEU H 1 44 VAL H 3.270 . 3.570 2.635 2.537 2.716 . 0 0 "[ . 1 . 2]" 1
1325 1 43 LEU HA 1 44 VAL HA 5.500 . 5.800 4.559 4.522 4.603 . 0 0 "[ . 1 . 2]" 1
1326 1 43 LEU HB2 1 44 VAL H 3.480 . 3.780 2.545 2.432 2.603 . 0 0 "[ . 1 . 2]" 1
1327 1 43 LEU HB2 1 44 VAL QG 4.700 . 5.000 4.093 3.167 4.239 . 0 0 "[ . 1 . 2]" 1
1328 1 43 LEU HB2 1 44 VAL HA 4.660 . 4.960 4.241 4.119 4.333 . 0 0 "[ . 1 . 2]" 1
1329 1 43 LEU HB3 1 44 VAL HA 4.990 . 5.290 4.308 4.197 4.421 . 0 0 "[ . 1 . 2]" 1
1330 1 43 LEU HB3 1 44 VAL H 4.220 . 4.520 3.597 3.488 3.661 . 0 0 "[ . 1 . 2]" 1
1331 1 43 LEU H 1 45 ALA MB 4.730 . 5.030 4.568 4.467 4.665 . 0 0 "[ . 1 . 2]" 1
1332 1 43 LEU HA 1 45 ALA H 4.630 . 4.930 4.348 4.158 4.469 . 0 0 "[ . 1 . 2]" 1
1333 1 43 LEU HB3 1 45 ALA H 5.500 . 5.800 5.490 5.369 5.578 . 0 0 "[ . 1 . 2]" 1
1334 1 43 LEU HA 1 46 TYR QD 4.590 . 4.890 3.713 3.340 4.029 . 0 0 "[ . 1 . 2]" 1
1335 1 43 LEU HA 1 46 TYR H 4.060 . 4.360 3.552 3.443 3.713 . 0 0 "[ . 1 . 2]" 1
1336 1 43 LEU HA 1 46 TYR HB3 3.460 . 3.760 2.583 2.377 2.839 . 0 0 "[ . 1 . 2]" 1
1337 1 43 LEU HG 2 45 ILE MG 5.000 . 5.300 5.408 5.321 5.450 0.150 6 0 "[ . 1 . 2]" 1
1338 1 43 LEU MD2 2 49 LEU HB3 4.500 . 4.800 4.848 4.779 4.910 0.110 15 0 "[ . 1 . 2]" 1
1339 1 44 VAL H 1 44 VAL MG1 3.530 . 3.830 2.314 2.197 2.441 . 0 0 "[ . 1 . 2]" 1
1340 1 44 VAL H 1 44 VAL QG 2.980 . 3.280 2.274 1.947 2.409 . 0 0 "[ . 1 . 2]" 1
1341 1 44 VAL H 1 44 VAL HB 3.680 . 3.980 2.520 2.358 3.683 . 0 0 "[ . 1 . 2]" 1
1342 1 44 VAL H 1 44 VAL MG2 3.530 . 3.830 3.678 2.072 3.793 . 0 0 "[ . 1 . 2]" 1
1343 1 44 VAL HA 1 44 VAL QG 2.850 . 3.150 2.248 2.205 2.287 . 0 0 "[ . 1 . 2]" 1
1344 1 44 VAL HA 1 44 VAL MG2 3.360 . 3.660 2.338 2.245 3.215 . 0 0 "[ . 1 . 2]" 1
1345 1 44 VAL HA 1 44 VAL MG1 3.360 . 3.660 3.186 2.340 3.241 . 0 0 "[ . 1 . 2]" 1
1346 1 44 VAL H 1 45 ALA MB 4.540 . 4.840 4.225 4.149 4.284 . 0 0 "[ . 1 . 2]" 1
1347 1 44 VAL H 1 45 ALA H 3.310 . 3.610 2.515 2.462 2.591 . 0 0 "[ . 1 . 2]" 1
1348 1 44 VAL HB 1 45 ALA HA 5.410 . 5.710 5.673 4.711 5.749 0.039 18 0 "[ . 1 . 2]" 1
1349 1 44 VAL HB 1 45 ALA H 3.740 . 4.040 3.951 3.852 4.020 . 0 0 "[ . 1 . 2]" 1
1350 1 44 VAL QG 1 45 ALA MB 3.490 . 3.790 3.296 3.227 3.397 . 0 0 "[ . 1 . 2]" 1
1351 1 44 VAL QG 1 45 ALA H 3.670 . 3.970 2.389 2.329 2.468 . 0 0 "[ . 1 . 2]" 1
1352 1 44 VAL QG 1 45 ALA HA 3.770 . 4.070 3.228 3.165 3.421 . 0 0 "[ . 1 . 2]" 1
1353 1 44 VAL H 1 46 TYR H 4.620 . 4.920 4.170 3.995 4.308 . 0 0 "[ . 1 . 2]" 1
1354 1 44 VAL HA 1 46 TYR H 4.810 . 5.110 4.337 4.186 4.453 . 0 0 "[ . 1 . 2]" 1
1355 1 44 VAL H 1 47 ALA MB 4.960 . 5.260 4.494 4.424 4.584 . 0 0 "[ . 1 . 2]" 1
1356 1 44 VAL HA 1 47 ALA MB 3.300 . 3.600 2.189 2.090 2.304 . 0 0 "[ . 1 . 2]" 1
1357 1 44 VAL HA 1 47 ALA HA 5.500 . 5.800 4.833 4.721 4.947 . 0 0 "[ . 1 . 2]" 1
1358 1 44 VAL HA 1 47 ALA H 3.930 . 4.230 2.953 2.874 3.022 . 0 0 "[ . 1 . 2]" 1
1359 1 44 VAL QG 1 47 ALA MB 3.680 . 3.980 2.880 2.680 3.406 . 0 0 "[ . 1 . 2]" 1
1360 1 44 VAL HA 1 48 LYS HE2 5.360 . 5.660 5.005 4.388 5.708 0.048 8 0 "[ . 1 . 2]" 1
1361 1 44 VAL HA 1 48 LYS H 4.480 . 4.780 3.703 3.620 3.809 . 0 0 "[ . 1 . 2]" 1
1362 1 44 VAL HA 1 48 LYS HD2 5.130 . 5.430 5.128 4.836 5.385 . 0 0 "[ . 1 . 2]" 1
1363 1 44 VAL HB 1 48 LYS HE2 5.390 . 5.690 4.759 2.293 5.705 0.015 16 0 "[ . 1 . 2]" 1
1364 1 44 VAL MG1 1 48 LYS HG2 5.000 . 5.300 4.953 4.628 5.371 0.071 19 0 "[ . 1 . 2]" 1
1365 1 44 VAL MG1 1 48 LYS HG3 4.750 . 5.050 3.825 3.508 4.412 . 0 0 "[ . 1 . 2]" 1
1366 1 44 VAL MG1 1 48 LYS HE3 4.660 . 4.960 3.231 2.155 4.934 . 0 0 "[ . 1 . 2]" 1
1367 1 44 VAL MG2 1 48 LYS HE3 4.660 . 4.960 3.162 1.938 3.636 . 0 0 "[ . 1 . 2]" 1
1368 1 44 VAL MG2 1 48 LYS HG3 4.750 . 5.050 2.488 2.271 3.907 . 0 0 "[ . 1 . 2]" 1
1369 1 44 VAL QG 1 48 LYS HE3 3.250 . 3.550 2.809 1.806 3.314 . 0 0 "[ . 1 . 2]" 1
1370 1 44 VAL QG 1 48 LYS HD2 3.560 . 3.860 2.865 2.586 3.299 . 0 0 "[ . 1 . 2]" 1
1371 1 44 VAL QG 1 48 LYS HE2 4.460 . 4.760 2.209 1.903 2.810 . 0 0 "[ . 1 . 2]" 1
1372 1 44 VAL QG 1 48 LYS HG3 4.180 . 4.480 2.450 2.252 3.659 . 0 0 "[ . 1 . 2]" 1
1373 1 45 ALA H 1 45 ALA MB 2.760 . 3.060 2.253 2.206 2.305 . 0 0 "[ . 1 . 2]" 1
1374 1 45 ALA H 1 46 TYR QB 4.770 . 5.070 4.262 4.122 4.350 . 0 0 "[ . 1 . 2]" 1
1375 1 45 ALA HA 1 46 TYR HA 4.910 . 5.210 4.880 4.848 4.924 . 0 0 "[ . 1 . 2]" 1
1376 1 45 ALA MB 1 46 TYR HB3 4.430 . 4.730 4.208 4.068 4.387 . 0 0 "[ . 1 . 2]" 1
1377 1 45 ALA MB 1 46 TYR HA 4.010 . 4.310 3.917 3.838 3.976 . 0 0 "[ . 1 . 2]" 1
1378 1 45 ALA MB 1 46 TYR H 2.990 . 3.290 2.340 2.236 2.473 . 0 0 "[ . 1 . 2]" 1
1379 1 45 ALA HA 1 47 ALA H 4.870 . 5.170 4.473 4.317 4.585 . 0 0 "[ . 1 . 2]" 1
1380 1 45 ALA H 1 48 LYS HD2 4.150 . 4.450 4.434 4.298 4.497 0.047 9 0 "[ . 1 . 2]" 1
1381 1 45 ALA H 1 48 LYS H 4.760 . 5.060 4.617 4.517 4.680 . 0 0 "[ . 1 . 2]" 1
1382 1 45 ALA H 1 48 LYS HG3 5.350 . 5.650 5.005 4.736 5.243 . 0 0 "[ . 1 . 2]" 1
1383 1 45 ALA HA 1 48 LYS QB 3.580 . 3.880 2.702 2.554 2.801 . 0 0 "[ . 1 . 2]" 1
1384 1 45 ALA HA 1 48 LYS HG2 5.000 . 5.300 4.946 4.721 5.172 . 0 0 "[ . 1 . 2]" 1
1385 1 45 ALA HA 1 48 LYS HD3 3.670 . 3.970 3.993 3.914 4.039 0.069 1 0 "[ . 1 . 2]" 1
1386 1 45 ALA HA 1 48 LYS HG3 4.350 . 4.650 3.754 3.450 4.049 . 0 0 "[ . 1 . 2]" 1
1387 1 45 ALA HA 1 48 LYS HD2 3.660 . 3.960 2.518 2.269 2.772 . 0 0 "[ . 1 . 2]" 1
1388 1 45 ALA HA 1 48 LYS HE3 4.800 . 5.100 4.569 3.748 4.981 . 0 0 "[ . 1 . 2]" 1
1389 1 45 ALA MB 1 48 LYS HD2 3.920 . 4.220 4.008 3.790 4.234 0.014 1 0 "[ . 1 . 2]" 1
1390 1 45 ALA HA 1 49 LYS HB3 5.500 . 5.800 4.959 4.680 5.807 0.007 6 0 "[ . 1 . 2]" 1
1391 1 45 ALA MB 1 49 LYS HG2 4.510 . 4.810 4.583 3.946 4.838 0.028 17 0 "[ . 1 . 2]" 1
1392 1 45 ALA MB 1 49 LYS HD3 4.740 . 5.040 4.199 3.517 4.970 . 0 0 "[ . 1 . 2]" 1
1393 1 46 TYR H 1 46 TYR QB 2.880 . 3.180 2.152 2.087 2.228 . 0 0 "[ . 1 . 2]" 1
1394 1 46 TYR H 1 46 TYR QD 4.200 . 4.500 4.053 3.921 4.136 . 0 0 "[ . 1 . 2]" 1
1395 1 46 TYR HA 1 46 TYR HE1 5.500 . 5.800 6.000 5.325 6.119 0.319 18 0 "[ . 1 . 2]" 1
1396 1 46 TYR HA 1 46 TYR QD 4.270 . 4.570 3.210 3.121 3.370 . 0 0 "[ . 1 . 2]" 1
1397 1 46 TYR H 1 47 ALA H 3.250 . 3.550 2.756 2.713 2.796 . 0 0 "[ . 1 . 2]" 1
1398 1 46 TYR HB3 1 47 ALA MB 4.820 . 5.120 4.087 4.011 4.206 . 0 0 "[ . 1 . 2]" 1
1399 1 46 TYR QD 1 47 ALA H 3.780 . 4.080 2.653 2.370 2.789 . 0 0 "[ . 1 . 2]" 1
1400 1 46 TYR QD 1 47 ALA MB 4.760 . 5.060 2.803 2.634 2.896 . 0 0 "[ . 1 . 2]" 1
1401 1 46 TYR QD 1 47 ALA HA 4.250 . 4.550 3.001 2.842 3.207 . 0 0 "[ . 1 . 2]" 1
1402 1 46 TYR QB 1 47 ALA H 3.280 . 3.580 2.632 2.540 2.732 . 0 0 "[ . 1 . 2]" 1
1403 1 46 TYR H 1 48 LYS H 4.430 . 4.730 4.231 4.133 4.330 . 0 0 "[ . 1 . 2]" 1
1404 1 46 TYR HA 1 48 LYS H 4.850 . 5.150 4.528 4.463 4.619 . 0 0 "[ . 1 . 2]" 1
1405 1 46 TYR QB 1 48 LYS H 5.030 . 5.330 4.853 4.773 4.992 . 0 0 "[ . 1 . 2]" 1
1406 1 46 TYR HA 1 49 LYS HB2 4.000 . 4.300 4.518 4.411 4.564 0.264 7 0 "[ . 1 . 2]" 1
1407 1 46 TYR HA 1 49 LYS H 4.040 . 4.340 3.534 3.432 3.607 . 0 0 "[ . 1 . 2]" 1
1408 1 46 TYR HA 1 49 LYS HB3 4.000 . 4.300 3.791 3.499 4.348 0.048 6 0 "[ . 1 . 2]" 1
1409 1 46 TYR HA 1 49 LYS HG2 3.760 . 4.060 1.927 1.828 2.124 . 0 0 "[ . 1 . 2]" 1
1410 1 46 TYR HA 1 49 LYS HG3 3.930 . 4.230 3.159 2.287 3.483 . 0 0 "[ . 1 . 2]" 1
1411 1 46 TYR HA 1 49 LYS QE 4.140 . 4.440 2.405 1.972 3.211 . 0 0 "[ . 1 . 2]" 1
1412 1 46 TYR HA 1 49 LYS HD2 3.850 . 4.150 3.805 3.614 3.996 . 0 0 "[ . 1 . 2]" 1
1413 1 46 TYR HB2 1 49 LYS HD2 5.330 . 5.630 5.497 5.285 5.644 0.014 12 0 "[ . 1 . 2]" 1
1414 1 46 TYR HB2 1 49 LYS HD3 4.650 . 4.950 4.008 3.546 4.263 . 0 0 "[ . 1 . 2]" 1
1415 1 46 TYR HB3 1 49 LYS HD3 5.020 . 5.320 5.168 4.837 5.366 0.046 12 0 "[ . 1 . 2]" 1
1416 1 46 TYR QD 1 49 LYS QE 5.000 . 5.300 2.430 2.109 3.197 . 0 0 "[ . 1 . 2]" 1
1417 1 46 TYR QB 1 49 LYS H 5.470 . 5.770 5.089 5.013 5.174 . 0 0 "[ . 1 . 2]" 1
1418 1 46 TYR HA 1 50 VAL H 4.030 . 4.330 3.889 3.791 4.016 . 0 0 "[ . 1 . 2]" 1
1419 1 46 TYR HA 1 50 VAL QG 4.700 . 5.000 3.478 3.331 3.618 . 0 0 "[ . 1 . 2]" 1
1420 1 46 TYR QD 1 50 VAL MG2 5.000 . 5.300 3.200 3.027 3.316 . 0 0 "[ . 1 . 2]" 1
1421 1 46 TYR QD 1 50 VAL QG 3.970 . 4.270 3.157 2.996 3.267 . 0 0 "[ . 1 . 2]" 1
1422 1 46 TYR QD 1 50 VAL MG1 5.000 . 5.300 4.838 4.671 4.926 . 0 0 "[ . 1 . 2]" 1
1423 1 46 TYR HE1 1 50 VAL MG1 5.000 . 5.000 4.326 3.913 4.660 . 0 0 "[ . 1 . 2]" 1
1424 1 46 TYR HE1 1 50 VAL HB 5.380 . 5.680 4.796 4.407 5.458 . 0 0 "[ . 1 . 2]" 1
1425 1 46 TYR HE1 1 50 VAL MG2 4.700 . 5.000 3.609 2.772 4.002 . 0 0 "[ . 1 . 2]" 1
1426 1 46 TYR HE1 1 50 VAL QG 3.580 . 3.880 3.422 2.749 3.748 . 0 0 "[ . 1 . 2]" 1
1427 1 46 TYR HE1 1 71 LYS QE 5.500 . 5.800 4.240 3.535 4.960 . 0 0 "[ . 1 . 2]" 1
1428 1 46 TYR QE 2 44 ILE MD 5.500 . 5.800 5.795 5.512 5.939 0.139 4 0 "[ . 1 . 2]" 1
1429 1 46 TYR QE 2 48 GLU HB3 5.500 . 5.800 2.549 1.937 3.842 . 0 0 "[ . 1 . 2]" 1
1430 1 46 TYR QE 2 48 GLU HA 5.500 . 5.800 4.719 4.167 5.359 . 0 0 "[ . 1 . 2]" 1
1431 1 47 ALA H 1 47 ALA MB 2.880 . 3.180 2.217 2.201 2.249 . 0 0 "[ . 1 . 2]" 1
1432 1 47 ALA H 1 48 LYS H 3.530 . 3.830 2.702 2.623 2.773 . 0 0 "[ . 1 . 2]" 1
1433 1 47 ALA H 1 48 LYS QB 5.060 . 5.360 4.566 4.462 4.638 . 0 0 "[ . 1 . 2]" 1
1434 1 47 ALA H 1 48 LYS HD2 5.380 . 5.680 5.688 5.597 5.706 0.026 2 0 "[ . 1 . 2]" 1
1435 1 47 ALA MB 1 48 LYS H 3.310 . 3.610 2.522 2.439 2.666 . 0 0 "[ . 1 . 2]" 1
1436 1 47 ALA H 1 49 LYS H 4.660 . 4.960 4.196 4.095 4.258 . 0 0 "[ . 1 . 2]" 1
1437 1 47 ALA HA 1 49 LYS QE 5.500 . 5.800 5.641 5.242 5.837 0.037 5 0 "[ . 1 . 2]" 1
1438 1 47 ALA HA 1 49 LYS H 5.100 . 5.400 4.526 4.364 4.637 . 0 0 "[ . 1 . 2]" 1
1439 1 47 ALA HA 1 49 LYS HG2 4.920 . 5.220 4.807 4.648 5.310 0.090 1 0 "[ . 1 . 2]" 1
1440 1 47 ALA H 1 50 VAL QG 4.790 . 5.090 4.499 4.264 4.628 . 0 0 "[ . 1 . 2]" 1
1441 1 47 ALA H 1 50 VAL HB 5.500 . 5.800 4.881 4.704 5.002 . 0 0 "[ . 1 . 2]" 1
1442 1 47 ALA HA 1 50 VAL QG 3.710 . 4.010 3.195 3.031 3.398 . 0 0 "[ . 1 . 2]" 1
1443 1 47 ALA HA 1 50 VAL HB 3.000 . 3.300 2.594 2.384 2.792 . 0 0 "[ . 1 . 2]" 1
1444 1 47 ALA HA 1 50 VAL MG1 5.000 . 5.300 3.797 3.582 4.042 . 0 0 "[ . 1 . 2]" 1
1445 1 47 ALA HA 1 50 VAL MG2 5.000 . 5.300 3.446 3.183 3.654 . 0 0 "[ . 1 . 2]" 1
1446 1 47 ALA HA 1 51 GLU H 4.160 . 4.460 3.806 3.614 3.892 . 0 0 "[ . 1 . 2]" 1
1447 1 48 LYS H 1 48 LYS HG3 3.800 . 4.100 2.342 2.203 2.434 . 0 0 "[ . 1 . 2]" 1
1448 1 48 LYS H 1 48 LYS QB 3.170 . 3.470 2.322 2.258 2.436 . 0 0 "[ . 1 . 2]" 1
1449 1 48 LYS H 1 48 LYS HE3 5.500 . 5.800 5.540 4.406 5.826 0.026 12 0 "[ . 1 . 2]" 1
1450 1 48 LYS H 1 48 LYS HD2 3.520 . 3.820 3.766 3.692 3.827 0.007 19 0 "[ . 1 . 2]" 1
1451 1 48 LYS H 1 48 LYS HE2 5.270 . 5.570 4.832 4.571 5.218 . 0 0 "[ . 1 . 2]" 1
1452 1 48 LYS HA 1 48 LYS HG2 3.730 . 4.030 2.586 2.522 2.663 . 0 0 "[ . 1 . 2]" 1
1453 1 48 LYS HA 1 48 LYS HG3 3.270 . 3.570 2.900 2.806 2.997 . 0 0 "[ . 1 . 2]" 1
1454 1 48 LYS HA 1 48 LYS HE2 5.190 . 5.490 5.181 4.956 5.302 . 0 0 "[ . 1 . 2]" 1
1455 1 48 LYS HE2 1 48 LYS HG2 3.600 . 3.900 2.878 2.427 3.089 . 0 0 "[ . 1 . 2]" 1
1456 1 48 LYS HE2 1 48 LYS HG3 4.130 . 4.430 2.638 2.508 2.980 . 0 0 "[ . 1 . 2]" 1
1457 1 48 LYS QB 1 48 LYS HE3 4.280 . 4.580 4.174 3.904 4.265 . 0 0 "[ . 1 . 2]" 1
1458 1 48 LYS QB 1 48 LYS HE2 4.770 . 5.070 3.998 3.948 4.037 . 0 0 "[ . 1 . 2]" 1
1459 1 48 LYS QB 1 48 LYS HD2 3.150 . 3.450 2.374 2.280 2.433 . 0 0 "[ . 1 . 2]" 1
1460 1 48 LYS H 1 49 LYS HB3 5.500 . 5.800 5.133 4.930 5.662 . 0 0 "[ . 1 . 2]" 1
1461 1 48 LYS H 1 49 LYS H 3.380 . 3.680 2.719 2.676 2.771 . 0 0 "[ . 1 . 2]" 1
1462 1 48 LYS HD2 1 49 LYS H 5.180 . 5.480 4.867 4.634 5.030 . 0 0 "[ . 1 . 2]" 1
1463 1 48 LYS QB 1 49 LYS HG2 4.080 . 4.380 4.414 3.998 4.497 0.117 14 0 "[ . 1 . 2]" 1
1464 1 48 LYS H 1 51 GLU HB2 5.410 . 5.710 5.143 5.018 5.243 . 0 0 "[ . 1 . 2]" 1
1465 1 48 LYS H 1 51 GLU H 5.000 . 5.300 4.614 4.529 4.671 . 0 0 "[ . 1 . 2]" 1
1466 1 48 LYS HA 1 51 GLU H 4.400 . 4.700 3.573 3.448 3.680 . 0 0 "[ . 1 . 2]" 1
1467 1 48 LYS HA 1 51 GLU HB2 4.480 . 4.780 3.462 3.272 3.673 . 0 0 "[ . 1 . 2]" 1
1468 1 49 LYS H 1 49 LYS HB2 3.620 . 3.920 3.627 3.591 3.660 . 0 0 "[ . 1 . 2]" 1
1469 1 49 LYS H 1 49 LYS HG2 4.140 . 4.440 2.331 2.132 2.446 . 0 0 "[ . 1 . 2]" 1
1470 1 49 LYS H 1 49 LYS HG3 3.870 . 4.170 3.392 2.567 3.621 . 0 0 "[ . 1 . 2]" 1
1471 1 49 LYS H 1 49 LYS HB3 3.180 . 3.480 2.559 2.404 3.015 . 0 0 "[ . 1 . 2]" 1
1472 1 49 LYS H 1 49 LYS HD2 5.490 . 5.790 4.721 4.504 4.847 . 0 0 "[ . 1 . 2]" 1
1473 1 49 LYS HA 1 49 LYS HG2 3.790 . 4.090 3.759 3.716 3.866 . 0 0 "[ . 1 . 2]" 1
1474 1 49 LYS HA 1 49 LYS QE 5.500 . 5.800 5.431 4.186 5.749 . 0 0 "[ . 1 . 2]" 1
1475 1 49 LYS HA 1 49 LYS HB2 2.770 . 3.070 2.496 2.449 2.654 . 0 0 "[ . 1 . 2]" 1
1476 1 49 LYS HB2 1 49 LYS QE 3.990 . 4.290 3.659 2.117 4.061 . 0 0 "[ . 1 . 2]" 1
1477 1 49 LYS HB2 1 49 LYS HD2 2.840 . 3.140 2.243 2.120 2.431 . 0 0 "[ . 1 . 2]" 1
1478 1 49 LYS HB3 1 49 LYS QE 4.010 . 4.310 3.977 3.505 4.133 . 0 0 "[ . 1 . 2]" 1
1479 1 49 LYS HB3 1 49 LYS HD3 3.950 . 4.250 2.781 2.467 3.703 . 0 0 "[ . 1 . 2]" 1
1480 1 49 LYS H 1 50 VAL QG 4.700 . 5.000 4.178 3.988 4.302 . 0 0 "[ . 1 . 2]" 1
1481 1 49 LYS HA 1 50 VAL HA 5.050 . 5.350 4.759 4.687 4.808 . 0 0 "[ . 1 . 2]" 1
1482 1 49 LYS HB2 1 50 VAL HA 4.410 . 4.710 4.650 4.175 4.745 0.035 2 0 "[ . 1 . 2]" 1
1483 1 49 LYS HD2 1 50 VAL QG 4.670 . 4.970 4.420 4.142 4.691 . 0 0 "[ . 1 . 2]" 1
1484 1 49 LYS HD3 1 50 VAL QG 4.970 . 5.270 4.307 3.674 4.652 . 0 0 "[ . 1 . 2]" 1
1485 1 49 LYS HG2 1 50 VAL H 3.360 . 3.660 2.598 2.322 3.430 . 0 0 "[ . 1 . 2]" 1
1486 1 49 LYS HG2 1 50 VAL HA 5.500 . 5.800 4.673 4.277 5.710 . 0 0 "[ . 1 . 2]" 1
1487 1 49 LYS HG3 1 50 VAL HA 4.490 . 4.790 3.394 3.046 4.112 . 0 0 "[ . 1 . 2]" 1
1488 1 49 LYS HG3 1 50 VAL QG 3.800 . 4.100 2.442 2.222 2.626 . 0 0 "[ . 1 . 2]" 1
1489 1 49 LYS QE 1 50 VAL HA 5.500 . 5.800 4.787 3.068 5.702 . 0 0 "[ . 1 . 2]" 1
1490 1 49 LYS QE 1 50 VAL QG 4.910 . 5.210 2.763 1.950 3.408 . 0 0 "[ . 1 . 2]" 1
1491 1 49 LYS H 1 51 GLU HB2 5.500 . 5.800 5.731 5.486 5.828 0.028 1 0 "[ . 1 . 2]" 1
1492 1 49 LYS H 1 51 GLU H 4.970 . 5.270 4.176 4.042 4.264 . 0 0 "[ . 1 . 2]" 1
1493 1 49 LYS HA 1 52 GLY H 4.070 . 4.370 3.633 3.372 3.829 . 0 0 "[ . 1 . 2]" 1
1494 1 49 LYS HA 1 52 GLY HA3 4.830 . 5.130 3.882 3.604 4.128 . 0 0 "[ . 1 . 2]" 1
1495 1 49 LYS HA 1 52 GLY HA2 5.500 . 5.800 5.498 5.220 5.729 . 0 0 "[ . 1 . 2]" 1
1496 1 49 LYS HA 1 53 ASP H 4.720 . 5.020 4.113 3.952 4.320 . 0 0 "[ . 1 . 2]" 1
1497 1 49 LYS HB2 1 53 ASP H 5.500 . 5.800 5.294 5.021 5.476 . 0 0 "[ . 1 . 2]" 1
1498 1 50 VAL H 1 50 VAL QG 3.920 . 4.220 2.353 2.221 2.457 . 0 0 "[ . 1 . 2]" 1
1499 1 50 VAL H 1 50 VAL HB 3.960 . 4.260 2.331 2.223 2.389 . 0 0 "[ . 1 . 2]" 1
1500 1 50 VAL HA 1 50 VAL MG2 3.100 . 3.400 2.269 2.224 2.314 . 0 0 "[ . 1 . 2]" 1
1501 1 50 VAL HA 1 50 VAL MG1 3.100 . 3.400 2.577 2.533 2.640 . 0 0 "[ . 1 . 2]" 1
1502 1 50 VAL HA 1 50 VAL QG 2.650 . 2.950 2.128 2.103 2.151 . 0 0 "[ . 1 . 2]" 1
1503 1 50 VAL H 1 51 GLU HA 5.500 . 5.800 5.249 5.161 5.331 . 0 0 "[ . 1 . 2]" 1
1504 1 50 VAL H 1 51 GLU H 4.120 . 4.420 2.647 2.542 2.721 . 0 0 "[ . 1 . 2]" 1
1505 1 50 VAL HA 1 51 GLU HA 5.130 . 5.430 4.857 4.795 4.890 . 0 0 "[ . 1 . 2]" 1
1506 1 50 VAL HB 1 51 GLU HA 4.550 . 4.850 4.522 4.356 4.664 . 0 0 "[ . 1 . 2]" 1
1507 1 50 VAL HB 1 51 GLU H 3.510 . 3.810 2.563 2.437 2.696 . 0 0 "[ . 1 . 2]" 1
1508 1 50 VAL MG1 1 51 GLU H 4.070 . 4.370 3.047 2.874 3.167 . 0 0 "[ . 1 . 2]" 1
1509 1 50 VAL MG2 1 51 GLU H 4.070 . 4.370 3.918 3.788 4.028 . 0 0 "[ . 1 . 2]" 1
1510 1 50 VAL QG 1 51 GLU HA 3.350 . 3.650 3.212 3.080 3.316 . 0 0 "[ . 1 . 2]" 1
1511 1 50 VAL QG 1 51 GLU QG 4.670 . 4.970 4.769 4.609 4.918 . 0 0 "[ . 1 . 2]" 1
1512 1 50 VAL QG 1 51 GLU HB2 5.440 . 5.740 3.971 3.783 4.129 . 0 0 "[ . 1 . 2]" 1
1513 1 50 VAL QG 1 51 GLU H 3.340 . 3.640 2.945 2.806 3.042 . 0 0 "[ . 1 . 2]" 1
1514 1 50 VAL HA 1 52 GLY H 4.690 . 4.990 4.574 4.432 4.724 . 0 0 "[ . 1 . 2]" 1
1515 1 50 VAL HB 1 52 GLY H 5.170 . 5.470 5.100 4.958 5.239 . 0 0 "[ . 1 . 2]" 1
1516 1 50 VAL MG1 1 52 GLY H 5.500 . 5.800 4.946 4.862 5.042 . 0 0 "[ . 1 . 2]" 1
1517 1 50 VAL MG2 1 52 GLY H 5.500 . 5.800 5.541 5.445 5.675 . 0 0 "[ . 1 . 2]" 1
1518 1 50 VAL QG 1 52 GLY H 4.530 . 4.830 4.619 4.576 4.672 . 0 0 "[ . 1 . 2]" 1
1519 1 50 VAL HA 1 53 ASP HB2 4.000 . 4.300 3.344 2.704 3.517 . 0 0 "[ . 1 . 2]" 1
1520 1 50 VAL HA 1 53 ASP HA 5.500 . 5.800 5.439 5.129 5.564 . 0 0 "[ . 1 . 2]" 1
1521 1 50 VAL HA 1 53 ASP H 3.810 . 4.110 3.515 3.350 3.629 . 0 0 "[ . 1 . 2]" 1
1522 1 50 VAL HA 1 53 ASP HB3 3.850 . 4.150 2.944 2.709 3.109 . 0 0 "[ . 1 . 2]" 1
1523 1 50 VAL HB 1 53 ASP H 5.500 . 5.800 5.598 5.484 5.715 . 0 0 "[ . 1 . 2]" 1
1524 1 50 VAL MG1 1 53 ASP HB2 4.840 . 5.140 4.970 4.390 5.155 0.015 1 0 "[ . 1 . 2]" 1
1525 1 50 VAL MG1 1 53 ASP H 5.220 . 5.520 4.738 4.571 4.835 . 0 0 "[ . 1 . 2]" 1
1526 1 50 VAL MG2 1 53 ASP HB2 4.840 . 5.140 4.844 4.332 5.031 . 0 0 "[ . 1 . 2]" 1
1527 1 50 VAL MG2 1 53 ASP H 5.220 . 5.520 5.191 5.074 5.283 . 0 0 "[ . 1 . 2]" 1
1528 1 50 VAL QG 1 53 ASP H 4.260 . 4.560 4.391 4.257 4.467 . 0 0 "[ . 1 . 2]" 1
1529 1 50 VAL QG 1 53 ASP HB2 4.260 . 4.560 4.368 3.885 4.529 . 0 0 "[ . 1 . 2]" 1
1530 1 50 VAL QG 1 53 ASP HB3 4.210 . 4.510 3.720 3.515 3.852 . 0 0 "[ . 1 . 2]" 1
1531 1 50 VAL HA 1 54 MET H 4.580 . 4.880 4.195 4.052 4.283 . 0 0 "[ . 1 . 2]" 1
1532 1 50 VAL HA 1 54 MET ME 3.970 . 4.270 3.166 2.946 3.405 . 0 0 "[ . 1 . 2]" 1
1533 1 50 VAL MG1 1 54 MET ME 3.890 . 4.190 2.065 1.928 2.633 . 0 0 "[ . 1 . 2]" 1
1534 1 50 VAL MG2 1 54 MET ME 3.890 . 4.190 3.586 3.341 3.899 . 0 0 "[ . 1 . 2]" 1
1535 1 50 VAL QG 1 54 MET HG2 4.360 . 4.660 3.450 2.876 3.649 . 0 0 "[ . 1 . 2]" 1
1536 1 50 VAL QG 1 54 MET H 4.270 . 4.570 4.043 3.896 4.134 . 0 0 "[ . 1 . 2]" 1
1537 1 50 VAL QG 1 54 MET HG3 4.550 . 4.850 4.037 3.055 4.229 . 0 0 "[ . 1 . 2]" 1
1538 1 50 VAL QG 1 54 MET ME 2.690 . 2.990 2.052 1.917 2.593 . 0 0 "[ . 1 . 2]" 1
1539 1 50 VAL MG1 1 68 LEU MD2 4.500 . 4.800 4.570 4.187 4.819 0.019 6 0 "[ . 1 . 2]" 1
1540 1 50 VAL MG1 1 68 LEU MD1 4.500 . 4.800 4.097 3.800 4.364 . 0 0 "[ . 1 . 2]" 1
1541 1 50 VAL QG 1 68 LEU HB2 4.740 . 5.040 3.686 3.242 3.940 . 0 0 "[ . 1 . 2]" 1
1542 1 50 VAL QG 1 68 LEU HA 5.440 . 5.740 4.388 3.993 4.641 . 0 0 "[ . 1 . 2]" 1
1543 1 50 VAL HB 1 71 LYS QE 5.040 . 5.340 4.493 3.903 5.335 . 0 0 "[ . 1 . 2]" 1
1544 1 50 VAL MG1 1 71 LYS QE 4.210 . 4.510 2.307 1.871 3.130 . 0 0 "[ . 1 . 2]" 1
1545 1 50 VAL MG2 1 71 LYS QE 4.210 . 4.510 3.091 2.478 3.884 . 0 0 "[ . 1 . 2]" 1
1546 1 50 VAL QG 1 71 LYS QE 3.070 . 3.370 2.236 1.839 2.983 . 0 0 "[ . 1 . 2]" 1
1547 1 19 VAL MG1 1 51 GLU H 5.500 . 5.800 4.742 4.593 4.841 . 0 0 "[ . 1 . 2]" 1
1548 1 51 GLU H 1 51 GLU HB2 3.450 . 3.750 2.356 2.307 2.460 . 0 0 "[ . 1 . 2]" 1
1549 1 51 GLU H 1 51 GLU HG2 4.620 . 4.920 4.377 4.332 4.426 . 0 0 "[ . 1 . 2]" 1
1550 1 51 GLU H 1 51 GLU QG 3.890 . 4.190 3.940 3.906 3.968 . 0 0 "[ . 1 . 2]" 1
1551 1 51 GLU H 1 51 GLU HB3 3.610 . 3.910 2.489 2.361 2.527 . 0 0 "[ . 1 . 2]" 1
1552 1 51 GLU H 1 51 GLU HG3 4.620 . 4.920 4.472 4.441 4.502 . 0 0 "[ . 1 . 2]" 1
1553 1 51 GLU HA 1 51 GLU QG 3.580 . 3.880 2.526 2.459 2.606 . 0 0 "[ . 1 . 2]" 1
1554 1 51 GLU H 1 52 GLY H 3.600 . 3.900 2.764 2.712 2.832 . 0 0 "[ . 1 . 2]" 1
1555 1 51 GLU HB2 1 52 GLY H 3.880 . 4.180 3.721 3.653 3.825 . 0 0 "[ . 1 . 2]" 1
1556 1 51 GLU HB3 1 52 GLY H 3.990 . 4.290 2.390 2.288 2.501 . 0 0 "[ . 1 . 2]" 1
1557 1 51 GLU HB3 1 52 GLY HA3 4.980 . 5.280 4.395 4.308 4.542 . 0 0 "[ . 1 . 2]" 1
1558 1 51 GLU HG2 1 52 GLY H 5.500 . 5.800 4.584 4.508 4.671 . 0 0 "[ . 1 . 2]" 1
1559 1 51 GLU HG3 1 52 GLY H 5.500 . 5.800 4.734 4.620 4.889 . 0 0 "[ . 1 . 2]" 1
1560 1 51 GLU H 1 53 ASP H 4.560 . 4.860 4.155 4.041 4.266 . 0 0 "[ . 1 . 2]" 1
1561 1 51 GLU H 1 53 ASP HB2 5.500 . 5.800 5.775 5.302 5.850 0.050 6 0 "[ . 1 . 2]" 1
1562 1 51 GLU HA 1 53 ASP HB3 5.500 . 5.800 5.190 4.930 5.378 . 0 0 "[ . 1 . 2]" 1
1563 1 51 GLU HB3 1 53 ASP H 5.500 . 5.800 4.912 4.810 4.985 . 0 0 "[ . 1 . 2]" 1
1564 1 51 GLU H 1 54 MET H 5.430 . 5.730 4.971 4.747 5.045 . 0 0 "[ . 1 . 2]" 1
1565 1 51 GLU H 1 54 MET HG3 5.500 . 5.800 5.364 4.787 5.462 . 0 0 "[ . 1 . 2]" 1
1566 1 51 GLU HA 1 54 MET HG3 5.000 . 5.300 2.847 2.529 2.970 . 0 0 "[ . 1 . 2]" 1
1567 1 51 GLU HA 1 54 MET HB2 5.000 . 5.300 4.818 3.500 5.023 . 0 0 "[ . 1 . 2]" 1
1568 1 51 GLU HA 1 54 MET HG2 4.650 . 4.950 2.534 2.422 2.653 . 0 0 "[ . 1 . 2]" 1
1569 1 51 GLU HA 1 54 MET ME 4.280 . 4.580 4.132 3.991 4.583 0.003 3 0 "[ . 1 . 2]" 1
1570 1 51 GLU HB3 1 54 MET HG2 5.080 . 5.380 5.204 5.103 5.358 . 0 0 "[ . 1 . 2]" 1
1571 1 51 GLU HB3 1 54 MET HG3 5.500 . 5.800 5.765 5.554 5.841 0.041 16 0 "[ . 1 . 2]" 1
1572 1 51 GLU HA 1 68 LEU MD2 3.600 . 3.900 3.371 2.885 3.635 . 0 0 "[ . 1 . 2]" 1
1573 1 51 GLU HA 1 68 LEU MD1 4.170 . 4.470 4.382 4.196 4.485 0.015 15 0 "[ . 1 . 2]" 1
1574 1 51 GLU HB2 1 68 LEU MD2 5.000 . 5.300 4.306 3.861 4.619 . 0 0 "[ . 1 . 2]" 1
1575 1 51 GLU QG 1 68 LEU HB2 4.630 . 4.930 4.973 4.788 5.014 0.084 13 0 "[ . 1 . 2]" 1
1576 1 51 GLU QG 1 68 LEU MD2 4.110 . 4.410 2.969 2.553 3.150 . 0 0 "[ . 1 . 2]" 1
1577 1 52 GLY H 1 53 ASP HB2 4.840 . 5.140 5.054 4.828 5.151 0.011 5 0 "[ . 1 . 2]" 1
1578 1 52 GLY H 1 53 ASP H 3.760 . 4.060 2.747 2.687 2.812 . 0 0 "[ . 1 . 2]" 1
1579 1 52 GLY H 1 53 ASP HA 5.300 . 5.600 5.366 5.307 5.434 . 0 0 "[ . 1 . 2]" 1
1580 1 52 GLY H 1 53 ASP HB3 5.500 . 5.800 4.978 4.806 5.145 . 0 0 "[ . 1 . 2]" 1
1581 1 52 GLY HA2 1 53 ASP HB2 5.500 . 5.800 5.820 5.793 5.857 0.057 5 0 "[ . 1 . 2]" 1
1582 1 52 GLY HA3 1 54 MET H 5.280 . 5.580 4.956 4.734 5.084 . 0 0 "[ . 1 . 2]" 1
1583 1 52 GLY HA2 1 55 TYR H 4.560 . 4.860 3.505 3.416 3.608 . 0 0 "[ . 1 . 2]" 1
1584 1 52 GLY HA2 1 55 TYR HB3 4.360 . 4.660 2.342 2.141 2.470 . 0 0 "[ . 1 . 2]" 1
1585 1 52 GLY HA2 1 55 TYR HB2 4.130 . 4.430 3.060 2.811 3.349 . 0 0 "[ . 1 . 2]" 1
1586 1 52 GLY HA2 1 55 TYR QD 5.500 . 5.800 3.686 3.006 4.064 . 0 0 "[ . 1 . 2]" 1
1587 1 52 GLY HA3 1 55 TYR HB3 4.260 . 4.560 3.916 3.719 4.086 . 0 0 "[ . 1 . 2]" 1
1588 1 52 GLY HA2 1 56 GLU QG 5.010 . 5.310 3.846 3.446 4.613 . 0 0 "[ . 1 . 2]" 1
1589 1 52 GLY HA2 1 56 GLU H 4.470 . 4.770 3.915 3.754 4.094 . 0 0 "[ . 1 . 2]" 1
1590 1 53 ASP H 1 53 ASP HB3 3.240 . 3.540 2.555 2.438 2.697 . 0 0 "[ . 1 . 2]" 1
1591 1 53 ASP H 1 53 ASP HB2 3.210 . 3.510 2.472 2.349 2.565 . 0 0 "[ . 1 . 2]" 1
1592 1 53 ASP H 1 54 MET HA 5.500 . 5.800 5.336 5.201 5.405 . 0 0 "[ . 1 . 2]" 1
1593 1 53 ASP HA 1 54 MET ME 4.750 . 5.050 4.968 4.289 5.095 0.045 19 0 "[ . 1 . 2]" 1
1594 1 53 ASP HA 1 54 MET HA 4.990 . 5.290 4.621 4.561 4.763 . 0 0 "[ . 1 . 2]" 1
1595 1 53 ASP HB2 1 54 MET H 3.520 . 3.820 3.615 3.418 3.698 . 0 0 "[ . 1 . 2]" 1
1596 1 53 ASP HB2 1 54 MET HA 5.470 . 5.770 5.518 5.382 5.577 . 0 0 "[ . 1 . 2]" 1
1597 1 53 ASP HB2 1 54 MET ME 4.610 . 4.910 4.056 3.393 4.271 . 0 0 "[ . 1 . 2]" 1
1598 1 53 ASP HB3 1 54 MET HG2 4.690 . 4.990 3.589 2.927 3.808 . 0 0 "[ . 1 . 2]" 1
1599 1 53 ASP HB3 1 54 MET HB3 4.390 . 4.690 4.413 4.101 4.877 0.187 3 0 "[ . 1 . 2]" 1
1600 1 53 ASP HB3 1 54 MET H 3.580 . 3.880 2.225 2.079 2.364 . 0 0 "[ . 1 . 2]" 1
1601 1 53 ASP HB3 1 54 MET ME 3.130 . 3.430 2.550 1.968 2.747 . 0 0 "[ . 1 . 2]" 1
1602 1 53 ASP H 1 55 TYR H 4.410 . 4.710 3.944 3.811 4.101 . 0 0 "[ . 1 . 2]" 1
1603 1 53 ASP HA 1 55 TYR H 5.160 . 5.460 4.436 4.279 4.640 . 0 0 "[ . 1 . 2]" 1
1604 1 53 ASP HA 1 56 GLU QB 3.920 . 4.220 3.247 2.774 3.515 . 0 0 "[ . 1 . 2]" 1
1605 1 53 ASP HA 1 56 GLU H 4.400 . 4.700 3.732 3.317 4.059 . 0 0 "[ . 1 . 2]" 1
1606 1 53 ASP HA 1 56 GLU HB3 5.000 . 5.300 4.968 4.322 5.306 0.006 18 0 "[ . 1 . 2]" 1
1607 1 53 ASP HA 1 56 GLU HG2 5.500 . 5.800 5.275 4.396 5.844 0.044 17 0 "[ . 1 . 2]" 1
1608 1 53 ASP HA 1 56 GLU HB2 5.000 . 5.300 3.291 2.807 3.567 . 0 0 "[ . 1 . 2]" 1
1609 1 53 ASP HA 1 56 GLU HG3 5.500 . 5.800 4.436 3.853 5.016 . 0 0 "[ . 1 . 2]" 1
1610 1 53 ASP HA 1 56 GLU QG 4.310 . 4.610 4.159 3.782 4.441 . 0 0 "[ . 1 . 2]" 1
1611 1 53 ASP HB3 1 56 GLU H 5.500 . 5.800 5.557 5.168 5.723 . 0 0 "[ . 1 . 2]" 1
1612 1 53 ASP HA 1 57 SER H 4.420 . 4.720 4.372 4.073 4.517 . 0 0 "[ . 1 . 2]" 1
1613 1 53 ASP HA 1 57 SER HB2 4.520 . 4.820 4.749 4.470 4.913 0.093 4 0 "[ . 1 . 2]" 1
1614 1 53 ASP HB3 1 57 SER H 5.500 . 5.800 5.772 5.447 5.827 0.027 9 0 "[ . 1 . 2]" 1
1615 1 51 GLU HA 1 54 MET H 4.500 . 4.800 3.811 3.551 3.910 . 0 0 "[ . 1 . 2]" 1
1616 1 54 MET H 1 54 MET HB3 3.490 . 3.790 3.116 3.031 3.575 . 0 0 "[ . 1 . 2]" 1
1617 1 54 MET H 1 54 MET HB2 3.700 . 4.000 3.594 3.059 3.637 . 0 0 "[ . 1 . 2]" 1
1618 1 54 MET H 1 54 MET HG2 3.550 . 3.850 1.769 1.744 1.781 0.056 3 0 "[ . 1 . 2]" 1
1619 1 54 MET H 1 54 MET ME 3.790 . 4.090 2.620 2.374 2.748 . 0 0 "[ . 1 . 2]" 1
1620 1 54 MET H 1 54 MET HG3 3.830 . 4.130 3.377 3.343 3.421 . 0 0 "[ . 1 . 2]" 1
1621 1 54 MET HA 1 54 MET ME 3.690 . 3.990 3.332 2.074 3.521 . 0 0 "[ . 1 . 2]" 1
1622 1 54 MET HA 1 54 MET HG2 3.950 . 4.250 3.505 3.251 3.542 . 0 0 "[ . 1 . 2]" 1
1623 1 54 MET HA 1 54 MET HG3 4.180 . 4.480 4.061 4.000 4.133 . 0 0 "[ . 1 . 2]" 1
1624 1 54 MET HB2 1 54 MET ME 3.910 . 4.210 3.359 3.246 3.747 . 0 0 "[ . 1 . 2]" 1
1625 1 54 MET HB3 1 54 MET ME 4.240 . 4.540 1.917 1.821 2.869 . 0 0 "[ . 1 . 2]" 1
1626 1 54 MET ME 1 54 MET HG3 3.370 . 3.670 3.433 3.392 3.460 . 0 0 "[ . 1 . 2]" 1
1627 1 54 MET H 1 55 TYR H 3.460 . 3.760 2.617 2.544 2.669 . 0 0 "[ . 1 . 2]" 1
1628 1 54 MET H 1 55 TYR HB3 4.860 . 5.160 4.673 4.397 4.813 . 0 0 "[ . 1 . 2]" 1
1629 1 54 MET HB2 1 55 TYR H 4.130 . 4.430 3.611 2.513 3.762 . 0 0 "[ . 1 . 2]" 1
1630 1 54 MET HB3 1 55 TYR HA 5.500 . 5.800 5.740 4.848 5.829 0.029 4 0 "[ . 1 . 2]" 1
1631 1 54 MET HB3 1 55 TYR H 4.340 . 4.640 4.299 3.820 4.393 . 0 0 "[ . 1 . 2]" 1
1632 1 54 MET HG2 1 55 TYR HB2 5.110 . 5.410 4.545 4.302 5.354 . 0 0 "[ . 1 . 2]" 1
1633 1 54 MET HG2 1 55 TYR H 4.970 . 5.270 2.828 2.682 3.429 . 0 0 "[ . 1 . 2]" 1
1634 1 54 MET HG3 1 55 TYR H 4.730 . 5.030 3.437 3.251 4.115 . 0 0 "[ . 1 . 2]" 1
1635 1 54 MET H 1 56 GLU H 4.680 . 4.980 4.236 3.925 4.379 . 0 0 "[ . 1 . 2]" 1
1636 1 54 MET HA 1 56 GLU H 4.530 . 4.830 4.253 4.027 4.410 . 0 0 "[ . 1 . 2]" 1
1637 1 54 MET HG2 1 56 GLU H 4.910 . 5.210 5.226 5.124 5.404 0.194 3 0 "[ . 1 . 2]" 1
1638 1 54 MET H 1 57 SER H 5.160 . 5.460 4.584 4.468 4.666 . 0 0 "[ . 1 . 2]" 1
1639 1 54 MET HA 1 57 SER HB3 2.920 . 3.220 2.641 2.039 3.329 0.109 15 0 "[ . 1 . 2]" 1
1640 1 54 MET HA 1 57 SER HB2 3.120 . 3.420 2.475 1.844 3.311 . 0 0 "[ . 1 . 2]" 1
1641 1 54 MET HA 1 58 ALA H 4.010 . 4.310 3.945 3.571 4.282 . 0 0 "[ . 1 . 2]" 1
1642 1 54 MET HA 1 58 ALA MB 4.170 . 4.470 4.363 4.145 4.492 0.022 16 0 "[ . 1 . 2]" 1
1643 1 54 MET HB2 1 58 ALA H 4.890 . 5.190 4.871 4.498 5.214 0.024 3 0 "[ . 1 . 2]" 1
1644 1 54 MET HB2 1 58 ALA MB 4.430 . 4.730 4.035 3.704 4.416 . 0 0 "[ . 1 . 2]" 1
1645 1 54 MET HB3 1 58 ALA MB 5.150 . 5.450 5.083 4.150 5.385 . 0 0 "[ . 1 . 2]" 1
1646 1 54 MET H 1 67 LEU QD 4.850 . 5.150 4.406 4.214 4.541 . 0 0 "[ . 1 . 2]" 1
1647 1 54 MET HA 1 67 LEU HG 5.500 . 5.800 5.259 4.410 5.806 0.006 8 0 "[ . 1 . 2]" 1
1648 1 54 MET HA 1 67 LEU MD2 4.610 . 4.910 3.824 3.381 3.971 . 0 0 "[ . 1 . 2]" 1
1649 1 54 MET HA 1 67 LEU QD 3.700 . 4.000 2.839 2.201 3.120 . 0 0 "[ . 1 . 2]" 1
1650 1 54 MET HA 1 67 LEU MD1 4.000 . 4.300 2.933 2.230 3.267 . 0 0 "[ . 1 . 2]" 1
1651 1 54 MET HB3 1 67 LEU QD 4.970 . 5.270 2.062 1.794 2.424 0.006 2 0 "[ . 1 . 2]" 1
1652 1 54 MET HG2 1 67 LEU MD2 5.500 . 5.800 5.843 5.580 5.896 0.096 4 0 "[ . 1 . 2]" 1
1653 1 54 MET HG2 1 67 LEU MD1 5.000 . 5.300 4.071 3.787 4.162 . 0 0 "[ . 1 . 2]" 1
1654 1 54 MET HG2 1 67 LEU QD 4.170 . 4.470 3.998 3.729 4.077 . 0 0 "[ . 1 . 2]" 1
1655 1 54 MET HG3 1 67 LEU MD1 5.000 . 5.300 3.487 3.203 3.706 . 0 0 "[ . 1 . 2]" 1
1656 1 54 MET HG3 1 67 LEU MD2 5.000 . 5.300 5.302 5.215 5.377 0.077 3 0 "[ . 1 . 2]" 1
1657 1 54 MET HG3 1 67 LEU QD 4.310 . 4.610 3.440 3.178 3.640 . 0 0 "[ . 1 . 2]" 1
1658 1 54 MET ME 1 67 LEU QD 3.400 . 3.700 2.868 2.369 3.319 . 0 0 "[ . 1 . 2]" 1
1659 1 54 MET HB2 1 68 LEU MD2 4.870 . 5.170 3.988 2.957 4.209 . 0 0 "[ . 1 . 2]" 1
1660 1 54 MET HB2 1 68 LEU HB3 4.710 . 5.010 3.158 2.961 3.393 . 0 0 "[ . 1 . 2]" 1
1661 1 54 MET HB2 1 68 LEU H 4.530 . 4.830 4.185 3.916 4.635 . 0 0 "[ . 1 . 2]" 1
1662 1 54 MET HB2 1 68 LEU HA 5.500 . 5.800 4.525 4.143 5.101 . 0 0 "[ . 1 . 2]" 1
1663 1 54 MET HB3 1 68 LEU HA 4.540 . 4.840 4.228 3.853 4.579 . 0 0 "[ . 1 . 2]" 1
1664 1 54 MET HB3 1 68 LEU HB3 5.040 . 5.340 3.843 2.777 4.104 . 0 0 "[ . 1 . 2]" 1
1665 1 54 MET HB3 1 68 LEU MD1 5.500 . 5.800 5.879 5.455 5.934 0.134 13 0 "[ . 1 . 2]" 1
1666 1 54 MET HG2 1 68 LEU MD1 5.000 . 5.300 5.268 5.164 5.316 0.016 3 0 "[ . 1 . 2]" 1
1667 1 54 MET HG2 1 68 LEU HB3 4.590 . 4.890 4.055 3.622 4.250 . 0 0 "[ . 1 . 2]" 1
1668 1 54 MET HG2 1 68 LEU MD2 5.290 . 5.590 4.122 3.683 4.294 . 0 0 "[ . 1 . 2]" 1
1669 1 54 MET HG3 1 68 LEU HG 4.700 . 5.000 4.787 4.289 5.003 0.003 8 0 "[ . 1 . 2]" 1
1670 1 54 MET HG3 1 68 LEU MD1 4.040 . 4.340 4.271 3.945 4.327 . 0 0 "[ . 1 . 2]" 1
1671 1 54 MET ME 1 68 LEU HB3 3.970 . 4.270 4.233 3.985 4.306 0.036 13 0 "[ . 1 . 2]" 1
1672 1 54 MET ME 1 68 LEU HB2 4.160 . 4.460 3.923 3.799 4.524 0.064 3 0 "[ . 1 . 2]" 1
1673 1 54 MET ME 1 68 LEU HA 3.960 . 4.260 3.618 3.426 4.122 . 0 0 "[ . 1 . 2]" 1
1674 1 54 MET ME 1 71 LYS QG 3.950 . 4.250 2.411 2.087 3.350 . 0 0 "[ . 1 . 2]" 1
1675 1 54 MET ME 1 71 LYS QE 4.000 . 4.300 3.267 2.043 4.331 0.031 5 0 "[ . 1 . 2]" 1
1676 1 55 TYR H 1 55 TYR HB2 3.590 . 3.890 2.401 2.186 2.578 . 0 0 "[ . 1 . 2]" 1
1677 1 55 TYR H 1 55 TYR QD 4.350 . 4.650 4.112 4.000 4.169 . 0 0 "[ . 1 . 2]" 1
1678 1 55 TYR H 1 55 TYR HB3 3.630 . 3.930 2.421 2.221 2.495 . 0 0 "[ . 1 . 2]" 1
1679 1 55 TYR HA 1 55 TYR QD 4.100 . 4.400 2.906 2.596 3.101 . 0 0 "[ . 1 . 2]" 1
1680 1 55 TYR HA 1 55 TYR QE 5.370 . 5.670 4.761 4.616 4.894 . 0 0 "[ . 1 . 2]" 1
1681 1 55 TYR HB2 1 55 TYR QE 4.880 . 5.180 4.396 4.365 4.414 . 0 0 "[ . 1 . 2]" 1
1682 1 55 TYR H 1 56 GLU H 3.630 . 3.930 2.689 2.602 2.776 . 0 0 "[ . 1 . 2]" 1
1683 1 55 TYR H 1 56 GLU QG 5.090 . 5.390 4.562 4.165 5.117 . 0 0 "[ . 1 . 2]" 1
1684 1 55 TYR HB2 1 56 GLU H 4.160 . 4.460 3.728 3.524 3.877 . 0 0 "[ . 1 . 2]" 1
1685 1 55 TYR HB3 1 56 GLU QB 4.840 . 5.140 4.297 4.032 4.496 . 0 0 "[ . 1 . 2]" 1
1686 1 55 TYR HB3 1 56 GLU H 3.840 . 4.140 2.381 2.151 2.636 . 0 0 "[ . 1 . 2]" 1
1687 1 55 TYR HB3 1 56 GLU HG2 5.500 . 5.800 3.803 2.837 4.843 . 0 0 "[ . 1 . 2]" 1
1688 1 55 TYR HB3 1 56 GLU HG3 5.500 . 5.800 3.901 3.021 5.031 . 0 0 "[ . 1 . 2]" 1
1689 1 55 TYR QD 1 56 GLU H . . 4.280 3.322 2.881 3.701 . 0 0 "[ . 1 . 2]" 1
1690 1 55 TYR H 1 57 SER H 4.500 . 4.800 3.799 3.733 3.914 . 0 0 "[ . 1 . 2]" 1
1691 1 55 TYR H 1 58 ALA MB 5.060 . 5.360 5.043 4.761 5.198 . 0 0 "[ . 1 . 2]" 1
1692 1 55 TYR HA 1 58 ALA MB 4.080 . 4.380 3.442 3.114 3.605 . 0 0 "[ . 1 . 2]" 1
1693 1 55 TYR HB2 1 58 ALA MB 5.410 . 5.710 5.552 5.278 5.714 0.004 1 0 "[ . 1 . 2]" 1
1694 1 55 TYR HA 1 61 ARG HA 5.340 . 5.640 4.978 4.705 5.100 . 0 0 "[ . 1 . 2]" 1
1695 1 55 TYR H 1 64 TYR QE 5.130 . 5.430 3.653 3.473 3.753 . 0 0 "[ . 1 . 2]" 1
1696 1 55 TYR HA 1 64 TYR QD 4.000 . 4.300 2.596 2.282 2.796 . 0 0 "[ . 1 . 2]" 1
1697 1 55 TYR HA 1 64 TYR HA 4.550 . 4.850 4.617 4.349 4.819 . 0 0 "[ . 1 . 2]" 1
1698 1 55 TYR HA 1 64 TYR H 5.130 . 5.430 5.381 5.085 5.479 0.049 8 0 "[ . 1 . 2]" 1
1699 1 55 TYR HA 1 64 TYR HB2 3.630 . 3.930 2.446 2.101 2.621 . 0 0 "[ . 1 . 2]" 1
1700 1 55 TYR HB3 1 64 TYR QE 4.390 . 4.690 4.514 4.107 4.692 0.002 13 0 "[ . 1 . 2]" 1
1701 1 55 TYR H 1 67 LEU QD 4.910 . 5.210 4.707 4.403 4.924 . 0 0 "[ . 1 . 2]" 1
1702 1 55 TYR H 1 68 LEU MD2 4.900 . 5.200 5.055 4.562 5.218 0.018 9 0 "[ . 1 . 2]" 1
1703 1 56 GLU H 1 56 GLU QB 3.000 . 3.300 2.393 2.229 2.569 . 0 0 "[ . 1 . 2]" 1
1704 1 56 GLU H 1 56 GLU HG3 3.760 . 4.060 3.017 2.142 4.064 0.004 3 0 "[ . 1 . 2]" 1
1705 1 56 GLU H 1 56 GLU HG2 3.760 . 4.060 3.075 2.404 3.707 . 0 0 "[ . 1 . 2]" 1
1706 1 56 GLU H 1 56 GLU QG 3.280 . 3.580 2.435 2.107 2.974 . 0 0 "[ . 1 . 2]" 1
1707 1 56 GLU H 1 56 GLU HB3 3.640 . 3.940 3.607 3.531 3.665 . 0 0 "[ . 1 . 2]" 1
1708 1 56 GLU H 1 56 GLU HB2 3.640 . 3.940 2.429 2.254 2.626 . 0 0 "[ . 1 . 2]" 1
1709 1 56 GLU HA 1 56 GLU QG 3.430 . 3.730 2.536 2.311 2.818 . 0 0 "[ . 1 . 2]" 1
1710 1 56 GLU H 1 57 SER HB2 4.940 . 5.240 4.520 4.069 4.811 . 0 0 "[ . 1 . 2]" 1
1711 1 56 GLU HA 1 57 SER HB2 5.500 . 5.800 5.562 5.286 5.728 . 0 0 "[ . 1 . 2]" 1
1712 1 56 GLU HG2 1 57 SER H 5.500 . 5.800 4.847 4.470 5.200 . 0 0 "[ . 1 . 2]" 1
1713 1 56 GLU HG3 1 57 SER H 5.500 . 5.800 4.835 4.135 5.548 . 0 0 "[ . 1 . 2]" 1
1714 1 56 GLU QB 1 57 SER H 3.840 . 4.140 2.992 2.678 3.213 . 0 0 "[ . 1 . 2]" 1
1715 1 56 GLU QG 1 57 SER H 4.780 . 5.080 4.246 3.915 4.570 . 0 0 "[ . 1 . 2]" 1
1716 1 56 GLU H 1 58 ALA H 5.120 . 5.420 4.237 3.907 4.558 . 0 0 "[ . 1 . 2]" 1
1717 1 56 GLU H 1 58 ALA MB 5.180 . 5.480 5.245 4.927 5.411 . 0 0 "[ . 1 . 2]" 1
1718 1 54 MET HA 1 57 SER H 4.500 . 4.800 3.014 2.770 3.275 . 0 0 "[ . 1 . 2]" 1
1719 1 57 SER H 1 57 SER HB2 3.070 . 3.370 2.386 2.060 2.685 . 0 0 "[ . 1 . 2]" 1
1720 1 57 SER HA 1 57 SER HB2 2.720 . 3.020 2.676 2.468 2.953 . 0 0 "[ . 1 . 2]" 1
1721 1 57 SER H 1 58 ALA MB 4.350 . 4.650 4.204 3.927 4.371 . 0 0 "[ . 1 . 2]" 1
1722 1 57 SER H 1 58 ALA H 2.920 . 3.220 2.527 2.197 2.695 . 0 0 "[ . 1 . 2]" 1
1723 1 57 SER HB3 1 58 ALA HA 4.390 . 4.690 4.296 4.021 4.445 . 0 0 "[ . 1 . 2]" 1
1724 1 57 SER HB3 1 58 ALA H 3.410 . 3.710 3.235 2.352 3.826 0.116 8 0 "[ . 1 . 2]" 1
1725 1 57 SER H 1 67 LEU MD2 5.500 . 5.800 5.048 4.588 5.451 . 0 0 "[ . 1 . 2]" 1
1726 1 57 SER H 1 67 LEU MD1 5.500 . 5.800 5.084 4.754 5.524 . 0 0 "[ . 1 . 2]" 1
1727 1 57 SER HB2 1 67 LEU MD2 5.000 . 5.300 4.325 3.369 5.103 . 0 0 "[ . 1 . 2]" 1
1728 1 57 SER HB2 1 67 LEU MD1 5.000 . 5.300 4.347 3.201 5.193 . 0 0 "[ . 1 . 2]" 1
1729 1 57 SER HB3 1 67 LEU QD 4.460 . 4.760 3.155 2.686 3.705 . 0 0 "[ . 1 . 2]" 1
1730 1 58 ALA H 1 58 ALA MB 2.700 . 3.000 2.265 2.178 2.339 . 0 0 "[ . 1 . 2]" 1
1731 1 58 ALA H 1 59 ASN H 4.630 . 4.930 4.553 4.447 4.614 . 0 0 "[ . 1 . 2]" 1
1732 1 58 ALA HA 1 59 ASN HA 4.930 . 5.230 4.400 4.316 4.471 . 0 0 "[ . 1 . 2]" 1
1733 1 58 ALA HA 1 59 ASN QB 4.870 . 5.170 4.245 3.925 4.569 . 0 0 "[ . 1 . 2]" 1
1734 1 58 ALA HA 1 59 ASN H 2.950 . 3.250 2.346 2.219 2.428 . 0 0 "[ . 1 . 2]" 1
1735 1 58 ALA MB 1 59 ASN H 3.380 . 3.680 2.305 2.210 2.434 . 0 0 "[ . 1 . 2]" 1
1736 1 58 ALA MB 1 59 ASN QB 4.690 . 4.990 4.370 4.212 4.503 . 0 0 "[ . 1 . 2]" 1
1737 1 58 ALA H 1 60 SER H 5.360 . 5.660 5.050 4.861 5.215 . 0 0 "[ . 1 . 2]" 1
1738 1 58 ALA HA 1 60 SER H 4.500 . 4.800 3.902 3.812 3.997 . 0 0 "[ . 1 . 2]" 1
1739 1 58 ALA MB 1 60 SER H 3.160 . 3.460 2.281 2.185 2.426 . 0 0 "[ . 1 . 2]" 1
1740 1 58 ALA MB 1 60 SER QB 5.420 . 5.720 4.308 3.783 4.820 . 0 0 "[ . 1 . 2]" 1
1741 1 58 ALA MB 1 60 SER HA 4.930 . 5.230 4.510 4.312 4.726 . 0 0 "[ . 1 . 2]" 1
1742 1 58 ALA MB 1 61 ARG HA 4.870 . 5.170 3.918 3.764 4.072 . 0 0 "[ . 1 . 2]" 1
1743 1 58 ALA H 1 63 GLU HG2 5.390 . 5.690 5.163 4.668 5.768 0.078 19 0 "[ . 1 . 2]" 1
1744 1 58 ALA H 1 63 GLU QB 5.500 . 5.800 5.678 5.382 5.818 0.018 18 0 "[ . 1 . 2]" 1
1745 1 58 ALA HA 1 63 GLU QB 4.000 . 4.300 4.047 3.818 4.300 . 0 0 "[ . 1 . 2]" 1
1746 1 58 ALA HA 1 63 GLU HG2 4.210 . 4.510 3.012 2.802 3.226 . 0 0 "[ . 1 . 2]" 1
1747 1 58 ALA HA 1 63 GLU HG3 4.140 . 4.440 4.211 3.512 4.504 0.064 14 0 "[ . 1 . 2]" 1
1748 1 58 ALA MB 1 63 GLU H 4.040 . 4.340 3.992 3.785 4.142 . 0 0 "[ . 1 . 2]" 1
1749 1 58 ALA MB 1 63 GLU HG2 3.600 . 3.900 2.212 1.923 2.816 . 0 0 "[ . 1 . 2]" 1
1750 1 58 ALA MB 1 63 GLU HG3 3.970 . 4.270 3.226 2.357 3.666 . 0 0 "[ . 1 . 2]" 1
1751 1 58 ALA MB 1 63 GLU QB 3.250 . 3.550 2.241 1.928 2.431 . 0 0 "[ . 1 . 2]" 1
1752 1 58 ALA H 1 64 TYR HB2 4.550 . 4.850 3.481 3.306 3.607 . 0 0 "[ . 1 . 2]" 1
1753 1 58 ALA H 1 64 TYR HB3 4.380 . 4.680 4.571 4.364 4.693 0.013 20 0 "[ . 1 . 2]" 1
1754 1 58 ALA HA 1 64 TYR HA 4.870 . 5.170 4.664 4.485 4.839 . 0 0 "[ . 1 . 2]" 1
1755 1 58 ALA MB 1 64 TYR HA 3.240 . 3.540 2.251 2.089 2.408 . 0 0 "[ . 1 . 2]" 1
1756 1 58 ALA MB 1 64 TYR H 3.420 . 3.720 2.541 2.469 2.599 . 0 0 "[ . 1 . 2]" 1
1757 1 58 ALA MB 1 64 TYR QD . . 4.210 3.683 3.615 3.745 . 0 0 "[ . 1 . 2]" 1
1758 1 58 ALA MB 1 64 TYR HB3 3.670 . 3.970 2.302 2.215 2.378 . 0 0 "[ . 1 . 2]" 1
1759 1 58 ALA MB 1 64 TYR HB2 3.570 . 3.870 2.091 2.014 2.207 . 0 0 "[ . 1 . 2]" 1
1760 1 58 ALA MB 1 65 TYR H 4.350 . 4.650 4.360 4.268 4.464 . 0 0 "[ . 1 . 2]" 1
1761 1 58 ALA MB 1 66 HIS H 5.500 . 5.800 5.319 5.101 5.505 . 0 0 "[ . 1 . 2]" 1
1762 1 58 ALA MB 1 66 HIS QB 5.340 . 5.640 5.419 5.031 5.721 0.081 12 0 "[ . 1 . 2]" 1
1763 1 58 ALA H 1 67 LEU MD1 5.500 . 5.800 4.630 4.052 5.069 . 0 0 "[ . 1 . 2]" 1
1764 1 58 ALA H 1 67 LEU QD 3.860 . 4.160 3.664 3.271 3.998 . 0 0 "[ . 1 . 2]" 1
1765 1 58 ALA H 1 67 LEU MD2 5.500 . 5.800 3.851 3.367 4.199 . 0 0 "[ . 1 . 2]" 1
1766 1 58 ALA HA 1 67 LEU MD2 5.000 . 5.300 3.238 2.996 3.548 . 0 0 "[ . 1 . 2]" 1
1767 1 58 ALA HA 1 67 LEU MD1 5.000 . 5.300 5.031 4.544 5.340 0.040 7 0 "[ . 1 . 2]" 1
1768 1 58 ALA HA 1 67 LEU QD 3.880 . 4.180 3.200 2.958 3.498 . 0 0 "[ . 1 . 2]" 1
1769 1 58 ALA MB 1 67 LEU QD 3.160 . 3.460 2.266 1.953 2.630 . 0 0 "[ . 1 . 2]" 1
1770 1 58 ALA MB 1 67 LEU HG 3.960 . 4.260 3.540 3.061 3.850 . 0 0 "[ . 1 . 2]" 1
1771 1 58 ALA MB 1 67 LEU MD1 3.660 . 3.960 3.465 2.708 3.851 . 0 0 "[ . 1 . 2]" 1
1772 1 58 ALA MB 1 67 LEU MD2 3.660 . 3.960 2.310 1.999 2.683 . 0 0 "[ . 1 . 2]" 1
1773 1 59 ASN H 1 59 ASN HD22 4.350 . 4.650 3.947 3.242 4.711 0.061 14 0 "[ . 1 . 2]" 1
1774 1 59 ASN H 1 59 ASN QB 3.360 . 3.660 2.660 2.470 2.943 . 0 0 "[ . 1 . 2]" 1
1775 1 59 ASN H 1 59 ASN QD 3.720 . 4.020 2.829 2.036 4.079 0.059 1 0 "[ . 1 . 2]" 1
1776 1 59 ASN H 1 59 ASN HB2 4.040 . 4.340 3.285 2.509 3.851 . 0 0 "[ . 1 . 2]" 1
1777 1 59 ASN H 1 59 ASN HD21 4.350 . 4.650 2.980 2.044 4.656 0.006 4 0 "[ . 1 . 2]" 1
1778 1 59 ASN H 1 59 ASN HB3 4.040 . 4.340 3.177 2.562 3.757 . 0 0 "[ . 1 . 2]" 1
1779 1 59 ASN HA 1 59 ASN HD22 5.270 . 5.570 4.902 4.246 5.409 . 0 0 "[ . 1 . 2]" 1
1780 1 59 ASN H 1 60 SER H 3.100 . 3.400 2.219 2.109 2.348 . 0 0 "[ . 1 . 2]" 1
1781 1 59 ASN HB2 1 60 SER H 4.700 . 5.000 4.140 3.566 4.565 . 0 0 "[ . 1 . 2]" 1
1782 1 59 ASN HB3 1 60 SER H 4.700 . 5.000 4.317 4.089 4.490 . 0 0 "[ . 1 . 2]" 1
1783 1 59 ASN QD 1 60 SER H 5.340 . 5.640 4.278 2.878 5.352 . 0 0 "[ . 1 . 2]" 1
1784 1 59 ASN H 1 63 GLU HG2 4.780 . 5.080 3.009 2.280 3.317 . 0 0 "[ . 1 . 2]" 1
1785 1 59 ASN H 1 63 GLU QB 3.760 . 4.060 2.978 2.722 3.118 . 0 0 "[ . 1 . 2]" 1
1786 1 59 ASN H 1 63 GLU HA 5.500 . 5.800 5.801 5.566 5.903 0.103 3 0 "[ . 1 . 2]" 1
1787 1 59 ASN H 1 63 GLU HG3 4.580 . 4.880 4.260 3.673 4.506 . 0 0 "[ . 1 . 2]" 1
1788 1 59 ASN H 1 63 GLU H 5.110 . 5.410 5.276 5.028 5.433 0.023 14 0 "[ . 1 . 2]" 1
1789 1 59 ASN HA 1 63 GLU QB 5.230 . 5.530 5.134 4.818 5.253 . 0 0 "[ . 1 . 2]" 1
1790 1 59 ASN QB 1 63 GLU HG2 4.980 . 5.280 5.050 4.170 5.391 0.111 2 0 "[ . 1 . 2]" 1
1791 1 59 ASN H 1 64 TYR HA 5.500 . 5.800 5.622 5.492 5.733 . 0 0 "[ . 1 . 2]" 1
1792 1 59 ASN H 1 64 TYR H 5.000 . 5.300 4.790 4.684 4.924 . 0 0 "[ . 1 . 2]" 1
1793 1 59 ASN H 1 67 LEU QD 4.480 . 4.780 4.541 4.315 4.786 0.006 7 0 "[ . 1 . 2]" 1
1794 1 60 SER H 1 60 SER QB 3.600 . 3.900 3.098 2.850 3.351 . 0 0 "[ . 1 . 2]" 1
1795 1 60 SER H 1 61 ARG H 4.300 . 4.600 4.221 4.169 4.303 . 0 0 "[ . 1 . 2]" 1
1796 1 60 SER HA 1 61 ARG HG2 5.500 . 5.800 5.850 5.799 5.958 0.158 5 0 "[ . 1 . 2]" 1
1797 1 60 SER HA 1 61 ARG H 3.210 . 3.510 2.286 2.217 2.375 . 0 0 "[ . 1 . 2]" 1
1798 1 60 SER HA 1 61 ARG QD 4.940 . 5.240 3.662 3.432 4.232 . 0 0 "[ . 1 . 2]" 1
1799 1 60 SER QB 1 61 ARG HG2 5.500 . 5.800 5.000 4.783 5.806 0.006 5 0 "[ . 1 . 2]" 1
1800 1 60 SER QB 1 61 ARG HG3 5.500 . 5.800 5.742 4.758 5.974 0.174 9 0 "[ . 1 . 2]" 1
1801 1 60 SER QB 1 61 ARG HB2 5.500 . 5.800 5.649 5.382 5.794 . 0 0 "[ . 1 . 2]" 1
1802 1 60 SER QB 1 61 ARG H 3.220 . 3.520 2.592 2.382 3.049 . 0 0 "[ . 1 . 2]" 1
1803 1 60 SER H 1 62 ASP H 5.090 . 5.390 5.150 4.842 5.367 . 0 0 "[ . 1 . 2]" 1
1804 1 60 SER HA 1 62 ASP H 4.130 . 4.430 4.176 3.939 4.396 . 0 0 "[ . 1 . 2]" 1
1805 1 60 SER QB 1 62 ASP H 4.210 . 4.510 2.724 2.471 2.935 . 0 0 "[ . 1 . 2]" 1
1806 1 60 SER QB 1 62 ASP QB 4.920 . 5.220 3.490 2.593 4.232 . 0 0 "[ . 1 . 2]" 1
1807 1 60 SER H 1 63 GLU HG3 5.400 . 5.700 4.986 4.291 5.434 . 0 0 "[ . 1 . 2]" 1
1808 1 60 SER H 1 63 GLU QB 3.130 . 3.430 2.512 2.078 2.757 . 0 0 "[ . 1 . 2]" 1
1809 1 60 SER H 1 63 GLU HG2 4.270 . 4.570 3.864 3.477 4.112 . 0 0 "[ . 1 . 2]" 1
1810 1 60 SER H 1 63 GLU H 4.050 . 4.350 3.960 3.662 4.136 . 0 0 "[ . 1 . 2]" 1
1811 1 60 SER HA 1 63 GLU H 5.160 . 5.460 4.479 4.260 4.846 . 0 0 "[ . 1 . 2]" 1
1812 1 60 SER QB 1 63 GLU H 5.000 . 5.300 2.695 1.967 3.279 . 0 0 "[ . 1 . 2]" 1
1813 1 60 SER H 1 64 TYR H 3.980 . 4.280 3.648 3.409 3.762 . 0 0 "[ . 1 . 2]" 1
1814 1 61 ARG H 1 61 ARG HB3 3.460 . 3.760 2.735 2.544 3.278 . 0 0 "[ . 1 . 2]" 1
1815 1 61 ARG H 1 61 ARG HG2 4.130 . 4.430 3.593 3.465 3.790 . 0 0 "[ . 1 . 2]" 1
1816 1 61 ARG H 1 61 ARG HB2 3.610 . 3.910 3.724 3.646 3.784 . 0 0 "[ . 1 . 2]" 1
1817 1 61 ARG H 1 61 ARG HG3 4.360 . 4.660 3.897 2.451 4.080 . 0 0 "[ . 1 . 2]" 1
1818 1 61 ARG H 1 61 ARG QD 3.670 . 3.970 1.880 1.765 2.469 0.035 14 0 "[ . 1 . 2]" 1
1819 1 61 ARG HA 1 61 ARG QD 4.560 . 4.860 3.532 3.452 3.724 . 0 0 "[ . 1 . 2]" 1
1820 1 61 ARG HB2 1 61 ARG HD3 3.990 . 4.290 3.655 2.500 3.767 . 0 0 "[ . 1 . 2]" 1
1821 1 61 ARG HB2 1 61 ARG HD2 3.990 . 4.290 3.505 3.172 3.653 . 0 0 "[ . 1 . 2]" 1
1822 1 61 ARG HB2 1 61 ARG HG2 2.600 . 2.900 2.423 2.218 2.500 . 0 0 "[ . 1 . 2]" 1
1823 1 61 ARG H 1 62 ASP H 3.390 . 3.690 2.567 2.461 2.647 . 0 0 "[ . 1 . 2]" 1
1824 1 61 ARG H 1 62 ASP HA 5.500 . 5.800 5.203 5.081 5.286 . 0 0 "[ . 1 . 2]" 1
1825 1 61 ARG H 1 62 ASP QB 4.750 . 5.050 4.494 4.157 4.952 . 0 0 "[ . 1 . 2]" 1
1826 1 61 ARG HA 1 62 ASP HA 5.500 . 5.800 4.778 4.634 4.981 . 0 0 "[ . 1 . 2]" 1
1827 1 61 ARG HB2 1 62 ASP QB 5.150 . 5.450 5.334 4.712 5.484 0.034 11 0 "[ . 1 . 2]" 1
1828 1 61 ARG HB2 1 62 ASP H 4.030 . 4.330 3.963 3.486 4.153 . 0 0 "[ . 1 . 2]" 1
1829 1 61 ARG HB3 1 62 ASP H 4.740 . 5.040 4.059 3.900 4.300 . 0 0 "[ . 1 . 2]" 1
1830 1 61 ARG HG2 1 62 ASP H 4.200 . 4.500 2.847 2.561 4.301 . 0 0 "[ . 1 . 2]" 1
1831 1 61 ARG HG2 1 62 ASP QB 5.100 . 5.400 3.672 3.368 5.238 . 0 0 "[ . 1 . 2]" 1
1832 1 61 ARG HG3 1 62 ASP QB 5.120 . 5.420 5.079 4.908 5.324 . 0 0 "[ . 1 . 2]" 1
1833 1 61 ARG HG3 1 62 ASP H 4.740 . 5.040 4.177 3.845 4.335 . 0 0 "[ . 1 . 2]" 1
1834 1 61 ARG QD 1 62 ASP HA 5.340 . 5.640 4.166 3.246 4.673 . 0 0 "[ . 1 . 2]" 1
1835 1 61 ARG QD 1 62 ASP H 3.820 . 4.120 1.980 1.825 2.393 . 0 0 "[ . 1 . 2]" 1
1836 1 61 ARG H 1 63 GLU H 4.630 . 4.930 4.016 3.783 4.412 . 0 0 "[ . 1 . 2]" 1
1837 1 61 ARG HA 1 63 GLU H 4.650 . 4.950 4.088 3.931 4.259 . 0 0 "[ . 1 . 2]" 1
1838 1 61 ARG QD 1 63 GLU H 5.340 . 5.640 4.271 3.956 4.617 . 0 0 "[ . 1 . 2]" 1
1839 1 61 ARG H 1 64 TYR H 5.170 . 5.470 4.653 4.545 4.826 . 0 0 "[ . 1 . 2]" 1
1840 1 61 ARG HA 1 64 TYR QD 4.410 . 4.710 1.883 1.797 1.954 0.003 9 0 "[ . 1 . 2]" 1
1841 1 61 ARG HA 1 64 TYR HB2 5.000 . 5.300 4.138 3.970 4.445 . 0 0 "[ . 1 . 2]" 1
1842 1 61 ARG HA 1 64 TYR HB3 4.230 . 4.530 2.476 2.320 2.804 . 0 0 "[ . 1 . 2]" 1
1843 1 61 ARG HA 1 64 TYR H 4.040 . 4.340 3.086 2.975 3.242 . 0 0 "[ . 1 . 2]" 1
1844 1 61 ARG HD2 1 64 TYR QD 5.000 . 5.300 5.428 5.301 5.490 0.190 20 0 "[ . 1 . 2]" 1
1845 1 61 ARG HD3 1 64 TYR QD 5.000 . 5.300 5.242 5.109 5.318 0.018 2 0 "[ . 1 . 2]" 1
1846 1 61 ARG HG2 1 64 TYR QE 5.250 . 5.550 4.959 4.606 5.156 . 0 0 "[ . 1 . 2]" 1
1847 1 61 ARG HG3 1 64 TYR QE 5.190 . 5.490 4.996 4.697 5.543 0.053 5 0 "[ . 1 . 2]" 1
1848 1 61 ARG QD 1 64 TYR QD 5.340 . 5.640 4.747 4.672 4.790 . 0 0 "[ . 1 . 2]" 1
1849 1 61 ARG HA 1 65 TYR H 4.260 . 4.560 3.650 3.559 3.764 . 0 0 "[ . 1 . 2]" 1
1850 1 61 ARG HG2 1 65 TYR HD2 5.500 . 5.800 5.033 4.615 5.883 0.083 5 0 "[ . 1 . 2]" 1
1851 1 62 ASP H 1 62 ASP QB 2.790 . 3.090 2.370 2.166 2.685 . 0 0 "[ . 1 . 2]" 1
1852 1 62 ASP H 1 63 GLU H 3.350 . 3.650 2.560 2.419 2.702 . 0 0 "[ . 1 . 2]" 1
1853 1 62 ASP H 1 63 GLU QB 5.130 . 5.430 4.307 4.178 4.400 . 0 0 "[ . 1 . 2]" 1
1854 1 62 ASP QB 1 63 GLU H 3.300 . 3.600 2.919 2.228 3.603 0.003 13 0 "[ . 1 . 2]" 1
1855 1 62 ASP QB 1 63 GLU QB 5.500 . 5.800 4.259 3.449 4.850 . 0 0 "[ . 1 . 2]" 1
1856 1 62 ASP H 1 64 TYR H 4.410 . 4.710 4.093 3.929 4.221 . 0 0 "[ . 1 . 2]" 1
1857 1 62 ASP HA 1 64 TYR QD 5.090 . 5.390 4.851 4.619 5.157 . 0 0 "[ . 1 . 2]" 1
1858 1 62 ASP HA 1 64 TYR H 5.500 . 5.800 4.563 4.387 4.705 . 0 0 "[ . 1 . 2]" 1
1859 1 62 ASP QB 1 64 TYR H 5.160 . 5.460 4.985 4.535 5.348 . 0 0 "[ . 1 . 2]" 1
1860 1 62 ASP H 1 65 TYR QB 4.850 . 5.150 4.245 4.105 4.459 . 0 0 "[ . 1 . 2]" 1
1861 1 62 ASP HA 1 65 TYR HE2 5.000 . 5.300 5.418 5.117 5.510 0.210 15 0 "[ . 1 . 2]" 1
1862 1 62 ASP HA 1 65 TYR QB 4.040 . 4.340 2.231 2.023 2.816 . 0 0 "[ . 1 . 2]" 1
1863 1 62 ASP HA 1 65 TYR HD2 4.050 . 4.350 3.678 2.825 4.062 . 0 0 "[ . 1 . 2]" 1
1864 1 62 ASP HA 1 65 TYR H 3.850 . 4.150 3.563 3.328 3.962 . 0 0 "[ . 1 . 2]" 1
1865 1 62 ASP QB 1 65 TYR QB 4.830 . 5.130 3.979 3.591 4.505 . 0 0 "[ . 1 . 2]" 1
1866 1 62 ASP QB 1 65 TYR HD2 5.230 . 5.530 5.120 3.733 5.570 0.040 2 0 "[ . 1 . 2]" 1
1867 1 62 ASP QB 1 65 TYR H 5.160 . 5.460 5.036 4.911 5.167 . 0 0 "[ . 1 . 2]" 1
1868 1 62 ASP QB 1 66 HIS H 5.500 . 5.800 4.985 4.647 5.368 . 0 0 "[ . 1 . 2]" 1
1869 1 63 GLU H 1 63 GLU HG3 4.560 . 4.860 4.496 4.379 4.580 . 0 0 "[ . 1 . 2]" 1
1870 1 63 GLU H 1 63 GLU HG2 4.750 . 5.050 4.404 4.183 4.720 . 0 0 "[ . 1 . 2]" 1
1871 1 63 GLU H 1 63 GLU QB 2.980 . 3.280 2.229 2.094 2.307 . 0 0 "[ . 1 . 2]" 1
1872 1 63 GLU HA 1 63 GLU HG3 3.140 . 3.440 2.756 2.617 3.049 . 0 0 "[ . 1 . 2]" 1
1873 1 63 GLU H 1 64 TYR H 3.590 . 3.890 2.629 2.478 2.759 . 0 0 "[ . 1 . 2]" 1
1874 1 63 GLU H 1 64 TYR HB3 4.970 . 5.270 4.428 4.237 4.543 . 0 0 "[ . 1 . 2]" 1
1875 1 63 GLU HG2 1 64 TYR H 4.970 . 5.270 3.671 3.251 4.471 . 0 0 "[ . 1 . 2]" 1
1876 1 63 GLU HG3 1 64 TYR HA 4.120 . 4.420 4.193 3.417 4.506 0.086 11 0 "[ . 1 . 2]" 1
1877 1 63 GLU HG3 1 64 TYR H 4.900 . 5.200 4.131 3.478 4.416 . 0 0 "[ . 1 . 2]" 1
1878 1 63 GLU QB 1 64 TYR HA 4.370 . 4.670 4.182 3.934 4.311 . 0 0 "[ . 1 . 2]" 1
1879 1 63 GLU QB 1 64 TYR HB3 4.870 . 5.170 4.023 3.744 4.249 . 0 0 "[ . 1 . 2]" 1
1880 1 63 GLU QB 1 64 TYR H 3.610 . 3.910 2.511 2.290 2.687 . 0 0 "[ . 1 . 2]" 1
1881 1 63 GLU QB 1 64 TYR HB2 5.370 . 5.670 4.873 4.563 5.068 . 0 0 "[ . 1 . 2]" 1
1882 1 63 GLU H 1 65 TYR QB 5.030 . 5.330 4.290 4.051 4.580 . 0 0 "[ . 1 . 2]" 1
1883 1 63 GLU H 1 65 TYR H 4.430 . 4.730 4.003 3.832 4.213 . 0 0 "[ . 1 . 2]" 1
1884 1 63 GLU QB 1 65 TYR H 4.780 . 5.080 4.677 4.519 4.880 . 0 0 "[ . 1 . 2]" 1
1885 1 63 GLU H 1 66 HIS QB 5.340 . 5.640 4.668 4.316 5.087 . 0 0 "[ . 1 . 2]" 1
1886 1 63 GLU H 1 66 HIS H 4.560 . 4.860 4.461 4.296 4.627 . 0 0 "[ . 1 . 2]" 1
1887 1 63 GLU HA 1 66 HIS H 4.750 . 4.800 3.327 3.050 3.607 . 0 0 "[ . 1 . 2]" 1
1888 1 63 GLU HA 1 66 HIS QB 3.590 . 3.890 2.528 2.103 2.970 . 0 0 "[ . 1 . 2]" 1
1889 1 63 GLU HG3 1 66 HIS QB 5.340 . 5.640 4.069 3.492 4.828 . 0 0 "[ . 1 . 2]" 1
1890 1 63 GLU QB 1 66 HIS H 5.500 . 5.800 4.843 4.676 4.984 . 0 0 "[ . 1 . 2]" 1
1891 1 63 GLU HG2 1 67 LEU MD1 5.000 . 5.300 4.981 4.638 5.322 0.022 4 0 "[ . 1 . 2]" 1
1892 1 63 GLU HG2 1 67 LEU HB3 5.110 . 5.410 4.809 4.321 5.467 0.057 8 0 "[ . 1 . 2]" 1
1893 1 63 GLU HG2 1 67 LEU QD 3.130 . 3.430 2.679 2.217 3.446 0.016 16 0 "[ . 1 . 2]" 1
1894 1 63 GLU HG3 1 67 LEU QD 3.820 . 4.120 2.571 2.380 2.706 . 0 0 "[ . 1 . 2]" 1
1895 1 63 GLU HG3 1 67 LEU MD1 5.000 . 5.300 4.933 3.997 5.359 0.059 17 0 "[ . 1 . 2]" 1
1896 1 63 GLU HG3 1 67 LEU H 4.920 . 5.220 4.203 3.785 4.439 . 0 0 "[ . 1 . 2]" 1
1897 1 63 GLU HG3 1 67 LEU HB3 4.770 . 5.070 3.939 3.637 4.194 . 0 0 "[ . 1 . 2]" 1
1898 1 64 TYR H 1 64 TYR HB2 3.600 . 3.900 3.247 3.175 3.365 . 0 0 "[ . 1 . 2]" 1
1899 1 64 TYR H 1 64 TYR QD 3.750 . 4.050 3.333 3.193 3.430 . 0 0 "[ . 1 . 2]" 1
1900 1 64 TYR H 1 64 TYR HB3 3.480 . 3.780 2.047 2.020 2.118 . 0 0 "[ . 1 . 2]" 1
1901 1 64 TYR H 1 64 TYR QE 5.160 . 5.460 5.506 5.404 5.556 0.096 20 0 "[ . 1 . 2]" 1
1902 1 64 TYR H 1 65 TYR QB 5.020 . 5.320 4.016 3.906 4.149 . 0 0 "[ . 1 . 2]" 1
1903 1 64 TYR H 1 65 TYR H 3.680 . 3.980 2.582 2.504 2.701 . 0 0 "[ . 1 . 2]" 1
1904 1 64 TYR HB2 1 65 TYR H 4.210 . 4.510 4.096 4.027 4.154 . 0 0 "[ . 1 . 2]" 1
1905 1 64 TYR HB3 1 65 TYR H 3.700 . 4.000 3.163 3.038 3.273 . 0 0 "[ . 1 . 2]" 1
1906 1 64 TYR QD 1 65 TYR HA 5.030 . 5.330 4.065 3.856 4.181 . 0 0 "[ . 1 . 2]" 1
1907 1 64 TYR QD 1 65 TYR QB . . 4.510 3.406 3.162 3.688 . 0 0 "[ . 1 . 2]" 1
1908 1 64 TYR QD 1 65 TYR H 3.590 . 3.890 2.720 2.612 2.778 . 0 0 "[ . 1 . 2]" 1
1909 1 64 TYR QE 1 65 TYR QB 4.500 . 4.800 3.785 3.592 4.066 . 0 0 "[ . 1 . 2]" 1
1910 1 64 TYR QE 1 65 TYR HA 4.060 . 4.360 4.233 4.036 4.378 0.018 5 0 "[ . 1 . 2]" 1
1911 1 64 TYR H 1 66 HIS QB 5.140 . 5.440 4.870 4.443 5.207 . 0 0 "[ . 1 . 2]" 1
1912 1 64 TYR H 1 66 HIS H 4.630 . 4.930 3.996 3.858 4.122 . 0 0 "[ . 1 . 2]" 1
1913 1 64 TYR QD 1 66 HIS H 5.130 . 5.430 5.200 5.147 5.243 . 0 0 "[ . 1 . 2]" 1
1914 1 64 TYR H 1 67 LEU QD 4.400 . 4.700 4.081 3.943 4.249 . 0 0 "[ . 1 . 2]" 1
1915 1 64 TYR H 1 67 LEU HG 4.990 . 5.290 4.545 4.064 4.834 . 0 0 "[ . 1 . 2]" 1
1916 1 64 TYR HA 1 67 LEU QD 2.760 . 3.060 2.334 1.965 2.665 . 0 0 "[ . 1 . 2]" 1
1917 1 64 TYR HA 1 67 LEU MD1 3.790 . 4.090 2.892 2.004 3.390 . 0 0 "[ . 1 . 2]" 1
1918 1 64 TYR HA 1 67 LEU HG 3.020 . 3.320 2.299 2.091 2.442 . 0 0 "[ . 1 . 2]" 1
1919 1 64 TYR HA 1 67 LEU MD2 3.790 . 4.090 2.679 2.362 3.007 . 0 0 "[ . 1 . 2]" 1
1920 1 64 TYR HA 1 67 LEU HB2 5.000 . 5.300 5.116 4.792 5.317 0.017 20 0 "[ . 1 . 2]" 1
1921 1 64 TYR HB2 1 67 LEU HG 4.240 . 4.540 4.386 4.202 4.542 0.002 13 0 "[ . 1 . 2]" 1
1922 1 64 TYR HB3 1 67 LEU QD 4.490 . 4.790 4.298 3.960 4.617 . 0 0 "[ . 1 . 2]" 1
1923 1 64 TYR HA 1 68 LEU H 3.950 . 4.250 3.908 3.796 4.082 . 0 0 "[ . 1 . 2]" 1
1924 1 64 TYR HA 1 68 LEU HB3 4.470 . 4.770 4.337 4.138 4.532 . 0 0 "[ . 1 . 2]" 1
1925 1 64 TYR HB3 1 68 LEU MD2 4.970 . 5.270 4.832 4.725 4.929 . 0 0 "[ . 1 . 2]" 1
1926 1 64 TYR QD 1 68 LEU MD2 4.000 . 4.300 2.985 2.737 3.083 . 0 0 "[ . 1 . 2]" 1
1927 1 64 TYR QE 1 68 LEU HG 5.500 . 5.800 5.131 5.036 5.341 . 0 0 "[ . 1 . 2]" 1
1928 1 64 TYR QE 1 68 LEU MD2 4.870 . 5.170 2.531 2.452 2.685 . 0 0 "[ . 1 . 2]" 1
1929 1 65 TYR H 1 65 TYR QB 3.370 . 3.670 2.058 2.006 2.126 . 0 0 "[ . 1 . 2]" 1
1930 1 65 TYR H 1 66 HIS QB 4.560 . 4.860 4.533 4.183 4.811 . 0 0 "[ . 1 . 2]" 1
1931 1 65 TYR H 1 66 HIS H 3.550 . 3.850 2.719 2.598 2.802 . 0 0 "[ . 1 . 2]" 1
1932 1 65 TYR QB 1 66 HIS H . . 3.980 2.370 2.229 2.580 . 0 0 "[ . 1 . 2]" 1
1933 1 65 TYR HD2 1 66 HIS H 5.180 . 5.480 5.076 4.111 5.481 0.001 3 0 "[ . 1 . 2]" 1
1934 1 65 TYR H 1 67 LEU MD2 5.500 . 5.800 5.392 5.008 5.828 0.028 19 0 "[ . 1 . 2]" 1
1935 1 65 TYR H 1 67 LEU HG 5.280 . 5.580 4.840 4.621 4.982 . 0 0 "[ . 1 . 2]" 1
1936 1 65 TYR H 1 67 LEU H 4.630 . 4.930 4.434 4.259 4.591 . 0 0 "[ . 1 . 2]" 1
1937 1 65 TYR H 1 67 LEU MD1 5.500 . 5.800 5.377 4.519 5.833 0.033 18 0 "[ . 1 . 2]" 1
1938 1 65 TYR HA 1 68 LEU MD1 3.820 . 4.120 3.784 3.382 4.025 . 0 0 "[ . 1 . 2]" 1
1939 1 65 TYR HA 1 68 LEU HG 3.560 . 3.860 2.547 2.269 2.789 . 0 0 "[ . 1 . 2]" 1
1940 1 65 TYR HA 1 68 LEU HB3 4.780 . 5.080 3.917 3.723 4.194 . 0 0 "[ . 1 . 2]" 1
1941 1 65 TYR HA 1 68 LEU HB2 4.990 . 5.290 4.970 4.809 5.170 . 0 0 "[ . 1 . 2]" 1
1942 1 65 TYR HA 1 68 LEU MD2 3.720 . 4.020 2.142 2.018 2.357 . 0 0 "[ . 1 . 2]" 1
1943 1 65 TYR QB 1 68 LEU HG 5.500 . 5.800 4.465 4.255 4.635 . 0 0 "[ . 1 . 2]" 1
1944 1 65 TYR HA 1 69 ALA H 3.850 . 4.150 3.967 3.808 4.097 . 0 0 "[ . 1 . 2]" 1
1945 1 65 TYR HA 1 69 ALA MB 4.590 . 4.890 4.211 4.082 4.374 . 0 0 "[ . 1 . 2]" 1
1946 1 65 TYR HE2 1 69 ALA MB 5.290 . 5.590 5.662 5.493 5.780 0.190 2 0 "[ . 1 . 2]" 1
1947 1 65 TYR HE1 1 69 ALA H 5.120 . 5.420 5.515 5.424 5.606 0.186 4 0 "[ . 1 . 2]" 1
1948 1 65 TYR HD2 2 15 LEU MD1 4.160 . 4.460 4.533 4.218 4.741 0.281 12 0 "[ . 1 . 2]" 1
1949 1 65 TYR HE2 2 15 LEU HB2 5.500 . 5.800 4.663 4.076 5.280 . 0 0 "[ . 1 . 2]" 1
1950 1 66 HIS H 1 66 HIS HB3 3.540 . 3.840 2.849 2.282 3.658 . 0 0 "[ . 1 . 2]" 1
1951 1 66 HIS H 1 66 HIS HB2 3.540 . 3.840 2.499 2.284 2.671 . 0 0 "[ . 1 . 2]" 1
1952 1 66 HIS H 1 66 HIS HD1 4.750 . 5.050 4.462 2.780 5.092 0.042 20 0 "[ . 1 . 2]" 1
1953 1 66 HIS H 1 66 HIS QB 2.800 . 3.100 2.277 2.150 2.443 . 0 0 "[ . 1 . 2]" 1
1954 1 66 HIS HA 1 66 HIS HD2 3.700 . 4.000 2.999 2.320 3.973 . 0 0 "[ . 1 . 2]" 1
1955 1 66 HIS H 1 67 LEU H 3.410 . 3.710 2.774 2.617 2.926 . 0 0 "[ . 1 . 2]" 1
1956 1 66 HIS H 1 67 LEU QD 4.480 . 4.780 4.582 4.315 4.802 0.022 11 0 "[ . 1 . 2]" 1
1957 1 66 HIS H 1 67 LEU HB3 5.500 . 5.800 5.334 5.097 5.690 . 0 0 "[ . 1 . 2]" 1
1958 1 66 HIS HA 1 67 LEU HA 4.830 . 5.130 4.554 4.500 4.595 . 0 0 "[ . 1 . 2]" 1
1959 1 66 HIS QB 1 67 LEU QD 5.170 . 5.470 4.208 3.957 4.512 . 0 0 "[ . 1 . 2]" 1
1960 1 66 HIS QB 1 67 LEU HA 5.030 . 5.330 3.971 3.464 4.320 . 0 0 "[ . 1 . 2]" 1
1961 1 66 HIS QB 1 67 LEU HB3 4.860 . 5.160 3.981 3.650 4.338 . 0 0 "[ . 1 . 2]" 1
1962 1 66 HIS QB 1 67 LEU H 3.500 . 3.800 2.452 2.224 2.760 . 0 0 "[ . 1 . 2]" 1
1963 1 66 HIS H 1 68 LEU MD2 4.860 . 5.160 4.794 4.631 5.034 . 0 0 "[ . 1 . 2]" 1
1964 1 66 HIS H 1 68 LEU H 4.430 . 4.730 4.027 3.841 4.168 . 0 0 "[ . 1 . 2]" 1
1965 1 66 HIS H 1 68 LEU HG 5.500 . 5.800 4.844 4.583 5.028 . 0 0 "[ . 1 . 2]" 1
1966 1 66 HIS HA 1 68 LEU HG 4.920 . 5.220 4.917 4.704 5.187 . 0 0 "[ . 1 . 2]" 1
1967 1 66 HIS HA 1 69 ALA H 4.010 . 4.310 3.489 3.231 3.795 . 0 0 "[ . 1 . 2]" 1
1968 1 66 HIS HA 1 69 ALA MB 3.220 . 3.520 2.480 2.250 2.771 . 0 0 "[ . 1 . 2]" 1
1969 1 66 HIS HD2 1 69 ALA MB 4.770 . 5.070 4.088 3.608 5.077 0.007 18 0 "[ . 1 . 2]" 1
1970 1 66 HIS QB 1 69 ALA MB 4.370 . 4.670 4.194 3.812 4.447 . 0 0 "[ . 1 . 2]" 1
1971 1 66 HIS QB 1 69 ALA H 5.340 . 5.640 4.921 4.777 5.111 . 0 0 "[ . 1 . 2]" 1
1972 1 66 HIS HB2 1 70 GLU HG2 5.500 . 5.800 5.581 5.221 5.903 0.103 9 0 "[ . 1 . 2]" 1
1973 1 66 HIS HB3 1 70 GLU HG2 5.500 . 5.800 4.877 3.775 5.807 0.007 13 0 "[ . 1 . 2]" 1
1974 1 66 HIS QB 1 70 GLU HG3 5.240 . 5.540 4.749 3.155 5.402 . 0 0 "[ . 1 . 2]" 1
1975 1 67 LEU H 1 67 LEU MD2 4.150 . 4.450 3.392 3.112 3.730 . 0 0 "[ . 1 . 2]" 1
1976 1 67 LEU H 1 67 LEU MD1 4.150 . 4.450 3.496 2.888 3.858 . 0 0 "[ . 1 . 2]" 1
1977 1 67 LEU H 1 67 LEU HB3 3.660 . 3.960 2.668 2.504 2.876 . 0 0 "[ . 1 . 2]" 1
1978 1 67 LEU H 1 67 LEU QD 3.280 . 3.580 3.001 2.784 3.130 . 0 0 "[ . 1 . 2]" 1
1979 1 67 LEU H 1 67 LEU HG 3.160 . 3.460 2.297 2.067 2.535 . 0 0 "[ . 1 . 2]" 1
1980 1 67 LEU HB2 1 67 LEU QD 3.060 . 3.360 2.084 2.037 2.122 . 0 0 "[ . 1 . 2]" 1
1981 1 67 LEU H 1 68 LEU H 3.530 . 3.830 2.641 2.582 2.718 . 0 0 "[ . 1 . 2]" 1
1982 1 67 LEU HA 1 68 LEU HA 4.870 . 5.170 4.621 4.550 4.692 . 0 0 "[ . 1 . 2]" 1
1983 1 67 LEU HG 1 68 LEU H 3.500 . 3.800 2.873 2.467 3.447 . 0 0 "[ . 1 . 2]" 1
1984 1 67 LEU QD 1 68 LEU HB3 4.470 . 4.770 2.957 2.525 3.339 . 0 0 "[ . 1 . 2]" 1
1985 1 67 LEU QD 1 68 LEU HB2 3.970 . 4.270 3.897 3.634 4.224 . 0 0 "[ . 1 . 2]" 1
1986 1 67 LEU QD 1 68 LEU MD2 4.090 . 4.390 4.068 3.627 4.379 . 0 0 "[ . 1 . 2]" 1
1987 1 67 LEU QD 1 68 LEU H 4.030 . 4.330 2.528 1.944 2.898 . 0 0 "[ . 1 . 2]" 1
1988 1 67 LEU QD 1 68 LEU HA 4.650 . 4.950 2.922 2.702 3.159 . 0 0 "[ . 1 . 2]" 1
1989 1 67 LEU H 1 69 ALA H 4.340 . 4.640 4.096 3.973 4.280 . 0 0 "[ . 1 . 2]" 1
1990 1 67 LEU HA 1 69 ALA H 5.190 . 5.490 4.313 4.190 4.546 . 0 0 "[ . 1 . 2]" 1
1991 1 67 LEU QD 1 69 ALA H 5.140 . 5.440 4.508 4.167 4.796 . 0 0 "[ . 1 . 2]" 1
1992 1 67 LEU H 1 70 GLU HG2 5.410 . 5.710 4.969 4.449 5.765 0.055 6 0 "[ . 1 . 2]" 1
1993 1 67 LEU HA 1 70 GLU QB 3.050 . 3.350 2.447 2.138 2.822 . 0 0 "[ . 1 . 2]" 1
1994 1 67 LEU HA 1 70 GLU HG3 3.870 . 4.170 2.637 1.971 3.066 . 0 0 "[ . 1 . 2]" 1
1995 1 67 LEU HA 1 71 LYS H 5.320 . 5.620 4.132 3.968 4.262 . 0 0 "[ . 1 . 2]" 1
1996 1 65 TYR HA 1 68 LEU H 4.500 . 4.800 3.940 3.768 4.167 . 0 0 "[ . 1 . 2]" 1
1997 1 68 LEU H 1 68 LEU HB3 3.170 . 3.470 2.342 2.267 2.444 . 0 0 "[ . 1 . 2]" 1
1998 1 68 LEU H 1 68 LEU HB2 3.560 . 3.860 3.589 3.549 3.638 . 0 0 "[ . 1 . 2]" 1
1999 1 68 LEU H 1 68 LEU MD2 4.180 . 4.480 3.478 3.402 3.616 . 0 0 "[ . 1 . 2]" 1
2000 1 68 LEU H 1 68 LEU HG 3.410 . 3.710 2.917 2.671 3.044 . 0 0 "[ . 1 . 2]" 1
2001 1 68 LEU H 1 68 LEU MD1 4.130 . 4.430 4.044 3.905 4.108 . 0 0 "[ . 1 . 2]" 1
2002 1 68 LEU HA 1 68 LEU HG 3.800 . 4.100 3.828 3.799 3.900 . 0 0 "[ . 1 . 2]" 1
2003 1 68 LEU HA 1 68 LEU MD1 3.380 . 3.680 3.407 3.320 3.573 . 0 0 "[ . 1 . 2]" 1
2004 1 68 LEU HA 1 68 LEU MD2 4.370 . 4.670 4.139 4.104 4.156 . 0 0 "[ . 1 . 2]" 1
2005 1 68 LEU HB2 1 68 LEU MD1 3.410 . 3.710 2.193 2.141 2.341 . 0 0 "[ . 1 . 2]" 1
2006 1 68 LEU HB3 1 68 LEU HG 2.980 . 3.280 2.604 2.554 2.627 . 0 0 "[ . 1 . 2]" 1
2007 1 68 LEU H 1 69 ALA H 3.310 . 3.610 2.511 2.463 2.587 . 0 0 "[ . 1 . 2]" 1
2008 1 68 LEU H 1 69 ALA MB 4.300 . 4.600 4.130 4.024 4.186 . 0 0 "[ . 1 . 2]" 1
2009 1 68 LEU HB2 1 69 ALA H 4.110 . 4.410 4.123 3.956 4.255 . 0 0 "[ . 1 . 2]" 1
2010 1 68 LEU HB3 1 69 ALA H 3.730 . 4.030 3.716 3.585 3.884 . 0 0 "[ . 1 . 2]" 1
2011 1 68 LEU HG 1 69 ALA HA 4.390 . 4.690 3.790 3.644 4.128 . 0 0 "[ . 1 . 2]" 1
2012 1 68 LEU HG 1 69 ALA H 4.200 . 4.500 2.263 1.966 2.570 . 0 0 "[ . 1 . 2]" 1
2013 1 68 LEU HG 1 69 ALA MB 3.280 . 3.580 3.305 3.153 3.533 . 0 0 "[ . 1 . 2]" 1
2014 1 68 LEU MD1 1 69 ALA H 3.980 . 4.280 3.061 2.782 3.258 . 0 0 "[ . 1 . 2]" 1
2015 1 68 LEU MD1 1 69 ALA HA 2.950 . 3.250 2.746 2.522 2.930 . 0 0 "[ . 1 . 2]" 1
2016 1 68 LEU MD1 1 69 ALA MB 4.400 . 4.700 3.405 3.115 3.621 . 0 0 "[ . 1 . 2]" 1
2017 1 68 LEU MD2 1 69 ALA H 4.370 . 4.670 3.900 3.656 4.168 . 0 0 "[ . 1 . 2]" 1
2018 1 68 LEU H 1 70 GLU H 4.730 . 5.030 3.853 3.772 3.935 . 0 0 "[ . 1 . 2]" 1
2019 1 68 LEU HA 1 70 GLU H 4.590 . 4.890 4.110 3.913 4.229 . 0 0 "[ . 1 . 2]" 1
2020 1 68 LEU HA 1 70 GLU QB 5.070 . 5.370 4.526 4.240 4.821 . 0 0 "[ . 1 . 2]" 1
2021 1 68 LEU HB2 1 70 GLU H 5.500 . 5.800 5.762 5.607 5.830 0.030 7 0 "[ . 1 . 2]" 1
2022 1 68 LEU MD1 1 70 GLU H 5.130 . 5.430 4.730 4.591 4.826 . 0 0 "[ . 1 . 2]" 1
2023 1 68 LEU HA 1 71 LYS QB 4.200 . 4.500 3.420 2.288 3.959 . 0 0 "[ . 1 . 2]" 1
2024 1 68 LEU HA 1 71 LYS QE 4.930 . 5.230 4.964 4.430 5.325 0.095 9 0 "[ . 1 . 2]" 1
2025 1 68 LEU HA 1 71 LYS H 3.860 . 4.160 3.131 3.035 3.258 . 0 0 "[ . 1 . 2]" 1
2026 1 68 LEU MD1 1 71 LYS H 5.330 . 5.630 4.835 4.734 4.971 . 0 0 "[ . 1 . 2]" 1
2027 1 68 LEU HA 1 72 ILE MG 5.420 . 5.720 4.562 4.390 4.781 . 0 0 "[ . 1 . 2]" 1
2028 1 68 LEU MD1 1 72 ILE H 4.270 . 4.570 3.830 3.656 4.150 . 0 0 "[ . 1 . 2]" 1
2029 1 68 LEU MD1 1 72 ILE HB 3.990 . 4.290 3.127 2.798 3.526 . 0 0 "[ . 1 . 2]" 1
2030 1 68 LEU MD2 1 72 ILE MG 5.190 . 5.490 4.905 4.745 5.081 . 0 0 "[ . 1 . 2]" 1
2031 1 69 ALA H 1 69 ALA MB 2.830 . 3.130 2.195 2.130 2.240 . 0 0 "[ . 1 . 2]" 1
2032 1 69 ALA H 1 70 GLU H 3.300 . 3.600 2.664 2.549 2.853 . 0 0 "[ . 1 . 2]" 1
2033 1 69 ALA H 1 70 GLU HG3 5.480 . 5.780 5.638 4.380 5.873 0.093 12 0 "[ . 1 . 2]" 1
2034 1 69 ALA MB 1 70 GLU H 3.240 . 3.540 2.663 2.501 2.809 . 0 0 "[ . 1 . 2]" 1
2035 1 69 ALA MB 1 70 GLU HA 4.040 . 4.340 4.001 3.901 4.120 . 0 0 "[ . 1 . 2]" 1
2036 1 69 ALA H 1 72 ILE MG 4.650 . 4.950 3.882 3.761 4.035 . 0 0 "[ . 1 . 2]" 1
2037 1 69 ALA H 1 72 ILE HB 5.500 . 5.800 5.624 5.389 5.773 . 0 0 "[ . 1 . 2]" 1
2038 1 69 ALA HA 1 72 ILE HB 3.810 . 4.110 3.869 3.575 3.973 . 0 0 "[ . 1 . 2]" 1
2039 1 69 ALA HA 1 72 ILE QG 5.180 . 5.480 4.886 4.789 4.985 . 0 0 "[ . 1 . 2]" 1
2040 1 69 ALA HA 1 72 ILE MG 3.290 . 3.590 1.806 1.790 1.839 0.010 8 0 "[ . 1 . 2]" 1
2041 1 69 ALA HA 1 72 ILE MD 3.980 . 4.280 3.986 3.850 4.128 . 0 0 "[ . 1 . 2]" 1
2042 1 69 ALA MB 1 72 ILE MG 3.240 . 3.540 3.167 3.107 3.211 . 0 0 "[ . 1 . 2]" 1
2043 1 69 ALA MB 1 72 ILE HB 5.000 . 5.300 5.293 5.048 5.359 0.059 13 0 "[ . 1 . 2]" 1
2044 1 69 ALA MB 1 73 TYR HB2 5.060 . 5.360 4.311 4.061 5.138 . 0 0 "[ . 1 . 2]" 1
2045 1 69 ALA MB 1 73 TYR HB3 5.480 . 5.780 4.756 4.014 5.093 . 0 0 "[ . 1 . 2]" 1
2046 1 69 ALA HA 2 11 LEU QD 4.810 . 5.110 5.083 4.157 5.182 0.072 2 0 "[ . 1 . 2]" 1
2047 1 69 ALA MB 2 12 GLN HB3 4.000 . 4.300 4.062 2.473 4.419 0.119 1 0 "[ . 1 . 2]" 1
2048 1 69 ALA HA 2 15 LEU QD 4.170 . 4.470 2.887 2.511 3.590 . 0 0 "[ . 1 . 2]" 1
2049 1 69 ALA MB 2 15 LEU MD1 4.000 . 4.300 2.436 1.808 3.764 . 0 0 "[ . 1 . 2]" 1
2050 1 70 GLU H 1 70 GLU HG2 3.600 . 3.900 2.424 2.026 3.049 . 0 0 "[ . 1 . 2]" 1
2051 1 70 GLU H 1 70 GLU HG3 3.710 . 4.010 3.432 2.116 3.699 . 0 0 "[ . 1 . 2]" 1
2052 1 70 GLU H 1 70 GLU QB 2.970 . 3.270 2.365 2.162 2.561 . 0 0 "[ . 1 . 2]" 1
2053 1 70 GLU HA 1 70 GLU HG2 3.400 . 3.700 2.761 2.373 3.035 . 0 0 "[ . 1 . 2]" 1
2054 1 70 GLU H 1 71 LYS H 3.310 . 3.610 2.732 2.635 2.901 . 0 0 "[ . 1 . 2]" 1
2055 1 70 GLU HG3 1 71 LYS H 4.710 . 5.010 4.729 3.940 5.015 0.005 15 0 "[ . 1 . 2]" 1
2056 1 70 GLU QB 1 71 LYS QG 4.720 . 5.020 4.562 4.125 5.105 0.085 4 0 "[ . 1 . 2]" 1
2057 1 70 GLU QB 1 71 LYS H 2.970 . 3.270 2.451 2.179 2.651 . 0 0 "[ . 1 . 2]" 1
2058 1 70 GLU H 1 72 ILE MG 4.150 . 4.450 4.006 3.851 4.173 . 0 0 "[ . 1 . 2]" 1
2059 1 70 GLU HG2 1 72 ILE MG 5.500 . 5.800 5.773 5.561 5.930 0.130 9 0 "[ . 1 . 2]" 1
2060 1 70 GLU HA 1 73 TYR HD1 4.640 . 4.940 3.748 3.430 4.152 . 0 0 "[ . 1 . 2]" 1
2061 1 70 GLU HA 1 73 TYR HB3 3.970 . 4.270 2.396 2.145 3.155 . 0 0 "[ . 1 . 2]" 1
2062 1 70 GLU HA 1 73 TYR HB2 3.920 . 4.220 3.349 3.035 4.302 0.082 6 0 "[ . 1 . 2]" 1
2063 1 70 GLU HG2 1 73 TYR HB2 5.500 . 5.800 5.667 5.224 5.955 0.155 6 0 "[ . 1 . 2]" 1
2064 1 70 GLU QB 1 73 TYR HB3 5.500 . 5.800 4.128 3.793 5.086 . 0 0 "[ . 1 . 2]" 1
2065 1 70 GLU HA 1 74 LYS QE 4.960 . 5.260 4.545 3.829 5.168 . 0 0 "[ . 1 . 2]" 1
2066 1 71 LYS H 1 71 LYS QG 3.440 . 3.740 2.697 2.304 3.545 . 0 0 "[ . 1 . 2]" 1
2067 1 71 LYS H 1 71 LYS QB 3.180 . 3.480 2.462 2.036 2.657 . 0 0 "[ . 1 . 2]" 1
2068 1 71 LYS HA 1 71 LYS QD 3.910 . 4.210 3.630 2.983 3.952 . 0 0 "[ . 1 . 2]" 1
2069 1 71 LYS QB 1 71 LYS QE 4.170 . 4.470 2.783 1.909 3.606 . 0 0 "[ . 1 . 2]" 1
2070 1 71 LYS H 1 72 ILE H 3.430 . 3.730 2.625 2.530 2.764 . 0 0 "[ . 1 . 2]" 1
2071 1 71 LYS H 1 72 ILE MG 4.210 . 4.510 3.936 3.797 4.179 . 0 0 "[ . 1 . 2]" 1
2072 1 71 LYS H 1 72 ILE HA 5.420 . 5.720 5.204 5.127 5.292 . 0 0 "[ . 1 . 2]" 1
2073 1 71 LYS HA 1 72 ILE MG 5.200 . 5.500 5.053 4.961 5.186 . 0 0 "[ . 1 . 2]" 1
2074 1 71 LYS HG2 1 72 ILE H 3.900 . 4.200 4.155 4.007 4.232 0.032 20 0 "[ . 1 . 2]" 1
2075 1 71 LYS HG3 1 72 ILE H 3.900 . 4.200 2.557 2.434 2.643 . 0 0 "[ . 1 . 2]" 1
2076 1 71 LYS QD 1 72 ILE HA 3.920 . 4.220 2.715 2.527 2.993 . 0 0 "[ . 1 . 2]" 1
2077 1 71 LYS QD 1 72 ILE QG 4.060 . 4.360 4.106 3.713 4.498 0.138 4 0 "[ . 1 . 2]" 1
2078 1 71 LYS QE 1 72 ILE HA 5.500 . 5.800 3.872 3.393 4.424 . 0 0 "[ . 1 . 2]" 1
2079 1 71 LYS QE 1 72 ILE MG 5.090 . 5.390 5.298 5.009 5.457 0.067 17 0 "[ . 1 . 2]" 1
2080 1 71 LYS QE 1 72 ILE MD 5.500 . 5.800 5.617 4.986 5.903 0.103 16 0 "[ . 1 . 2]" 1
2081 1 71 LYS QG 1 72 ILE MG 3.670 . 3.970 3.957 3.811 4.037 0.067 2 0 "[ . 1 . 2]" 1
2082 1 71 LYS QG 1 72 ILE H 3.380 . 3.680 2.534 2.417 2.618 . 0 0 "[ . 1 . 2]" 1
2083 1 71 LYS H 1 73 TYR H 4.200 . 4.500 3.999 3.889 4.163 . 0 0 "[ . 1 . 2]" 1
2084 1 71 LYS H 1 73 TYR HB3 5.500 . 5.800 4.517 4.264 5.517 . 0 0 "[ . 1 . 2]" 1
2085 1 71 LYS HA 1 74 LYS HG2 4.200 . 4.500 2.129 1.919 2.369 . 0 0 "[ . 1 . 2]" 1
2086 1 71 LYS HA 1 74 LYS HB3 4.000 . 4.300 3.868 3.462 4.242 . 0 0 "[ . 1 . 2]" 1
2087 1 71 LYS HA 1 74 LYS HB2 5.000 . 5.300 4.870 4.704 5.109 . 0 0 "[ . 1 . 2]" 1
2088 1 71 LYS HA 1 74 LYS H 4.450 . 4.750 3.306 3.082 3.631 . 0 0 "[ . 1 . 2]" 1
2089 1 71 LYS HA 1 75 ILE MD 3.610 . 3.910 3.573 3.315 3.781 . 0 0 "[ . 1 . 2]" 1
2090 1 71 LYS HA 1 75 ILE H 4.500 . 4.800 4.146 4.002 4.329 . 0 0 "[ . 1 . 2]" 1
2091 1 71 LYS QB 1 75 ILE MD 3.370 . 3.670 3.328 2.981 3.789 0.119 4 0 "[ . 1 . 2]" 1
2092 1 71 LYS QD 1 75 ILE QG 3.940 . 4.240 3.735 2.875 4.247 0.007 16 0 "[ . 1 . 2]" 1
2093 1 71 LYS QD 1 75 ILE MD 3.660 . 3.960 3.045 1.928 3.898 . 0 0 "[ . 1 . 2]" 1
2094 1 71 LYS QD 1 75 ILE HB 4.150 . 4.450 3.842 3.161 4.215 . 0 0 "[ . 1 . 2]" 1
2095 1 71 LYS QE 1 75 ILE MG 5.500 . 5.800 4.538 4.030 5.398 . 0 0 "[ . 1 . 2]" 1
2096 1 71 LYS QE 1 75 ILE MD 5.000 . 5.300 3.142 2.138 4.184 . 0 0 "[ . 1 . 2]" 1
2097 1 69 ALA HA 1 72 ILE H 4.500 . 4.800 3.535 3.364 3.727 . 0 0 "[ . 1 . 2]" 1
2098 1 72 ILE H 1 72 ILE QG 4.080 . 4.380 3.961 3.871 4.015 . 0 0 "[ . 1 . 2]" 1
2099 1 72 ILE H 1 72 ILE HB 3.180 . 3.480 2.588 2.454 2.667 . 0 0 "[ . 1 . 2]" 1
2100 1 72 ILE H 1 72 ILE MG 3.000 . 3.300 2.137 2.018 2.279 . 0 0 "[ . 1 . 2]" 1
2101 1 72 ILE HA 1 72 ILE QG 2.950 . 3.250 2.386 2.267 2.439 . 0 0 "[ . 1 . 2]" 1
2102 1 72 ILE HA 1 72 ILE MD 3.860 . 4.160 3.853 3.786 3.887 . 0 0 "[ . 1 . 2]" 1
2103 1 72 ILE HA 1 72 ILE MG 3.280 . 3.580 3.216 3.200 3.240 . 0 0 "[ . 1 . 2]" 1
2104 1 72 ILE QG 1 72 ILE MG 2.700 . 3.000 2.336 2.276 2.385 . 0 0 "[ . 1 . 2]" 1
2105 1 72 ILE MD 1 72 ILE MG 2.630 . 2.930 1.811 1.781 1.877 0.019 16 0 "[ . 1 . 2]" 1
2106 1 72 ILE MD 1 73 TYR HA 4.840 . 5.140 5.019 4.646 5.148 0.008 16 0 "[ . 1 . 2]" 1
2107 1 72 ILE MD 1 73 TYR HB2 5.500 . 5.800 5.757 5.548 5.921 0.121 6 0 "[ . 1 . 2]" 1
2108 1 72 ILE QG 1 73 TYR H 4.630 . 4.930 3.854 3.742 3.997 . 0 0 "[ . 1 . 2]" 1
2109 1 72 ILE MG 1 73 TYR HB2 4.480 . 4.780 3.595 3.421 4.183 . 0 0 "[ . 1 . 2]" 1
2110 1 72 ILE MG 1 73 TYR HD1 5.500 . 5.800 5.757 5.609 5.842 0.042 19 0 "[ . 1 . 2]" 1
2111 1 72 ILE MG 1 73 TYR HB3 4.020 . 4.320 3.787 3.062 3.968 . 0 0 "[ . 1 . 2]" 1
2112 1 72 ILE MG 1 73 TYR HA 3.550 . 3.850 3.383 3.220 3.468 . 0 0 "[ . 1 . 2]" 1
2113 1 72 ILE HA 1 75 ILE HB 3.650 . 3.950 2.378 2.260 2.570 . 0 0 "[ . 1 . 2]" 1
2114 1 72 ILE HA 1 75 ILE MG 4.150 . 4.450 3.373 3.124 3.671 . 0 0 "[ . 1 . 2]" 1
2115 1 72 ILE HA 1 75 ILE H 4.420 . 4.720 3.348 3.259 3.431 . 0 0 "[ . 1 . 2]" 1
2116 1 72 ILE HA 1 75 ILE MD 4.020 . 4.320 3.542 3.105 3.853 . 0 0 "[ . 1 . 2]" 1
2117 1 72 ILE HA 1 76 GLN H 4.520 . 4.820 4.152 4.022 4.250 . 0 0 "[ . 1 . 2]" 1
2118 1 72 ILE HA 1 76 GLN HG2 5.060 . 5.360 5.041 4.874 5.248 . 0 0 "[ . 1 . 2]" 1
2119 1 72 ILE HB 1 76 GLN HE21 5.500 . 5.800 4.669 4.491 4.944 . 0 0 "[ . 1 . 2]" 1
2120 1 72 ILE MD 1 76 GLN HB2 5.500 . 5.800 5.837 5.742 5.885 0.085 19 0 "[ . 1 . 2]" 1
2121 1 72 ILE QG 1 76 GLN HG3 4.400 . 4.700 2.673 2.577 2.790 . 0 0 "[ . 1 . 2]" 1
2122 1 72 ILE QG 1 76 GLN HG2 3.760 . 4.060 3.279 3.122 3.449 . 0 0 "[ . 1 . 2]" 1
2123 1 72 ILE MG 1 76 GLN HE21 3.930 . 4.230 2.862 2.609 3.144 . 0 0 "[ . 1 . 2]" 1
2124 1 72 ILE MG 1 76 GLN HE22 4.610 . 4.910 3.811 3.471 4.109 . 0 0 "[ . 1 . 2]" 1
2125 1 72 ILE MG 1 76 GLN HB2 5.500 . 5.800 5.344 5.170 5.480 . 0 0 "[ . 1 . 2]" 1
2126 1 72 ILE MG 1 76 GLN HG2 4.640 . 4.940 4.942 4.721 5.011 0.071 14 0 "[ . 1 . 2]" 1
2127 1 72 ILE MG 1 76 GLN HG3 4.110 . 4.410 3.828 3.629 3.928 . 0 0 "[ . 1 . 2]" 1
2128 1 72 ILE MG 2 11 LEU HG 4.700 . 5.000 4.005 3.447 4.382 . 0 0 "[ . 1 . 2]" 1
2129 1 73 TYR H 1 73 TYR HB3 4.150 . 4.450 2.168 2.047 2.301 . 0 0 "[ . 1 . 2]" 1
2130 1 73 TYR HA 1 73 TYR HD1 4.260 . 4.560 4.197 3.876 4.291 . 0 0 "[ . 1 . 2]" 1
2131 1 73 TYR HA 1 74 LYS HA 4.860 . 5.160 4.663 4.628 4.718 . 0 0 "[ . 1 . 2]" 1
2132 1 73 TYR HB3 1 74 LYS H 3.860 . 4.160 2.535 2.285 3.792 . 0 0 "[ . 1 . 2]" 1
2133 1 73 TYR HB3 1 74 LYS HB3 5.500 . 5.800 4.356 4.003 5.822 0.022 6 0 "[ . 1 . 2]" 1
2134 1 73 TYR HD1 1 74 LYS QE 5.090 . 5.390 3.727 3.345 4.442 . 0 0 "[ . 1 . 2]" 1
2135 1 73 TYR HD1 1 74 LYS HG3 5.500 . 5.800 5.125 4.971 5.303 . 0 0 "[ . 1 . 2]" 1
2136 1 73 TYR HD1 1 74 LYS HA 4.510 . 4.810 2.921 2.480 3.094 . 0 0 "[ . 1 . 2]" 1
2137 1 73 TYR HD1 1 74 LYS HG2 5.380 . 5.680 4.133 3.933 4.515 . 0 0 "[ . 1 . 2]" 1
2138 1 73 TYR HD1 1 74 LYS H 3.960 . 4.260 2.417 2.236 2.627 . 0 0 "[ . 1 . 2]" 1
2139 1 73 TYR HA 1 75 ILE MG 5.380 . 5.680 5.505 5.104 5.628 . 0 0 "[ . 1 . 2]" 1
2140 1 73 TYR HB3 1 75 ILE H 5.500 . 5.800 4.825 4.676 5.598 . 0 0 "[ . 1 . 2]" 1
2141 1 73 TYR H 1 76 GLN HE21 5.100 . 5.400 4.668 4.292 4.906 . 0 0 "[ . 1 . 2]" 1
2142 1 73 TYR HA 1 76 GLN H 4.000 . 4.300 3.648 3.197 3.838 . 0 0 "[ . 1 . 2]" 1
2143 1 73 TYR HA 1 76 GLN HE21 4.970 . 5.270 3.819 3.566 3.996 . 0 0 "[ . 1 . 2]" 1
2144 1 73 TYR HA 1 76 GLN HB2 3.980 . 4.280 3.205 2.939 3.355 . 0 0 "[ . 1 . 2]" 1
2145 1 73 TYR HA 1 76 GLN HB3 4.880 . 5.180 4.768 4.506 4.906 . 0 0 "[ . 1 . 2]" 1
2146 1 73 TYR HA 1 76 GLN HG2 5.000 . 5.150 4.744 4.347 4.936 . 0 0 "[ . 1 . 2]" 1
2147 1 73 TYR HD1 1 76 GLN H 5.500 . 5.800 5.814 5.271 5.880 0.080 14 0 "[ . 1 . 2]" 1
2148 1 73 TYR HA 1 77 LYS HD2 5.220 . 5.520 5.425 4.852 5.579 0.059 7 0 "[ . 1 . 2]" 1
2149 1 73 TYR HA 1 77 LYS QE 4.590 . 4.890 4.468 3.819 4.724 . 0 0 "[ . 1 . 2]" 1
2150 1 73 TYR HA 1 77 LYS H 4.890 . 5.190 4.313 4.031 4.463 . 0 0 "[ . 1 . 2]" 1
2151 1 73 TYR HB3 1 77 LYS HD2 5.500 . 5.800 5.523 4.863 5.918 0.118 6 0 "[ . 1 . 2]" 1
2152 1 73 TYR HD1 1 77 LYS H 5.500 . 5.800 5.576 4.636 5.741 . 0 0 "[ . 1 . 2]" 1
2153 1 73 TYR HE1 1 77 LYS QE 4.280 . 4.580 3.763 3.444 3.940 . 0 0 "[ . 1 . 2]" 1
2154 1 73 TYR HE1 1 77 LYS HE3 4.920 . 5.220 4.123 3.681 5.301 0.081 9 0 "[ . 1 . 2]" 1
2155 1 73 TYR HE1 1 77 LYS HE2 4.920 . 5.220 4.956 3.522 5.331 0.111 8 0 "[ . 1 . 2]" 1
2156 1 73 TYR HB2 2 11 LEU MD2 5.000 . 5.300 3.581 2.097 3.991 . 0 0 "[ . 1 . 2]" 1
2157 1 73 TYR HB3 2 11 LEU MD2 5.000 . 5.300 4.813 3.319 5.168 . 0 0 "[ . 1 . 2]" 1
2158 1 73 TYR QB 2 11 LEU QD 3.190 . 3.490 3.121 2.058 3.422 . 0 0 "[ . 1 . 2]" 1
2159 1 74 LYS H 1 74 LYS HB3 2.900 . 3.200 2.543 2.423 2.592 . 0 0 "[ . 1 . 2]" 1
2160 1 74 LYS H 1 74 LYS QE 4.090 . 4.390 3.492 3.211 3.685 . 0 0 "[ . 1 . 2]" 1
2161 1 74 LYS H 1 74 LYS HB2 3.610 . 3.910 3.641 3.597 3.682 . 0 0 "[ . 1 . 2]" 1
2162 1 74 LYS H 1 74 LYS HG2 3.490 . 3.790 2.325 2.151 2.563 . 0 0 "[ . 1 . 2]" 1
2163 1 74 LYS HA 1 74 LYS QE 4.670 . 4.970 4.312 4.106 4.945 . 0 0 "[ . 1 . 2]" 1
2164 1 74 LYS HA 1 74 LYS HG3 3.710 . 4.010 3.727 3.651 3.784 . 0 0 "[ . 1 . 2]" 1
2165 1 74 LYS HA 1 74 LYS HG2 3.960 . 4.260 3.776 3.722 3.837 . 0 0 "[ . 1 . 2]" 1
2166 1 74 LYS HA 1 74 LYS QD 4.480 . 4.780 4.526 4.476 4.559 . 0 0 "[ . 1 . 2]" 1
2167 1 74 LYS HB2 1 74 LYS QD 3.390 . 3.690 2.493 2.434 2.562 . 0 0 "[ . 1 . 2]" 1
2168 1 74 LYS HB3 1 74 LYS QE 3.640 . 3.940 2.082 1.879 2.846 . 0 0 "[ . 1 . 2]" 1
2169 1 74 LYS HB3 1 74 LYS QD 3.460 . 3.760 2.909 2.822 2.968 . 0 0 "[ . 1 . 2]" 1
2170 1 74 LYS QD 1 74 LYS HG3 2.670 . 2.970 2.168 2.157 2.184 . 0 0 "[ . 1 . 2]" 1
2171 1 74 LYS QE 1 74 LYS HG3 3.420 . 3.720 3.342 3.306 3.491 . 0 0 "[ . 1 . 2]" 1
2172 1 74 LYS H 1 75 ILE H 3.460 . 3.760 2.615 2.552 2.671 . 0 0 "[ . 1 . 2]" 1
2173 1 74 LYS HB2 1 75 ILE H 4.530 . 4.830 4.002 3.883 4.085 . 0 0 "[ . 1 . 2]" 1
2174 1 74 LYS HB3 1 75 ILE H 4.710 . 5.010 4.015 3.919 4.065 . 0 0 "[ . 1 . 2]" 1
2175 1 74 LYS HB3 1 75 ILE MD 4.350 . 4.650 4.532 4.332 4.600 . 0 0 "[ . 1 . 2]" 1
2176 1 74 LYS HG2 1 75 ILE MD 3.490 . 3.790 2.747 2.484 2.868 . 0 0 "[ . 1 . 2]" 1
2177 1 74 LYS HG2 1 75 ILE HB 4.910 . 5.210 4.166 4.082 4.269 . 0 0 "[ . 1 . 2]" 1
2178 1 74 LYS HG2 1 75 ILE MG 5.060 . 5.360 5.423 5.391 5.479 0.119 3 0 "[ . 1 . 2]" 1
2179 1 74 LYS HG3 1 75 ILE HA 4.840 . 5.140 3.426 3.209 3.576 . 0 0 "[ . 1 . 2]" 1
2180 1 74 LYS HG3 1 75 ILE QG 5.190 . 5.490 4.179 3.990 4.244 . 0 0 "[ . 1 . 2]" 1
2181 1 74 LYS HG3 1 75 ILE HB 5.030 . 5.330 4.182 3.930 4.357 . 0 0 "[ . 1 . 2]" 1
2182 1 74 LYS HG3 1 75 ILE H 4.300 . 4.600 2.744 2.588 2.861 . 0 0 "[ . 1 . 2]" 1
2183 1 74 LYS HG3 1 75 ILE MD 3.200 . 3.500 2.099 1.921 2.158 . 0 0 "[ . 1 . 2]" 1
2184 1 74 LYS QE 1 75 ILE MD 3.970 . 4.270 4.232 3.899 4.336 0.066 1 0 "[ . 1 . 2]" 1
2185 1 74 LYS HG2 1 76 GLN H 4.960 . 5.260 5.114 5.000 5.224 . 0 0 "[ . 1 . 2]" 1
2186 1 74 LYS HA 1 77 LYS HB3 4.890 . 5.190 4.682 4.357 4.899 . 0 0 "[ . 1 . 2]" 1
2187 1 74 LYS HA 1 77 LYS HD3 4.380 . 4.680 3.936 3.607 4.179 . 0 0 "[ . 1 . 2]" 1
2188 1 74 LYS HA 1 77 LYS HB2 5.000 . 5.300 4.907 4.592 5.100 . 0 0 "[ . 1 . 2]" 1
2189 1 74 LYS HA 1 77 LYS QE 5.300 . 5.600 3.948 3.166 4.491 . 0 0 "[ . 1 . 2]" 1
2190 1 74 LYS HA 1 77 LYS HG2 4.390 . 4.690 2.287 1.995 2.471 . 0 0 "[ . 1 . 2]" 1
2191 1 74 LYS HA 1 77 LYS H 3.840 . 4.140 3.519 3.410 3.651 . 0 0 "[ . 1 . 2]" 1
2192 1 74 LYS HA 1 77 LYS HG3 4.430 . 4.730 2.705 2.518 2.853 . 0 0 "[ . 1 . 2]" 1
2193 1 74 LYS HB3 1 77 LYS HD2 4.670 . 4.970 4.244 3.658 4.655 . 0 0 "[ . 1 . 2]" 1
2194 1 74 LYS HG3 1 77 LYS HG3 5.500 . 5.800 5.734 5.475 5.833 0.033 1 0 "[ . 1 . 2]" 1
2195 1 74 LYS HA 1 78 GLU H 4.480 . 4.780 3.870 3.789 3.969 . 0 0 "[ . 1 . 2]" 1
2196 1 75 ILE H 1 75 ILE MD 3.290 . 3.590 2.582 2.478 2.645 . 0 0 "[ . 1 . 2]" 1
2197 1 75 ILE H 1 75 ILE HB 3.300 . 3.600 2.140 2.070 2.207 . 0 0 "[ . 1 . 2]" 1
2198 1 75 ILE H 1 75 ILE QG 3.870 . 4.170 3.656 3.617 3.689 . 0 0 "[ . 1 . 2]" 1
2199 1 75 ILE HA 1 75 ILE MG 3.370 . 3.670 2.836 2.788 2.896 . 0 0 "[ . 1 . 2]" 1
2200 1 75 ILE HA 1 75 ILE MD 3.160 . 3.460 2.238 2.094 2.408 . 0 0 "[ . 1 . 2]" 1
2201 1 75 ILE HA 1 75 ILE QG 3.690 . 3.990 2.440 2.377 2.536 . 0 0 "[ . 1 . 2]" 1
2202 1 75 ILE HB 1 75 ILE MD 3.160 . 3.460 2.484 2.443 2.562 . 0 0 "[ . 1 . 2]" 1
2203 1 75 ILE H 1 76 GLN HG2 4.970 . 5.270 5.315 5.283 5.340 0.070 4 0 "[ . 1 . 2]" 1
2204 1 75 ILE HB 1 76 GLN H 3.380 . 3.680 2.993 2.826 3.089 . 0 0 "[ . 1 . 2]" 1
2205 1 75 ILE QG 1 76 GLN HG2 5.500 . 5.800 5.858 5.814 5.890 0.090 13 0 "[ . 1 . 2]" 1
2206 1 75 ILE MG 1 76 GLN HG2 4.700 . 5.000 2.949 2.833 3.064 . 0 0 "[ . 1 . 2]" 1
2207 1 75 ILE MG 1 76 GLN HG3 4.810 . 5.110 3.372 3.219 3.534 . 0 0 "[ . 1 . 2]" 1
2208 1 75 ILE MG 1 76 GLN H 3.160 . 3.460 2.731 2.630 2.819 . 0 0 "[ . 1 . 2]" 1
2209 1 75 ILE MG 1 76 GLN HA 3.180 . 3.480 2.924 2.810 3.013 . 0 0 "[ . 1 . 2]" 1
2210 1 75 ILE MG 1 76 GLN HB2 4.730 . 5.030 4.509 4.395 4.575 . 0 0 "[ . 1 . 2]" 1
2211 1 75 ILE HA 1 77 LYS H 4.980 . 5.280 4.699 4.537 4.824 . 0 0 "[ . 1 . 2]" 1
2212 1 75 ILE MG 1 77 LYS H 4.950 . 5.250 4.797 4.667 4.927 . 0 0 "[ . 1 . 2]" 1
2213 1 75 ILE HA 1 78 GLU H 4.010 . 4.310 3.494 3.268 3.693 . 0 0 "[ . 1 . 2]" 1
2214 1 75 ILE HA 1 78 GLU QG 5.100 . 5.400 4.118 3.605 4.559 . 0 0 "[ . 1 . 2]" 1
2215 1 75 ILE HA 1 78 GLU HB2 3.840 . 4.140 3.012 2.660 3.450 . 0 0 "[ . 1 . 2]" 1
2216 1 75 ILE MD 1 78 GLU HB3 4.840 . 5.140 4.319 3.937 4.781 . 0 0 "[ . 1 . 2]" 1
2217 1 75 ILE MD 1 78 GLU QG 4.460 . 4.760 4.562 4.113 4.888 0.128 6 0 "[ . 1 . 2]" 1
2218 1 75 ILE MD 1 78 GLU HB2 4.160 . 4.460 4.090 3.704 4.489 0.029 4 0 "[ . 1 . 2]" 1
2219 1 75 ILE MG 1 78 GLU H 4.600 . 4.900 4.745 4.609 4.880 . 0 0 "[ . 1 . 2]" 1
2220 1 75 ILE MG 1 78 GLU HB3 4.130 . 4.430 4.325 4.130 4.467 0.037 18 0 "[ . 1 . 2]" 1
2221 1 75 ILE H 1 79 LEU QD 5.210 . 5.510 5.519 5.301 5.580 0.070 13 0 "[ . 1 . 2]" 1
2222 1 75 ILE HA 1 79 LEU H 4.200 . 4.500 3.991 3.791 4.127 . 0 0 "[ . 1 . 2]" 1
2223 1 75 ILE QG 1 79 LEU QD 4.260 . 4.560 4.144 3.796 4.339 . 0 0 "[ . 1 . 2]" 1
2224 1 75 ILE MG 1 79 LEU H 3.880 . 4.180 4.178 4.023 4.224 0.044 2 0 "[ . 1 . 2]" 1
2225 1 75 ILE MG 1 79 LEU QD 2.580 . 2.880 2.307 2.016 2.416 . 0 0 "[ . 1 . 2]" 1
2226 1 75 ILE MG 1 79 LEU HG 3.590 . 3.890 3.868 3.664 3.962 0.072 20 0 "[ . 1 . 2]" 1
2227 1 75 ILE MD 2 41 MET ME 3.670 . 3.970 3.433 2.725 3.996 0.026 19 0 "[ . 1 . 2]" 1
2228 1 75 ILE MG 2 41 MET ME 4.580 . 4.880 2.364 1.944 3.313 . 0 0 "[ . 1 . 2]" 1
2229 1 76 GLN H 1 76 GLN HG2 3.350 . 3.650 3.023 2.917 3.111 . 0 0 "[ . 1 . 2]" 1
2230 1 76 GLN H 1 76 GLN HB2 3.290 . 3.590 2.583 2.515 2.618 . 0 0 "[ . 1 . 2]" 1
2231 1 76 GLN H 1 76 GLN HG3 3.620 . 3.920 2.265 2.171 2.374 . 0 0 "[ . 1 . 2]" 1
2232 1 76 GLN H 1 76 GLN HB3 3.630 . 3.930 3.626 3.595 3.646 . 0 0 "[ . 1 . 2]" 1
2233 1 76 GLN HA 1 76 GLN HE21 5.500 . 5.800 5.127 5.040 5.185 . 0 0 "[ . 1 . 2]" 1
2234 1 76 GLN HA 1 76 GLN HG2 3.680 . 3.980 2.385 2.288 2.476 . 0 0 "[ . 1 . 2]" 1
2235 1 76 GLN HA 1 76 GLN HB3 2.910 . 3.210 2.440 2.423 2.452 . 0 0 "[ . 1 . 2]" 1
2236 1 76 GLN HE22 1 76 GLN HG3 3.900 . 4.200 3.474 3.463 3.504 . 0 0 "[ . 1 . 2]" 1
2237 1 76 GLN H 1 77 LYS HG3 5.500 . 5.800 5.082 4.926 5.409 . 0 0 "[ . 1 . 2]" 1
2238 1 76 GLN H 1 77 LYS H 3.240 . 3.540 2.749 2.645 2.826 . 0 0 "[ . 1 . 2]" 1
2239 1 76 GLN HA 1 77 LYS HG2 5.130 . 5.430 5.346 5.189 5.411 . 0 0 "[ . 1 . 2]" 1
2240 1 76 GLN HB2 1 77 LYS HG2 4.260 . 4.560 3.709 3.536 3.924 . 0 0 "[ . 1 . 2]" 1
2241 1 76 GLN HB2 1 77 LYS HE3 4.830 . 5.130 4.907 4.536 5.005 . 0 0 "[ . 1 . 2]" 1
2242 1 76 GLN HB2 1 77 LYS HE2 4.830 . 5.130 5.158 4.750 5.228 0.098 18 0 "[ . 1 . 2]" 1
2243 1 76 GLN HB2 1 77 LYS H 3.510 . 3.810 2.411 2.301 2.538 . 0 0 "[ . 1 . 2]" 1
2244 1 76 GLN HB2 1 77 LYS QE 4.140 . 4.440 4.473 4.129 4.545 0.105 19 0 "[ . 1 . 2]" 1
2245 1 76 GLN HB2 1 77 LYS HB2 5.500 . 5.800 5.403 5.307 5.545 . 0 0 "[ . 1 . 2]" 1
2246 1 76 GLN HB3 1 77 LYS H 3.820 . 4.120 3.516 3.377 3.677 . 0 0 "[ . 1 . 2]" 1
2247 1 76 GLN HG2 1 77 LYS H 4.670 . 4.970 4.718 4.604 4.806 . 0 0 "[ . 1 . 2]" 1
2248 1 76 GLN HG3 1 77 LYS HG2 5.400 . 5.700 5.285 5.120 5.423 . 0 0 "[ . 1 . 2]" 1
2249 1 76 GLN HG3 1 77 LYS H 4.220 . 4.520 4.096 3.981 4.193 . 0 0 "[ . 1 . 2]" 1
2250 1 76 GLN H 1 78 GLU H 4.230 . 4.530 3.896 3.777 4.028 . 0 0 "[ . 1 . 2]" 1
2251 1 76 GLN H 1 79 LEU H 4.770 . 5.070 4.906 4.725 5.051 . 0 0 "[ . 1 . 2]" 1
2252 1 76 GLN HA 1 79 LEU QD 3.050 . 3.350 2.422 2.168 2.581 . 0 0 "[ . 1 . 2]" 1
2253 1 76 GLN HA 1 79 LEU H 4.190 . 4.490 3.870 3.616 4.132 . 0 0 "[ . 1 . 2]" 1
2254 1 76 GLN HA 1 79 LEU MD1 3.620 . 3.920 3.211 3.016 3.462 . 0 0 "[ . 1 . 2]" 1
2255 1 76 GLN HA 1 79 LEU HB3 4.720 . 5.020 4.767 4.381 5.033 0.013 9 0 "[ . 1 . 2]" 1
2256 1 76 GLN HA 1 79 LEU MD2 3.620 . 3.920 2.513 2.222 2.726 . 0 0 "[ . 1 . 2]" 1
2257 1 76 GLN HB3 1 79 LEU MD1 4.410 . 4.710 4.174 3.691 4.510 . 0 0 "[ . 1 . 2]" 1
2258 1 76 GLN HB3 1 79 LEU MD2 4.410 . 4.710 4.345 3.829 4.628 . 0 0 "[ . 1 . 2]" 1
2259 1 76 GLN HB3 1 79 LEU QD 3.750 . 4.050 3.783 3.346 3.987 . 0 0 "[ . 1 . 2]" 1
2260 1 76 GLN HG2 1 79 LEU QD 4.950 . 5.250 3.542 3.178 3.831 . 0 0 "[ . 1 . 2]" 1
2261 1 76 GLN HG2 1 79 LEU HG 4.850 . 5.150 4.827 4.570 5.135 . 0 0 "[ . 1 . 2]" 1
2262 1 76 GLN HG3 1 79 LEU QD 4.680 . 4.980 4.626 4.335 4.839 . 0 0 "[ . 1 . 2]" 1
2263 1 77 LYS H 1 77 LYS HB2 3.720 . 4.020 3.534 3.498 3.631 . 0 0 "[ . 1 . 2]" 1
2264 1 77 LYS H 1 77 LYS HG2 3.760 . 4.060 1.817 1.745 1.871 0.055 12 0 "[ . 1 . 2]" 1
2265 1 77 LYS H 1 77 LYS HD2 3.790 . 4.090 4.123 3.976 4.169 0.079 11 0 "[ . 1 . 2]" 1
2266 1 77 LYS H 1 77 LYS HG3 3.390 . 3.690 2.911 2.799 3.163 . 0 0 "[ . 1 . 2]" 1
2267 1 77 LYS H 1 77 LYS HB3 3.120 . 3.420 2.663 2.535 2.901 . 0 0 "[ . 1 . 2]" 1
2268 1 77 LYS H 1 77 LYS HD3 4.110 . 4.410 4.512 4.474 4.531 0.121 15 0 "[ . 1 . 2]" 1
2269 1 77 LYS HA 1 77 LYS QE 3.920 . 4.220 3.954 3.843 4.216 . 0 0 "[ . 1 . 2]" 1
2270 1 77 LYS HA 1 77 LYS HG2 3.800 . 4.100 3.656 3.552 3.709 . 0 0 "[ . 1 . 2]" 1
2271 1 77 LYS HB2 1 77 LYS QE 4.390 . 4.690 2.632 2.383 3.021 . 0 0 "[ . 1 . 2]" 1
2272 1 77 LYS HB2 1 77 LYS HD3 3.400 . 3.700 2.530 2.448 2.690 . 0 0 "[ . 1 . 2]" 1
2273 1 77 LYS HB3 1 77 LYS HD3 3.810 . 4.110 3.140 2.883 3.281 . 0 0 "[ . 1 . 2]" 1
2274 1 77 LYS HB3 1 77 LYS QE 3.730 . 4.030 1.868 1.793 2.054 0.007 4 0 "[ . 1 . 2]" 1
2275 1 77 LYS QE 1 77 LYS HG2 3.610 . 3.910 2.687 2.464 3.232 . 0 0 "[ . 1 . 2]" 1
2276 1 77 LYS H 1 78 GLU H 3.310 . 3.610 2.583 2.522 2.642 . 0 0 "[ . 1 . 2]" 1
2277 1 77 LYS HB2 1 78 GLU HB2 5.430 . 5.730 5.708 5.522 5.767 0.037 19 0 "[ . 1 . 2]" 1
2278 1 77 LYS HB3 1 78 GLU H 4.470 . 4.770 4.223 4.146 4.334 . 0 0 "[ . 1 . 2]" 1
2279 1 77 LYS HG2 1 78 GLU HB2 4.500 . 4.800 4.820 4.552 4.879 0.079 1 0 "[ . 1 . 2]" 1
2280 1 77 LYS HG3 1 78 GLU HB2 4.300 . 4.600 3.965 3.668 4.458 . 0 0 "[ . 1 . 2]" 1
2281 1 77 LYS HG3 1 78 GLU H 4.190 . 4.490 2.724 2.430 3.154 . 0 0 "[ . 1 . 2]" 1
2282 1 77 LYS HG3 1 78 GLU HA 4.560 . 4.860 3.892 3.656 4.285 . 0 0 "[ . 1 . 2]" 1
2283 1 77 LYS HG2 1 79 LEU H 5.410 . 5.710 5.639 5.385 5.733 0.023 2 0 "[ . 1 . 2]" 1
2284 1 77 LYS HA 1 80 GLU H 3.770 . 4.070 3.183 2.793 3.435 . 0 0 "[ . 1 . 2]" 1
2285 1 77 LYS HB3 1 80 GLU QB 5.500 . 5.800 4.295 3.620 5.737 . 0 0 "[ . 1 . 2]" 1
2286 1 77 LYS HB3 2 11 LEU MD2 5.000 . 5.300 4.712 4.515 4.927 . 0 0 "[ . 1 . 2]" 1
2287 1 77 LYS QB 2 11 LEU QD 3.930 . 4.230 4.330 4.213 4.484 0.254 18 0 "[ . 1 . 2]" 1
2288 1 77 LYS QE 2 11 LEU QD 3.610 . 3.910 3.356 2.887 3.665 . 0 0 "[ . 1 . 2]" 1
2289 1 78 GLU H 1 78 GLU HB3 3.340 . 3.640 2.766 2.400 2.978 . 0 0 "[ . 1 . 2]" 1
2290 1 78 GLU H 1 78 GLU HB2 3.140 . 3.440 2.360 2.187 2.530 . 0 0 "[ . 1 . 2]" 1
2291 1 78 GLU H 1 78 GLU QG 4.230 . 4.530 4.013 3.811 4.094 . 0 0 "[ . 1 . 2]" 1
2292 1 78 GLU HA 1 78 GLU HG2 3.500 . 3.800 3.448 2.439 3.813 0.013 1 0 "[ . 1 . 2]" 1
2293 1 78 GLU HA 1 78 GLU HG3 3.500 . 3.800 2.834 2.266 3.691 . 0 0 "[ . 1 . 2]" 1
2294 1 78 GLU HA 1 78 GLU QG 3.050 . 3.350 2.665 2.227 3.195 . 0 0 "[ . 1 . 2]" 1
2295 1 78 GLU HA 1 78 GLU HB2 2.670 . 2.970 2.589 2.422 2.681 . 0 0 "[ . 1 . 2]" 1
2296 1 78 GLU H 1 79 LEU HB3 5.270 . 5.570 5.313 5.167 5.455 . 0 0 "[ . 1 . 2]" 1
2297 1 78 GLU H 1 79 LEU H 3.420 . 3.720 2.718 2.627 2.801 . 0 0 "[ . 1 . 2]" 1
2298 1 78 GLU HB2 1 79 LEU H 3.720 . 4.020 3.570 3.366 3.802 . 0 0 "[ . 1 . 2]" 1
2299 1 78 GLU HB2 1 79 LEU HB3 5.500 . 5.800 5.626 5.459 5.804 0.004 6 0 "[ . 1 . 2]" 1
2300 1 78 GLU HB3 1 79 LEU H 3.720 . 4.020 2.362 2.193 2.611 . 0 0 "[ . 1 . 2]" 1
2301 1 78 GLU QG 1 79 LEU H 4.600 . 4.900 3.743 3.267 4.250 . 0 0 "[ . 1 . 2]" 1
2302 1 78 GLU H 1 81 GLU HG2 5.500 . 5.800 4.347 4.134 4.536 . 0 0 "[ . 1 . 2]" 1
2303 1 78 GLU HA 1 81 GLU HG2 3.730 . 4.030 2.410 2.005 2.926 . 0 0 "[ . 1 . 2]" 1
2304 1 78 GLU HB3 1 82 LYS HG2 4.510 . 4.810 4.829 4.665 4.898 0.088 8 0 "[ . 1 . 2]" 1
2305 1 78 GLU QG 1 82 LYS QB 4.150 . 4.450 3.735 3.192 4.499 0.049 15 0 "[ . 1 . 2]" 1
2306 1 78 GLU QG 1 82 LYS HG3 5.340 . 5.640 4.172 3.135 4.884 . 0 0 "[ . 1 . 2]" 1
2307 1 78 GLU HB3 2 44 ILE MD 4.010 . 4.310 4.430 4.345 4.496 0.186 13 0 "[ . 1 . 2]" 1
2308 1 78 GLU QG 2 44 ILE MD 4.110 . 4.410 3.761 2.890 4.424 0.014 8 0 "[ . 1 . 2]" 1
2309 1 79 LEU H 1 79 LEU HB2 3.680 . 3.980 3.637 3.613 3.658 . 0 0 "[ . 1 . 2]" 1
2310 1 79 LEU H 1 79 LEU MD2 4.190 . 4.490 3.208 3.069 3.362 . 0 0 "[ . 1 . 2]" 1
2311 1 79 LEU H 1 79 LEU HB3 3.520 . 3.820 2.682 2.605 2.738 . 0 0 "[ . 1 . 2]" 1
2312 1 79 LEU H 1 79 LEU HG 3.660 . 3.960 2.219 2.083 2.359 . 0 0 "[ . 1 . 2]" 1
2313 1 79 LEU H 1 79 LEU MD1 4.190 . 4.490 3.630 3.519 3.788 . 0 0 "[ . 1 . 2]" 1
2314 1 79 LEU H 1 79 LEU QD 3.460 . 3.760 3.004 2.940 3.083 . 0 0 "[ . 1 . 2]" 1
2315 1 79 LEU HA 1 79 LEU MD1 4.170 . 4.470 3.728 3.681 3.763 . 0 0 "[ . 1 . 2]" 1
2316 1 79 LEU HA 1 79 LEU QD 3.400 . 3.700 3.442 3.417 3.470 . 0 0 "[ . 1 . 2]" 1
2317 1 79 LEU HA 1 79 LEU HB3 2.770 . 3.070 2.393 2.355 2.431 . 0 0 "[ . 1 . 2]" 1
2318 1 79 LEU HA 1 79 LEU MD2 4.170 . 4.470 4.044 3.985 4.079 . 0 0 "[ . 1 . 2]" 1
2319 1 79 LEU HA 1 79 LEU HG 4.070 . 4.370 3.729 3.676 3.765 . 0 0 "[ . 1 . 2]" 1
2320 1 79 LEU HB2 1 79 LEU QD 2.800 . 3.100 2.120 2.094 2.139 . 0 0 "[ . 1 . 2]" 1
2321 1 79 LEU HB2 1 79 LEU MD1 3.360 . 3.660 2.244 2.203 2.272 . 0 0 "[ . 1 . 2]" 1
2322 1 79 LEU HB2 1 79 LEU MD2 3.360 . 3.660 2.611 2.533 2.640 . 0 0 "[ . 1 . 2]" 1
2323 1 79 LEU H 1 80 GLU H 3.070 . 3.370 2.659 2.522 2.740 . 0 0 "[ . 1 . 2]" 1
2324 1 79 LEU HB2 1 80 GLU H 3.930 . 4.230 3.824 3.728 3.952 . 0 0 "[ . 1 . 2]" 1
2325 1 79 LEU HG 1 80 GLU H 3.310 . 3.610 2.486 2.173 2.749 . 0 0 "[ . 1 . 2]" 1
2326 1 79 LEU HG 1 80 GLU QB 3.960 . 4.260 4.031 3.273 4.357 0.097 12 0 "[ . 1 . 2]" 1
2327 1 79 LEU HG 1 80 GLU QG 4.680 . 4.980 3.883 2.942 5.116 0.136 20 0 "[ . 1 . 2]" 1
2328 1 79 LEU MD1 1 80 GLU H 4.280 . 4.580 2.400 2.271 2.628 . 0 0 "[ . 1 . 2]" 1
2329 1 79 LEU MD2 1 80 GLU H 4.280 . 4.580 4.089 3.855 4.249 . 0 0 "[ . 1 . 2]" 1
2330 1 79 LEU QD 1 80 GLU H 3.540 . 3.840 2.383 2.260 2.600 . 0 0 "[ . 1 . 2]" 1
2331 1 79 LEU QD 1 80 GLU QG 3.800 . 4.100 2.695 1.994 4.103 0.003 20 0 "[ . 1 . 2]" 1
2332 1 79 LEU QD 1 80 GLU HA 2.930 . 3.230 2.645 2.428 2.839 . 0 0 "[ . 1 . 2]" 1
2333 1 79 LEU H 1 81 GLU H 4.640 . 4.940 4.356 4.203 4.466 . 0 0 "[ . 1 . 2]" 1
2334 1 79 LEU QD 1 81 GLU H 4.790 . 5.090 4.561 4.457 4.677 . 0 0 "[ . 1 . 2]" 1
2335 1 79 LEU H 1 82 LYS H 4.960 . 5.260 4.818 4.713 4.948 . 0 0 "[ . 1 . 2]" 1
2336 1 79 LEU HA 1 82 LYS HG2 3.340 . 3.640 2.778 1.983 3.475 . 0 0 "[ . 1 . 2]" 1
2337 1 79 LEU HA 1 82 LYS QE 4.390 . 4.690 3.353 1.903 4.680 . 0 0 "[ . 1 . 2]" 1
2338 1 79 LEU QD 1 83 ARG QB 3.780 . 4.080 3.892 3.590 4.104 0.024 16 0 "[ . 1 . 2]" 1
2339 1 79 LEU QD 1 83 ARG H 5.190 . 5.490 4.805 4.587 4.988 . 0 0 "[ . 1 . 2]" 1
2340 1 79 LEU QB 2 41 MET ME 3.950 . 4.250 2.576 1.926 3.457 . 0 0 "[ . 1 . 2]" 1
2341 1 79 LEU QD 2 41 MET ME 3.360 . 3.660 2.519 1.976 3.115 . 0 0 "[ . 1 . 2]" 1
2342 1 79 LEU QD 2 41 MET QG 3.820 . 4.120 3.052 2.191 4.162 0.042 12 0 "[ . 1 . 2]" 1
2343 1 80 GLU H 1 80 GLU QG 3.210 . 3.510 2.794 2.181 3.620 0.110 6 0 "[ . 1 . 2]" 1
2344 1 80 GLU H 1 80 GLU HG2 3.730 . 4.030 3.479 2.240 4.096 0.066 20 0 "[ . 1 . 2]" 1
2345 1 80 GLU H 1 80 GLU HG3 3.730 . 4.030 3.169 2.360 4.153 0.123 10 0 "[ . 1 . 2]" 1
2346 1 80 GLU H 1 80 GLU QB 2.850 . 3.150 2.218 1.883 2.721 . 0 0 "[ . 1 . 2]" 1
2347 1 80 GLU HA 1 80 GLU HG3 4.010 . 4.310 3.320 2.906 3.761 . 0 0 "[ . 1 . 2]" 1
2348 1 80 GLU HA 1 80 GLU QG 3.400 . 3.700 2.502 2.255 3.347 . 0 0 "[ . 1 . 2]" 1
2349 1 80 GLU HA 1 80 GLU HG2 4.010 . 4.310 2.640 2.283 3.759 . 0 0 "[ . 1 . 2]" 1
2350 1 80 GLU QB 1 81 GLU H 3.390 . 3.690 2.577 2.230 3.569 . 0 0 "[ . 1 . 2]" 1
2351 1 80 GLU HA 2 37 LEU QD 3.980 . 4.280 3.097 1.931 4.345 0.065 7 0 "[ . 1 . 2]" 1
2352 1 80 GLU QG 2 37 LEU QD 3.910 . 4.210 3.615 2.216 4.265 0.055 3 0 "[ . 1 . 2]" 1
2353 1 81 GLU H 1 81 GLU HG2 3.820 . 4.120 2.233 2.129 2.408 . 0 0 "[ . 1 . 2]" 1
2354 1 81 GLU H 1 81 GLU QB 3.310 . 3.610 2.639 2.577 2.709 . 0 0 "[ . 1 . 2]" 1
2355 1 81 GLU H 1 82 LYS H 3.810 . 4.110 2.640 2.547 2.737 . 0 0 "[ . 1 . 2]" 1
2356 1 81 GLU HG2 1 82 LYS QB 4.240 . 4.540 4.351 3.889 4.555 0.015 1 0 "[ . 1 . 2]" 1
2357 1 81 GLU HG2 1 82 LYS H 3.340 . 3.640 2.946 2.789 3.217 . 0 0 "[ . 1 . 2]" 1
2358 1 81 GLU HG3 1 82 LYS HG3 4.910 . 5.210 4.503 3.850 5.254 0.044 9 0 "[ . 1 . 2]" 1
2359 1 81 GLU HG3 1 82 LYS H 2.680 . 2.980 2.501 2.207 2.899 . 0 0 "[ . 1 . 2]" 1
2360 1 81 GLU HA 1 84 ARG H 3.680 . 3.980 3.373 2.897 3.852 . 0 0 "[ . 1 . 2]" 1
2361 1 81 GLU HA 1 84 ARG QB 3.670 . 3.970 2.756 1.956 4.062 0.092 18 0 "[ . 1 . 2]" 1
2362 1 81 GLU QB 1 84 ARG H 4.990 . 5.290 4.900 4.486 5.339 0.049 15 0 "[ . 1 . 2]" 1
2363 1 79 LEU HA 1 82 LYS H 4.500 . 4.800 3.621 3.430 3.889 . 0 0 "[ . 1 . 2]" 1
2364 1 82 LYS H 1 82 LYS HG3 4.400 . 4.700 2.370 2.068 2.956 . 0 0 "[ . 1 . 2]" 1
2365 1 82 LYS H 1 82 LYS QD 5.040 . 5.340 3.876 3.483 4.333 . 0 0 "[ . 1 . 2]" 1
2366 1 82 LYS H 1 82 LYS QB 3.730 . 4.030 2.586 2.315 2.735 . 0 0 "[ . 1 . 2]" 1
2367 1 82 LYS H 1 82 LYS QE 4.940 . 5.240 4.731 4.222 5.261 0.021 20 0 "[ . 1 . 2]" 1
2368 1 82 LYS HA 1 82 LYS HG3 3.670 . 3.970 3.693 3.590 3.806 . 0 0 "[ . 1 . 2]" 1
2369 1 82 LYS HA 1 82 LYS QE 4.960 . 5.260 4.876 3.693 5.406 0.146 7 0 "[ . 1 . 2]" 1
2370 1 82 LYS QE 1 82 LYS HG3 3.560 . 3.860 2.889 2.361 3.506 . 0 0 "[ . 1 . 2]" 1
2371 1 82 LYS QB 1 82 LYS QD 2.620 . 2.920 2.390 1.995 2.787 . 0 0 "[ . 1 . 2]" 1
2372 1 82 LYS QB 1 82 LYS QE 4.040 . 4.340 3.001 1.843 3.745 . 0 0 "[ . 1 . 2]" 1
2373 1 82 LYS H 1 83 ARG H 4.050 . 4.350 2.567 2.470 2.690 . 0 0 "[ . 1 . 2]" 1
2374 1 82 LYS HG3 1 83 ARG HA 4.320 . 4.620 4.453 3.782 4.712 0.092 4 0 "[ . 1 . 2]" 1
2375 1 82 LYS HG3 1 83 ARG H 3.520 . 3.820 2.560 1.786 2.871 0.014 1 0 "[ . 1 . 2]" 1
2376 1 82 LYS QD 1 83 ARG HA 3.200 . 3.500 2.842 2.437 3.535 0.035 1 0 "[ . 1 . 2]" 1
2377 1 82 LYS QD 1 83 ARG H 3.460 . 3.760 2.776 2.271 3.745 . 0 0 "[ . 1 . 2]" 1
2378 1 82 LYS QE 1 83 ARG H 4.710 . 5.010 4.165 3.456 4.761 . 0 0 "[ . 1 . 2]" 1
2379 1 82 LYS QE 1 83 ARG QB 4.170 . 4.470 3.932 2.965 4.673 0.203 13 0 "[ . 1 . 2]" 1
2380 1 82 LYS QE 1 83 ARG HA 5.120 . 5.420 4.309 3.646 5.070 . 0 0 "[ . 1 . 2]" 1
2381 1 82 LYS HA 1 87 LEU QD 4.140 . 4.440 3.634 2.204 4.504 0.064 14 0 "[ . 1 . 2]" 1
2382 1 82 LYS QB 1 87 LEU QD 4.180 . 4.480 3.576 2.036 4.422 . 0 0 "[ . 1 . 2]" 1
2383 1 82 LYS QE 2 44 ILE QG 5.000 . 5.300 4.981 3.802 5.402 0.102 2 0 "[ . 1 . 2]" 1
2384 1 82 LYS QG 2 44 ILE MD 5.210 . 5.510 4.977 4.154 5.546 0.036 9 0 "[ . 1 . 2]" 1
2385 1 80 GLU HA 1 83 ARG H 4.500 . 4.800 3.818 3.346 4.199 . 0 0 "[ . 1 . 2]" 1
2386 1 83 ARG H 1 83 ARG QD 4.510 . 4.810 4.241 3.576 4.686 . 0 0 "[ . 1 . 2]" 1
2387 1 83 ARG H 1 83 ARG QB 2.400 . 2.700 2.254 2.056 2.719 0.019 12 0 "[ . 1 . 2]" 1
2388 1 83 ARG HA 1 83 ARG QG 3.250 . 3.550 2.818 2.423 3.554 0.004 12 0 "[ . 1 . 2]" 1
2389 1 83 ARG HA 1 83 ARG QD 4.180 . 4.480 2.594 1.974 3.715 . 0 0 "[ . 1 . 2]" 1
2390 1 83 ARG QB 1 83 ARG QD 3.200 . 3.500 2.310 2.166 2.419 . 0 0 "[ . 1 . 2]" 1
2391 1 83 ARG HG2 2 37 LEU MD2 5.490 . 5.790 3.368 1.858 5.798 0.008 20 0 "[ . 1 . 2]" 1
2392 1 83 ARG HG2 2 37 LEU MD1 5.490 . 5.790 3.827 2.178 5.737 . 0 0 "[ . 1 . 2]" 1
2393 1 83 ARG HG3 2 37 LEU MD2 5.490 . 5.790 3.757 2.608 5.190 . 0 0 "[ . 1 . 2]" 1
2394 1 83 ARG HG3 2 37 LEU MD1 5.490 . 5.790 4.254 2.960 5.758 . 0 0 "[ . 1 . 2]" 1
2395 1 83 ARG QB 2 37 LEU QD . . 4.030 2.858 2.114 3.684 . 0 0 "[ . 1 . 2]" 1
2396 1 83 ARG QB 2 37 LEU MD2 4.610 . 4.910 3.239 2.130 4.611 . 0 0 "[ . 1 . 2]" 1
2397 1 83 ARG QD 2 37 LEU QB 4.130 . 4.430 3.845 2.828 4.463 0.033 17 0 "[ . 1 . 2]" 1
2398 1 83 ARG QD 2 37 LEU QD . . 3.580 3.030 2.139 3.673 0.093 2 0 "[ . 1 . 2]" 1
2399 1 83 ARG QD 2 37 LEU HG 4.890 . 5.190 3.642 2.015 5.226 0.036 13 0 "[ . 1 . 2]" 1
2400 1 83 ARG QD 2 37 LEU MD1 4.150 . 4.450 3.758 2.155 4.517 0.067 13 0 "[ . 1 . 2]" 1
2401 1 83 ARG QD 2 37 LEU MD2 4.150 . 4.450 3.498 2.456 4.459 0.009 9 0 "[ . 1 . 2]" 1
2402 1 83 ARG QG 2 37 LEU QD . . 3.400 2.519 1.842 3.472 0.072 19 0 "[ . 1 . 2]" 1
2403 1 84 ARG H 1 84 ARG QB 2.520 . 2.820 2.262 2.105 2.788 . 0 0 "[ . 1 . 2]" 1
2404 1 84 ARG HA 1 84 ARG QG 3.230 . 3.530 2.680 2.433 3.352 . 0 0 "[ . 1 . 2]" 1
2405 1 84 ARG HA 1 84 ARG QD 4.530 . 4.830 3.847 2.042 4.491 . 0 0 "[ . 1 . 2]" 1
2406 1 84 ARG QB 1 84 ARG QD 3.220 . 3.520 2.253 1.998 2.842 . 0 0 "[ . 1 . 2]" 1
2407 1 84 ARG HA 1 85 SER HA 4.870 . 5.170 4.861 4.350 5.222 0.052 7 0 "[ . 1 . 2]" 1
2408 1 84 ARG HA 1 85 SER QB 4.590 . 4.890 4.477 4.115 4.960 0.070 19 0 "[ . 1 . 2]" 1
2409 1 84 ARG QB 1 85 SER QB 4.180 . 4.480 4.088 3.571 4.595 0.115 14 0 "[ . 1 . 2]" 1
2410 1 84 ARG QB 1 85 SER HA 4.660 . 4.960 4.325 4.026 4.653 . 0 0 "[ . 1 . 2]" 1
2411 1 84 ARG QB 1 85 SER H 3.090 . 3.390 2.426 1.949 3.482 0.092 18 0 "[ . 1 . 2]" 1
2412 1 84 ARG QD 1 85 SER QB 5.000 . 5.300 4.421 3.424 5.425 0.125 7 0 "[ . 1 . 2]" 1
2413 1 84 ARG QD 1 85 SER H 4.350 . 4.650 4.103 3.617 4.664 0.014 10 0 "[ . 1 . 2]" 1
2414 1 84 ARG QD 1 85 SER HA 5.240 . 5.540 5.470 4.858 5.674 0.134 3 0 "[ . 1 . 2]" 1
2415 1 84 ARG QG 1 85 SER QB 4.050 . 4.350 3.362 2.502 4.338 . 0 0 "[ . 1 . 2]" 1
2416 1 82 LYS HA 1 85 SER H 4.500 . 4.800 3.778 2.862 4.667 . 0 0 "[ . 1 . 2]" 1
2417 1 85 SER H 1 85 SER QB 3.120 . 3.420 3.173 2.861 3.459 0.039 5 0 "[ . 1 . 2]" 1
2418 1 85 SER HA 1 85 SER QB 2.530 . 2.830 2.314 2.133 2.454 . 0 0 "[ . 1 . 2]" 1
2419 1 85 SER H 1 86 ARG HB3 4.340 . 4.640 4.424 3.884 4.701 0.061 20 0 "[ . 1 . 2]" 1
2420 1 85 SER HA 1 86 ARG H 2.780 . 3.080 2.486 2.098 3.282 0.202 10 0 "[ . 1 . 2]" 1
2421 1 85 SER QB 1 86 ARG H 3.970 . 4.270 3.816 2.688 4.042 . 0 0 "[ . 1 . 2]" 1
2422 1 85 SER HA 1 87 LEU H 3.910 . 4.210 3.385 2.816 4.246 0.036 10 0 "[ . 1 . 2]" 1
2423 1 85 SER QB 1 87 LEU H 5.210 . 5.510 4.561 3.479 5.320 . 0 0 "[ . 1 . 2]" 1
2424 1 86 ARG H 1 86 ARG HG3 3.420 . 3.720 3.317 2.742 3.771 0.051 8 0 "[ . 1 . 2]" 1
2425 1 86 ARG H 1 86 ARG HB2 3.940 . 4.240 3.803 3.652 4.116 . 0 0 "[ . 1 . 2]" 1
2426 1 86 ARG H 1 86 ARG HB3 3.080 . 3.380 2.899 2.457 3.437 0.057 16 0 "[ . 1 . 2]" 1
2427 1 86 ARG H 1 86 ARG QD 4.410 . 4.710 4.260 3.549 4.819 0.109 16 0 "[ . 1 . 2]" 1
2428 1 86 ARG H 1 86 ARG HG2 3.460 . 3.760 2.498 1.945 3.301 . 0 0 "[ . 1 . 2]" 1
2429 1 86 ARG HB2 1 86 ARG QD 3.580 . 3.880 2.527 2.172 3.069 . 0 0 "[ . 1 . 2]" 1
2430 1 86 ARG HB3 1 86 ARG HG2 2.770 . 3.070 2.377 2.210 2.478 . 0 0 "[ . 1 . 2]" 1
2431 1 86 ARG H 1 87 LEU H 3.140 . 3.440 2.125 1.749 2.953 0.051 4 0 "[ . 1 . 2]" 1
2432 1 86 ARG HB2 1 87 LEU H 4.170 . 4.470 4.160 4.000 4.308 . 0 0 "[ . 1 . 2]" 1
2433 1 86 ARG HB3 1 87 LEU H 4.020 . 4.320 4.101 3.850 4.332 0.012 19 0 "[ . 1 . 2]" 1
2434 1 86 ARG HG2 1 87 LEU QD 3.320 . 3.620 2.917 2.018 3.670 0.050 16 0 "[ . 1 . 2]" 1
2435 1 86 ARG HG3 1 87 LEU QD 3.150 . 3.450 2.198 1.794 2.647 0.006 6 0 "[ . 1 . 2]" 1
2436 1 86 ARG HG3 1 87 LEU H 2.690 . 2.990 2.937 2.559 3.083 0.093 19 0 "[ . 1 . 2]" 1
2437 1 86 ARG QD 1 87 LEU H 4.650 . 4.950 4.647 4.350 4.891 . 0 0 "[ . 1 . 2]" 1
2438 1 86 ARG QD 1 87 LEU QD 3.480 . 3.780 3.228 2.501 3.735 . 0 0 "[ . 1 . 2]" 1
2439 1 87 LEU H 1 87 LEU QD 3.650 . 3.950 2.652 1.803 3.703 . 0 0 "[ . 1 . 2]" 1
2440 1 87 LEU H 1 87 LEU MD1 4.270 . 4.570 3.167 1.932 4.144 . 0 0 "[ . 1 . 2]" 1
2441 1 87 LEU H 1 87 LEU QB 3.250 . 3.550 2.485 2.218 2.694 . 0 0 "[ . 1 . 2]" 1
2442 1 87 LEU H 1 87 LEU MD2 4.270 . 4.570 3.505 1.812 4.588 0.018 10 0 "[ . 1 . 2]" 1
2443 1 87 LEU HA 1 87 LEU MD2 4.190 . 4.490 3.036 2.090 3.862 . 0 0 "[ . 1 . 2]" 1
2444 1 87 LEU HA 1 87 LEU QD 2.750 . 3.050 2.411 2.027 3.049 . 0 0 "[ . 1 . 2]" 1
2445 1 87 LEU HA 1 87 LEU MD1 4.190 . 4.490 3.084 2.058 3.911 . 0 0 "[ . 1 . 2]" 1
2446 1 87 LEU HA 1 87 LEU HG 3.810 . 4.110 3.090 2.528 3.796 . 0 0 "[ . 1 . 2]" 1
2447 2 5 HIS HA 2 6 TYR H 3.230 . 3.530 2.449 2.012 3.502 . 0 0 "[ . 1 . 2]" 1
2448 2 6 TYR H 2 6 TYR HB3 3.980 . 4.280 3.417 2.591 3.861 . 0 0 "[ . 1 . 2]" 1
2449 2 6 TYR H 2 6 TYR HB2 3.980 . 4.280 2.886 2.387 3.934 . 0 0 "[ . 1 . 2]" 1
2450 2 6 TYR HA 2 7 GLY H 3.120 . 3.420 2.561 2.004 3.480 0.060 9 0 "[ . 1 . 2]" 1
2451 2 6 TYR HB2 2 7 GLY H 4.640 . 4.940 3.736 1.967 4.495 . 0 0 "[ . 1 . 2]" 1
2452 2 6 TYR HB3 2 7 GLY H 4.640 . 4.940 3.717 2.130 4.443 . 0 0 "[ . 1 . 2]" 1
2453 2 6 TYR QB 2 7 GLY H 4.000 . 4.300 3.178 1.957 3.886 . 0 0 "[ . 1 . 2]" 1
2454 2 6 TYR HA 2 8 ASN QD 4.850 . 5.150 4.732 4.022 5.259 0.109 12 0 "[ . 1 . 2]" 1
2455 2 6 TYR HA 2 8 ASN H 4.370 . 4.670 3.673 3.066 4.764 0.094 6 0 "[ . 1 . 2]" 1
2456 2 7 GLY QA 2 8 ASN H 3.400 . 3.700 2.558 2.218 2.900 . 0 0 "[ . 1 . 2]" 1
2457 2 7 GLY QA 2 8 ASN QD 5.250 . 5.550 5.453 4.306 5.726 0.176 4 0 "[ . 1 . 2]" 1
2458 2 7 GLY QA 2 9 GLN H 4.990 . 5.290 3.275 2.836 3.911 . 0 0 "[ . 1 . 2]" 1
2459 2 8 ASN H 2 8 ASN HB2 3.630 . 3.930 3.650 3.545 3.906 . 0 0 "[ . 1 . 2]" 1
2460 2 8 ASN H 2 8 ASN HB3 3.630 . 3.930 2.902 2.466 4.013 0.083 19 0 "[ . 1 . 2]" 1
2461 2 8 ASN HA 2 8 ASN QD 3.960 . 4.260 4.247 3.860 4.317 0.057 1 0 "[ . 1 . 2]" 1
2462 2 8 ASN HA 2 9 GLN QE 4.680 . 4.980 4.955 3.925 5.117 0.137 2 0 "[ . 1 . 2]" 1
2463 2 8 ASN HA 2 9 GLN H 2.780 . 3.080 3.129 2.922 3.236 0.156 4 0 "[ . 1 . 2]" 1
2464 2 8 ASN HB2 2 9 GLN H 5.210 . 5.510 4.163 3.919 4.429 . 0 0 "[ . 1 . 2]" 1
2465 2 8 ASN HB3 2 9 GLN H 5.210 . 5.510 4.273 4.050 4.571 . 0 0 "[ . 1 . 2]" 1
2466 2 8 ASN QB 2 9 GLN H 4.420 . 4.720 3.752 3.575 3.990 . 0 0 "[ . 1 . 2]" 1
2467 2 8 ASN HA 2 10 THR H 3.870 . 4.170 3.978 3.703 4.214 0.044 6 0 "[ . 1 . 2]" 1
2468 2 8 ASN QB 2 10 THR H 5.340 . 5.640 5.166 4.910 5.380 . 0 0 "[ . 1 . 2]" 1
2469 2 8 ASN HA 2 11 LEU H 3.600 . 3.900 3.277 2.961 3.746 . 0 0 "[ . 1 . 2]" 1
2470 2 8 ASN HA 2 12 GLN H 3.950 . 4.250 4.185 3.894 4.338 0.088 1 0 "[ . 1 . 2]" 1
2471 2 9 GLN H 2 9 GLN HB2 3.780 . 4.080 3.189 2.445 3.803 . 0 0 "[ . 1 . 2]" 1
2472 2 9 GLN H 2 9 GLN QE 5.120 . 5.420 3.009 2.625 3.435 . 0 0 "[ . 1 . 2]" 1
2473 2 9 GLN H 2 9 GLN QB 3.160 . 3.460 2.608 2.407 3.011 . 0 0 "[ . 1 . 2]" 1
2474 2 9 GLN H 2 9 GLN HB3 3.780 . 4.080 3.130 2.494 3.688 . 0 0 "[ . 1 . 2]" 1
2475 2 9 GLN H 2 9 GLN QG 3.980 . 4.280 2.566 1.770 3.326 0.030 13 0 "[ . 1 . 2]" 1
2476 2 9 GLN HA 2 9 GLN QE 4.760 . 5.060 4.145 2.365 5.033 . 0 0 "[ . 1 . 2]" 1
2477 2 9 GLN HB2 2 10 THR H 4.260 . 4.560 3.174 2.022 4.185 . 0 0 "[ . 1 . 2]" 1
2478 2 9 GLN HB3 2 10 THR H 4.260 . 4.560 3.870 3.245 4.554 . 0 0 "[ . 1 . 2]" 1
2479 2 9 GLN QB 2 10 THR H 3.570 . 3.870 2.991 2.007 3.869 . 0 0 "[ . 1 . 2]" 1
2480 2 9 GLN QG 2 10 THR H 4.280 . 4.580 3.280 2.097 4.172 . 0 0 "[ . 1 . 2]" 1
2481 2 9 GLN QB 2 11 LEU H 4.980 . 5.280 4.872 4.315 5.296 0.016 1 0 "[ . 1 . 2]" 1
2482 2 9 GLN QG 2 11 LEU H 5.500 . 5.800 5.253 4.043 5.873 0.073 6 0 "[ . 1 . 2]" 1
2483 2 10 THR H 2 10 THR HA 2.940 . 3.240 2.782 2.723 2.843 . 0 0 "[ . 1 . 2]" 1
2484 2 10 THR H 2 10 THR HB 3.320 . 3.620 2.599 2.452 2.788 . 0 0 "[ . 1 . 2]" 1
2485 2 10 THR H 2 10 THR MG 3.290 . 3.590 2.987 1.833 3.686 0.096 10 0 "[ . 1 . 2]" 1
2486 2 10 THR MG 2 11 LEU H 4.290 . 4.590 3.049 2.053 3.674 . 0 0 "[ . 1 . 2]" 1
2487 2 10 THR MG 2 12 GLN H 4.990 . 5.290 4.968 4.290 5.346 0.056 16 0 "[ . 1 . 2]" 1
2488 2 10 THR MG 2 13 ASP H 5.040 . 5.340 5.095 4.749 5.327 . 0 0 "[ . 1 . 2]" 1
2489 2 11 LEU H 2 11 LEU HA 2.880 . 3.180 2.835 2.790 2.868 . 0 0 "[ . 1 . 2]" 1
2490 2 11 LEU H 2 11 LEU QB 2.710 . 3.010 2.301 2.054 2.433 . 0 0 "[ . 1 . 2]" 1
2491 2 11 LEU H 2 11 LEU MD2 4.500 . 4.800 2.304 2.012 3.043 . 0 0 "[ . 1 . 2]" 1
2492 2 11 LEU H 2 11 LEU MD1 4.500 . 4.800 3.755 3.351 4.175 . 0 0 "[ . 1 . 2]" 1
2493 2 11 LEU H 2 11 LEU QD 3.780 . 4.080 2.283 2.000 2.973 . 0 0 "[ . 1 . 2]" 1
2494 2 11 LEU QB 2 12 GLN H 3.270 . 3.570 2.554 2.375 2.825 . 0 0 "[ . 1 . 2]" 1
2495 2 11 LEU MD1 2 12 GLN H 5.030 . 5.330 4.684 4.443 4.809 . 0 0 "[ . 1 . 2]" 1
2496 2 11 LEU MD2 2 12 GLN H 5.030 . 5.330 4.134 3.906 4.562 . 0 0 "[ . 1 . 2]" 1
2497 2 11 LEU QD 2 12 GLN H 4.650 . 4.950 3.870 3.722 4.022 . 0 0 "[ . 1 . 2]" 1
2498 2 11 LEU H 2 13 ASP QB 5.290 . 5.590 4.798 4.311 5.143 . 0 0 "[ . 1 . 2]" 1
2499 2 11 LEU HA 2 13 ASP H 4.910 . 5.210 4.442 4.182 4.753 . 0 0 "[ . 1 . 2]" 1
2500 2 12 GLN H 2 12 GLN QB 3.490 . 3.790 2.622 2.431 2.900 . 0 0 "[ . 1 . 2]" 1
2501 2 12 GLN H 2 12 GLN HA 2.870 . 3.170 2.827 2.802 2.862 . 0 0 "[ . 1 . 2]" 1
2502 2 12 GLN H 2 12 GLN QG 4.030 . 4.330 2.186 2.032 2.573 . 0 0 "[ . 1 . 2]" 1
2503 2 12 GLN H 2 13 ASP QB 4.740 . 5.040 4.428 4.121 4.646 . 0 0 "[ . 1 . 2]" 1
2504 2 12 GLN H 2 13 ASP HA 5.330 . 5.630 5.247 5.130 5.359 . 0 0 "[ . 1 . 2]" 1
2505 2 12 GLN QB 2 13 ASP H 4.060 . 4.360 2.768 2.396 3.761 . 0 0 "[ . 1 . 2]" 1
2506 2 12 GLN QG 2 13 ASP H 4.180 . 4.480 3.842 2.721 4.191 . 0 0 "[ . 1 . 2]" 1
2507 2 12 GLN QG 2 14 LEU H 5.500 . 5.800 5.732 5.160 5.836 0.036 8 0 "[ . 1 . 2]" 1
2508 2 12 GLN H 2 15 LEU QD 4.970 . 5.270 4.318 3.895 4.846 . 0 0 "[ . 1 . 2]" 1
2509 2 12 GLN QE 2 15 LEU QD 4.250 . 4.550 4.139 2.609 4.661 0.111 19 0 "[ . 1 . 2]" 1
2510 2 12 GLN QE 2 15 LEU QB 5.180 . 5.480 4.777 3.851 5.465 . 0 0 "[ . 1 . 2]" 1
2511 2 12 GLN QE 2 15 LEU HB2 5.340 . 5.640 5.042 4.076 5.759 0.119 3 0 "[ . 1 . 2]" 1
2512 2 13 ASP H 2 13 ASP QB 2.690 . 2.990 2.286 2.203 2.563 . 0 0 "[ . 1 . 2]" 1
2513 2 13 ASP H 2 14 LEU H 3.470 . 3.770 2.688 2.550 2.847 . 0 0 "[ . 1 . 2]" 1
2514 2 13 ASP H 2 14 LEU QD 5.330 . 5.630 5.251 4.086 5.639 0.009 3 0 "[ . 1 . 2]" 1
2515 2 13 ASP HA 2 14 LEU H 3.540 . 3.840 3.533 3.511 3.559 . 0 0 "[ . 1 . 2]" 1
2516 2 13 ASP QB 2 14 LEU H 3.180 . 3.480 2.491 2.270 2.712 . 0 0 "[ . 1 . 2]" 1
2517 2 13 ASP QB 2 15 LEU H 4.720 . 5.020 4.757 4.636 5.027 0.007 1 0 "[ . 1 . 2]" 1
2518 2 14 LEU H 2 14 LEU MD2 4.350 . 4.650 3.826 2.245 4.301 . 0 0 "[ . 1 . 2]" 1
2519 2 14 LEU H 2 14 LEU MD1 4.350 . 4.650 3.990 3.645 4.281 . 0 0 "[ . 1 . 2]" 1
2520 2 14 LEU H 2 14 LEU QD 3.570 . 3.870 3.422 2.228 3.764 . 0 0 "[ . 1 . 2]" 1
2521 2 14 LEU H 2 14 LEU QB 2.630 . 2.930 2.294 2.183 2.562 . 0 0 "[ . 1 . 2]" 1
2522 2 14 LEU H 2 15 LEU H 3.940 . 4.240 2.741 2.651 2.860 . 0 0 "[ . 1 . 2]" 1
2523 2 14 LEU QB 2 15 LEU H 2.720 . 3.020 2.420 2.207 2.702 . 0 0 "[ . 1 . 2]" 1
2524 2 14 LEU QD 2 15 LEU H 4.470 . 4.770 3.791 3.182 4.164 . 0 0 "[ . 1 . 2]" 1
2525 2 14 LEU QD 2 17 SER H 4.980 . 5.280 4.887 4.344 5.141 . 0 0 "[ . 1 . 2]" 1
2526 2 15 LEU H 2 15 LEU QD 3.590 . 3.890 2.930 2.315 3.410 . 0 0 "[ . 1 . 2]" 1
2527 2 15 LEU H 2 15 LEU HB2 2.920 . 3.220 2.340 2.208 2.522 . 0 0 "[ . 1 . 2]" 1
2528 2 15 LEU H 2 15 LEU MD2 4.980 . 5.280 3.129 2.331 3.868 . 0 0 "[ . 1 . 2]" 1
2529 2 15 LEU H 2 15 LEU HB3 4.190 . 4.490 3.542 3.459 3.620 . 0 0 "[ . 1 . 2]" 1
2530 2 15 LEU H 2 15 LEU MD1 4.980 . 5.280 3.832 3.627 4.121 . 0 0 "[ . 1 . 2]" 1
2531 2 15 LEU H 2 16 THR H 4.140 . 4.440 2.949 2.761 3.043 . 0 0 "[ . 1 . 2]" 1
2532 2 15 LEU HB2 2 16 THR H 3.720 . 4.020 2.294 1.959 2.629 . 0 0 "[ . 1 . 2]" 1
2533 2 15 LEU HB3 2 16 THR H 3.800 . 4.100 2.867 2.544 3.170 . 0 0 "[ . 1 . 2]" 1
2534 2 15 LEU QD 2 16 THR H 4.330 . 4.630 3.811 3.588 3.961 . 0 0 "[ . 1 . 2]" 1
2535 2 15 LEU HB3 2 17 SER H 4.660 . 4.960 5.031 4.931 5.112 0.152 20 0 "[ . 1 . 2]" 1
2536 2 15 LEU QD 2 17 SER H 5.440 . 5.740 5.255 4.937 5.419 . 0 0 "[ . 1 . 2]" 1
2537 2 16 THR H 2 16 THR HB 2.810 . 3.110 2.597 2.445 2.724 . 0 0 "[ . 1 . 2]" 1
2538 2 16 THR H 2 16 THR HA 2.830 . 3.130 2.787 2.757 2.820 . 0 0 "[ . 1 . 2]" 1
2539 2 16 THR H 2 16 THR MG 3.470 . 3.770 3.011 2.049 3.771 0.001 1 0 "[ . 1 . 2]" 1
2540 2 16 THR H 2 17 SER H 3.690 . 3.990 2.706 2.547 2.875 . 0 0 "[ . 1 . 2]" 1
2541 2 16 THR H 2 17 SER QB 5.310 . 5.610 4.780 4.283 5.117 . 0 0 "[ . 1 . 2]" 1
2542 2 16 THR HA 2 17 SER H 3.470 . 3.770 3.479 3.425 3.531 . 0 0 "[ . 1 . 2]" 1
2543 2 16 THR MG 2 17 SER H 4.660 . 4.960 3.111 2.155 3.884 . 0 0 "[ . 1 . 2]" 1
2544 2 17 SER H 2 17 SER QB 3.300 . 3.600 2.487 2.213 2.809 . 0 0 "[ . 1 . 2]" 1
2545 2 17 SER HA 2 18 ASP H 3.560 . 3.860 3.557 3.482 3.593 . 0 0 "[ . 1 . 2]" 1
2546 2 17 SER QB 2 18 ASP H 3.860 . 4.160 2.712 2.260 3.535 . 0 0 "[ . 1 . 2]" 1
2547 2 18 ASP H 2 18 ASP QB 3.150 . 3.450 2.338 2.215 2.581 . 0 0 "[ . 1 . 2]" 1
2548 2 18 ASP QB 2 19 SER H 3.640 . 3.940 2.677 2.325 3.075 . 0 0 "[ . 1 . 2]" 1
2549 2 18 ASP QB 2 20 LEU H 5.500 . 5.800 5.022 4.583 5.418 . 0 0 "[ . 1 . 2]" 1
2550 2 19 SER H 2 19 SER QB 3.200 . 3.500 2.482 2.251 2.682 . 0 0 "[ . 1 . 2]" 1
2551 2 19 SER H 2 20 LEU HB2 4.910 . 5.210 4.989 4.860 5.193 . 0 0 "[ . 1 . 2]" 1
2552 2 19 SER QB 2 20 LEU H 3.810 . 4.110 2.708 2.253 3.259 . 0 0 "[ . 1 . 2]" 1
2553 2 20 LEU H 2 20 LEU MD1 4.480 . 4.780 3.713 3.484 3.940 . 0 0 "[ . 1 . 2]" 1
2554 2 20 LEU H 2 20 LEU HB2 2.910 . 3.210 2.425 2.354 2.499 . 0 0 "[ . 1 . 2]" 1
2555 2 20 LEU H 2 20 LEU HG 3.060 . 3.360 2.597 2.487 2.746 . 0 0 "[ . 1 . 2]" 1
2556 2 20 LEU H 2 20 LEU MD2 4.910 . 5.210 3.593 3.471 3.665 . 0 0 "[ . 1 . 2]" 1
2557 2 20 LEU HB2 2 21 SER H 4.100 . 4.400 2.935 2.424 3.436 . 0 0 "[ . 1 . 2]" 1
2558 2 20 LEU HB3 2 21 SER H 4.260 . 4.560 3.770 3.327 4.155 . 0 0 "[ . 1 . 2]" 1
2559 2 20 LEU MD1 2 21 SER H 5.500 . 5.800 4.785 4.378 5.161 . 0 0 "[ . 1 . 2]" 1
2560 2 20 LEU MD2 2 21 SER H 5.500 . 5.800 4.748 4.643 4.833 . 0 0 "[ . 1 . 2]" 1
2561 2 21 SER H 2 21 SER QB 3.320 . 3.620 2.392 2.245 2.681 . 0 0 "[ . 1 . 2]" 1
2562 2 21 SER H 2 21 SER HA 2.930 . 3.230 2.839 2.802 2.865 . 0 0 "[ . 1 . 2]" 1
2563 2 36 SER HA 2 37 LEU H 3.520 . 3.820 2.675 1.920 3.626 . 0 0 "[ . 1 . 2]" 1
2564 2 36 SER HB2 2 37 LEU H 5.170 . 5.470 3.995 2.708 4.547 . 0 0 "[ . 1 . 2]" 1
2565 2 36 SER HB3 2 37 LEU H 5.170 . 5.470 4.207 3.474 4.673 . 0 0 "[ . 1 . 2]" 1
2566 2 36 SER QB 2 37 LEU H 4.450 . 4.750 3.600 2.650 4.025 . 0 0 "[ . 1 . 2]" 1
2567 2 37 LEU H 2 37 LEU QB 3.420 . 3.720 2.498 2.314 2.910 . 0 0 "[ . 1 . 2]" 1
2568 2 37 LEU H 2 37 LEU HG 3.830 . 4.130 3.533 2.096 4.274 0.144 18 0 "[ . 1 . 2]" 1
2569 2 37 LEU QB 2 38 GLU H 3.940 . 4.240 2.827 2.288 3.710 . 0 0 "[ . 1 . 2]" 1
2570 2 38 GLU H 2 38 GLU HB3 3.600 . 3.900 3.264 2.614 3.694 . 0 0 "[ . 1 . 2]" 1
2571 2 38 GLU H 2 38 GLU QG 4.760 . 5.060 2.245 1.793 3.181 0.007 4 0 "[ . 1 . 2]" 1
2572 2 38 GLU H 2 38 GLU HB2 3.600 . 3.900 3.270 2.525 3.588 . 0 0 "[ . 1 . 2]" 1
2573 2 38 GLU QB 2 39 CYS H 4.210 . 4.510 2.998 2.061 3.790 . 0 0 "[ . 1 . 2]" 1
2574 2 39 CYS H 2 39 CYS QB 3.530 . 3.830 2.562 2.202 3.353 . 0 0 "[ . 1 . 2]" 1
2575 2 39 CYS QB 2 40 ASP H 4.150 . 4.450 2.828 1.894 3.954 . 0 0 "[ . 1 . 2]" 1
2576 2 40 ASP H 2 40 ASP QB 3.470 . 3.770 2.511 2.023 3.383 . 0 0 "[ . 1 . 2]" 1
2577 2 40 ASP H 2 41 MET QB 4.910 . 5.210 4.098 3.576 5.075 . 0 0 "[ . 1 . 2]" 1
2578 2 40 ASP HA 2 41 MET H 4.000 . 4.300 3.466 3.317 3.558 . 0 0 "[ . 1 . 2]" 1
2579 2 40 ASP QB 2 41 MET H 3.960 . 4.260 2.784 1.965 3.811 . 0 0 "[ . 1 . 2]" 1
2580 2 41 MET H 2 41 MET QB 3.210 . 3.510 2.196 2.054 2.422 . 0 0 "[ . 1 . 2]" 1
2581 2 41 MET H 2 41 MET QG 4.210 . 4.510 3.783 2.229 4.031 . 0 0 "[ . 1 . 2]" 1
2582 2 41 MET HA 2 42 GLU H 4.000 . 4.300 3.467 3.371 3.573 . 0 0 "[ . 1 . 2]" 1
2583 2 41 MET H 2 44 ILE MD 5.000 . 5.300 5.387 5.263 5.471 0.171 14 0 "[ . 1 . 2]" 1
2584 2 42 GLU H 2 42 GLU HG2 4.660 . 4.960 3.687 3.422 4.514 . 0 0 "[ . 1 . 2]" 1
2585 2 42 GLU H 2 42 GLU HG3 4.660 . 4.960 2.794 2.341 4.457 . 0 0 "[ . 1 . 2]" 1
2586 2 42 GLU H 2 42 GLU QG 4.070 . 4.370 2.688 2.306 3.908 . 0 0 "[ . 1 . 2]" 1
2587 2 42 GLU H 2 42 GLU QB 3.030 . 3.330 2.373 2.077 2.507 . 0 0 "[ . 1 . 2]" 1
2588 2 42 GLU H 2 43 SER H 3.580 . 3.880 2.944 2.494 3.153 . 0 0 "[ . 1 . 2]" 1
2589 2 42 GLU QB 2 43 SER H 3.630 . 3.930 3.072 2.921 3.199 . 0 0 "[ . 1 . 2]" 1
2590 2 42 GLU HA 2 45 ILE H 4.480 . 4.780 3.226 2.950 3.477 . 0 0 "[ . 1 . 2]" 1
2591 2 43 SER H 2 43 SER QB 3.370 . 3.670 2.477 2.256 2.648 . 0 0 "[ . 1 . 2]" 1
2592 2 43 SER H 2 44 ILE H 3.720 . 4.020 2.879 2.677 3.011 . 0 0 "[ . 1 . 2]" 1
2593 2 43 SER QB 2 44 ILE H 3.710 . 4.010 2.461 2.125 2.994 . 0 0 "[ . 1 . 2]" 1
2594 2 43 SER HA 2 45 ILE H 5.370 . 5.670 4.323 4.218 4.414 . 0 0 "[ . 1 . 2]" 1
2595 2 44 ILE H 2 44 ILE QG 3.770 . 4.070 1.994 1.828 2.193 . 0 0 "[ . 1 . 2]" 1
2596 2 44 ILE H 2 44 ILE MG 4.340 . 4.640 2.552 2.194 2.868 . 0 0 "[ . 1 . 2]" 1
2597 2 44 ILE H 2 44 ILE MD 4.320 . 4.620 3.362 2.961 3.808 . 0 0 "[ . 1 . 2]" 1
2598 2 44 ILE H 2 44 ILE HB 3.740 . 4.040 3.680 3.646 3.737 . 0 0 "[ . 1 . 2]" 1
2599 2 44 ILE H 2 45 ILE H 3.920 . 4.220 2.452 2.351 2.576 . 0 0 "[ . 1 . 2]" 1
2600 2 44 ILE H 2 45 ILE MD 4.830 . 5.130 4.889 4.070 5.160 0.030 16 0 "[ . 1 . 2]" 1
2601 2 44 ILE HB 2 45 ILE H 3.920 . 4.220 3.900 3.616 3.969 . 0 0 "[ . 1 . 2]" 1
2602 2 44 ILE MD 2 45 ILE H 4.440 . 4.740 2.842 2.137 4.093 . 0 0 "[ . 1 . 2]" 1
2603 2 44 ILE QG 2 45 ILE H 3.580 . 3.880 2.756 2.009 3.238 . 0 0 "[ . 1 . 2]" 1
2604 2 45 ILE H 2 45 ILE MD 4.570 . 4.870 3.163 2.513 3.457 . 0 0 "[ . 1 . 2]" 1
2605 2 45 ILE H 2 45 ILE MG 4.190 . 4.490 3.710 3.534 3.806 . 0 0 "[ . 1 . 2]" 1
2606 2 45 ILE H 2 45 ILE HB 3.680 . 3.980 2.291 2.084 2.509 . 0 0 "[ . 1 . 2]" 1
2607 2 45 ILE H 2 46 ARG H 4.340 . 4.640 2.648 2.547 2.768 . 0 0 "[ . 1 . 2]" 1
2608 2 45 ILE HB 2 46 ARG H 3.840 . 4.140 2.671 2.408 3.167 . 0 0 "[ . 1 . 2]" 1
2609 2 45 ILE MD 2 46 ARG H 4.510 . 4.810 4.587 4.400 4.705 . 0 0 "[ . 1 . 2]" 1
2610 2 45 ILE QG 2 46 ARG H 4.720 . 5.020 4.203 4.003 4.710 . 0 0 "[ . 1 . 2]" 1
2611 2 45 ILE HA 2 47 SER H 4.930 . 5.230 4.358 4.188 4.479 . 0 0 "[ . 1 . 2]" 1
2612 2 45 ILE MD 2 47 SER H 5.280 . 5.580 5.552 5.443 5.627 0.047 20 0 "[ . 1 . 2]" 1
2613 2 45 ILE HA 2 48 GLU H 4.340 . 4.640 3.205 3.017 3.461 . 0 0 "[ . 1 . 2]" 1
2614 2 45 ILE MD 2 48 GLU H 5.450 . 5.750 4.513 4.211 4.794 . 0 0 "[ . 1 . 2]" 1
2615 2 46 ARG H 2 46 ARG HB3 4.080 . 4.380 2.944 2.388 3.630 . 0 0 "[ . 1 . 2]" 1
2616 2 46 ARG H 2 46 ARG HB2 4.080 . 4.380 2.442 2.229 2.666 . 0 0 "[ . 1 . 2]" 1
2617 2 46 ARG H 2 46 ARG QG 4.330 . 4.630 3.407 2.220 4.075 . 0 0 "[ . 1 . 2]" 1
2618 2 46 ARG H 2 46 ARG QD 4.970 . 5.270 4.225 3.524 4.798 . 0 0 "[ . 1 . 2]" 1
2619 2 46 ARG H 2 46 ARG HG3 5.120 . 5.420 3.781 2.245 4.526 . 0 0 "[ . 1 . 2]" 1
2620 2 46 ARG H 2 46 ARG HG2 5.120 . 5.420 4.124 2.327 4.626 . 0 0 "[ . 1 . 2]" 1
2621 2 46 ARG HB2 2 47 SER H 4.590 . 4.890 3.393 2.510 4.053 . 0 0 "[ . 1 . 2]" 1
2622 2 46 ARG HB3 2 47 SER H 4.590 . 4.890 2.908 2.312 3.774 . 0 0 "[ . 1 . 2]" 1
2623 2 46 ARG QB 2 47 SER H 4.010 . 4.310 2.545 2.278 2.823 . 0 0 "[ . 1 . 2]" 1
2624 2 47 SER H 2 47 SER QB 3.440 . 3.740 2.529 2.186 2.792 . 0 0 "[ . 1 . 2]" 1
2625 2 47 SER H 2 48 GLU H 4.330 . 4.630 2.791 2.601 2.943 . 0 0 "[ . 1 . 2]" 1
2626 2 48 GLU H 2 48 GLU QG 4.110 . 4.410 3.013 2.283 3.984 . 0 0 "[ . 1 . 2]" 1
2627 2 48 GLU H 2 48 GLU QB 3.430 . 3.730 2.341 2.071 2.567 . 0 0 "[ . 1 . 2]" 1
2628 2 48 GLU H 2 49 LEU H 3.790 . 4.090 2.717 2.523 2.886 . 0 0 "[ . 1 . 2]" 1
2629 2 48 GLU HB2 2 49 LEU H 4.910 . 5.210 3.143 2.515 4.050 . 0 0 "[ . 1 . 2]" 1
2630 2 48 GLU HB3 2 49 LEU H 4.910 . 5.210 3.236 2.529 3.851 . 0 0 "[ . 1 . 2]" 1
2631 2 48 GLU QB 2 49 LEU H 4.170 . 4.470 2.621 2.406 2.884 . 0 0 "[ . 1 . 2]" 1
2632 2 49 LEU H 2 49 LEU QD 4.510 . 4.810 3.066 2.976 3.140 . 0 0 "[ . 1 . 2]" 1
2633 2 49 LEU H 2 49 LEU MD1 5.500 . 5.800 3.426 3.220 3.753 . 0 0 "[ . 1 . 2]" 1
2634 2 49 LEU H 2 49 LEU HB3 3.950 . 4.250 2.796 2.603 2.921 . 0 0 "[ . 1 . 2]" 1
2635 2 49 LEU H 2 49 LEU HB2 3.950 . 4.250 3.683 3.621 3.726 . 0 0 "[ . 1 . 2]" 1
2636 2 49 LEU H 2 49 LEU MD2 5.500 . 5.800 3.508 3.121 3.718 . 0 0 "[ . 1 . 2]" 1
2637 2 49 LEU QB 2 50 MET H 4.230 . 4.530 3.681 3.568 3.784 . 0 0 "[ . 1 . 2]" 1
2638 2 49 LEU QD 2 50 MET H 4.870 . 5.170 2.424 2.168 2.597 . 0 0 "[ . 1 . 2]" 1
2639 2 50 MET H 2 50 MET QB 3.440 . 3.740 2.276 2.201 2.437 . 0 0 "[ . 1 . 2]" 1
2640 2 50 MET H 2 50 MET HB2 4.110 . 4.410 2.535 2.401 2.698 . 0 0 "[ . 1 . 2]" 1
2641 2 50 MET H 2 50 MET HG3 4.760 . 5.060 4.356 2.547 4.572 . 0 0 "[ . 1 . 2]" 1
2642 2 50 MET H 2 50 MET HG2 4.760 . 5.060 4.429 2.660 4.698 . 0 0 "[ . 1 . 2]" 1
2643 2 50 MET H 2 50 MET HB3 4.110 . 4.410 2.649 2.454 3.652 . 0 0 "[ . 1 . 2]" 1
2644 2 50 MET HB2 2 51 ASP H 4.330 . 4.630 3.797 2.991 4.183 . 0 0 "[ . 1 . 2]" 1
2645 2 50 MET HB3 2 51 ASP H 4.330 . 4.630 2.764 2.233 4.259 . 0 0 "[ . 1 . 2]" 1
2646 2 51 ASP H 2 51 ASP QB 3.580 . 3.880 2.698 2.260 3.258 . 0 0 "[ . 1 . 2]" 1
2647 2 51 ASP H 2 52 ALA H 4.210 . 4.510 3.791 2.466 4.530 0.020 10 0 "[ . 1 . 2]" 1
2648 2 51 ASP QB 2 52 ALA H 4.280 . 4.580 3.382 1.987 3.997 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 118
_Distance_constraint_stats_list.Viol_count 614
_Distance_constraint_stats_list.Viol_total 387.006
_Distance_constraint_stats_list.Viol_max 0.129
_Distance_constraint_stats_list.Viol_rms 0.0189
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0082
_Distance_constraint_stats_list.Viol_average_violations_only 0.0315
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 12 GLN 0.116 0.050 17 0 "[ . 1 . 2]"
1 13 ASP 0.805 0.080 20 0 "[ . 1 . 2]"
1 14 LEU 0.578 0.082 13 0 "[ . 1 . 2]"
1 15 ARG 0.114 0.058 3 0 "[ . 1 . 2]"
1 16 SER 0.127 0.050 17 0 "[ . 1 . 2]"
1 17 HIS 0.835 0.080 20 0 "[ . 1 . 2]"
1 18 LEU 0.601 0.082 13 0 "[ . 1 . 2]"
1 19 VAL 0.356 0.062 16 0 "[ . 1 . 2]"
1 20 HIS 0.250 0.046 9 0 "[ . 1 . 2]"
1 21 LYS 0.042 0.022 20 0 "[ . 1 . 2]"
1 22 LEU 0.023 0.015 6 0 "[ . 1 . 2]"
1 23 VAL 0.242 0.062 16 0 "[ . 1 . 2]"
1 24 GLN 0.239 0.046 9 0 "[ . 1 . 2]"
1 25 ALA 0.012 0.007 10 0 "[ . 1 . 2]"
1 26 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ARG 0.179 0.044 7 0 "[ . 1 . 2]"
1 40 MET 0.945 0.080 19 0 "[ . 1 . 2]"
1 41 GLU 0.463 0.064 8 0 "[ . 1 . 2]"
1 42 ASN 0.102 0.040 17 0 "[ . 1 . 2]"
1 43 LEU 0.179 0.044 7 0 "[ . 1 . 2]"
1 44 VAL 1.135 0.080 19 0 "[ . 1 . 2]"
1 45 ALA 0.469 0.064 8 0 "[ . 1 . 2]"
1 46 TYR 0.102 0.040 17 0 "[ . 1 . 2]"
1 47 ALA 0.095 0.038 1 0 "[ . 1 . 2]"
1 48 LYS 0.214 0.027 19 0 "[ . 1 . 2]"
1 49 LYS 0.644 0.067 19 0 "[ . 1 . 2]"
1 50 VAL 0.196 0.042 15 0 "[ . 1 . 2]"
1 51 GLU 0.095 0.038 1 0 "[ . 1 . 2]"
1 52 GLY 0.041 0.016 6 0 "[ . 1 . 2]"
1 53 ASP 1.237 0.067 19 0 "[ . 1 . 2]"
1 54 MET 0.196 0.042 15 0 "[ . 1 . 2]"
1 55 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLU 0.016 0.016 6 0 "[ . 1 . 2]"
1 57 SER 0.599 0.057 1 0 "[ . 1 . 2]"
1 61 ARG 0.369 0.046 20 0 "[ . 1 . 2]"
1 62 ASP 0.037 0.016 9 0 "[ . 1 . 2]"
1 63 GLU 0.048 0.030 19 0 "[ . 1 . 2]"
1 64 TYR 0.021 0.012 3 0 "[ . 1 . 2]"
1 65 TYR 0.501 0.046 20 0 "[ . 1 . 2]"
1 66 HIS 0.037 0.016 9 0 "[ . 1 . 2]"
1 67 LEU 0.703 0.067 3 0 "[ . 1 . 2]"
1 68 LEU 0.077 0.026 10 0 "[ . 1 . 2]"
1 69 ALA 0.183 0.022 14 0 "[ . 1 . 2]"
1 70 GLU 0.265 0.067 17 0 "[ . 1 . 2]"
1 71 LYS 1.802 0.096 3 0 "[ . 1 . 2]"
1 72 ILE 0.066 0.026 10 0 "[ . 1 . 2]"
1 73 TYR 1.586 0.096 19 0 "[ . 1 . 2]"
1 74 LYS 0.317 0.067 17 0 "[ . 1 . 2]"
1 75 ILE 1.330 0.096 3 0 "[ . 1 . 2]"
1 76 GLN 0.720 0.072 20 0 "[ . 1 . 2]"
1 77 LYS 1.679 0.096 19 0 "[ . 1 . 2]"
1 78 GLU 0.163 0.041 8 0 "[ . 1 . 2]"
1 79 LEU 0.731 0.105 16 0 "[ . 1 . 2]"
1 80 GLU 0.865 0.072 20 0 "[ . 1 . 2]"
1 81 GLU 0.143 0.030 9 0 "[ . 1 . 2]"
1 82 LYS 0.111 0.041 8 0 "[ . 1 . 2]"
1 83 ARG 0.549 0.105 16 0 "[ . 1 . 2]"
1 84 ARG 0.155 0.046 16 0 "[ . 1 . 2]"
2 9 GLN 0.145 0.054 13 0 "[ . 1 . 2]"
2 10 THR 0.214 0.049 19 0 "[ . 1 . 2]"
2 11 LEU 0.214 0.052 15 0 "[ . 1 . 2]"
2 12 GLN 0.028 0.024 4 0 "[ . 1 . 2]"
2 13 ASP 0.296 0.054 13 0 "[ . 1 . 2]"
2 14 LEU 0.948 0.077 14 0 "[ . 1 . 2]"
2 15 LEU 0.357 0.052 15 0 "[ . 1 . 2]"
2 16 THR 0.028 0.024 4 0 "[ . 1 . 2]"
2 17 SER 0.151 0.035 17 0 "[ . 1 . 2]"
2 18 ASP 0.734 0.077 14 0 "[ . 1 . 2]"
2 19 SER 0.143 0.020 19 0 "[ . 1 . 2]"
2 41 MET 0.582 0.102 4 0 "[ . 1 . 2]"
2 42 GLU 0.532 0.058 18 0 "[ . 1 . 2]"
2 43 SER 2.317 0.120 14 0 "[ . 1 . 2]"
2 44 ILE 0.743 0.129 5 0 "[ . 1 . 2]"
2 45 ILE 1.897 0.102 4 0 "[ . 1 . 2]"
2 46 ARG 0.910 0.080 15 0 "[ . 1 . 2]"
2 47 SER 2.317 0.120 14 0 "[ . 1 . 2]"
2 48 GLU 0.743 0.129 5 0 "[ . 1 . 2]"
2 49 LEU 1.314 0.084 13 0 "[ . 1 . 2]"
2 50 MET 0.378 0.080 15 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 12 GLN O 1 16 SER H 2.000 . 2.100 1.884 1.750 2.100 0.050 17 0 "[ . 1 . 2]" 2
2 1 12 GLN O 1 16 SER N 3.000 2.700 3.100 2.823 2.700 3.043 0.000 17 0 "[ . 1 . 2]" 2
3 1 13 ASP O 1 17 HIS H 2.000 . 2.100 2.132 1.997 2.180 0.080 20 0 "[ . 1 . 2]" 2
4 1 13 ASP O 1 17 HIS N 3.000 2.700 3.100 2.910 2.713 3.002 . 0 0 "[ . 1 . 2]" 2
5 1 14 LEU O 1 18 LEU H 2.000 . 2.100 2.108 2.003 2.182 0.082 13 0 "[ . 1 . 2]" 2
6 1 14 LEU O 1 18 LEU N 3.000 2.700 3.100 3.027 2.922 3.111 0.011 13 0 "[ . 1 . 2]" 2
7 1 15 ARG O 1 19 VAL H 2.000 . 2.100 1.987 1.834 2.158 0.058 3 0 "[ . 1 . 2]" 2
8 1 15 ARG O 1 19 VAL N 3.000 2.700 3.100 2.929 2.789 3.107 0.007 3 0 "[ . 1 . 2]" 2
9 1 16 SER O 1 20 HIS H 2.000 . 2.100 1.951 1.820 2.111 0.011 13 0 "[ . 1 . 2]" 2
10 1 16 SER O 1 20 HIS N 3.000 2.700 3.100 2.874 2.766 3.018 . 0 0 "[ . 1 . 2]" 2
11 1 17 HIS O 1 21 LYS H 2.000 . 2.100 2.002 1.876 2.122 0.022 20 0 "[ . 1 . 2]" 2
12 1 17 HIS O 1 21 LYS N 3.000 2.700 3.100 2.929 2.810 3.044 . 0 0 "[ . 1 . 2]" 2
13 1 18 LEU O 1 22 LEU H 2.000 . 2.100 1.871 1.785 2.076 0.015 6 0 "[ . 1 . 2]" 2
14 1 18 LEU O 1 22 LEU N 3.000 2.700 3.100 2.794 2.706 2.980 . 0 0 "[ . 1 . 2]" 2
15 1 19 VAL O 1 23 VAL H 2.000 . 2.100 2.038 1.858 2.162 0.062 16 0 "[ . 1 . 2]" 2
16 1 19 VAL O 1 23 VAL N 3.000 2.700 3.100 2.993 2.816 3.121 0.021 16 0 "[ . 1 . 2]" 2
17 1 20 HIS O 1 24 GLN H 2.000 . 2.100 2.044 1.880 2.146 0.046 9 0 "[ . 1 . 2]" 2
18 1 20 HIS O 1 24 GLN N 3.000 2.700 3.100 2.977 2.826 3.103 0.003 9 0 "[ . 1 . 2]" 2
19 1 21 LYS O 1 25 ALA H 2.000 . 2.100 1.956 1.862 2.107 0.007 10 0 "[ . 1 . 2]" 2
20 1 21 LYS O 1 25 ALA N 3.000 2.700 3.100 2.823 2.745 2.983 . 0 0 "[ . 1 . 2]" 2
21 1 22 LEU O 1 26 ILE H 2.000 . 2.100 1.965 1.838 2.069 . 0 0 "[ . 1 . 2]" 2
22 1 22 LEU O 1 26 ILE N 3.000 2.700 3.100 2.911 2.801 3.010 . 0 0 "[ . 1 . 2]" 2
23 1 39 ARG O 1 43 LEU H 2.000 . 2.100 2.062 1.955 2.144 0.044 7 0 "[ . 1 . 2]" 2
24 1 39 ARG O 1 43 LEU N 3.000 2.700 3.100 2.990 2.881 3.087 . 0 0 "[ . 1 . 2]" 2
25 1 40 MET O 1 44 VAL H 2.000 . 2.100 1.753 1.720 1.783 0.080 19 0 "[ . 1 . 2]" 2
26 1 40 MET O 1 44 VAL N 3.000 2.700 3.100 2.729 2.693 2.764 0.007 19 0 "[ . 1 . 2]" 2
27 1 41 GLU O 1 45 ALA H 2.000 . 2.100 2.085 1.845 2.164 0.064 8 0 "[ . 1 . 2]" 2
28 1 41 GLU O 1 45 ALA N 3.000 2.700 3.100 2.913 2.767 2.993 . 0 0 "[ . 1 . 2]" 2
29 1 42 ASN O 1 46 TYR H 2.000 . 2.100 2.026 1.861 2.140 0.040 17 0 "[ . 1 . 2]" 2
30 1 42 ASN O 1 46 TYR N 3.000 2.700 3.100 2.981 2.810 3.111 0.011 17 0 "[ . 1 . 2]" 2
31 1 43 LEU O 1 47 ALA H 2.000 . 2.100 1.928 1.821 2.037 . 0 0 "[ . 1 . 2]" 2
32 1 43 LEU O 1 47 ALA N 3.000 2.700 3.100 2.849 2.757 2.949 . 0 0 "[ . 1 . 2]" 2
33 1 44 VAL O 1 48 LYS H 2.000 . 2.100 1.796 1.773 1.837 0.027 19 0 "[ . 1 . 2]" 2
34 1 44 VAL O 1 48 LYS N 3.000 2.700 3.100 2.745 2.712 2.791 . 0 0 "[ . 1 . 2]" 2
35 1 45 ALA O 1 49 LYS H 2.000 . 2.100 1.925 1.826 2.106 0.006 9 0 "[ . 1 . 2]" 2
36 1 45 ALA O 1 49 LYS N 3.000 2.700 3.100 2.862 2.753 3.005 . 0 0 "[ . 1 . 2]" 2
37 1 46 TYR O 1 50 VAL H 2.000 . 2.100 1.944 1.863 2.056 . 0 0 "[ . 1 . 2]" 2
38 1 46 TYR O 1 50 VAL N 3.000 2.700 3.100 2.878 2.799 2.968 . 0 0 "[ . 1 . 2]" 2
39 1 47 ALA O 1 51 GLU H 2.000 . 2.100 1.825 1.762 1.907 0.038 1 0 "[ . 1 . 2]" 2
40 1 47 ALA O 1 51 GLU N 3.000 2.700 3.100 2.780 2.723 2.857 . 0 0 "[ . 1 . 2]" 2
41 1 48 LYS O 1 52 GLY H 2.000 . 2.100 1.879 1.785 2.040 0.015 3 0 "[ . 1 . 2]" 2
42 1 48 LYS O 1 52 GLY N 3.000 2.700 3.100 2.827 2.736 2.996 . 0 0 "[ . 1 . 2]" 2
43 1 49 LYS O 1 53 ASP H 2.000 . 2.100 2.118 1.969 2.167 0.067 19 0 "[ . 1 . 2]" 2
44 1 49 LYS O 1 53 ASP N 3.000 2.700 3.100 2.998 2.871 3.086 . 0 0 "[ . 1 . 2]" 2
45 1 50 VAL O 1 54 MET H 2.000 . 2.100 2.083 1.938 2.142 0.042 15 0 "[ . 1 . 2]" 2
46 1 50 VAL O 1 54 MET N 3.000 2.700 3.100 3.062 2.884 3.123 0.023 15 0 "[ . 1 . 2]" 2
47 1 51 GLU O 1 55 TYR H 2.000 . 2.100 1.867 1.816 1.944 . 0 0 "[ . 1 . 2]" 2
48 1 51 GLU O 1 55 TYR N 3.000 2.700 3.100 2.771 2.718 2.833 . 0 0 "[ . 1 . 2]" 2
49 1 52 GLY O 1 56 GLU H 2.000 . 2.100 1.978 1.849 2.116 0.016 6 0 "[ . 1 . 2]" 2
50 1 52 GLY O 1 56 GLU N 3.000 2.700 3.100 2.916 2.812 3.051 . 0 0 "[ . 1 . 2]" 2
51 1 53 ASP O 1 57 SER H 2.000 . 2.100 2.119 1.934 2.157 0.057 1 0 "[ . 1 . 2]" 2
52 1 53 ASP O 1 57 SER N 3.000 2.700 3.100 2.865 2.760 2.936 . 0 0 "[ . 1 . 2]" 2
53 1 61 ARG O 1 65 TYR H 2.000 . 2.100 1.782 1.754 1.812 0.046 20 0 "[ . 1 . 2]" 2
54 1 61 ARG O 1 65 TYR N 3.000 2.700 3.100 2.726 2.702 2.758 . 0 0 "[ . 1 . 2]" 2
55 1 62 ASP O 1 66 HIS H 2.000 . 2.100 1.975 1.821 2.116 0.016 9 0 "[ . 1 . 2]" 2
56 1 62 ASP O 1 66 HIS N 3.000 2.700 3.100 2.841 2.697 3.022 0.003 2 0 "[ . 1 . 2]" 2
57 1 63 GLU O 1 67 LEU H 2.000 . 2.100 1.863 1.770 1.968 0.030 19 0 "[ . 1 . 2]" 2
58 1 63 GLU O 1 67 LEU N 3.000 2.700 3.100 2.842 2.748 2.951 . 0 0 "[ . 1 . 2]" 2
59 1 64 TYR O 1 68 LEU H 2.000 . 2.100 2.021 1.916 2.112 0.012 3 0 "[ . 1 . 2]" 2
60 1 64 TYR O 1 68 LEU N 3.000 2.700 3.100 2.918 2.826 3.011 . 0 0 "[ . 1 . 2]" 2
61 1 65 TYR O 1 69 ALA H 2.000 . 2.100 1.827 1.779 1.936 0.021 17 0 "[ . 1 . 2]" 2
62 1 65 TYR O 1 69 ALA N 3.000 2.700 3.100 2.753 2.691 2.891 0.009 10 0 "[ . 1 . 2]" 2
63 1 66 HIS O 1 70 GLU H 2.000 . 2.100 1.956 1.823 2.053 . 0 0 "[ . 1 . 2]" 2
64 1 66 HIS O 1 70 GLU N 3.000 2.700 3.100 2.839 2.739 2.954 . 0 0 "[ . 1 . 2]" 2
65 1 67 LEU O 1 71 LYS H 2.000 . 2.100 2.125 2.037 2.167 0.067 3 0 "[ . 1 . 2]" 2
66 1 67 LEU O 1 71 LYS N 3.000 2.700 3.100 3.042 2.931 3.113 0.013 4 0 "[ . 1 . 2]" 2
67 1 68 LEU O 1 72 ILE H 2.000 . 2.100 1.831 1.774 1.955 0.026 10 0 "[ . 1 . 2]" 2
68 1 68 LEU O 1 72 ILE N 3.000 2.700 3.100 2.790 2.724 2.913 . 0 0 "[ . 1 . 2]" 2
69 1 69 ALA O 1 73 TYR H 2.000 . 2.100 2.013 1.855 2.122 0.022 14 0 "[ . 1 . 2]" 2
70 1 69 ALA O 1 73 TYR N 3.000 2.700 3.100 2.892 2.760 3.011 . 0 0 "[ . 1 . 2]" 2
71 1 70 GLU O 1 74 LYS H 2.000 . 2.100 2.067 1.903 2.167 0.067 17 0 "[ . 1 . 2]" 2
72 1 70 GLU O 1 74 LYS N 3.000 2.700 3.100 3.010 2.833 3.107 0.007 17 0 "[ . 1 . 2]" 2
73 1 71 LYS O 1 75 ILE H 2.000 . 2.100 2.157 2.117 2.196 0.096 3 0 "[ . 1 . 2]" 2
74 1 71 LYS O 1 75 ILE N 3.000 2.700 3.100 3.061 3.015 3.107 0.007 12 0 "[ . 1 . 2]" 2
75 1 72 ILE O 1 76 GLN H 2.000 . 2.100 2.022 1.912 2.110 0.010 6 0 "[ . 1 . 2]" 2
76 1 72 ILE O 1 76 GLN N 3.000 2.700 3.100 2.920 2.833 3.021 . 0 0 "[ . 1 . 2]" 2
77 1 73 TYR O 1 77 LYS H 2.000 . 2.100 2.147 2.033 2.196 0.096 19 0 "[ . 1 . 2]" 2
78 1 73 TYR O 1 77 LYS N 3.000 2.700 3.100 3.119 3.004 3.171 0.071 19 0 "[ . 1 . 2]" 2
79 1 74 LYS O 1 78 GLU H 2.000 . 2.100 1.988 1.817 2.129 0.029 17 0 "[ . 1 . 2]" 2
80 1 74 LYS O 1 78 GLU N 3.000 2.700 3.100 2.841 2.697 2.969 0.003 18 0 "[ . 1 . 2]" 2
81 1 75 ILE O 1 79 LEU H 2.000 . 2.100 2.070 1.943 2.127 0.027 2 0 "[ . 1 . 2]" 2
82 1 75 ILE O 1 79 LEU N 3.000 2.700 3.100 3.041 2.891 3.110 0.010 2 0 "[ . 1 . 2]" 2
83 1 76 GLN O 1 80 GLU H 2.000 . 2.100 2.101 1.932 2.172 0.072 20 0 "[ . 1 . 2]" 2
84 1 76 GLN O 1 80 GLU N 3.000 2.700 3.100 3.048 2.882 3.132 0.032 3 0 "[ . 1 . 2]" 2
85 1 77 LYS O 1 81 GLU H 2.000 . 2.100 1.842 1.770 2.025 0.030 9 0 "[ . 1 . 2]" 2
86 1 77 LYS O 1 81 GLU N 3.000 2.700 3.100 2.806 2.729 2.986 . 0 0 "[ . 1 . 2]" 2
87 1 78 GLU O 1 82 LYS H 2.000 . 2.100 2.005 1.795 2.141 0.041 8 0 "[ . 1 . 2]" 2
88 1 78 GLU O 1 82 LYS N 3.000 2.700 3.100 2.946 2.756 3.106 0.006 8 0 "[ . 1 . 2]" 2
89 1 79 LEU O 1 83 ARG H 2.000 . 2.100 2.090 1.835 2.205 0.105 16 0 "[ . 1 . 2]" 2
90 1 79 LEU O 1 83 ARG N 3.000 2.700 3.100 2.978 2.774 3.120 0.020 1 0 "[ . 1 . 2]" 2
91 1 80 GLU O 1 84 ARG H 2.000 . 2.100 1.992 1.754 2.133 0.046 16 0 "[ . 1 . 2]" 2
92 1 80 GLU O 1 84 ARG N 3.000 2.700 3.100 2.892 2.683 3.067 0.017 17 0 "[ . 1 . 2]" 2
93 2 9 GLN O 2 13 ASP H 2.000 . 2.100 1.946 1.782 2.154 0.054 13 0 "[ . 1 . 2]" 2
94 2 9 GLN O 2 13 ASP N 3.000 2.700 3.100 2.862 2.727 3.067 . 0 0 "[ . 1 . 2]" 2
95 2 10 THR O 2 14 LEU H 2.000 . 2.100 2.065 1.934 2.149 0.049 19 0 "[ . 1 . 2]" 2
96 2 10 THR O 2 14 LEU N 3.000 2.700 3.100 2.996 2.850 3.101 0.001 19 0 "[ . 1 . 2]" 2
97 2 11 LEU O 2 15 LEU H 2.000 . 2.100 2.031 1.865 2.152 0.052 15 0 "[ . 1 . 2]" 2
98 2 11 LEU O 2 15 LEU N 3.000 2.700 3.100 2.985 2.819 3.107 0.007 17 0 "[ . 1 . 2]" 2
99 2 12 GLN O 2 16 THR H 2.000 . 2.100 1.945 1.796 2.124 0.024 4 0 "[ . 1 . 2]" 2
100 2 12 GLN O 2 16 THR N 3.000 2.700 3.100 2.919 2.775 3.079 . 0 0 "[ . 1 . 2]" 2
101 2 13 ASP O 2 17 SER H 2.000 . 2.100 1.997 1.787 2.135 0.035 17 0 "[ . 1 . 2]" 2
102 2 13 ASP O 2 17 SER N 3.000 2.700 3.100 2.894 2.695 3.052 0.005 14 0 "[ . 1 . 2]" 2
103 2 14 LEU O 2 18 ASP H 2.000 . 2.100 2.094 1.891 2.177 0.077 14 0 "[ . 1 . 2]" 2
104 2 14 LEU O 2 18 ASP N 3.000 2.700 3.100 3.043 2.845 3.146 0.046 14 0 "[ . 1 . 2]" 2
105 2 15 LEU O 2 19 SER H 2.000 . 2.100 1.911 1.780 2.120 0.020 19 0 "[ . 1 . 2]" 2
106 2 15 LEU O 2 19 SER N 3.000 2.700 3.100 2.846 2.713 3.079 . 0 0 "[ . 1 . 2]" 2
107 2 41 MET O 2 45 ILE H 2.000 . 2.100 2.070 1.823 2.202 0.102 4 0 "[ . 1 . 2]" 2
108 2 41 MET O 2 45 ILE N 3.000 2.700 3.100 3.000 2.755 3.132 0.032 4 0 "[ . 1 . 2]" 2
109 2 42 GLU O 2 46 ARG H 2.000 . 2.100 1.827 1.742 1.969 0.058 19 0 "[ . 1 . 2]" 2
110 2 42 GLU O 2 46 ARG N 3.000 2.700 3.100 2.694 2.642 2.787 0.058 18 0 "[ . 1 . 2]" 2
111 2 43 SER O 2 47 SER H 2.000 . 2.100 2.183 2.110 2.220 0.120 14 0 "[ . 1 . 2]" 2
112 2 43 SER O 2 47 SER N 3.000 2.700 3.100 3.125 3.049 3.186 0.086 14 0 "[ . 1 . 2]" 2
113 2 44 ILE O 2 48 GLU H 2.000 . 2.100 2.121 1.962 2.229 0.129 5 0 "[ . 1 . 2]" 2
114 2 44 ILE O 2 48 GLU N 3.000 2.700 3.100 3.018 2.836 3.128 0.028 5 0 "[ . 1 . 2]" 2
115 2 45 ILE O 2 49 LEU H 2.000 . 2.100 1.742 1.716 1.778 0.084 13 0 "[ . 1 . 2]" 2
116 2 45 ILE O 2 49 LEU N 3.000 2.700 3.100 2.701 2.662 2.744 0.038 18 0 "[ . 1 . 2]" 2
117 2 46 ARG O 2 50 MET H 2.000 . 2.100 2.075 1.816 2.180 0.080 15 0 "[ . 1 . 2]" 2
118 2 46 ARG O 2 50 MET N 3.000 2.700 3.100 2.959 2.746 3.076 . 0 0 "[ . 1 . 2]" 2
stop_
save_