NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
384899 |
1kot   |
5058 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1kot
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 3128
_Distance_constraint_stats_list.Viol_count 5212
_Distance_constraint_stats_list.Viol_total 2022.112
_Distance_constraint_stats_list.Viol_max 0.174
_Distance_constraint_stats_list.Viol_rms 0.0113
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0029
_Distance_constraint_stats_list.Viol_average_violations_only 0.0259
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.333 0.032 3 0 "[ . 1 .]"
1 3 MET 3.704 0.074 6 0 "[ . 1 .]"
1 4 LYS 0.343 0.047 3 0 "[ . 1 .]"
1 5 PHE 0.771 0.054 6 0 "[ . 1 .]"
1 6 VAL 1.357 0.094 9 0 "[ . 1 .]"
1 7 TYR 1.313 0.074 6 0 "[ . 1 .]"
1 8 LYS 2.537 0.167 4 0 "[ . 1 .]"
1 9 GLU 1.510 0.094 12 0 "[ . 1 .]"
1 10 GLU 0.324 0.038 6 0 "[ . 1 .]"
1 11 HIS 2.186 0.119 4 0 "[ . 1 .]"
1 12 PRO 1.934 0.129 3 0 "[ . 1 .]"
1 13 PHE 1.849 0.083 14 0 "[ . 1 .]"
1 14 GLU 0.808 0.077 9 0 "[ . 1 .]"
1 15 LYS 3.473 0.129 3 0 "[ . 1 .]"
1 16 ARG 0.107 0.030 7 0 "[ . 1 .]"
1 17 ARG 0.702 0.071 14 0 "[ . 1 .]"
1 18 SER 1.207 0.118 9 0 "[ . 1 .]"
1 19 GLU 1.457 0.040 3 0 "[ . 1 .]"
1 20 GLY 0.073 0.017 9 0 "[ . 1 .]"
1 21 GLU 3.096 0.100 3 0 "[ . 1 .]"
1 22 LYS 2.587 0.091 9 0 "[ . 1 .]"
1 23 ILE 4.690 0.130 9 0 "[ . 1 .]"
1 24 ARG 3.026 0.079 4 0 "[ . 1 .]"
1 25 LYS 3.529 0.144 10 0 "[ . 1 .]"
1 26 LYS 4.199 0.144 10 0 "[ . 1 .]"
1 27 TYR 2.819 0.111 10 0 "[ . 1 .]"
1 28 PRO 1.031 0.141 13 0 "[ . 1 .]"
1 29 ASP 0.089 0.016 5 0 "[ . 1 .]"
1 30 ARG 1.358 0.081 3 0 "[ . 1 .]"
1 31 VAL 2.391 0.098 3 0 "[ . 1 .]"
1 32 PRO 0.593 0.033 15 0 "[ . 1 .]"
1 33 VAL 3.149 0.096 5 0 "[ . 1 .]"
1 34 ILE 4.167 0.135 11 0 "[ . 1 .]"
1 35 VAL 1.957 0.076 12 0 "[ . 1 .]"
1 36 GLU 2.362 0.074 6 0 "[ . 1 .]"
1 37 LYS 2.288 0.059 6 0 "[ . 1 .]"
1 38 ALA 3.152 0.106 10 0 "[ . 1 .]"
1 39 PRO 3.291 0.106 10 0 "[ . 1 .]"
1 40 LYS 0.943 0.046 14 0 "[ . 1 .]"
1 41 ALA 3.972 0.085 2 0 "[ . 1 .]"
1 42 ARG 2.865 0.077 5 0 "[ . 1 .]"
1 43 ILE 5.155 0.077 5 0 "[ . 1 .]"
1 44 GLY 1.218 0.067 14 0 "[ . 1 .]"
1 45 ASP 0.553 0.027 9 0 "[ . 1 .]"
1 46 LEU 2.131 0.067 14 0 "[ . 1 .]"
1 47 ASP 0.093 0.044 11 0 "[ . 1 .]"
1 48 LYS 0.499 0.034 2 0 "[ . 1 .]"
1 49 LYS 3.200 0.119 4 0 "[ . 1 .]"
1 50 LYS 0.845 0.042 14 0 "[ . 1 .]"
1 51 TYR 1.875 0.064 10 0 "[ . 1 .]"
1 52 LEU 2.073 0.096 5 0 "[ . 1 .]"
1 53 VAL 1.313 0.067 5 0 "[ . 1 .]"
1 54 PRO 0.505 0.032 12 0 "[ . 1 .]"
1 55 SER 2.063 0.079 5 0 "[ . 1 .]"
1 56 ASP 0.553 0.040 10 0 "[ . 1 .]"
1 57 LEU 2.720 0.063 10 0 "[ . 1 .]"
1 58 THR 1.984 0.075 14 0 "[ . 1 .]"
1 59 VAL 1.021 0.075 14 0 "[ . 1 .]"
1 60 GLY 0.296 0.021 2 0 "[ . 1 .]"
1 61 GLN 3.061 0.071 3 0 "[ . 1 .]"
1 62 PHE 4.274 0.086 5 0 "[ . 1 .]"
1 63 TYR 4.828 0.082 7 0 "[ . 1 .]"
1 64 PHE 3.801 0.114 7 0 "[ . 1 .]"
1 65 LEU 5.986 0.144 12 0 "[ . 1 .]"
1 66 ILE 3.441 0.088 12 0 "[ . 1 .]"
1 67 ARG 3.125 0.091 2 0 "[ . 1 .]"
1 68 LYS 2.615 0.114 7 0 "[ . 1 .]"
1 69 ARG 2.416 0.107 15 0 "[ . 1 .]"
1 70 ILE 2.199 0.072 7 0 "[ . 1 .]"
1 71 HIS 1.808 0.067 12 0 "[ . 1 .]"
1 72 LEU 5.194 0.093 8 0 "[ . 1 .]"
1 73 ARG 1.453 0.151 2 0 "[ . 1 .]"
1 74 ALA 0.790 0.101 6 0 "[ . 1 .]"
1 75 GLU 1.765 0.151 2 0 "[ . 1 .]"
1 76 ASP 1.090 0.079 5 0 "[ . 1 .]"
1 77 ALA 1.609 0.070 3 0 "[ . 1 .]"
1 78 LEU 2.781 0.082 7 0 "[ . 1 .]"
1 79 PHE 1.162 0.030 13 0 "[ . 1 .]"
1 80 PHE 0.865 0.041 1 0 "[ . 1 .]"
1 81 PHE 2.164 0.077 7 0 "[ . 1 .]"
1 82 VAL 2.125 0.079 6 0 "[ . 1 .]"
1 83 ASN 0.118 0.014 12 0 "[ . 1 .]"
1 84 ASN 0.388 0.034 9 0 "[ . 1 .]"
1 85 VAL 4.280 0.174 3 0 "[ . 1 .]"
1 86 ILE 4.176 0.174 3 0 "[ . 1 .]"
1 87 PRO 0.693 0.049 9 0 "[ . 1 .]"
1 88 PRO 0.756 0.049 9 0 "[ . 1 .]"
1 89 THR 0.453 0.021 2 0 "[ . 1 .]"
1 90 SER 0.041 0.019 3 0 "[ . 1 .]"
1 91 ALA 0.484 0.032 3 0 "[ . 1 .]"
1 92 THR 0.075 0.009 14 0 "[ . 1 .]"
1 93 MET 3.419 0.086 5 0 "[ . 1 .]"
1 94 GLY 0.431 0.039 2 0 "[ . 1 .]"
1 95 GLN 1.137 0.041 1 0 "[ . 1 .]"
1 96 LEU 1.385 0.043 3 0 "[ . 1 .]"
1 97 TYR 2.435 0.076 13 0 "[ . 1 .]"
1 98 GLN 2.072 0.087 10 0 "[ . 1 .]"
1 99 GLU 1.752 0.058 15 0 "[ . 1 .]"
1 100 HIS 1.055 0.068 3 0 "[ . 1 .]"
1 101 HIS 1.198 0.075 10 0 "[ . 1 .]"
1 102 GLU 0.637 0.051 10 0 "[ . 1 .]"
1 103 GLU 0.498 0.066 6 0 "[ . 1 .]"
1 104 ASP 1.334 0.071 14 0 "[ . 1 .]"
1 105 PHE 0.670 0.051 3 0 "[ . 1 .]"
1 106 PHE 2.404 0.070 3 0 "[ . 1 .]"
1 107 LEU 5.572 0.122 9 0 "[ . 1 .]"
1 108 TYR 4.394 0.167 4 0 "[ . 1 .]"
1 109 ILE 3.600 0.122 9 0 "[ . 1 .]"
1 110 ALA 1.751 0.096 4 0 "[ . 1 .]"
1 111 TYR 4.887 0.096 4 0 "[ . 1 .]"
1 112 SER 0.745 0.056 10 0 "[ . 1 .]"
1 113 ASP 0.382 0.041 3 0 "[ . 1 .]"
1 114 GLU 0.903 0.044 14 0 "[ . 1 .]"
1 115 SER 2.179 0.077 7 0 "[ . 1 .]"
1 116 VAL 2.274 0.059 4 0 "[ . 1 .]"
1 117 TYR 2.653 0.073 4 0 "[ . 1 .]"
1 118 GLY 0.565 0.073 4 0 "[ . 1 .]"
1 119 LEU 3.595 0.136 2 0 "[ . 1 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER HA 1 2 SER QB 2.100 . 2.600 2.275 2.174 2.501 . 0 0 "[ . 1 .]" 1
2 1 2 SER HA 1 3 MET H 2.400 . 3.100 2.603 2.281 2.983 . 0 0 "[ . 1 .]" 1
3 1 2 SER HA 1 119 LEU QD 3.500 . 5.100 4.987 3.138 5.127 0.027 2 0 "[ . 1 .]" 1
4 1 2 SER QB 1 3 MET H 3.000 . 4.100 3.683 1.975 4.072 . 0 0 "[ . 1 .]" 1
5 1 2 SER QB 1 3 MET QG 4.200 . 6.000 4.584 3.313 5.268 . 0 0 "[ . 1 .]" 1
6 1 2 SER QB 1 4 LYS QG 5.100 . 6.000 5.765 4.867 6.009 0.009 3 0 "[ . 1 .]" 1
7 1 2 SER QB 1 117 TYR QD 3.300 . 4.700 4.230 3.738 4.732 0.032 3 0 "[ . 1 .]" 1
8 1 2 SER QB 1 119 LEU QD 3.800 . 5.600 3.358 2.925 4.675 . 0 0 "[ . 1 .]" 1
9 1 3 MET H 1 3 MET QB 2.800 . 3.800 2.400 2.262 3.211 . 0 0 "[ . 1 .]" 1
10 1 3 MET H 1 3 MET QG 3.100 . 4.300 2.952 2.578 3.296 . 0 0 "[ . 1 .]" 1
11 1 3 MET HA 1 3 MET QB 2.400 . 3.100 2.439 2.381 2.478 . 0 0 "[ . 1 .]" 1
12 1 3 MET HA 1 3 MET QB 1.900 . 2.400 2.060 2.016 2.098 . 0 0 "[ . 1 .]" 1
13 1 3 MET HA 1 3 MET ME 3.200 . 4.500 3.480 3.015 3.738 . 0 0 "[ . 1 .]" 1
14 1 3 MET HA 1 3 MET QG 2.600 . 2.700 2.224 2.135 2.331 . 0 0 "[ . 1 .]" 1
15 1 3 MET HA 1 4 LYS H 1.900 . 2.300 2.238 2.126 2.332 0.032 6 0 "[ . 1 .]" 1
16 1 3 MET HA 1 4 LYS HA 3.200 . 4.500 4.409 4.382 4.447 . 0 0 "[ . 1 .]" 1
17 1 3 MET HA 1 4 LYS QB 4.000 . 6.000 4.132 3.946 4.396 . 0 0 "[ . 1 .]" 1
18 1 3 MET HA 1 4 LYS QB 2.500 . 3.300 3.084 2.656 3.335 0.035 3 0 "[ . 1 .]" 1
19 1 3 MET HA 1 4 LYS QG . . 5.200 4.908 4.372 5.207 0.007 11 0 "[ . 1 .]" 1
20 1 3 MET HA 1 38 ALA MB 4.400 . 6.000 5.684 5.439 5.860 . 0 0 "[ . 1 .]" 1
21 1 3 MET HA 1 39 PRO QG 3.300 . 4.700 4.234 3.831 4.486 . 0 0 "[ . 1 .]" 1
22 1 3 MET HA 1 117 TYR QD 2.800 . 3.800 3.524 3.117 3.863 0.063 14 0 "[ . 1 .]" 1
23 1 3 MET HA 1 117 TYR QE 2.100 . 2.700 1.857 1.768 2.037 . 0 0 "[ . 1 .]" 1
24 1 3 MET HA 1 119 LEU QD 3.000 . 4.100 4.122 4.104 4.136 0.036 14 0 "[ . 1 .]" 1
25 1 3 MET QB 1 3 MET ME 2.100 . 2.700 2.714 2.665 2.733 0.033 4 0 "[ . 1 .]" 1
26 1 3 MET QB 1 3 MET QG 2.100 . 2.200 2.064 2.046 2.076 . 0 0 "[ . 1 .]" 1
27 1 3 MET QB 1 4 LYS H 2.800 . 3.800 2.768 2.480 3.132 . 0 0 "[ . 1 .]" 1
28 1 3 MET QB 1 5 PHE QE 3.000 . 4.100 2.173 1.880 3.129 0.020 11 0 "[ . 1 .]" 1
29 1 3 MET QB 1 4 LYS H 3.800 . 5.600 2.858 2.513 3.310 . 0 0 "[ . 1 .]" 1
30 1 3 MET QB 1 5 PHE QD 3.000 . 4.100 2.709 2.413 3.434 . 0 0 "[ . 1 .]" 1
31 1 3 MET QB 1 5 PHE QD 3.000 . 4.100 2.665 2.393 3.227 . 0 0 "[ . 1 .]" 1
32 1 3 MET QB 1 5 PHE QE 2.800 . 3.800 2.204 1.894 3.242 . 0 0 "[ . 1 .]" 1
33 1 3 MET QB 1 84 ASN HD22 6.000 . 6.000 5.293 3.346 6.006 0.006 9 0 "[ . 1 .]" 1
34 1 3 MET QB 1 108 TYR QD 3.600 . 5.300 4.940 4.422 5.222 . 0 0 "[ . 1 .]" 1
35 1 3 MET QB 1 117 TYR QR 6.000 . 6.000 3.560 3.387 3.748 . 0 0 "[ . 1 .]" 1
36 1 3 MET ME 1 3 MET QG 2.400 . 3.100 2.211 2.043 2.260 . 0 0 "[ . 1 .]" 1
37 1 3 MET ME 1 4 LYS H 4.200 . 6.000 3.774 3.447 4.282 . 0 0 "[ . 1 .]" 1
38 1 3 MET ME 1 5 PHE HA 4.200 . 6.000 5.680 5.421 5.928 . 0 0 "[ . 1 .]" 1
39 1 3 MET ME 1 5 PHE QE 2.300 . 3.000 1.832 1.645 1.992 . 0 0 "[ . 1 .]" 1
40 1 3 MET ME 1 5 PHE HZ 2.200 . 2.800 2.158 1.820 2.743 . 0 0 "[ . 1 .]" 1
41 1 3 MET ME 1 36 GLU H 3.500 . 5.000 5.027 4.890 5.058 0.058 15 0 "[ . 1 .]" 1
42 1 3 MET ME 1 36 GLU QB 2.600 . 3.400 3.455 3.435 3.474 0.074 6 0 "[ . 1 .]" 1
43 1 3 MET ME 1 38 ALA HA 2.900 . 3.900 3.909 3.877 3.954 0.054 15 0 "[ . 1 .]" 1
44 1 3 MET ME 1 38 ALA MB 2.700 . 3.600 3.645 3.634 3.662 0.062 3 0 "[ . 1 .]" 1
45 1 3 MET ME 1 39 PRO QD 4.700 . 5.000 3.894 3.863 3.961 . 0 0 "[ . 1 .]" 1
46 1 3 MET ME 1 81 PHE H 4.000 . 6.000 4.255 4.142 4.361 . 0 0 "[ . 1 .]" 1
47 1 3 MET ME 1 81 PHE HA 3.800 . 5.600 4.537 4.373 4.638 . 0 0 "[ . 1 .]" 1
48 1 3 MET ME 1 81 PHE QB 2.400 . 3.100 2.527 2.347 2.697 . 0 0 "[ . 1 .]" 1
49 1 3 MET ME 1 82 VAL H 3.700 . 5.500 4.713 4.462 4.851 . 0 0 "[ . 1 .]" 1
50 1 3 MET ME 1 82 VAL HA 2.700 . 3.600 3.550 3.260 3.623 0.023 10 0 "[ . 1 .]" 1
51 1 3 MET ME 1 83 ASN H 2.800 . 3.800 3.563 3.223 3.809 0.009 3 0 "[ . 1 .]" 1
52 1 3 MET ME 1 83 ASN HA 3.500 . 5.000 4.658 4.233 4.948 . 0 0 "[ . 1 .]" 1
53 1 3 MET ME 1 84 ASN H 3.200 . 4.400 3.100 2.857 3.297 . 0 0 "[ . 1 .]" 1
54 1 3 MET ME 1 84 ASN HA 2.500 . 3.300 3.320 3.311 3.334 0.034 13 0 "[ . 1 .]" 1
55 1 3 MET ME 1 109 ILE HA 3.600 . 5.200 3.909 3.645 4.483 . 0 0 "[ . 1 .]" 1
56 1 3 MET ME 1 110 ALA H 2.900 . 3.900 3.316 3.135 3.761 . 0 0 "[ . 1 .]" 1
57 1 3 MET ME 1 110 ALA HA 4.000 . 6.000 3.665 3.599 3.787 . 0 0 "[ . 1 .]" 1
58 1 3 MET ME 1 111 TYR H 3.800 . 5.600 4.643 4.577 4.727 . 0 0 "[ . 1 .]" 1
59 1 3 MET ME 1 117 TYR QR 2.300 . 3.000 2.058 1.875 2.215 . 0 0 "[ . 1 .]" 1
60 1 3 MET QG 1 4 LYS H 4.800 . 5.600 3.776 3.555 4.043 . 0 0 "[ . 1 .]" 1
61 1 3 MET QG 1 5 PHE QD 3.800 . 5.600 4.227 4.001 4.519 . 0 0 "[ . 1 .]" 1
62 1 3 MET QG 1 5 PHE QE 3.000 . 4.100 3.440 3.027 4.123 0.023 6 0 "[ . 1 .]" 1
63 1 3 MET QG 1 83 ASN H 4.700 . 6.000 4.133 3.981 4.328 . 0 0 "[ . 1 .]" 1
64 1 3 MET QG 1 83 ASN HA 2.700 . 3.600 3.606 3.601 3.614 0.014 12 0 "[ . 1 .]" 1
65 1 3 MET QG 1 84 ASN H 4.100 . 6.000 3.133 2.843 3.444 . 0 0 "[ . 1 .]" 1
66 1 3 MET QG 1 84 ASN HD22 3.700 . 5.400 3.653 2.100 4.411 . 0 0 "[ . 1 .]" 1
67 1 3 MET QG 1 117 TYR QD 3.000 . 4.100 3.347 3.142 3.564 . 0 0 "[ . 1 .]" 1
68 1 3 MET QG 1 117 TYR QR 3.300 . 4.600 2.781 2.590 3.038 . 0 0 "[ . 1 .]" 1
69 1 3 MET QG 1 117 TYR QE 3.200 . 4.500 2.990 2.701 3.344 . 0 0 "[ . 1 .]" 1
70 1 4 LYS H 1 4 LYS HA 2.800 . 3.800 2.944 2.931 2.949 . 0 0 "[ . 1 .]" 1
71 1 4 LYS H 1 4 LYS QB 2.100 . 2.700 2.447 2.245 2.573 . 0 0 "[ . 1 .]" 1
72 1 4 LYS H 1 4 LYS QG 3.600 . 4.700 3.834 3.400 4.107 . 0 0 "[ . 1 .]" 1
73 1 4 LYS H 1 5 PHE H 4.000 . 6.000 4.091 3.458 4.398 . 0 0 "[ . 1 .]" 1
74 1 4 LYS H 1 39 PRO QD 5.100 . 6.000 3.368 2.914 4.193 . 0 0 "[ . 1 .]" 1
75 1 4 LYS H 1 117 TYR QE 3.500 . 5.000 2.628 2.018 3.316 . 0 0 "[ . 1 .]" 1
76 1 4 LYS H 1 119 LEU QD 5.200 . 6.000 4.854 4.576 5.176 . 0 0 "[ . 1 .]" 1
77 1 4 LYS HA 1 4 LYS QB 2.000 . 2.500 2.464 2.355 2.508 0.008 2 0 "[ . 1 .]" 1
78 1 4 LYS HA 1 4 LYS QD 2.600 . 3.400 3.041 2.609 3.424 0.024 10 0 "[ . 1 .]" 1
79 1 4 LYS HA 1 4 LYS QG 2.500 . 3.300 2.243 2.133 2.432 . 0 0 "[ . 1 .]" 1
80 1 4 LYS HA 1 5 PHE H 2.000 . 2.500 2.193 2.147 2.392 . 0 0 "[ . 1 .]" 1
81 1 4 LYS HA 1 5 PHE QD 4.000 . 6.000 3.531 3.200 4.296 . 0 0 "[ . 1 .]" 1
82 1 4 LYS QB 1 4 LYS QE 3.200 . 4.500 3.509 2.647 3.777 . 0 0 "[ . 1 .]" 1
83 1 4 LYS QB 1 4 LYS QG 2.200 . 2.700 2.016 1.999 2.021 . 0 0 "[ . 1 .]" 1
84 1 4 LYS QB 1 5 PHE H 3.100 . 4.300 3.543 3.147 3.902 . 0 0 "[ . 1 .]" 1
85 1 4 LYS QB 1 39 PRO QG 2.900 . 3.600 2.976 2.312 3.439 . 0 0 "[ . 1 .]" 1
86 1 4 LYS QB 1 119 LEU QD 3.400 . 4.800 4.753 4.477 4.847 0.047 3 0 "[ . 1 .]" 1
87 1 4 LYS QD 1 4 LYS QG 1.800 . 2.200 2.060 2.031 2.088 . 0 0 "[ . 1 .]" 1
88 1 4 LYS QD 1 5 PHE H 5.300 . 6.000 4.913 4.504 5.168 . 0 0 "[ . 1 .]" 1
89 1 4 LYS QE 1 4 LYS QG 2.800 . 3.600 2.171 1.955 2.478 . 0 0 "[ . 1 .]" 1
90 1 4 LYS QG 1 5 PHE H 4.400 . 6.000 4.052 3.627 4.498 . 0 0 "[ . 1 .]" 1
91 1 5 PHE H 1 5 PHE QB 2.600 . 3.500 2.445 2.298 2.554 . 0 0 "[ . 1 .]" 1
92 1 5 PHE H 1 5 PHE QD 2.900 . 4.000 2.799 2.469 3.189 . 0 0 "[ . 1 .]" 1
93 1 5 PHE H 1 5 PHE QE 5.300 . 6.000 5.045 4.794 5.452 . 0 0 "[ . 1 .]" 1
94 1 5 PHE HA 1 5 PHE QB 2.400 . 3.100 2.446 2.409 2.489 . 0 0 "[ . 1 .]" 1
95 1 5 PHE HA 1 5 PHE QD 2.400 . 3.100 2.842 2.017 3.069 . 0 0 "[ . 1 .]" 1
96 1 5 PHE HA 1 6 VAL QG 3.800 . 4.500 3.247 2.861 3.770 . 0 0 "[ . 1 .]" 1
97 1 5 PHE QB 1 5 PHE QD 2.400 . 2.500 2.168 2.125 2.328 . 0 0 "[ . 1 .]" 1
98 1 5 PHE QB 1 5 PHE QE 3.200 . 4.500 3.939 3.925 3.981 . 0 0 "[ . 1 .]" 1
99 1 5 PHE QB 1 7 TYR H 4.100 . 6.000 4.116 3.634 4.591 . 0 0 "[ . 1 .]" 1
100 1 5 PHE QB 1 7 TYR QB 3.700 . 5.400 4.798 4.556 5.071 . 0 0 "[ . 1 .]" 1
101 1 5 PHE QB 1 8 LYS H 2.900 . 3.900 3.208 3.007 3.463 . 0 0 "[ . 1 .]" 1
102 1 5 PHE QB 1 8 LYS QB 3.100 . 3.600 2.822 2.198 3.604 0.004 6 0 "[ . 1 .]" 1
103 1 5 PHE QB 1 8 LYS QD 4.600 . 6.000 4.232 3.147 5.407 . 0 0 "[ . 1 .]" 1
104 1 5 PHE QB 1 8 LYS QG 4.600 . 6.000 3.317 1.891 4.674 0.009 6 0 "[ . 1 .]" 1
105 1 5 PHE QB 1 9 GLU QB 4.200 . 6.000 2.669 1.993 2.951 0.007 8 0 "[ . 1 .]" 1
106 1 5 PHE QB 1 9 GLU QG 5.200 . 6.000 2.596 1.814 3.831 . 0 0 "[ . 1 .]" 1
107 1 5 PHE QB 1 34 ILE QG 4.000 . 5.000 4.205 3.731 4.482 . 0 0 "[ . 1 .]" 1
108 1 5 PHE QB 1 49 LYS QD 3.200 . 4.500 4.157 3.924 4.495 . 0 0 "[ . 1 .]" 1
109 1 5 PHE QB 1 108 TYR QD 3.000 . 4.100 3.747 3.393 4.140 0.040 6 0 "[ . 1 .]" 1
110 1 5 PHE QD 1 35 VAL QG 4.100 . 6.000 5.016 4.820 5.134 . 0 0 "[ . 1 .]" 1
111 1 5 PHE QD 1 36 GLU H 3.900 . 5.800 4.351 4.079 4.619 . 0 0 "[ . 1 .]" 1
112 1 5 PHE QD 1 108 TYR QB 3.700 . 5.400 3.269 2.169 3.643 . 0 0 "[ . 1 .]" 1
113 1 5 PHE QD 1 109 ILE H 4.600 . 6.000 4.060 3.486 4.587 . 0 0 "[ . 1 .]" 1
114 1 5 PHE QD 1 110 ALA HA 3.600 . 5.200 3.630 3.410 3.886 . 0 0 "[ . 1 .]" 1
115 1 5 PHE QD 1 110 ALA MB 2.300 . 2.900 2.387 1.938 2.863 . 0 0 "[ . 1 .]" 1
116 1 5 PHE QD 1 8 LYS QB 3.100 . 4.300 2.272 1.894 3.790 0.006 11 0 "[ . 1 .]" 1
117 1 5 PHE QD 1 8 LYS QD 3.300 . 4.600 4.019 2.639 4.620 0.020 14 0 "[ . 1 .]" 1
118 1 5 PHE QD 1 8 LYS QG 3.300 . 4.700 2.928 1.894 4.007 0.006 3 0 "[ . 1 .]" 1
119 1 5 PHE QD 1 34 ILE QG 2.600 . 3.500 2.953 2.593 3.506 0.006 6 0 "[ . 1 .]" 1
120 1 5 PHE QD 1 36 GLU HA 4.900 . 6.000 5.174 4.851 5.459 . 0 0 "[ . 1 .]" 1
121 1 5 PHE QD 1 36 GLU QB 2.800 . 3.600 3.349 2.979 3.610 0.010 1 0 "[ . 1 .]" 1
122 1 5 PHE QD 1 36 GLU QG 2.600 . 3.400 2.416 2.025 2.772 . 0 0 "[ . 1 .]" 1
123 1 5 PHE QE 1 34 ILE HB 4.600 . 6.000 3.933 3.229 4.966 . 0 0 "[ . 1 .]" 1
124 1 5 PHE QE 1 34 ILE QG 4.000 . 6.000 3.226 2.606 4.232 . 0 0 "[ . 1 .]" 1
125 1 5 PHE QE 1 35 VAL HA 4.600 . 6.000 4.317 4.068 5.008 . 0 0 "[ . 1 .]" 1
126 1 5 PHE QE 1 36 GLU H 3.200 . 4.500 4.257 3.863 4.533 0.033 6 0 "[ . 1 .]" 1
127 1 5 PHE QE 1 36 GLU QB 2.800 . 3.800 2.216 1.969 2.595 0.031 10 0 "[ . 1 .]" 1
128 1 5 PHE QE 1 36 GLU QG 3.600 . 5.200 2.859 2.492 3.375 . 0 0 "[ . 1 .]" 1
129 1 5 PHE QE 1 108 TYR QB 4.000 . 6.000 2.714 1.946 3.206 0.054 6 0 "[ . 1 .]" 1
130 1 5 PHE QE 1 109 ILE H 6.000 . 6.000 3.311 2.824 3.881 . 0 0 "[ . 1 .]" 1
131 1 5 PHE QE 1 109 ILE QG 4.100 . 6.000 4.692 4.443 4.848 . 0 0 "[ . 1 .]" 1
132 1 5 PHE QE 1 110 ALA HA 3.200 . 4.500 4.215 3.844 4.399 . 0 0 "[ . 1 .]" 1
133 1 5 PHE QE 1 110 ALA MB 2.700 . 3.600 2.916 2.173 3.270 . 0 0 "[ . 1 .]" 1
134 1 5 PHE QE 1 111 TYR H 4.400 . 6.000 5.875 5.104 6.049 0.049 9 0 "[ . 1 .]" 1
135 1 5 PHE HZ 1 108 TYR QD 2.900 . 3.900 3.599 3.041 3.929 0.029 6 0 "[ . 1 .]" 1
136 1 5 PHE HZ 1 110 ALA H 3.300 . 4.700 3.923 3.633 4.075 . 0 0 "[ . 1 .]" 1
137 1 5 PHE HZ 1 110 ALA MB 2.700 . 3.600 2.397 1.941 2.894 . 0 0 "[ . 1 .]" 1
138 1 6 VAL HA 1 6 VAL HB 2.200 . 2.800 2.672 2.466 2.894 0.094 9 0 "[ . 1 .]" 1
139 1 6 VAL HA 1 6 VAL QG 1.900 . 2.400 2.138 1.998 2.313 . 0 0 "[ . 1 .]" 1
140 1 6 VAL HA 1 7 TYR H 4.800 . 6.000 3.576 3.553 3.595 . 0 0 "[ . 1 .]" 1
141 1 6 VAL HA 1 9 GLU H 3.000 . 4.100 3.480 3.328 3.738 . 0 0 "[ . 1 .]" 1
142 1 6 VAL HA 1 9 GLU HA 3.600 2.200 5.000 5.030 5.015 5.046 0.046 4 0 "[ . 1 .]" 1
143 1 6 VAL HA 1 9 GLU QB 2.600 . 2.900 2.247 2.126 2.332 . 0 0 "[ . 1 .]" 1
144 1 6 VAL HA 1 9 GLU QG 2.900 . 4.000 3.802 3.600 4.025 0.025 13 0 "[ . 1 .]" 1
145 1 6 VAL HB 1 6 VAL QG 1.800 . 2.200 1.885 1.878 1.893 . 0 0 "[ . 1 .]" 1
146 1 6 VAL HB 1 7 TYR H 2.800 . 3.800 2.832 1.973 3.852 0.052 6 0 "[ . 1 .]" 1
147 1 6 VAL HB 1 7 TYR HA 3.900 . 5.800 4.361 3.653 5.629 . 0 0 "[ . 1 .]" 1
148 1 6 VAL HB 1 7 TYR QB 6.000 . 6.000 4.408 3.609 5.508 . 0 0 "[ . 1 .]" 1
149 1 6 VAL HB 1 36 GLU QG 4.300 . 6.000 5.920 5.511 6.031 0.031 2 0 "[ . 1 .]" 1
150 1 6 VAL HB 1 49 LYS QE 3.800 . 5.600 4.204 3.559 4.830 . 0 0 "[ . 1 .]" 1
151 1 6 VAL QG 1 7 TYR H 4.300 . 6.000 2.067 1.926 2.770 0.074 6 0 "[ . 1 .]" 1
152 1 6 VAL QG 1 7 TYR HA 3.000 . 4.100 3.748 2.971 4.130 0.030 13 0 "[ . 1 .]" 1
153 1 6 VAL QG 1 9 GLU H 3.700 . 5.400 4.178 4.065 4.303 . 0 0 "[ . 1 .]" 1
154 1 6 VAL QG 1 9 GLU QB 3.300 . 4.700 3.476 3.389 3.572 . 0 0 "[ . 1 .]" 1
155 1 6 VAL QG 1 10 GLU H 5.300 . 6.000 3.991 3.465 4.586 . 0 0 "[ . 1 .]" 1
156 1 6 VAL QG 1 10 GLU QB 3.200 . 4.500 4.017 3.182 4.507 0.007 13 0 "[ . 1 .]" 1
157 1 6 VAL QG 1 10 GLU QG 2.400 . 3.100 2.675 1.862 3.109 0.009 13 0 "[ . 1 .]" 1
158 1 6 VAL QG 1 49 LYS QE 3.500 . 4.500 2.639 2.156 2.961 . 0 0 "[ . 1 .]" 1
159 1 7 TYR H 1 7 TYR QB 2.700 . 3.600 2.253 2.168 2.316 . 0 0 "[ . 1 .]" 1
160 1 7 TYR H 1 34 ILE QG 5.300 . 6.000 4.921 4.698 5.137 . 0 0 "[ . 1 .]" 1
161 1 7 TYR HA 1 7 TYR QB 2.400 . 3.100 2.418 2.357 2.467 . 0 0 "[ . 1 .]" 1
162 1 7 TYR HA 1 7 TYR QD 2.400 . 3.100 2.448 2.094 2.701 . 0 0 "[ . 1 .]" 1
163 1 7 TYR HA 1 10 GLU QB 2.700 . 3.600 2.879 2.060 3.298 . 0 0 "[ . 1 .]" 1
164 1 7 TYR HA 1 10 GLU QG 4.200 . 6.000 3.787 2.633 4.523 . 0 0 "[ . 1 .]" 1
165 1 7 TYR HA 1 11 HIS H 2.900 . 4.000 3.698 3.407 3.966 . 0 0 "[ . 1 .]" 1
166 1 7 TYR HA 1 11 HIS HD1 2.700 . 3.600 3.184 2.833 3.575 . 0 0 "[ . 1 .]" 1
167 1 7 TYR HA 1 49 LYS QD 4.000 . 6.000 5.169 4.960 5.351 . 0 0 "[ . 1 .]" 1
168 1 7 TYR QB 1 7 TYR QD 2.700 . 3.000 2.146 2.136 2.170 . 0 0 "[ . 1 .]" 1
169 1 7 TYR QB 1 8 LYS H 3.200 . 3.400 2.300 1.942 2.527 . 0 0 "[ . 1 .]" 1
170 1 7 TYR QB 1 10 GLU QG 4.300 . 6.000 5.276 4.374 6.005 0.005 9 0 "[ . 1 .]" 1
171 1 7 TYR QB 1 34 ILE MD 4.900 . 6.000 4.661 3.683 5.101 . 0 0 "[ . 1 .]" 1
172 1 7 TYR QB 1 34 ILE QG 2.700 . 3.600 3.231 3.054 3.339 . 0 0 "[ . 1 .]" 1
173 1 7 TYR QB 1 49 LYS QD 2.600 . 3.400 2.467 2.271 2.655 . 0 0 "[ . 1 .]" 1
174 1 7 TYR QB 1 49 LYS QD 2.900 . 4.000 2.482 2.279 2.680 . 0 0 "[ . 1 .]" 1
175 1 7 TYR QB 1 49 LYS QG 3.700 . 5.400 2.031 1.964 2.255 0.036 7 0 "[ . 1 .]" 1
176 1 7 TYR QD 1 11 HIS HD1 3.300 . 4.700 3.410 2.891 3.968 . 0 0 "[ . 1 .]" 1
177 1 7 TYR QD 1 34 ILE MD 2.600 . 3.400 3.284 2.687 3.444 0.044 10 0 "[ . 1 .]" 1
178 1 7 TYR QD 1 34 ILE QG 3.200 . 4.500 2.774 2.265 3.536 . 0 0 "[ . 1 .]" 1
179 1 7 TYR QD 1 49 LYS QD 2.700 . 3.600 3.316 2.810 3.609 0.009 15 0 "[ . 1 .]" 1
180 1 7 TYR QD 1 49 LYS QE 3.500 . 5.000 3.732 3.507 3.823 . 0 0 "[ . 1 .]" 1
181 1 7 TYR QD 1 50 LYS QB 3.500 . 5.100 4.076 3.388 5.035 . 0 0 "[ . 1 .]" 1
182 1 7 TYR QE 1 10 GLU QB 3.800 . 5.600 5.535 4.632 5.627 0.027 10 0 "[ . 1 .]" 1
183 1 7 TYR QE 1 34 ILE MD 2.800 . 3.800 3.430 2.556 3.804 0.004 3 0 "[ . 1 .]" 1
184 1 7 TYR QE 1 49 LYS QD 4.200 . 6.000 5.351 4.877 5.643 . 0 0 "[ . 1 .]" 1
185 1 7 TYR QE 1 50 LYS QD 3.800 . 5.700 3.521 2.651 5.070 . 0 0 "[ . 1 .]" 1
186 1 7 TYR QE 1 50 LYS QE 3.200 . 4.000 3.270 2.422 4.031 0.031 14 0 "[ . 1 .]" 1
187 1 8 LYS H 1 8 LYS QB 3.500 . 5.100 2.212 2.071 2.372 . 0 0 "[ . 1 .]" 1
188 1 8 LYS H 1 9 GLU H 2.800 . 3.800 2.493 2.394 2.637 . 0 0 "[ . 1 .]" 1
189 1 8 LYS H 1 34 ILE QG 2.400 . 3.100 3.041 2.841 3.142 0.042 10 0 "[ . 1 .]" 1
190 1 8 LYS QB 1 8 LYS QD 3.200 . 3.900 2.155 1.972 2.365 . 0 0 "[ . 1 .]" 1
191 1 8 LYS QB 1 34 ILE HB 2.400 . 3.100 3.038 2.911 3.125 0.025 6 0 "[ . 1 .]" 1
192 1 8 LYS QB 1 49 LYS QB 3.000 . 3.800 3.853 3.836 3.877 0.077 7 0 "[ . 1 .]" 1
193 1 8 LYS QB 1 49 LYS QD 2.400 . 3.100 2.797 2.471 3.107 0.007 4 0 "[ . 1 .]" 1
194 1 8 LYS QB 1 49 LYS QE 4.700 . 6.000 3.143 2.723 3.871 . 0 0 "[ . 1 .]" 1
195 1 8 LYS QB 1 108 TYR QB 2.200 . 2.800 2.864 2.551 2.967 0.167 4 0 "[ . 1 .]" 1
196 1 8 LYS QB 1 108 TYR QD 2.700 . 3.600 3.024 2.544 3.657 0.057 5 0 "[ . 1 .]" 1
197 1 8 LYS QG 1 34 ILE HB 4.000 . 6.000 3.300 1.984 4.229 0.016 1 0 "[ . 1 .]" 1
198 1 9 GLU H 1 9 GLU HA 2.200 . 2.800 2.849 2.812 2.894 0.094 12 0 "[ . 1 .]" 1
199 1 9 GLU H 1 9 GLU QB 2.200 . 2.800 2.108 2.025 2.170 . 0 0 "[ . 1 .]" 1
200 1 9 GLU H 1 9 GLU QG 2.800 . 3.800 3.494 3.117 3.836 0.036 13 0 "[ . 1 .]" 1
201 1 9 GLU H 1 10 GLU H 3.400 . 4.800 2.593 2.210 2.912 . 0 0 "[ . 1 .]" 1
202 1 9 GLU HA 1 9 GLU QB 2.300 . 2.500 2.507 2.488 2.530 0.030 5 0 "[ . 1 .]" 1
203 1 9 GLU HA 1 9 GLU QG 2.100 . 2.500 2.238 2.010 2.531 0.031 5 0 "[ . 1 .]" 1
204 1 9 GLU HA 1 10 GLU H 3.600 . 5.200 3.525 3.410 3.559 . 0 0 "[ . 1 .]" 1
205 1 9 GLU QB 1 9 GLU QG 2.000 . 2.200 2.012 1.973 2.035 . 0 0 "[ . 1 .]" 1
206 1 9 GLU QB 1 10 GLU H 3.200 . 4.500 2.468 1.988 3.094 . 0 0 "[ . 1 .]" 1
207 1 9 GLU QB 1 10 GLU HA 4.500 . 6.000 3.754 3.629 3.989 . 0 0 "[ . 1 .]" 1
208 1 10 GLU H 1 10 GLU HA 3.000 . 4.100 2.793 2.716 2.916 . 0 0 "[ . 1 .]" 1
209 1 10 GLU H 1 10 GLU QB 2.900 . 4.000 2.346 2.153 2.526 . 0 0 "[ . 1 .]" 1
210 1 10 GLU H 1 10 GLU QG 3.000 . 4.100 2.563 2.194 3.503 . 0 0 "[ . 1 .]" 1
211 1 10 GLU HA 1 10 GLU QB 2.100 . 2.600 2.426 2.360 2.504 . 0 0 "[ . 1 .]" 1
212 1 10 GLU HA 1 10 GLU QG 2.500 . 2.800 2.350 2.121 2.600 . 0 0 "[ . 1 .]" 1
213 1 10 GLU HA 1 11 HIS H 3.900 . 5.800 3.575 3.558 3.598 . 0 0 "[ . 1 .]" 1
214 1 10 GLU QB 1 10 GLU QG 2.300 . 2.500 2.047 1.977 2.085 . 0 0 "[ . 1 .]" 1
215 1 10 GLU QB 1 11 HIS H 4.200 . 6.000 2.307 2.147 2.463 . 0 0 "[ . 1 .]" 1
216 1 10 GLU QB 1 11 HIS HD1 3.100 . 3.900 3.169 2.606 3.636 . 0 0 "[ . 1 .]" 1
217 1 10 GLU QG 1 11 HIS HD1 4.900 . 6.000 5.022 4.473 5.419 . 0 0 "[ . 1 .]" 1
218 1 10 GLU QG 1 49 LYS QE 2.500 . 3.300 3.273 3.109 3.338 0.038 6 0 "[ . 1 .]" 1
219 1 11 HIS H 1 11 HIS QB 4.900 . 6.000 2.269 2.157 2.867 . 0 0 "[ . 1 .]" 1
220 1 11 HIS H 1 49 LYS QE 5.000 . 6.000 6.079 6.057 6.119 0.119 4 0 "[ . 1 .]" 1
221 1 11 HIS HA 1 12 PRO QD 2.700 . 3.000 1.863 1.793 1.951 0.007 13 0 "[ . 1 .]" 1
222 1 11 HIS HA 1 12 PRO QG 2.800 . 3.800 3.798 3.705 3.851 0.051 9 0 "[ . 1 .]" 1
223 1 11 HIS HA 1 15 LYS QB 3.300 . 4.600 3.570 3.337 3.987 . 0 0 "[ . 1 .]" 1
224 1 11 HIS HA 1 15 LYS QD 3.100 . 4.300 4.351 4.326 4.383 0.083 11 0 "[ . 1 .]" 1
225 1 11 HIS QB 1 11 HIS HD1 2.900 . 3.900 2.358 2.314 2.480 . 0 0 "[ . 1 .]" 1
226 1 12 PRO HA 1 12 PRO QB 2.000 . 2.400 2.198 2.172 2.237 . 0 0 "[ . 1 .]" 1
227 1 12 PRO HA 1 12 PRO QD 5.400 . 6.000 3.130 3.036 3.356 . 0 0 "[ . 1 .]" 1
228 1 12 PRO HA 1 12 PRO QG 2.600 . 3.400 3.165 2.804 3.381 . 0 0 "[ . 1 .]" 1
229 1 12 PRO HA 1 13 PHE HA 3.300 . 4.600 4.300 4.284 4.313 . 0 0 "[ . 1 .]" 1
230 1 12 PRO HA 1 13 PHE QB 4.800 . 6.000 4.217 4.164 4.269 . 0 0 "[ . 1 .]" 1
231 1 12 PRO QB 1 12 PRO QD . . 4.100 2.960 2.694 3.014 . 0 0 "[ . 1 .]" 1
232 1 12 PRO QB 1 12 PRO QG 2.100 . 2.600 1.944 1.932 1.986 . 0 0 "[ . 1 .]" 1
233 1 12 PRO QB 1 13 PHE H 4.000 . 6.000 2.512 2.316 2.603 . 0 0 "[ . 1 .]" 1
234 1 12 PRO QB 1 13 PHE HA 3.100 . 4.300 4.345 4.325 4.383 0.083 14 0 "[ . 1 .]" 1
235 1 12 PRO QB 1 13 PHE QB . . 4.900 3.987 3.869 4.077 . 0 0 "[ . 1 .]" 1
236 1 12 PRO QB 1 14 GLU H 3.600 . 5.200 2.816 2.517 3.062 . 0 0 "[ . 1 .]" 1
237 1 12 PRO QB 1 14 GLU H 1.800 . 2.200 2.052 1.990 2.222 0.022 4 0 "[ . 1 .]" 1
238 1 12 PRO QB 1 15 LYS QD 3.000 . 4.100 3.801 1.871 4.119 0.029 11 0 "[ . 1 .]" 1
239 1 12 PRO QB 1 15 LYS QG 2.600 . 3.500 2.407 2.059 3.607 0.107 11 0 "[ . 1 .]" 1
240 1 12 PRO QD 1 12 PRO QG 2.200 . 2.700 1.942 1.933 1.972 . 0 0 "[ . 1 .]" 1
241 1 12 PRO QD 1 15 LYS HA 4.900 . 6.000 5.554 5.175 5.645 . 0 0 "[ . 1 .]" 1
242 1 12 PRO QD 1 15 LYS QB 2.600 . 3.300 3.319 3.157 3.429 0.129 3 0 "[ . 1 .]" 1
243 1 12 PRO QD 1 15 LYS QD 2.600 . 3.500 3.248 2.286 3.498 . 0 0 "[ . 1 .]" 1
244 1 12 PRO QD 1 15 LYS QG 4.300 . 5.400 1.997 1.975 2.129 0.025 3 0 "[ . 1 .]" 1
245 1 12 PRO QG 1 14 GLU H 5.000 . 6.000 4.721 4.495 5.045 . 0 0 "[ . 1 .]" 1
246 1 12 PRO QG 1 15 LYS QD 2.600 . 3.400 3.094 2.186 3.426 0.026 14 0 "[ . 1 .]" 1
247 1 12 PRO QG 1 15 LYS QE 2.900 . 4.000 2.433 1.844 3.999 . 0 0 "[ . 1 .]" 1
248 1 13 PHE H 1 13 PHE QB 3.200 . 4.400 2.229 2.196 2.277 . 0 0 "[ . 1 .]" 1
249 1 13 PHE H 1 14 GLU H 4.000 . 6.000 2.640 2.385 2.784 . 0 0 "[ . 1 .]" 1
250 1 13 PHE HA 1 13 PHE QB 2.300 . 3.000 2.446 2.419 2.457 . 0 0 "[ . 1 .]" 1
251 1 13 PHE HA 1 13 PHE QD 2.400 . 3.100 3.023 2.919 3.126 0.026 4 0 "[ . 1 .]" 1
252 1 13 PHE HA 1 14 GLU H 3.300 . 4.700 3.543 3.465 3.560 . 0 0 "[ . 1 .]" 1
253 1 13 PHE HA 1 14 GLU HA 3.600 . 5.200 4.828 4.795 4.880 . 0 0 "[ . 1 .]" 1
254 1 13 PHE HA 1 15 LYS QG 4.300 . 6.000 5.233 5.002 6.042 0.042 4 0 "[ . 1 .]" 1
255 1 13 PHE HA 1 16 ARG H 4.700 . 6.000 3.448 3.180 3.801 . 0 0 "[ . 1 .]" 1
256 1 13 PHE HA 1 16 ARG QD 2.500 . 3.300 3.072 1.898 3.330 0.030 7 0 "[ . 1 .]" 1
257 1 13 PHE HA 1 17 ARG H 4.700 . 6.000 3.711 3.403 3.945 . 0 0 "[ . 1 .]" 1
258 1 13 PHE HA 1 17 ARG QB 3.200 . 4.500 4.066 3.888 4.363 . 0 0 "[ . 1 .]" 1
259 1 13 PHE HA 1 17 ARG QD 6.000 . 6.000 5.609 5.291 5.857 . 0 0 "[ . 1 .]" 1
260 1 13 PHE QB 1 13 PHE QD 2.200 . 2.800 2.137 2.126 2.155 . 0 0 "[ . 1 .]" 1
261 1 13 PHE QB 1 14 GLU H 2.600 . 3.500 2.453 2.308 2.857 . 0 0 "[ . 1 .]" 1
262 1 13 PHE QB 1 14 GLU QG 4.000 . 6.000 4.262 3.361 4.863 . 0 0 "[ . 1 .]" 1
263 1 13 PHE QD 1 104 ASP QB 3.000 . 4.100 3.070 2.538 3.398 . 0 0 "[ . 1 .]" 1
264 1 13 PHE QD 1 14 GLU H 2.900 . 4.000 3.737 3.647 3.914 . 0 0 "[ . 1 .]" 1
265 1 13 PHE QD 1 14 GLU HA 2.500 . 3.300 3.308 3.264 3.318 0.018 10 0 "[ . 1 .]" 1
266 1 13 PHE QD 1 14 GLU QB 3.600 . 5.200 4.864 4.664 5.033 . 0 0 "[ . 1 .]" 1
267 1 13 PHE QD 1 14 GLU QG 3.300 . 4.600 4.459 4.047 4.610 0.010 11 0 "[ . 1 .]" 1
268 1 13 PHE QD 1 17 ARG QB 3.100 . 4.300 2.084 1.985 2.273 0.015 10 0 "[ . 1 .]" 1
269 1 13 PHE QD 1 17 ARG QD 2.400 . 3.100 2.774 2.353 3.109 0.009 8 0 "[ . 1 .]" 1
270 1 13 PHE QD 1 104 ASP HA 2.800 . 3.700 3.716 3.614 3.757 0.057 14 0 "[ . 1 .]" 1
271 1 13 PHE QD 1 104 ASP QB 2.800 . 3.800 3.518 3.083 3.838 0.038 2 0 "[ . 1 .]" 1
272 1 13 PHE QE 1 17 ARG QB 4.800 . 6.000 2.364 1.982 2.717 . 0 0 "[ . 1 .]" 1
273 1 13 PHE QE 1 17 ARG QD 2.400 . 3.100 2.210 1.859 2.855 . 0 0 "[ . 1 .]" 1
274 1 13 PHE QE 1 17 ARG QG 3.700 . 4.500 2.637 2.036 3.366 . 0 0 "[ . 1 .]" 1
275 1 13 PHE QE 1 103 GLU HA 4.700 . 6.000 4.916 4.785 5.074 . 0 0 "[ . 1 .]" 1
276 1 13 PHE QE 1 103 GLU QB 2.700 . 3.400 2.840 2.232 3.373 . 0 0 "[ . 1 .]" 1
277 1 13 PHE QE 1 103 GLU QG 2.600 . 3.500 3.288 3.006 3.490 . 0 0 "[ . 1 .]" 1
278 1 13 PHE QE 1 104 ASP HA 3.000 . 4.100 2.191 1.936 2.645 . 0 0 "[ . 1 .]" 1
279 1 13 PHE QE 1 104 ASP QB 2.500 . 3.300 2.998 2.613 3.307 0.007 9 0 "[ . 1 .]" 1
280 1 13 PHE HZ 1 17 ARG QD 3.600 . 5.200 4.270 3.500 4.951 . 0 0 "[ . 1 .]" 1
281 1 13 PHE HZ 1 103 GLU H 4.100 . 6.000 5.391 4.695 5.771 . 0 0 "[ . 1 .]" 1
282 1 13 PHE HZ 1 103 GLU HA 3.000 . 4.100 4.087 3.960 4.114 0.014 14 0 "[ . 1 .]" 1
283 1 13 PHE HZ 1 103 GLU QB 2.700 . 3.100 2.081 1.861 2.422 . 0 0 "[ . 1 .]" 1
284 1 13 PHE HZ 1 103 GLU QG 2.500 . 3.300 2.237 1.928 2.782 . 0 0 "[ . 1 .]" 1
285 1 13 PHE HZ 1 104 ASP QB 2.900 . 4.000 3.512 2.585 4.064 0.064 12 0 "[ . 1 .]" 1
286 1 14 GLU H 1 14 GLU HA 2.600 . 3.500 2.774 2.727 2.827 . 0 0 "[ . 1 .]" 1
287 1 14 GLU H 1 14 GLU QG 2.900 . 4.000 3.285 2.290 3.728 . 0 0 "[ . 1 .]" 1
288 1 14 GLU H 1 15 LYS H 2.900 . 3.900 2.708 2.575 2.833 . 0 0 "[ . 1 .]" 1
289 1 14 GLU H 1 15 LYS QB 3.900 . 5.800 4.884 4.450 5.002 . 0 0 "[ . 1 .]" 1
290 1 14 GLU H 1 16 ARG QG 6.000 . 6.000 5.059 4.369 6.011 0.011 15 0 "[ . 1 .]" 1
291 1 14 GLU HA 1 14 GLU QB 2.100 . 2.600 2.513 2.355 2.541 . 0 0 "[ . 1 .]" 1
292 1 14 GLU HA 1 14 GLU QG 2.300 . 3.000 2.131 2.014 2.501 . 0 0 "[ . 1 .]" 1
293 1 14 GLU HA 1 15 LYS H 3.200 . 4.500 3.440 3.386 3.466 . 0 0 "[ . 1 .]" 1
294 1 14 GLU HA 1 15 LYS HA 3.400 . 4.800 4.701 4.665 4.775 . 0 0 "[ . 1 .]" 1
295 1 14 GLU HA 1 15 LYS QD 4.800 . 6.000 5.783 4.067 6.077 0.077 9 0 "[ . 1 .]" 1
296 1 14 GLU HA 1 16 ARG H 5.000 . 6.000 5.100 4.678 5.349 . 0 0 "[ . 1 .]" 1
297 1 14 GLU HA 1 17 ARG H 4.700 . 6.000 3.850 3.575 4.063 . 0 0 "[ . 1 .]" 1
298 1 14 GLU HA 1 17 ARG QB 2.700 . 3.100 2.673 2.445 2.900 . 0 0 "[ . 1 .]" 1
299 1 14 GLU HA 1 17 ARG QD 3.300 . 4.700 3.406 2.990 3.749 . 0 0 "[ . 1 .]" 1
300 1 14 GLU HA 1 17 ARG QG 3.500 . 5.000 4.598 4.227 4.907 . 0 0 "[ . 1 .]" 1
301 1 14 GLU HA 1 18 SER H 3.200 . 4.500 3.509 3.403 3.618 . 0 0 "[ . 1 .]" 1
302 1 14 GLU QB 1 14 GLU QG 2.100 . 2.600 2.041 2.016 2.086 . 0 0 "[ . 1 .]" 1
303 1 14 GLU QB 1 15 LYS H 2.800 . 3.800 3.009 2.931 3.093 . 0 0 "[ . 1 .]" 1
304 1 14 GLU QB 1 15 LYS QG 3.100 . 4.300 3.312 3.069 4.366 0.066 4 0 "[ . 1 .]" 1
305 1 14 GLU QB 1 18 SER QB 4.800 . 6.000 4.037 3.714 4.569 . 0 0 "[ . 1 .]" 1
306 1 14 GLU QG 1 15 LYS QD 4.000 . 6.000 5.600 3.902 6.003 0.003 6 0 "[ . 1 .]" 1
307 1 15 LYS H 1 15 LYS HA 2.700 . 3.600 2.879 2.829 2.894 . 0 0 "[ . 1 .]" 1
308 1 15 LYS H 1 15 LYS QB 2.700 . 2.700 2.527 2.261 2.608 . 0 0 "[ . 1 .]" 1
309 1 15 LYS H 1 15 LYS QG 4.600 . 6.000 2.229 1.988 3.506 0.012 10 0 "[ . 1 .]" 1
310 1 15 LYS H 1 16 ARG H 3.600 . 5.200 2.647 2.418 2.985 . 0 0 "[ . 1 .]" 1
311 1 15 LYS HA 1 15 LYS QB 2.000 . 2.300 2.313 2.277 2.414 0.114 4 0 "[ . 1 .]" 1
312 1 15 LYS HA 1 15 LYS QD 2.600 . 3.400 2.586 2.430 2.712 . 0 0 "[ . 1 .]" 1
313 1 15 LYS HA 1 15 LYS QG 2.600 . 3.100 2.768 2.514 2.915 . 0 0 "[ . 1 .]" 1
314 1 15 LYS HA 1 16 ARG H 4.800 . 6.000 3.567 3.553 3.576 . 0 0 "[ . 1 .]" 1
315 1 15 LYS HA 1 18 SER H 3.500 . 5.100 3.576 3.428 3.726 . 0 0 "[ . 1 .]" 1
316 1 15 LYS QB 1 15 LYS QE 2.600 . 3.500 3.321 1.911 3.578 0.078 11 0 "[ . 1 .]" 1
317 1 15 LYS QB 1 15 LYS QG 2.200 . 2.700 2.006 1.960 2.018 . 0 0 "[ . 1 .]" 1
318 1 15 LYS QB 1 16 ARG H 2.400 . 3.100 2.148 1.935 2.491 . 0 0 "[ . 1 .]" 1
319 1 15 LYS QB 1 16 ARG QG 2.800 . 3.800 3.223 2.753 3.626 . 0 0 "[ . 1 .]" 1
320 1 15 LYS QB 1 18 SER QB 3.700 . 5.400 4.278 4.139 4.585 . 0 0 "[ . 1 .]" 1
321 1 15 LYS QD 1 15 LYS QE 2.000 . 2.500 2.057 2.016 2.086 . 0 0 "[ . 1 .]" 1
322 1 15 LYS QD 1 15 LYS QG 1.800 . 2.200 2.057 1.993 2.083 . 0 0 "[ . 1 .]" 1
323 1 15 LYS QD 1 18 SER QB 3.100 . 4.300 4.314 4.273 4.337 0.037 4 0 "[ . 1 .]" 1
324 1 15 LYS QE 1 15 LYS QG 2.600 . 3.000 2.126 1.936 2.374 . 0 0 "[ . 1 .]" 1
325 1 15 LYS QG 1 18 SER QB 3.400 . 4.800 4.728 4.618 4.818 0.018 13 0 "[ . 1 .]" 1
326 1 16 ARG QD 1 106 PHE QE 4.100 . 6.000 5.379 4.841 6.003 0.003 14 0 "[ . 1 .]" 1
327 1 17 ARG H 1 17 ARG QB 3.000 . 4.100 2.253 2.166 2.319 . 0 0 "[ . 1 .]" 1
328 1 17 ARG H 1 18 SER H 3.000 . 4.100 2.608 2.443 2.741 . 0 0 "[ . 1 .]" 1
329 1 17 ARG HA 1 17 ARG QD 3.100 . 4.000 3.996 3.932 4.026 0.026 13 0 "[ . 1 .]" 1
330 1 17 ARG HA 1 17 ARG QG 2.700 . 3.100 2.393 2.300 2.476 . 0 0 "[ . 1 .]" 1
331 1 17 ARG HA 1 18 SER H 3.100 . 4.300 3.558 3.546 3.568 . 0 0 "[ . 1 .]" 1
332 1 17 ARG HA 1 20 GLY H 4.000 . 6.000 3.573 3.136 3.916 . 0 0 "[ . 1 .]" 1
333 1 17 ARG HA 1 104 ASP HA 2.200 . 2.800 2.745 2.383 2.871 0.071 14 0 "[ . 1 .]" 1
334 1 17 ARG HA 1 104 ASP QB 3.100 . 4.100 3.279 2.636 4.027 . 0 0 "[ . 1 .]" 1
335 1 17 ARG HA 1 105 PHE H 4.100 . 6.000 4.283 4.081 4.770 . 0 0 "[ . 1 .]" 1
336 1 17 ARG HA 1 105 PHE QD 3.700 . 5.400 3.010 2.364 3.577 . 0 0 "[ . 1 .]" 1
337 1 17 ARG HA 1 105 PHE QE 3.800 . 5.600 4.946 4.257 5.604 0.004 7 0 "[ . 1 .]" 1
338 1 17 ARG QB 1 17 ARG QD 2.600 . 3.100 2.092 2.027 2.128 . 0 0 "[ . 1 .]" 1
339 1 17 ARG QB 1 18 SER H 2.800 . 3.400 2.306 2.175 2.416 . 0 0 "[ . 1 .]" 1
340 1 17 ARG QB 1 104 ASP HA 2.600 . 3.400 2.527 2.108 2.849 . 0 0 "[ . 1 .]" 1
341 1 17 ARG QB 1 104 ASP QB 4.200 . 6.000 3.249 2.270 4.227 . 0 0 "[ . 1 .]" 1
342 1 17 ARG QD 1 17 ARG QG 2.300 . 2.600 2.072 2.039 2.088 . 0 0 "[ . 1 .]" 1
343 1 17 ARG QD 1 18 SER H 3.500 . 4.300 4.239 3.881 4.348 0.048 7 0 "[ . 1 .]" 1
344 1 17 ARG QD 1 103 GLU QG 3.400 . 4.900 4.621 4.219 4.921 0.021 7 0 "[ . 1 .]" 1
345 1 17 ARG QD 1 104 ASP HA 3.000 . 4.000 3.569 2.837 4.001 0.001 10 0 "[ . 1 .]" 1
346 1 17 ARG QD 1 105 PHE QD 3.000 . 4.100 4.052 3.663 4.129 0.029 12 0 "[ . 1 .]" 1
347 1 17 ARG QG 1 18 SER H 3.000 . 4.100 3.663 3.367 4.077 . 0 0 "[ . 1 .]" 1
348 1 17 ARG QG 1 104 ASP HA 2.500 . 2.900 2.451 1.908 2.906 0.006 4 0 "[ . 1 .]" 1
349 1 17 ARG QG 1 105 PHE QD 2.800 . 3.800 2.150 1.950 2.402 . 0 0 "[ . 1 .]" 1
350 1 17 ARG QG 1 105 PHE QE 2.700 . 3.600 2.820 2.263 3.371 . 0 0 "[ . 1 .]" 1
351 1 18 SER H 1 18 SER HA 2.100 . 2.700 2.734 2.707 2.751 0.051 4 0 "[ . 1 .]" 1
352 1 18 SER H 1 18 SER QB 1.900 . 2.400 2.253 2.202 2.381 . 0 0 "[ . 1 .]" 1
353 1 18 SER H 1 19 GLU H 2.700 . 3.600 2.971 2.826 3.230 . 0 0 "[ . 1 .]" 1
354 1 18 SER H 1 20 GLY H 3.900 . 5.800 4.272 4.197 4.398 . 0 0 "[ . 1 .]" 1
355 1 18 SER H 1 21 GLU H 6.000 . 6.000 4.736 4.572 4.862 . 0 0 "[ . 1 .]" 1
356 1 18 SER H 1 104 ASP HA 6.000 . 6.000 5.662 5.218 5.842 . 0 0 "[ . 1 .]" 1
357 1 18 SER HA 1 18 SER QB 2.000 . 2.300 2.298 2.268 2.418 0.118 9 0 "[ . 1 .]" 1
358 1 18 SER HA 1 19 GLU H 3.200 . 4.500 3.551 3.513 3.568 . 0 0 "[ . 1 .]" 1
359 1 18 SER HA 1 19 GLU QB 6.000 . 6.000 5.243 5.220 5.279 . 0 0 "[ . 1 .]" 1
360 1 18 SER HA 1 21 GLU H 3.200 . 4.500 3.976 3.640 4.281 . 0 0 "[ . 1 .]" 1
361 1 18 SER HA 1 21 GLU QB 2.400 . 3.100 2.977 2.677 3.106 0.006 9 0 "[ . 1 .]" 1
362 1 18 SER HA 1 21 GLU QB 2.300 . 3.000 2.921 2.652 3.023 0.023 9 0 "[ . 1 .]" 1
363 1 18 SER HA 1 21 GLU QG 3.200 . 4.300 4.265 4.087 4.307 0.007 4 0 "[ . 1 .]" 1
364 1 18 SER HA 1 22 LYS H 5.000 . 6.000 4.580 4.064 4.946 . 0 0 "[ . 1 .]" 1
365 1 18 SER QB 1 19 GLU H 3.000 . 4.100 2.390 2.117 2.717 . 0 0 "[ . 1 .]" 1
366 1 18 SER QB 1 21 GLU QB 3.900 . 5.800 4.756 4.470 4.894 . 0 0 "[ . 1 .]" 1
367 1 19 GLU H 1 19 GLU HA 2.500 . 3.300 2.794 2.732 2.868 . 0 0 "[ . 1 .]" 1
368 1 19 GLU H 1 19 GLU QB 2.400 . 3.100 2.038 2.015 2.092 . 0 0 "[ . 1 .]" 1
369 1 19 GLU H 1 19 GLU QG 3.300 . 3.400 3.428 3.411 3.440 0.040 3 0 "[ . 1 .]" 1
370 1 19 GLU H 1 20 GLY H 2.600 . 3.400 2.747 2.488 2.943 . 0 0 "[ . 1 .]" 1
371 1 19 GLU HA 1 19 GLU QB 2.000 . 2.500 2.530 2.517 2.533 0.033 13 0 "[ . 1 .]" 1
372 1 19 GLU HA 1 19 GLU QB 1.900 . 2.300 2.000 1.971 2.027 . 0 0 "[ . 1 .]" 1
373 1 19 GLU HA 1 19 GLU QG 2.200 . 2.600 2.096 2.055 2.133 . 0 0 "[ . 1 .]" 1
374 1 19 GLU HA 1 20 GLY H 3.200 . 4.500 3.550 3.534 3.563 . 0 0 "[ . 1 .]" 1
375 1 19 GLU HA 1 20 GLY QA 6.000 . 6.000 4.472 4.452 4.486 . 0 0 "[ . 1 .]" 1
376 1 19 GLU HA 1 22 LYS H 2.900 . 4.000 3.756 3.652 3.940 . 0 0 "[ . 1 .]" 1
377 1 19 GLU HA 1 22 LYS HA 4.400 . 6.000 5.807 5.762 5.876 . 0 0 "[ . 1 .]" 1
378 1 19 GLU HA 1 22 LYS QB 2.400 . 2.900 2.902 2.845 2.918 0.018 3 0 "[ . 1 .]" 1
379 1 19 GLU HA 1 22 LYS QD 2.500 . 3.300 3.185 2.921 3.308 0.008 10 0 "[ . 1 .]" 1
380 1 19 GLU HA 1 22 LYS QE 3.200 . 4.500 4.014 3.291 4.505 0.005 5 0 "[ . 1 .]" 1
381 1 19 GLU HA 1 22 LYS QG 4.200 . 6.000 4.588 4.455 4.781 . 0 0 "[ . 1 .]" 1
382 1 19 GLU HA 1 23 ILE H 4.700 . 6.000 3.920 3.697 4.129 . 0 0 "[ . 1 .]" 1
383 1 19 GLU HA 1 23 ILE MD 3.200 . 4.500 3.186 2.645 3.791 . 0 0 "[ . 1 .]" 1
384 1 19 GLU HA 1 106 PHE HZ 3.900 . 5.800 4.875 4.594 5.139 . 0 0 "[ . 1 .]" 1
385 1 19 GLU QB 1 50 LYS QE 4.000 . 6.000 3.354 2.887 4.459 . 0 0 "[ . 1 .]" 1
386 1 19 GLU QB 1 20 GLY H 2.300 . 2.900 2.567 2.451 2.675 . 0 0 "[ . 1 .]" 1
387 1 19 GLU QB 1 20 GLY QA 3.600 . 5.200 3.471 3.431 3.524 . 0 0 "[ . 1 .]" 1
388 1 19 GLU QB 1 50 LYS QE 4.400 . 6.000 3.689 3.249 4.840 . 0 0 "[ . 1 .]" 1
389 1 19 GLU QB 1 106 PHE QE 2.600 . 3.400 2.114 1.977 2.232 . 0 0 "[ . 1 .]" 1
390 1 19 GLU QB 1 106 PHE HZ 2.200 . 2.800 2.069 1.864 2.278 . 0 0 "[ . 1 .]" 1
391 1 19 GLU QG 1 20 GLY H 3.800 . 5.600 4.323 4.231 4.420 . 0 0 "[ . 1 .]" 1
392 1 19 GLU QG 1 23 ILE MD 2.600 . 2.600 2.194 2.010 2.371 . 0 0 "[ . 1 .]" 1
393 1 19 GLU QG 1 50 LYS QE 4.100 . 6.000 3.889 3.231 5.219 . 0 0 "[ . 1 .]" 1
394 1 19 GLU QG 1 106 PHE QE 2.800 . 3.800 3.831 3.825 3.835 0.035 15 0 "[ . 1 .]" 1
395 1 19 GLU QG 1 106 PHE HZ 2.600 . 3.500 3.222 3.071 3.501 0.001 3 0 "[ . 1 .]" 1
396 1 20 GLY H 1 20 GLY QA 2.400 . 2.900 2.196 2.192 2.203 . 0 0 "[ . 1 .]" 1
397 1 20 GLY H 1 21 GLU H 2.700 . 3.600 2.870 2.755 3.044 . 0 0 "[ . 1 .]" 1
398 1 20 GLY H 1 21 GLU QB 3.700 . 5.400 4.470 4.396 4.531 . 0 0 "[ . 1 .]" 1
399 1 20 GLY H 1 22 LYS QB 4.300 . 6.000 4.917 4.808 5.037 . 0 0 "[ . 1 .]" 1
400 1 20 GLY H 1 23 ILE MD 3.500 . 5.000 3.835 3.530 4.200 . 0 0 "[ . 1 .]" 1
401 1 20 GLY H 1 105 PHE QB 4.100 . 6.000 3.482 3.264 3.678 . 0 0 "[ . 1 .]" 1
402 1 20 GLY H 1 106 PHE QE 2.800 . 3.800 2.444 2.329 2.576 . 0 0 "[ . 1 .]" 1
403 1 20 GLY H 1 106 PHE HZ 4.200 . 6.000 4.127 3.911 4.364 . 0 0 "[ . 1 .]" 1
404 1 20 GLY QA 1 21 GLU H 2.900 . 3.900 2.579 2.444 2.725 . 0 0 "[ . 1 .]" 1
405 1 20 GLY QA 1 21 GLU HA 3.500 . 5.000 4.012 3.999 4.022 . 0 0 "[ . 1 .]" 1
406 1 20 GLY QA 1 23 ILE H 3.500 . 5.000 3.306 3.193 3.510 . 0 0 "[ . 1 .]" 1
407 1 20 GLY QA 1 23 ILE HA 5.500 . 6.000 5.104 5.017 5.237 . 0 0 "[ . 1 .]" 1
408 1 20 GLY QA 1 23 ILE HB 2.800 . 3.800 2.412 2.253 2.606 . 0 0 "[ . 1 .]" 1
409 1 20 GLY QA 1 23 ILE MD 2.500 . 3.300 2.768 2.411 2.958 . 0 0 "[ . 1 .]" 1
410 1 20 GLY QA 1 23 ILE QG 4.100 . 4.700 3.351 3.182 3.505 . 0 0 "[ . 1 .]" 1
411 1 20 GLY QA 1 32 PRO QG 4.400 . 6.000 2.108 1.992 2.311 0.008 14 0 "[ . 1 .]" 1
412 1 20 GLY QA 1 105 PHE HA 3.000 . 4.100 4.065 3.909 4.117 0.017 9 0 "[ . 1 .]" 1
413 1 20 GLY QA 1 105 PHE QB 2.600 . 3.300 1.928 1.843 2.096 . 0 0 "[ . 1 .]" 1
414 1 20 GLY QA 1 105 PHE QD 5.300 . 6.000 3.834 3.689 4.038 . 0 0 "[ . 1 .]" 1
415 1 20 GLY QA 1 106 PHE QE 3.100 . 3.600 2.144 1.952 2.334 . 0 0 "[ . 1 .]" 1
416 1 20 GLY QA 1 106 PHE HZ 3.200 . 4.500 4.337 4.189 4.506 0.006 6 0 "[ . 1 .]" 1
417 1 21 GLU H 1 21 GLU HA 2.200 . 2.800 2.747 2.698 2.797 . 0 0 "[ . 1 .]" 1
418 1 21 GLU H 1 21 GLU QB 2.400 . 3.000 2.186 2.168 2.205 . 0 0 "[ . 1 .]" 1
419 1 21 GLU H 1 21 GLU QG 3.100 . 3.800 3.883 3.863 3.900 0.100 3 0 "[ . 1 .]" 1
420 1 21 GLU H 1 22 LYS H 2.700 . 3.600 2.796 2.654 2.933 . 0 0 "[ . 1 .]" 1
421 1 21 GLU H 1 22 LYS QB 4.600 . 6.000 4.544 4.361 4.688 . 0 0 "[ . 1 .]" 1
422 1 21 GLU H 1 23 ILE H 5.100 . 6.000 4.463 4.399 4.531 . 0 0 "[ . 1 .]" 1
423 1 21 GLU H 1 105 PHE QB 3.900 . 5.100 2.456 2.068 2.731 . 0 0 "[ . 1 .]" 1
424 1 21 GLU H 1 105 PHE QD 4.300 . 6.000 3.214 2.528 3.685 . 0 0 "[ . 1 .]" 1
425 1 21 GLU HA 1 21 GLU QB 2.100 . 2.200 2.249 2.236 2.278 0.078 8 0 "[ . 1 .]" 1
426 1 21 GLU HA 1 21 GLU QG 2.400 . 3.000 2.604 2.486 2.654 . 0 0 "[ . 1 .]" 1
427 1 21 GLU HA 1 22 LYS H 3.800 . 5.600 3.473 3.421 3.545 . 0 0 "[ . 1 .]" 1
428 1 21 GLU HA 1 22 LYS H 2.600 . 3.500 3.337 3.273 3.451 . 0 0 "[ . 1 .]" 1
429 1 21 GLU HA 1 22 LYS HA 4.000 . 6.000 4.628 4.586 4.713 . 0 0 "[ . 1 .]" 1
430 1 21 GLU HA 1 23 ILE H 3.700 . 5.400 4.910 4.794 5.036 . 0 0 "[ . 1 .]" 1
431 1 21 GLU HA 1 24 ARG H 3.000 . 4.100 3.853 3.659 3.957 . 0 0 "[ . 1 .]" 1
432 1 21 GLU HA 1 24 ARG QB 2.300 . 2.900 2.915 2.907 2.934 0.034 14 0 "[ . 1 .]" 1
433 1 21 GLU HA 1 25 LYS QG 4.900 . 6.000 3.722 3.562 4.273 . 0 0 "[ . 1 .]" 1
434 1 21 GLU HA 1 105 PHE HA 5.900 . 6.000 5.290 4.947 5.526 . 0 0 "[ . 1 .]" 1
435 1 21 GLU HA 1 105 PHE QB 3.000 . 4.100 3.016 2.788 3.165 . 0 0 "[ . 1 .]" 1
436 1 21 GLU HA 1 105 PHE QD 3.000 . 4.100 2.411 1.975 3.217 . 0 0 "[ . 1 .]" 1
437 1 21 GLU HA 1 105 PHE QE 2.900 . 3.900 3.378 3.042 3.900 0.000 8 0 "[ . 1 .]" 1
438 1 21 GLU QB 1 22 LYS H 2.700 . 3.600 3.024 2.796 3.199 . 0 0 "[ . 1 .]" 1
439 1 21 GLU QB 1 23 ILE H 4.100 . 6.000 5.108 4.958 5.264 . 0 0 "[ . 1 .]" 1
440 1 21 GLU QB 1 105 PHE QB 4.500 . 6.000 3.438 3.209 3.574 . 0 0 "[ . 1 .]" 1
441 1 21 GLU QB 1 105 PHE QD 2.500 . 3.300 2.723 2.014 3.225 . 0 0 "[ . 1 .]" 1
442 1 21 GLU QB 1 105 PHE QE 2.500 . 3.300 2.914 2.331 3.309 0.009 1 0 "[ . 1 .]" 1
443 1 21 GLU QB 1 105 PHE HZ 3.700 . 5.400 4.018 3.492 4.388 . 0 0 "[ . 1 .]" 1
444 1 21 GLU QG 1 22 LYS H 4.700 . 6.000 3.583 3.262 3.831 . 0 0 "[ . 1 .]" 1
445 1 21 GLU QG 1 22 LYS QG 4.100 . 6.000 5.334 5.171 5.572 . 0 0 "[ . 1 .]" 1
446 1 21 GLU QG 1 25 LYS H 3.100 . 4.500 4.532 4.513 4.553 0.053 3 0 "[ . 1 .]" 1
447 1 21 GLU QG 1 25 LYS QE 3.400 . 4.800 3.969 3.528 4.236 . 0 0 "[ . 1 .]" 1
448 1 21 GLU QG 1 105 PHE QD 3.200 . 4.100 4.120 4.104 4.151 0.051 3 0 "[ . 1 .]" 1
449 1 21 GLU QG 1 105 PHE QE 3.000 . 3.900 3.778 3.668 3.902 0.002 3 0 "[ . 1 .]" 1
450 1 22 LYS H 1 22 LYS HA 2.100 . 2.700 2.690 2.595 2.725 0.025 8 0 "[ . 1 .]" 1
451 1 22 LYS H 1 22 LYS QB 2.100 . 2.600 2.202 2.138 2.249 . 0 0 "[ . 1 .]" 1
452 1 22 LYS H 1 22 LYS QD 3.100 . 4.300 3.573 3.462 3.808 . 0 0 "[ . 1 .]" 1
453 1 22 LYS H 1 22 LYS QG 3.500 . 5.100 4.048 4.018 4.074 . 0 0 "[ . 1 .]" 1
454 1 22 LYS H 1 22 LYS QG 2.900 . 3.900 3.808 3.669 3.857 . 0 0 "[ . 1 .]" 1
455 1 22 LYS H 1 23 ILE H 2.500 . 3.300 2.352 2.258 2.551 . 0 0 "[ . 1 .]" 1
456 1 22 LYS H 1 23 ILE HB 3.000 . 4.200 4.211 4.113 4.291 0.091 9 0 "[ . 1 .]" 1
457 1 22 LYS H 1 23 ILE QG 5.000 . 6.000 4.402 4.203 4.839 . 0 0 "[ . 1 .]" 1
458 1 22 LYS HA 1 22 LYS QB 2.100 . 2.200 2.239 2.224 2.266 0.066 14 0 "[ . 1 .]" 1
459 1 22 LYS HA 1 22 LYS QD 2.800 . 3.800 3.775 3.654 3.815 0.015 10 0 "[ . 1 .]" 1
460 1 22 LYS HA 1 22 LYS QG 2.400 . 3.000 2.693 2.587 2.756 . 0 0 "[ . 1 .]" 1
461 1 22 LYS HA 1 23 ILE H 2.900 . 3.900 3.539 3.529 3.549 . 0 0 "[ . 1 .]" 1
462 1 22 LYS HA 1 24 ARG H 3.000 . 4.100 3.882 3.783 3.926 . 0 0 "[ . 1 .]" 1
463 1 22 LYS HA 1 24 ARG QB 3.200 . 4.500 4.551 4.519 4.576 0.076 14 0 "[ . 1 .]" 1
464 1 22 LYS HA 1 25 LYS QB 2.100 . 2.600 2.603 2.481 2.625 0.025 10 0 "[ . 1 .]" 1
465 1 22 LYS HA 1 25 LYS QD 2.800 . 3.800 2.974 2.592 3.839 0.039 9 0 "[ . 1 .]" 1
466 1 22 LYS HA 1 25 LYS QE 3.400 . 4.900 4.179 3.166 4.771 . 0 0 "[ . 1 .]" 1
467 1 22 LYS HA 1 25 LYS QG 2.800 . 3.800 3.248 1.826 3.650 . 0 0 "[ . 1 .]" 1
468 1 22 LYS HA 1 26 LYS QB 6.000 . 6.000 4.241 3.872 5.335 . 0 0 "[ . 1 .]" 1
469 1 22 LYS QB 1 22 LYS QD 2.100 . 2.500 2.017 1.965 2.062 . 0 0 "[ . 1 .]" 1
470 1 22 LYS QB 1 22 LYS QD 2.100 . 2.600 1.798 1.774 1.818 . 0 0 "[ . 1 .]" 1
471 1 22 LYS QB 1 22 LYS QE 3.100 . 4.300 3.173 2.827 3.425 . 0 0 "[ . 1 .]" 1
472 1 22 LYS QB 1 22 LYS QG 2.200 . 2.700 2.019 2.018 2.020 . 0 0 "[ . 1 .]" 1
473 1 22 LYS QB 1 23 ILE H 2.200 . 2.800 2.586 2.466 2.678 . 0 0 "[ . 1 .]" 1
474 1 22 LYS QB 1 23 ILE HA 4.100 . 6.000 4.421 4.321 4.480 . 0 0 "[ . 1 .]" 1
475 1 22 LYS QD 1 22 LYS QE 2.300 . 3.000 2.054 2.010 2.091 . 0 0 "[ . 1 .]" 1
476 1 22 LYS QD 1 22 LYS QG 2.100 . 2.600 2.045 2.033 2.055 . 0 0 "[ . 1 .]" 1
477 1 22 LYS QD 1 26 LYS QB 2.600 . 3.500 2.679 2.357 3.516 0.016 9 0 "[ . 1 .]" 1
478 1 22 LYS QD 1 23 ILE H 4.700 . 6.000 2.361 2.173 2.632 . 0 0 "[ . 1 .]" 1
479 1 22 LYS QD 1 23 ILE HA 5.500 . 6.000 2.419 2.220 2.620 . 0 0 "[ . 1 .]" 1
480 1 22 LYS QD 1 23 ILE MD 2.400 . 3.100 3.117 3.106 3.130 0.030 3 0 "[ . 1 .]" 1
481 1 22 LYS QD 1 26 LYS QE 3.300 . 4.600 4.300 2.926 4.608 0.008 15 0 "[ . 1 .]" 1
482 1 22 LYS QE 1 22 LYS QG 2.700 . 3.000 2.091 1.937 2.315 . 0 0 "[ . 1 .]" 1
483 1 22 LYS QG 1 23 ILE H 4.500 . 6.000 3.593 3.480 3.686 . 0 0 "[ . 1 .]" 1
484 1 22 LYS QG 1 23 ILE HA 3.500 . 5.000 3.773 3.640 3.969 . 0 0 "[ . 1 .]" 1
485 1 22 LYS QG 1 26 LYS H 4.600 . 4.900 3.737 3.632 3.968 . 0 0 "[ . 1 .]" 1
486 1 23 ILE H 1 23 ILE HA 2.300 . 3.000 2.792 2.763 2.804 . 0 0 "[ . 1 .]" 1
487 1 23 ILE H 1 23 ILE HB 1.900 . 2.300 2.314 2.218 2.341 0.041 10 0 "[ . 1 .]" 1
488 1 23 ILE H 1 23 ILE HB 2.000 . 2.500 2.093 2.061 2.125 . 0 0 "[ . 1 .]" 1
489 1 23 ILE H 1 23 ILE MD 2.600 . 3.500 3.204 2.972 3.312 . 0 0 "[ . 1 .]" 1
490 1 23 ILE H 1 23 ILE QG 2.100 . 2.600 2.400 2.293 2.618 0.018 9 0 "[ . 1 .]" 1
491 1 23 ILE H 1 23 ILE QG 2.900 . 4.000 2.371 2.272 2.564 . 0 0 "[ . 1 .]" 1
492 1 23 ILE H 1 24 ARG H 2.600 . 3.400 2.643 2.616 2.689 . 0 0 "[ . 1 .]" 1
493 1 23 ILE H 1 24 ARG HA 4.800 . 6.000 5.260 5.238 5.311 . 0 0 "[ . 1 .]" 1
494 1 23 ILE H 1 26 LYS QB 4.300 . 6.000 4.939 4.584 6.001 0.001 9 0 "[ . 1 .]" 1
495 1 23 ILE HA 1 23 ILE HB 2.400 . 3.100 3.005 2.984 3.010 . 0 0 "[ . 1 .]" 1
496 1 23 ILE HA 1 23 ILE MD 2.800 . 3.800 3.786 3.703 3.814 0.014 10 0 "[ . 1 .]" 1
497 1 23 ILE HA 1 23 ILE QG 2.200 . 2.500 2.302 2.186 2.342 . 0 0 "[ . 1 .]" 1
498 1 23 ILE HA 1 23 ILE QG 2.000 . 2.500 2.162 2.100 2.181 . 0 0 "[ . 1 .]" 1
499 1 23 ILE HA 1 24 ARG H 3.900 . 5.800 3.462 3.448 3.477 . 0 0 "[ . 1 .]" 1
500 1 23 ILE HA 1 25 LYS H 3.600 . 5.200 4.475 4.040 4.696 . 0 0 "[ . 1 .]" 1
501 1 23 ILE HA 1 26 LYS H 3.900 . 5.800 3.781 3.655 4.062 . 0 0 "[ . 1 .]" 1
502 1 23 ILE HA 1 26 LYS QB 1.900 . 2.300 2.385 2.356 2.430 0.130 9 0 "[ . 1 .]" 1
503 1 23 ILE HA 1 26 LYS QB 3.100 . 4.300 3.287 2.937 4.234 . 0 0 "[ . 1 .]" 1
504 1 23 ILE HA 1 27 TYR H 3.500 . 5.100 3.478 3.323 3.832 . 0 0 "[ . 1 .]" 1
505 1 23 ILE HA 1 27 TYR QD 2.300 . 3.000 3.023 3.000 3.054 0.054 3 0 "[ . 1 .]" 1
506 1 23 ILE HA 1 27 TYR QE 3.000 . 4.200 2.901 2.574 3.059 . 0 0 "[ . 1 .]" 1
507 1 23 ILE HA 1 52 LEU QD 4.000 . 6.000 3.763 3.612 3.965 . 0 0 "[ . 1 .]" 1
508 1 23 ILE HB 1 23 ILE MD 1.900 . 2.400 1.741 1.717 1.751 . 0 0 "[ . 1 .]" 1
509 1 23 ILE HB 1 23 ILE MD 1.900 . 2.300 1.838 1.812 1.847 . 0 0 "[ . 1 .]" 1
510 1 23 ILE HB 1 23 ILE QG 2.400 . 3.100 2.469 2.445 2.506 . 0 0 "[ . 1 .]" 1
511 1 23 ILE HB 1 23 ILE QG 1.900 . 2.300 2.001 1.994 2.015 . 0 0 "[ . 1 .]" 1
512 1 23 ILE HB 1 27 TYR QD 2.900 . 3.900 3.105 2.935 3.378 . 0 0 "[ . 1 .]" 1
513 1 23 ILE HB 1 52 LEU QD 2.900 . 4.000 2.150 1.890 2.433 . 0 0 "[ . 1 .]" 1
514 1 23 ILE HB 1 24 ARG H 2.300 . 3.000 3.016 2.992 3.034 0.034 9 0 "[ . 1 .]" 1
515 1 23 ILE HB 1 27 TYR QD 3.100 . 4.300 4.319 4.290 4.343 0.043 10 0 "[ . 1 .]" 1
516 1 23 ILE HB 1 27 TYR QE 3.400 . 4.900 4.521 4.268 4.674 . 0 0 "[ . 1 .]" 1
517 1 23 ILE HB 1 31 VAL HA 4.100 . 6.000 5.839 5.591 6.003 0.003 11 0 "[ . 1 .]" 1
518 1 23 ILE HB 1 32 PRO QG 3.000 . 4.100 2.784 2.580 3.045 . 0 0 "[ . 1 .]" 1
519 1 23 ILE HB 1 52 LEU QD 3.900 . 5.800 3.545 3.407 3.779 . 0 0 "[ . 1 .]" 1
520 1 23 ILE MD 1 23 ILE QG 1.900 . 2.300 1.844 1.838 1.848 . 0 0 "[ . 1 .]" 1
521 1 23 ILE MD 1 32 PRO HA 3.100 . 4.300 2.946 2.744 3.162 . 0 0 "[ . 1 .]" 1
522 1 23 ILE MD 1 32 PRO QB 2.500 . 3.300 1.863 1.731 2.053 . 0 0 "[ . 1 .]" 1
523 1 23 ILE MD 1 32 PRO QD 3.700 . 4.100 1.986 1.967 2.015 0.033 15 0 "[ . 1 .]" 1
524 1 23 ILE MD 1 32 PRO QG 2.600 . 3.400 2.549 2.458 2.703 . 0 0 "[ . 1 .]" 1
525 1 23 ILE MD 1 27 TYR QE 3.600 . 5.200 2.471 2.068 2.663 . 0 0 "[ . 1 .]" 1
526 1 23 ILE MD 1 27 TYR QD 3.300 . 4.700 4.405 4.291 4.615 . 0 0 "[ . 1 .]" 1
527 1 23 ILE MD 1 27 TYR QE 2.700 . 3.600 3.616 3.602 3.643 0.043 14 0 "[ . 1 .]" 1
528 1 23 ILE MD 1 32 PRO HA 3.400 . 4.800 3.771 3.551 4.017 . 0 0 "[ . 1 .]" 1
529 1 23 ILE MD 1 32 PRO QB 2.600 . 3.500 2.058 1.942 2.293 . 0 0 "[ . 1 .]" 1
530 1 23 ILE MD 1 32 PRO QG 2.700 . 3.600 3.091 2.856 3.276 . 0 0 "[ . 1 .]" 1
531 1 23 ILE MD 1 50 LYS QD 3.600 . 5.200 3.479 2.689 4.338 . 0 0 "[ . 1 .]" 1
532 1 23 ILE MD 1 50 LYS QE 2.900 . 4.000 3.825 3.481 4.005 0.005 8 0 "[ . 1 .]" 1
533 1 23 ILE MD 1 52 LEU QB 4.300 . 6.000 4.519 4.206 4.874 . 0 0 "[ . 1 .]" 1
534 1 23 ILE MD 1 52 LEU QD 2.200 . 2.500 2.313 2.144 2.506 0.006 9 0 "[ . 1 .]" 1
535 1 23 ILE MD 1 106 PHE QE 2.400 . 3.100 2.333 2.056 2.545 . 0 0 "[ . 1 .]" 1
536 1 23 ILE MD 1 106 PHE HZ 2.400 . 3.100 2.929 2.476 3.106 0.006 15 0 "[ . 1 .]" 1
537 1 23 ILE QG 1 24 ARG H 2.500 . 3.300 3.344 3.219 3.379 0.079 4 0 "[ . 1 .]" 1
538 1 23 ILE QG 1 24 ARG HA 2.900 . 3.900 3.339 3.233 3.383 . 0 0 "[ . 1 .]" 1
539 1 23 ILE QG 1 24 ARG QD 4.600 . 5.400 3.176 2.749 3.637 . 0 0 "[ . 1 .]" 1
540 1 23 ILE QG 1 25 LYS H 3.800 . 5.600 4.735 4.462 4.861 . 0 0 "[ . 1 .]" 1
541 1 23 ILE QG 1 27 TYR H 3.400 . 4.800 3.924 3.806 4.145 . 0 0 "[ . 1 .]" 1
542 1 23 ILE QG 1 27 TYR QB 3.400 . 4.100 2.933 2.843 3.183 . 0 0 "[ . 1 .]" 1
543 1 23 ILE QG 1 27 TYR QD 2.200 . 2.800 1.700 1.645 1.763 . 0 0 "[ . 1 .]" 1
544 1 23 ILE QG 1 27 TYR QE 2.700 . 3.600 1.916 1.807 1.969 . 0 0 "[ . 1 .]" 1
545 1 23 ILE QG 1 30 ARG QB 4.300 . 6.000 3.036 2.905 3.172 . 0 0 "[ . 1 .]" 1
546 1 23 ILE QG 1 31 VAL HA 3.200 . 4.500 3.700 3.522 3.882 . 0 0 "[ . 1 .]" 1
547 1 23 ILE QG 1 32 PRO HA 2.900 . 3.900 3.079 2.855 3.309 . 0 0 "[ . 1 .]" 1
548 1 23 ILE QG 1 32 PRO QD 2.800 . 3.100 1.992 1.972 2.021 . 0 0 "[ . 1 .]" 1
549 1 23 ILE QG 1 32 PRO QG 2.900 . 4.000 2.717 2.609 2.880 . 0 0 "[ . 1 .]" 1
550 1 23 ILE QG 1 33 VAL H 4.400 . 6.000 4.894 4.682 5.077 . 0 0 "[ . 1 .]" 1
551 1 23 ILE QG 1 52 LEU HA 5.200 . 6.000 3.950 3.872 4.076 . 0 0 "[ . 1 .]" 1
552 1 23 ILE QG 1 52 LEU QD 2.100 . 2.500 1.624 1.581 1.814 0.019 7 0 "[ . 1 .]" 1
553 1 23 ILE QG 1 52 LEU HG 2.400 . 3.100 3.029 2.883 3.109 0.009 13 0 "[ . 1 .]" 1
554 1 23 ILE QG 1 106 PHE HZ 4.300 . 6.000 4.620 4.186 4.812 . 0 0 "[ . 1 .]" 1
555 1 23 ILE QG 1 24 ARG H 4.200 . 6.000 4.308 4.257 4.395 . 0 0 "[ . 1 .]" 1
556 1 23 ILE QG 1 27 TYR QD 3.200 . 4.100 3.186 2.989 3.535 . 0 0 "[ . 1 .]" 1
557 1 23 ILE QG 1 27 TYR QE 3.800 . 4.500 1.992 1.932 2.033 0.068 14 0 "[ . 1 .]" 1
558 1 23 ILE QG 1 52 LEU QD 2.500 . 3.300 2.170 1.897 2.463 0.003 9 0 "[ . 1 .]" 1
559 1 24 ARG H 1 24 ARG HA 2.600 . 3.400 2.887 2.879 2.906 . 0 0 "[ . 1 .]" 1
560 1 24 ARG H 1 24 ARG QB . . 3.300 2.378 2.314 2.559 . 0 0 "[ . 1 .]" 1
561 1 24 ARG H 1 24 ARG QD 3.300 . 4.700 3.645 3.291 3.912 . 0 0 "[ . 1 .]" 1
562 1 24 ARG H 1 24 ARG QG 2.000 . 2.500 2.423 2.143 2.522 0.022 14 0 "[ . 1 .]" 1
563 1 24 ARG H 1 25 LYS H 2.500 . 3.300 2.375 2.267 2.423 . 0 0 "[ . 1 .]" 1
564 1 24 ARG H 1 25 LYS QG 2.900 . 4.000 4.013 3.886 4.050 0.050 14 0 "[ . 1 .]" 1
565 1 24 ARG HA 1 24 ARG QB 2.200 . 2.800 2.381 2.305 2.406 . 0 0 "[ . 1 .]" 1
566 1 24 ARG HA 1 24 ARG QD 2.100 . 2.700 2.108 1.923 2.701 0.001 9 0 "[ . 1 .]" 1
567 1 24 ARG HA 1 24 ARG QG 2.400 . 3.100 2.893 2.746 3.062 . 0 0 "[ . 1 .]" 1
568 1 24 ARG HA 1 25 LYS H 3.100 . 4.300 3.513 3.431 3.541 . 0 0 "[ . 1 .]" 1
569 1 24 ARG HA 1 27 TYR H 3.100 . 4.300 3.710 3.556 3.795 . 0 0 "[ . 1 .]" 1
570 1 24 ARG HA 1 28 PRO HA 3.000 . 4.100 3.841 3.344 4.115 0.015 4 0 "[ . 1 .]" 1
571 1 24 ARG HA 1 28 PRO QB 4.900 . 6.000 5.484 4.891 5.767 . 0 0 "[ . 1 .]" 1
572 1 24 ARG QB 1 24 ARG QD 2.600 . 3.400 2.756 2.607 2.952 . 0 0 "[ . 1 .]" 1
573 1 24 ARG QB 1 28 PRO HA 3.300 . 4.600 4.387 3.787 4.614 0.014 14 0 "[ . 1 .]" 1
574 1 24 ARG QB 1 25 LYS H 3.300 . 4.700 2.620 2.431 3.110 . 0 0 "[ . 1 .]" 1
575 1 24 ARG QD 1 24 ARG QG 2.000 . 2.200 1.994 1.958 2.017 . 0 0 "[ . 1 .]" 1
576 1 24 ARG QD 1 28 PRO HA 6.000 . 6.000 4.846 4.117 5.507 . 0 0 "[ . 1 .]" 1
577 1 24 ARG QD 1 31 VAL HA 3.000 . 3.600 2.999 2.825 3.124 . 0 0 "[ . 1 .]" 1
578 1 24 ARG QD 1 31 VAL QG 3.400 . 4.800 3.681 3.480 3.856 . 0 0 "[ . 1 .]" 1
579 1 24 ARG QD 1 32 PRO QD 2.400 . 3.100 2.074 1.992 2.244 0.008 4 0 "[ . 1 .]" 1
580 1 24 ARG QD 1 32 PRO QG 3.100 . 4.000 2.915 2.737 3.112 . 0 0 "[ . 1 .]" 1
581 1 24 ARG QD 1 105 PHE HA 5.200 . 6.000 4.400 4.101 4.730 . 0 0 "[ . 1 .]" 1
582 1 24 ARG QD 1 106 PHE HA 3.500 . 5.000 4.849 4.687 5.010 0.010 9 0 "[ . 1 .]" 1
583 1 24 ARG QD 1 106 PHE QD 3.500 . 5.100 5.128 5.119 5.138 0.038 2 0 "[ . 1 .]" 1
584 1 24 ARG QG 1 25 LYS H 3.600 . 5.200 4.060 4.006 4.140 . 0 0 "[ . 1 .]" 1
585 1 24 ARG QG 1 32 PRO QG 4.400 . 6.000 2.914 2.642 3.331 . 0 0 "[ . 1 .]" 1
586 1 24 ARG QG 1 105 PHE HA 3.100 . 4.300 3.621 3.331 4.291 . 0 0 "[ . 1 .]" 1
587 1 24 ARG QG 1 105 PHE QB 3.100 . 3.400 2.355 1.945 2.626 . 0 0 "[ . 1 .]" 1
588 1 24 ARG QG 1 105 PHE QD 3.000 . 4.100 2.529 2.161 2.957 . 0 0 "[ . 1 .]" 1
589 1 25 LYS H 1 25 LYS QB 1.900 . 2.300 2.349 2.326 2.374 0.074 15 0 "[ . 1 .]" 1
590 1 25 LYS H 1 25 LYS QD 3.600 . 5.300 3.674 3.273 4.357 . 0 0 "[ . 1 .]" 1
591 1 25 LYS H 1 25 LYS QG 3.300 . 3.500 2.288 2.147 2.546 . 0 0 "[ . 1 .]" 1
592 1 25 LYS H 1 26 LYS H 2.100 . 2.600 2.547 2.478 2.636 0.036 3 0 "[ . 1 .]" 1
593 1 25 LYS H 1 26 LYS QB 4.200 . 5.200 4.331 4.231 4.526 . 0 0 "[ . 1 .]" 1
594 1 25 LYS H 1 27 TYR H 3.500 . 5.100 3.842 3.656 3.952 . 0 0 "[ . 1 .]" 1
595 1 25 LYS HA 1 25 LYS QB 2.000 . 2.500 2.379 2.366 2.400 . 0 0 "[ . 1 .]" 1
596 1 25 LYS HA 1 25 LYS QE 2.900 . 3.900 3.912 3.804 3.950 0.050 15 0 "[ . 1 .]" 1
597 1 25 LYS HA 1 25 LYS QG 2.400 . 3.100 2.462 2.353 3.039 . 0 0 "[ . 1 .]" 1
598 1 25 LYS HA 1 26 LYS H 2.800 . 3.800 3.531 3.514 3.561 . 0 0 "[ . 1 .]" 1
599 1 25 LYS HA 1 27 TYR H 4.800 . 6.000 4.584 4.467 4.866 . 0 0 "[ . 1 .]" 1
600 1 25 LYS HA 1 28 PRO QD 4.500 . 6.000 5.228 4.566 5.662 . 0 0 "[ . 1 .]" 1
601 1 25 LYS HA 1 28 PRO QG 4.600 . 6.000 4.637 4.105 6.003 0.003 9 0 "[ . 1 .]" 1
602 1 25 LYS QB 1 25 LYS QD 2.000 . 2.400 2.313 2.252 2.432 0.032 9 0 "[ . 1 .]" 1
603 1 25 LYS QB 1 25 LYS QG 2.000 . 2.500 2.069 1.960 2.086 . 0 0 "[ . 1 .]" 1
604 1 25 LYS QB 1 26 LYS H . . 2.500 2.459 2.202 2.527 0.027 8 0 "[ . 1 .]" 1
605 1 25 LYS QB 1 26 LYS HA 3.600 . 5.200 3.871 3.808 3.900 . 0 0 "[ . 1 .]" 1
606 1 25 LYS QB 1 26 LYS QB 3.700 . 5.400 3.584 3.337 3.661 . 0 0 "[ . 1 .]" 1
607 1 25 LYS QB 1 26 LYS QG 3.300 . 4.700 4.735 4.609 4.844 0.144 10 0 "[ . 1 .]" 1
608 1 25 LYS QB 1 27 TYR H 3.800 . 5.600 4.520 4.295 4.607 . 0 0 "[ . 1 .]" 1
609 1 25 LYS QB 1 28 PRO QD 6.000 . 6.000 5.870 5.308 6.025 0.025 3 0 "[ . 1 .]" 1
610 1 25 LYS QD 1 26 LYS H 4.900 . 6.000 4.729 4.561 5.226 . 0 0 "[ . 1 .]" 1
611 1 25 LYS QE 1 25 LYS QG 2.500 . 2.600 2.299 2.144 2.382 . 0 0 "[ . 1 .]" 1
612 1 26 LYS H 1 26 LYS HA 2.200 . 2.800 2.856 2.849 2.878 0.078 3 0 "[ . 1 .]" 1
613 1 26 LYS H 1 26 LYS QB 2.000 . 2.500 2.192 2.157 2.287 . 0 0 "[ . 1 .]" 1
614 1 26 LYS H 1 26 LYS QG 3.300 . 4.000 3.876 3.851 3.950 . 0 0 "[ . 1 .]" 1
615 1 26 LYS H 1 27 TYR H 1.900 . 2.400 2.415 2.345 2.426 0.026 5 0 "[ . 1 .]" 1
616 1 26 LYS H 1 27 TYR HA 4.600 . 6.000 5.073 5.028 5.090 . 0 0 "[ . 1 .]" 1
617 1 26 LYS H 1 27 TYR QD 3.500 . 5.000 4.611 4.242 4.718 . 0 0 "[ . 1 .]" 1
618 1 26 LYS H 1 27 TYR QE 4.800 . 6.000 5.134 4.651 5.272 . 0 0 "[ . 1 .]" 1
619 1 26 LYS H 1 28 PRO QD 3.900 . 5.800 4.972 4.374 5.097 . 0 0 "[ . 1 .]" 1
620 1 26 LYS HA 1 26 LYS QB 2.000 . 2.500 2.469 2.437 2.484 . 0 0 "[ . 1 .]" 1
621 1 26 LYS HA 1 26 LYS QD 2.800 . 3.800 3.814 3.743 3.839 0.039 14 0 "[ . 1 .]" 1
622 1 26 LYS HA 1 26 LYS QE 5.000 . 6.000 4.562 4.285 4.961 . 0 0 "[ . 1 .]" 1
623 1 26 LYS HA 1 26 LYS QG 2.600 . 3.000 2.165 2.127 2.201 . 0 0 "[ . 1 .]" 1
624 1 26 LYS HA 1 27 TYR H 2.800 . 3.800 3.503 3.483 3.520 . 0 0 "[ . 1 .]" 1
625 1 26 LYS HA 1 27 TYR HA 3.900 . 5.800 4.522 4.491 4.541 . 0 0 "[ . 1 .]" 1
626 1 26 LYS HA 1 28 PRO QD 3.600 . 5.200 4.020 3.306 4.203 . 0 0 "[ . 1 .]" 1
627 1 26 LYS HA 1 28 PRO QG 6.000 . 6.000 4.875 4.425 5.689 . 0 0 "[ . 1 .]" 1
628 1 26 LYS QB 1 26 LYS QE 3.600 . 5.200 2.924 1.948 3.473 0.052 10 0 "[ . 1 .]" 1
629 1 26 LYS QB 1 26 LYS QG 2.100 . 2.700 2.067 2.038 2.078 . 0 0 "[ . 1 .]" 1
630 1 26 LYS QB 1 27 TYR H 3.000 . 3.500 2.688 2.562 2.897 . 0 0 "[ . 1 .]" 1
631 1 26 LYS QB 1 27 TYR QD 2.200 . 2.800 2.685 2.330 2.807 0.007 5 0 "[ . 1 .]" 1
632 1 26 LYS QB 1 27 TYR QE 2.600 . 3.400 2.600 2.237 2.766 . 0 0 "[ . 1 .]" 1
633 1 26 LYS QB 1 28 PRO QD 4.700 . 6.000 4.740 4.339 4.832 . 0 0 "[ . 1 .]" 1
634 1 26 LYS QD 1 26 LYS QE 2.200 . 2.500 2.047 1.976 2.090 . 0 0 "[ . 1 .]" 1
635 1 26 LYS QD 1 26 LYS QG 2.200 . 2.800 2.041 1.987 2.079 0.013 10 0 "[ . 1 .]" 1
636 1 26 LYS QD 1 27 TYR QD 3.100 . 4.300 3.813 2.225 4.411 0.111 10 0 "[ . 1 .]" 1
637 1 26 LYS QD 1 27 TYR QE 2.600 . 3.400 2.612 1.795 2.972 0.005 4 0 "[ . 1 .]" 1
638 1 26 LYS QE 1 26 LYS QG 2.400 . 3.000 2.184 1.935 2.476 . 0 0 "[ . 1 .]" 1
639 1 26 LYS QE 1 27 TYR QE 2.400 . 3.100 2.246 1.868 2.706 . 0 0 "[ . 1 .]" 1
640 1 26 LYS QG 1 27 TYR H 4.600 . 6.000 4.234 4.047 4.393 . 0 0 "[ . 1 .]" 1
641 1 26 LYS QG 1 27 TYR HA 3.300 . 4.700 4.691 4.529 4.740 0.040 4 0 "[ . 1 .]" 1
642 1 26 LYS QG 1 27 TYR QD 2.900 . 4.000 3.078 2.506 3.680 . 0 0 "[ . 1 .]" 1
643 1 26 LYS QG 1 27 TYR QE 2.900 . 3.800 2.636 1.965 3.747 . 0 0 "[ . 1 .]" 1
644 1 27 TYR H 1 27 TYR HA 2.700 . 3.600 2.947 2.942 2.950 . 0 0 "[ . 1 .]" 1
645 1 27 TYR H 1 27 TYR QB 2.700 . 3.300 2.917 2.847 2.997 . 0 0 "[ . 1 .]" 1
646 1 27 TYR H 1 27 TYR QD 2.600 . 3.500 3.155 2.865 3.243 . 0 0 "[ . 1 .]" 1
647 1 27 TYR H 1 27 TYR QE 4.900 . 6.000 4.437 4.145 4.534 . 0 0 "[ . 1 .]" 1
648 1 27 TYR H 1 28 PRO HA 5.000 . 6.000 4.735 4.691 4.790 . 0 0 "[ . 1 .]" 1
649 1 27 TYR H 1 28 PRO QD 3.000 . 4.100 3.558 3.356 3.613 . 0 0 "[ . 1 .]" 1
650 1 27 TYR H 1 28 PRO QG 5.500 . 6.000 4.765 4.582 5.387 . 0 0 "[ . 1 .]" 1
651 1 27 TYR H 1 52 LEU QD 4.300 . 6.000 5.254 5.060 5.615 . 0 0 "[ . 1 .]" 1
652 1 27 TYR HA 1 27 TYR QB 2.500 . 2.500 2.216 2.189 2.238 . 0 0 "[ . 1 .]" 1
653 1 27 TYR HA 1 27 TYR QD 2.200 . 2.800 2.584 2.441 2.757 . 0 0 "[ . 1 .]" 1
654 1 27 TYR HA 1 27 TYR QE 4.200 . 6.000 4.862 4.745 5.019 . 0 0 "[ . 1 .]" 1
655 1 27 TYR HA 1 28 PRO QD 1.900 . 2.300 1.951 1.937 2.003 . 0 0 "[ . 1 .]" 1
656 1 27 TYR HA 1 28 PRO QG 2.800 . 3.800 3.840 3.824 3.867 0.067 3 0 "[ . 1 .]" 1
657 1 27 TYR HA 1 29 ASP H 3.100 . 4.300 3.362 3.197 3.454 . 0 0 "[ . 1 .]" 1
658 1 27 TYR HA 1 30 ARG H 3.400 . 4.800 4.079 3.836 4.386 . 0 0 "[ . 1 .]" 1
659 1 27 TYR HA 1 30 ARG QB 3.500 . 5.000 3.775 3.507 3.869 . 0 0 "[ . 1 .]" 1
660 1 27 TYR HA 1 30 ARG QG 3.600 . 5.200 4.526 3.789 5.091 . 0 0 "[ . 1 .]" 1
661 1 27 TYR QB 1 27 TYR QD 2.100 . 2.600 2.180 2.149 2.198 . 0 0 "[ . 1 .]" 1
662 1 27 TYR QB 1 27 TYR QE 3.000 . 4.100 3.955 3.941 3.961 . 0 0 "[ . 1 .]" 1
663 1 27 TYR QB 1 28 PRO QD 3.800 . 4.300 3.548 3.517 3.686 . 0 0 "[ . 1 .]" 1
664 1 27 TYR QB 1 29 ASP H 4.200 . 6.000 3.489 3.301 3.697 . 0 0 "[ . 1 .]" 1
665 1 27 TYR QB 1 30 ARG H 3.200 . 4.300 2.814 2.605 3.024 . 0 0 "[ . 1 .]" 1
666 1 27 TYR QB 1 30 ARG QB 2.400 . 3.100 1.815 1.788 1.916 0.012 4 0 "[ . 1 .]" 1
667 1 27 TYR QB 1 30 ARG QD 3.000 . 4.100 3.748 3.437 4.006 . 0 0 "[ . 1 .]" 1
668 1 27 TYR QB 1 30 ARG QG 2.900 . 3.600 2.485 1.901 2.969 . 0 0 "[ . 1 .]" 1
669 1 27 TYR QB 1 52 LEU QD 3.000 . 4.000 3.556 3.337 4.003 0.003 4 0 "[ . 1 .]" 1
670 1 27 TYR QD 1 28 PRO QD 3.200 . 4.000 3.886 3.779 4.010 0.010 4 0 "[ . 1 .]" 1
671 1 27 TYR QD 1 30 ARG QB 4.400 . 6.000 2.818 2.704 2.915 . 0 0 "[ . 1 .]" 1
672 1 27 TYR QD 1 30 ARG QD 2.800 . 3.800 3.820 3.808 3.832 0.032 3 0 "[ . 1 .]" 1
673 1 27 TYR QD 1 30 ARG QG 3.000 . 4.100 3.881 3.632 4.105 0.005 4 0 "[ . 1 .]" 1
674 1 27 TYR QD 1 52 LEU QD 2.300 . 3.000 2.379 2.214 2.886 . 0 0 "[ . 1 .]" 1
675 1 27 TYR QE 1 30 ARG QD 6.000 . 6.000 4.942 4.865 5.034 . 0 0 "[ . 1 .]" 1
676 1 27 TYR QE 1 32 PRO QD 4.300 . 6.000 5.822 5.437 6.002 0.002 15 0 "[ . 1 .]" 1
677 1 27 TYR QE 1 52 LEU QB 3.700 . 5.500 4.696 4.595 4.949 . 0 0 "[ . 1 .]" 1
678 1 27 TYR QE 1 52 LEU QD 2.700 . 3.600 2.007 1.898 2.211 0.002 6 0 "[ . 1 .]" 1
679 1 28 PRO HA 1 28 PRO QB 2.000 . 2.500 2.185 2.160 2.191 . 0 0 "[ . 1 .]" 1
680 1 28 PRO HA 1 28 PRO QD 2.700 . 3.600 3.463 3.300 3.494 . 0 0 "[ . 1 .]" 1
681 1 28 PRO HA 1 28 PRO QG 2.600 . 3.300 3.192 3.128 3.441 0.141 13 0 "[ . 1 .]" 1
682 1 28 PRO HA 1 29 ASP H 2.900 . 3.900 3.451 3.385 3.491 . 0 0 "[ . 1 .]" 1
683 1 28 PRO HA 1 30 ARG QB 5.000 . 6.000 5.492 5.311 5.633 . 0 0 "[ . 1 .]" 1
684 1 28 PRO QB 1 28 PRO QD 2.500 . 3.300 2.773 2.680 2.815 . 0 0 "[ . 1 .]" 1
685 1 28 PRO QB 1 28 PRO QG 2.100 . 2.600 1.962 1.957 1.969 . 0 0 "[ . 1 .]" 1
686 1 28 PRO QB 1 29 ASP H 2.400 . 3.100 3.004 2.696 3.116 0.016 5 0 "[ . 1 .]" 1
687 1 28 PRO QB 1 29 ASP QB 3.300 . 4.600 4.001 3.534 4.345 . 0 0 "[ . 1 .]" 1
688 1 28 PRO QB 1 29 ASP H 3.400 . 4.100 3.248 3.069 3.618 . 0 0 "[ . 1 .]" 1
689 1 28 PRO QB 1 29 ASP QB 4.300 . 6.000 4.360 3.807 4.712 . 0 0 "[ . 1 .]" 1
690 1 28 PRO QD 1 28 PRO QG 2.200 . 2.200 1.973 1.970 1.975 . 0 0 "[ . 1 .]" 1
691 1 28 PRO QD 1 29 ASP H 3.200 . 3.800 2.392 2.189 2.892 . 0 0 "[ . 1 .]" 1
692 1 28 PRO QD 1 29 ASP QB 3.300 . 4.600 3.751 3.423 4.192 . 0 0 "[ . 1 .]" 1
693 1 28 PRO QG 1 29 ASP H 3.400 . 4.800 3.693 2.797 3.913 . 0 0 "[ . 1 .]" 1
694 1 29 ASP H 1 29 ASP HA 2.500 . 3.300 2.931 2.913 2.946 . 0 0 "[ . 1 .]" 1
695 1 29 ASP H 1 29 ASP QB 2.200 . 2.800 2.414 2.201 2.801 0.001 4 0 "[ . 1 .]" 1
696 1 29 ASP H 1 30 ARG H 1.900 . 2.300 2.260 2.122 2.309 0.009 5 0 "[ . 1 .]" 1
697 1 29 ASP H 1 30 ARG HA 6.000 . 6.000 4.855 4.758 4.942 . 0 0 "[ . 1 .]" 1
698 1 29 ASP H 1 30 ARG QB 3.200 . 4.500 4.014 3.798 4.251 . 0 0 "[ . 1 .]" 1
699 1 29 ASP H 1 30 ARG QG 4.900 . 6.000 4.262 3.758 4.803 . 0 0 "[ . 1 .]" 1
700 1 29 ASP HA 1 29 ASP QB 2.000 . 2.500 2.406 2.182 2.502 0.002 12 0 "[ . 1 .]" 1
701 1 29 ASP HA 1 30 ARG H 2.800 . 3.800 3.319 3.119 3.457 . 0 0 "[ . 1 .]" 1
702 1 29 ASP HA 1 55 SER H 5.100 . 6.000 4.242 3.889 4.466 . 0 0 "[ . 1 .]" 1
703 1 29 ASP HA 1 55 SER QB 3.100 . 4.100 3.004 2.661 3.283 . 0 0 "[ . 1 .]" 1
704 1 29 ASP QB 1 30 ARG H 2.800 . 3.800 3.343 3.019 3.815 0.015 4 0 "[ . 1 .]" 1
705 1 29 ASP QB 1 30 ARG QG 4.400 . 6.000 3.619 3.189 4.665 . 0 0 "[ . 1 .]" 1
706 1 29 ASP QB 1 55 SER H 5.100 . 6.000 3.776 3.502 4.413 . 0 0 "[ . 1 .]" 1
707 1 29 ASP QB 1 55 SER HA 4.300 . 6.000 3.959 3.330 4.366 . 0 0 "[ . 1 .]" 1
708 1 29 ASP QB 1 55 SER QB 4.900 . 5.000 4.017 3.352 4.446 . 0 0 "[ . 1 .]" 1
709 1 30 ARG H 1 30 ARG HA 2.700 . 3.600 2.936 2.904 2.951 . 0 0 "[ . 1 .]" 1
710 1 30 ARG H 1 30 ARG QB 2.900 . 3.900 2.347 2.200 2.528 . 0 0 "[ . 1 .]" 1
711 1 30 ARG H 1 30 ARG QD 5.000 . 6.000 4.665 4.473 4.814 . 0 0 "[ . 1 .]" 1
712 1 30 ARG H 1 30 ARG QG 2.800 . 3.800 3.183 2.786 3.552 . 0 0 "[ . 1 .]" 1
713 1 30 ARG H 1 31 VAL H 5.200 . 6.000 4.535 4.466 4.598 . 0 0 "[ . 1 .]" 1
714 1 30 ARG H 1 31 VAL HA 3.900 . 5.800 5.073 4.882 5.264 . 0 0 "[ . 1 .]" 1
715 1 30 ARG H 1 55 SER H 6.000 . 6.000 5.272 5.076 5.371 . 0 0 "[ . 1 .]" 1
716 1 30 ARG HA 1 30 ARG QB 2.500 . 3.300 2.455 2.384 2.532 . 0 0 "[ . 1 .]" 1
717 1 30 ARG HA 1 30 ARG QD 2.700 . 3.100 3.066 2.947 3.118 0.018 9 0 "[ . 1 .]" 1
718 1 30 ARG HA 1 30 ARG QG 2.400 . 3.100 2.246 2.086 2.397 . 0 0 "[ . 1 .]" 1
719 1 30 ARG HA 1 31 VAL H 2.200 . 2.800 2.350 2.247 2.391 . 0 0 "[ . 1 .]" 1
720 1 30 ARG HA 1 31 VAL QG 3.000 . 4.100 3.288 3.216 3.387 . 0 0 "[ . 1 .]" 1
721 1 30 ARG HA 1 54 PRO HA 2.400 . 3.100 1.996 1.963 2.041 . 0 0 "[ . 1 .]" 1
722 1 30 ARG HA 1 54 PRO QB 3.100 . 4.300 3.924 3.871 3.975 . 0 0 "[ . 1 .]" 1
723 1 30 ARG HA 1 55 SER H 2.700 . 3.600 3.598 3.532 3.621 0.021 3 0 "[ . 1 .]" 1
724 1 30 ARG HA 1 55 SER QB 3.300 . 4.500 3.838 3.626 4.268 . 0 0 "[ . 1 .]" 1
725 1 30 ARG QB 1 30 ARG QD 3.100 . 3.100 2.072 1.921 2.114 . 0 0 "[ . 1 .]" 1
726 1 30 ARG QB 1 30 ARG QD 2.200 . 2.500 1.848 1.760 1.870 . 0 0 "[ . 1 .]" 1
727 1 30 ARG QB 1 30 ARG QG 2.000 . 2.500 2.022 2.018 2.026 . 0 0 "[ . 1 .]" 1
728 1 30 ARG QB 1 52 LEU QD 2.400 . 3.100 2.765 2.565 3.105 0.005 4 0 "[ . 1 .]" 1
729 1 30 ARG QB 1 31 VAL H 2.800 . 3.800 2.574 2.420 2.846 . 0 0 "[ . 1 .]" 1
730 1 30 ARG QB 1 52 LEU QD 2.900 . 3.900 2.851 2.628 3.256 . 0 0 "[ . 1 .]" 1
731 1 30 ARG QB 1 53 VAL H 3.700 . 5.400 4.602 4.198 4.921 . 0 0 "[ . 1 .]" 1
732 1 30 ARG QB 1 54 PRO HA 3.300 . 4.700 3.823 3.707 3.930 . 0 0 "[ . 1 .]" 1
733 1 30 ARG QB 1 55 SER H 4.200 . 6.000 5.580 5.527 5.628 . 0 0 "[ . 1 .]" 1
734 1 30 ARG QD 1 30 ARG QG 2.200 . 2.500 2.078 2.042 2.088 . 0 0 "[ . 1 .]" 1
735 1 30 ARG QD 1 31 VAL H 3.600 . 4.100 3.239 2.694 3.681 . 0 0 "[ . 1 .]" 1
736 1 30 ARG QD 1 52 LEU HA 4.300 . 6.000 3.520 2.939 3.968 . 0 0 "[ . 1 .]" 1
737 1 30 ARG QD 1 52 LEU QB 5.500 . 6.000 2.778 2.519 3.022 . 0 0 "[ . 1 .]" 1
738 1 30 ARG QD 1 52 LEU QD 3.000 . 3.500 2.676 2.581 2.784 . 0 0 "[ . 1 .]" 1
739 1 30 ARG QD 1 52 LEU HG 2.800 . 2.900 1.870 1.793 2.012 0.007 3 0 "[ . 1 .]" 1
740 1 30 ARG QD 1 53 VAL H 3.400 . 4.900 3.721 3.114 4.326 . 0 0 "[ . 1 .]" 1
741 1 30 ARG QD 1 53 VAL HA 3.900 . 5.400 3.144 2.671 3.583 . 0 0 "[ . 1 .]" 1
742 1 30 ARG QD 1 54 PRO HA 2.500 . 3.300 3.270 3.125 3.320 0.020 15 0 "[ . 1 .]" 1
743 1 30 ARG QD 1 54 PRO QD 4.400 . 6.000 3.479 3.092 3.797 . 0 0 "[ . 1 .]" 1
744 1 30 ARG QD 1 54 PRO QG 3.900 . 5.800 4.007 3.730 4.309 . 0 0 "[ . 1 .]" 1
745 1 30 ARG QG 1 31 VAL H 4.600 . 4.700 3.859 3.439 4.120 . 0 0 "[ . 1 .]" 1
746 1 30 ARG QG 1 52 LEU QD 3.100 . 4.300 3.732 3.577 3.917 . 0 0 "[ . 1 .]" 1
747 1 30 ARG QG 1 52 LEU HG 2.700 . 3.600 3.642 3.632 3.681 0.081 3 0 "[ . 1 .]" 1
748 1 30 ARG QG 1 54 PRO HA 2.700 . 3.600 2.460 2.122 2.783 . 0 0 "[ . 1 .]" 1
749 1 30 ARG QG 1 54 PRO QB 3.300 . 4.600 3.853 3.644 4.073 . 0 0 "[ . 1 .]" 1
750 1 30 ARG QG 1 55 SER H 4.100 . 6.000 4.597 4.389 4.738 . 0 0 "[ . 1 .]" 1
751 1 31 VAL H 1 31 VAL HA 2.900 . 3.900 2.935 2.929 2.943 . 0 0 "[ . 1 .]" 1
752 1 31 VAL H 1 31 VAL HB 2.900 . 3.900 3.877 3.817 3.901 0.001 14 0 "[ . 1 .]" 1
753 1 31 VAL H 1 31 VAL QG 2.400 . 3.100 2.160 2.092 2.212 . 0 0 "[ . 1 .]" 1
754 1 31 VAL H 1 32 PRO QD 4.300 . 6.000 4.077 4.005 4.146 . 0 0 "[ . 1 .]" 1
755 1 31 VAL H 1 52 LEU QD . . 4.100 3.902 3.709 4.059 . 0 0 "[ . 1 .]" 1
756 1 31 VAL H 1 53 VAL H 2.800 . 3.800 3.629 3.373 3.801 0.001 11 0 "[ . 1 .]" 1
757 1 31 VAL H 1 53 VAL HA 3.800 . 5.600 4.658 4.586 4.749 . 0 0 "[ . 1 .]" 1
758 1 31 VAL H 1 53 VAL HB 3.500 . 5.000 4.768 4.663 4.901 . 0 0 "[ . 1 .]" 1
759 1 31 VAL H 1 54 PRO HA 3.400 . 4.800 3.605 3.512 3.709 . 0 0 "[ . 1 .]" 1
760 1 31 VAL H 1 55 SER H 3.500 . 5.100 5.082 4.808 5.107 0.007 9 0 "[ . 1 .]" 1
761 1 31 VAL H 1 55 SER HA 5.000 . 6.000 4.721 4.277 4.892 . 0 0 "[ . 1 .]" 1
762 1 31 VAL HA 1 31 VAL HB 2.500 . 3.300 2.423 2.402 2.447 . 0 0 "[ . 1 .]" 1
763 1 31 VAL HA 1 31 VAL QG 2.400 . 2.500 2.275 2.233 2.362 . 0 0 "[ . 1 .]" 1
764 1 31 VAL HA 1 32 PRO QB 5.600 . 6.000 4.643 4.620 4.678 . 0 0 "[ . 1 .]" 1
765 1 31 VAL HA 1 32 PRO QD 1.900 . 2.400 1.928 1.880 1.965 . 0 0 "[ . 1 .]" 1
766 1 31 VAL HA 1 32 PRO QG 3.300 . 4.100 3.834 3.788 3.868 . 0 0 "[ . 1 .]" 1
767 1 31 VAL HA 1 52 LEU QD 4.200 . 6.000 4.223 4.082 4.457 . 0 0 "[ . 1 .]" 1
768 1 31 VAL HA 1 55 SER QB 3.800 . 5.600 5.281 4.992 5.649 0.049 11 0 "[ . 1 .]" 1
769 1 31 VAL HA 1 97 TYR QD 3.200 . 4.500 3.838 3.657 4.143 . 0 0 "[ . 1 .]" 1
770 1 31 VAL HB 1 31 VAL QG 1.900 . 2.200 1.860 1.855 1.868 . 0 0 "[ . 1 .]" 1
771 1 31 VAL HB 1 32 PRO QD 2.600 . 3.300 3.056 2.944 3.197 . 0 0 "[ . 1 .]" 1
772 1 31 VAL HB 1 32 PRO QG 5.000 . 6.000 4.475 4.338 4.596 . 0 0 "[ . 1 .]" 1
773 1 31 VAL HB 1 33 VAL QG 2.600 . 3.400 3.397 3.348 3.408 0.008 8 0 "[ . 1 .]" 1
774 1 31 VAL HB 1 55 SER HA 3.500 . 5.100 5.031 4.871 5.114 0.014 6 0 "[ . 1 .]" 1
775 1 31 VAL HB 1 93 MET QB 3.700 . 5.400 4.473 4.362 4.607 . 0 0 "[ . 1 .]" 1
776 1 31 VAL HB 1 97 TYR QB 3.300 . 4.100 2.350 2.148 2.516 . 0 0 "[ . 1 .]" 1
777 1 31 VAL HB 1 97 TYR QD 2.800 . 3.800 2.285 2.102 2.608 . 0 0 "[ . 1 .]" 1
778 1 31 VAL QG 1 32 PRO QD 3.300 . 3.300 3.294 3.239 3.320 0.020 3 0 "[ . 1 .]" 1
779 1 31 VAL QG 1 33 VAL H 3.800 . 5.600 4.118 4.011 4.402 . 0 0 "[ . 1 .]" 1
780 1 31 VAL QG 1 33 VAL HA 3.800 . 5.600 4.334 4.218 4.534 . 0 0 "[ . 1 .]" 1
781 1 31 VAL QG 1 33 VAL HB 3.300 . 4.700 4.175 4.027 4.305 . 0 0 "[ . 1 .]" 1
782 1 31 VAL QG 1 33 VAL QG 2.000 . 2.500 2.026 1.918 2.148 . 0 0 "[ . 1 .]" 1
783 1 31 VAL QG 1 53 VAL HB 2.600 . 3.400 3.446 3.431 3.467 0.067 5 0 "[ . 1 .]" 1
784 1 31 VAL QG 1 55 SER H 3.200 . 4.500 3.878 3.705 3.999 . 0 0 "[ . 1 .]" 1
785 1 31 VAL QG 1 55 SER HA 2.100 . 2.600 2.198 2.007 2.344 . 0 0 "[ . 1 .]" 1
786 1 31 VAL QG 1 55 SER QB 2.400 . 3.100 2.621 2.270 2.989 . 0 0 "[ . 1 .]" 1
787 1 31 VAL QG 1 56 ASP H 4.700 . 6.000 4.704 4.564 4.794 . 0 0 "[ . 1 .]" 1
788 1 31 VAL QG 1 93 MET H 4.300 . 6.000 4.625 4.494 4.709 . 0 0 "[ . 1 .]" 1
789 1 31 VAL QG 1 93 MET HA 3.200 . 4.500 3.857 3.689 4.011 . 0 0 "[ . 1 .]" 1
790 1 31 VAL QG 1 93 MET QB 2.400 . 3.100 2.076 1.896 2.198 0.004 15 0 "[ . 1 .]" 1
791 1 31 VAL QG 1 93 MET ME 2.300 . 2.900 2.786 2.592 2.925 0.025 4 0 "[ . 1 .]" 1
792 1 31 VAL QG 1 93 MET QG 4.100 . 4.600 3.612 3.460 3.839 . 0 0 "[ . 1 .]" 1
793 1 31 VAL QG 1 94 GLY H 3.100 . 4.300 3.394 3.145 3.576 . 0 0 "[ . 1 .]" 1
794 1 31 VAL QG 1 94 GLY QA 2.300 . 2.800 2.038 1.860 2.193 . 0 0 "[ . 1 .]" 1
795 1 31 VAL QG 1 95 GLN H 5.100 . 6.000 4.691 4.481 4.893 . 0 0 "[ . 1 .]" 1
796 1 31 VAL QG 1 96 LEU QB 5.100 . 6.000 4.292 4.139 4.439 . 0 0 "[ . 1 .]" 1
797 1 31 VAL QG 1 97 TYR H 3.000 . 3.800 3.642 3.405 3.781 . 0 0 "[ . 1 .]" 1
798 1 31 VAL QG 1 97 TYR HA 3.500 . 4.300 4.223 4.096 4.305 0.005 9 0 "[ . 1 .]" 1
799 1 31 VAL QG 1 97 TYR QB 2.500 . 2.500 2.110 1.875 2.263 . 0 0 "[ . 1 .]" 1
800 1 31 VAL QG 1 97 TYR QD 2.300 . 2.900 2.927 2.908 2.952 0.052 6 0 "[ . 1 .]" 1
801 1 31 VAL QG 1 97 TYR QE 4.300 . 6.000 3.965 3.923 4.005 . 0 0 "[ . 1 .]" 1
802 1 31 VAL QG 1 107 LEU QB 3.700 . 5.400 3.296 3.227 3.374 . 0 0 "[ . 1 .]" 1
803 1 31 VAL QG 1 107 LEU QD 3.300 . 4.600 3.580 3.446 3.701 . 0 0 "[ . 1 .]" 1
804 1 31 VAL QG 1 107 LEU HG 3.200 . 3.300 3.358 3.326 3.398 0.098 3 0 "[ . 1 .]" 1
805 1 32 PRO HA 1 32 PRO QD 4.500 . 6.000 3.346 3.299 3.378 . 0 0 "[ . 1 .]" 1
806 1 32 PRO HA 1 32 PRO QG 3.300 . 4.500 3.502 3.494 3.507 . 0 0 "[ . 1 .]" 1
807 1 32 PRO HA 1 33 VAL H 2.000 . 2.500 2.179 2.169 2.186 . 0 0 "[ . 1 .]" 1
808 1 32 PRO HA 1 33 VAL HB 3.800 . 5.600 4.673 4.627 4.702 . 0 0 "[ . 1 .]" 1
809 1 32 PRO HA 1 33 VAL QG 3.500 . 5.000 3.723 3.594 3.770 . 0 0 "[ . 1 .]" 1
810 1 32 PRO HA 1 34 ILE QG 5.100 . 6.000 5.655 5.325 5.871 . 0 0 "[ . 1 .]" 1
811 1 32 PRO HA 1 52 LEU HA 2.400 . 3.100 2.853 2.731 3.090 . 0 0 "[ . 1 .]" 1
812 1 32 PRO HA 1 52 LEU QD 2.400 . 3.100 2.228 2.089 2.348 . 0 0 "[ . 1 .]" 1
813 1 32 PRO HA 1 52 LEU HG 4.100 . 6.000 4.574 4.392 4.754 . 0 0 "[ . 1 .]" 1
814 1 32 PRO HA 1 53 VAL H 3.400 . 4.800 4.194 4.070 4.364 . 0 0 "[ . 1 .]" 1
815 1 32 PRO QB 1 32 PRO QD 3.100 . 4.100 2.772 2.737 2.799 . 0 0 "[ . 1 .]" 1
816 1 32 PRO QB 1 33 VAL H 3.000 . 3.600 3.597 3.459 3.622 0.022 2 0 "[ . 1 .]" 1
817 1 32 PRO QB 1 33 VAL HA 4.900 . 6.000 4.363 4.276 4.399 . 0 0 "[ . 1 .]" 1
818 1 32 PRO QB 1 33 VAL QG 4.500 . 6.000 4.485 4.373 4.518 . 0 0 "[ . 1 .]" 1
819 1 32 PRO QB 1 50 LYS QE 3.500 . 5.000 4.423 2.948 4.965 . 0 0 "[ . 1 .]" 1
820 1 32 PRO QB 1 52 LEU QD 3.000 . 3.600 2.698 2.518 2.921 . 0 0 "[ . 1 .]" 1
821 1 32 PRO QB 1 52 LEU HG 5.000 . 6.000 5.238 4.973 5.486 . 0 0 "[ . 1 .]" 1
822 1 32 PRO QB 1 106 PHE QD 3.100 . 3.900 2.826 2.636 3.065 . 0 0 "[ . 1 .]" 1
823 1 32 PRO QB 1 106 PHE QE 2.900 . 3.900 2.713 2.545 2.877 . 0 0 "[ . 1 .]" 1
824 1 32 PRO QB 1 106 PHE HZ 2.900 . 3.900 3.516 3.289 3.715 . 0 0 "[ . 1 .]" 1
825 1 32 PRO QD 1 32 PRO QG 2.800 . 2.800 1.967 1.963 1.972 . 0 0 "[ . 1 .]" 1
826 1 32 PRO QD 1 52 LEU QD . . 4.800 3.119 2.829 3.419 . 0 0 "[ . 1 .]" 1
827 1 32 PRO QD 1 97 TYR QD 2.900 . 4.000 3.186 2.922 3.428 . 0 0 "[ . 1 .]" 1
828 1 32 PRO QG 1 52 LEU QD 3.300 . 4.700 3.867 3.672 4.149 . 0 0 "[ . 1 .]" 1
829 1 32 PRO QG 1 97 TYR QD 3.100 . 4.300 3.657 3.524 3.760 . 0 0 "[ . 1 .]" 1
830 1 32 PRO QG 1 97 TYR QE 3.900 . 5.800 2.023 1.983 2.253 0.017 5 0 "[ . 1 .]" 1
831 1 32 PRO QG 1 106 PHE HA 2.700 . 3.600 1.979 1.893 2.214 0.007 8 0 "[ . 1 .]" 1
832 1 32 PRO QG 1 106 PHE QD 3.300 . 4.700 2.570 2.398 2.862 . 0 0 "[ . 1 .]" 1
833 1 33 VAL H 1 33 VAL HB 2.200 . 2.800 2.555 2.520 2.624 . 0 0 "[ . 1 .]" 1
834 1 33 VAL H 1 33 VAL QG 2.600 . 3.100 2.555 2.488 2.658 . 0 0 "[ . 1 .]" 1
835 1 33 VAL H 1 50 LYS HA 3.600 . 5.200 4.685 4.496 4.852 . 0 0 "[ . 1 .]" 1
836 1 33 VAL H 1 51 TYR H 3.000 . 4.100 2.889 2.665 3.073 . 0 0 "[ . 1 .]" 1
837 1 33 VAL H 1 51 TYR QB 4.700 . 6.000 3.387 3.308 3.439 . 0 0 "[ . 1 .]" 1
838 1 33 VAL H 1 51 TYR QD 4.100 . 6.000 5.155 5.073 5.226 . 0 0 "[ . 1 .]" 1
839 1 33 VAL H 1 52 LEU HA 3.200 . 4.500 3.258 3.173 3.324 . 0 0 "[ . 1 .]" 1
840 1 33 VAL H 1 52 LEU QD 3.500 . 4.500 3.524 3.425 3.665 . 0 0 "[ . 1 .]" 1
841 1 33 VAL H 1 53 VAL H 4.800 . 6.000 3.595 3.438 3.881 . 0 0 "[ . 1 .]" 1
842 1 33 VAL H 1 53 VAL QG 4.000 . 6.000 3.582 3.425 3.849 . 0 0 "[ . 1 .]" 1
843 1 33 VAL HA 1 33 VAL HB 2.500 . 3.300 3.017 3.013 3.022 . 0 0 "[ . 1 .]" 1
844 1 33 VAL HA 1 33 VAL QG 2.000 . 2.500 2.118 2.087 2.162 . 0 0 "[ . 1 .]" 1
845 1 33 VAL HA 1 34 ILE H 1.900 . 2.300 2.225 2.190 2.265 . 0 0 "[ . 1 .]" 1
846 1 33 VAL HA 1 34 ILE QG 4.300 . 6.000 3.538 3.395 3.827 . 0 0 "[ . 1 .]" 1
847 1 33 VAL HA 1 97 TYR QD 3.600 . 5.200 4.608 4.413 4.856 . 0 0 "[ . 1 .]" 1
848 1 33 VAL HA 1 106 PHE HA 3.600 . 5.200 4.823 4.662 5.066 . 0 0 "[ . 1 .]" 1
849 1 33 VAL HA 1 106 PHE QB 3.600 . 5.300 4.780 4.408 5.180 . 0 0 "[ . 1 .]" 1
850 1 33 VAL HA 1 107 LEU H 2.700 . 3.600 2.923 2.645 3.344 . 0 0 "[ . 1 .]" 1
851 1 33 VAL HA 1 107 LEU QB 2.900 . 3.900 2.318 2.072 2.492 . 0 0 "[ . 1 .]" 1
852 1 33 VAL HA 1 107 LEU HG 4.100 . 6.000 4.210 4.072 4.349 . 0 0 "[ . 1 .]" 1
853 1 33 VAL HA 1 108 TYR HA 3.600 . 5.300 3.824 3.689 3.982 . 0 0 "[ . 1 .]" 1
854 1 33 VAL HB 1 33 VAL QG 2.000 . 2.500 1.887 1.874 1.896 . 0 0 "[ . 1 .]" 1
855 1 33 VAL HB 1 34 ILE H 3.200 . 4.500 3.924 3.860 4.022 . 0 0 "[ . 1 .]" 1
856 1 33 VAL HB 1 51 TYR H 3.300 . 4.700 3.560 3.479 3.628 . 0 0 "[ . 1 .]" 1
857 1 33 VAL HB 1 51 TYR HA 3.300 . 4.600 4.528 4.429 4.604 0.004 11 0 "[ . 1 .]" 1
858 1 33 VAL HB 1 51 TYR QB 2.600 . 3.100 1.973 1.930 2.060 . 0 0 "[ . 1 .]" 1
859 1 33 VAL HB 1 51 TYR QD 2.900 . 3.900 3.921 3.806 3.964 0.064 10 0 "[ . 1 .]" 1
860 1 33 VAL HB 1 53 VAL QG 2.800 . 3.800 2.664 2.440 2.908 . 0 0 "[ . 1 .]" 1
861 1 33 VAL HB 1 62 PHE QE 4.300 . 6.000 3.749 3.604 3.949 . 0 0 "[ . 1 .]" 1
862 1 33 VAL HB 1 62 PHE HZ 3.200 . 4.500 3.021 2.861 3.334 . 0 0 "[ . 1 .]" 1
863 1 33 VAL HB 1 93 MET ME 3.100 . 4.300 4.195 4.043 4.332 0.032 11 0 "[ . 1 .]" 1
864 1 33 VAL HB 1 107 LEU QB 4.200 . 6.000 4.531 4.214 4.743 . 0 0 "[ . 1 .]" 1
865 1 33 VAL HB 1 109 ILE QG 4.000 . 6.000 4.811 4.594 4.971 . 0 0 "[ . 1 .]" 1
866 1 33 VAL QG 1 34 ILE H . . 2.700 2.043 1.900 2.198 . 0 0 "[ . 1 .]" 1
867 1 33 VAL QG 1 34 ILE HA 2.700 . 3.600 3.499 3.327 3.635 0.035 1 0 "[ . 1 .]" 1
868 1 33 VAL QG 1 35 VAL H 2.700 . 3.600 2.610 2.379 2.907 . 0 0 "[ . 1 .]" 1
869 1 33 VAL QG 1 35 VAL HA 3.100 . 4.300 3.348 3.250 3.522 . 0 0 "[ . 1 .]" 1
870 1 33 VAL QG 1 35 VAL QG 1.800 . 2.200 1.960 1.831 2.160 . 0 0 "[ . 1 .]" 1
871 1 33 VAL QG 1 51 TYR H 2.900 . 3.900 3.930 3.904 3.952 0.052 15 0 "[ . 1 .]" 1
872 1 33 VAL QG 1 51 TYR QB 3.100 . 4.100 2.587 2.497 2.736 . 0 0 "[ . 1 .]" 1
873 1 33 VAL QG 1 51 TYR QD 2.700 . 3.600 3.294 3.143 3.437 . 0 0 "[ . 1 .]" 1
874 1 33 VAL QG 1 52 LEU H 4.000 . 6.000 5.226 5.188 5.273 . 0 0 "[ . 1 .]" 1
875 1 33 VAL QG 1 52 LEU HA 3.000 . 4.100 4.159 4.132 4.196 0.096 5 0 "[ . 1 .]" 1
876 1 33 VAL QG 1 53 VAL H 3.200 . 4.400 3.131 3.023 3.261 . 0 0 "[ . 1 .]" 1
877 1 33 VAL QG 1 53 VAL QG 2.100 . 2.700 1.941 1.727 2.160 . 0 0 "[ . 1 .]" 1
878 1 33 VAL QG 1 62 PHE QD 3.100 . 4.300 3.902 3.812 3.980 . 0 0 "[ . 1 .]" 1
879 1 33 VAL QG 1 62 PHE QE 3.400 . 3.500 2.549 2.468 2.704 . 0 0 "[ . 1 .]" 1
880 1 33 VAL QG 1 62 PHE HZ 2.600 . 3.400 1.974 1.890 2.191 0.010 14 0 "[ . 1 .]" 1
881 1 33 VAL QG 1 66 ILE MD 4.100 . 6.000 4.250 4.117 4.394 . 0 0 "[ . 1 .]" 1
882 1 33 VAL QG 1 93 MET HA 4.500 . 6.000 4.497 4.390 4.615 . 0 0 "[ . 1 .]" 1
883 1 33 VAL QG 1 93 MET QB 2.900 . 4.000 3.269 3.170 3.506 . 0 0 "[ . 1 .]" 1
884 1 33 VAL QG 1 93 MET ME 1.800 . 2.200 2.031 1.861 2.203 0.003 7 0 "[ . 1 .]" 1
885 1 33 VAL QG 1 93 MET QG 5.100 . 6.000 3.831 3.525 4.141 . 0 0 "[ . 1 .]" 1
886 1 33 VAL QG 1 97 TYR QD 3.000 . 4.100 3.656 3.530 3.824 . 0 0 "[ . 1 .]" 1
887 1 33 VAL QG 1 107 LEU H 4.000 . 6.000 3.908 3.718 4.058 . 0 0 "[ . 1 .]" 1
888 1 33 VAL QG 1 107 LEU HA 3.800 . 5.600 4.258 4.117 4.409 . 0 0 "[ . 1 .]" 1
889 1 33 VAL QG 1 107 LEU QB 2.600 . 3.100 2.169 1.910 2.407 . 0 0 "[ . 1 .]" 1
890 1 33 VAL QG 1 107 LEU HG 2.000 . 2.500 2.548 2.532 2.557 0.057 1 0 "[ . 1 .]" 1
891 1 33 VAL QG 1 108 TYR HA 3.200 . 4.500 3.133 2.984 3.314 . 0 0 "[ . 1 .]" 1
892 1 33 VAL QG 1 109 ILE H 3.100 . 4.300 3.110 2.979 3.274 . 0 0 "[ . 1 .]" 1
893 1 33 VAL QG 1 109 ILE HA 3.200 . 4.500 4.482 4.319 4.541 0.041 9 0 "[ . 1 .]" 1
894 1 33 VAL QG 1 109 ILE HB . . 3.000 2.772 2.569 2.946 . 0 0 "[ . 1 .]" 1
895 1 33 VAL QG 1 109 ILE MD 2.000 . 2.500 2.375 1.996 2.483 . 0 0 "[ . 1 .]" 1
896 1 33 VAL QG 1 109 ILE QG 2.300 . 2.900 2.015 1.885 2.209 . 0 0 "[ . 1 .]" 1
897 1 34 ILE H 1 34 ILE HA 2.800 . 3.800 2.941 2.935 2.944 . 0 0 "[ . 1 .]" 1
898 1 34 ILE H 1 34 ILE HB 2.200 . 2.800 2.776 2.620 2.843 0.043 8 0 "[ . 1 .]" 1
899 1 34 ILE H 1 34 ILE MD 3.100 . 4.300 3.549 3.252 4.245 . 0 0 "[ . 1 .]" 1
900 1 34 ILE H 1 34 ILE QG 3.100 . 4.300 2.749 2.527 3.179 . 0 0 "[ . 1 .]" 1
901 1 34 ILE H 1 34 ILE QG 2.800 . 3.800 2.688 2.497 3.023 . 0 0 "[ . 1 .]" 1
902 1 34 ILE H 1 35 VAL H 4.700 . 6.000 3.534 3.424 3.715 . 0 0 "[ . 1 .]" 1
903 1 34 ILE H 1 35 VAL QG 3.500 . 5.100 4.021 3.826 4.117 . 0 0 "[ . 1 .]" 1
904 1 34 ILE H 1 62 PHE HZ 5.700 . 6.000 5.304 5.093 5.644 . 0 0 "[ . 1 .]" 1
905 1 34 ILE H 1 106 PHE HA 4.100 . 6.000 6.021 5.966 6.053 0.053 1 0 "[ . 1 .]" 1
906 1 34 ILE H 1 106 PHE QD 3.800 . 5.600 5.042 4.755 5.244 . 0 0 "[ . 1 .]" 1
907 1 34 ILE H 1 107 LEU H 5.000 . 6.000 3.886 3.504 4.743 . 0 0 "[ . 1 .]" 1
908 1 34 ILE H 1 107 LEU QB 4.500 . 6.000 3.906 3.656 4.138 . 0 0 "[ . 1 .]" 1
909 1 34 ILE H 1 108 TYR HA 2.900 . 3.900 1.900 1.865 2.010 0.035 8 0 "[ . 1 .]" 1
910 1 34 ILE H 1 108 TYR QD 3.900 . 5.800 5.062 4.756 5.165 . 0 0 "[ . 1 .]" 1
911 1 34 ILE H 1 109 ILE H 3.700 . 5.400 3.063 2.991 3.189 . 0 0 "[ . 1 .]" 1
912 1 34 ILE H 1 109 ILE QG 5.300 . 6.000 3.467 3.270 3.579 . 0 0 "[ . 1 .]" 1
913 1 34 ILE HA 1 34 ILE HB 3.000 . 4.100 3.020 3.010 3.031 . 0 0 "[ . 1 .]" 1
914 1 34 ILE HA 1 34 ILE MD 2.200 . 2.800 1.905 1.802 2.176 . 0 0 "[ . 1 .]" 1
915 1 34 ILE HA 1 34 ILE QG 3.100 . 4.300 2.992 2.613 3.109 . 0 0 "[ . 1 .]" 1
916 1 34 ILE HA 1 34 ILE QG 2.500 . 3.300 2.170 2.097 2.303 . 0 0 "[ . 1 .]" 1
917 1 34 ILE HA 1 35 VAL H 2.200 . 2.800 2.342 2.239 2.397 . 0 0 "[ . 1 .]" 1
918 1 34 ILE HA 1 35 VAL HA 6.000 . 6.000 4.548 4.489 4.584 . 0 0 "[ . 1 .]" 1
919 1 34 ILE HA 1 35 VAL HB 4.400 . 6.000 4.717 4.667 4.762 . 0 0 "[ . 1 .]" 1
920 1 34 ILE HA 1 35 VAL QG 3.700 . 5.500 3.871 3.692 4.029 . 0 0 "[ . 1 .]" 1
921 1 34 ILE HA 1 50 LYS HA 2.400 . 3.100 2.499 2.401 2.664 . 0 0 "[ . 1 .]" 1
922 1 34 ILE HA 1 50 LYS QB 5.200 . 6.000 4.048 3.764 4.531 . 0 0 "[ . 1 .]" 1
923 1 34 ILE HA 1 51 TYR H 3.000 . 4.200 3.621 3.489 3.753 . 0 0 "[ . 1 .]" 1
924 1 34 ILE HB 1 34 ILE MD 2.900 . 3.900 3.217 3.208 3.221 . 0 0 "[ . 1 .]" 1
925 1 34 ILE HB 1 34 ILE QG 2.700 . 2.800 2.193 2.179 2.200 . 0 0 "[ . 1 .]" 1
926 1 34 ILE HB 1 34 ILE QG 2.100 . 2.600 1.909 1.895 1.924 . 0 0 "[ . 1 .]" 1
927 1 34 ILE HB 1 35 VAL H 4.000 . 6.000 4.440 4.397 4.548 . 0 0 "[ . 1 .]" 1
928 1 34 ILE HB 1 106 PHE QD 3.100 . 4.300 4.187 3.519 4.345 0.045 2 0 "[ . 1 .]" 1
929 1 34 ILE HB 1 108 TYR HA 2.600 . 3.400 2.011 1.825 2.200 . 0 0 "[ . 1 .]" 1
930 1 34 ILE HB 1 108 TYR QB 2.200 . 2.800 1.737 1.643 1.788 . 0 0 "[ . 1 .]" 1
931 1 34 ILE HB 1 108 TYR QD 2.700 . 3.600 3.663 3.351 3.735 0.135 11 0 "[ . 1 .]" 1
932 1 34 ILE HB 1 109 ILE H 3.400 . 4.900 3.371 3.052 3.853 . 0 0 "[ . 1 .]" 1
933 1 34 ILE MD 1 34 ILE QG 2.000 . 2.500 1.758 1.698 1.781 . 0 0 "[ . 1 .]" 1
934 1 34 ILE MD 1 35 VAL H 2.900 . 3.900 3.929 3.900 3.943 0.043 12 0 "[ . 1 .]" 1
935 1 34 ILE MD 1 49 LYS QD 4.100 . 6.000 4.096 3.196 4.617 . 0 0 "[ . 1 .]" 1
936 1 34 ILE MD 1 49 LYS QG 4.800 . 6.000 5.028 4.015 5.437 . 0 0 "[ . 1 .]" 1
937 1 34 ILE MD 1 50 LYS H 4.700 . 6.000 3.618 2.696 4.024 . 0 0 "[ . 1 .]" 1
938 1 34 ILE MD 1 50 LYS HA 2.200 . 2.800 1.906 1.796 2.031 . 0 0 "[ . 1 .]" 1
939 1 34 ILE MD 1 50 LYS QB 2.800 . 3.700 3.005 2.198 3.582 . 0 0 "[ . 1 .]" 1
940 1 34 ILE MD 1 50 LYS QB 2.600 . 3.400 2.196 1.815 3.008 . 0 0 "[ . 1 .]" 1
941 1 34 ILE MD 1 50 LYS QD 3.200 . 4.500 2.334 1.891 3.697 0.009 10 0 "[ . 1 .]" 1
942 1 34 ILE MD 1 50 LYS QE 2.500 . 3.300 2.839 1.887 3.335 0.035 3 0 "[ . 1 .]" 1
943 1 34 ILE MD 1 50 LYS QG 3.000 . 4.100 2.674 1.904 3.336 . 0 0 "[ . 1 .]" 1
944 1 34 ILE MD 1 51 TYR H 2.900 . 3.900 3.144 2.976 3.501 . 0 0 "[ . 1 .]" 1
945 1 34 ILE MD 1 106 PHE QB 4.000 . 6.000 3.918 3.526 4.929 . 0 0 "[ . 1 .]" 1
946 1 34 ILE MD 1 106 PHE QD 2.600 . 3.400 2.528 2.109 3.405 0.005 5 0 "[ . 1 .]" 1
947 1 34 ILE MD 1 106 PHE QE 2.600 . 3.400 2.137 1.937 2.462 . 0 0 "[ . 1 .]" 1
948 1 34 ILE QG 1 35 VAL H 2.700 . 3.600 3.497 3.251 3.606 0.006 12 0 "[ . 1 .]" 1
949 1 34 ILE QG 1 35 VAL HA 4.500 . 6.000 4.386 4.068 4.520 . 0 0 "[ . 1 .]" 1
950 1 34 ILE QG 1 36 GLU H 4.800 . 6.000 5.165 4.787 5.372 . 0 0 "[ . 1 .]" 1
951 1 34 ILE QG 1 36 GLU HA 4.400 . 6.000 4.787 4.593 4.966 . 0 0 "[ . 1 .]" 1
952 1 34 ILE QG 1 36 GLU QB 3.200 . 4.500 4.140 3.821 4.411 . 0 0 "[ . 1 .]" 1
953 1 34 ILE QG 1 36 GLU QG 2.600 . 3.500 3.537 3.505 3.569 0.069 5 0 "[ . 1 .]" 1
954 1 34 ILE QG 1 49 LYS QB 3.100 . 4.000 1.921 1.877 2.109 0.023 10 0 "[ . 1 .]" 1
955 1 34 ILE QG 1 49 LYS QD 2.600 . 3.400 1.892 1.775 2.020 0.025 3 0 "[ . 1 .]" 1
956 1 34 ILE QG 1 49 LYS QE 4.600 . 4.800 3.232 3.051 3.608 . 0 0 "[ . 1 .]" 1
957 1 34 ILE QG 1 49 LYS QG 4.200 . 5.800 3.476 3.321 3.611 . 0 0 "[ . 1 .]" 1
958 1 34 ILE QG 1 50 LYS HA 3.100 . 4.300 3.220 2.822 3.467 . 0 0 "[ . 1 .]" 1
959 1 34 ILE QG 1 50 LYS QB 4.800 . 6.000 4.072 3.757 4.530 . 0 0 "[ . 1 .]" 1
960 1 34 ILE QG 1 106 PHE QD 2.800 . 3.800 1.971 1.940 2.042 . 0 0 "[ . 1 .]" 1
961 1 34 ILE QG 1 108 TYR QB 3.800 . 5.600 2.416 2.011 2.586 . 0 0 "[ . 1 .]" 1
962 1 34 ILE QG 1 108 TYR QD 2.800 . 3.800 3.521 3.185 3.669 . 0 0 "[ . 1 .]" 1
963 1 34 ILE QG 1 109 ILE H 4.200 . 6.000 3.762 3.609 3.887 . 0 0 "[ . 1 .]" 1
964 1 34 ILE QG 1 106 PHE QB 3.000 . 4.100 2.921 2.704 3.533 . 0 0 "[ . 1 .]" 1
965 1 34 ILE QG 1 106 PHE QD 3.000 . 4.100 1.976 1.945 2.047 . 0 0 "[ . 1 .]" 1
966 1 34 ILE QG 1 106 PHE QE 4.200 . 6.000 3.143 2.494 3.507 . 0 0 "[ . 1 .]" 1
967 1 34 ILE MG 1 49 LYS QG 3.400 . 4.800 3.495 3.343 3.631 . 0 0 "[ . 1 .]" 1
968 1 35 VAL H 1 35 VAL HA 2.900 . 4.000 2.811 2.789 2.856 . 0 0 "[ . 1 .]" 1
969 1 35 VAL H 1 35 VAL HB 2.400 . 3.100 2.590 2.528 2.632 . 0 0 "[ . 1 .]" 1
970 1 35 VAL H 1 35 VAL QG 2.800 . 3.100 1.989 1.899 2.198 . 0 0 "[ . 1 .]" 1
971 1 35 VAL H 1 36 GLU H 4.400 . 6.000 4.642 4.612 4.661 . 0 0 "[ . 1 .]" 1
972 1 35 VAL H 1 46 LEU QD 4.000 . 6.000 5.223 4.987 5.400 . 0 0 "[ . 1 .]" 1
973 1 35 VAL H 1 49 LYS HA 2.900 . 3.900 3.633 3.385 3.902 0.002 10 0 "[ . 1 .]" 1
974 1 35 VAL H 1 49 LYS QB 4.000 . 6.000 4.379 4.199 4.510 . 0 0 "[ . 1 .]" 1
975 1 35 VAL H 1 50 LYS HA 3.400 . 4.800 3.980 3.845 4.219 . 0 0 "[ . 1 .]" 1
976 1 35 VAL H 1 51 TYR QD 4.000 . 6.000 2.082 1.992 2.185 0.008 6 0 "[ . 1 .]" 1
977 1 35 VAL H 1 51 TYR QE 4.600 . 6.000 3.461 3.051 3.664 . 0 0 "[ . 1 .]" 1
978 1 35 VAL H 1 109 ILE QG 3.400 . 4.900 4.904 4.805 4.942 0.042 5 0 "[ . 1 .]" 1
979 1 35 VAL HA 1 35 VAL HB 2.800 . 3.800 3.020 3.018 3.022 . 0 0 "[ . 1 .]" 1
980 1 35 VAL HA 1 35 VAL QG 2.000 . 2.500 2.074 2.048 2.098 . 0 0 "[ . 1 .]" 1
981 1 35 VAL HA 1 36 GLU H 2.100 . 2.600 2.313 2.209 2.370 . 0 0 "[ . 1 .]" 1
982 1 35 VAL HA 1 36 GLU HA 3.400 . 4.800 4.480 4.436 4.506 . 0 0 "[ . 1 .]" 1
983 1 35 VAL HA 1 36 GLU QG 6.000 . 6.000 5.050 4.948 5.182 . 0 0 "[ . 1 .]" 1
984 1 35 VAL HA 1 108 TYR HA 3.300 . 4.600 4.370 4.122 4.609 0.009 15 0 "[ . 1 .]" 1
985 1 35 VAL HA 1 109 ILE H 2.700 . 3.600 2.553 2.337 2.775 . 0 0 "[ . 1 .]" 1
986 1 35 VAL HA 1 109 ILE HB 2.800 . 3.800 2.303 2.254 2.393 . 0 0 "[ . 1 .]" 1
987 1 35 VAL HA 1 109 ILE QG 3.500 . 5.000 3.177 3.103 3.293 . 0 0 "[ . 1 .]" 1
988 1 35 VAL HA 1 110 ALA HA 3.000 . 4.100 3.753 3.650 3.841 . 0 0 "[ . 1 .]" 1
989 1 35 VAL HA 1 111 TYR H 4.800 . 6.000 5.644 5.530 5.749 . 0 0 "[ . 1 .]" 1
990 1 35 VAL HA 1 111 TYR QD 4.700 . 6.000 4.417 4.259 4.509 . 0 0 "[ . 1 .]" 1
991 1 35 VAL HB 1 35 VAL QG 2.100 . 2.300 1.884 1.865 1.890 . 0 0 "[ . 1 .]" 1
992 1 35 VAL HB 1 36 GLU H 3.500 . 5.000 3.739 3.638 3.906 . 0 0 "[ . 1 .]" 1
993 1 35 VAL HB 1 49 LYS HA 3.000 . 4.100 3.391 3.134 3.744 . 0 0 "[ . 1 .]" 1
994 1 35 VAL HB 1 51 TYR QD 3.700 . 5.400 2.751 2.580 3.080 . 0 0 "[ . 1 .]" 1
995 1 35 VAL HB 1 51 TYR QE 2.200 . 2.800 1.960 1.901 2.061 . 0 0 "[ . 1 .]" 1
996 1 35 VAL HB 1 62 PHE QE 4.200 . 6.000 4.947 4.792 5.058 . 0 0 "[ . 1 .]" 1
997 1 35 VAL HB 1 62 PHE HZ 5.100 . 6.000 4.390 4.273 4.478 . 0 0 "[ . 1 .]" 1
998 1 35 VAL HB 1 66 ILE MD 3.000 . 4.200 2.994 2.801 3.274 . 0 0 "[ . 1 .]" 1
999 1 35 VAL HB 1 109 ILE HB 3.600 . 5.300 4.752 4.643 4.812 . 0 0 "[ . 1 .]" 1
1000 1 35 VAL HB 1 109 ILE QG 6.000 . 6.000 4.966 4.921 5.003 . 0 0 "[ . 1 .]" 1
1001 1 35 VAL HB 1 111 TYR QD 3.700 . 5.400 4.119 4.013 4.173 . 0 0 "[ . 1 .]" 1
1002 1 35 VAL QG 1 36 GLU H 2.400 . 3.100 1.935 1.890 2.118 0.010 11 0 "[ . 1 .]" 1
1003 1 35 VAL QG 1 36 GLU HA 2.900 . 4.000 3.490 3.384 3.649 . 0 0 "[ . 1 .]" 1
1004 1 35 VAL QG 1 37 LYS H 3.900 . 5.800 4.653 4.570 4.799 . 0 0 "[ . 1 .]" 1
1005 1 35 VAL QG 1 49 LYS HA 4.000 . 6.000 3.937 3.755 4.218 . 0 0 "[ . 1 .]" 1
1006 1 35 VAL QG 1 51 TYR QB 2.800 . 3.800 2.619 2.439 2.923 . 0 0 "[ . 1 .]" 1
1007 1 35 VAL QG 1 51 TYR QD 2.000 . 2.500 2.126 2.008 2.389 . 0 0 "[ . 1 .]" 1
1008 1 35 VAL QG 1 51 TYR QE 2.300 . 2.900 2.800 2.728 2.869 . 0 0 "[ . 1 .]" 1
1009 1 35 VAL QG 1 62 PHE QE 2.100 . 2.700 2.226 2.107 2.324 . 0 0 "[ . 1 .]" 1
1010 1 35 VAL QG 1 62 PHE HZ 2.200 . 2.800 1.909 1.889 1.930 0.011 5 0 "[ . 1 .]" 1
1011 1 35 VAL QG 1 66 ILE MD . . 2.300 1.861 1.712 2.037 . 0 0 "[ . 1 .]" 1
1012 1 35 VAL QG 1 66 ILE QG 2.300 . 2.300 2.260 2.080 2.330 0.030 3 0 "[ . 1 .]" 1
1013 1 35 VAL QG 1 66 ILE QG 2.300 . 2.900 2.015 1.869 2.108 . 0 0 "[ . 1 .]" 1
1014 1 35 VAL QG 1 109 ILE H 3.400 . 4.500 3.612 3.353 3.804 . 0 0 "[ . 1 .]" 1
1015 1 35 VAL QG 1 109 ILE HB 2.300 . 3.000 2.364 2.179 2.520 . 0 0 "[ . 1 .]" 1
1016 1 35 VAL QG 1 109 ILE QG 2.100 . 2.600 2.657 2.623 2.676 0.076 12 0 "[ . 1 .]" 1
1017 1 35 VAL QG 1 110 ALA H 4.500 . 6.000 4.004 3.866 4.080 . 0 0 "[ . 1 .]" 1
1018 1 35 VAL QG 1 110 ALA HA 2.700 . 3.600 3.077 2.915 3.164 . 0 0 "[ . 1 .]" 1
1019 1 35 VAL QG 1 111 TYR H 3.300 . 4.700 3.770 3.658 3.866 . 0 0 "[ . 1 .]" 1
1020 1 35 VAL QG 1 111 TYR QB 3.100 . 4.300 2.833 2.741 2.912 . 0 0 "[ . 1 .]" 1
1021 1 35 VAL QG 1 111 TYR QD 2.000 . 2.500 1.751 1.712 1.784 . 0 0 "[ . 1 .]" 1
1022 1 35 VAL QG 1 111 TYR QE 2.000 . 2.500 2.518 2.497 2.529 0.029 15 0 "[ . 1 .]" 1
1023 1 36 GLU H 1 36 GLU HA 2.900 . 3.900 2.923 2.906 2.942 . 0 0 "[ . 1 .]" 1
1024 1 36 GLU H 1 36 GLU QB 3.000 . 4.100 2.640 2.525 2.708 . 0 0 "[ . 1 .]" 1
1025 1 36 GLU H 1 36 GLU QG 3.300 . 4.600 4.069 3.962 4.152 . 0 0 "[ . 1 .]" 1
1026 1 36 GLU H 1 37 LYS H 4.200 . 6.000 4.412 4.379 4.450 . 0 0 "[ . 1 .]" 1
1027 1 36 GLU H 1 109 ILE H 3.700 . 5.400 4.187 4.018 4.327 . 0 0 "[ . 1 .]" 1
1028 1 36 GLU H 1 109 ILE HB 3.800 . 5.600 3.981 3.889 4.038 . 0 0 "[ . 1 .]" 1
1029 1 36 GLU H 1 109 ILE QG 3.900 . 5.800 3.644 3.548 3.785 . 0 0 "[ . 1 .]" 1
1030 1 36 GLU H 1 110 ALA HA 2.200 . 2.800 1.950 1.827 2.057 . 0 0 "[ . 1 .]" 1
1031 1 36 GLU H 1 110 ALA MB 3.100 . 4.300 3.626 3.520 3.732 . 0 0 "[ . 1 .]" 1
1032 1 36 GLU H 1 111 TYR H 3.300 . 4.600 3.591 3.492 3.710 . 0 0 "[ . 1 .]" 1
1033 1 36 GLU H 1 111 TYR QD 4.000 . 6.000 2.943 2.719 3.199 . 0 0 "[ . 1 .]" 1
1034 1 36 GLU H 1 111 TYR QE 4.500 . 6.000 4.137 3.908 4.471 . 0 0 "[ . 1 .]" 1
1035 1 36 GLU HA 1 36 GLU QB 2.300 . 3.000 2.530 2.487 2.544 . 0 0 "[ . 1 .]" 1
1036 1 36 GLU HA 1 36 GLU QG 2.200 . 2.800 2.164 1.992 2.601 . 0 0 "[ . 1 .]" 1
1037 1 36 GLU HA 1 37 LYS H 2.100 . 2.600 2.360 2.323 2.399 . 0 0 "[ . 1 .]" 1
1038 1 36 GLU HA 1 49 LYS QB 3.600 . 5.200 4.973 4.803 5.224 0.024 3 0 "[ . 1 .]" 1
1039 1 36 GLU HA 1 49 LYS QD 3.100 . 4.300 2.708 2.418 3.161 . 0 0 "[ . 1 .]" 1
1040 1 36 GLU HA 1 49 LYS QE 3.000 . 4.100 4.080 3.923 4.127 0.027 13 0 "[ . 1 .]" 1
1041 1 36 GLU HA 1 49 LYS QG 4.300 . 6.000 3.371 2.978 3.762 . 0 0 "[ . 1 .]" 1
1042 1 36 GLU HA 1 111 TYR QD 4.200 . 6.000 4.267 4.128 4.373 . 0 0 "[ . 1 .]" 1
1043 1 36 GLU HA 1 111 TYR QE 3.200 . 4.400 3.680 3.414 3.971 . 0 0 "[ . 1 .]" 1
1044 1 36 GLU QB 1 36 GLU QG 2.300 . 2.500 2.017 1.966 2.043 . 0 0 "[ . 1 .]" 1
1045 1 36 GLU QB 1 37 LYS H 2.700 . 3.600 2.914 2.496 3.089 . 0 0 "[ . 1 .]" 1
1046 1 36 GLU QB 1 37 LYS HA 5.100 . 6.000 4.217 4.150 4.279 . 0 0 "[ . 1 .]" 1
1047 1 36 GLU QB 1 37 LYS QB 4.800 . 6.000 4.603 4.327 4.708 . 0 0 "[ . 1 .]" 1
1048 1 36 GLU QB 1 110 ALA HA 4.300 . 6.000 2.548 2.468 2.604 . 0 0 "[ . 1 .]" 1
1049 1 36 GLU QB 1 110 ALA MB 2.800 . 3.800 2.481 2.386 2.612 . 0 0 "[ . 1 .]" 1
1050 1 36 GLU QG 1 37 LYS H 3.100 . 3.800 2.997 2.596 3.589 . 0 0 "[ . 1 .]" 1
1051 1 36 GLU QG 1 49 LYS QB 4.300 . 6.000 4.299 4.120 4.521 . 0 0 "[ . 1 .]" 1
1052 1 36 GLU QG 1 49 LYS QD 2.600 . 3.400 1.853 1.783 1.990 0.017 6 0 "[ . 1 .]" 1
1053 1 36 GLU QG 1 49 LYS QG 3.500 . 5.000 3.198 2.935 3.607 . 0 0 "[ . 1 .]" 1
1054 1 37 LYS H 1 37 LYS HA 2.900 . 3.900 2.931 2.924 2.937 . 0 0 "[ . 1 .]" 1
1055 1 37 LYS H 1 37 LYS QB 2.000 . 2.500 2.386 2.335 2.416 . 0 0 "[ . 1 .]" 1
1056 1 37 LYS H 1 37 LYS QD 3.400 . 4.800 4.804 4.763 4.826 0.026 1 0 "[ . 1 .]" 1
1057 1 37 LYS H 1 37 LYS QG 3.100 . 4.300 4.052 3.979 4.082 . 0 0 "[ . 1 .]" 1
1058 1 37 LYS H 1 45 ASP HA 3.500 . 5.000 5.009 5.000 5.018 0.018 2 0 "[ . 1 .]" 1
1059 1 37 LYS H 1 111 TYR QD 4.200 . 6.000 4.722 4.632 4.853 . 0 0 "[ . 1 .]" 1
1060 1 37 LYS H 1 111 TYR QE 3.000 . 4.100 3.881 3.692 4.057 . 0 0 "[ . 1 .]" 1
1061 1 37 LYS HA 1 37 LYS QB 2.000 . 2.500 2.461 2.446 2.502 0.002 14 0 "[ . 1 .]" 1
1062 1 37 LYS HA 1 37 LYS QG 2.100 . 2.700 2.233 2.204 2.259 . 0 0 "[ . 1 .]" 1
1063 1 37 LYS HA 1 38 ALA H 1.700 . 2.200 2.204 2.169 2.222 0.022 6 0 "[ . 1 .]" 1
1064 1 37 LYS HA 1 38 ALA HA 4.300 . 6.000 4.505 4.465 4.524 . 0 0 "[ . 1 .]" 1
1065 1 37 LYS HA 1 38 ALA MB 2.700 . 3.600 3.210 3.149 3.245 . 0 0 "[ . 1 .]" 1
1066 1 37 LYS HA 1 43 ILE MD 3.000 . 4.100 3.398 3.299 3.451 . 0 0 "[ . 1 .]" 1
1067 1 37 LYS HA 1 43 ILE QG 3.800 . 5.600 4.525 4.397 4.630 . 0 0 "[ . 1 .]" 1
1068 1 37 LYS HA 1 110 ALA HA 3.100 . 4.300 4.317 4.292 4.330 0.030 14 0 "[ . 1 .]" 1
1069 1 37 LYS HA 1 110 ALA MB 3.700 . 5.400 4.201 4.049 4.380 . 0 0 "[ . 1 .]" 1
1070 1 37 LYS HA 1 111 TYR H 2.100 . 2.700 2.729 2.720 2.742 0.042 3 0 "[ . 1 .]" 1
1071 1 37 LYS HA 1 111 TYR HA 4.200 . 6.000 4.979 4.937 5.044 . 0 0 "[ . 1 .]" 1
1072 1 37 LYS HA 1 111 TYR QD 2.900 . 3.900 3.375 3.283 3.490 . 0 0 "[ . 1 .]" 1
1073 1 37 LYS HA 1 111 TYR QE 2.600 . 3.500 3.311 3.204 3.405 . 0 0 "[ . 1 .]" 1
1074 1 37 LYS QB 1 37 LYS QE 2.100 . 2.200 2.205 2.175 2.237 0.037 14 0 "[ . 1 .]" 1
1075 1 37 LYS QB 1 37 LYS QG 2.000 . 2.500 2.034 2.030 2.050 . 0 0 "[ . 1 .]" 1
1076 1 37 LYS QB 1 43 ILE MD 3.000 . 4.200 4.131 4.104 4.154 . 0 0 "[ . 1 .]" 1
1077 1 37 LYS QB 1 45 ASP HA 2.900 . 4.000 2.521 2.484 2.623 . 0 0 "[ . 1 .]" 1
1078 1 37 LYS QB 1 46 LEU H 3.800 . 5.600 2.266 2.123 2.518 . 0 0 "[ . 1 .]" 1
1079 1 37 LYS QB 1 111 TYR QD 5.600 . 6.000 4.311 4.222 4.519 . 0 0 "[ . 1 .]" 1
1080 1 37 LYS QB 1 111 TYR QE 2.700 . 3.500 3.015 2.861 3.263 . 0 0 "[ . 1 .]" 1
1081 1 37 LYS QD 1 37 LYS QE 2.100 . 2.600 2.066 2.048 2.073 . 0 0 "[ . 1 .]" 1
1082 1 37 LYS QD 1 37 LYS QG . . 2.200 2.017 2.014 2.024 . 0 0 "[ . 1 .]" 1
1083 1 37 LYS QD 1 41 ALA H 3.700 . 5.400 4.966 4.754 5.370 . 0 0 "[ . 1 .]" 1
1084 1 37 LYS QD 1 43 ILE H 4.500 . 6.000 3.252 3.118 3.387 . 0 0 "[ . 1 .]" 1
1085 1 37 LYS QD 1 45 ASP H 5.400 . 6.000 3.445 3.317 3.569 . 0 0 "[ . 1 .]" 1
1086 1 37 LYS QD 1 45 ASP HA 2.800 . 3.700 1.916 1.887 1.953 0.013 13 0 "[ . 1 .]" 1
1087 1 37 LYS QD 1 45 ASP QB 2.800 . 3.700 2.886 2.522 3.176 . 0 0 "[ . 1 .]" 1
1088 1 37 LYS QD 1 111 TYR QE 3.000 . 4.100 3.606 3.472 3.739 . 0 0 "[ . 1 .]" 1
1089 1 37 LYS QE 1 37 LYS QG 2.500 . 3.300 2.192 2.163 2.249 . 0 0 "[ . 1 .]" 1
1090 1 37 LYS QE 1 39 PRO HA 4.000 . 6.000 3.774 3.462 4.248 . 0 0 "[ . 1 .]" 1
1091 1 37 LYS QE 1 41 ALA H 3.100 . 4.300 3.246 3.099 3.533 . 0 0 "[ . 1 .]" 1
1092 1 37 LYS QE 1 41 ALA MB . . 2.200 1.788 1.712 1.825 . 0 0 "[ . 1 .]" 1
1093 1 37 LYS QE 1 43 ILE H 3.000 . 4.200 4.024 2.781 4.220 0.020 13 0 "[ . 1 .]" 1
1094 1 37 LYS QE 1 43 ILE MD . . 3.500 3.534 3.520 3.559 0.059 6 0 "[ . 1 .]" 1
1095 1 37 LYS QE 1 45 ASP HA 3.200 . 4.500 3.830 3.748 4.098 . 0 0 "[ . 1 .]" 1
1096 1 37 LYS QE 1 45 ASP QB 3.100 . 4.300 4.135 3.800 4.314 0.014 5 0 "[ . 1 .]" 1
1097 1 37 LYS QE 1 111 TYR QE 3.800 . 5.600 4.536 4.467 4.626 . 0 0 "[ . 1 .]" 1
1098 1 37 LYS QG 1 38 ALA H 2.800 . 3.800 3.536 3.381 3.622 . 0 0 "[ . 1 .]" 1
1099 1 37 LYS QG 1 41 ALA H 6.000 . 6.000 5.140 5.026 5.314 . 0 0 "[ . 1 .]" 1
1100 1 37 LYS QG 1 41 ALA MB 2.300 . 3.000 2.689 2.559 2.737 . 0 0 "[ . 1 .]" 1
1101 1 37 LYS QG 1 43 ILE H 3.900 . 5.800 4.322 4.151 4.417 . 0 0 "[ . 1 .]" 1
1102 1 37 LYS QG 1 43 ILE HB 2.700 . 3.600 3.605 3.569 3.620 0.020 3 0 "[ . 1 .]" 1
1103 1 37 LYS QG 1 43 ILE MD . . 2.200 2.212 2.198 2.227 0.027 5 0 "[ . 1 .]" 1
1104 1 37 LYS QG 1 43 ILE QG 2.100 . 2.700 2.391 2.295 2.484 . 0 0 "[ . 1 .]" 1
1105 1 37 LYS QG 1 45 ASP H 5.700 . 6.000 4.560 4.427 4.755 . 0 0 "[ . 1 .]" 1
1106 1 37 LYS QG 1 46 LEU H 3.500 . 5.000 3.295 3.175 3.482 . 0 0 "[ . 1 .]" 1
1107 1 37 LYS QG 1 111 TYR QE 2.800 . 3.800 2.193 2.056 2.337 . 0 0 "[ . 1 .]" 1
1108 1 37 LYS QG 1 112 SER HA 5.000 . 6.000 3.772 3.731 3.815 . 0 0 "[ . 1 .]" 1
1109 1 37 LYS QG 1 112 SER QB 3.800 . 5.600 4.973 4.779 5.311 . 0 0 "[ . 1 .]" 1
1110 1 38 ALA H 1 38 ALA HA 2.900 . 3.900 2.652 2.628 2.702 . 0 0 "[ . 1 .]" 1
1111 1 38 ALA H 1 38 ALA MB 2.100 . 2.600 2.191 2.159 2.247 . 0 0 "[ . 1 .]" 1
1112 1 38 ALA H 1 39 PRO QD 4.200 . 5.200 4.246 4.209 4.285 . 0 0 "[ . 1 .]" 1
1113 1 38 ALA H 1 41 ALA MB 2.900 . 3.900 3.710 3.486 3.856 . 0 0 "[ . 1 .]" 1
1114 1 38 ALA H 1 43 ILE MD 4.100 . 6.000 4.080 3.931 4.208 . 0 0 "[ . 1 .]" 1
1115 1 38 ALA H 1 110 ALA MB 3.400 . 4.900 2.715 2.562 3.097 . 0 0 "[ . 1 .]" 1
1116 1 38 ALA H 1 111 TYR H 2.700 . 3.600 2.142 1.989 2.293 . 0 0 "[ . 1 .]" 1
1117 1 38 ALA H 1 111 TYR HA 4.500 . 6.000 4.378 4.287 4.473 . 0 0 "[ . 1 .]" 1
1118 1 38 ALA H 1 111 TYR QB 6.000 . 6.000 4.677 4.571 4.762 . 0 0 "[ . 1 .]" 1
1119 1 38 ALA H 1 111 TYR QD 4.400 . 6.000 4.331 4.229 4.416 . 0 0 "[ . 1 .]" 1
1120 1 38 ALA H 1 112 SER HA 4.700 . 6.000 4.089 3.773 4.239 . 0 0 "[ . 1 .]" 1
1121 1 38 ALA H 1 112 SER QB 3.900 . 5.800 3.924 3.785 4.082 . 0 0 "[ . 1 .]" 1
1122 1 38 ALA HA 1 38 ALA MB 2.000 . 2.500 2.118 2.115 2.125 . 0 0 "[ . 1 .]" 1
1123 1 38 ALA HA 1 39 PRO QD 2.100 . 2.600 1.983 1.909 2.025 . 0 0 "[ . 1 .]" 1
1124 1 38 ALA HA 1 39 PRO QG 3.000 . 3.800 3.868 3.815 3.906 0.106 10 0 "[ . 1 .]" 1
1125 1 38 ALA HA 1 110 ALA MB 2.800 . 3.800 3.085 2.965 3.357 . 0 0 "[ . 1 .]" 1
1126 1 38 ALA HA 1 111 TYR H 4.600 . 6.000 4.375 4.224 4.502 . 0 0 "[ . 1 .]" 1
1127 1 38 ALA HA 1 112 SER QB 4.000 . 6.000 4.570 4.504 4.698 . 0 0 "[ . 1 .]" 1
1128 1 38 ALA HA 1 117 TYR QD 2.900 . 4.000 3.700 3.487 4.005 0.005 2 0 "[ . 1 .]" 1
1129 1 38 ALA HA 1 117 TYR QE 2.700 . 3.600 2.223 2.041 2.455 . 0 0 "[ . 1 .]" 1
1130 1 38 ALA MB 1 39 PRO HA 4.800 . 6.000 4.522 4.326 4.621 . 0 0 "[ . 1 .]" 1
1131 1 38 ALA MB 1 39 PRO QD 2.200 . 2.500 2.185 1.884 2.503 0.003 11 0 "[ . 1 .]" 1
1132 1 38 ALA MB 1 39 PRO QG 3.000 . 4.100 3.508 3.398 3.704 . 0 0 "[ . 1 .]" 1
1133 1 38 ALA MB 1 40 LYS H 4.200 2.600 5.800 5.511 5.415 5.663 . 0 0 "[ . 1 .]" 1
1134 1 38 ALA MB 1 41 ALA H 3.000 . 4.200 3.732 3.633 3.844 . 0 0 "[ . 1 .]" 1
1135 1 38 ALA MB 1 41 ALA HA 3.200 . 4.500 4.245 4.090 4.438 . 0 0 "[ . 1 .]" 1
1136 1 38 ALA MB 1 41 ALA MB 1.900 . 2.400 2.448 2.438 2.456 0.056 11 0 "[ . 1 .]" 1
1137 1 38 ALA MB 1 81 PHE QD 3.200 . 4.500 3.108 2.914 3.246 . 0 0 "[ . 1 .]" 1
1138 1 38 ALA MB 1 81 PHE QE 2.900 . 3.900 3.914 3.791 3.948 0.048 9 0 "[ . 1 .]" 1
1139 1 38 ALA MB 1 110 ALA MB 2.300 . 2.900 2.378 2.244 2.664 . 0 0 "[ . 1 .]" 1
1140 1 38 ALA MB 1 111 TYR H 3.000 . 4.100 3.176 2.974 3.344 . 0 0 "[ . 1 .]" 1
1141 1 38 ALA MB 1 111 TYR HA 3.900 . 5.800 4.045 3.839 4.177 . 0 0 "[ . 1 .]" 1
1142 1 38 ALA MB 1 112 SER H 4.200 . 6.000 3.755 3.517 3.900 . 0 0 "[ . 1 .]" 1
1143 1 38 ALA MB 1 112 SER HA 2.600 . 3.500 3.055 2.773 3.172 . 0 0 "[ . 1 .]" 1
1144 1 38 ALA MB 1 112 SER QB 2.400 . 2.400 1.805 1.751 1.885 . 0 0 "[ . 1 .]" 1
1145 1 38 ALA MB 1 112 SER HG 2.800 . 3.800 3.638 3.139 3.815 0.015 12 0 "[ . 1 .]" 1
1146 1 38 ALA MB 1 113 ASP H 4.800 . 6.000 4.529 4.214 4.693 . 0 0 "[ . 1 .]" 1
1147 1 38 ALA MB 1 117 TYR HA 3.600 . 5.200 2.962 2.834 3.265 . 0 0 "[ . 1 .]" 1
1148 1 38 ALA MB 1 117 TYR QB 3.400 . 4.900 3.790 3.644 4.165 . 0 0 "[ . 1 .]" 1
1149 1 38 ALA MB 1 117 TYR QD 2.600 . 3.400 2.212 2.044 2.519 . 0 0 "[ . 1 .]" 1
1150 1 38 ALA MB 1 117 TYR QR 2.200 . 2.800 2.060 1.930 2.278 . 0 0 "[ . 1 .]" 1
1151 1 38 ALA MB 1 117 TYR QE 2.900 . 3.900 2.471 2.373 2.599 . 0 0 "[ . 1 .]" 1
1152 1 38 ALA MB 1 118 GLY H 3.900 . 5.800 2.635 2.242 2.750 . 0 0 "[ . 1 .]" 1
1153 1 38 ALA MB 1 119 LEU H 4.800 . 6.000 3.524 3.196 4.582 . 0 0 "[ . 1 .]" 1
1154 1 39 PRO HA 1 39 PRO QB 2.100 . 2.600 2.177 2.172 2.179 . 0 0 "[ . 1 .]" 1
1155 1 39 PRO HA 1 39 PRO QD 2.600 . 3.400 3.248 3.150 3.469 0.069 3 0 "[ . 1 .]" 1
1156 1 39 PRO HA 1 39 PRO QG 2.700 . 3.400 3.462 3.314 3.481 0.081 5 0 "[ . 1 .]" 1
1157 1 39 PRO HA 1 40 LYS H 2.100 . 2.600 2.250 2.181 2.381 . 0 0 "[ . 1 .]" 1
1158 1 39 PRO HA 1 41 ALA H 3.000 . 4.100 3.436 3.270 3.652 . 0 0 "[ . 1 .]" 1
1159 1 39 PRO QB 1 39 PRO QD 2.800 . 3.800 2.772 2.715 2.936 . 0 0 "[ . 1 .]" 1
1160 1 39 PRO QB 1 39 PRO QG 2.200 . 2.200 1.958 1.928 1.968 . 0 0 "[ . 1 .]" 1
1161 1 39 PRO QB 1 40 LYS H 2.900 . 3.900 2.931 2.724 3.069 . 0 0 "[ . 1 .]" 1
1162 1 39 PRO QB 1 40 LYS HA 3.500 . 5.100 4.433 4.277 4.530 . 0 0 "[ . 1 .]" 1
1163 1 39 PRO QB 1 40 LYS QE 4.000 . 6.000 2.873 1.994 4.075 0.006 1 0 "[ . 1 .]" 1
1164 1 39 PRO QB 1 40 LYS QG 3.300 . 4.100 3.685 2.731 3.894 . 0 0 "[ . 1 .]" 1
1165 1 39 PRO QB 1 117 TYR QR 5.400 . 6.000 4.338 4.185 4.530 . 0 0 "[ . 1 .]" 1
1166 1 39 PRO QB 1 117 TYR QE 3.300 . 4.700 4.577 4.410 4.751 0.051 2 0 "[ . 1 .]" 1
1167 1 39 PRO QB 1 118 GLY QA 4.500 . 6.000 4.257 3.785 4.403 . 0 0 "[ . 1 .]" 1
1168 1 39 PRO QB 1 119 LEU HA 2.600 . 3.400 3.433 3.414 3.448 0.048 12 0 "[ . 1 .]" 1
1169 1 39 PRO QD 1 39 PRO QG 2.200 . 2.400 1.963 1.947 1.974 . 0 0 "[ . 1 .]" 1
1170 1 39 PRO QD 1 40 LYS H 3.600 . 5.200 4.963 4.845 4.987 . 0 0 "[ . 1 .]" 1
1171 1 39 PRO QD 1 110 ALA MB 4.700 . 6.000 3.994 3.884 4.180 . 0 0 "[ . 1 .]" 1
1172 1 39 PRO QD 1 117 TYR QE 3.000 . 3.800 2.613 2.493 2.732 . 0 0 "[ . 1 .]" 1
1173 1 39 PRO QD 1 119 LEU HA 3.600 . 5.200 5.103 4.478 5.242 0.042 2 0 "[ . 1 .]" 1
1174 1 39 PRO QD 1 119 LEU QD 6.000 . 6.000 3.428 3.048 3.530 . 0 0 "[ . 1 .]" 1
1175 1 39 PRO QG 1 40 LYS H 3.200 . 4.500 4.520 4.475 4.546 0.046 14 0 "[ . 1 .]" 1
1176 1 39 PRO QG 1 117 TYR QD 4.600 . 6.000 3.625 3.381 4.080 . 0 0 "[ . 1 .]" 1
1177 1 39 PRO QG 1 117 TYR QE 3.400 . 4.500 2.836 2.690 3.033 . 0 0 "[ . 1 .]" 1
1178 1 39 PRO QG 1 119 LEU HA 2.900 . 3.900 3.473 3.288 3.925 0.025 3 0 "[ . 1 .]" 1
1179 1 39 PRO QG 1 119 LEU QD 3.300 . 4.700 2.287 1.972 2.437 0.028 9 0 "[ . 1 .]" 1
1180 1 40 LYS H 1 40 LYS HA 2.000 . 2.500 2.267 2.262 2.279 . 0 0 "[ . 1 .]" 1
1181 1 40 LYS H 1 40 LYS QB 3.000 . 3.600 3.308 3.237 3.355 . 0 0 "[ . 1 .]" 1
1182 1 40 LYS H 1 40 LYS QD 3.100 . 4.300 2.907 2.330 4.258 . 0 0 "[ . 1 .]" 1
1183 1 40 LYS H 1 40 LYS QE 5.300 . 6.000 4.059 2.695 5.095 . 0 0 "[ . 1 .]" 1
1184 1 40 LYS H 1 40 LYS QG 2.500 . 3.300 3.180 2.631 3.335 0.035 6 0 "[ . 1 .]" 1
1185 1 40 LYS H 1 41 ALA H 2.500 . 3.300 3.002 2.876 3.319 0.019 11 0 "[ . 1 .]" 1
1186 1 40 LYS HA 1 40 LYS QB 2.000 . 2.500 2.407 2.363 2.455 . 0 0 "[ . 1 .]" 1
1187 1 40 LYS HA 1 40 LYS QG 2.100 . 2.600 2.283 2.163 2.473 . 0 0 "[ . 1 .]" 1
1188 1 40 LYS HA 1 41 ALA H 2.800 . 3.800 3.405 3.322 3.546 . 0 0 "[ . 1 .]" 1
1189 1 40 LYS QB 1 40 LYS QE 4.500 . 6.000 3.555 3.369 3.753 . 0 0 "[ . 1 .]" 1
1190 1 40 LYS QB 1 40 LYS QG 2.200 . 2.800 2.021 2.013 2.066 . 0 0 "[ . 1 .]" 1
1191 1 40 LYS QB 1 41 ALA H 2.600 . 3.400 3.246 2.831 3.414 0.014 3 0 "[ . 1 .]" 1
1192 1 40 LYS QB 1 41 ALA HA 4.000 . 6.000 4.088 3.940 4.155 . 0 0 "[ . 1 .]" 1
1193 1 40 LYS QB 1 118 GLY QA 2.900 . 3.900 3.381 3.062 3.596 . 0 0 "[ . 1 .]" 1
1194 1 40 LYS QB 1 119 LEU HA 2.200 . 2.800 2.295 2.096 2.805 0.005 3 0 "[ . 1 .]" 1
1195 1 40 LYS QB 1 119 LEU QB 3.400 . 4.800 4.130 3.964 4.649 . 0 0 "[ . 1 .]" 1
1196 1 40 LYS QD 1 119 LEU HA 2.400 . 3.000 1.820 1.729 1.906 . 0 0 "[ . 1 .]" 1
1197 1 40 LYS QD 1 119 LEU QD 2.800 . 3.800 2.792 2.271 3.227 . 0 0 "[ . 1 .]" 1
1198 1 40 LYS QD 1 119 LEU HG 2.100 . 2.600 2.624 2.615 2.637 0.037 14 0 "[ . 1 .]" 1
1199 1 40 LYS QE 1 119 LEU H 4.600 . 6.000 5.281 4.592 6.010 0.010 11 0 "[ . 1 .]" 1
1200 1 40 LYS QG 1 41 ALA H 3.600 . 5.200 4.714 4.414 4.826 . 0 0 "[ . 1 .]" 1
1201 1 40 LYS QG 1 119 LEU H 3.700 . 5.400 4.965 4.431 5.214 . 0 0 "[ . 1 .]" 1
1202 1 40 LYS QG 1 119 LEU HA 2.500 . 3.300 3.053 2.754 3.326 0.026 10 0 "[ . 1 .]" 1
1203 1 41 ALA H 1 41 ALA HA 2.100 . 2.700 2.732 2.662 2.772 0.072 3 0 "[ . 1 .]" 1
1204 1 41 ALA H 1 41 ALA MB 2.100 . 2.600 2.180 2.161 2.213 . 0 0 "[ . 1 .]" 1
1205 1 41 ALA H 1 42 ARG H 3.200 . 4.500 4.551 4.527 4.571 0.071 12 0 "[ . 1 .]" 1
1206 1 41 ALA H 1 43 ILE MD 4.700 . 6.000 5.260 5.203 5.380 . 0 0 "[ . 1 .]" 1
1207 1 41 ALA H 1 112 SER HA 4.600 . 6.000 4.952 4.690 5.064 . 0 0 "[ . 1 .]" 1
1208 1 41 ALA H 1 112 SER HG 4.400 . 6.000 4.624 3.625 5.082 . 0 0 "[ . 1 .]" 1
1209 1 41 ALA H 1 113 ASP H 4.500 . 6.000 5.180 4.778 5.429 . 0 0 "[ . 1 .]" 1
1210 1 41 ALA HA 1 41 ALA MB 1.800 . 2.200 2.117 2.110 2.125 . 0 0 "[ . 1 .]" 1
1211 1 41 ALA HA 1 42 ARG H 1.800 . 2.200 2.175 2.148 2.203 0.003 12 0 "[ . 1 .]" 1
1212 1 41 ALA HA 1 42 ARG QG 2.500 . 3.300 3.304 3.281 3.313 0.013 9 0 "[ . 1 .]" 1
1213 1 41 ALA HA 1 43 ILE MD 2.900 . 4.000 3.760 3.734 3.780 . 0 0 "[ . 1 .]" 1
1214 1 41 ALA HA 1 43 ILE MD 3.700 . 5.400 3.346 3.273 3.416 . 0 0 "[ . 1 .]" 1
1215 1 41 ALA HA 1 112 SER HA 2.800 . 3.800 3.846 3.831 3.856 0.056 10 0 "[ . 1 .]" 1
1216 1 41 ALA HA 1 113 ASP H 3.500 . 5.000 2.875 2.562 3.076 . 0 0 "[ . 1 .]" 1
1217 1 41 ALA MB 1 42 ARG H 2.400 . 3.100 2.938 2.839 3.053 . 0 0 "[ . 1 .]" 1
1218 1 41 ALA MB 1 43 ILE H 2.400 . 3.100 2.677 2.627 2.740 . 0 0 "[ . 1 .]" 1
1219 1 41 ALA MB 1 43 ILE MD 2.000 . 2.500 2.346 2.277 2.427 . 0 0 "[ . 1 .]" 1
1220 1 41 ALA MB 1 43 ILE QG 2.100 . 2.600 1.864 1.811 1.923 . 0 0 "[ . 1 .]" 1
1221 1 41 ALA MB 1 111 TYR QD 3.300 . 4.600 4.218 4.158 4.299 . 0 0 "[ . 1 .]" 1
1222 1 41 ALA MB 1 111 TYR QE 3.100 . 4.200 4.251 4.214 4.285 0.085 2 0 "[ . 1 .]" 1
1223 1 41 ALA MB 1 112 SER HA 2.100 . 2.600 1.980 1.924 2.132 . 0 0 "[ . 1 .]" 1
1224 1 41 ALA MB 1 112 SER QB 3.000 . 3.800 2.576 2.058 3.201 . 0 0 "[ . 1 .]" 1
1225 1 41 ALA MB 1 112 SER HG 3.400 . 4.900 2.914 2.465 3.150 . 0 0 "[ . 1 .]" 1
1226 1 41 ALA MB 1 113 ASP H 2.300 . 3.000 2.330 2.148 2.687 . 0 0 "[ . 1 .]" 1
1227 1 41 ALA MB 1 113 ASP QB 3.800 . 5.600 3.456 3.127 3.887 . 0 0 "[ . 1 .]" 1
1228 1 41 ALA MB 1 114 GLU H 3.100 . 4.300 4.322 4.312 4.344 0.044 14 0 "[ . 1 .]" 1
1229 1 41 ALA MB 1 118 GLY QA 4.400 . 6.000 2.608 2.451 3.010 . 0 0 "[ . 1 .]" 1
1230 1 42 ARG H 1 42 ARG HA 2.300 . 2.900 2.905 2.900 2.909 0.009 14 0 "[ . 1 .]" 1
1231 1 42 ARG H 1 42 ARG QB 2.400 . 3.100 2.639 2.615 2.686 . 0 0 "[ . 1 .]" 1
1232 1 42 ARG H 1 42 ARG QD 4.500 . 6.000 3.547 3.069 4.163 . 0 0 "[ . 1 .]" 1
1233 1 42 ARG H 1 42 ARG QG 2.500 . 3.300 2.104 1.995 2.228 . 0 0 "[ . 1 .]" 1
1234 1 42 ARG H 1 43 ILE H 2.300 . 2.900 2.956 2.949 2.963 0.063 6 0 "[ . 1 .]" 1
1235 1 42 ARG H 1 43 ILE MD 3.700 . 5.400 2.876 2.810 2.943 . 0 0 "[ . 1 .]" 1
1236 1 42 ARG H 1 112 SER HG 5.700 . 6.000 3.953 3.668 4.240 . 0 0 "[ . 1 .]" 1
1237 1 42 ARG H 1 113 ASP H 3.700 . 5.400 2.948 2.719 3.158 . 0 0 "[ . 1 .]" 1
1238 1 42 ARG H 1 113 ASP QB 5.200 . 6.000 2.396 1.936 3.222 . 0 0 "[ . 1 .]" 1
1239 1 42 ARG HA 1 42 ARG QB 2.100 . 2.600 2.284 2.266 2.295 . 0 0 "[ . 1 .]" 1
1240 1 42 ARG HA 1 42 ARG QD 4.000 . 6.000 4.019 2.856 4.297 . 0 0 "[ . 1 .]" 1
1241 1 42 ARG HA 1 42 ARG QG 2.100 . 2.700 2.666 2.637 2.728 0.028 7 0 "[ . 1 .]" 1
1242 1 42 ARG HA 1 43 ILE H 2.100 . 2.700 2.771 2.765 2.777 0.077 5 0 "[ . 1 .]" 1
1243 1 42 ARG QB 1 42 ARG QD 2.900 . 3.000 2.112 2.030 2.440 . 0 0 "[ . 1 .]" 1
1244 1 42 ARG QB 1 42 ARG QG 2.100 . 2.200 2.066 2.023 2.087 . 0 0 "[ . 1 .]" 1
1245 1 42 ARG QB 1 43 ILE H 3.600 . 5.300 3.812 3.807 3.817 . 0 0 "[ . 1 .]" 1
1246 1 42 ARG QB 1 43 ILE HA 4.000 . 6.000 4.328 4.309 4.347 . 0 0 "[ . 1 .]" 1
1247 1 42 ARG QB 1 43 ILE QG 3.900 . 5.800 3.506 3.407 3.666 . 0 0 "[ . 1 .]" 1
1248 1 42 ARG QD 1 42 ARG QG 2.300 . 2.400 2.051 2.002 2.091 . 0 0 "[ . 1 .]" 1
1249 1 43 ILE H 1 43 ILE HA 2.500 . 3.300 2.947 2.942 2.954 . 0 0 "[ . 1 .]" 1
1250 1 43 ILE H 1 43 ILE HB 2.700 . 3.600 3.618 3.603 3.636 0.036 5 0 "[ . 1 .]" 1
1251 1 43 ILE H 1 43 ILE MD 2.900 . 3.900 3.675 3.645 3.700 . 0 0 "[ . 1 .]" 1
1252 1 43 ILE H 1 43 ILE MD 2.000 . 2.500 1.958 1.922 1.983 . 0 0 "[ . 1 .]" 1
1253 1 43 ILE H 1 43 ILE QG 2.600 . 2.800 1.980 1.944 2.007 . 0 0 "[ . 1 .]" 1
1254 1 43 ILE H 1 43 ILE QG 2.300 . 2.900 1.965 1.929 1.991 . 0 0 "[ . 1 .]" 1
1255 1 43 ILE H 1 44 GLY H 3.300 . 4.600 4.440 4.405 4.466 . 0 0 "[ . 1 .]" 1
1256 1 43 ILE H 1 111 TYR QE 4.600 . 6.000 5.218 5.174 5.306 . 0 0 "[ . 1 .]" 1
1257 1 43 ILE H 1 112 SER HG 4.400 . 6.000 5.895 5.487 6.005 0.005 14 0 "[ . 1 .]" 1
1258 1 43 ILE H 1 113 ASP QB 4.300 . 6.000 3.630 3.372 3.878 . 0 0 "[ . 1 .]" 1
1259 1 43 ILE HA 1 43 ILE HB 2.100 . 2.600 2.612 2.602 2.625 0.025 14 0 "[ . 1 .]" 1
1260 1 43 ILE HA 1 43 ILE MD 2.100 . 2.600 2.184 1.995 2.229 . 0 0 "[ . 1 .]" 1
1261 1 43 ILE HA 1 43 ILE QG 2.700 . 3.600 3.241 3.221 3.251 . 0 0 "[ . 1 .]" 1
1262 1 43 ILE HA 1 44 GLY H 1.900 . 2.400 2.441 2.425 2.466 0.066 14 0 "[ . 1 .]" 1
1263 1 43 ILE HA 1 44 GLY QA 3.000 . 4.200 3.921 3.910 3.929 . 0 0 "[ . 1 .]" 1
1264 1 43 ILE HA 1 70 ILE MD 5.100 . 6.000 5.126 4.922 5.229 . 0 0 "[ . 1 .]" 1
1265 1 43 ILE HA 1 72 LEU QD 3.300 . 4.700 3.767 3.350 3.975 . 0 0 "[ . 1 .]" 1
1266 1 43 ILE HA 1 111 TYR QE 5.800 . 6.000 5.224 5.147 5.292 . 0 0 "[ . 1 .]" 1
1267 1 43 ILE HA 1 113 ASP QB 4.100 . 6.000 4.003 3.855 4.105 . 0 0 "[ . 1 .]" 1
1268 1 43 ILE HB 1 43 ILE MD 2.200 . 2.800 2.320 2.290 2.352 . 0 0 "[ . 1 .]" 1
1269 1 43 ILE HB 1 43 ILE MD 1.900 . 2.400 1.867 1.852 1.872 . 0 0 "[ . 1 .]" 1
1270 1 43 ILE HB 1 43 ILE QG 2.400 . 3.100 2.359 2.343 2.369 . 0 0 "[ . 1 .]" 1
1271 1 43 ILE HB 1 43 ILE QG 2.000 . 2.500 1.968 1.953 1.977 . 0 0 "[ . 1 .]" 1
1272 1 43 ILE HB 1 44 GLY H 2.200 . 2.800 2.252 2.136 2.330 . 0 0 "[ . 1 .]" 1
1273 1 43 ILE HB 1 44 GLY QA 3.900 . 5.800 3.852 3.789 3.904 . 0 0 "[ . 1 .]" 1
1274 1 43 ILE HB 1 70 ILE MD 3.100 . 4.300 3.160 3.016 3.299 . 0 0 "[ . 1 .]" 1
1275 1 43 ILE HB 1 72 LEU QD 3.100 . 4.300 3.232 2.815 3.513 . 0 0 "[ . 1 .]" 1
1276 1 43 ILE HB 1 78 LEU QD 3.700 . 5.500 4.097 3.852 4.305 . 0 0 "[ . 1 .]" 1
1277 1 43 ILE HB 1 111 TYR QE 2.900 . 3.900 2.692 2.590 2.785 . 0 0 "[ . 1 .]" 1
1278 1 43 ILE HB 1 113 ASP HA 4.200 . 6.000 5.818 5.668 5.901 . 0 0 "[ . 1 .]" 1
1279 1 43 ILE HB 1 113 ASP QB 3.100 . 4.300 4.323 4.314 4.341 0.041 3 0 "[ . 1 .]" 1
1280 1 43 ILE MD 1 43 ILE QG 2.000 . 2.500 1.848 1.844 1.853 . 0 0 "[ . 1 .]" 1
1281 1 43 ILE MD 1 44 GLY QA 4.000 . 6.000 3.925 3.892 3.943 . 0 0 "[ . 1 .]" 1
1282 1 43 ILE MD 1 70 ILE MD 2.100 . 2.600 2.289 2.202 2.381 . 0 0 "[ . 1 .]" 1
1283 1 43 ILE MD 1 70 ILE QG 2.600 . 3.400 2.503 2.342 2.700 . 0 0 "[ . 1 .]" 1
1284 1 43 ILE MD 1 112 SER H 3.500 . 5.000 3.463 3.403 3.542 . 0 0 "[ . 1 .]" 1
1285 1 43 ILE MD 1 113 ASP HA 2.400 . 3.100 2.782 2.610 2.852 . 0 0 "[ . 1 .]" 1
1286 1 43 ILE MD 1 113 ASP QB 2.400 . 3.100 1.840 1.800 1.900 . 0 0 "[ . 1 .]" 1
1287 1 43 ILE MD 1 114 GLU H 3.900 . 5.800 4.033 3.973 4.098 . 0 0 "[ . 1 .]" 1
1288 1 43 ILE MD 1 66 ILE QG 3.200 . 4.500 4.349 4.249 4.451 . 0 0 "[ . 1 .]" 1
1289 1 43 ILE MD 1 70 ILE HB 2.900 . 4.000 4.015 3.989 4.034 0.034 3 0 "[ . 1 .]" 1
1290 1 43 ILE MD 1 78 LEU HA 2.600 . 3.500 3.510 3.501 3.529 0.029 5 0 "[ . 1 .]" 1
1291 1 43 ILE MD 1 111 TYR QB 3.600 . 5.200 3.489 3.393 3.537 . 0 0 "[ . 1 .]" 1
1292 1 43 ILE MD 1 111 TYR QD 2.000 . 2.500 1.729 1.692 1.771 . 0 0 "[ . 1 .]" 1
1293 1 43 ILE MD 1 111 TYR QE 2.100 . 2.600 1.930 1.852 2.129 . 0 0 "[ . 1 .]" 1
1294 1 43 ILE MD 1 112 SER H 3.100 . 4.300 3.544 3.482 3.627 . 0 0 "[ . 1 .]" 1
1295 1 43 ILE MD 1 112 SER HA 2.500 . 3.300 1.992 1.914 2.129 . 0 0 "[ . 1 .]" 1
1296 1 43 ILE MD 1 113 ASP H 2.800 . 3.800 2.696 2.578 2.837 . 0 0 "[ . 1 .]" 1
1297 1 43 ILE MD 1 113 ASP HA 2.500 . 3.300 3.253 3.194 3.302 0.002 12 0 "[ . 1 .]" 1
1298 1 43 ILE MD 1 113 ASP QB 2.400 . 3.100 2.999 2.917 3.077 . 0 0 "[ . 1 .]" 1
1299 1 43 ILE QG 1 44 GLY H 2.900 . 3.900 3.018 2.957 3.094 . 0 0 "[ . 1 .]" 1
1300 1 43 ILE QG 1 44 GLY QA 6.000 . 6.000 4.077 4.041 4.098 . 0 0 "[ . 1 .]" 1
1301 1 43 ILE QG 1 70 ILE MD 2.800 . 3.800 2.782 2.538 2.944 . 0 0 "[ . 1 .]" 1
1302 1 43 ILE QG 1 70 ILE QG 2.400 . 3.100 2.927 2.736 3.101 0.001 5 0 "[ . 1 .]" 1
1303 1 43 ILE QG 1 72 LEU QD 2.000 . 2.500 1.936 1.720 2.140 . 0 0 "[ . 1 .]" 1
1304 1 43 ILE QG 1 111 TYR QD 2.500 . 3.300 3.311 3.275 3.347 0.047 3 0 "[ . 1 .]" 1
1305 1 43 ILE QG 1 111 TYR QE 2.200 . 2.800 2.814 2.787 2.834 0.034 5 0 "[ . 1 .]" 1
1306 1 43 ILE QG 1 112 SER H 5.100 . 6.000 4.868 4.796 4.963 . 0 0 "[ . 1 .]" 1
1307 1 43 ILE QG 1 112 SER HA 2.600 . 3.500 2.961 2.880 3.084 . 0 0 "[ . 1 .]" 1
1308 1 43 ILE QG 1 113 ASP H 3.200 . 4.500 2.729 2.612 2.866 . 0 0 "[ . 1 .]" 1
1309 1 43 ILE QG 1 113 ASP HA 3.100 . 4.300 3.024 2.764 3.137 . 0 0 "[ . 1 .]" 1
1310 1 43 ILE QG 1 113 ASP QB 2.500 . 2.800 1.857 1.816 1.921 . 0 0 "[ . 1 .]" 1
1311 1 43 ILE QG 1 114 GLU H 4.000 . 6.000 4.661 4.530 4.785 . 0 0 "[ . 1 .]" 1
1312 1 43 ILE QG 1 44 GLY H 3.000 . 4.100 3.867 3.790 3.907 . 0 0 "[ . 1 .]" 1
1313 1 43 ILE QG 1 70 ILE MD 3.200 . 4.500 4.214 4.033 4.304 . 0 0 "[ . 1 .]" 1
1314 1 43 ILE QG 1 111 TYR QD 3.200 . 4.500 3.703 3.643 3.766 . 0 0 "[ . 1 .]" 1
1315 1 43 ILE QG 1 111 TYR QE 2.800 . 3.600 2.921 2.869 2.967 . 0 0 "[ . 1 .]" 1
1316 1 44 GLY H 1 44 GLY QA 2.000 . 2.200 2.208 2.202 2.219 0.019 15 0 "[ . 1 .]" 1
1317 1 44 GLY H 1 45 ASP HA 4.300 . 6.000 5.526 5.479 5.552 . 0 0 "[ . 1 .]" 1
1318 1 44 GLY H 1 46 LEU QD 5.000 . 6.000 6.028 6.009 6.067 0.067 14 0 "[ . 1 .]" 1
1319 1 44 GLY H 1 70 ILE HB 2.700 . 3.600 3.379 3.209 3.486 . 0 0 "[ . 1 .]" 1
1320 1 44 GLY H 1 70 ILE MD 3.200 . 4.500 4.431 4.254 4.505 0.005 11 0 "[ . 1 .]" 1
1321 1 44 GLY H 1 70 ILE QG 3.000 . 4.100 2.655 2.346 2.888 . 0 0 "[ . 1 .]" 1
1322 1 44 GLY H 1 72 LEU QD 4.700 . 5.400 3.693 3.142 3.959 . 0 0 "[ . 1 .]" 1
1323 1 44 GLY QA 1 45 ASP H . . 2.200 2.158 2.139 2.184 . 0 0 "[ . 1 .]" 1
1324 1 44 GLY QA 1 45 ASP HA 3.300 . 4.700 3.996 3.984 4.013 . 0 0 "[ . 1 .]" 1
1325 1 44 GLY QA 1 45 ASP QB 3.900 . 5.800 4.169 4.064 4.250 . 0 0 "[ . 1 .]" 1
1326 1 44 GLY QA 1 70 ILE HB 3.200 . 4.300 4.286 4.221 4.315 0.015 3 0 "[ . 1 .]" 1
1327 1 44 GLY QA 1 70 ILE QG 2.900 . 3.900 2.791 2.637 3.053 . 0 0 "[ . 1 .]" 1
1328 1 45 ASP H 1 45 ASP QB 2.000 . 2.500 2.507 2.497 2.517 0.017 6 0 "[ . 1 .]" 1
1329 1 45 ASP H 1 46 LEU H 3.400 . 4.800 4.539 4.515 4.593 . 0 0 "[ . 1 .]" 1
1330 1 45 ASP H 1 70 ILE QG 4.900 . 6.000 4.328 4.247 4.477 . 0 0 "[ . 1 .]" 1
1331 1 45 ASP HA 1 45 ASP QB 2.100 . 2.600 2.263 2.180 2.337 . 0 0 "[ . 1 .]" 1
1332 1 45 ASP HA 1 46 LEU H 2.000 . 2.500 2.154 2.136 2.213 . 0 0 "[ . 1 .]" 1
1333 1 45 ASP QB 1 46 LEU H 3.100 . 3.100 3.094 2.871 3.127 0.027 9 0 "[ . 1 .]" 1
1334 1 45 ASP QB 1 46 LEU QB 4.500 . 6.000 4.705 4.605 4.767 . 0 0 "[ . 1 .]" 1
1335 1 46 LEU H 1 46 LEU HA 2.600 . 3.500 2.900 2.883 2.925 . 0 0 "[ . 1 .]" 1
1336 1 46 LEU H 1 46 LEU QB 1.900 . 2.300 2.120 2.080 2.210 . 0 0 "[ . 1 .]" 1
1337 1 46 LEU H 1 46 LEU QD 2.700 . 3.600 3.564 3.480 3.626 0.026 14 0 "[ . 1 .]" 1
1338 1 46 LEU H 1 46 LEU HG 2.800 . 3.800 3.734 3.383 3.862 0.062 15 0 "[ . 1 .]" 1
1339 1 46 LEU H 1 47 ASP H 4.300 . 6.000 4.557 4.492 4.589 . 0 0 "[ . 1 .]" 1
1340 1 46 LEU H 1 47 ASP QB 4.700 . 6.000 5.776 5.603 6.006 0.006 15 0 "[ . 1 .]" 1
1341 1 46 LEU H 1 48 LYS H 4.400 . 6.000 5.525 5.107 5.761 . 0 0 "[ . 1 .]" 1
1342 1 46 LEU H 1 70 ILE QG 4.100 . 6.000 4.032 3.741 4.159 . 0 0 "[ . 1 .]" 1
1343 1 46 LEU H 1 111 TYR QE 3.700 . 5.400 3.700 3.524 3.917 . 0 0 "[ . 1 .]" 1
1344 1 46 LEU HA 1 46 LEU QB 2.200 . 2.800 2.528 2.501 2.536 . 0 0 "[ . 1 .]" 1
1345 1 46 LEU HA 1 46 LEU QD 2.500 . 2.800 2.453 1.820 2.732 . 0 0 "[ . 1 .]" 1
1346 1 46 LEU HA 1 46 LEU HG 3.400 . 4.900 2.345 2.132 2.965 . 0 0 "[ . 1 .]" 1
1347 1 46 LEU HA 1 47 ASP H 2.000 . 2.500 2.213 2.152 2.281 . 0 0 "[ . 1 .]" 1
1348 1 46 LEU HA 1 47 ASP QB 3.400 . 4.900 4.304 4.011 4.443 . 0 0 "[ . 1 .]" 1
1349 1 46 LEU HA 1 48 LYS H 3.200 . 4.400 3.748 3.583 3.935 . 0 0 "[ . 1 .]" 1
1350 1 46 LEU HA 1 70 ILE QG 3.100 . 4.300 4.208 3.789 4.312 0.012 13 0 "[ . 1 .]" 1
1351 1 46 LEU HA 1 111 TYR QE 4.300 . 6.000 4.870 4.728 4.989 . 0 0 "[ . 1 .]" 1
1352 1 46 LEU QB 1 46 LEU QD 2.100 . 2.500 1.865 1.798 1.931 . 0 0 "[ . 1 .]" 1
1353 1 46 LEU QB 1 47 ASP H 3.600 . 5.200 3.116 2.935 3.324 . 0 0 "[ . 1 .]" 1
1354 1 46 LEU QB 1 47 ASP HA 3.800 . 5.600 4.179 4.052 4.287 . 0 0 "[ . 1 .]" 1
1355 1 46 LEU QB 1 48 LYS H 2.400 . 3.100 2.860 2.392 3.114 0.014 15 0 "[ . 1 .]" 1
1356 1 46 LEU QB 1 49 LYS HA 3.200 . 4.500 3.962 3.816 4.071 . 0 0 "[ . 1 .]" 1
1357 1 46 LEU QB 1 70 ILE QG 2.800 . 3.800 3.694 3.440 3.819 0.019 14 0 "[ . 1 .]" 1
1358 1 46 LEU QB 1 111 TYR QE 2.500 . 3.300 2.239 2.053 2.438 . 0 0 "[ . 1 .]" 1
1359 1 46 LEU QD 1 47 ASP H 2.900 . 3.900 2.437 2.263 2.744 . 0 0 "[ . 1 .]" 1
1360 1 46 LEU QD 1 48 LYS H 2.800 . 3.800 2.345 1.939 3.040 . 0 0 "[ . 1 .]" 1
1361 1 46 LEU QD 1 48 LYS QB 3.700 . 5.400 2.295 1.975 2.783 0.025 2 0 "[ . 1 .]" 1
1362 1 46 LEU QD 1 49 LYS HA 3.100 . 3.800 3.837 3.817 3.854 0.054 4 0 "[ . 1 .]" 1
1363 1 46 LEU QD 1 51 TYR QD 3.800 . 5.100 4.401 4.317 4.486 . 0 0 "[ . 1 .]" 1
1364 1 46 LEU QD 1 66 ILE HA 3.000 . 4.100 3.465 3.284 3.737 . 0 0 "[ . 1 .]" 1
1365 1 46 LEU QD 1 66 ILE MD 2.200 . 2.800 2.733 2.541 2.810 0.010 4 0 "[ . 1 .]" 1
1366 1 46 LEU QD 1 66 ILE QG 2.000 . 2.500 2.325 2.159 2.514 0.014 1 0 "[ . 1 .]" 1
1367 1 46 LEU QD 1 69 ARG H 3.100 . 4.300 4.203 4.080 4.316 0.016 11 0 "[ . 1 .]" 1
1368 1 46 LEU QD 1 69 ARG HA 2.900 . 4.000 3.590 3.183 3.815 . 0 0 "[ . 1 .]" 1
1369 1 46 LEU QD 1 69 ARG QB 2.400 . 3.100 1.735 1.692 1.807 0.008 4 0 "[ . 1 .]" 1
1370 1 46 LEU QD 1 69 ARG QD 2.300 . 2.800 2.477 2.155 2.811 0.011 4 0 "[ . 1 .]" 1
1371 1 46 LEU QD 1 69 ARG QG 2.700 . 3.600 2.919 2.568 3.109 . 0 0 "[ . 1 .]" 1
1372 1 46 LEU QD 1 70 ILE H 3.300 . 4.100 3.948 3.738 4.107 0.007 15 0 "[ . 1 .]" 1
1373 1 46 LEU QD 1 111 TYR QD 2.800 . 3.800 3.284 3.157 3.430 . 0 0 "[ . 1 .]" 1
1374 1 46 LEU HG 1 48 LYS H 3.600 . 5.200 4.546 4.195 5.206 0.006 4 0 "[ . 1 .]" 1
1375 1 46 LEU HG 1 111 TYR QE 3.900 . 5.800 3.801 2.836 4.245 . 0 0 "[ . 1 .]" 1
1376 1 47 ASP H 1 47 ASP HA 2.400 . 3.100 2.941 2.927 2.948 . 0 0 "[ . 1 .]" 1
1377 1 47 ASP H 1 47 ASP QB 2.600 . 3.400 2.829 2.274 3.002 . 0 0 "[ . 1 .]" 1
1378 1 47 ASP H 1 48 LYS H 2.700 . 3.600 2.180 1.947 2.715 . 0 0 "[ . 1 .]" 1
1379 1 47 ASP H 1 48 LYS QB 4.600 . 6.000 3.764 3.603 3.957 . 0 0 "[ . 1 .]" 1
1380 1 47 ASP H 1 70 ILE QG 4.900 . 6.000 5.862 5.464 5.974 . 0 0 "[ . 1 .]" 1
1381 1 47 ASP HA 1 47 ASP QB 1.700 . 2.200 2.194 2.184 2.244 0.044 11 0 "[ . 1 .]" 1
1382 1 47 ASP HA 1 48 LYS H 2.800 . 3.800 3.257 2.947 3.455 . 0 0 "[ . 1 .]" 1
1383 1 47 ASP QB 1 48 LYS H 3.000 . 4.100 3.732 3.101 4.021 . 0 0 "[ . 1 .]" 1
1384 1 47 ASP QB 1 48 LYS HA 3.400 . 4.900 4.502 4.358 4.605 . 0 0 "[ . 1 .]" 1
1385 1 48 LYS H 1 48 LYS HA 2.500 . 3.300 2.906 2.829 2.947 . 0 0 "[ . 1 .]" 1
1386 1 48 LYS H 1 48 LYS QB 2.400 . 3.100 2.305 2.223 2.426 . 0 0 "[ . 1 .]" 1
1387 1 48 LYS H 1 48 LYS QD 5.000 . 6.000 4.315 4.083 4.511 . 0 0 "[ . 1 .]" 1
1388 1 48 LYS H 1 48 LYS QG 4.000 . 5.600 4.005 3.951 4.050 . 0 0 "[ . 1 .]" 1
1389 1 48 LYS H 1 69 ARG QD 5.000 . 6.000 5.207 4.676 5.999 . 0 0 "[ . 1 .]" 1
1390 1 48 LYS HA 1 48 LYS QB 2.200 . 2.800 2.341 2.316 2.412 . 0 0 "[ . 1 .]" 1
1391 1 48 LYS HA 1 48 LYS QD 3.600 . 5.200 4.078 3.955 4.173 . 0 0 "[ . 1 .]" 1
1392 1 48 LYS HA 1 48 LYS QG 2.600 . 3.400 2.535 2.389 2.611 . 0 0 "[ . 1 .]" 1
1393 1 48 LYS HA 1 49 LYS HA 4.100 . 6.000 5.076 4.432 5.360 . 0 0 "[ . 1 .]" 1
1394 1 48 LYS HA 1 50 LYS H 3.800 . 5.600 3.859 3.509 4.017 . 0 0 "[ . 1 .]" 1
1395 1 48 LYS QB 1 48 LYS QD 2.200 . 2.800 2.069 1.923 2.131 . 0 0 "[ . 1 .]" 1
1396 1 48 LYS QB 1 48 LYS QE 3.200 . 4.400 3.554 3.389 3.646 . 0 0 "[ . 1 .]" 1
1397 1 48 LYS QB 1 48 LYS QG 2.300 . 2.700 2.065 2.029 2.086 . 0 0 "[ . 1 .]" 1
1398 1 48 LYS QB 1 51 TYR QE 2.900 . 4.000 3.508 3.109 3.952 . 0 0 "[ . 1 .]" 1
1399 1 48 LYS QB 1 69 ARG QD 3.200 . 4.500 3.405 3.193 3.826 . 0 0 "[ . 1 .]" 1
1400 1 48 LYS QD 1 48 LYS QG 2.300 . 2.900 2.069 2.040 2.093 . 0 0 "[ . 1 .]" 1
1401 1 48 LYS QD 1 50 LYS H 3.500 . 5.000 4.637 4.164 5.006 0.006 11 0 "[ . 1 .]" 1
1402 1 48 LYS QD 1 51 TYR QE 2.700 . 3.600 2.663 2.518 2.832 . 0 0 "[ . 1 .]" 1
1403 1 48 LYS QD 1 69 ARG QD 3.700 . 5.400 2.405 2.291 2.736 . 0 0 "[ . 1 .]" 1
1404 1 48 LYS QD 1 69 ARG QG 3.000 . 4.100 4.119 4.109 4.134 0.034 2 0 "[ . 1 .]" 1
1405 1 48 LYS QE 1 48 LYS QG 2.500 . 3.100 2.226 1.948 2.469 . 0 0 "[ . 1 .]" 1
1406 1 48 LYS QE 1 51 TYR HA 2.700 . 3.600 3.027 2.589 3.598 . 0 0 "[ . 1 .]" 1
1407 1 48 LYS QE 1 51 TYR QD 2.700 . 3.600 3.139 2.833 3.442 . 0 0 "[ . 1 .]" 1
1408 1 48 LYS QE 1 51 TYR QE 2.800 . 3.600 3.095 2.764 3.602 0.002 7 0 "[ . 1 .]" 1
1409 1 48 LYS QG 1 50 LYS H 3.400 . 4.800 2.959 2.672 3.320 . 0 0 "[ . 1 .]" 1
1410 1 48 LYS QG 1 51 TYR QE 2.900 . 4.000 3.813 3.471 3.994 . 0 0 "[ . 1 .]" 1
1411 1 49 LYS H 1 50 LYS H 3.700 . 5.400 3.317 2.490 3.707 . 0 0 "[ . 1 .]" 1
1412 1 49 LYS HA 1 49 LYS QB 2.600 . 3.400 2.480 2.449 2.507 . 0 0 "[ . 1 .]" 1
1413 1 49 LYS HA 1 49 LYS QG 2.900 . 3.600 2.222 2.102 2.345 . 0 0 "[ . 1 .]" 1
1414 1 49 LYS HA 1 51 TYR QD 3.200 . 4.400 3.865 3.768 4.023 . 0 0 "[ . 1 .]" 1
1415 1 49 LYS HA 1 51 TYR QE 2.400 . 3.100 3.015 2.843 3.118 0.018 12 0 "[ . 1 .]" 1
1416 1 49 LYS QB 1 49 LYS QE 3.000 . 3.800 3.294 3.121 3.359 . 0 0 "[ . 1 .]" 1
1417 1 49 LYS QB 1 50 LYS H 4.200 . 4.500 2.493 2.327 2.754 . 0 0 "[ . 1 .]" 1
1418 1 49 LYS QB 1 50 LYS QB 5.100 . 6.000 3.828 3.632 4.205 . 0 0 "[ . 1 .]" 1
1419 1 49 LYS QD 1 49 LYS QE 1.900 . 2.400 1.990 1.950 2.083 . 0 0 "[ . 1 .]" 1
1420 1 49 LYS QD 1 49 LYS QG 2.200 . 2.500 2.052 2.039 2.060 . 0 0 "[ . 1 .]" 1
1421 1 49 LYS QD 1 50 LYS HA 3.700 . 5.500 5.348 5.214 5.472 . 0 0 "[ . 1 .]" 1
1422 1 49 LYS QE 1 49 LYS QG 2.800 . 3.100 2.379 2.000 2.530 . 0 0 "[ . 1 .]" 1
1423 1 49 LYS QG 1 50 LYS H 3.200 . 4.400 4.241 4.114 4.407 0.007 8 0 "[ . 1 .]" 1
1424 1 50 LYS H 1 50 LYS HA 2.600 . 3.500 2.830 2.814 2.847 . 0 0 "[ . 1 .]" 1
1425 1 50 LYS H 1 50 LYS QB 2.500 . 3.100 2.220 2.069 2.397 . 0 0 "[ . 1 .]" 1
1426 1 50 LYS H 1 50 LYS QG 3.700 . 5.400 3.707 2.477 4.037 . 0 0 "[ . 1 .]" 1
1427 1 50 LYS H 1 51 TYR H 3.700 . 5.400 4.607 4.589 4.624 . 0 0 "[ . 1 .]" 1
1428 1 50 LYS H 1 51 TYR QE 4.100 . 6.000 4.779 4.599 4.999 . 0 0 "[ . 1 .]" 1
1429 1 50 LYS HA 1 50 LYS QB 2.300 . 2.700 2.427 2.355 2.527 . 0 0 "[ . 1 .]" 1
1430 1 50 LYS HA 1 50 LYS QB 2.100 . 2.600 2.127 1.999 2.196 . 0 0 "[ . 1 .]" 1
1431 1 50 LYS HA 1 50 LYS QD 3.800 . 5.600 3.099 2.627 4.095 . 0 0 "[ . 1 .]" 1
1432 1 50 LYS HA 1 50 LYS QE 3.300 . 4.600 3.692 2.253 4.476 . 0 0 "[ . 1 .]" 1
1433 1 50 LYS HA 1 50 LYS QG 2.600 . 3.400 2.376 2.097 2.625 . 0 0 "[ . 1 .]" 1
1434 1 50 LYS HA 1 51 TYR H 2.100 . 2.600 2.202 2.172 2.259 . 0 0 "[ . 1 .]" 1
1435 1 50 LYS HA 1 51 TYR QD 2.700 . 3.600 3.628 3.616 3.642 0.042 14 0 "[ . 1 .]" 1
1436 1 50 LYS HA 1 51 TYR QE 4.100 . 6.000 5.244 5.156 5.308 . 0 0 "[ . 1 .]" 1
1437 1 50 LYS QB 1 50 LYS QD 2.300 . 3.000 2.239 2.025 2.521 . 0 0 "[ . 1 .]" 1
1438 1 50 LYS QB 1 50 LYS QE 2.200 . 2.800 2.316 1.968 2.782 . 0 0 "[ . 1 .]" 1
1439 1 50 LYS QB 1 50 LYS QE 2.100 . 2.700 2.070 1.887 2.324 . 0 0 "[ . 1 .]" 1
1440 1 50 LYS QB 1 50 LYS QG 2.300 . 2.900 2.027 2.020 2.085 . 0 0 "[ . 1 .]" 1
1441 1 50 LYS QB 1 106 PHE QE 2.900 . 4.000 3.470 2.352 3.882 . 0 0 "[ . 1 .]" 1
1442 1 50 LYS QB 1 51 TYR H 3.300 . 4.600 3.383 2.858 3.629 . 0 0 "[ . 1 .]" 1
1443 1 50 LYS QB 1 52 LEU H 5.300 . 6.000 5.219 4.713 5.674 . 0 0 "[ . 1 .]" 1
1444 1 50 LYS QB 1 106 PHE HZ 3.900 . 5.800 5.179 4.585 5.593 . 0 0 "[ . 1 .]" 1
1445 1 50 LYS QD 1 50 LYS QE 1.800 . 2.200 2.023 1.977 2.078 . 0 0 "[ . 1 .]" 1
1446 1 50 LYS QD 1 50 LYS QG 2.200 . 2.800 2.018 1.985 2.031 . 0 0 "[ . 1 .]" 1
1447 1 50 LYS QD 1 51 TYR H 4.300 . 6.000 3.786 3.298 4.863 . 0 0 "[ . 1 .]" 1
1448 1 50 LYS QD 1 106 PHE QE 2.400 . 3.100 2.420 1.945 3.125 0.025 6 0 "[ . 1 .]" 1
1449 1 50 LYS QD 1 106 PHE HZ 3.500 . 4.800 2.599 2.120 3.380 . 0 0 "[ . 1 .]" 1
1450 1 50 LYS QE 1 50 LYS QG 2.400 . 3.000 2.442 2.172 2.830 . 0 0 "[ . 1 .]" 1
1451 1 50 LYS QE 1 106 PHE QE 2.700 . 3.600 2.541 1.921 3.393 . 0 0 "[ . 1 .]" 1
1452 1 50 LYS QE 1 106 PHE HZ 2.700 . 3.600 2.459 1.986 3.603 0.003 14 0 "[ . 1 .]" 1
1453 1 50 LYS QG 1 51 TYR H 3.100 . 4.300 2.596 1.993 4.166 0.007 5 0 "[ . 1 .]" 1
1454 1 50 LYS QG 1 51 TYR HA 4.300 . 6.000 4.292 3.485 5.849 . 0 0 "[ . 1 .]" 1
1455 1 50 LYS QG 1 52 LEU QD 4.100 . 6.000 4.100 3.308 5.760 . 0 0 "[ . 1 .]" 1
1456 1 50 LYS QG 1 106 PHE QE 3.300 . 4.100 3.761 2.370 4.114 0.014 11 0 "[ . 1 .]" 1
1457 1 50 LYS QG 1 106 PHE HZ 3.400 . 4.800 4.203 3.519 4.812 0.012 6 0 "[ . 1 .]" 1
1458 1 51 TYR H 1 51 TYR HA 2.900 . 4.000 2.902 2.889 2.912 . 0 0 "[ . 1 .]" 1
1459 1 51 TYR H 1 51 TYR QB 2.600 . 3.400 2.741 2.697 2.775 . 0 0 "[ . 1 .]" 1
1460 1 51 TYR H 1 51 TYR QD 2.900 . 3.900 3.462 3.382 3.595 . 0 0 "[ . 1 .]" 1
1461 1 51 TYR H 1 51 TYR QE 4.300 . 6.000 5.484 5.395 5.610 . 0 0 "[ . 1 .]" 1
1462 1 51 TYR H 1 52 LEU H 6.000 . 6.000 4.029 3.936 4.115 . 0 0 "[ . 1 .]" 1
1463 1 51 TYR HA 1 51 TYR QB 2.200 . 2.800 2.438 2.423 2.454 . 0 0 "[ . 1 .]" 1
1464 1 51 TYR HA 1 51 TYR QD 2.300 . 3.000 2.922 2.891 2.962 . 0 0 "[ . 1 .]" 1
1465 1 51 TYR HA 1 51 TYR QE 3.400 . 4.800 4.548 4.523 4.575 . 0 0 "[ . 1 .]" 1
1466 1 51 TYR HA 1 52 LEU H 1.900 . 2.400 2.145 2.136 2.164 . 0 0 "[ . 1 .]" 1
1467 1 51 TYR HA 1 52 LEU QB 4.500 . 6.000 4.049 4.033 4.086 . 0 0 "[ . 1 .]" 1
1468 1 51 TYR QB 1 51 TYR QD 2.000 . 2.500 2.125 2.121 2.129 . 0 0 "[ . 1 .]" 1
1469 1 51 TYR QB 1 51 TYR QE 3.100 . 4.300 3.926 3.923 3.929 . 0 0 "[ . 1 .]" 1
1470 1 51 TYR QB 1 52 LEU H 2.900 . 3.900 3.375 3.277 3.471 . 0 0 "[ . 1 .]" 1
1471 1 51 TYR QB 1 53 VAL QG 2.600 . 3.500 2.299 2.166 2.375 . 0 0 "[ . 1 .]" 1
1472 1 51 TYR QB 1 62 PHE QE 3.700 . 4.600 2.537 2.385 2.715 . 0 0 "[ . 1 .]" 1
1473 1 51 TYR QB 1 62 PHE HZ 3.400 . 4.800 2.758 2.556 3.039 . 0 0 "[ . 1 .]" 1
1474 1 51 TYR QD 1 52 LEU H 3.900 . 5.800 4.097 4.055 4.138 . 0 0 "[ . 1 .]" 1
1475 1 51 TYR QD 1 53 VAL QG 2.600 . 3.400 3.372 3.291 3.417 0.017 7 0 "[ . 1 .]" 1
1476 1 51 TYR QD 1 62 PHE QE 3.900 . 5.800 3.345 2.941 3.639 . 0 0 "[ . 1 .]" 1
1477 1 51 TYR QD 1 62 PHE HZ 3.000 . 4.100 3.680 3.497 3.811 . 0 0 "[ . 1 .]" 1
1478 1 51 TYR QD 1 65 LEU QD 2.700 . 3.600 2.538 2.310 2.735 . 0 0 "[ . 1 .]" 1
1479 1 51 TYR QD 1 66 ILE MD 3.000 . 4.100 3.149 2.954 3.353 . 0 0 "[ . 1 .]" 1
1480 1 51 TYR QE 1 52 LEU H 5.600 . 6.000 6.024 6.005 6.033 0.033 9 0 "[ . 1 .]" 1
1481 1 51 TYR QE 1 65 LEU QD 2.300 . 3.000 2.113 1.872 2.326 . 0 0 "[ . 1 .]" 1
1482 1 51 TYR QE 1 66 ILE MD 2.300 . 3.000 2.502 2.290 2.682 . 0 0 "[ . 1 .]" 1
1483 1 51 TYR QE 1 69 ARG QD 2.300 . 2.700 2.126 1.933 2.520 . 0 0 "[ . 1 .]" 1
1484 1 51 TYR QE 1 69 ARG QG 5.000 . 6.000 2.799 2.576 2.946 . 0 0 "[ . 1 .]" 1
1485 1 52 LEU H 1 52 LEU QB 2.700 . 3.600 2.308 2.243 2.355 . 0 0 "[ . 1 .]" 1
1486 1 52 LEU H 1 52 LEU QD 3.600 . 5.200 3.486 3.379 3.564 . 0 0 "[ . 1 .]" 1
1487 1 52 LEU H 1 52 LEU HG 4.600 . 6.000 4.676 4.650 4.712 . 0 0 "[ . 1 .]" 1
1488 1 52 LEU H 1 53 VAL H 4.100 . 6.000 3.735 3.614 3.863 . 0 0 "[ . 1 .]" 1
1489 1 52 LEU H 1 53 VAL QG 5.100 . 6.000 3.837 3.670 3.917 . 0 0 "[ . 1 .]" 1
1490 1 52 LEU HA 1 52 LEU QB 2.400 . 3.100 2.507 2.491 2.529 . 0 0 "[ . 1 .]" 1
1491 1 52 LEU HA 1 52 LEU QD 2.100 . 2.700 1.942 1.889 2.017 . 0 0 "[ . 1 .]" 1
1492 1 52 LEU HA 1 52 LEU HG 2.700 . 3.600 2.824 2.748 2.880 . 0 0 "[ . 1 .]" 1
1493 1 52 LEU HA 1 53 VAL H 2.100 . 2.600 2.341 2.278 2.394 . 0 0 "[ . 1 .]" 1
1494 1 52 LEU QB 1 52 LEU QD 2.200 . 2.500 1.933 1.916 1.943 . 0 0 "[ . 1 .]" 1
1495 1 52 LEU QB 1 52 LEU HG 2.100 . 2.700 2.331 2.308 2.361 . 0 0 "[ . 1 .]" 1
1496 1 52 LEU QB 1 53 VAL H 3.100 . 4.200 3.966 3.949 3.977 . 0 0 "[ . 1 .]" 1
1497 1 52 LEU QD 1 52 LEU HG 2.200 . 2.200 1.861 1.857 1.868 . 0 0 "[ . 1 .]" 1
1498 1 52 LEU QD 1 53 VAL H 2.800 . 3.800 3.787 3.694 3.813 0.013 5 0 "[ . 1 .]" 1
1499 1 52 LEU HG 1 53 VAL H 3.500 . 5.000 4.445 4.227 4.559 . 0 0 "[ . 1 .]" 1
1500 1 53 VAL H 1 53 VAL HB 2.700 . 3.600 3.501 3.421 3.588 . 0 0 "[ . 1 .]" 1
1501 1 53 VAL H 1 53 VAL QG 2.200 . 2.800 1.842 1.796 1.872 0.004 5 0 "[ . 1 .]" 1
1502 1 53 VAL H 1 54 PRO QD 6.000 . 6.000 4.403 4.395 4.411 . 0 0 "[ . 1 .]" 1
1503 1 53 VAL HA 1 53 VAL HB 2.400 . 3.100 2.694 2.563 2.770 . 0 0 "[ . 1 .]" 1
1504 1 53 VAL HA 1 53 VAL QG 2.400 . 3.100 2.065 1.987 2.121 . 0 0 "[ . 1 .]" 1
1505 1 53 VAL HA 1 54 PRO QD 2.100 . 2.700 1.943 1.907 1.971 . 0 0 "[ . 1 .]" 1
1506 1 53 VAL HA 1 54 PRO QG 3.100 . 4.300 3.832 3.795 3.863 . 0 0 "[ . 1 .]" 1
1507 1 53 VAL HA 1 57 LEU QD 3.300 . 4.600 3.679 3.572 3.794 . 0 0 "[ . 1 .]" 1
1508 1 53 VAL HA 1 65 LEU QD 4.700 . 6.000 4.396 4.258 4.628 . 0 0 "[ . 1 .]" 1
1509 1 53 VAL HB 1 53 VAL QG 2.100 . 2.500 1.886 1.870 1.896 . 0 0 "[ . 1 .]" 1
1510 1 53 VAL HB 1 54 PRO QD 2.000 . 2.500 2.429 2.266 2.513 0.013 6 0 "[ . 1 .]" 1
1511 1 53 VAL HB 1 57 LEU H 4.800 . 6.000 4.999 4.962 5.047 . 0 0 "[ . 1 .]" 1
1512 1 53 VAL HB 1 57 LEU QB 2.500 . 3.300 2.990 2.936 3.035 . 0 0 "[ . 1 .]" 1
1513 1 53 VAL HB 1 57 LEU QD 2.500 . 3.300 2.050 1.902 2.447 . 0 0 "[ . 1 .]" 1
1514 1 53 VAL HB 1 62 PHE QD 3.600 . 5.200 3.975 3.839 4.177 . 0 0 "[ . 1 .]" 1
1515 1 53 VAL HB 1 93 MET QB 2.900 . 4.000 3.371 3.234 3.546 . 0 0 "[ . 1 .]" 1
1516 1 53 VAL QG 1 54 PRO QD 2.800 . 3.100 2.326 2.007 2.734 . 0 0 "[ . 1 .]" 1
1517 1 53 VAL QG 1 57 LEU QB 3.700 . 5.400 3.264 3.076 3.414 . 0 0 "[ . 1 .]" 1
1518 1 53 VAL QG 1 57 LEU QB 2.100 . 2.600 1.857 1.819 1.892 . 0 0 "[ . 1 .]" 1
1519 1 53 VAL QG 1 57 LEU QD 2.600 . 3.300 1.816 1.787 2.071 0.013 7 0 "[ . 1 .]" 1
1520 1 53 VAL QG 1 62 PHE HA 4.000 . 6.000 3.332 3.224 3.533 . 0 0 "[ . 1 .]" 1
1521 1 53 VAL QG 1 62 PHE QD 3.500 . 4.100 2.005 1.978 2.089 0.022 13 0 "[ . 1 .]" 1
1522 1 53 VAL QG 1 62 PHE QE 2.900 . 3.100 1.971 1.876 2.132 0.024 5 0 "[ . 1 .]" 1
1523 1 53 VAL QG 1 62 PHE HZ 3.800 . 5.600 3.166 3.068 3.255 . 0 0 "[ . 1 .]" 1
1524 1 53 VAL QG 1 93 MET H 3.800 . 5.600 5.208 4.985 5.338 . 0 0 "[ . 1 .]" 1
1525 1 53 VAL QG 1 93 MET HA 3.700 . 5.400 4.762 4.430 4.912 . 0 0 "[ . 1 .]" 1
1526 1 53 VAL QG 1 93 MET QB 3.200 . 4.500 2.947 2.366 3.178 . 0 0 "[ . 1 .]" 1
1527 1 53 VAL QG 1 93 MET QG 2.300 . 2.900 2.675 2.201 2.948 0.048 11 0 "[ . 1 .]" 1
1528 1 54 PRO HA 1 54 PRO QB 2.300 . 2.900 2.221 2.212 2.229 . 0 0 "[ . 1 .]" 1
1529 1 54 PRO HA 1 54 PRO QD 4.600 . 6.000 3.394 3.367 3.429 . 0 0 "[ . 1 .]" 1
1530 1 54 PRO HA 1 54 PRO QG 2.500 . 3.300 2.934 2.898 2.983 . 0 0 "[ . 1 .]" 1
1531 1 54 PRO HA 1 55 SER H 2.100 . 2.600 2.621 2.603 2.632 0.032 12 0 "[ . 1 .]" 1
1532 1 54 PRO HA 1 55 SER HA 4.600 . 6.000 4.408 4.401 4.415 . 0 0 "[ . 1 .]" 1
1533 1 54 PRO HA 1 57 LEU H 4.600 . 6.000 4.828 4.791 4.853 . 0 0 "[ . 1 .]" 1
1534 1 54 PRO QB 1 54 PRO QD 3.200 . 3.900 2.759 2.750 2.770 . 0 0 "[ . 1 .]" 1
1535 1 54 PRO QB 1 55 SER H 3.300 . 3.600 2.262 2.223 2.315 . 0 0 "[ . 1 .]" 1
1536 1 54 PRO QB 1 56 ASP H 2.600 . 3.500 2.399 2.305 2.504 . 0 0 "[ . 1 .]" 1
1537 1 54 PRO QB 1 56 ASP QB 3.600 . 5.200 3.574 3.436 4.287 . 0 0 "[ . 1 .]" 1
1538 1 54 PRO QB 1 57 LEU H . . 2.300 2.295 2.218 2.309 0.009 6 0 "[ . 1 .]" 1
1539 1 54 PRO QB 1 57 LEU QB 2.400 . 3.100 2.443 2.261 2.544 . 0 0 "[ . 1 .]" 1
1540 1 54 PRO QB 1 57 LEU QD 3.500 . 4.000 3.578 3.396 3.683 . 0 0 "[ . 1 .]" 1
1541 1 54 PRO QD 1 54 PRO QG 2.600 . 3.000 1.969 1.967 1.972 . 0 0 "[ . 1 .]" 1
1542 1 54 PRO QD 1 55 SER H 4.300 . 6.000 4.731 4.671 4.798 . 0 0 "[ . 1 .]" 1
1543 1 54 PRO QD 1 57 LEU H 4.900 . 6.000 4.078 3.910 4.219 . 0 0 "[ . 1 .]" 1
1544 1 54 PRO QD 1 57 LEU QB . . 3.900 2.239 2.094 2.350 . 0 0 "[ . 1 .]" 1
1545 1 54 PRO QD 1 57 LEU QD 2.600 . 2.700 2.279 2.141 2.390 . 0 0 "[ . 1 .]" 1
1546 1 54 PRO QG 1 55 SER H 3.600 . 5.300 4.126 4.093 4.163 . 0 0 "[ . 1 .]" 1
1547 1 54 PRO QG 1 56 ASP H 4.400 . 6.000 4.364 4.277 4.461 . 0 0 "[ . 1 .]" 1
1548 1 54 PRO QG 1 57 LEU H 4.500 . 6.000 3.977 3.835 4.074 . 0 0 "[ . 1 .]" 1
1549 1 54 PRO QG 1 57 LEU HA 5.000 . 6.000 4.383 4.246 4.484 . 0 0 "[ . 1 .]" 1
1550 1 54 PRO QG 1 57 LEU QB 3.400 . 4.900 2.700 2.483 2.799 . 0 0 "[ . 1 .]" 1
1551 1 54 PRO QG 1 57 LEU QD 3.200 . 4.500 2.915 2.636 3.081 . 0 0 "[ . 1 .]" 1
1552 1 55 SER H 1 55 SER HA 2.500 . 3.300 2.944 2.940 2.947 . 0 0 "[ . 1 .]" 1
1553 1 55 SER H 1 55 SER HA 2.100 . 2.600 2.385 2.236 2.584 . 0 0 "[ . 1 .]" 1
1554 1 55 SER H 1 55 SER QB 2.500 . 3.300 2.538 2.317 2.864 . 0 0 "[ . 1 .]" 1
1555 1 55 SER H 1 56 ASP H 2.300 . 2.900 2.001 1.972 2.020 . 0 0 "[ . 1 .]" 1
1556 1 55 SER H 1 57 LEU H 3.800 . 5.600 3.462 3.443 3.482 . 0 0 "[ . 1 .]" 1
1557 1 55 SER H 1 57 LEU HA 4.800 . 6.000 6.045 6.036 6.051 0.051 3 0 "[ . 1 .]" 1
1558 1 55 SER HA 1 56 ASP H 2.500 . 3.300 3.045 2.934 3.154 . 0 0 "[ . 1 .]" 1
1559 1 55 SER HA 1 56 ASP QB 5.000 . 6.000 4.318 3.825 4.783 . 0 0 "[ . 1 .]" 1
1560 1 55 SER HA 1 56 ASP H 3.400 . 4.900 3.389 3.350 3.428 . 0 0 "[ . 1 .]" 1
1561 1 55 SER HA 1 56 ASP QB 6.000 . 6.000 5.261 5.060 5.473 . 0 0 "[ . 1 .]" 1
1562 1 55 SER HA 1 57 LEU H 3.700 . 5.400 3.779 3.740 3.838 . 0 0 "[ . 1 .]" 1
1563 1 55 SER HA 1 57 LEU QB 5.300 . 6.000 4.466 4.391 4.588 . 0 0 "[ . 1 .]" 1
1564 1 55 SER HA 1 93 MET H 3.400 . 4.800 4.667 4.533 4.805 0.005 9 0 "[ . 1 .]" 1
1565 1 55 SER HA 1 93 MET QB 2.800 . 3.500 2.989 2.918 3.052 . 0 0 "[ . 1 .]" 1
1566 1 55 SER HA 1 93 MET QG 3.400 . 4.800 4.836 4.802 4.879 0.079 5 0 "[ . 1 .]" 1
1567 1 55 SER HA 1 94 GLY H 2.400 . 3.100 2.520 2.209 2.855 . 0 0 "[ . 1 .]" 1
1568 1 55 SER HA 1 94 GLY QA 2.500 . 3.300 2.451 2.342 2.678 . 0 0 "[ . 1 .]" 1
1569 1 55 SER QB 1 56 ASP H 3.900 . 5.200 3.475 3.215 3.748 . 0 0 "[ . 1 .]" 1
1570 1 55 SER QB 1 94 GLY H 2.800 . 3.800 3.739 3.487 3.839 0.039 2 0 "[ . 1 .]" 1
1571 1 55 SER QB 1 94 GLY QA 2.400 . 3.100 2.345 1.897 2.697 0.003 6 0 "[ . 1 .]" 1
1572 1 55 SER QB 1 95 GLN H 4.800 . 5.400 4.971 4.504 5.275 . 0 0 "[ . 1 .]" 1
1573 1 55 SER HG 1 95 GLN H 4.100 . 6.000 5.646 4.751 6.008 0.008 10 0 "[ . 1 .]" 1
1574 1 56 ASP H 1 56 ASP HA 2.400 . 3.100 2.928 2.920 2.937 . 0 0 "[ . 1 .]" 1
1575 1 56 ASP H 1 56 ASP QB 2.300 . 3.000 2.395 2.235 2.837 . 0 0 "[ . 1 .]" 1
1576 1 56 ASP H 1 57 LEU H 2.000 . 2.500 2.122 2.041 2.194 . 0 0 "[ . 1 .]" 1
1577 1 56 ASP H 1 57 LEU HA 4.300 . 6.000 4.566 4.485 4.648 . 0 0 "[ . 1 .]" 1
1578 1 56 ASP H 1 57 LEU QB 4.400 . 6.000 3.854 3.754 3.929 . 0 0 "[ . 1 .]" 1
1579 1 56 ASP H 1 61 GLN HE22 4.400 . 6.000 6.037 6.031 6.040 0.040 10 0 "[ . 1 .]" 1
1580 1 56 ASP H 1 92 THR HG1 4.800 . 6.000 4.649 4.456 5.001 . 0 0 "[ . 1 .]" 1
1581 1 56 ASP H 1 94 GLY H 4.800 . 6.000 4.406 4.199 4.705 . 0 0 "[ . 1 .]" 1
1582 1 56 ASP HA 1 56 ASP QB 2.000 . 2.500 2.432 2.189 2.502 0.002 7 0 "[ . 1 .]" 1
1583 1 56 ASP HA 1 57 LEU H 2.900 . 3.900 3.329 3.308 3.348 . 0 0 "[ . 1 .]" 1
1584 1 56 ASP HA 1 92 THR HB 2.500 . 3.300 2.346 2.124 2.685 . 0 0 "[ . 1 .]" 1
1585 1 56 ASP HA 1 92 THR HG1 2.200 . 2.800 2.534 2.221 2.797 . 0 0 "[ . 1 .]" 1
1586 1 56 ASP HA 1 93 MET H 3.700 . 5.400 4.699 4.491 5.059 . 0 0 "[ . 1 .]" 1
1587 1 56 ASP HA 1 94 GLY H 4.200 . 6.000 3.959 3.821 4.193 . 0 0 "[ . 1 .]" 1
1588 1 56 ASP QB 1 57 LEU H 6.000 . 6.000 3.300 3.214 3.787 . 0 0 "[ . 1 .]" 1
1589 1 56 ASP QB 1 57 LEU HA 4.700 . 6.000 4.078 4.003 4.502 . 0 0 "[ . 1 .]" 1
1590 1 56 ASP QB 1 92 THR HA 3.200 . 4.500 4.151 3.910 4.364 . 0 0 "[ . 1 .]" 1
1591 1 56 ASP QB 1 92 THR HG1 2.900 . 4.000 3.681 3.039 4.002 0.002 15 0 "[ . 1 .]" 1
1592 1 57 LEU H 1 57 LEU HA 2.400 . 3.100 2.782 2.765 2.789 . 0 0 "[ . 1 .]" 1
1593 1 57 LEU H 1 57 LEU QB 2.000 . 2.500 2.233 2.214 2.248 . 0 0 "[ . 1 .]" 1
1594 1 57 LEU H 1 57 LEU QD 3.000 . 4.000 3.676 3.603 3.697 . 0 0 "[ . 1 .]" 1
1595 1 57 LEU H 1 58 THR H 3.800 . 5.700 4.400 4.316 4.478 . 0 0 "[ . 1 .]" 1
1596 1 57 LEU H 1 58 THR HG1 4.000 . 6.000 5.216 5.123 5.445 . 0 0 "[ . 1 .]" 1
1597 1 57 LEU H 1 92 THR HA 4.100 . 6.000 5.010 4.822 5.188 . 0 0 "[ . 1 .]" 1
1598 1 57 LEU H 1 92 THR HG1 3.700 . 5.400 4.391 3.995 4.580 . 0 0 "[ . 1 .]" 1
1599 1 57 LEU H 1 93 MET H 3.700 . 5.400 3.837 3.692 4.120 . 0 0 "[ . 1 .]" 1
1600 1 57 LEU H 1 93 MET QB 3.600 . 5.200 3.310 3.134 3.508 . 0 0 "[ . 1 .]" 1
1601 1 57 LEU H 1 93 MET QG 4.400 . 6.000 4.045 3.955 4.125 . 0 0 "[ . 1 .]" 1
1602 1 57 LEU H 1 94 GLY H 4.400 . 6.000 4.029 3.860 4.261 . 0 0 "[ . 1 .]" 1
1603 1 57 LEU HA 1 57 LEU QB 2.400 . 3.000 2.361 2.347 2.403 . 0 0 "[ . 1 .]" 1
1604 1 57 LEU HA 1 57 LEU QD 2.000 . 2.400 2.364 2.194 2.440 0.040 8 0 "[ . 1 .]" 1
1605 1 57 LEU HA 1 57 LEU HG 2.100 . 2.700 2.735 2.704 2.758 0.058 4 0 "[ . 1 .]" 1
1606 1 57 LEU HA 1 58 THR H 1.800 . 2.200 2.145 2.136 2.162 . 0 0 "[ . 1 .]" 1
1607 1 57 LEU HA 1 58 THR HG1 2.800 . 3.800 3.676 3.606 3.827 0.027 8 0 "[ . 1 .]" 1
1608 1 57 LEU HA 1 61 GLN HE22 5.000 . 6.000 2.030 1.957 2.219 . 0 0 "[ . 1 .]" 1
1609 1 57 LEU HA 1 92 THR HG1 4.800 . 6.000 4.625 3.977 4.816 . 0 0 "[ . 1 .]" 1
1610 1 57 LEU QB 1 57 LEU QD 2.100 . 2.600 1.868 1.830 1.901 . 0 0 "[ . 1 .]" 1
1611 1 57 LEU QB 1 57 LEU HG 2.500 . 3.300 2.481 2.451 2.496 . 0 0 "[ . 1 .]" 1
1612 1 57 LEU QB 1 58 THR H 3.800 . 5.400 3.880 3.836 3.924 . 0 0 "[ . 1 .]" 1
1613 1 57 LEU QB 1 61 GLN HE21 4.500 . 6.000 3.379 3.296 3.665 . 0 0 "[ . 1 .]" 1
1614 1 57 LEU QB 1 61 GLN HE22 5.300 . 6.000 3.711 3.631 3.875 . 0 0 "[ . 1 .]" 1
1615 1 57 LEU QB 1 93 MET H 4.900 . 6.000 3.272 3.190 3.376 . 0 0 "[ . 1 .]" 1
1616 1 57 LEU QB 1 93 MET QG 3.000 . 3.100 2.007 1.900 2.209 0.000 11 0 "[ . 1 .]" 1
1617 1 57 LEU QD 1 57 LEU HG 1.800 . 2.200 1.879 1.871 1.889 . 0 0 "[ . 1 .]" 1
1618 1 57 LEU QD 1 58 THR H 2.600 . 3.400 3.435 3.416 3.447 0.047 7 0 "[ . 1 .]" 1
1619 1 57 LEU QD 1 61 GLN H 3.500 . 5.000 4.028 3.981 4.120 . 0 0 "[ . 1 .]" 1
1620 1 57 LEU QD 1 61 GLN HA 2.800 . 3.800 3.831 3.810 3.863 0.063 10 0 "[ . 1 .]" 1
1621 1 57 LEU QD 1 61 GLN QB 2.200 . 2.600 1.788 1.776 1.799 0.024 10 0 "[ . 1 .]" 1
1622 1 57 LEU QD 1 61 GLN HE22 4.300 . 6.000 2.272 2.039 2.473 . 0 0 "[ . 1 .]" 1
1623 1 57 LEU QD 1 61 GLN QG 2.600 . 3.400 3.353 3.166 3.404 0.004 12 0 "[ . 1 .]" 1
1624 1 57 LEU QD 1 62 PHE H 2.800 . 3.600 2.745 2.674 2.865 . 0 0 "[ . 1 .]" 1
1625 1 57 LEU QD 1 62 PHE HA 2.400 . 3.100 2.189 1.993 2.301 . 0 0 "[ . 1 .]" 1
1626 1 57 LEU QD 1 62 PHE QB 2.700 . 3.100 2.052 1.912 2.625 . 0 0 "[ . 1 .]" 1
1627 1 57 LEU QD 1 62 PHE QE 3.300 . 4.600 3.696 3.582 3.939 . 0 0 "[ . 1 .]" 1
1628 1 57 LEU QD 1 92 THR HA 3.800 . 5.600 5.193 5.074 5.376 . 0 0 "[ . 1 .]" 1
1629 1 57 LEU QD 1 93 MET H 4.600 . 6.000 4.059 3.926 4.289 . 0 0 "[ . 1 .]" 1
1630 1 57 LEU QD 1 93 MET QB 3.400 . 4.900 3.263 3.155 3.463 . 0 0 "[ . 1 .]" 1
1631 1 57 LEU QD 1 93 MET QG 2.500 . 3.300 1.855 1.789 2.079 0.011 9 0 "[ . 1 .]" 1
1632 1 57 LEU HG 1 58 THR H 2.500 . 3.300 3.116 2.915 3.302 0.002 3 0 "[ . 1 .]" 1
1633 1 57 LEU HG 1 61 GLN H 3.500 . 5.000 3.912 3.858 3.967 . 0 0 "[ . 1 .]" 1
1634 1 57 LEU HG 1 61 GLN HA 3.700 . 5.400 4.796 4.658 4.846 . 0 0 "[ . 1 .]" 1
1635 1 57 LEU HG 1 61 GLN QB 2.600 . 3.400 1.921 1.798 1.996 0.002 14 0 "[ . 1 .]" 1
1636 1 57 LEU HG 1 62 PHE H 3.600 . 5.200 2.860 2.708 3.049 . 0 0 "[ . 1 .]" 1
1637 1 57 LEU HG 1 62 PHE QB 3.700 . 5.400 3.392 3.228 3.666 . 0 0 "[ . 1 .]" 1
1638 1 58 THR H 1 58 THR HA 2.800 . 3.700 2.841 2.813 2.883 . 0 0 "[ . 1 .]" 1
1639 1 58 THR H 1 58 THR HG1 2.100 . 2.600 2.025 1.874 2.421 . 0 0 "[ . 1 .]" 1
1640 1 58 THR H 1 59 VAL H 5.100 . 6.000 4.599 4.577 4.606 . 0 0 "[ . 1 .]" 1
1641 1 58 THR H 1 59 VAL HA 6.000 . 6.000 5.731 5.659 5.789 . 0 0 "[ . 1 .]" 1
1642 1 58 THR H 1 61 GLN H 3.300 . 4.600 4.001 3.801 4.105 . 0 0 "[ . 1 .]" 1
1643 1 58 THR H 1 61 GLN QB 2.500 . 3.300 3.053 2.903 3.197 . 0 0 "[ . 1 .]" 1
1644 1 58 THR H 1 61 GLN HE22 5.000 . 6.000 2.682 2.600 2.924 . 0 0 "[ . 1 .]" 1
1645 1 58 THR H 1 61 GLN QG 2.900 . 4.000 3.126 2.965 3.313 . 0 0 "[ . 1 .]" 1
1646 1 58 THR H 1 92 THR HG1 3.400 . 4.800 3.915 3.183 4.159 . 0 0 "[ . 1 .]" 1
1647 1 58 THR H 1 93 MET H 5.000 . 6.000 4.529 4.430 4.608 . 0 0 "[ . 1 .]" 1
1648 1 58 THR HA 1 58 THR HB 2.200 . 2.800 2.600 2.456 2.725 . 0 0 "[ . 1 .]" 1
1649 1 58 THR HA 1 58 THR HG1 2.000 . 2.500 2.100 1.969 2.363 . 0 0 "[ . 1 .]" 1
1650 1 58 THR HA 1 59 VAL H 2.200 . 2.800 2.214 2.196 2.258 . 0 0 "[ . 1 .]" 1
1651 1 58 THR HA 1 59 VAL HB 3.200 . 4.500 4.528 4.520 4.538 0.038 8 0 "[ . 1 .]" 1
1652 1 58 THR HA 1 59 VAL QG 2.900 . 3.900 3.882 3.831 3.905 0.005 3 0 "[ . 1 .]" 1
1653 1 58 THR HA 1 60 GLY H 3.300 . 4.700 4.057 3.999 4.091 . 0 0 "[ . 1 .]" 1
1654 1 58 THR HA 1 90 SER HA 3.900 . 5.800 5.231 5.078 5.502 . 0 0 "[ . 1 .]" 1
1655 1 58 THR HA 1 92 THR HG1 2.300 . 3.000 2.945 2.405 3.003 0.003 9 0 "[ . 1 .]" 1
1656 1 58 THR HA 1 93 MET H 2.700 . 3.600 3.330 3.159 3.402 . 0 0 "[ . 1 .]" 1
1657 1 58 THR HA 1 93 MET QG 5.400 . 6.000 4.352 4.071 4.583 . 0 0 "[ . 1 .]" 1
1658 1 58 THR HB 1 58 THR HG1 2.000 . 2.500 1.986 1.905 2.026 . 0 0 "[ . 1 .]" 1
1659 1 58 THR HB 1 59 VAL H 2.600 . 3.500 2.933 2.617 3.171 . 0 0 "[ . 1 .]" 1
1660 1 58 THR HB 1 59 VAL HB 3.600 . 5.200 4.298 4.115 4.490 . 0 0 "[ . 1 .]" 1
1661 1 58 THR HB 1 59 VAL QG 4.600 . 6.000 4.453 4.355 4.566 . 0 0 "[ . 1 .]" 1
1662 1 58 THR HB 1 60 GLY H 2.500 . 3.300 2.497 2.396 2.656 . 0 0 "[ . 1 .]" 1
1663 1 58 THR HB 1 90 SER HA 3.000 . 4.100 3.777 3.246 4.081 . 0 0 "[ . 1 .]" 1
1664 1 58 THR HB 1 93 MET H 4.400 . 6.000 5.878 5.654 5.970 . 0 0 "[ . 1 .]" 1
1665 1 58 THR HG1 1 59 VAL H 2.500 . 3.300 3.299 3.025 3.375 0.075 14 0 "[ . 1 .]" 1
1666 1 58 THR HG1 1 60 GLY H 3.000 . 4.200 3.468 2.592 3.796 . 0 0 "[ . 1 .]" 1
1667 1 58 THR HG1 1 61 GLN H 3.100 . 4.300 3.356 1.976 3.935 . 0 0 "[ . 1 .]" 1
1668 1 58 THR HG1 1 61 GLN QB 2.800 . 3.800 3.592 3.074 3.811 0.011 3 0 "[ . 1 .]" 1
1669 1 58 THR HG1 1 61 GLN HE21 4.600 . 6.000 3.142 2.587 3.529 . 0 0 "[ . 1 .]" 1
1670 1 58 THR HG1 1 61 GLN HE22 3.400 . 4.900 3.523 3.280 4.071 . 0 0 "[ . 1 .]" 1
1671 1 58 THR HG1 1 61 GLN QG 3.100 . 4.300 2.501 1.985 2.816 0.015 8 0 "[ . 1 .]" 1
1672 1 58 THR HG1 1 90 SER H 6.000 . 6.000 4.944 4.447 5.324 . 0 0 "[ . 1 .]" 1
1673 1 58 THR HG1 1 90 SER HA 2.700 . 3.600 2.851 2.407 3.517 . 0 0 "[ . 1 .]" 1
1674 1 58 THR HG1 1 91 ALA H 3.300 . 4.700 4.478 3.981 4.707 0.007 2 0 "[ . 1 .]" 1
1675 1 58 THR HG1 1 93 MET H 3.200 . 4.500 4.536 4.519 4.551 0.051 14 0 "[ . 1 .]" 1
1676 1 59 VAL H 1 59 VAL HA 2.400 . 3.100 2.736 2.723 2.768 . 0 0 "[ . 1 .]" 1
1677 1 59 VAL H 1 59 VAL HB 2.000 . 2.500 2.349 2.280 2.381 . 0 0 "[ . 1 .]" 1
1678 1 59 VAL H 1 59 VAL QG 2.900 . 2.900 2.368 2.250 2.476 . 0 0 "[ . 1 .]" 1
1679 1 59 VAL H 1 60 GLY H 2.600 . 3.400 2.832 2.739 2.870 . 0 0 "[ . 1 .]" 1
1680 1 59 VAL H 1 61 GLN H 5.400 . 6.000 4.269 4.206 4.483 . 0 0 "[ . 1 .]" 1
1681 1 59 VAL H 1 89 THR HA 3.000 . 4.100 3.866 3.651 3.990 . 0 0 "[ . 1 .]" 1
1682 1 59 VAL H 1 90 SER HA 3.700 . 5.400 4.825 4.629 4.987 . 0 0 "[ . 1 .]" 1
1683 1 59 VAL H 1 91 ALA H 3.500 . 5.000 4.262 4.072 4.419 . 0 0 "[ . 1 .]" 1
1684 1 59 VAL H 1 91 ALA MB 3.100 . 4.300 3.881 3.786 4.039 . 0 0 "[ . 1 .]" 1
1685 1 59 VAL H 1 92 THR HA 3.500 . 5.000 3.114 2.961 3.389 . 0 0 "[ . 1 .]" 1
1686 1 59 VAL H 1 92 THR HG1 3.400 . 4.800 4.414 4.151 4.592 . 0 0 "[ . 1 .]" 1
1687 1 59 VAL H 1 93 MET H 3.200 . 4.500 4.236 4.084 4.503 0.003 1 0 "[ . 1 .]" 1
1688 1 59 VAL H 1 93 MET QG 4.100 . 6.000 4.530 4.198 4.832 . 0 0 "[ . 1 .]" 1
1689 1 59 VAL HA 1 59 VAL HB 2.700 . 3.600 2.995 2.988 2.999 . 0 0 "[ . 1 .]" 1
1690 1 59 VAL HA 1 59 VAL QG 2.100 . 2.600 2.103 2.036 2.143 . 0 0 "[ . 1 .]" 1
1691 1 59 VAL HA 1 60 GLY H 3.400 . 4.800 3.520 3.508 3.531 . 0 0 "[ . 1 .]" 1
1692 1 59 VAL HA 1 60 GLY H 3.300 . 4.600 3.021 2.961 3.097 . 0 0 "[ . 1 .]" 1
1693 1 59 VAL HA 1 61 GLN H 4.300 . 6.000 4.121 4.053 4.411 . 0 0 "[ . 1 .]" 1
1694 1 59 VAL HA 1 62 PHE QB 2.500 . 3.300 2.547 2.461 2.675 . 0 0 "[ . 1 .]" 1
1695 1 59 VAL HA 1 62 PHE QD 3.100 . 4.300 4.001 3.853 4.153 . 0 0 "[ . 1 .]" 1
1696 1 59 VAL HA 1 63 TYR H 3.700 . 5.400 4.023 3.875 4.112 . 0 0 "[ . 1 .]" 1
1697 1 59 VAL HA 1 80 PHE QE 4.500 . 6.000 4.063 3.953 4.160 . 0 0 "[ . 1 .]" 1
1698 1 59 VAL HA 1 89 THR HG1 4.100 . 6.000 5.157 5.122 5.225 . 0 0 "[ . 1 .]" 1
1699 1 59 VAL HA 1 93 MET QG 3.500 . 5.000 3.687 3.376 4.047 . 0 0 "[ . 1 .]" 1
1700 1 59 VAL HB 1 59 VAL QG 2.100 . 2.600 1.886 1.881 1.896 . 0 0 "[ . 1 .]" 1
1701 1 59 VAL HB 1 60 GLY H 2.500 . 3.300 2.868 2.818 2.928 . 0 0 "[ . 1 .]" 1
1702 1 59 VAL HB 1 60 GLY QA 3.900 . 5.800 4.193 4.164 4.243 . 0 0 "[ . 1 .]" 1
1703 1 59 VAL HB 1 87 PRO QB 3.300 . 4.700 3.861 3.703 4.003 . 0 0 "[ . 1 .]" 1
1704 1 59 VAL HB 1 87 PRO QG 4.000 . 6.000 4.585 4.368 4.713 . 0 0 "[ . 1 .]" 1
1705 1 59 VAL HB 1 89 THR HA 2.000 . 2.500 1.850 1.783 1.902 . 0 0 "[ . 1 .]" 1
1706 1 59 VAL HB 1 89 THR HB 3.300 . 4.600 4.198 4.139 4.268 . 0 0 "[ . 1 .]" 1
1707 1 59 VAL HB 1 89 THR HG1 2.700 . 3.600 3.604 3.602 3.609 0.009 1 0 "[ . 1 .]" 1
1708 1 59 VAL HB 1 91 ALA H 3.200 . 4.500 3.795 3.717 3.900 . 0 0 "[ . 1 .]" 1
1709 1 59 VAL HB 1 91 ALA MB 3.500 . 5.000 3.723 3.646 3.845 . 0 0 "[ . 1 .]" 1
1710 1 59 VAL QG 1 60 GLY H 2.400 . 3.100 3.104 3.094 3.120 0.020 3 0 "[ . 1 .]" 1
1711 1 59 VAL QG 1 60 GLY QA 3.700 . 5.400 3.070 3.055 3.089 . 0 0 "[ . 1 .]" 1
1712 1 59 VAL QG 1 62 PHE QB 3.100 . 4.300 3.191 3.057 3.278 . 0 0 "[ . 1 .]" 1
1713 1 59 VAL QG 1 63 TYR H 3.400 . 4.800 3.765 3.708 3.829 . 0 0 "[ . 1 .]" 1
1714 1 59 VAL QG 1 63 TYR HA 3.500 . 5.000 4.773 4.688 4.859 . 0 0 "[ . 1 .]" 1
1715 1 59 VAL QG 1 63 TYR QD 2.300 . 2.900 2.376 2.274 2.497 . 0 0 "[ . 1 .]" 1
1716 1 59 VAL QG 1 63 TYR QE 2.100 . 2.600 1.954 1.855 2.148 . 0 0 "[ . 1 .]" 1
1717 1 59 VAL QG 1 80 PHE QB 3.300 . 4.700 3.180 3.111 3.259 . 0 0 "[ . 1 .]" 1
1718 1 59 VAL QG 1 80 PHE QD . . 2.700 2.186 2.121 2.260 . 0 0 "[ . 1 .]" 1
1719 1 59 VAL QG 1 80 PHE QE 2.500 . 3.300 3.306 3.259 3.323 0.023 8 0 "[ . 1 .]" 1
1720 1 59 VAL QG 1 87 PRO QB 2.500 . 3.300 1.961 1.809 2.048 . 0 0 "[ . 1 .]" 1
1721 1 59 VAL QG 1 87 PRO QB 2.400 . 3.100 1.843 1.722 1.913 . 0 0 "[ . 1 .]" 1
1722 1 59 VAL QG 1 87 PRO QD 3.800 . 5.600 3.649 3.485 3.740 . 0 0 "[ . 1 .]" 1
1723 1 59 VAL QG 1 87 PRO QG 2.200 . 2.800 2.243 2.106 2.342 . 0 0 "[ . 1 .]" 1
1724 1 59 VAL QG 1 89 THR H 3.900 . 5.800 3.453 3.378 3.537 . 0 0 "[ . 1 .]" 1
1725 1 59 VAL QG 1 89 THR HA 2.300 . 2.500 1.931 1.916 2.014 . 0 0 "[ . 1 .]" 1
1726 1 59 VAL QG 1 89 THR HB 3.300 . 4.600 3.693 3.594 3.790 . 0 0 "[ . 1 .]" 1
1727 1 59 VAL QG 1 89 THR HG1 2.200 . 2.800 2.237 2.168 2.353 . 0 0 "[ . 1 .]" 1
1728 1 59 VAL QG 1 91 ALA H 3.400 . 3.600 3.591 3.516 3.603 0.003 5 0 "[ . 1 .]" 1
1729 1 59 VAL QG 1 91 ALA MB 2.100 . 2.600 2.379 2.218 2.435 . 0 0 "[ . 1 .]" 1
1730 1 59 VAL QG 1 92 THR H 4.100 . 6.000 4.480 4.202 4.708 . 0 0 "[ . 1 .]" 1
1731 1 59 VAL QG 1 93 MET H 3.400 . 4.800 4.124 3.960 4.350 . 0 0 "[ . 1 .]" 1
1732 1 59 VAL QG 1 96 LEU HG 3.000 . 6.000 3.265 3.132 3.404 . 0 0 "[ . 1 .]" 1
1733 1 60 GLY H 1 60 GLY QA 1.900 . 2.400 2.202 2.201 2.204 . 0 0 "[ . 1 .]" 1
1734 1 60 GLY H 1 61 GLN H 2.900 . 4.000 2.641 2.612 2.715 . 0 0 "[ . 1 .]" 1
1735 1 60 GLY H 1 63 TYR QD 4.500 . 6.000 4.128 4.034 4.228 . 0 0 "[ . 1 .]" 1
1736 1 60 GLY H 1 89 THR H 5.200 . 6.000 5.586 5.505 5.658 . 0 0 "[ . 1 .]" 1
1737 1 60 GLY H 1 89 THR HA 2.600 . 3.400 2.948 2.846 3.042 . 0 0 "[ . 1 .]" 1
1738 1 60 GLY H 1 89 THR HB 2.700 . 3.600 3.491 3.413 3.548 . 0 0 "[ . 1 .]" 1
1739 1 60 GLY H 1 89 THR HG1 3.000 . 4.100 3.758 3.634 3.785 . 0 0 "[ . 1 .]" 1
1740 1 60 GLY H 1 90 SER HA 3.600 . 5.300 4.644 4.545 4.760 . 0 0 "[ . 1 .]" 1
1741 1 60 GLY H 1 91 ALA H 5.500 . 6.000 5.525 5.430 5.660 . 0 0 "[ . 1 .]" 1
1742 1 60 GLY QA 1 61 GLN H 3.100 . 4.100 2.741 2.665 2.766 . 0 0 "[ . 1 .]" 1
1743 1 60 GLY QA 1 63 TYR H 3.300 . 4.600 3.652 3.560 3.735 . 0 0 "[ . 1 .]" 1
1744 1 60 GLY QA 1 63 TYR QB 3.200 . 4.100 2.873 2.794 2.973 . 0 0 "[ . 1 .]" 1
1745 1 60 GLY QA 1 63 TYR QD 2.300 . 3.000 2.213 2.085 2.385 . 0 0 "[ . 1 .]" 1
1746 1 60 GLY QA 1 63 TYR QE 4.500 . 5.200 4.006 3.868 4.168 . 0 0 "[ . 1 .]" 1
1747 1 60 GLY QA 1 64 PHE H 5.000 . 6.000 4.262 4.185 4.327 . 0 0 "[ . 1 .]" 1
1748 1 60 GLY QA 1 89 THR HA 3.900 . 5.800 3.516 3.449 3.571 . 0 0 "[ . 1 .]" 1
1749 1 60 GLY QA 1 89 THR HB 2.300 . 3.000 3.014 3.005 3.021 0.021 2 0 "[ . 1 .]" 1
1750 1 60 GLY QA 1 89 THR HG1 2.200 . 2.800 2.748 2.566 2.804 0.004 4 0 "[ . 1 .]" 1
1751 1 61 GLN H 1 61 GLN HA 2.700 . 3.600 2.859 2.824 2.871 . 0 0 "[ . 1 .]" 1
1752 1 61 GLN H 1 61 GLN QB 2.700 . 3.600 2.387 2.366 2.403 . 0 0 "[ . 1 .]" 1
1753 1 61 GLN H 1 61 GLN QG 1.900 . 2.300 2.284 2.237 2.311 0.011 2 0 "[ . 1 .]" 1
1754 1 61 GLN H 1 62 PHE H 2.500 . 3.300 2.539 2.483 2.657 . 0 0 "[ . 1 .]" 1
1755 1 61 GLN H 1 62 PHE QB 4.000 . 6.000 4.225 4.183 4.330 . 0 0 "[ . 1 .]" 1
1756 1 61 GLN H 1 63 TYR H 4.200 . 6.000 4.013 3.957 4.119 . 0 0 "[ . 1 .]" 1
1757 1 61 GLN H 1 89 THR HG1 4.700 . 6.000 5.431 5.294 5.542 . 0 0 "[ . 1 .]" 1
1758 1 61 GLN HA 1 61 GLN QB 2.500 . 2.600 2.366 2.356 2.389 . 0 0 "[ . 1 .]" 1
1759 1 61 GLN HA 1 61 GLN QG 1.900 . 2.300 2.340 2.323 2.344 0.044 2 0 "[ . 1 .]" 1
1760 1 61 GLN HA 1 62 PHE H 2.900 . 4.000 3.547 3.536 3.556 . 0 0 "[ . 1 .]" 1
1761 1 61 GLN HA 1 63 TYR H 3.100 . 4.300 4.305 4.301 4.307 0.007 13 0 "[ . 1 .]" 1
1762 1 61 GLN HA 1 64 PHE H 3.300 . 4.600 3.844 3.774 3.927 . 0 0 "[ . 1 .]" 1
1763 1 61 GLN HA 1 64 PHE H 2.900 . 3.900 3.416 3.383 3.451 . 0 0 "[ . 1 .]" 1
1764 1 61 GLN HA 1 64 PHE QB 2.400 . 3.100 2.925 2.848 3.007 . 0 0 "[ . 1 .]" 1
1765 1 61 GLN HA 1 64 PHE QD 2.800 . 3.800 3.825 3.819 3.834 0.034 5 0 "[ . 1 .]" 1
1766 1 61 GLN HA 1 65 LEU H 4.600 . 6.000 4.573 4.515 4.629 . 0 0 "[ . 1 .]" 1
1767 1 61 GLN HA 1 65 LEU QB 4.100 . 6.000 5.015 4.967 5.102 . 0 0 "[ . 1 .]" 1
1768 1 61 GLN QB 1 61 GLN HE22 4.500 . 6.000 3.265 3.245 3.406 . 0 0 "[ . 1 .]" 1
1769 1 61 GLN QB 1 61 GLN QG 2.000 . 2.500 2.075 2.074 2.076 . 0 0 "[ . 1 .]" 1
1770 1 61 GLN QB 1 62 PHE H 2.800 . 3.500 2.380 2.346 2.424 . 0 0 "[ . 1 .]" 1
1771 1 61 GLN QB 1 64 PHE H 5.000 . 6.000 4.145 4.087 4.215 . 0 0 "[ . 1 .]" 1
1772 1 61 GLN QB 1 64 PHE QB 4.200 . 6.000 4.386 4.313 4.473 . 0 0 "[ . 1 .]" 1
1773 1 61 GLN HE21 1 61 GLN QG 3.200 . 4.500 2.679 2.453 2.719 . 0 0 "[ . 1 .]" 1
1774 1 61 GLN HE22 1 61 GLN QG 2.800 . 3.800 3.455 3.384 3.468 . 0 0 "[ . 1 .]" 1
1775 1 61 GLN QG 1 62 PHE H 2.900 . 3.900 3.945 3.934 3.971 0.071 3 0 "[ . 1 .]" 1
1776 1 61 GLN QG 1 64 PHE QB 3.400 . 4.800 4.605 4.532 4.694 . 0 0 "[ . 1 .]" 1
1777 1 62 PHE H 1 62 PHE HA 2.500 . 3.300 2.760 2.749 2.775 . 0 0 "[ . 1 .]" 1
1778 1 62 PHE H 1 62 PHE QB 2.000 . 2.500 2.189 2.175 2.209 . 0 0 "[ . 1 .]" 1
1779 1 62 PHE H 1 62 PHE QD 3.500 . 5.000 4.015 3.994 4.051 . 0 0 "[ . 1 .]" 1
1780 1 62 PHE H 1 63 TYR H 2.500 . 3.300 2.816 2.777 2.850 . 0 0 "[ . 1 .]" 1
1781 1 62 PHE H 1 63 TYR HA 4.200 . 6.000 5.396 5.366 5.427 . 0 0 "[ . 1 .]" 1
1782 1 62 PHE H 1 63 TYR QB 3.200 . 4.500 4.516 4.506 4.526 0.026 8 0 "[ . 1 .]" 1
1783 1 62 PHE H 1 64 PHE H 4.300 . 6.000 4.880 4.822 4.980 . 0 0 "[ . 1 .]" 1
1784 1 62 PHE H 1 80 PHE QE 4.800 . 6.000 4.314 4.246 4.362 . 0 0 "[ . 1 .]" 1
1785 1 62 PHE H 1 93 MET QB 4.600 . 6.000 6.052 6.026 6.086 0.086 5 0 "[ . 1 .]" 1
1786 1 62 PHE H 1 93 MET QG 4.300 . 6.000 4.079 4.039 4.179 . 0 0 "[ . 1 .]" 1
1787 1 62 PHE HA 1 62 PHE QB 2.400 . 2.700 2.434 2.425 2.440 . 0 0 "[ . 1 .]" 1
1788 1 62 PHE HA 1 62 PHE QD 2.100 . 2.600 1.930 1.907 1.946 . 0 0 "[ . 1 .]" 1
1789 1 62 PHE HA 1 62 PHE QE 3.700 . 5.400 4.180 4.174 4.191 . 0 0 "[ . 1 .]" 1
1790 1 62 PHE HA 1 62 PHE HZ 3.900 . 5.800 5.820 5.811 5.832 0.032 10 0 "[ . 1 .]" 1
1791 1 62 PHE HA 1 63 TYR H 3.500 . 5.000 3.533 3.530 3.538 . 0 0 "[ . 1 .]" 1
1792 1 62 PHE HA 1 65 LEU H 2.900 . 3.900 3.681 3.653 3.709 . 0 0 "[ . 1 .]" 1
1793 1 62 PHE HA 1 65 LEU QB 2.700 . 3.600 3.008 2.949 3.051 . 0 0 "[ . 1 .]" 1
1794 1 62 PHE HA 1 65 LEU QD . . 3.100 1.998 1.989 2.026 0.011 14 0 "[ . 1 .]" 1
1795 1 62 PHE HA 1 66 ILE H 4.000 . 6.000 4.361 4.248 4.468 . 0 0 "[ . 1 .]" 1
1796 1 62 PHE QB 1 62 PHE QD 2.300 . 2.900 2.184 2.181 2.189 . 0 0 "[ . 1 .]" 1
1797 1 62 PHE QB 1 62 PHE QE 3.900 . 5.800 3.948 3.946 3.950 . 0 0 "[ . 1 .]" 1
1798 1 62 PHE QB 1 63 TYR H 2.400 . 3.100 2.510 2.485 2.541 . 0 0 "[ . 1 .]" 1
1799 1 62 PHE QB 1 80 PHE QD 3.100 . 4.300 3.448 3.372 3.509 . 0 0 "[ . 1 .]" 1
1800 1 62 PHE QB 1 80 PHE QE 3.300 . 4.700 2.001 1.984 2.050 0.016 5 0 "[ . 1 .]" 1
1801 1 62 PHE QB 1 93 MET ME 3.400 . 4.400 3.783 3.700 3.881 . 0 0 "[ . 1 .]" 1
1802 1 62 PHE QB 1 93 MET QG 3.600 . 5.200 2.704 2.589 2.763 . 0 0 "[ . 1 .]" 1
1803 1 62 PHE QD 1 63 TYR H 3.700 . 5.400 4.256 4.239 4.281 . 0 0 "[ . 1 .]" 1
1804 1 62 PHE QD 1 63 TYR HA 3.300 . 4.600 4.642 4.616 4.663 0.063 13 0 "[ . 1 .]" 1
1805 1 62 PHE QD 1 65 LEU H 4.000 . 6.000 5.031 4.970 5.072 . 0 0 "[ . 1 .]" 1
1806 1 62 PHE QD 1 65 LEU QB 2.800 . 3.800 3.840 3.829 3.852 0.052 6 0 "[ . 1 .]" 1
1807 1 62 PHE QD 1 65 LEU QD 2.900 . 3.100 1.796 1.790 1.806 0.010 10 0 "[ . 1 .]" 1
1808 1 62 PHE QD 1 66 ILE MD 3.000 . 4.100 4.110 4.072 4.133 0.033 12 0 "[ . 1 .]" 1
1809 1 62 PHE QD 1 66 ILE QG 3.500 . 4.600 3.544 3.438 3.634 . 0 0 "[ . 1 .]" 1
1810 1 62 PHE QD 1 80 PHE QE 2.700 . 3.600 2.605 2.511 2.646 . 0 0 "[ . 1 .]" 1
1811 1 62 PHE QD 1 93 MET ME 2.500 . 3.300 3.324 3.307 3.333 0.033 2 0 "[ . 1 .]" 1
1812 1 62 PHE QD 1 109 ILE MD 2.600 . 3.500 3.108 2.899 3.283 . 0 0 "[ . 1 .]" 1
1813 1 62 PHE QE 1 65 LEU QD 2.700 . 3.600 2.064 2.023 2.097 . 0 0 "[ . 1 .]" 1
1814 1 62 PHE QE 1 66 ILE MD 2.600 . 3.400 3.254 3.136 3.324 . 0 0 "[ . 1 .]" 1
1815 1 62 PHE QE 1 66 ILE QG 3.900 . 5.800 3.461 3.268 3.623 . 0 0 "[ . 1 .]" 1
1816 1 62 PHE QE 1 93 MET ME 2.600 . 3.400 3.191 3.040 3.381 . 0 0 "[ . 1 .]" 1
1817 1 62 PHE QE 1 109 ILE MD 2.400 . 3.100 2.087 1.877 2.303 . 0 0 "[ . 1 .]" 1
1818 1 62 PHE QE 1 109 ILE QG 5.700 . 6.000 3.640 3.377 3.908 . 0 0 "[ . 1 .]" 1
1819 1 62 PHE QE 1 109 ILE QG 3.600 . 5.200 2.658 2.418 2.833 . 0 0 "[ . 1 .]" 1
1820 1 62 PHE HZ 1 66 ILE MD 2.600 . 3.400 3.347 3.126 3.405 0.005 5 0 "[ . 1 .]" 1
1821 1 62 PHE HZ 1 93 MET ME 3.600 . 5.200 3.973 3.697 4.304 . 0 0 "[ . 1 .]" 1
1822 1 62 PHE HZ 1 109 ILE MD 3.500 . 5.100 3.808 3.563 4.029 . 0 0 "[ . 1 .]" 1
1823 1 63 TYR H 1 63 TYR HA 2.200 . 2.800 2.772 2.763 2.778 . 0 0 "[ . 1 .]" 1
1824 1 63 TYR H 1 63 TYR QB 2.000 . 2.500 2.176 2.147 2.199 . 0 0 "[ . 1 .]" 1
1825 1 63 TYR H 1 63 TYR QD 2.700 . 3.600 3.065 2.981 3.180 . 0 0 "[ . 1 .]" 1
1826 1 63 TYR H 1 63 TYR QE 6.000 . 6.000 4.928 4.845 5.014 . 0 0 "[ . 1 .]" 1
1827 1 63 TYR H 1 64 PHE H 2.600 . 3.500 3.016 2.978 3.079 . 0 0 "[ . 1 .]" 1
1828 1 63 TYR H 1 64 PHE QB 3.900 . 5.800 4.423 4.381 4.470 . 0 0 "[ . 1 .]" 1
1829 1 63 TYR H 1 65 LEU H 5.200 . 6.000 4.085 4.040 4.134 . 0 0 "[ . 1 .]" 1
1830 1 63 TYR H 1 80 PHE QD 4.800 . 6.000 4.329 4.275 4.411 . 0 0 "[ . 1 .]" 1
1831 1 63 TYR H 1 80 PHE QE 3.000 . 4.100 2.461 2.409 2.518 . 0 0 "[ . 1 .]" 1
1832 1 63 TYR H 1 80 PHE HZ 3.900 . 5.800 3.964 3.908 4.008 . 0 0 "[ . 1 .]" 1
1833 1 63 TYR HA 1 63 TYR QB 2.400 . 3.100 2.499 2.488 2.512 . 0 0 "[ . 1 .]" 1
1834 1 63 TYR HA 1 63 TYR QD 2.000 . 2.500 2.483 2.406 2.527 0.027 7 0 "[ . 1 .]" 1
1835 1 63 TYR HA 1 63 TYR QE 3.500 . 5.100 4.343 4.312 4.362 . 0 0 "[ . 1 .]" 1
1836 1 63 TYR HA 1 64 PHE H 3.300 . 4.700 3.512 3.506 3.518 . 0 0 "[ . 1 .]" 1
1837 1 63 TYR HA 1 65 LEU H 4.400 . 6.000 4.193 4.117 4.262 . 0 0 "[ . 1 .]" 1
1838 1 63 TYR HA 1 65 LEU HG 2.600 . 3.500 3.546 3.539 3.555 0.055 11 0 "[ . 1 .]" 1
1839 1 63 TYR HA 1 66 ILE H 3.200 . 4.500 3.432 3.394 3.507 . 0 0 "[ . 1 .]" 1
1840 1 63 TYR HA 1 66 ILE HB 2.700 . 3.600 2.846 2.794 2.895 . 0 0 "[ . 1 .]" 1
1841 1 63 TYR HA 1 66 ILE QG 3.300 . 4.700 3.542 3.400 3.673 . 0 0 "[ . 1 .]" 1
1842 1 63 TYR HA 1 66 ILE QG 3.300 . 4.700 3.366 3.273 3.460 . 0 0 "[ . 1 .]" 1
1843 1 63 TYR HA 1 67 ARG H 4.200 . 6.000 3.841 3.716 3.981 . 0 0 "[ . 1 .]" 1
1844 1 63 TYR HA 1 78 LEU QB 4.000 . 6.000 4.152 3.962 4.383 . 0 0 "[ . 1 .]" 1
1845 1 63 TYR HA 1 78 LEU QD 2.900 . 4.000 2.961 2.810 3.086 . 0 0 "[ . 1 .]" 1
1846 1 63 TYR HA 1 80 PHE QE 2.800 . 3.800 2.419 2.363 2.466 . 0 0 "[ . 1 .]" 1
1847 1 63 TYR HA 1 80 PHE HZ 2.000 . 2.500 2.030 1.978 2.108 . 0 0 "[ . 1 .]" 1
1848 1 63 TYR QB 1 63 TYR QD 2.100 . 2.600 2.121 2.117 2.126 . 0 0 "[ . 1 .]" 1
1849 1 63 TYR QB 1 63 TYR QE 2.900 . 3.900 3.925 3.921 3.927 0.027 3 0 "[ . 1 .]" 1
1850 1 63 TYR QB 1 64 PHE H 2.700 . 3.600 2.089 2.052 2.112 . 0 0 "[ . 1 .]" 1
1851 1 63 TYR QB 1 64 PHE HA 2.900 . 3.900 3.567 3.550 3.582 . 0 0 "[ . 1 .]" 1
1852 1 63 TYR QB 1 66 ILE H 5.300 . 6.000 4.702 4.663 4.794 . 0 0 "[ . 1 .]" 1
1853 1 63 TYR QB 1 66 ILE HB 5.200 . 6.000 4.677 4.607 4.773 . 0 0 "[ . 1 .]" 1
1854 1 63 TYR QB 1 67 ARG H 4.100 . 6.000 4.357 4.293 4.435 . 0 0 "[ . 1 .]" 1
1855 1 63 TYR QB 1 78 LEU QD 4.200 . 6.000 3.120 2.982 3.361 . 0 0 "[ . 1 .]" 1
1856 1 63 TYR QB 1 80 PHE QE 4.400 . 6.000 3.576 3.533 3.635 . 0 0 "[ . 1 .]" 1
1857 1 63 TYR QB 1 89 THR HG1 3.900 . 5.800 4.286 4.183 4.392 . 0 0 "[ . 1 .]" 1
1858 1 63 TYR QD 1 64 PHE H 3.000 . 4.100 4.141 4.126 4.155 0.055 14 0 "[ . 1 .]" 1
1859 1 63 TYR QD 1 64 PHE HA 3.700 . 5.400 5.442 5.369 5.481 0.081 9 0 "[ . 1 .]" 1
1860 1 63 TYR QD 1 66 ILE H 5.200 . 6.000 5.305 5.209 5.393 . 0 0 "[ . 1 .]" 1
1861 1 63 TYR QD 1 66 ILE HB 3.500 . 5.000 4.044 3.917 4.168 . 0 0 "[ . 1 .]" 1
1862 1 63 TYR QD 1 66 ILE QG 4.500 . 6.000 4.150 4.063 4.238 . 0 0 "[ . 1 .]" 1
1863 1 63 TYR QD 1 67 ARG QD 3.200 . 4.500 3.267 3.107 3.741 . 0 0 "[ . 1 .]" 1
1864 1 63 TYR QD 1 78 LEU QB 3.100 . 4.300 3.188 2.942 3.349 . 0 0 "[ . 1 .]" 1
1865 1 63 TYR QD 1 78 LEU QD 2.200 . 2.800 2.111 1.885 2.263 0.015 7 0 "[ . 1 .]" 1
1866 1 63 TYR QD 1 78 LEU HG 2.200 . 2.800 2.300 1.986 2.803 0.003 7 0 "[ . 1 .]" 1
1867 1 63 TYR QD 1 79 PHE HA 3.100 . 4.300 4.324 4.316 4.330 0.030 13 0 "[ . 1 .]" 1
1868 1 63 TYR QD 1 80 PHE H 4.700 . 6.000 4.432 4.339 4.540 . 0 0 "[ . 1 .]" 1
1869 1 63 TYR QD 1 80 PHE QE 2.800 . 3.800 3.315 3.275 3.390 . 0 0 "[ . 1 .]" 1
1870 1 63 TYR QD 1 89 THR HB 3.800 . 5.600 4.671 4.563 4.834 . 0 0 "[ . 1 .]" 1
1871 1 63 TYR QD 1 89 THR HG1 2.200 . 2.800 2.802 2.771 2.817 0.017 3 0 "[ . 1 .]" 1
1872 1 63 TYR QD 1 111 TYR HA 4.100 . 6.000 6.044 6.026 6.082 0.082 7 0 "[ . 1 .]" 1
1873 1 63 TYR QE 1 67 ARG QD 3.500 . 5.100 5.124 5.111 5.164 0.064 7 0 "[ . 1 .]" 1
1874 1 63 TYR QE 1 78 LEU QB 2.900 . 4.000 3.841 3.444 3.995 . 0 0 "[ . 1 .]" 1
1875 1 63 TYR QE 1 78 LEU QD 3.200 . 3.400 3.269 3.163 3.389 . 0 0 "[ . 1 .]" 1
1876 1 63 TYR QE 1 78 LEU HG 2.500 . 3.300 2.423 2.274 2.571 . 0 0 "[ . 1 .]" 1
1877 1 63 TYR QE 1 79 PHE HA 2.200 . 2.800 2.140 2.063 2.189 . 0 0 "[ . 1 .]" 1
1878 1 63 TYR QE 1 80 PHE H 2.600 . 3.500 2.332 2.146 2.538 . 0 0 "[ . 1 .]" 1
1879 1 63 TYR QE 1 80 PHE HA 3.500 . 5.000 3.817 3.681 4.059 . 0 0 "[ . 1 .]" 1
1880 1 63 TYR QE 1 80 PHE QB 6.000 . 6.000 3.388 3.239 3.533 . 0 0 "[ . 1 .]" 1
1881 1 63 TYR QE 1 80 PHE QD 3.400 . 4.800 3.211 3.093 3.334 . 0 0 "[ . 1 .]" 1
1882 1 63 TYR QE 1 80 PHE QE 3.700 . 5.400 3.974 3.908 4.136 . 0 0 "[ . 1 .]" 1
1883 1 63 TYR QE 1 86 ILE QG 6.000 . 6.000 4.111 3.969 4.226 . 0 0 "[ . 1 .]" 1
1884 1 63 TYR QE 1 89 THR HA 4.100 . 6.000 3.542 3.350 3.773 . 0 0 "[ . 1 .]" 1
1885 1 63 TYR QE 1 89 THR HB 4.000 . 6.000 4.820 4.629 4.956 . 0 0 "[ . 1 .]" 1
1886 1 63 TYR QE 1 89 THR HG1 2.200 . 2.800 2.295 2.107 2.451 . 0 0 "[ . 1 .]" 1
1887 1 64 PHE H 1 64 PHE HA 2.000 . 2.500 2.464 2.453 2.476 . 0 0 "[ . 1 .]" 1
1888 1 64 PHE H 1 64 PHE QB 2.100 . 2.700 2.191 2.169 2.211 . 0 0 "[ . 1 .]" 1
1889 1 64 PHE H 1 64 PHE QB 1.800 . 2.200 1.919 1.909 1.927 . 0 0 "[ . 1 .]" 1
1890 1 64 PHE H 1 65 LEU QB 4.400 . 6.000 3.386 3.373 3.402 . 0 0 "[ . 1 .]" 1
1891 1 64 PHE H 1 65 LEU H 2.400 . 3.100 3.004 2.980 3.034 . 0 0 "[ . 1 .]" 1
1892 1 64 PHE H 1 80 PHE HZ 4.200 . 6.000 5.261 5.228 5.306 . 0 0 "[ . 1 .]" 1
1893 1 64 PHE HA 1 64 PHE QB 2.000 . 2.500 2.248 2.237 2.256 . 0 0 "[ . 1 .]" 1
1894 1 64 PHE HA 1 64 PHE QD 2.400 . 3.100 2.867 2.838 2.905 . 0 0 "[ . 1 .]" 1
1895 1 64 PHE HA 1 65 LEU H 3.500 . 5.100 3.540 3.528 3.551 . 0 0 "[ . 1 .]" 1
1896 1 64 PHE HA 1 65 LEU QB 4.400 . 6.000 4.980 4.973 4.984 . 0 0 "[ . 1 .]" 1
1897 1 64 PHE HA 1 66 ILE H 3.900 . 5.800 4.557 4.440 4.721 . 0 0 "[ . 1 .]" 1
1898 1 64 PHE HA 1 67 ARG H 2.900 . 3.900 3.511 3.388 3.578 . 0 0 "[ . 1 .]" 1
1899 1 64 PHE HA 1 67 ARG HA 5.200 . 6.000 5.106 5.036 5.176 . 0 0 "[ . 1 .]" 1
1900 1 64 PHE HA 1 67 ARG QB 1.800 . 2.200 2.233 2.207 2.285 0.085 6 0 "[ . 1 .]" 1
1901 1 64 PHE HA 1 67 ARG QD 2.400 . 3.100 2.537 2.058 3.190 0.090 7 0 "[ . 1 .]" 1
1902 1 64 PHE HA 1 67 ARG QG 3.200 . 4.400 3.936 2.946 4.237 . 0 0 "[ . 1 .]" 1
1903 1 64 PHE HA 1 68 LYS QE 2.800 . 3.800 3.855 3.807 3.914 0.114 7 0 "[ . 1 .]" 1
1904 1 64 PHE QB 1 64 PHE QD 2.600 . 3.400 2.120 2.118 2.122 . 0 0 "[ . 1 .]" 1
1905 1 64 PHE QB 1 65 LEU H 2.200 . 2.800 2.835 2.816 2.856 0.056 6 0 "[ . 1 .]" 1
1906 1 64 PHE QB 1 65 LEU HA 3.400 . 5.000 4.469 4.452 4.495 . 0 0 "[ . 1 .]" 1
1907 1 64 PHE QB 1 65 LEU QB 3.900 . 5.800 4.073 4.028 4.113 . 0 0 "[ . 1 .]" 1
1908 1 64 PHE QB 1 65 LEU QB 3.000 . 4.100 3.997 3.957 4.031 . 0 0 "[ . 1 .]" 1
1909 1 64 PHE QB 1 67 ARG H 5.000 . 6.000 4.996 4.909 5.071 . 0 0 "[ . 1 .]" 1
1910 1 64 PHE QD 1 65 LEU HA 3.100 . 4.300 3.730 3.675 3.797 . 0 0 "[ . 1 .]" 1
1911 1 64 PHE QD 1 65 LEU QD 3.300 . 4.700 4.714 4.710 4.723 0.023 7 0 "[ . 1 .]" 1
1912 1 64 PHE QD 1 68 LYS QE 2.800 . 3.800 2.935 2.780 3.066 . 0 0 "[ . 1 .]" 1
1913 1 64 PHE QD 1 68 LYS QG 3.600 . 5.200 4.181 3.981 4.389 . 0 0 "[ . 1 .]" 1
1914 1 64 PHE QD 1 74 ALA MB 3.800 . 5.600 4.243 3.514 4.888 . 0 0 "[ . 1 .]" 1
1915 1 65 LEU H 1 65 LEU HA 2.300 . 2.900 2.830 2.814 2.849 . 0 0 "[ . 1 .]" 1
1916 1 65 LEU H 1 65 LEU QB 1.900 . 2.300 2.093 2.076 2.117 . 0 0 "[ . 1 .]" 1
1917 1 65 LEU H 1 65 LEU QD 3.200 . 4.500 3.411 3.390 3.442 . 0 0 "[ . 1 .]" 1
1918 1 65 LEU H 1 65 LEU HG 2.400 . 3.100 3.219 3.206 3.244 0.144 12 0 "[ . 1 .]" 1
1919 1 65 LEU H 1 66 ILE H 2.300 . 2.900 2.542 2.474 2.602 . 0 0 "[ . 1 .]" 1
1920 1 65 LEU H 1 66 ILE HB 3.500 . 5.000 4.694 4.620 4.761 . 0 0 "[ . 1 .]" 1
1921 1 65 LEU H 1 66 ILE MD 4.500 . 6.000 5.173 5.126 5.254 . 0 0 "[ . 1 .]" 1
1922 1 65 LEU H 1 66 ILE QG 3.700 . 5.400 4.277 4.176 4.390 . 0 0 "[ . 1 .]" 1
1923 1 65 LEU H 1 67 ARG H 4.000 . 6.000 3.827 3.643 3.951 . 0 0 "[ . 1 .]" 1
1924 1 65 LEU H 1 80 PHE HZ 5.100 . 6.000 4.901 4.842 4.984 . 0 0 "[ . 1 .]" 1
1925 1 65 LEU HA 1 65 LEU QB 2.300 . 2.500 2.131 2.126 2.134 . 0 0 "[ . 1 .]" 1
1926 1 65 LEU HA 1 65 LEU QB 2.000 . 2.200 2.117 2.113 2.120 . 0 0 "[ . 1 .]" 1
1927 1 65 LEU HA 1 65 LEU QD 2.200 . 2.800 2.828 2.821 2.836 0.036 9 0 "[ . 1 .]" 1
1928 1 65 LEU HA 1 66 ILE H 3.000 . 4.100 3.532 3.517 3.552 . 0 0 "[ . 1 .]" 1
1929 1 65 LEU HA 1 66 ILE HA 3.300 . 4.700 4.717 4.699 4.736 0.036 4 0 "[ . 1 .]" 1
1930 1 65 LEU HA 1 66 ILE QG 4.300 . 6.000 5.252 5.141 5.355 . 0 0 "[ . 1 .]" 1
1931 1 65 LEU HA 1 67 ARG H 4.500 . 6.000 4.381 4.126 4.594 . 0 0 "[ . 1 .]" 1
1932 1 65 LEU HA 1 68 LYS QE 3.000 . 4.200 2.210 1.966 2.632 0.034 10 0 "[ . 1 .]" 1
1933 1 65 LEU HA 1 68 LYS QG 3.000 . 4.100 4.005 3.437 4.119 0.019 9 0 "[ . 1 .]" 1
1934 1 65 LEU HA 1 69 ARG H 3.400 . 4.900 4.888 4.725 4.918 0.018 13 0 "[ . 1 .]" 1
1935 1 65 LEU QB 1 65 LEU QD 2.300 . 2.800 1.876 1.865 1.883 . 0 0 "[ . 1 .]" 1
1936 1 65 LEU QB 1 65 LEU QD 2.000 . 2.500 1.674 1.667 1.678 0.033 7 0 "[ . 1 .]" 1
1937 1 65 LEU QB 1 66 ILE H 2.600 . 3.500 3.234 3.176 3.271 . 0 0 "[ . 1 .]" 1
1938 1 65 LEU QB 1 66 ILE HA 4.600 . 6.000 4.748 4.732 4.768 . 0 0 "[ . 1 .]" 1
1939 1 65 LEU QB 1 66 ILE MD 3.400 . 4.300 4.293 4.240 4.309 0.009 15 0 "[ . 1 .]" 1
1940 1 65 LEU QB 1 66 ILE QG 5.600 . 5.800 4.115 4.026 4.191 . 0 0 "[ . 1 .]" 1
1941 1 65 LEU QB 1 68 LYS QE 2.800 . 3.800 3.727 3.652 3.805 0.005 6 0 "[ . 1 .]" 1
1942 1 65 LEU QD 1 66 ILE H 3.200 . 4.500 3.098 2.971 3.195 . 0 0 "[ . 1 .]" 1
1943 1 65 LEU QD 1 66 ILE HA 2.700 . 3.600 2.718 2.533 2.873 . 0 0 "[ . 1 .]" 1
1944 1 65 LEU QD 1 66 ILE MD 3.300 . 3.300 1.970 1.960 1.983 0.040 12 0 "[ . 1 .]" 1
1945 1 65 LEU QD 1 68 LYS QB 3.800 . 5.600 4.311 4.038 4.516 . 0 0 "[ . 1 .]" 1
1946 1 65 LEU QD 1 69 ARG QD 2.700 . 3.600 3.171 2.986 3.299 . 0 0 "[ . 1 .]" 1
1947 1 65 LEU HG 1 66 ILE H 3.000 . 4.100 2.143 1.991 2.255 . 0 0 "[ . 1 .]" 1
1948 1 65 LEU HG 1 66 ILE MD 3.500 . 5.100 2.664 2.551 2.729 . 0 0 "[ . 1 .]" 1
1949 1 66 ILE H 1 66 ILE HA 2.500 . 3.300 2.858 2.840 2.878 . 0 0 "[ . 1 .]" 1
1950 1 66 ILE H 1 66 ILE HB 1.900 . 2.400 2.425 2.413 2.442 0.042 14 0 "[ . 1 .]" 1
1951 1 66 ILE H 1 66 ILE MD 2.500 . 3.300 3.333 3.304 3.352 0.052 6 0 "[ . 1 .]" 1
1952 1 66 ILE H 1 66 ILE QG 2.200 . 2.800 2.343 2.248 2.430 . 0 0 "[ . 1 .]" 1
1953 1 66 ILE H 1 66 ILE QG 2.700 . 3.600 2.320 2.231 2.401 . 0 0 "[ . 1 .]" 1
1954 1 66 ILE H 1 67 ARG H 2.300 . 2.900 2.465 2.415 2.530 . 0 0 "[ . 1 .]" 1
1955 1 66 ILE H 1 80 PHE HZ 3.500 . 5.000 3.261 3.187 3.336 . 0 0 "[ . 1 .]" 1
1956 1 66 ILE HA 1 66 ILE HB 2.800 . 3.800 3.018 3.016 3.022 . 0 0 "[ . 1 .]" 1
1957 1 66 ILE HA 1 66 ILE MD 1.900 . 2.300 1.824 1.767 1.893 . 0 0 "[ . 1 .]" 1
1958 1 66 ILE HA 1 66 ILE QG 3.100 . 3.600 2.924 2.911 2.941 . 0 0 "[ . 1 .]" 1
1959 1 66 ILE HA 1 66 ILE QG 2.100 . 2.600 2.283 2.255 2.305 . 0 0 "[ . 1 .]" 1
1960 1 66 ILE HA 1 67 ARG H 3.400 . 4.800 3.506 3.464 3.540 . 0 0 "[ . 1 .]" 1
1961 1 66 ILE HA 1 68 LYS H 4.000 . 6.000 4.246 3.788 4.454 . 0 0 "[ . 1 .]" 1
1962 1 66 ILE HA 1 69 ARG H 2.800 . 3.800 3.230 3.088 3.361 . 0 0 "[ . 1 .]" 1
1963 1 66 ILE HA 1 69 ARG HA 3.700 . 5.400 5.069 4.855 5.169 . 0 0 "[ . 1 .]" 1
1964 1 66 ILE HA 1 69 ARG QB 2.900 . 3.600 2.655 2.435 2.827 . 0 0 "[ . 1 .]" 1
1965 1 66 ILE HA 1 69 ARG QB 3.200 . 4.500 1.957 1.900 2.026 0.000 14 0 "[ . 1 .]" 1
1966 1 66 ILE HA 1 69 ARG QG 3.100 . 3.500 2.017 1.968 2.078 . 0 0 "[ . 1 .]" 1
1967 1 66 ILE HA 1 111 TYR QD 6.000 . 6.000 6.040 6.029 6.062 0.062 15 0 "[ . 1 .]" 1
1968 1 66 ILE HB 1 66 ILE MD 2.600 . 3.500 3.225 3.215 3.231 . 0 0 "[ . 1 .]" 1
1969 1 66 ILE HB 1 66 ILE QG 2.400 . 2.800 2.184 2.182 2.186 . 0 0 "[ . 1 .]" 1
1970 1 66 ILE HB 1 66 ILE QG 1.800 . 2.200 1.905 1.901 1.909 . 0 0 "[ . 1 .]" 1
1971 1 66 ILE HB 1 67 ARG H 2.600 . 3.400 2.755 2.602 2.993 . 0 0 "[ . 1 .]" 1
1972 1 66 ILE HB 1 67 ARG QB 3.000 . 6.000 4.504 4.353 4.725 . 0 0 "[ . 1 .]" 1
1973 1 66 ILE HB 1 78 LEU QD 2.800 . 3.400 2.423 2.280 2.603 . 0 0 "[ . 1 .]" 1
1974 1 66 ILE HB 1 80 PHE QE 2.900 . 4.000 2.768 2.712 2.850 . 0 0 "[ . 1 .]" 1
1975 1 66 ILE HB 1 80 PHE HZ 2.600 . 3.400 2.006 1.952 2.169 . 0 0 "[ . 1 .]" 1
1976 1 66 ILE MD 1 66 ILE QG 1.800 . 2.200 1.777 1.755 1.793 . 0 0 "[ . 1 .]" 1
1977 1 66 ILE MD 1 67 ARG H 3.600 . 5.200 4.595 4.582 4.607 . 0 0 "[ . 1 .]" 1
1978 1 66 ILE MD 1 69 ARG H 4.200 . 6.000 4.512 4.352 4.633 . 0 0 "[ . 1 .]" 1
1979 1 66 ILE MD 1 69 ARG QB 3.700 . 4.800 3.192 3.082 3.364 . 0 0 "[ . 1 .]" 1
1980 1 66 ILE MD 1 69 ARG QD 2.500 . 3.300 3.344 3.323 3.388 0.088 12 0 "[ . 1 .]" 1
1981 1 66 ILE MD 1 69 ARG QG 2.900 . 4.000 2.370 2.070 2.543 . 0 0 "[ . 1 .]" 1
1982 1 66 ILE MD 1 80 PHE HZ 3.000 . 6.000 3.717 3.654 3.831 . 0 0 "[ . 1 .]" 1
1983 1 66 ILE QG 1 67 ARG H 3.000 . 4.200 3.325 3.227 3.450 . 0 0 "[ . 1 .]" 1
1984 1 66 ILE QG 1 67 ARG HA 3.100 . 4.300 3.538 3.464 3.593 . 0 0 "[ . 1 .]" 1
1985 1 66 ILE QG 1 68 LYS H 4.500 . 6.000 4.703 4.391 4.838 . 0 0 "[ . 1 .]" 1
1986 1 66 ILE QG 1 69 ARG H 5.000 . 6.000 4.098 3.955 4.236 . 0 0 "[ . 1 .]" 1
1987 1 66 ILE QG 1 69 ARG QB 3.300 . 4.700 2.669 2.441 2.786 . 0 0 "[ . 1 .]" 1
1988 1 66 ILE QG 1 69 ARG QD 3.200 . 4.500 4.374 4.312 4.482 . 0 0 "[ . 1 .]" 1
1989 1 66 ILE QG 1 69 ARG QG 5.400 . 6.000 3.280 3.091 3.405 . 0 0 "[ . 1 .]" 1
1990 1 66 ILE QG 1 70 ILE H 3.900 . 5.800 3.995 3.840 4.151 . 0 0 "[ . 1 .]" 1
1991 1 66 ILE QG 1 70 ILE QG 3.300 . 4.700 2.389 2.179 2.558 . 0 0 "[ . 1 .]" 1
1992 1 66 ILE QG 1 70 ILE QG 2.400 . 3.100 2.347 2.142 2.508 . 0 0 "[ . 1 .]" 1
1993 1 66 ILE QG 1 78 LEU QB 3.200 . 4.500 4.512 4.507 4.521 0.021 7 0 "[ . 1 .]" 1
1994 1 66 ILE QG 1 78 LEU QD 3.200 . 4.500 2.053 1.996 2.101 . 0 0 "[ . 1 .]" 1
1995 1 66 ILE QG 1 80 PHE QD 3.400 . 4.800 3.660 3.625 3.700 . 0 0 "[ . 1 .]" 1
1996 1 66 ILE QG 1 80 PHE QE 2.200 . 2.800 2.021 1.949 2.063 . 0 0 "[ . 1 .]" 1
1997 1 66 ILE QG 1 80 PHE HZ 2.700 . 3.600 2.016 1.937 2.133 . 0 0 "[ . 1 .]" 1
1998 1 66 ILE QG 1 111 TYR QB 3.200 . 4.400 2.752 2.654 2.816 . 0 0 "[ . 1 .]" 1
1999 1 66 ILE QG 1 111 TYR QD 2.700 . 3.600 2.786 2.744 2.831 . 0 0 "[ . 1 .]" 1
2000 1 66 ILE QG 1 112 SER H 5.100 . 6.000 5.850 5.737 5.896 . 0 0 "[ . 1 .]" 1
2001 1 66 ILE QG 1 67 ARG H 4.200 . 5.400 4.115 4.014 4.237 . 0 0 "[ . 1 .]" 1
2002 1 66 ILE QG 1 78 LEU QD 4.700 . 6.000 3.726 3.623 3.801 . 0 0 "[ . 1 .]" 1
2003 1 66 ILE QG 1 80 PHE QE . . 3.300 2.442 2.365 2.583 . 0 0 "[ . 1 .]" 1
2004 1 66 ILE QG 1 80 PHE HZ 2.600 . 3.400 2.039 1.952 2.168 . 0 0 "[ . 1 .]" 1
2005 1 67 ARG H 1 67 ARG HA 2.200 . 2.800 2.749 2.722 2.797 . 0 0 "[ . 1 .]" 1
2006 1 67 ARG H 1 67 ARG QB 1.900 . 2.300 2.081 2.029 2.316 0.016 7 0 "[ . 1 .]" 1
2007 1 67 ARG H 1 67 ARG QD 3.500 . 5.000 3.327 3.060 4.212 . 0 0 "[ . 1 .]" 1
2008 1 67 ARG H 1 67 ARG QG 2.900 . 4.000 3.380 2.287 3.625 . 0 0 "[ . 1 .]" 1
2009 1 67 ARG H 1 68 LYS H 2.400 . 3.100 2.912 2.746 3.049 . 0 0 "[ . 1 .]" 1
2010 1 67 ARG H 1 68 LYS QB 4.000 . 6.000 5.001 4.864 5.093 . 0 0 "[ . 1 .]" 1
2011 1 67 ARG H 1 69 ARG H 4.500 . 6.000 4.259 3.942 4.432 . 0 0 "[ . 1 .]" 1
2012 1 67 ARG H 1 70 ILE MD 4.500 . 6.000 3.947 3.839 4.101 . 0 0 "[ . 1 .]" 1
2013 1 67 ARG H 1 72 LEU QD 3.800 . 5.600 4.994 4.745 5.311 . 0 0 "[ . 1 .]" 1
2014 1 67 ARG H 1 78 LEU QD 3.700 . 5.400 2.827 2.673 3.012 . 0 0 "[ . 1 .]" 1
2015 1 67 ARG H 1 80 PHE HZ 4.400 . 6.000 4.316 4.126 4.500 . 0 0 "[ . 1 .]" 1
2016 1 67 ARG HA 1 67 ARG QB 2.500 . 3.300 2.533 2.416 2.550 . 0 0 "[ . 1 .]" 1
2017 1 67 ARG HA 1 67 ARG QD 2.800 . 3.700 3.563 3.443 3.760 0.060 7 0 "[ . 1 .]" 1
2018 1 67 ARG HA 1 67 ARG QG . . 2.800 2.043 2.012 2.217 . 0 0 "[ . 1 .]" 1
2019 1 67 ARG HA 1 68 LYS H 2.900 . 4.000 3.559 3.485 3.581 . 0 0 "[ . 1 .]" 1
2020 1 67 ARG HA 1 70 ILE HB 3.100 . 4.300 4.328 4.305 4.349 0.049 8 0 "[ . 1 .]" 1
2021 1 67 ARG HA 1 70 ILE MD 2.300 . 3.000 2.024 1.903 2.250 . 0 0 "[ . 1 .]" 1
2022 1 67 ARG HA 1 70 ILE QG 3.100 . 3.100 2.330 2.254 2.445 . 0 0 "[ . 1 .]" 1
2023 1 67 ARG HA 1 70 ILE QG 4.300 . 6.000 2.325 2.250 2.439 . 0 0 "[ . 1 .]" 1
2024 1 67 ARG HA 1 72 LEU H 2.900 . 3.900 3.739 3.439 3.878 . 0 0 "[ . 1 .]" 1
2025 1 67 ARG HA 1 72 LEU QB . . 2.800 2.374 2.180 2.803 0.003 7 0 "[ . 1 .]" 1
2026 1 67 ARG HA 1 72 LEU QD 2.300 . 3.000 2.860 2.405 3.060 0.060 1 0 "[ . 1 .]" 1
2027 1 67 ARG HA 1 78 LEU QD 2.700 . 3.000 2.010 1.924 2.124 . 0 0 "[ . 1 .]" 1
2028 1 67 ARG QB 1 67 ARG QD 1.900 . 2.200 2.117 2.059 2.257 0.057 3 0 "[ . 1 .]" 1
2029 1 67 ARG QB 1 67 ARG QG 2.000 . 2.500 2.039 2.032 2.077 . 0 0 "[ . 1 .]" 1
2030 1 67 ARG QB 1 68 LYS H 2.300 . 2.900 2.651 2.505 2.905 0.005 7 0 "[ . 1 .]" 1
2031 1 67 ARG QB 1 74 ALA HA 3.800 . 5.700 4.485 3.723 4.973 . 0 0 "[ . 1 .]" 1
2032 1 67 ARG QB 1 78 LEU QD 3.500 . 5.000 3.031 2.772 3.257 . 0 0 "[ . 1 .]" 1
2033 1 67 ARG QD 1 68 LYS H 5.000 . 6.000 4.885 4.626 5.339 . 0 0 "[ . 1 .]" 1
2034 1 67 ARG QD 1 68 LYS QG 4.700 . 6.000 5.228 4.986 5.714 . 0 0 "[ . 1 .]" 1
2035 1 67 ARG QD 1 72 LEU HA 4.100 . 6.000 6.021 5.517 6.091 0.091 2 0 "[ . 1 .]" 1
2036 1 67 ARG QD 1 72 LEU QB 2.900 . 3.900 3.588 2.954 3.742 . 0 0 "[ . 1 .]" 1
2037 1 67 ARG QD 1 72 LEU QD 4.900 . 6.000 4.037 2.947 4.928 . 0 0 "[ . 1 .]" 1
2038 1 67 ARG QD 1 74 ALA HA 2.800 . 3.800 3.129 2.449 3.579 . 0 0 "[ . 1 .]" 1
2039 1 67 ARG QD 1 74 ALA MB 3.100 . 4.300 4.200 3.655 4.326 0.026 5 0 "[ . 1 .]" 1
2040 1 67 ARG QD 1 78 LEU QB 3.800 . 5.700 2.978 2.574 3.356 . 0 0 "[ . 1 .]" 1
2041 1 67 ARG QD 1 78 LEU QD 3.000 . 4.100 2.065 1.921 2.926 . 0 0 "[ . 1 .]" 1
2042 1 67 ARG QG 1 68 LYS H 3.600 . 5.200 4.374 4.272 4.497 . 0 0 "[ . 1 .]" 1
2043 1 67 ARG QG 1 70 ILE MD 3.400 . 4.900 2.797 2.638 2.978 . 0 0 "[ . 1 .]" 1
2044 1 67 ARG QG 1 72 LEU H 6.000 . 6.000 3.990 3.594 5.073 . 0 0 "[ . 1 .]" 1
2045 1 67 ARG QG 1 72 LEU QB 3.100 . 3.800 1.948 1.838 3.118 0.062 8 0 "[ . 1 .]" 1
2046 1 67 ARG QG 1 74 ALA H 4.800 . 6.000 3.201 2.163 5.128 . 0 0 "[ . 1 .]" 1
2047 1 67 ARG QG 1 74 ALA HA 3.500 . 5.000 3.713 2.894 4.800 . 0 0 "[ . 1 .]" 1
2048 1 68 LYS H 1 68 LYS HA 2.400 . 3.100 2.836 2.812 2.898 . 0 0 "[ . 1 .]" 1
2049 1 68 LYS H 1 68 LYS QB 2.000 . 2.500 2.522 2.454 2.568 0.068 13 0 "[ . 1 .]" 1
2050 1 68 LYS H 1 68 LYS QE 3.800 . 5.600 3.265 2.816 3.921 . 0 0 "[ . 1 .]" 1
2051 1 68 LYS H 1 68 LYS QG 2.500 . 3.300 2.120 1.963 2.256 . 0 0 "[ . 1 .]" 1
2052 1 68 LYS H 1 69 ARG H 2.200 . 2.800 2.601 2.357 2.695 . 0 0 "[ . 1 .]" 1
2053 1 68 LYS H 1 70 ILE QG 5.200 . 6.000 4.084 3.835 4.189 . 0 0 "[ . 1 .]" 1
2054 1 68 LYS H 1 72 LEU H 4.000 . 6.000 4.233 4.046 4.531 . 0 0 "[ . 1 .]" 1
2055 1 68 LYS HA 1 68 LYS QB 1.900 . 2.300 2.329 2.311 2.361 0.061 5 0 "[ . 1 .]" 1
2056 1 68 LYS HA 1 68 LYS QE 4.800 . 6.000 4.672 4.442 4.927 . 0 0 "[ . 1 .]" 1
2057 1 68 LYS HA 1 68 LYS QG 2.300 . 3.000 2.536 2.477 2.556 . 0 0 "[ . 1 .]" 1
2058 1 68 LYS HA 1 71 HIS HA 2.300 . 3.000 3.001 2.845 3.025 0.025 13 0 "[ . 1 .]" 1
2059 1 68 LYS HA 1 72 LEU H 3.400 . 4.900 2.743 2.446 3.145 . 0 0 "[ . 1 .]" 1
2060 1 68 LYS QB 1 68 LYS QD 2.100 . 2.700 2.096 2.049 2.141 . 0 0 "[ . 1 .]" 1
2061 1 68 LYS QB 1 68 LYS QE 3.900 . 5.800 3.087 2.431 3.691 . 0 0 "[ . 1 .]" 1
2062 1 68 LYS QB 1 68 LYS QG 2.100 . 2.600 2.059 2.031 2.080 . 0 0 "[ . 1 .]" 1
2063 1 68 LYS QB 1 69 ARG H 2.200 . 2.800 2.483 2.340 2.665 . 0 0 "[ . 1 .]" 1
2064 1 68 LYS QB 1 69 ARG QG 2.700 . 3.600 3.136 3.002 3.373 . 0 0 "[ . 1 .]" 1
2065 1 68 LYS QB 1 71 HIS HA 5.300 . 6.000 4.541 4.464 4.684 . 0 0 "[ . 1 .]" 1
2066 1 68 LYS QD 1 68 LYS QG 2.000 . 2.400 2.056 2.029 2.091 . 0 0 "[ . 1 .]" 1
2067 1 68 LYS QD 1 69 ARG H 3.200 . 4.500 4.244 3.678 4.563 0.063 5 0 "[ . 1 .]" 1
2068 1 68 LYS QE 1 68 LYS QG 2.800 . 3.400 2.189 2.065 2.331 . 0 0 "[ . 1 .]" 1
2069 1 68 LYS QG 1 69 ARG H 3.700 . 4.700 3.998 3.925 4.079 . 0 0 "[ . 1 .]" 1
2070 1 69 ARG H 1 69 ARG HA 2.700 . 3.600 2.772 2.739 2.795 . 0 0 "[ . 1 .]" 1
2071 1 69 ARG H 1 69 ARG QB 2.100 . 2.700 2.568 2.454 2.600 . 0 0 "[ . 1 .]" 1
2072 1 69 ARG H 1 69 ARG QD 3.200 . 4.000 3.985 3.800 4.023 0.023 8 0 "[ . 1 .]" 1
2073 1 69 ARG H 1 69 ARG QG 2.200 . 2.700 2.016 1.960 2.122 . 0 0 "[ . 1 .]" 1
2074 1 69 ARG HA 1 69 ARG QB 2.300 . 2.900 2.335 2.314 2.388 . 0 0 "[ . 1 .]" 1
2075 1 69 ARG HA 1 69 ARG QB 1.900 . 2.300 2.185 2.173 2.230 . 0 0 "[ . 1 .]" 1
2076 1 69 ARG HA 1 69 ARG QD 2.300 . 2.900 2.916 2.892 2.968 0.068 12 0 "[ . 1 .]" 1
2077 1 69 ARG HA 1 69 ARG QG 2.100 . 2.600 2.629 2.595 2.707 0.107 15 0 "[ . 1 .]" 1
2078 1 69 ARG HA 1 70 ILE H 2.700 . 3.600 3.444 3.418 3.479 . 0 0 "[ . 1 .]" 1
2079 1 69 ARG QB 1 69 ARG QD 2.500 . 3.100 2.121 1.979 2.827 . 0 0 "[ . 1 .]" 1
2080 1 69 ARG QB 1 69 ARG QG 2.100 . 2.600 2.021 2.010 2.023 . 0 0 "[ . 1 .]" 1
2081 1 69 ARG QB 1 71 HIS H 5.200 . 6.000 4.349 4.309 4.394 . 0 0 "[ . 1 .]" 1
2082 1 69 ARG QB 1 71 HIS HD1 3.600 . 5.200 5.022 4.496 5.219 0.019 5 0 "[ . 1 .]" 1
2083 1 69 ARG QB 1 70 ILE H 2.700 . 3.600 2.945 2.809 3.035 . 0 0 "[ . 1 .]" 1
2084 1 69 ARG QB 1 70 ILE QG 2.500 . 3.300 2.938 2.839 3.019 . 0 0 "[ . 1 .]" 1
2085 1 69 ARG QB 1 70 ILE QG 3.400 . 4.700 2.849 2.766 2.922 . 0 0 "[ . 1 .]" 1
2086 1 69 ARG QD 1 69 ARG QG 1.800 . 2.200 2.031 1.897 2.065 . 0 0 "[ . 1 .]" 1
2087 1 70 ILE H 1 70 ILE HA 2.600 . 3.400 2.940 2.934 2.945 . 0 0 "[ . 1 .]" 1
2088 1 70 ILE H 1 70 ILE MD 2.900 . 3.900 3.531 3.471 3.594 . 0 0 "[ . 1 .]" 1
2089 1 70 ILE H 1 70 ILE QG 2.200 . 2.600 1.764 1.699 1.841 . 0 0 "[ . 1 .]" 1
2090 1 70 ILE H 1 70 ILE QG 2.200 . 2.800 1.759 1.696 1.835 . 0 0 "[ . 1 .]" 1
2091 1 70 ILE H 1 72 LEU H 4.000 . 6.000 3.679 3.476 3.933 . 0 0 "[ . 1 .]" 1
2092 1 70 ILE HA 1 70 ILE HB 2.600 . 3.400 2.779 2.737 2.803 . 0 0 "[ . 1 .]" 1
2093 1 70 ILE HA 1 70 ILE MD 3.100 . 4.300 4.152 4.141 4.158 . 0 0 "[ . 1 .]" 1
2094 1 70 ILE HA 1 70 ILE QG 2.900 . 3.100 3.136 3.118 3.164 0.064 8 0 "[ . 1 .]" 1
2095 1 70 ILE HA 1 70 ILE QG 2.200 . 2.800 1.921 1.904 1.939 . 0 0 "[ . 1 .]" 1
2096 1 70 ILE HA 1 71 HIS QB 4.100 . 6.000 4.352 4.215 4.467 . 0 0 "[ . 1 .]" 1
2097 1 70 ILE HA 1 71 HIS HD1 3.400 . 4.800 3.207 2.574 4.185 . 0 0 "[ . 1 .]" 1
2098 1 70 ILE HB 1 70 ILE MD 2.000 . 2.500 2.275 2.207 2.349 . 0 0 "[ . 1 .]" 1
2099 1 70 ILE HB 1 70 ILE QG 2.400 . 2.700 2.446 2.420 2.466 . 0 0 "[ . 1 .]" 1
2100 1 70 ILE HB 1 70 ILE QG 1.900 . 2.300 1.978 1.969 1.989 . 0 0 "[ . 1 .]" 1
2101 1 70 ILE HB 1 72 LEU H 3.700 . 5.400 4.377 4.153 4.540 . 0 0 "[ . 1 .]" 1
2102 1 70 ILE HB 1 72 LEU QD 2.800 . 3.800 2.325 1.767 2.807 0.033 5 0 "[ . 1 .]" 1
2103 1 70 ILE MD 1 70 ILE QG 2.200 . 2.300 1.854 1.848 1.867 . 0 0 "[ . 1 .]" 1
2104 1 70 ILE MD 1 70 ILE QG 2.000 . 2.500 1.781 1.761 1.792 . 0 0 "[ . 1 .]" 1
2105 1 70 ILE MD 1 72 LEU H 3.000 . 4.100 4.141 4.108 4.172 0.072 7 0 "[ . 1 .]" 1
2106 1 70 ILE MD 1 72 LEU QB 3.300 . 4.100 2.756 2.645 3.257 . 0 0 "[ . 1 .]" 1
2107 1 70 ILE MD 1 72 LEU QD 1.800 . 2.200 1.790 1.659 2.159 . 0 0 "[ . 1 .]" 1
2108 1 70 ILE MD 1 72 LEU HG 3.100 . 4.300 2.590 1.982 3.995 . 0 0 "[ . 1 .]" 1
2109 1 70 ILE MD 1 78 LEU HA 4.100 . 6.000 4.116 3.957 4.356 . 0 0 "[ . 1 .]" 1
2110 1 70 ILE MD 1 111 TYR QD 2.700 . 3.600 2.748 2.495 2.858 . 0 0 "[ . 1 .]" 1
2111 1 70 ILE MD 1 111 TYR QE 2.200 . 2.800 2.751 2.509 2.822 0.022 14 0 "[ . 1 .]" 1
2112 1 70 ILE QG 1 71 HIS H 3.700 . 5.400 3.019 2.771 3.196 . 0 0 "[ . 1 .]" 1
2113 1 70 ILE QG 1 72 LEU H 3.800 . 5.600 3.556 3.439 3.646 . 0 0 "[ . 1 .]" 1
2114 1 70 ILE QG 1 111 TYR QD 3.700 . 5.400 3.320 3.238 3.389 . 0 0 "[ . 1 .]" 1
2115 1 70 ILE QG 1 111 TYR QE 2.700 . 3.600 1.828 1.785 1.849 0.015 3 0 "[ . 1 .]" 1
2116 1 70 ILE QG 1 71 HIS H 3.400 . 4.900 3.075 2.802 3.275 . 0 0 "[ . 1 .]" 1
2117 1 70 ILE QG 1 72 LEU H . . 4.000 3.601 3.479 3.700 . 0 0 "[ . 1 .]" 1
2118 1 70 ILE QG 1 78 LEU QD 2.900 . 4.000 2.900 2.818 2.961 . 0 0 "[ . 1 .]" 1
2119 1 70 ILE QG 1 111 TYR QE 5.500 . 6.000 3.576 3.329 3.773 . 0 0 "[ . 1 .]" 1
2120 1 71 HIS H 1 71 HIS HA 1.900 . 2.300 2.263 2.252 2.280 . 0 0 "[ . 1 .]" 1
2121 1 71 HIS H 1 71 HIS QB 2.900 . 3.600 3.455 3.394 3.505 . 0 0 "[ . 1 .]" 1
2122 1 71 HIS H 1 71 HIS HD1 4.600 . 6.000 2.753 2.245 3.484 . 0 0 "[ . 1 .]" 1
2123 1 71 HIS H 1 72 LEU H 2.000 . 2.500 2.528 2.508 2.555 0.055 6 0 "[ . 1 .]" 1
2124 1 71 HIS HA 1 71 HIS QB 2.200 . 2.300 2.320 2.282 2.365 0.065 15 0 "[ . 1 .]" 1
2125 1 71 HIS HA 1 71 HIS HD1 3.400 . 4.800 2.963 2.430 3.366 . 0 0 "[ . 1 .]" 1
2126 1 71 HIS HA 1 72 LEU H 2.000 . 2.500 2.550 2.537 2.567 0.067 12 0 "[ . 1 .]" 1
2127 1 71 HIS HA 1 72 LEU QB 3.800 . 5.600 4.812 4.638 4.894 . 0 0 "[ . 1 .]" 1
2128 1 71 HIS HA 1 72 LEU QB 3.400 . 4.900 4.415 4.246 4.676 . 0 0 "[ . 1 .]" 1
2129 1 71 HIS HA 1 73 ARG H 4.300 . 6.000 5.706 5.103 6.032 0.032 3 0 "[ . 1 .]" 1
2130 1 71 HIS QB 1 71 HIS HD1 2.700 . 3.600 2.415 2.313 2.551 . 0 0 "[ . 1 .]" 1
2131 1 71 HIS QB 1 72 LEU H 4.800 . 6.000 3.884 3.869 3.900 . 0 0 "[ . 1 .]" 1
2132 1 72 LEU H 1 72 LEU HA 2.300 . 3.000 2.947 2.943 2.951 . 0 0 "[ . 1 .]" 1
2133 1 72 LEU H 1 72 LEU QB . . 2.600 2.514 2.304 2.613 0.013 15 0 "[ . 1 .]" 1
2134 1 72 LEU H 1 72 LEU QB 1.900 . 2.400 2.424 2.295 2.493 0.093 8 0 "[ . 1 .]" 1
2135 1 72 LEU H 1 72 LEU QD 2.600 . 3.500 3.013 2.323 3.510 0.010 6 0 "[ . 1 .]" 1
2136 1 72 LEU H 1 72 LEU HG 3.300 . 4.700 3.536 2.978 4.447 . 0 0 "[ . 1 .]" 1
2137 1 72 LEU H 1 73 ARG H 3.800 . 5.600 4.329 4.027 4.495 . 0 0 "[ . 1 .]" 1
2138 1 72 LEU HA 1 72 LEU QB 2.400 . 2.600 2.383 2.335 2.478 . 0 0 "[ . 1 .]" 1
2139 1 72 LEU HA 1 72 LEU QD 2.500 . 2.500 1.957 1.763 2.523 0.023 14 0 "[ . 1 .]" 1
2140 1 72 LEU HA 1 72 LEU HG 4.100 . 6.000 3.306 2.284 3.754 . 0 0 "[ . 1 .]" 1
2141 1 72 LEU HA 1 73 ARG H 1.800 . 2.200 2.200 2.145 2.238 0.038 3 0 "[ . 1 .]" 1
2142 1 72 LEU HA 1 76 ASP H 4.200 . 6.000 4.604 4.149 5.124 . 0 0 "[ . 1 .]" 1
2143 1 72 LEU HA 1 76 ASP QB 4.200 . 6.000 2.635 2.354 2.975 . 0 0 "[ . 1 .]" 1
2144 1 72 LEU HA 1 77 ALA H 4.300 . 6.000 5.970 5.668 6.040 0.040 3 0 "[ . 1 .]" 1
2145 1 72 LEU QB 1 72 LEU QD 2.100 . 2.400 1.976 1.888 2.063 . 0 0 "[ . 1 .]" 1
2146 1 72 LEU QB 1 72 LEU QD 1.800 . 2.200 1.709 1.673 1.743 . 0 0 "[ . 1 .]" 1
2147 1 72 LEU QB 1 72 LEU HG 2.600 . 3.500 2.267 2.165 2.401 . 0 0 "[ . 1 .]" 1
2148 1 72 LEU QB 1 76 ASP HA 3.300 . 4.600 4.482 4.125 4.646 0.046 8 0 "[ . 1 .]" 1
2149 1 72 LEU QB 1 76 ASP QB 2.400 . 3.100 1.934 1.743 2.180 . 0 0 "[ . 1 .]" 1
2150 1 72 LEU QB 1 78 LEU HA 3.900 . 5.800 5.010 4.140 5.386 . 0 0 "[ . 1 .]" 1
2151 1 72 LEU QB 1 73 ARG H 2.800 . 3.800 3.122 2.817 3.573 . 0 0 "[ . 1 .]" 1
2152 1 72 LEU QB 1 73 ARG QD 3.000 . 4.100 4.070 3.852 4.165 0.065 1 0 "[ . 1 .]" 1
2153 1 72 LEU QB 1 74 ALA H 5.000 . 6.000 3.731 2.659 5.621 . 0 0 "[ . 1 .]" 1
2154 1 72 LEU QB 1 74 ALA HA 3.500 . 5.100 4.659 3.896 5.173 0.073 6 0 "[ . 1 .]" 1
2155 1 72 LEU QB 1 76 ASP H 3.700 . 5.400 3.889 3.538 4.376 . 0 0 "[ . 1 .]" 1
2156 1 72 LEU QB 1 76 ASP QB 2.300 . 2.800 1.993 1.810 2.208 . 0 0 "[ . 1 .]" 1
2157 1 72 LEU QD 1 72 LEU HG 1.900 . 2.300 1.872 1.865 1.881 . 0 0 "[ . 1 .]" 1
2158 1 72 LEU QD 1 73 ARG H 2.800 . 3.800 3.445 2.961 3.833 0.033 3 0 "[ . 1 .]" 1
2159 1 72 LEU QD 1 76 ASP H 3.600 . 5.200 4.211 4.007 4.470 . 0 0 "[ . 1 .]" 1
2160 1 72 LEU QD 1 76 ASP HA 3.500 . 3.800 3.777 3.600 3.834 0.034 14 0 "[ . 1 .]" 1
2161 1 72 LEU QD 1 76 ASP QB 2.400 . 2.800 1.840 1.761 1.913 . 0 0 "[ . 1 .]" 1
2162 1 72 LEU QD 1 77 ALA H 3.400 . 4.900 3.172 2.849 3.395 . 0 0 "[ . 1 .]" 1
2163 1 72 LEU QD 1 77 ALA HA 4.300 . 4.600 4.267 3.654 4.660 0.060 1 0 "[ . 1 .]" 1
2164 1 72 LEU QD 1 78 LEU H 4.800 . 6.000 4.383 3.788 5.070 . 0 0 "[ . 1 .]" 1
2165 1 72 LEU QD 1 111 TYR QE 3.200 . 4.200 4.181 3.837 4.229 0.029 2 0 "[ . 1 .]" 1
2166 1 72 LEU QD 1 113 ASP QB 3.500 . 5.100 3.979 3.378 4.274 . 0 0 "[ . 1 .]" 1
2167 1 72 LEU HG 1 73 ARG H 4.700 . 6.000 5.043 3.451 5.683 . 0 0 "[ . 1 .]" 1
2168 1 73 ARG H 1 73 ARG HA 2.400 . 3.100 2.913 2.839 2.950 . 0 0 "[ . 1 .]" 1
2169 1 73 ARG H 1 73 ARG QB 2.600 . 3.100 2.985 2.740 3.133 0.033 13 0 "[ . 1 .]" 1
2170 1 73 ARG H 1 73 ARG QD 4.200 . 5.200 2.075 1.990 2.343 0.010 14 0 "[ . 1 .]" 1
2171 1 73 ARG H 1 73 ARG QG 2.300 . 2.400 2.104 1.832 2.308 . 0 0 "[ . 1 .]" 1
2172 1 73 ARG H 1 75 GLU H 3.500 . 5.000 4.543 4.111 4.993 . 0 0 "[ . 1 .]" 1
2173 1 73 ARG H 1 76 ASP H 3.400 . 4.800 3.256 2.904 3.754 . 0 0 "[ . 1 .]" 1
2174 1 73 ARG H 1 76 ASP QB 3.000 . 3.900 2.377 1.894 3.050 0.006 1 0 "[ . 1 .]" 1
2175 1 73 ARG HA 1 73 ARG QB 2.100 . 2.500 2.162 2.155 2.170 . 0 0 "[ . 1 .]" 1
2176 1 73 ARG HA 1 73 ARG QD 2.800 . 3.800 3.419 3.039 3.619 . 0 0 "[ . 1 .]" 1
2177 1 73 ARG HA 1 73 ARG QG 2.600 . 3.500 3.462 3.405 3.532 0.032 11 0 "[ . 1 .]" 1
2178 1 73 ARG HA 1 74 ALA H 2.700 . 3.600 2.543 2.379 2.768 . 0 0 "[ . 1 .]" 1
2179 1 73 ARG HA 1 74 ALA HA 3.400 . 4.900 4.554 4.280 4.740 . 0 0 "[ . 1 .]" 1
2180 1 73 ARG HA 1 74 ALA MB 3.200 2.100 4.300 3.818 3.670 4.168 . 0 0 "[ . 1 .]" 1
2181 1 73 ARG HA 1 75 GLU H 4.100 . 6.000 4.511 4.181 4.730 . 0 0 "[ . 1 .]" 1
2182 1 73 ARG HA 1 75 GLU QB 4.300 . 6.000 5.622 5.369 5.756 . 0 0 "[ . 1 .]" 1
2183 1 73 ARG QB 1 73 ARG QD 2.500 . 3.000 2.275 2.043 2.548 . 0 0 "[ . 1 .]" 1
2184 1 73 ARG QB 1 73 ARG QG 1.900 . 2.300 2.001 1.946 2.020 . 0 0 "[ . 1 .]" 1
2185 1 73 ARG QB 1 74 ALA H 4.200 . 6.000 3.671 2.465 4.021 . 0 0 "[ . 1 .]" 1
2186 1 73 ARG QB 1 74 ALA MB 3.900 . 5.800 3.751 3.594 3.973 . 0 0 "[ . 1 .]" 1
2187 1 73 ARG QB 1 75 GLU H 2.900 . 3.900 3.544 2.462 3.913 0.013 15 0 "[ . 1 .]" 1
2188 1 73 ARG QB 1 76 ASP H 3.300 . 4.700 4.351 3.074 4.721 0.021 12 0 "[ . 1 .]" 1
2189 1 73 ARG QB 1 76 ASP QB 4.700 . 6.000 4.602 3.808 5.047 . 0 0 "[ . 1 .]" 1
2190 1 73 ARG QD 1 73 ARG QG 1.900 . 2.200 2.052 2.014 2.085 . 0 0 "[ . 1 .]" 1
2191 1 73 ARG QD 1 75 GLU H 5.000 . 6.000 4.229 1.889 5.590 0.011 2 0 "[ . 1 .]" 1
2192 1 73 ARG QG 1 74 ALA H 5.100 . 6.000 4.405 4.019 4.733 . 0 0 "[ . 1 .]" 1
2193 1 73 ARG QG 1 75 GLU H 2.800 . 3.800 3.726 3.508 3.951 0.151 2 0 "[ . 1 .]" 1
2194 1 73 ARG QG 1 76 ASP H 5.100 . 6.000 3.373 2.483 4.140 . 0 0 "[ . 1 .]" 1
2195 1 73 ARG QG 1 76 ASP QB 4.300 . 6.000 3.455 2.292 4.243 . 0 0 "[ . 1 .]" 1
2196 1 74 ALA H 1 74 ALA MB 3.100 . 4.300 2.732 2.068 2.951 . 0 0 "[ . 1 .]" 1
2197 1 74 ALA HA 1 74 ALA MB 1.800 . 2.200 2.104 2.089 2.126 . 0 0 "[ . 1 .]" 1
2198 1 74 ALA HA 1 75 GLU H 3.100 . 4.300 3.560 3.490 3.606 . 0 0 "[ . 1 .]" 1
2199 1 74 ALA HA 1 75 GLU HA 3.400 . 4.800 4.776 4.693 4.813 0.013 3 0 "[ . 1 .]" 1
2200 1 74 ALA HA 1 76 ASP H 4.400 . 6.000 4.087 3.911 4.387 . 0 0 "[ . 1 .]" 1
2201 1 74 ALA MB 1 75 GLU H 2.500 . 3.300 2.244 1.963 2.746 . 0 0 "[ . 1 .]" 1
2202 1 74 ALA MB 1 75 GLU HA 2.800 . 3.700 3.672 3.600 3.725 0.025 5 0 "[ . 1 .]" 1
2203 1 74 ALA MB 1 75 GLU QB 2.900 . 4.000 4.021 3.984 4.101 0.101 6 0 "[ . 1 .]" 1
2204 1 74 ALA MB 1 75 GLU QG 2.800 . 3.800 3.271 2.950 3.611 . 0 0 "[ . 1 .]" 1
2205 1 74 ALA MB 1 76 ASP H 3.500 . 5.000 4.148 3.972 4.513 . 0 0 "[ . 1 .]" 1
2206 1 75 GLU H 1 75 GLU HA 2.300 . 3.000 2.777 2.727 2.849 . 0 0 "[ . 1 .]" 1
2207 1 75 GLU H 1 75 GLU QB 2.200 . 2.800 2.336 2.098 2.486 . 0 0 "[ . 1 .]" 1
2208 1 75 GLU H 1 75 GLU QG 2.600 . 3.400 2.551 2.185 3.062 . 0 0 "[ . 1 .]" 1
2209 1 75 GLU H 1 76 ASP H 2.300 . 3.000 2.695 2.494 2.823 . 0 0 "[ . 1 .]" 1
2210 1 75 GLU HA 1 75 GLU QB 2.100 . 2.400 2.431 2.393 2.497 0.097 1 0 "[ . 1 .]" 1
2211 1 75 GLU HA 1 75 GLU QG . . 2.500 2.290 2.090 2.502 0.002 4 0 "[ . 1 .]" 1
2212 1 75 GLU HA 1 76 ASP H 3.000 . 4.100 3.472 3.424 3.514 . 0 0 "[ . 1 .]" 1
2213 1 75 GLU QB 1 75 GLU QG 1.800 . 2.200 2.039 2.016 2.086 . 0 0 "[ . 1 .]" 1
2214 1 75 GLU QB 1 76 ASP H 3.000 . 4.100 2.853 2.745 3.025 . 0 0 "[ . 1 .]" 1
2215 1 75 GLU QG 1 76 ASP H 3.200 . 4.400 4.293 4.160 4.479 0.079 5 0 "[ . 1 .]" 1
2216 1 76 ASP H 1 76 ASP HA 2.500 . 3.300 2.841 2.784 2.871 . 0 0 "[ . 1 .]" 1
2217 1 76 ASP H 1 76 ASP QB 2.000 . 2.500 2.174 2.077 2.378 . 0 0 "[ . 1 .]" 1
2218 1 76 ASP H 1 77 ALA H 3.600 2.100 5.100 4.604 4.573 4.623 . 0 0 "[ . 1 .]" 1
2219 1 76 ASP HA 1 76 ASP QB 2.300 . 2.500 2.482 2.393 2.526 0.026 8 0 "[ . 1 .]" 1
2220 1 76 ASP HA 1 77 ALA H 1.900 . 2.300 2.333 2.316 2.370 0.070 3 0 "[ . 1 .]" 1
2221 1 76 ASP HA 1 77 ALA MB 3.200 . 4.500 3.990 3.945 4.046 . 0 0 "[ . 1 .]" 1
2222 1 76 ASP QB 1 77 ALA H 2.600 . 3.100 2.723 2.307 3.081 . 0 0 "[ . 1 .]" 1
2223 1 76 ASP QB 1 77 ALA HA 4.400 . 6.000 4.352 4.227 4.516 . 0 0 "[ . 1 .]" 1
2224 1 76 ASP QB 1 77 ALA MB 3.500 . 5.100 4.252 4.018 4.499 . 0 0 "[ . 1 .]" 1
2225 1 77 ALA H 1 77 ALA HA 2.500 . 3.300 2.894 2.860 2.920 . 0 0 "[ . 1 .]" 1
2226 1 77 ALA H 1 77 ALA MB 2.000 . 2.500 2.290 2.244 2.333 . 0 0 "[ . 1 .]" 1
2227 1 77 ALA H 1 78 LEU H 3.200 . 4.500 4.529 4.517 4.541 0.041 11 0 "[ . 1 .]" 1
2228 1 77 ALA H 1 78 LEU HA 5.500 . 6.000 5.540 5.450 5.637 . 0 0 "[ . 1 .]" 1
2229 1 77 ALA H 1 79 PHE QE 4.400 . 6.000 5.479 5.309 5.626 . 0 0 "[ . 1 .]" 1
2230 1 77 ALA H 1 113 ASP QB 6.000 . 6.000 5.051 4.102 5.465 . 0 0 "[ . 1 .]" 1
2231 1 77 ALA HA 1 77 ALA MB 1.800 . 2.200 2.120 2.115 2.125 . 0 0 "[ . 1 .]" 1
2232 1 77 ALA HA 1 78 LEU H 1.800 . 2.200 2.149 2.123 2.166 . 0 0 "[ . 1 .]" 1
2233 1 77 ALA HA 1 78 LEU HA 3.500 . 5.000 4.440 4.426 4.449 . 0 0 "[ . 1 .]" 1
2234 1 77 ALA HA 1 78 LEU QB 3.800 . 5.600 3.972 3.951 4.026 . 0 0 "[ . 1 .]" 1
2235 1 77 ALA HA 1 79 PHE QE 3.000 . 4.100 3.814 3.478 4.071 . 0 0 "[ . 1 .]" 1
2236 1 77 ALA MB 1 78 LEU H 2.200 . 2.800 2.823 2.815 2.833 0.033 3 0 "[ . 1 .]" 1
2237 1 77 ALA MB 1 78 LEU HA 3.000 . 4.100 3.876 3.857 3.890 . 0 0 "[ . 1 .]" 1
2238 1 77 ALA MB 1 79 PHE QD 2.700 . 3.600 3.468 3.234 3.605 0.005 7 0 "[ . 1 .]" 1
2239 1 77 ALA MB 1 79 PHE QE 2.100 . 2.600 2.125 1.957 2.268 . 0 0 "[ . 1 .]" 1
2240 1 77 ALA MB 1 79 PHE HZ 2.900 . 3.900 3.805 3.558 3.905 0.005 3 0 "[ . 1 .]" 1
2241 1 77 ALA MB 1 113 ASP H 6.000 . 6.000 5.076 4.856 5.201 . 0 0 "[ . 1 .]" 1
2242 1 77 ALA MB 1 113 ASP HA 2.500 . 3.300 2.889 2.686 3.030 . 0 0 "[ . 1 .]" 1
2243 1 77 ALA MB 1 113 ASP QB 2.700 . 3.600 3.358 2.423 3.615 0.015 7 0 "[ . 1 .]" 1
2244 1 77 ALA MB 1 115 SER H 5.600 . 6.000 5.716 5.404 5.955 . 0 0 "[ . 1 .]" 1
2245 1 78 LEU H 1 78 LEU HA 2.700 . 3.600 2.844 2.828 2.859 . 0 0 "[ . 1 .]" 1
2246 1 78 LEU H 1 78 LEU QB 2.200 . 2.800 2.853 2.831 2.882 0.082 7 0 "[ . 1 .]" 1
2247 1 78 LEU H 1 78 LEU QD 3.400 . 4.100 4.095 4.071 4.116 0.016 7 0 "[ . 1 .]" 1
2248 1 78 LEU H 1 78 LEU HG 5.100 . 6.000 4.527 4.492 4.556 . 0 0 "[ . 1 .]" 1
2249 1 78 LEU H 1 79 PHE H 3.800 . 5.600 3.829 3.678 3.943 . 0 0 "[ . 1 .]" 1
2250 1 78 LEU HA 1 78 LEU QB 2.500 . 3.100 2.334 2.317 2.358 . 0 0 "[ . 1 .]" 1
2251 1 78 LEU HA 1 78 LEU QD . . 2.700 2.250 2.180 2.296 . 0 0 "[ . 1 .]" 1
2252 1 78 LEU HA 1 79 PHE H 2.100 . 2.600 2.149 2.138 2.169 . 0 0 "[ . 1 .]" 1
2253 1 78 LEU HA 1 79 PHE QD 4.500 . 6.000 3.337 3.146 3.486 . 0 0 "[ . 1 .]" 1
2254 1 78 LEU HA 1 112 SER H 3.500 . 5.000 4.197 4.116 4.309 . 0 0 "[ . 1 .]" 1
2255 1 78 LEU HA 1 113 ASP HA 2.500 . 3.300 2.677 2.425 2.971 . 0 0 "[ . 1 .]" 1
2256 1 78 LEU HA 1 113 ASP QB 4.700 . 6.000 4.414 4.217 4.700 . 0 0 "[ . 1 .]" 1
2257 1 78 LEU QB 1 78 LEU QD 1.700 . 2.200 1.688 1.675 1.701 . 0 0 "[ . 1 .]" 1
2258 1 78 LEU QB 1 79 PHE HA 3.100 . 4.300 3.657 3.582 3.713 . 0 0 "[ . 1 .]" 1
2259 1 78 LEU QB 1 79 PHE H 3.000 . 4.100 3.870 3.784 3.926 . 0 0 "[ . 1 .]" 1
2260 1 78 LEU QB 1 80 PHE HZ 5.300 . 6.000 6.011 6.002 6.023 0.023 3 0 "[ . 1 .]" 1
2261 1 78 LEU QB 1 111 TYR QD 4.900 . 6.000 4.574 4.452 4.690 . 0 0 "[ . 1 .]" 1
2262 1 78 LEU QD 1 79 PHE H . . 2.700 2.711 2.701 2.724 0.024 8 0 "[ . 1 .]" 1
2263 1 78 LEU QD 1 79 PHE HA 4.800 . 6.000 4.192 4.095 4.268 . 0 0 "[ . 1 .]" 1
2264 1 78 LEU QD 1 80 PHE QE 2.700 . 2.700 2.725 2.714 2.741 0.041 1 0 "[ . 1 .]" 1
2265 1 78 LEU QD 1 80 PHE HZ 2.900 . 3.900 3.241 3.123 3.334 . 0 0 "[ . 1 .]" 1
2266 1 78 LEU QD 1 111 TYR QB 2.300 . 2.800 1.802 1.777 1.899 0.023 14 0 "[ . 1 .]" 1
2267 1 78 LEU QD 1 112 SER H . . 3.400 3.108 2.914 3.334 . 0 0 "[ . 1 .]" 1
2268 1 78 LEU QD 1 113 ASP HA 3.300 . 4.700 3.844 3.567 4.091 . 0 0 "[ . 1 .]" 1
2269 1 78 LEU HG 1 111 TYR HA 4.900 . 6.000 4.663 4.173 5.006 . 0 0 "[ . 1 .]" 1
2270 1 79 PHE H 1 79 PHE HA 2.700 . 3.600 2.947 2.942 2.949 . 0 0 "[ . 1 .]" 1
2271 1 79 PHE H 1 79 PHE QB 2.700 . 3.200 2.643 2.605 2.706 . 0 0 "[ . 1 .]" 1
2272 1 79 PHE H 1 79 PHE QD 2.800 . 3.800 2.410 2.275 2.561 . 0 0 "[ . 1 .]" 1
2273 1 79 PHE H 1 80 PHE H 4.100 . 6.000 4.367 4.311 4.425 . 0 0 "[ . 1 .]" 1
2274 1 79 PHE H 1 111 TYR HA 4.000 . 6.000 4.150 4.017 4.297 . 0 0 "[ . 1 .]" 1
2275 1 79 PHE H 1 111 TYR QB 5.600 . 6.000 4.034 3.875 4.197 . 0 0 "[ . 1 .]" 1
2276 1 79 PHE H 1 112 SER H 2.500 . 3.300 2.696 2.567 2.821 . 0 0 "[ . 1 .]" 1
2277 1 79 PHE H 1 112 SER QB 5.700 . 6.000 4.123 3.852 4.320 . 0 0 "[ . 1 .]" 1
2278 1 79 PHE H 1 113 ASP HA 3.200 . 4.500 3.574 3.446 3.768 . 0 0 "[ . 1 .]" 1
2279 1 79 PHE H 1 114 GLU H 4.100 . 6.000 4.028 3.898 4.215 . 0 0 "[ . 1 .]" 1
2280 1 79 PHE H 1 115 SER HA 5.000 . 6.000 5.581 5.417 5.679 . 0 0 "[ . 1 .]" 1
2281 1 79 PHE HA 1 79 PHE QB 2.200 . 2.800 2.341 2.330 2.353 . 0 0 "[ . 1 .]" 1
2282 1 79 PHE HA 1 79 PHE QD 2.300 . 2.900 2.910 2.879 2.925 0.025 7 0 "[ . 1 .]" 1
2283 1 79 PHE HA 1 80 PHE H 2.000 . 2.500 2.173 2.158 2.192 . 0 0 "[ . 1 .]" 1
2284 1 79 PHE HA 1 86 ILE MD 3.400 . 4.900 4.045 3.912 4.392 . 0 0 "[ . 1 .]" 1
2285 1 79 PHE HA 1 86 ILE QG 3.000 . 4.100 3.882 3.770 3.970 . 0 0 "[ . 1 .]" 1
2286 1 79 PHE QB 1 79 PHE QD 2.000 . 2.500 2.123 2.122 2.124 . 0 0 "[ . 1 .]" 1
2287 1 79 PHE QB 1 80 PHE H 2.700 . 3.600 3.090 3.009 3.145 . 0 0 "[ . 1 .]" 1
2288 1 79 PHE QB 1 81 PHE QE 2.600 . 3.500 2.129 2.052 2.219 . 0 0 "[ . 1 .]" 1
2289 1 79 PHE QB 1 81 PHE QE 2.800 . 3.800 1.997 1.946 2.081 . 0 0 "[ . 1 .]" 1
2290 1 79 PHE QB 1 81 PHE HZ 3.800 . 5.600 2.424 2.271 2.543 . 0 0 "[ . 1 .]" 1
2291 1 79 PHE QB 1 86 ILE HA 4.900 . 6.000 4.833 4.774 4.916 . 0 0 "[ . 1 .]" 1
2292 1 79 PHE QB 1 86 ILE MD 2.600 . 3.400 2.032 1.929 2.354 . 0 0 "[ . 1 .]" 1
2293 1 79 PHE QB 1 86 ILE QG 5.300 . 6.000 3.547 3.358 3.678 . 0 0 "[ . 1 .]" 1
2294 1 79 PHE QB 1 86 ILE QG 3.400 . 4.300 2.761 2.648 2.911 . 0 0 "[ . 1 .]" 1
2295 1 79 PHE QB 1 111 TYR HA 4.700 . 6.000 4.587 4.532 4.649 . 0 0 "[ . 1 .]" 1
2296 1 79 PHE QB 1 112 SER H 3.700 . 5.400 3.369 3.275 3.459 . 0 0 "[ . 1 .]" 1
2297 1 79 PHE QB 1 112 SER QB 3.300 . 4.700 3.629 3.278 3.818 . 0 0 "[ . 1 .]" 1
2298 1 79 PHE QB 1 115 SER HA 2.600 . 3.400 2.848 2.743 2.940 . 0 0 "[ . 1 .]" 1
2299 1 79 PHE QB 1 115 SER QB 3.400 . 4.900 4.224 4.105 4.321 . 0 0 "[ . 1 .]" 1
2300 1 79 PHE QD 1 86 ILE MD 2.200 . 2.800 2.641 2.514 2.799 . 0 0 "[ . 1 .]" 1
2301 1 79 PHE QD 1 86 ILE QG 3.500 . 5.000 4.700 4.567 4.766 . 0 0 "[ . 1 .]" 1
2302 1 79 PHE QD 1 86 ILE QG 2.400 . 3.100 3.109 3.091 3.120 0.020 3 0 "[ . 1 .]" 1
2303 1 79 PHE QD 1 113 ASP HA 2.800 . 3.800 3.283 3.148 3.519 . 0 0 "[ . 1 .]" 1
2304 1 79 PHE QD 1 114 GLU H 3.300 . 4.700 3.028 2.757 3.307 . 0 0 "[ . 1 .]" 1
2305 1 79 PHE QD 1 114 GLU HA 3.300 . 4.700 3.395 3.371 3.422 . 0 0 "[ . 1 .]" 1
2306 1 79 PHE QD 1 115 SER HA 2.900 . 3.900 3.147 3.083 3.206 . 0 0 "[ . 1 .]" 1
2307 1 79 PHE QD 1 115 SER QB 3.300 . 4.600 3.724 3.659 3.776 . 0 0 "[ . 1 .]" 1
2308 1 79 PHE QE 1 115 SER H 2.900 . 4.000 4.011 4.002 4.019 0.019 4 0 "[ . 1 .]" 1
2309 1 79 PHE QE 1 113 ASP HA 4.100 . 6.000 4.061 3.902 4.242 . 0 0 "[ . 1 .]" 1
2310 1 79 PHE QE 1 114 GLU HA 2.700 . 3.600 2.896 2.847 3.008 . 0 0 "[ . 1 .]" 1
2311 1 79 PHE QE 1 115 SER QB 2.600 . 3.400 3.410 3.403 3.415 0.015 12 0 "[ . 1 .]" 1
2312 1 79 PHE HZ 1 114 GLU HA 3.700 . 5.500 4.494 4.341 4.744 . 0 0 "[ . 1 .]" 1
2313 1 79 PHE HZ 1 115 SER QB 3.000 . 4.200 4.022 3.898 4.111 . 0 0 "[ . 1 .]" 1
2314 1 80 PHE H 1 80 PHE HA 2.900 . 4.000 2.885 2.877 2.896 . 0 0 "[ . 1 .]" 1
2315 1 80 PHE H 1 80 PHE QB 2.900 . 3.500 2.288 2.261 2.310 . 0 0 "[ . 1 .]" 1
2316 1 80 PHE H 1 80 PHE QD 2.900 . 3.900 3.521 3.473 3.573 . 0 0 "[ . 1 .]" 1
2317 1 80 PHE H 1 81 PHE H 3.900 . 5.800 4.583 4.569 4.597 . 0 0 "[ . 1 .]" 1
2318 1 80 PHE H 1 86 ILE MD 4.300 . 6.000 4.108 3.980 4.501 . 0 0 "[ . 1 .]" 1
2319 1 80 PHE H 1 86 ILE MD 3.800 . 5.600 3.895 3.747 4.201 . 0 0 "[ . 1 .]" 1
2320 1 80 PHE H 1 86 ILE QG 3.100 . 4.300 3.239 3.124 3.379 . 0 0 "[ . 1 .]" 1
2321 1 80 PHE H 1 87 PRO QD 4.900 . 6.000 3.567 3.378 3.715 . 0 0 "[ . 1 .]" 1
2322 1 80 PHE H 1 109 ILE QG 4.000 . 6.000 5.214 5.138 5.343 . 0 0 "[ . 1 .]" 1
2323 1 80 PHE H 1 111 TYR HA 3.700 . 5.400 4.463 4.392 4.533 . 0 0 "[ . 1 .]" 1
2324 1 80 PHE HA 1 80 PHE QB 2.400 . 3.100 2.439 2.428 2.452 . 0 0 "[ . 1 .]" 1
2325 1 80 PHE HA 1 80 PHE QD 1.900 . 2.300 1.819 1.792 1.844 . 0 0 "[ . 1 .]" 1
2326 1 80 PHE HA 1 80 PHE QE 3.100 . 4.300 4.157 4.139 4.181 . 0 0 "[ . 1 .]" 1
2327 1 80 PHE HA 1 81 PHE H 1.900 . 2.300 2.237 2.198 2.282 . 0 0 "[ . 1 .]" 1
2328 1 80 PHE HA 1 81 PHE QB 4.300 . 6.000 4.296 4.278 4.315 . 0 0 "[ . 1 .]" 1
2329 1 80 PHE HA 1 86 ILE QG 5.100 . 6.000 4.669 4.589 4.747 . 0 0 "[ . 1 .]" 1
2330 1 80 PHE HA 1 87 PRO QG 4.600 . 6.000 4.772 4.533 4.855 . 0 0 "[ . 1 .]" 1
2331 1 80 PHE HA 1 109 ILE QG 2.700 . 3.600 3.474 3.409 3.549 . 0 0 "[ . 1 .]" 1
2332 1 80 PHE HA 1 110 ALA H 3.900 . 5.800 4.304 4.217 4.378 . 0 0 "[ . 1 .]" 1
2333 1 80 PHE HA 1 110 ALA MB 4.100 . 6.000 4.485 4.352 4.559 . 0 0 "[ . 1 .]" 1
2334 1 80 PHE HA 1 111 TYR H 4.400 . 6.000 4.573 4.518 4.651 . 0 0 "[ . 1 .]" 1
2335 1 80 PHE HA 1 111 TYR HA 2.500 . 3.300 2.207 2.126 2.310 . 0 0 "[ . 1 .]" 1
2336 1 80 PHE HA 1 111 TYR QB 3.200 . 4.500 3.083 3.024 3.171 . 0 0 "[ . 1 .]" 1
2337 1 80 PHE HA 1 112 SER H 3.400 . 4.900 3.736 3.664 3.845 . 0 0 "[ . 1 .]" 1
2338 1 80 PHE QB 1 80 PHE QD 2.500 . 3.300 2.230 2.218 2.241 . 0 0 "[ . 1 .]" 1
2339 1 80 PHE QB 1 81 PHE H 2.400 . 3.100 2.811 2.701 2.921 . 0 0 "[ . 1 .]" 1
2340 1 80 PHE QB 1 82 VAL QG 3.200 . 4.500 3.931 2.898 4.470 . 0 0 "[ . 1 .]" 1
2341 1 80 PHE QB 1 86 ILE HA 4.600 . 6.000 4.069 3.945 4.162 . 0 0 "[ . 1 .]" 1
2342 1 80 PHE QB 1 86 ILE QG 5.600 . 5.800 3.625 3.507 3.745 . 0 0 "[ . 1 .]" 1
2343 1 80 PHE QB 1 87 PRO QB 3.000 . 4.100 4.058 3.836 4.108 0.008 9 0 "[ . 1 .]" 1
2344 1 80 PHE QB 1 87 PRO QD 2.800 . 3.700 2.408 2.343 2.467 . 0 0 "[ . 1 .]" 1
2345 1 80 PHE QB 1 87 PRO QG 3.000 . 4.100 2.286 2.076 2.336 . 0 0 "[ . 1 .]" 1
2346 1 80 PHE QB 1 89 THR HG1 6.000 . 6.000 5.381 5.167 5.630 . 0 0 "[ . 1 .]" 1
2347 1 80 PHE QB 1 109 ILE MD 3.800 . 4.300 3.604 3.470 3.756 . 0 0 "[ . 1 .]" 1
2348 1 80 PHE QB 1 109 ILE QG 2.300 . 2.800 2.469 2.386 2.632 . 0 0 "[ . 1 .]" 1
2349 1 80 PHE QD 1 81 PHE H 2.600 . 3.500 3.412 3.344 3.487 . 0 0 "[ . 1 .]" 1
2350 1 80 PHE QD 1 82 VAL QG 4.900 . 6.000 5.271 4.396 5.763 . 0 0 "[ . 1 .]" 1
2351 1 80 PHE QD 1 87 PRO QG 3.200 . 4.500 3.071 2.922 3.170 . 0 0 "[ . 1 .]" 1
2352 1 80 PHE QD 1 96 LEU QD 4.800 . 6.000 4.446 4.214 4.651 . 0 0 "[ . 1 .]" 1
2353 1 80 PHE QD 1 109 ILE MD 3.800 . 5.600 4.254 4.171 4.338 . 0 0 "[ . 1 .]" 1
2354 1 80 PHE QD 1 109 ILE QG 2.400 . 3.100 3.089 3.034 3.128 0.028 1 0 "[ . 1 .]" 1
2355 1 80 PHE QD 1 111 TYR QB 2.700 . 3.600 1.949 1.891 2.065 . 0 0 "[ . 1 .]" 1
2356 1 80 PHE QE 1 109 ILE MD 4.200 . 6.000 4.866 4.769 5.021 . 0 0 "[ . 1 .]" 1
2357 1 80 PHE QE 1 111 TYR QB 2.800 . 3.800 2.188 2.094 2.255 . 0 0 "[ . 1 .]" 1
2358 1 81 PHE H 1 81 PHE HA 2.600 . 3.500 2.924 2.916 2.934 . 0 0 "[ . 1 .]" 1
2359 1 81 PHE H 1 81 PHE QB 2.600 . 3.400 2.699 2.649 2.754 . 0 0 "[ . 1 .]" 1
2360 1 81 PHE H 1 81 PHE QD 2.600 . 3.400 2.957 2.895 3.072 . 0 0 "[ . 1 .]" 1
2361 1 81 PHE H 1 82 VAL H 3.600 . 5.200 3.965 3.729 4.108 . 0 0 "[ . 1 .]" 1
2362 1 81 PHE H 1 109 ILE HA 3.800 . 5.600 4.756 4.683 4.826 . 0 0 "[ . 1 .]" 1
2363 1 81 PHE H 1 109 ILE QG 2.500 . 3.300 2.727 2.620 2.827 . 0 0 "[ . 1 .]" 1
2364 1 81 PHE H 1 110 ALA MB 3.000 . 4.100 3.051 2.975 3.130 . 0 0 "[ . 1 .]" 1
2365 1 81 PHE H 1 111 TYR HA 3.000 . 4.100 3.264 3.172 3.426 . 0 0 "[ . 1 .]" 1
2366 1 81 PHE HA 1 81 PHE QB 2.500 . 3.000 2.367 2.356 2.379 . 0 0 "[ . 1 .]" 1
2367 1 81 PHE HA 1 81 PHE QD 2.600 . 3.400 2.941 2.864 2.989 . 0 0 "[ . 1 .]" 1
2368 1 81 PHE HA 1 81 PHE QE 3.300 . 4.700 4.628 4.590 4.659 . 0 0 "[ . 1 .]" 1
2369 1 81 PHE HA 1 82 VAL H 2.000 . 2.500 2.154 2.125 2.217 . 0 0 "[ . 1 .]" 1
2370 1 81 PHE HA 1 82 VAL HB 4.900 . 6.000 4.683 4.500 5.014 . 0 0 "[ . 1 .]" 1
2371 1 81 PHE HA 1 82 VAL QG 3.600 . 5.200 3.767 3.525 3.955 . 0 0 "[ . 1 .]" 1
2372 1 81 PHE HA 1 84 ASN HA 5.000 . 6.000 4.816 4.551 5.088 . 0 0 "[ . 1 .]" 1
2373 1 81 PHE HA 1 85 VAL H 3.100 . 4.300 3.752 3.289 4.106 . 0 0 "[ . 1 .]" 1
2374 1 81 PHE HA 1 86 ILE HA 2.300 . 3.000 2.730 2.616 2.837 . 0 0 "[ . 1 .]" 1
2375 1 81 PHE HA 1 86 ILE MD 5.200 . 6.000 4.684 4.633 4.760 . 0 0 "[ . 1 .]" 1
2376 1 81 PHE HA 1 86 ILE QG 2.700 . 3.600 3.262 3.197 3.320 . 0 0 "[ . 1 .]" 1
2377 1 81 PHE HA 1 86 ILE QG 2.800 . 3.800 3.178 3.128 3.211 . 0 0 "[ . 1 .]" 1
2378 1 81 PHE HA 1 87 PRO QD 2.600 . 3.500 2.880 2.732 3.071 . 0 0 "[ . 1 .]" 1
2379 1 81 PHE HA 1 87 PRO QG 3.500 . 5.000 4.586 4.421 4.788 . 0 0 "[ . 1 .]" 1
2380 1 81 PHE HA 1 110 ALA MB 4.700 . 6.000 4.275 4.213 4.349 . 0 0 "[ . 1 .]" 1
2381 1 81 PHE QB 1 81 PHE QD 2.300 . 2.800 2.123 2.122 2.124 . 0 0 "[ . 1 .]" 1
2382 1 81 PHE QB 1 81 PHE QE 3.300 . 4.100 3.925 3.924 3.928 . 0 0 "[ . 1 .]" 1
2383 1 81 PHE QB 1 82 VAL H 3.100 . 4.300 3.528 3.362 3.705 . 0 0 "[ . 1 .]" 1
2384 1 81 PHE QB 1 82 VAL HA 3.200 . 4.500 4.304 4.197 4.433 . 0 0 "[ . 1 .]" 1
2385 1 81 PHE QB 1 84 ASN H 3.200 . 4.400 3.424 3.190 3.561 . 0 0 "[ . 1 .]" 1
2386 1 81 PHE QB 1 84 ASN HA 2.800 . 3.600 2.888 2.611 3.175 . 0 0 "[ . 1 .]" 1
2387 1 81 PHE QB 1 85 VAL H 3.600 . 5.200 3.667 3.236 3.944 . 0 0 "[ . 1 .]" 1
2388 1 81 PHE QB 1 86 ILE HA 5.300 . 6.000 4.580 4.457 4.736 . 0 0 "[ . 1 .]" 1
2389 1 81 PHE QB 1 86 ILE MD 6.000 . 6.000 3.873 3.822 3.918 . 0 0 "[ . 1 .]" 1
2390 1 81 PHE QB 1 110 ALA H 4.500 . 4.500 3.690 3.599 3.812 . 0 0 "[ . 1 .]" 1
2391 1 81 PHE QB 1 110 ALA HA 3.900 . 5.800 4.606 4.484 4.725 . 0 0 "[ . 1 .]" 1
2392 1 81 PHE QB 1 110 ALA MB 2.300 . 2.800 2.068 1.939 2.153 . 0 0 "[ . 1 .]" 1
2393 1 81 PHE QB 1 117 TYR QD 3.200 . 4.500 2.179 1.982 2.394 0.018 14 0 "[ . 1 .]" 1
2394 1 81 PHE QB 1 117 TYR QE 3.900 . 5.800 3.558 3.458 3.695 . 0 0 "[ . 1 .]" 1
2395 1 81 PHE QD 1 82 VAL H 4.700 . 6.000 4.510 4.386 4.707 . 0 0 "[ . 1 .]" 1
2396 1 81 PHE QD 1 84 ASN HA 3.000 . 4.100 3.946 3.706 4.110 0.010 5 0 "[ . 1 .]" 1
2397 1 81 PHE QD 1 85 VAL HA 3.900 . 5.800 3.600 3.460 3.712 . 0 0 "[ . 1 .]" 1
2398 1 81 PHE QD 1 86 ILE HA 6.000 . 6.000 3.958 3.844 4.109 . 0 0 "[ . 1 .]" 1
2399 1 81 PHE QD 1 86 ILE MD 2.500 . 3.300 2.506 2.459 2.607 . 0 0 "[ . 1 .]" 1
2400 1 81 PHE QD 1 86 ILE QG 2.800 . 3.800 2.558 2.506 2.670 . 0 0 "[ . 1 .]" 1
2401 1 81 PHE QD 1 110 ALA MB 2.500 . 3.300 3.264 2.947 3.328 0.028 2 0 "[ . 1 .]" 1
2402 1 81 PHE QD 1 112 SER QB 3.100 . 4.300 2.937 2.807 3.145 . 0 0 "[ . 1 .]" 1
2403 1 81 PHE QD 1 116 VAL HA 3.200 . 4.400 4.230 4.158 4.376 . 0 0 "[ . 1 .]" 1
2404 1 81 PHE QD 1 117 TYR HA 3.600 . 5.200 2.954 2.839 3.079 . 0 0 "[ . 1 .]" 1
2405 1 81 PHE QD 1 117 TYR QB 3.500 . 4.800 2.901 2.425 3.190 . 0 0 "[ . 1 .]" 1
2406 1 81 PHE QD 1 117 TYR QD 2.500 . 3.300 3.209 3.149 3.250 . 0 0 "[ . 1 .]" 1
2407 1 81 PHE QD 1 117 TYR QE 3.300 . 4.700 4.717 4.704 4.727 0.027 14 0 "[ . 1 .]" 1
2408 1 81 PHE QE 1 86 ILE MD 2.100 . 2.700 1.952 1.911 2.045 . 0 0 "[ . 1 .]" 1
2409 1 81 PHE QE 1 86 ILE QG 3.300 . 4.700 2.368 2.240 2.457 . 0 0 "[ . 1 .]" 1
2410 1 81 PHE QE 1 115 SER HA 1.900 . 2.400 2.468 2.452 2.477 0.077 7 0 "[ . 1 .]" 1
2411 1 81 PHE QE 1 116 VAL HA 2.300 . 3.000 2.433 2.374 2.469 . 0 0 "[ . 1 .]" 1
2412 1 81 PHE QE 1 116 VAL HB 4.200 . 6.000 4.404 4.387 4.446 . 0 0 "[ . 1 .]" 1
2413 1 81 PHE QE 1 116 VAL QG 3.100 . 4.300 3.485 3.434 3.542 . 0 0 "[ . 1 .]" 1
2414 1 81 PHE QE 1 117 TYR HA 3.900 . 5.800 3.199 3.029 3.280 . 0 0 "[ . 1 .]" 1
2415 1 81 PHE QE 1 86 ILE MD 2.200 . 2.800 2.061 1.986 2.210 . 0 0 "[ . 1 .]" 1
2416 1 81 PHE QE 1 86 ILE MD 2.600 . 3.500 1.946 1.894 2.048 . 0 0 "[ . 1 .]" 1
2417 1 81 PHE QE 1 86 ILE QG 2.800 . 3.800 2.397 2.264 2.489 . 0 0 "[ . 1 .]" 1
2418 1 81 PHE QE 1 111 TYR HA 3.900 . 5.800 3.765 3.658 3.966 . 0 0 "[ . 1 .]" 1
2419 1 81 PHE QE 1 112 SER H 3.500 . 5.100 2.284 2.193 2.428 . 0 0 "[ . 1 .]" 1
2420 1 81 PHE QE 1 112 SER HA 3.900 . 5.800 4.227 4.124 4.308 . 0 0 "[ . 1 .]" 1
2421 1 81 PHE QE 1 112 SER QB 2.600 . 3.100 1.985 1.883 2.210 . 0 0 "[ . 1 .]" 1
2422 1 81 PHE QE 1 115 SER HA 3.400 . 4.900 3.646 3.612 3.694 . 0 0 "[ . 1 .]" 1
2423 1 81 PHE QE 1 116 VAL HA 3.200 . 4.500 2.481 2.420 2.520 . 0 0 "[ . 1 .]" 1
2424 1 81 PHE QE 1 116 VAL HB 3.400 . 4.800 4.826 4.808 4.835 0.035 4 0 "[ . 1 .]" 1
2425 1 81 PHE QE 1 117 TYR H 3.300 . 4.700 3.199 2.618 3.472 . 0 0 "[ . 1 .]" 1
2426 1 81 PHE QE 1 117 TYR HA 3.100 . 4.300 3.365 3.185 3.452 . 0 0 "[ . 1 .]" 1
2427 1 81 PHE QE 1 117 TYR QB 3.200 . 4.400 4.059 3.730 4.233 . 0 0 "[ . 1 .]" 1
2428 1 81 PHE QE 1 117 TYR QD 3.400 . 4.900 4.602 4.522 4.653 . 0 0 "[ . 1 .]" 1
2429 1 81 PHE HZ 1 86 ILE MD 3.100 . 4.300 2.428 2.317 2.505 . 0 0 "[ . 1 .]" 1
2430 1 81 PHE HZ 1 86 ILE QG 2.900 . 4.000 3.705 3.577 3.782 . 0 0 "[ . 1 .]" 1
2431 1 81 PHE HZ 1 112 SER QB 3.700 . 5.400 3.545 3.189 3.700 . 0 0 "[ . 1 .]" 1
2432 1 81 PHE HZ 1 117 TYR QD 4.600 . 6.000 5.841 5.694 5.895 . 0 0 "[ . 1 .]" 1
2433 1 82 VAL H 1 82 VAL HA 2.900 . 3.900 2.937 2.913 2.948 . 0 0 "[ . 1 .]" 1
2434 1 82 VAL H 1 82 VAL HB 2.500 . 3.300 2.882 2.716 3.029 . 0 0 "[ . 1 .]" 1
2435 1 82 VAL H 1 82 VAL QG 2.700 . 3.600 2.129 1.950 2.231 . 0 0 "[ . 1 .]" 1
2436 1 82 VAL H 1 83 ASN H 4.600 . 6.000 4.295 4.176 4.384 . 0 0 "[ . 1 .]" 1
2437 1 82 VAL H 1 85 VAL H 2.300 . 2.900 2.927 2.918 2.934 0.034 3 0 "[ . 1 .]" 1
2438 1 82 VAL H 1 85 VAL HB 3.600 . 5.200 4.701 3.785 5.177 . 0 0 "[ . 1 .]" 1
2439 1 82 VAL H 1 85 VAL QG 3.100 . 4.300 3.219 2.685 4.207 . 0 0 "[ . 1 .]" 1
2440 1 82 VAL H 1 86 ILE HA 2.700 . 3.600 3.590 3.552 3.605 0.005 4 0 "[ . 1 .]" 1
2441 1 82 VAL H 1 87 PRO QD 3.200 . 4.300 2.572 2.220 2.830 . 0 0 "[ . 1 .]" 1
2442 1 82 VAL H 1 110 ALA MB 3.400 . 4.900 4.837 4.726 4.901 0.001 14 0 "[ . 1 .]" 1
2443 1 82 VAL HA 1 82 VAL HB 2.300 . 2.900 2.682 2.501 2.979 0.079 6 0 "[ . 1 .]" 1
2444 1 82 VAL HA 1 82 VAL QG 2.200 . 2.800 2.097 2.015 2.161 . 0 0 "[ . 1 .]" 1
2445 1 82 VAL HA 1 83 ASN H 2.200 . 2.800 2.149 2.143 2.154 . 0 0 "[ . 1 .]" 1
2446 1 82 VAL HA 1 83 ASN HA 3.300 . 4.700 4.372 4.366 4.377 . 0 0 "[ . 1 .]" 1
2447 1 82 VAL HA 1 84 ASN H 4.300 . 6.000 3.440 3.292 3.644 . 0 0 "[ . 1 .]" 1
2448 1 82 VAL HA 1 85 VAL H 3.500 . 5.000 4.218 4.083 4.324 . 0 0 "[ . 1 .]" 1
2449 1 82 VAL HA 1 109 ILE HA 2.900 . 3.900 2.673 2.541 2.861 . 0 0 "[ . 1 .]" 1
2450 1 82 VAL HA 1 109 ILE QG 4.200 . 6.000 3.096 2.872 3.381 . 0 0 "[ . 1 .]" 1
2451 1 82 VAL HA 1 110 ALA H 3.400 . 4.800 3.417 3.310 3.586 . 0 0 "[ . 1 .]" 1
2452 1 82 VAL HB 1 82 VAL QG 2.100 . 2.600 1.882 1.869 1.892 . 0 0 "[ . 1 .]" 1
2453 1 82 VAL HB 1 83 ASN H 3.700 . 5.500 4.303 4.095 4.424 . 0 0 "[ . 1 .]" 1
2454 1 82 VAL HB 1 83 ASN QB 3.800 . 5.600 4.972 3.870 5.542 . 0 0 "[ . 1 .]" 1
2455 1 82 VAL HB 1 85 VAL H 5.000 . 6.000 4.933 4.165 5.375 . 0 0 "[ . 1 .]" 1
2456 1 82 VAL HB 1 85 VAL QG 3.200 . 4.500 4.268 4.141 4.492 . 0 0 "[ . 1 .]" 1
2457 1 82 VAL HB 1 87 PRO QD 3.500 . 5.000 3.652 3.426 3.862 . 0 0 "[ . 1 .]" 1
2458 1 82 VAL HB 1 96 LEU QD 2.800 . 3.800 3.816 3.766 3.835 0.035 11 0 "[ . 1 .]" 1
2459 1 82 VAL HB 1 109 ILE HA 3.400 . 4.900 3.844 3.120 4.931 0.031 6 0 "[ . 1 .]" 1
2460 1 82 VAL HB 1 109 ILE MD 3.300 . 4.700 3.323 2.686 4.369 . 0 0 "[ . 1 .]" 1
2461 1 82 VAL HB 1 109 ILE QG 4.600 . 6.000 2.899 2.262 3.914 . 0 0 "[ . 1 .]" 1
2462 1 82 VAL QG 1 83 ASN H 3.300 . 4.600 2.812 2.671 2.989 . 0 0 "[ . 1 .]" 1
2463 1 82 VAL QG 1 83 ASN HA 3.700 . 5.400 4.071 3.949 4.327 . 0 0 "[ . 1 .]" 1
2464 1 82 VAL QG 1 83 ASN QB . . 3.800 3.162 2.924 3.634 . 0 0 "[ . 1 .]" 1
2465 1 82 VAL QG 1 83 ASN HD21 3.600 . 5.200 3.759 2.342 4.385 . 0 0 "[ . 1 .]" 1
2466 1 82 VAL QG 1 83 ASN HD22 2.900 . 4.000 3.271 2.780 3.829 . 0 0 "[ . 1 .]" 1
2467 1 82 VAL QG 1 85 VAL H 3.500 . 5.000 3.653 3.316 4.205 . 0 0 "[ . 1 .]" 1
2468 1 82 VAL QG 1 85 VAL HB 4.100 . 4.700 4.416 4.222 4.552 . 0 0 "[ . 1 .]" 1
2469 1 82 VAL QG 1 86 ILE HA 3.400 . 4.800 4.218 4.088 4.376 . 0 0 "[ . 1 .]" 1
2470 1 82 VAL QG 1 87 PRO QB . . 3.600 2.780 2.679 2.890 . 0 0 "[ . 1 .]" 1
2471 1 82 VAL QG 1 87 PRO QD 2.700 . 3.600 2.575 2.029 3.051 . 0 0 "[ . 1 .]" 1
2472 1 82 VAL QG 1 87 PRO QG 3.700 . 5.400 2.917 2.103 3.506 . 0 0 "[ . 1 .]" 1
2473 1 82 VAL QG 1 96 LEU HA 3.900 . 5.800 4.419 4.093 4.684 . 0 0 "[ . 1 .]" 1
2474 1 82 VAL QG 1 96 LEU QB 2.600 . 3.400 3.109 2.849 3.364 . 0 0 "[ . 1 .]" 1
2475 1 82 VAL QG 1 96 LEU QD 2.200 . 2.800 2.608 2.194 2.810 0.010 7 0 "[ . 1 .]" 1
2476 1 82 VAL QG 1 100 HIS H 4.600 . 6.000 5.038 4.703 5.422 . 0 0 "[ . 1 .]" 1
2477 1 82 VAL QG 1 100 HIS HA 4.100 . 6.000 4.046 3.754 4.413 . 0 0 "[ . 1 .]" 1
2478 1 82 VAL QG 1 100 HIS QB 2.400 . 3.000 2.113 1.849 2.536 . 0 0 "[ . 1 .]" 1
2479 1 82 VAL QG 1 100 HIS HD1 2.600 . 3.400 2.189 1.895 3.403 0.005 5 0 "[ . 1 .]" 1
2480 1 82 VAL QG 1 101 HIS HA 3.800 . 5.600 4.944 4.615 5.460 . 0 0 "[ . 1 .]" 1
2481 1 82 VAL QG 1 107 LEU HA 3.600 . 5.300 4.557 4.400 4.789 . 0 0 "[ . 1 .]" 1
2482 1 82 VAL QG 1 107 LEU QD 1.700 . 2.200 2.224 2.176 2.245 0.045 5 0 "[ . 1 .]" 1
2483 1 82 VAL QG 1 108 TYR H 3.600 . 5.300 4.125 3.786 4.421 . 0 0 "[ . 1 .]" 1
2484 1 82 VAL QG 1 109 ILE HA 2.500 . 3.300 2.615 2.472 2.757 . 0 0 "[ . 1 .]" 1
2485 1 82 VAL QG 1 109 ILE MD 2.900 . 3.300 2.504 1.833 3.024 . 0 0 "[ . 1 .]" 1
2486 1 82 VAL QG 1 109 ILE QG 2.700 . 3.600 2.089 1.963 2.438 0.037 11 0 "[ . 1 .]" 1
2487 1 82 VAL QG 1 109 ILE QG 2.000 . 2.500 1.976 1.683 2.374 . 0 0 "[ . 1 .]" 1
2488 1 82 VAL QG 1 110 ALA H 3.000 . 4.100 3.842 3.173 4.153 0.053 13 0 "[ . 1 .]" 1
2489 1 83 ASN H 1 83 ASN HA 2.300 . 2.900 2.280 2.275 2.283 . 0 0 "[ . 1 .]" 1
2490 1 83 ASN H 1 83 ASN QB 3.200 . 4.500 3.418 3.327 3.462 . 0 0 "[ . 1 .]" 1
2491 1 83 ASN H 1 84 ASN H 3.100 . 4.300 2.485 2.390 2.545 . 0 0 "[ . 1 .]" 1
2492 1 83 ASN H 1 84 ASN HA 4.500 . 6.000 4.734 4.640 4.807 . 0 0 "[ . 1 .]" 1
2493 1 83 ASN H 1 108 TYR QE 5.400 . 6.000 3.600 2.828 5.203 . 0 0 "[ . 1 .]" 1
2494 1 83 ASN HA 1 83 ASN QB 2.000 . 2.400 2.331 2.300 2.405 0.005 14 0 "[ . 1 .]" 1
2495 1 83 ASN HA 1 84 ASN H 2.600 . 3.400 2.978 2.885 3.045 . 0 0 "[ . 1 .]" 1
2496 1 83 ASN HA 1 84 ASN HA 3.500 . 5.100 4.815 4.788 4.845 . 0 0 "[ . 1 .]" 1
2497 1 83 ASN HA 1 85 VAL H 4.100 . 6.000 4.490 4.398 4.607 . 0 0 "[ . 1 .]" 1
2498 1 83 ASN HA 1 85 VAL QG 3.500 . 5.000 4.659 4.429 4.796 . 0 0 "[ . 1 .]" 1
2499 1 83 ASN QB 1 83 ASN HD21 3.400 . 3.800 2.252 2.089 2.582 . 0 0 "[ . 1 .]" 1
2500 1 83 ASN QB 1 83 ASN HD22 2.600 . 3.500 3.234 3.213 3.415 . 0 0 "[ . 1 .]" 1
2501 1 83 ASN QB 1 85 VAL HB 4.000 . 6.000 4.026 3.772 4.146 . 0 0 "[ . 1 .]" 1
2502 1 83 ASN QB 1 85 VAL QG 2.900 . 3.600 2.585 2.396 2.890 . 0 0 "[ . 1 .]" 1
2503 1 83 ASN HD21 1 85 VAL QG 6.000 . 6.000 4.432 3.633 5.506 . 0 0 "[ . 1 .]" 1
2504 1 83 ASN HD21 1 100 HIS QB 3.500 . 5.000 3.929 2.367 5.012 0.012 7 0 "[ . 1 .]" 1
2505 1 83 ASN HD22 1 100 HIS QB 4.300 . 6.000 2.802 2.006 3.668 . 0 0 "[ . 1 .]" 1
2506 1 84 ASN H 1 84 ASN HA 2.100 . 2.600 2.284 2.266 2.295 . 0 0 "[ . 1 .]" 1
2507 1 84 ASN H 1 85 VAL QG 5.600 . 6.000 3.974 3.829 4.086 . 0 0 "[ . 1 .]" 1
2508 1 84 ASN H 1 110 ALA MB 4.700 . 6.000 4.474 4.243 4.663 . 0 0 "[ . 1 .]" 1
2509 1 84 ASN H 1 117 TYR QR 5.600 . 6.000 4.715 4.305 5.059 . 0 0 "[ . 1 .]" 1
2510 1 84 ASN HA 1 84 ASN QB 2.300 . 2.500 2.469 2.308 2.534 0.034 9 0 "[ . 1 .]" 1
2511 1 84 ASN HA 1 85 VAL H 2.900 . 3.900 3.168 2.998 3.271 . 0 0 "[ . 1 .]" 1
2512 1 84 ASN HA 1 117 TYR QB 4.000 . 6.000 2.745 2.339 3.101 . 0 0 "[ . 1 .]" 1
2513 1 84 ASN HA 1 117 TYR QD 3.800 . 5.600 3.913 3.570 4.312 . 0 0 "[ . 1 .]" 1
2514 1 84 ASN QB 1 84 ASN HD21 2.700 . 3.600 2.239 2.088 2.562 . 0 0 "[ . 1 .]" 1
2515 1 84 ASN QB 1 84 ASN HD22 3.100 . 4.300 3.281 3.212 3.409 . 0 0 "[ . 1 .]" 1
2516 1 85 VAL H 1 85 VAL HB 2.200 . 2.800 2.917 2.852 2.961 0.161 3 0 "[ . 1 .]" 1
2517 1 85 VAL H 1 85 VAL QG 2.000 . 2.500 2.349 2.254 2.512 0.012 6 0 "[ . 1 .]" 1
2518 1 85 VAL H 1 86 ILE H 3.300 . 4.700 4.452 4.404 4.481 . 0 0 "[ . 1 .]" 1
2519 1 85 VAL H 1 87 PRO QD 4.800 . 6.000 4.847 4.467 5.152 . 0 0 "[ . 1 .]" 1
2520 1 85 VAL HA 1 85 VAL HB 2.300 . 3.000 2.626 2.436 2.999 . 0 0 "[ . 1 .]" 1
2521 1 85 VAL HA 1 85 VAL QG 2.200 . 2.500 2.146 2.042 2.217 . 0 0 "[ . 1 .]" 1
2522 1 85 VAL HA 1 86 ILE H 1.900 . 2.400 2.287 2.240 2.322 . 0 0 "[ . 1 .]" 1
2523 1 85 VAL HA 1 86 ILE MD 3.600 . 5.200 3.497 3.434 3.661 . 0 0 "[ . 1 .]" 1
2524 1 85 VAL HA 1 86 ILE QG 3.200 . 4.500 3.557 3.491 3.729 . 0 0 "[ . 1 .]" 1
2525 1 85 VAL HB 1 85 VAL QG 1.800 . 2.200 1.875 1.870 1.884 . 0 0 "[ . 1 .]" 1
2526 1 85 VAL HB 1 86 ILE H 2.700 . 3.600 3.737 3.656 3.774 0.174 3 0 "[ . 1 .]" 1
2527 1 85 VAL QG 1 86 ILE H 2.300 . 2.900 1.951 1.841 2.147 . 0 0 "[ . 1 .]" 1
2528 1 85 VAL QG 1 86 ILE HA 3.600 . 4.700 3.682 3.496 4.029 . 0 0 "[ . 1 .]" 1
2529 1 85 VAL QG 1 86 ILE HB 3.700 . 5.400 3.605 3.481 3.863 . 0 0 "[ . 1 .]" 1
2530 1 85 VAL QG 1 86 ILE QG 3.700 . 5.500 3.678 3.557 3.932 . 0 0 "[ . 1 .]" 1
2531 1 85 VAL QG 1 87 PRO HA 3.000 . 4.000 3.786 3.577 4.010 0.010 9 0 "[ . 1 .]" 1
2532 1 85 VAL QG 1 87 PRO QD 3.100 . 4.300 3.669 3.236 4.135 . 0 0 "[ . 1 .]" 1
2533 1 85 VAL QG 1 88 PRO QD 4.400 . 6.000 4.373 4.146 4.626 . 0 0 "[ . 1 .]" 1
2534 1 86 ILE H 1 86 ILE HA 2.800 . 3.800 2.916 2.898 2.924 . 0 0 "[ . 1 .]" 1
2535 1 86 ILE H 1 86 ILE HB 2.000 . 2.500 2.508 2.451 2.518 0.018 10 0 "[ . 1 .]" 1
2536 1 86 ILE H 1 86 ILE MD 2.800 . 4.000 4.053 4.029 4.069 0.069 5 0 "[ . 1 .]" 1
2537 1 86 ILE H 1 86 ILE MD 2.500 . 3.300 2.478 2.437 2.508 . 0 0 "[ . 1 .]" 1
2538 1 86 ILE H 1 86 ILE QG 2.200 . 2.800 2.500 2.458 2.531 . 0 0 "[ . 1 .]" 1
2539 1 86 ILE H 1 86 ILE QG 3.100 . 4.300 2.467 2.429 2.496 . 0 0 "[ . 1 .]" 1
2540 1 86 ILE H 1 87 PRO QD 4.000 . 6.000 4.195 4.119 4.269 . 0 0 "[ . 1 .]" 1
2541 1 86 ILE HA 1 86 ILE HB 2.500 . 3.300 3.015 3.011 3.018 . 0 0 "[ . 1 .]" 1
2542 1 86 ILE HA 1 86 ILE MD 2.500 . 3.500 3.536 3.526 3.578 0.078 4 0 "[ . 1 .]" 1
2543 1 86 ILE HA 1 86 ILE QG . . 2.400 2.288 2.237 2.302 . 0 0 "[ . 1 .]" 1
2544 1 86 ILE HA 1 86 ILE QG 2.100 . 2.600 2.092 2.062 2.108 . 0 0 "[ . 1 .]" 1
2545 1 86 ILE HA 1 87 PRO HA 4.400 . 6.000 4.507 4.489 4.525 . 0 0 "[ . 1 .]" 1
2546 1 86 ILE HA 1 87 PRO QB 3.000 . 4.100 3.676 3.655 3.693 . 0 0 "[ . 1 .]" 1
2547 1 86 ILE HA 1 87 PRO QD 1.900 . 2.300 1.959 1.912 1.995 . 0 0 "[ . 1 .]" 1
2548 1 86 ILE HA 1 87 PRO QG 3.000 . 4.100 3.866 3.823 3.899 . 0 0 "[ . 1 .]" 1
2549 1 86 ILE HB 1 86 ILE MD 2.000 . 2.700 2.693 2.676 2.705 0.005 2 0 "[ . 1 .]" 1
2550 1 86 ILE HB 1 86 ILE MD 2.000 . 2.500 2.131 2.128 2.136 . 0 0 "[ . 1 .]" 1
2551 1 86 ILE HB 1 86 ILE QG 2.300 . 2.700 2.233 2.228 2.245 . 0 0 "[ . 1 .]" 1
2552 1 86 ILE HB 1 86 ILE QG 1.900 . 2.400 1.935 1.927 1.947 . 0 0 "[ . 1 .]" 1
2553 1 86 ILE HB 1 87 PRO QD 3.200 . 4.500 4.195 4.111 4.288 . 0 0 "[ . 1 .]" 1
2554 1 86 ILE HB 1 115 SER QB 3.800 . 5.600 5.627 5.612 5.640 0.040 4 0 "[ . 1 .]" 1
2555 1 86 ILE MD 1 86 ILE QG 1.900 . 2.300 1.880 1.838 1.885 . 0 0 "[ . 1 .]" 1
2556 1 86 ILE MD 1 86 ILE QG 1.800 . 2.200 1.615 1.488 1.662 . 0 0 "[ . 1 .]" 1
2557 1 86 ILE MD 1 115 SER H 3.700 . 5.500 4.688 4.644 4.729 . 0 0 "[ . 1 .]" 1
2558 1 86 ILE MD 1 115 SER HA 2.200 . 2.800 2.394 2.352 2.480 . 0 0 "[ . 1 .]" 1
2559 1 86 ILE MD 1 115 SER QB 2.600 . 2.800 2.782 2.666 2.808 0.008 13 0 "[ . 1 .]" 1
2560 1 86 ILE MD 1 116 VAL HA 3.300 . 4.700 3.748 3.642 3.813 . 0 0 "[ . 1 .]" 1
2561 1 86 ILE QG 1 87 PRO HA 5.600 . 6.000 4.102 4.020 4.169 . 0 0 "[ . 1 .]" 1
2562 1 86 ILE QG 1 87 PRO QD 2.400 . 2.800 2.446 2.235 2.635 . 0 0 "[ . 1 .]" 1
2563 1 86 ILE QG 1 87 PRO QG 3.100 . 4.300 3.566 3.465 3.652 . 0 0 "[ . 1 .]" 1
2564 1 86 ILE QG 1 115 SER HA 4.400 . 6.000 3.938 3.899 3.982 . 0 0 "[ . 1 .]" 1
2565 1 86 ILE QG 1 115 SER QB 3.700 . 5.400 4.044 4.024 4.088 . 0 0 "[ . 1 .]" 1
2566 1 86 ILE QG 1 87 PRO QD 3.300 . 4.700 3.636 3.570 3.679 . 0 0 "[ . 1 .]" 1
2567 1 87 PRO HA 1 87 PRO QB 2.000 . 2.500 2.184 2.181 2.186 . 0 0 "[ . 1 .]" 1
2568 1 87 PRO HA 1 87 PRO QD 3.700 . 5.400 3.416 3.345 3.469 . 0 0 "[ . 1 .]" 1
2569 1 87 PRO HA 1 87 PRO QG 3.200 . 4.100 3.506 3.500 3.511 . 0 0 "[ . 1 .]" 1
2570 1 87 PRO HA 1 88 PRO QD 2.000 . 2.500 1.803 1.789 1.812 . 0 0 "[ . 1 .]" 1
2571 1 87 PRO HA 1 88 PRO QG 2.700 . 3.600 3.642 3.633 3.649 0.049 9 0 "[ . 1 .]" 1
2572 1 87 PRO HA 1 91 ALA MB 4.600 . 6.000 4.435 4.293 4.652 . 0 0 "[ . 1 .]" 1
2573 1 87 PRO HA 1 96 LEU QD 2.700 . 3.600 3.328 3.211 3.496 . 0 0 "[ . 1 .]" 1
2574 1 87 PRO QB 1 87 PRO QD . . 2.800 2.781 2.756 2.807 0.007 1 0 "[ . 1 .]" 1
2575 1 87 PRO QB 1 87 PRO QG 2.300 . 3.000 1.974 1.973 1.975 . 0 0 "[ . 1 .]" 1
2576 1 87 PRO QB 1 89 THR HA 6.000 . 6.000 4.568 4.520 4.605 . 0 0 "[ . 1 .]" 1
2577 1 87 PRO QB 1 109 ILE MD 3.300 . 4.600 3.154 3.035 3.356 . 0 0 "[ . 1 .]" 1
2578 1 87 PRO QB 1 88 PRO QD 2.600 . 3.000 2.688 2.633 2.785 . 0 0 "[ . 1 .]" 1
2579 1 87 PRO QB 1 91 ALA MB 3.600 . 5.300 3.426 3.268 3.579 . 0 0 "[ . 1 .]" 1
2580 1 87 PRO QB 1 96 LEU QB 4.300 . 6.000 4.024 3.835 4.167 . 0 0 "[ . 1 .]" 1
2581 1 87 PRO QB 1 96 LEU QD 2.200 . 2.800 1.937 1.821 2.025 . 0 0 "[ . 1 .]" 1
2582 1 87 PRO QD 1 87 PRO QG 2.500 . 2.500 1.963 1.958 1.969 . 0 0 "[ . 1 .]" 1
2583 1 87 PRO QD 1 96 LEU QD 3.400 . 4.800 3.876 3.699 4.006 . 0 0 "[ . 1 .]" 1
2584 1 87 PRO QG 1 88 PRO QD 3.600 . 5.300 4.234 4.186 4.291 . 0 0 "[ . 1 .]" 1
2585 1 87 PRO QG 1 89 THR H 6.000 . 6.000 5.693 5.521 5.807 . 0 0 "[ . 1 .]" 1
2586 1 87 PRO QG 1 109 ILE QG 3.400 . 4.900 3.375 3.217 3.521 . 0 0 "[ . 1 .]" 1
2587 1 88 PRO HA 1 88 PRO QB 2.100 . 2.600 2.195 2.192 2.197 . 0 0 "[ . 1 .]" 1
2588 1 88 PRO HA 1 88 PRO QD 4.000 . 6.000 3.477 3.474 3.480 . 0 0 "[ . 1 .]" 1
2589 1 88 PRO HA 1 88 PRO QG 2.400 . 3.100 3.101 3.086 3.111 0.011 1 0 "[ . 1 .]" 1
2590 1 88 PRO HA 1 89 THR HG1 3.300 . 4.600 3.733 3.389 3.802 . 0 0 "[ . 1 .]" 1
2591 1 88 PRO HA 1 91 ALA MB 3.600 . 5.200 4.414 4.310 4.545 . 0 0 "[ . 1 .]" 1
2592 1 88 PRO QB 1 88 PRO QD 2.700 . 3.600 2.763 2.756 2.767 . 0 0 "[ . 1 .]" 1
2593 1 88 PRO QB 1 88 PRO QG 1.800 . 2.200 1.965 1.964 1.968 . 0 0 "[ . 1 .]" 1
2594 1 88 PRO QB 1 89 THR H 2.800 . 3.600 3.297 3.254 3.362 . 0 0 "[ . 1 .]" 1
2595 1 88 PRO QB 1 89 THR HA 4.000 . 6.000 4.684 4.651 4.741 . 0 0 "[ . 1 .]" 1
2596 1 88 PRO QB 1 90 SER H 3.000 . 4.100 2.708 2.638 2.796 . 0 0 "[ . 1 .]" 1
2597 1 88 PRO QB 1 90 SER HA 4.200 . 6.000 4.804 4.784 4.836 . 0 0 "[ . 1 .]" 1
2598 1 88 PRO QB 1 90 SER QB 4.200 . 6.000 3.311 2.958 3.903 . 0 0 "[ . 1 .]" 1
2599 1 88 PRO QB 1 91 ALA H 2.900 . 3.900 2.050 1.990 2.128 . 0 0 "[ . 1 .]" 1
2600 1 88 PRO QB 1 91 ALA HA 4.100 . 6.000 4.078 3.985 4.174 . 0 0 "[ . 1 .]" 1
2601 1 88 PRO QB 1 91 ALA MB 2.300 . 3.000 2.444 2.196 2.559 . 0 0 "[ . 1 .]" 1
2602 1 88 PRO QD 1 88 PRO QG 2.100 . 2.200 1.973 1.971 1.975 . 0 0 "[ . 1 .]" 1
2603 1 88 PRO QD 1 89 THR H 5.000 . 6.000 4.892 4.872 4.904 . 0 0 "[ . 1 .]" 1
2604 1 88 PRO QD 1 91 ALA H 4.200 . 6.000 3.703 3.612 3.789 . 0 0 "[ . 1 .]" 1
2605 1 88 PRO QD 1 91 ALA MB 2.500 . 3.300 2.080 1.920 2.242 . 0 0 "[ . 1 .]" 1
2606 1 88 PRO QD 1 96 LEU QD 2.700 . 3.500 2.562 2.487 2.672 . 0 0 "[ . 1 .]" 1
2607 1 88 PRO QG 1 89 THR H 3.800 . 5.600 4.819 4.802 4.846 . 0 0 "[ . 1 .]" 1
2608 1 88 PRO QG 1 90 SER H 3.500 . 5.000 4.712 4.646 4.797 . 0 0 "[ . 1 .]" 1
2609 1 88 PRO QG 1 91 ALA H 2.800 . 3.800 3.736 3.688 3.799 . 0 0 "[ . 1 .]" 1
2610 1 88 PRO QG 1 91 ALA HA 3.500 . 5.000 4.661 4.480 4.814 . 0 0 "[ . 1 .]" 1
2611 1 88 PRO QG 1 91 ALA MB 2.000 . 2.500 2.417 2.275 2.502 0.002 8 0 "[ . 1 .]" 1
2612 1 88 PRO QG 1 96 LEU QD 2.900 . 4.000 3.994 3.917 4.016 0.016 2 0 "[ . 1 .]" 1
2613 1 89 THR H 1 89 THR HA 2.600 . 3.500 2.783 2.755 2.797 . 0 0 "[ . 1 .]" 1
2614 1 89 THR H 1 89 THR HB 2.800 . 3.800 3.570 3.555 3.598 . 0 0 "[ . 1 .]" 1
2615 1 89 THR H 1 89 THR HG1 2.100 . 2.700 2.195 1.775 2.281 . 0 0 "[ . 1 .]" 1
2616 1 89 THR H 1 90 SER H 2.800 . 3.700 2.705 2.673 2.773 . 0 0 "[ . 1 .]" 1
2617 1 89 THR H 1 90 SER HA 4.900 . 6.000 5.290 5.253 5.352 . 0 0 "[ . 1 .]" 1
2618 1 89 THR H 1 90 SER QB 5.400 . 6.000 4.576 4.414 4.859 . 0 0 "[ . 1 .]" 1
2619 1 89 THR H 1 91 ALA H 3.600 . 5.200 4.266 4.180 4.344 . 0 0 "[ . 1 .]" 1
2620 1 89 THR H 1 91 ALA MB 5.400 . 6.000 4.999 4.918 5.105 . 0 0 "[ . 1 .]" 1
2621 1 89 THR HA 1 89 THR HB 2.200 . 2.800 2.576 2.530 2.597 . 0 0 "[ . 1 .]" 1
2622 1 89 THR HA 1 89 THR HG1 2.000 . 2.500 2.213 2.143 2.301 . 0 0 "[ . 1 .]" 1
2623 1 89 THR HA 1 90 SER H 4.300 . 6.000 3.452 3.435 3.466 . 0 0 "[ . 1 .]" 1
2624 1 89 THR HA 1 91 ALA H 3.500 . 5.100 4.289 4.152 4.388 . 0 0 "[ . 1 .]" 1
2625 1 89 THR HA 1 91 ALA MB 4.900 . 6.000 4.807 4.730 4.879 . 0 0 "[ . 1 .]" 1
2626 1 89 THR HB 1 89 THR HG1 2.100 . 2.600 1.982 1.956 2.060 . 0 0 "[ . 1 .]" 1
2627 1 89 THR HB 1 90 SER H 3.500 . 5.000 3.815 3.753 3.873 . 0 0 "[ . 1 .]" 1
2628 1 89 THR HB 1 90 SER QB 3.400 . 4.900 4.892 4.855 4.919 0.019 3 0 "[ . 1 .]" 1
2629 1 89 THR HG1 1 90 SER H 3.800 . 5.600 2.452 2.325 2.758 . 0 0 "[ . 1 .]" 1
2630 1 89 THR HG1 1 90 SER HA 3.800 . 5.600 3.944 3.822 4.566 . 0 0 "[ . 1 .]" 1
2631 1 89 THR HG1 1 91 ALA H 3.300 . 4.600 4.536 4.450 4.611 0.011 1 0 "[ . 1 .]" 1
2632 1 90 SER H 1 90 SER HA 2.700 . 3.600 2.878 2.868 2.888 . 0 0 "[ . 1 .]" 1
2633 1 90 SER H 1 90 SER QB 2.600 . 3.400 2.353 2.216 2.581 . 0 0 "[ . 1 .]" 1
2634 1 90 SER H 1 91 ALA H 2.700 . 3.600 2.413 2.362 2.447 . 0 0 "[ . 1 .]" 1
2635 1 90 SER H 1 91 ALA MB 3.500 . 5.000 4.111 4.071 4.160 . 0 0 "[ . 1 .]" 1
2636 1 90 SER HA 1 90 SER QB 2.200 . 2.500 2.325 2.179 2.483 . 0 0 "[ . 1 .]" 1
2637 1 90 SER HA 1 91 ALA H 3.000 . 4.100 3.508 3.481 3.527 . 0 0 "[ . 1 .]" 1
2638 1 90 SER QB 1 91 ALA H 3.800 . 5.600 3.001 2.665 3.551 . 0 0 "[ . 1 .]" 1
2639 1 90 SER QB 1 91 ALA MB 4.500 . 6.000 4.229 3.906 4.728 . 0 0 "[ . 1 .]" 1
2640 1 91 ALA H 1 91 ALA HA 2.400 . 3.100 2.798 2.788 2.816 . 0 0 "[ . 1 .]" 1
2641 1 91 ALA H 1 91 ALA MB 1.900 . 2.300 2.232 2.174 2.249 . 0 0 "[ . 1 .]" 1
2642 1 91 ALA H 1 92 THR H 3.500 . 5.000 4.639 4.618 4.649 . 0 0 "[ . 1 .]" 1
2643 1 91 ALA H 1 92 THR HA 4.700 . 6.000 5.533 5.502 5.555 . 0 0 "[ . 1 .]" 1
2644 1 91 ALA HA 1 91 ALA MB 1.800 . 2.200 2.127 2.116 2.129 . 0 0 "[ . 1 .]" 1
2645 1 91 ALA HA 1 92 THR H 2.000 . 2.500 2.328 2.284 2.472 . 0 0 "[ . 1 .]" 1
2646 1 91 ALA HA 1 95 GLN QB 3.300 . 4.300 3.956 3.891 4.026 . 0 0 "[ . 1 .]" 1
2647 1 91 ALA MB 1 92 THR H 2.100 . 2.600 2.542 2.250 2.609 0.009 14 0 "[ . 1 .]" 1
2648 1 91 ALA MB 1 92 THR HA 4.100 . 6.000 4.148 4.034 4.183 . 0 0 "[ . 1 .]" 1
2649 1 91 ALA MB 1 95 GLN H 3.600 . 5.200 4.789 4.711 4.863 . 0 0 "[ . 1 .]" 1
2650 1 91 ALA MB 1 95 GLN HA 4.300 . 6.000 5.516 5.482 5.557 . 0 0 "[ . 1 .]" 1
2651 1 91 ALA MB 1 95 GLN QB 2.300 . 2.800 2.816 2.804 2.832 0.032 3 0 "[ . 1 .]" 1
2652 1 91 ALA MB 1 95 GLN QG 3.200 . 4.500 4.067 3.724 4.409 . 0 0 "[ . 1 .]" 1
2653 1 91 ALA MB 1 96 LEU H 3.100 . 4.300 4.184 3.980 4.304 0.004 4 0 "[ . 1 .]" 1
2654 1 91 ALA MB 1 96 LEU HA 4.200 . 6.000 4.786 4.635 4.895 . 0 0 "[ . 1 .]" 1
2655 1 91 ALA MB 1 96 LEU QD . . 2.300 2.305 2.241 2.330 0.030 11 0 "[ . 1 .]" 1
2656 1 92 THR H 1 92 THR HA 2.600 . 3.400 2.830 2.822 2.849 . 0 0 "[ . 1 .]" 1
2657 1 92 THR H 1 92 THR HG1 2.000 . 2.500 2.353 1.941 2.504 0.004 6 0 "[ . 1 .]" 1
2658 1 92 THR H 1 93 MET H 4.200 . 6.000 4.526 4.451 4.546 . 0 0 "[ . 1 .]" 1
2659 1 92 THR H 1 95 GLN H 3.100 . 4.300 3.646 3.525 3.735 . 0 0 "[ . 1 .]" 1
2660 1 92 THR H 1 95 GLN HA 4.000 . 6.000 5.252 5.104 5.408 . 0 0 "[ . 1 .]" 1
2661 1 92 THR H 1 95 GLN QB 2.600 . 3.000 2.464 2.218 2.686 . 0 0 "[ . 1 .]" 1
2662 1 92 THR H 1 95 GLN QG 3.200 . 4.500 2.770 2.191 3.388 . 0 0 "[ . 1 .]" 1
2663 1 92 THR H 1 96 LEU H 4.000 . 6.000 4.423 4.085 4.617 . 0 0 "[ . 1 .]" 1
2664 1 92 THR H 1 96 LEU QD 3.700 . 5.400 4.152 3.731 4.310 . 0 0 "[ . 1 .]" 1
2665 1 92 THR H 1 96 LEU HG 4.700 . 6.000 4.395 3.971 4.573 . 0 0 "[ . 1 .]" 1
2666 1 92 THR HA 1 92 THR HG1 2.000 . 2.500 1.855 1.801 1.933 . 0 0 "[ . 1 .]" 1
2667 1 92 THR HA 1 92 THR HG1 2.200 . 2.800 2.461 2.228 2.548 . 0 0 "[ . 1 .]" 1
2668 1 92 THR HA 1 93 MET H 2.100 . 2.600 2.242 2.210 2.265 . 0 0 "[ . 1 .]" 1
2669 1 92 THR HA 1 93 MET QG 4.300 . 6.000 4.058 3.909 4.231 . 0 0 "[ . 1 .]" 1
2670 1 92 THR HB 1 92 THR HG1 2.100 . 2.600 1.921 1.852 2.032 . 0 0 "[ . 1 .]" 1
2671 1 92 THR HB 1 93 MET H 2.400 . 3.100 2.859 2.773 2.954 . 0 0 "[ . 1 .]" 1
2672 1 92 THR HB 1 94 GLY H 2.700 . 3.600 2.959 2.534 3.253 . 0 0 "[ . 1 .]" 1
2673 1 92 THR HB 1 95 GLN H 3.500 . 5.000 3.753 3.522 3.923 . 0 0 "[ . 1 .]" 1
2674 1 92 THR HG1 1 93 MET H 2.800 . 3.800 3.680 3.411 3.801 0.001 8 0 "[ . 1 .]" 1
2675 1 92 THR HG1 1 94 GLY H 2.800 . 3.700 3.163 2.450 3.703 0.003 12 0 "[ . 1 .]" 1
2676 1 92 THR HG1 1 95 GLN H 3.400 . 4.800 2.558 1.993 2.911 0.007 6 0 "[ . 1 .]" 1
2677 1 92 THR HG1 1 95 GLN QB 4.200 . 6.000 3.341 2.294 3.634 . 0 0 "[ . 1 .]" 1
2678 1 92 THR HG1 1 95 GLN QG 3.100 . 4.300 2.307 1.994 2.554 0.006 14 0 "[ . 1 .]" 1
2679 1 93 MET H 1 93 MET HA 2.600 . 3.500 2.739 2.725 2.751 . 0 0 "[ . 1 .]" 1
2680 1 93 MET H 1 93 MET QB 2.700 . 3.600 2.413 2.292 2.486 . 0 0 "[ . 1 .]" 1
2681 1 93 MET H 1 93 MET ME 3.000 . 4.100 4.037 3.922 4.118 0.018 2 0 "[ . 1 .]" 1
2682 1 93 MET H 1 93 MET QG 2.700 . 2.800 2.354 2.171 2.599 . 0 0 "[ . 1 .]" 1
2683 1 93 MET H 1 94 GLY H 2.800 . 3.800 2.857 2.804 2.949 . 0 0 "[ . 1 .]" 1
2684 1 93 MET H 1 94 GLY QA 4.500 . 6.000 4.691 4.658 4.748 . 0 0 "[ . 1 .]" 1
2685 1 93 MET H 1 95 GLN H 4.400 . 6.000 4.355 4.200 4.527 . 0 0 "[ . 1 .]" 1
2686 1 93 MET H 1 96 LEU H 6.000 . 6.000 4.871 4.813 4.941 . 0 0 "[ . 1 .]" 1
2687 1 93 MET H 1 96 LEU QD 3.900 . 5.800 4.325 4.056 4.556 . 0 0 "[ . 1 .]" 1
2688 1 93 MET HA 1 93 MET QB . . 2.400 2.417 2.393 2.453 0.053 15 0 "[ . 1 .]" 1
2689 1 93 MET HA 1 93 MET ME 2.400 . 3.100 1.939 1.852 2.059 . 0 0 "[ . 1 .]" 1
2690 1 93 MET HA 1 93 MET ME 2.000 . 2.500 1.885 1.822 1.989 . 0 0 "[ . 1 .]" 1
2691 1 93 MET HA 1 93 MET QG 2.400 . 3.100 2.627 2.325 2.973 . 0 0 "[ . 1 .]" 1
2692 1 93 MET HA 1 94 GLY H 3.000 . 4.100 3.527 3.486 3.563 . 0 0 "[ . 1 .]" 1
2693 1 93 MET HA 1 95 GLN H 4.500 . 6.000 4.359 4.127 4.511 . 0 0 "[ . 1 .]" 1
2694 1 93 MET HA 1 96 LEU H 2.700 . 3.600 3.402 3.324 3.520 . 0 0 "[ . 1 .]" 1
2695 1 93 MET HA 1 96 LEU QB 2.500 . 3.100 2.837 2.656 3.069 . 0 0 "[ . 1 .]" 1
2696 1 93 MET HA 1 96 LEU QD 2.800 . 3.100 2.589 2.316 2.813 . 0 0 "[ . 1 .]" 1
2697 1 93 MET HA 1 96 LEU HG 2.400 . 3.100 2.778 2.616 3.024 . 0 0 "[ . 1 .]" 1
2698 1 93 MET HA 1 97 TYR H 3.300 . 4.700 4.068 3.909 4.179 . 0 0 "[ . 1 .]" 1
2699 1 93 MET HA 1 107 LEU HG 3.500 . 5.000 4.988 4.813 5.053 0.053 6 0 "[ . 1 .]" 1
2700 1 93 MET HA 1 109 ILE MD 5.200 . 6.000 4.436 4.344 4.604 . 0 0 "[ . 1 .]" 1
2701 1 93 MET QB 1 93 MET ME 2.300 . 3.000 2.173 1.951 2.578 . 0 0 "[ . 1 .]" 1
2702 1 93 MET QB 1 93 MET QG 2.100 . 2.700 1.996 1.972 2.015 . 0 0 "[ . 1 .]" 1
2703 1 93 MET QB 1 94 GLY H 2.600 . 3.400 2.648 2.500 2.769 . 0 0 "[ . 1 .]" 1
2704 1 93 MET QB 1 95 GLN H 4.800 . 6.000 4.746 4.581 4.907 . 0 0 "[ . 1 .]" 1
2705 1 93 MET ME 1 93 MET QG 2.300 . 2.800 2.508 2.296 2.574 . 0 0 "[ . 1 .]" 1
2706 1 93 MET ME 1 94 GLY H 3.300 . 4.700 4.639 4.492 4.728 0.028 3 0 "[ . 1 .]" 1
2707 1 93 MET ME 1 96 LEU QB 4.000 . 6.000 2.655 2.491 2.866 . 0 0 "[ . 1 .]" 1
2708 1 93 MET ME 1 97 TYR H 3.100 . 4.300 3.978 3.889 4.154 . 0 0 "[ . 1 .]" 1
2709 1 93 MET ME 1 107 LEU HG 2.300 . 3.000 2.991 2.871 3.022 0.022 8 0 "[ . 1 .]" 1
2710 1 93 MET ME 1 109 ILE MD 1.900 . 2.300 1.884 1.784 2.078 . 0 0 "[ . 1 .]" 1
2711 1 93 MET QG 1 94 GLY H 4.900 . 5.800 4.188 4.104 4.267 . 0 0 "[ . 1 .]" 1
2712 1 94 GLY H 1 94 GLY QA 1.900 . 2.300 2.200 2.196 2.206 . 0 0 "[ . 1 .]" 1
2713 1 94 GLY H 1 95 GLN H 2.600 . 3.400 2.702 2.634 2.785 . 0 0 "[ . 1 .]" 1
2714 1 94 GLY H 1 95 GLN QG 5.000 . 6.000 4.507 4.334 4.723 . 0 0 "[ . 1 .]" 1
2715 1 94 GLY H 1 96 LEU H 4.000 . 6.000 4.129 3.975 4.358 . 0 0 "[ . 1 .]" 1
2716 1 94 GLY H 1 97 TYR QB 5.200 . 6.000 4.778 4.673 4.945 . 0 0 "[ . 1 .]" 1
2717 1 94 GLY QA 1 95 GLN H 2.800 . 3.800 2.706 2.656 2.765 . 0 0 "[ . 1 .]" 1
2718 1 94 GLY QA 1 96 LEU H 4.300 . 6.000 4.015 3.845 4.295 . 0 0 "[ . 1 .]" 1
2719 1 94 GLY QA 1 97 TYR H 3.100 . 4.100 3.364 3.201 3.540 . 0 0 "[ . 1 .]" 1
2720 1 94 GLY QA 1 97 TYR QB 2.500 . 3.300 2.571 2.388 2.821 . 0 0 "[ . 1 .]" 1
2721 1 94 GLY QA 1 98 GLN H 6.000 . 6.000 3.964 3.826 4.058 . 0 0 "[ . 1 .]" 1
2722 1 94 GLY QA 1 99 GLU H 6.000 . 6.000 6.002 5.884 6.023 0.023 14 0 "[ . 1 .]" 1
2723 1 95 GLN H 1 95 GLN HA 2.200 . 2.800 2.815 2.804 2.841 0.041 1 0 "[ . 1 .]" 1
2724 1 95 GLN H 1 95 GLN QB 2.200 . 2.600 2.377 2.307 2.440 . 0 0 "[ . 1 .]" 1
2725 1 95 GLN H 1 95 GLN QG 2.200 . 2.800 2.431 2.271 2.578 . 0 0 "[ . 1 .]" 1
2726 1 95 GLN H 1 96 LEU H 2.100 . 2.600 2.618 2.603 2.633 0.033 10 0 "[ . 1 .]" 1
2727 1 95 GLN H 1 96 LEU HA 6.000 . 6.000 5.236 5.209 5.252 . 0 0 "[ . 1 .]" 1
2728 1 95 GLN H 1 96 LEU QB 4.200 . 6.000 4.721 4.655 4.761 . 0 0 "[ . 1 .]" 1
2729 1 95 GLN H 1 96 LEU QD 4.700 . 6.000 4.490 4.399 4.572 . 0 0 "[ . 1 .]" 1
2730 1 95 GLN H 1 96 LEU HG 3.600 . 5.200 4.235 4.111 4.378 . 0 0 "[ . 1 .]" 1
2731 1 95 GLN H 1 97 TYR H 3.700 . 5.400 4.140 3.908 4.322 . 0 0 "[ . 1 .]" 1
2732 1 95 GLN HA 1 95 GLN QB 1.900 . 2.400 2.403 2.374 2.431 0.031 14 0 "[ . 1 .]" 1
2733 1 95 GLN HA 1 95 GLN QG 2.100 . 2.500 2.387 2.256 2.504 0.004 1 0 "[ . 1 .]" 1
2734 1 95 GLN HA 1 96 LEU H 3.200 . 4.500 3.524 3.497 3.558 . 0 0 "[ . 1 .]" 1
2735 1 95 GLN HA 1 96 LEU QD 3.600 . 5.200 4.858 4.758 5.046 . 0 0 "[ . 1 .]" 1
2736 1 95 GLN HA 1 97 TYR H 4.100 . 6.000 4.506 4.176 4.706 . 0 0 "[ . 1 .]" 1
2737 1 95 GLN HA 1 98 GLN H 2.600 . 3.400 3.414 3.403 3.419 0.019 10 0 "[ . 1 .]" 1
2738 1 95 GLN HA 1 98 GLN QB 2.300 . 2.900 2.658 2.511 2.861 . 0 0 "[ . 1 .]" 1
2739 1 95 GLN HA 1 98 GLN QG 2.500 . 3.300 2.999 2.710 3.303 0.003 1 0 "[ . 1 .]" 1
2740 1 95 GLN HA 1 99 GLU H 3.900 . 5.800 4.275 3.866 4.438 . 0 0 "[ . 1 .]" 1
2741 1 95 GLN HA 1 99 GLU QB 4.300 . 6.000 4.661 4.151 4.868 . 0 0 "[ . 1 .]" 1
2742 1 95 GLN QB 1 95 GLN QG 1.900 . 2.400 2.053 2.019 2.086 . 0 0 "[ . 1 .]" 1
2743 1 95 GLN QB 1 96 LEU H 2.300 . 3.000 2.595 2.415 2.721 . 0 0 "[ . 1 .]" 1
2744 1 95 GLN QB 1 96 LEU QD 3.400 . 4.900 3.140 2.968 3.369 . 0 0 "[ . 1 .]" 1
2745 1 95 GLN HE21 1 95 GLN QG 2.800 . 3.800 2.310 2.092 2.690 . 0 0 "[ . 1 .]" 1
2746 1 95 GLN HE22 1 95 GLN QG 3.200 . 4.500 3.297 3.217 3.449 . 0 0 "[ . 1 .]" 1
2747 1 95 GLN QG 1 96 LEU H 4.000 . 6.000 4.124 3.957 4.217 . 0 0 "[ . 1 .]" 1
2748 1 95 GLN QG 1 96 LEU QD 4.800 . 6.000 4.759 4.550 4.992 . 0 0 "[ . 1 .]" 1
2749 1 95 GLN QG 1 98 GLN HE22 4.200 . 6.000 5.921 5.499 6.005 0.005 9 0 "[ . 1 .]" 1
2750 1 96 LEU H 1 96 LEU HA 2.300 . 3.000 2.825 2.780 2.844 . 0 0 "[ . 1 .]" 1
2751 1 96 LEU H 1 96 LEU QB 2.200 . 2.800 2.529 2.486 2.583 . 0 0 "[ . 1 .]" 1
2752 1 96 LEU H 1 96 LEU QB 2.200 . 2.800 2.084 1.982 2.130 . 0 0 "[ . 1 .]" 1
2753 1 96 LEU H 1 96 LEU QD 2.700 . 3.600 2.824 2.730 2.953 . 0 0 "[ . 1 .]" 1
2754 1 96 LEU H 1 96 LEU HG 2.500 . 3.300 2.222 2.058 2.316 . 0 0 "[ . 1 .]" 1
2755 1 96 LEU H 1 97 TYR H 2.700 . 3.600 2.633 2.522 2.744 . 0 0 "[ . 1 .]" 1
2756 1 96 LEU H 1 100 HIS HD1 4.300 . 6.000 4.719 4.620 4.847 . 0 0 "[ . 1 .]" 1
2757 1 96 LEU H 1 107 LEU HG 5.600 . 6.000 5.641 5.535 5.830 . 0 0 "[ . 1 .]" 1
2758 1 96 LEU HA 1 96 LEU QB 2.400 . 2.700 2.340 2.325 2.360 . 0 0 "[ . 1 .]" 1
2759 1 96 LEU HA 1 96 LEU QD 2.100 . 2.200 1.937 1.874 2.076 . 0 0 "[ . 1 .]" 1
2760 1 96 LEU HA 1 96 LEU HG 2.700 . 3.600 3.320 3.235 3.369 . 0 0 "[ . 1 .]" 1
2761 1 96 LEU HA 1 97 TYR H 3.000 . 4.100 3.537 3.504 3.553 . 0 0 "[ . 1 .]" 1
2762 1 96 LEU HA 1 99 GLU H 3.200 . 4.500 3.305 3.209 3.536 . 0 0 "[ . 1 .]" 1
2763 1 96 LEU HA 1 99 GLU QB 2.700 . 3.600 3.115 2.676 3.211 . 0 0 "[ . 1 .]" 1
2764 1 96 LEU HA 1 99 GLU QG 3.300 . 4.700 4.699 4.625 4.712 0.012 15 0 "[ . 1 .]" 1
2765 1 96 LEU HA 1 100 HIS H 3.600 . 5.300 4.186 3.773 4.544 . 0 0 "[ . 1 .]" 1
2766 1 96 LEU HA 1 100 HIS HD1 2.000 . 2.500 1.981 1.926 2.151 . 0 0 "[ . 1 .]" 1
2767 1 96 LEU HA 1 107 LEU HG 4.100 . 6.000 5.711 5.650 5.767 . 0 0 "[ . 1 .]" 1
2768 1 96 LEU QB 1 96 LEU QD 2.000 . 2.500 1.963 1.942 1.980 . 0 0 "[ . 1 .]" 1
2769 1 96 LEU QB 1 96 LEU QD 1.900 . 2.400 1.713 1.702 1.723 . 0 0 "[ . 1 .]" 1
2770 1 96 LEU QB 1 96 LEU HG 2.000 . 2.500 2.308 2.285 2.341 . 0 0 "[ . 1 .]" 1
2771 1 96 LEU QB 1 97 TYR H 2.700 . 3.600 2.405 2.250 2.549 . 0 0 "[ . 1 .]" 1
2772 1 96 LEU QB 1 97 TYR H 2.700 . 3.600 2.422 2.260 2.574 . 0 0 "[ . 1 .]" 1
2773 1 96 LEU QB 1 97 TYR HA 3.600 . 5.200 3.821 3.785 3.845 . 0 0 "[ . 1 .]" 1
2774 1 96 LEU QB 1 100 HIS QB 4.300 . 6.000 2.985 2.731 3.235 . 0 0 "[ . 1 .]" 1
2775 1 96 LEU QB 1 100 HIS HD1 2.900 . 3.800 3.380 3.191 3.794 . 0 0 "[ . 1 .]" 1
2776 1 96 LEU QB 1 107 LEU QD 3.600 . 4.200 2.570 2.463 2.665 . 0 0 "[ . 1 .]" 1
2777 1 96 LEU QB 1 107 LEU HG 2.500 . 3.300 3.312 3.290 3.324 0.024 6 0 "[ . 1 .]" 1
2778 1 96 LEU QD 1 97 TYR H 3.200 . 4.500 3.982 3.927 4.035 . 0 0 "[ . 1 .]" 1
2779 1 96 LEU QD 1 99 GLU QB 3.500 . 4.800 3.829 3.538 3.977 . 0 0 "[ . 1 .]" 1
2780 1 96 LEU QD 1 99 GLU QG 4.400 . 6.000 5.028 4.813 5.154 . 0 0 "[ . 1 .]" 1
2781 1 96 LEU QD 1 100 HIS HD1 2.300 . 2.900 2.911 2.873 2.943 0.043 3 0 "[ . 1 .]" 1
2782 1 96 LEU QD 1 109 ILE MD 2.600 . 3.400 2.505 2.300 2.712 . 0 0 "[ . 1 .]" 1
2783 1 96 LEU HG 1 97 TYR H 3.000 . 4.100 4.104 4.080 4.118 0.018 10 0 "[ . 1 .]" 1
2784 1 97 TYR H 1 97 TYR HA 2.200 . 2.800 2.805 2.785 2.822 0.022 6 0 "[ . 1 .]" 1
2785 1 97 TYR H 1 97 TYR QB 2.000 . 2.500 2.257 2.244 2.270 . 0 0 "[ . 1 .]" 1
2786 1 97 TYR H 1 98 GLN H 2.700 . 3.600 2.669 2.585 2.802 . 0 0 "[ . 1 .]" 1
2787 1 97 TYR H 1 98 GLN QB 3.800 . 5.600 4.711 4.653 4.761 . 0 0 "[ . 1 .]" 1
2788 1 97 TYR H 1 98 GLN QG 5.000 . 6.000 4.380 4.261 4.555 . 0 0 "[ . 1 .]" 1
2789 1 97 TYR H 1 99 GLU H 3.900 . 5.800 3.991 3.733 4.069 . 0 0 "[ . 1 .]" 1
2790 1 97 TYR H 1 107 LEU QD 3.100 . 4.300 3.161 2.948 3.394 . 0 0 "[ . 1 .]" 1
2791 1 97 TYR H 1 107 LEU HG 2.900 . 3.900 3.665 3.566 3.908 0.008 6 0 "[ . 1 .]" 1
2792 1 97 TYR HA 1 97 TYR QB 2.500 . 3.100 2.332 2.313 2.345 . 0 0 "[ . 1 .]" 1
2793 1 97 TYR HA 1 97 TYR QD 2.400 . 3.100 3.131 3.014 3.176 0.076 13 0 "[ . 1 .]" 1
2794 1 97 TYR HA 1 99 GLU H 4.400 . 6.000 4.144 4.031 4.257 . 0 0 "[ . 1 .]" 1
2795 1 97 TYR HA 1 100 HIS H 3.300 . 4.700 3.527 3.378 3.627 . 0 0 "[ . 1 .]" 1
2796 1 97 TYR HA 1 100 HIS QB 4.200 . 6.000 3.605 3.116 3.962 . 0 0 "[ . 1 .]" 1
2797 1 97 TYR HA 1 101 HIS H 2.600 . 3.500 3.158 2.752 3.517 0.017 1 0 "[ . 1 .]" 1
2798 1 97 TYR HA 1 101 HIS HA 4.300 . 6.000 3.889 3.359 4.079 . 0 0 "[ . 1 .]" 1
2799 1 97 TYR HA 1 101 HIS QB 3.200 . 4.500 2.692 2.398 2.934 . 0 0 "[ . 1 .]" 1
2800 1 97 TYR HA 1 107 LEU QB 3.800 . 4.000 2.727 2.439 3.247 . 0 0 "[ . 1 .]" 1
2801 1 97 TYR HA 1 107 LEU QD 2.400 . 2.600 1.828 1.703 1.973 . 0 0 "[ . 1 .]" 1
2802 1 97 TYR HA 1 107 LEU HG 2.400 . 3.100 2.978 2.758 3.113 0.013 7 0 "[ . 1 .]" 1
2803 1 97 TYR QB 1 97 TYR QD 2.300 . 2.700 2.134 2.131 2.137 . 0 0 "[ . 1 .]" 1
2804 1 97 TYR QB 1 98 GLN H 2.600 . 3.500 2.724 2.233 2.869 . 0 0 "[ . 1 .]" 1
2805 1 97 TYR QB 1 98 GLN HA 4.000 . 6.000 4.232 4.151 4.286 . 0 0 "[ . 1 .]" 1
2806 1 97 TYR QB 1 99 GLU H 6.000 . 6.000 4.654 4.307 4.762 . 0 0 "[ . 1 .]" 1
2807 1 97 TYR QB 1 107 LEU QD 3.500 . 5.100 3.072 2.928 3.229 . 0 0 "[ . 1 .]" 1
2808 1 97 TYR QB 1 107 LEU HG 3.400 . 4.000 2.783 2.633 3.002 . 0 0 "[ . 1 .]" 1
2809 1 97 TYR QD 1 98 GLN HA 2.200 . 2.800 2.811 2.627 2.834 0.034 3 0 "[ . 1 .]" 1
2810 1 97 TYR QD 1 98 GLN QB 3.800 . 5.200 4.161 3.859 4.251 . 0 0 "[ . 1 .]" 1
2811 1 97 TYR QD 1 98 GLN QG 2.800 . 3.800 2.452 2.199 2.622 . 0 0 "[ . 1 .]" 1
2812 1 97 TYR QD 1 101 HIS HA 3.600 . 5.200 4.841 4.229 5.202 0.002 4 0 "[ . 1 .]" 1
2813 1 97 TYR QD 1 101 HIS QB 2.700 . 3.600 3.231 2.911 3.406 . 0 0 "[ . 1 .]" 1
2814 1 97 TYR QD 1 107 LEU H 3.500 . 5.100 3.880 3.087 4.334 . 0 0 "[ . 1 .]" 1
2815 1 97 TYR QD 1 107 LEU HA 3.000 . 4.100 4.137 4.082 4.172 0.072 3 0 "[ . 1 .]" 1
2816 1 97 TYR QD 1 107 LEU QB 2.300 . 3.000 1.826 1.795 1.868 . 0 0 "[ . 1 .]" 1
2817 1 97 TYR QD 1 107 LEU QD 2.800 . 3.800 3.331 2.954 3.530 . 0 0 "[ . 1 .]" 1
2818 1 97 TYR QD 1 107 LEU HG 2.600 . 3.400 3.387 3.264 3.424 0.024 15 0 "[ . 1 .]" 1
2819 1 98 GLN H 1 98 GLN HA 2.500 . 3.300 2.865 2.805 2.895 . 0 0 "[ . 1 .]" 1
2820 1 98 GLN H 1 98 GLN QB 2.100 . 2.400 2.404 2.356 2.442 0.042 1 0 "[ . 1 .]" 1
2821 1 98 GLN H 1 98 GLN QG 2.300 . 3.000 2.534 2.288 2.639 . 0 0 "[ . 1 .]" 1
2822 1 98 GLN H 1 99 GLU H 2.500 . 3.300 2.450 2.342 2.667 . 0 0 "[ . 1 .]" 1
2823 1 98 GLN HA 1 98 GLN QB 1.900 . 2.300 2.363 2.347 2.387 0.087 10 0 "[ . 1 .]" 1
2824 1 98 GLN HA 1 98 GLN QG 2.200 . 2.600 2.364 2.308 2.437 . 0 0 "[ . 1 .]" 1
2825 1 98 GLN HA 1 99 GLU H 3.300 . 4.600 3.469 3.453 3.476 . 0 0 "[ . 1 .]" 1
2826 1 98 GLN HA 1 100 HIS H 3.500 . 5.000 4.211 4.063 4.291 . 0 0 "[ . 1 .]" 1
2827 1 98 GLN QB 1 98 GLN QG 2.100 . 2.200 2.036 2.025 2.052 . 0 0 "[ . 1 .]" 1
2828 1 98 GLN QB 1 99 GLU H 2.300 . 2.900 2.927 2.919 2.940 0.040 7 0 "[ . 1 .]" 1
2829 1 98 GLN QB 1 99 GLU HA 3.700 . 5.400 4.129 4.051 4.161 . 0 0 "[ . 1 .]" 1
2830 1 98 GLN QB 1 99 GLU QB 5.300 . 6.000 3.990 3.926 4.092 . 0 0 "[ . 1 .]" 1
2831 1 98 GLN QB 1 100 HIS H 4.400 . 6.000 4.748 4.702 4.808 . 0 0 "[ . 1 .]" 1
2832 1 98 GLN HE21 1 98 GLN QG 3.900 . 5.800 2.141 2.090 2.392 . 0 0 "[ . 1 .]" 1
2833 1 98 GLN QG 1 99 GLU H 3.200 . 4.500 4.192 4.129 4.255 . 0 0 "[ . 1 .]" 1
2834 1 98 GLN QG 1 99 GLU HA 4.000 . 6.000 5.860 5.799 5.890 . 0 0 "[ . 1 .]" 1
2835 1 99 GLU H 1 99 GLU QB 2.000 . 2.400 2.433 2.327 2.458 0.058 15 0 "[ . 1 .]" 1
2836 1 99 GLU H 1 99 GLU QG 2.900 . 3.900 3.140 3.058 3.667 . 0 0 "[ . 1 .]" 1
2837 1 99 GLU H 1 100 HIS H 2.100 . 2.600 2.350 2.231 2.471 . 0 0 "[ . 1 .]" 1
2838 1 99 GLU H 1 100 HIS HA 5.700 . 6.000 4.863 4.826 4.974 . 0 0 "[ . 1 .]" 1
2839 1 99 GLU H 1 100 HIS QB 3.200 . 4.500 4.095 3.971 4.343 . 0 0 "[ . 1 .]" 1
2840 1 99 GLU H 1 100 HIS HD1 3.400 . 4.900 3.139 2.808 3.601 . 0 0 "[ . 1 .]" 1
2841 1 99 GLU HA 1 99 GLU QB 2.000 . 2.400 2.415 2.407 2.440 0.040 1 0 "[ . 1 .]" 1
2842 1 99 GLU HA 1 99 GLU QG 2.100 . 2.200 2.215 2.205 2.226 0.026 3 0 "[ . 1 .]" 1
2843 1 99 GLU HA 1 100 HIS H 3.200 . 4.500 3.197 3.071 3.303 . 0 0 "[ . 1 .]" 1
2844 1 99 GLU HA 1 100 HIS HD1 3.100 . 4.300 4.264 4.201 4.309 0.009 6 0 "[ . 1 .]" 1
2845 1 99 GLU QB 1 99 GLU QG 2.200 . 2.200 2.044 2.012 2.058 . 0 0 "[ . 1 .]" 1
2846 1 99 GLU QB 1 100 HIS H 2.800 . 3.800 3.582 3.451 3.707 . 0 0 "[ . 1 .]" 1
2847 1 99 GLU QB 1 100 HIS QB 5.400 . 6.000 4.334 4.121 4.460 . 0 0 "[ . 1 .]" 1
2848 1 99 GLU QB 1 100 HIS HD1 2.600 . 3.400 2.315 2.179 2.474 . 0 0 "[ . 1 .]" 1
2849 1 99 GLU QG 1 100 HIS H 4.600 . 6.000 4.581 4.533 4.854 . 0 0 "[ . 1 .]" 1
2850 1 99 GLU QG 1 100 HIS HD1 3.100 . 4.300 4.248 4.162 4.310 0.010 3 0 "[ . 1 .]" 1
2851 1 100 HIS H 1 100 HIS HA 2.300 . 3.000 2.912 2.893 2.932 . 0 0 "[ . 1 .]" 1
2852 1 100 HIS H 1 100 HIS QB 2.300 . 2.900 2.781 2.712 2.883 . 0 0 "[ . 1 .]" 1
2853 1 100 HIS H 1 100 HIS HD1 3.000 . 4.200 3.309 3.079 3.542 . 0 0 "[ . 1 .]" 1
2854 1 100 HIS H 1 101 HIS H 2.000 . 2.500 1.815 1.738 1.907 . 0 0 "[ . 1 .]" 1
2855 1 100 HIS H 1 101 HIS QB 4.600 . 6.000 3.806 3.664 3.864 . 0 0 "[ . 1 .]" 1
2856 1 100 HIS H 1 107 LEU QD 2.700 . 3.600 3.490 3.343 3.621 0.021 4 0 "[ . 1 .]" 1
2857 1 100 HIS H 1 107 LEU HG 5.100 . 6.000 5.997 5.867 6.021 0.021 15 0 "[ . 1 .]" 1
2858 1 100 HIS HA 1 100 HIS QB 2.400 . 2.800 2.380 2.359 2.400 . 0 0 "[ . 1 .]" 1
2859 1 100 HIS HA 1 100 HIS HD1 3.900 . 5.800 3.232 3.152 3.295 . 0 0 "[ . 1 .]" 1
2860 1 100 HIS HA 1 101 HIS H 2.600 . 3.400 3.353 3.179 3.468 0.068 3 0 "[ . 1 .]" 1
2861 1 100 HIS HA 1 107 LEU QD 3.400 . 4.800 4.205 3.950 4.468 . 0 0 "[ . 1 .]" 1
2862 1 100 HIS QB 1 100 HIS HD1 2.700 . 3.600 2.327 2.314 2.378 . 0 0 "[ . 1 .]" 1
2863 1 100 HIS QB 1 101 HIS H 3.100 . 4.300 3.247 2.827 3.644 . 0 0 "[ . 1 .]" 1
2864 1 100 HIS QB 1 102 GLU QG 3.200 . 4.500 4.475 4.221 4.547 0.047 11 0 "[ . 1 .]" 1
2865 1 100 HIS QB 1 107 LEU QB 5.000 . 6.000 4.798 4.348 5.329 . 0 0 "[ . 1 .]" 1
2866 1 100 HIS QB 1 107 LEU QD 2.300 . 2.800 2.189 1.809 2.548 . 0 0 "[ . 1 .]" 1
2867 1 100 HIS QB 1 107 LEU HG 5.000 . 6.000 4.479 4.097 4.860 . 0 0 "[ . 1 .]" 1
2868 1 101 HIS H 1 101 HIS HA 2.900 . 4.000 2.808 2.741 2.869 . 0 0 "[ . 1 .]" 1
2869 1 101 HIS H 1 101 HIS QB 2.900 . 3.400 2.413 2.227 2.532 . 0 0 "[ . 1 .]" 1
2870 1 101 HIS H 1 107 LEU QD 3.500 . 4.000 3.087 2.532 3.598 . 0 0 "[ . 1 .]" 1
2871 1 101 HIS HA 1 101 HIS QB 2.200 . 2.800 2.179 2.166 2.184 . 0 0 "[ . 1 .]" 1
2872 1 101 HIS HA 1 101 HIS HD1 4.400 . 6.000 3.920 3.848 3.969 . 0 0 "[ . 1 .]" 1
2873 1 101 HIS HA 1 102 GLU H 1.900 . 2.400 2.141 2.116 2.171 . 0 0 "[ . 1 .]" 1
2874 1 101 HIS HA 1 107 LEU HA 2.400 . 3.100 2.605 2.368 2.834 . 0 0 "[ . 1 .]" 1
2875 1 101 HIS HA 1 107 LEU QB 3.300 . 4.700 3.629 3.327 3.868 . 0 0 "[ . 1 .]" 1
2876 1 101 HIS HA 1 107 LEU QD 2.200 . 2.800 2.547 1.940 2.802 0.002 14 0 "[ . 1 .]" 1
2877 1 101 HIS HA 1 107 LEU HG 4.400 . 6.000 5.223 4.649 5.512 . 0 0 "[ . 1 .]" 1
2878 1 101 HIS HA 1 108 TYR H 3.700 . 5.400 4.022 3.605 4.589 . 0 0 "[ . 1 .]" 1
2879 1 101 HIS QB 1 101 HIS HD1 3.000 . 4.100 2.363 2.313 2.410 . 0 0 "[ . 1 .]" 1
2880 1 101 HIS QB 1 102 GLU H 3.000 . 4.100 3.525 3.438 3.623 . 0 0 "[ . 1 .]" 1
2881 1 101 HIS QB 1 102 GLU QB 4.900 . 6.000 5.129 4.968 5.318 . 0 0 "[ . 1 .]" 1
2882 1 101 HIS QB 1 105 PHE HA 3.000 . 4.100 3.865 3.436 4.120 0.020 2 0 "[ . 1 .]" 1
2883 1 101 HIS QB 1 107 LEU HA 3.000 . 4.100 3.471 3.191 3.822 . 0 0 "[ . 1 .]" 1
2884 1 101 HIS QB 1 107 LEU QB 2.400 . 3.100 3.136 3.106 3.175 0.075 10 0 "[ . 1 .]" 1
2885 1 101 HIS QB 1 107 LEU QD 3.500 . 5.000 2.926 2.299 3.395 . 0 0 "[ . 1 .]" 1
2886 1 101 HIS HD1 1 102 GLU QG 4.000 . 6.000 5.913 5.784 6.007 0.007 10 0 "[ . 1 .]" 1
2887 1 101 HIS HD1 1 103 GLU HA 2.300 . 3.000 2.984 2.703 3.019 0.019 10 0 "[ . 1 .]" 1
2888 1 101 HIS HD1 1 105 PHE H 4.200 . 6.000 3.173 2.467 3.634 . 0 0 "[ . 1 .]" 1
2889 1 101 HIS HD1 1 105 PHE HA 2.700 . 3.600 3.226 2.822 3.601 0.001 13 0 "[ . 1 .]" 1
2890 1 102 GLU H 1 102 GLU QB 2.700 . 3.600 2.376 2.269 2.517 . 0 0 "[ . 1 .]" 1
2891 1 102 GLU H 1 102 GLU QG 4.000 . 5.100 2.576 2.378 2.901 . 0 0 "[ . 1 .]" 1
2892 1 102 GLU H 1 103 GLU H 4.800 . 6.000 3.701 3.584 3.890 . 0 0 "[ . 1 .]" 1
2893 1 102 GLU HA 1 102 GLU QB 2.300 . 3.000 2.389 2.329 2.439 . 0 0 "[ . 1 .]" 1
2894 1 102 GLU HA 1 102 GLU QG . . 2.800 2.444 2.250 2.662 . 0 0 "[ . 1 .]" 1
2895 1 102 GLU HA 1 103 GLU H 5.100 . 6.000 2.504 2.387 2.554 . 0 0 "[ . 1 .]" 1
2896 1 102 GLU HA 1 103 GLU HA 3.400 . 4.900 4.617 4.535 4.655 . 0 0 "[ . 1 .]" 1
2897 1 102 GLU QB 1 102 GLU QG 2.200 . 2.800 2.024 2.016 2.061 . 0 0 "[ . 1 .]" 1
2898 1 102 GLU QB 1 103 GLU H 3.100 . 4.300 3.904 3.861 3.913 . 0 0 "[ . 1 .]" 1
2899 1 102 GLU QB 1 108 TYR QD 3.000 . 4.200 4.009 3.611 4.251 0.051 10 0 "[ . 1 .]" 1
2900 1 102 GLU QB 1 108 TYR QE 3.000 . 4.100 3.735 2.097 4.138 0.038 10 0 "[ . 1 .]" 1
2901 1 102 GLU QG 1 103 GLU H 5.400 . 6.000 4.566 4.473 4.674 . 0 0 "[ . 1 .]" 1
2902 1 102 GLU QG 1 108 TYR QD 2.900 . 4.000 3.548 2.819 4.046 0.046 6 0 "[ . 1 .]" 1
2903 1 102 GLU QG 1 108 TYR QE 3.200 . 4.500 2.599 1.954 3.047 . 0 0 "[ . 1 .]" 1
2904 1 103 GLU H 1 103 GLU HA 2.700 . 3.600 2.281 2.269 2.300 . 0 0 "[ . 1 .]" 1
2905 1 103 GLU H 1 103 GLU QB 3.900 . 5.800 2.862 2.713 2.957 . 0 0 "[ . 1 .]" 1
2906 1 103 GLU H 1 104 ASP QB 4.100 . 6.000 5.420 4.982 6.066 0.066 6 0 "[ . 1 .]" 1
2907 1 103 GLU H 1 106 PHE H 4.500 . 6.000 5.173 4.851 5.440 . 0 0 "[ . 1 .]" 1
2908 1 103 GLU HA 1 103 GLU QB 2.200 . 2.800 2.474 2.383 2.535 . 0 0 "[ . 1 .]" 1
2909 1 103 GLU HA 1 103 GLU QG 1.900 . 2.300 2.224 2.093 2.351 0.051 7 0 "[ . 1 .]" 1
2910 1 103 GLU HA 1 105 PHE QD 4.700 . 6.000 5.093 4.519 5.741 . 0 0 "[ . 1 .]" 1
2911 1 103 GLU QB 1 103 GLU QG 1.800 . 2.200 2.046 2.002 2.079 . 0 0 "[ . 1 .]" 1
2912 1 104 ASP HA 1 104 ASP QB 2.400 . 3.100 2.293 2.150 2.543 . 0 0 "[ . 1 .]" 1
2913 1 104 ASP HA 1 105 PHE H 2.800 . 3.800 3.086 2.974 3.224 . 0 0 "[ . 1 .]" 1
2914 1 104 ASP HA 1 105 PHE QD 3.000 . 4.100 3.275 2.639 4.126 0.026 8 0 "[ . 1 .]" 1
2915 1 104 ASP HA 1 106 PHE H 4.400 . 6.000 4.253 4.132 4.334 . 0 0 "[ . 1 .]" 1
2916 1 104 ASP HA 1 106 PHE QB 4.200 . 6.000 4.716 4.626 4.808 . 0 0 "[ . 1 .]" 1
2917 1 104 ASP QB 1 105 PHE H 4.800 . 6.000 3.782 3.508 3.994 . 0 0 "[ . 1 .]" 1
2918 1 104 ASP QB 1 106 PHE QB 2.600 . 2.800 2.508 2.228 2.827 0.027 10 0 "[ . 1 .]" 1
2919 1 104 ASP QB 1 107 LEU H 5.000 . 6.000 5.998 5.918 6.047 0.047 2 0 "[ . 1 .]" 1
2920 1 105 PHE H 1 105 PHE HA 1.900 . 2.400 2.278 2.269 2.292 . 0 0 "[ . 1 .]" 1
2921 1 105 PHE H 1 105 PHE QB 3.000 . 4.100 3.269 3.185 3.321 . 0 0 "[ . 1 .]" 1
2922 1 105 PHE H 1 105 PHE QD 5.000 . 6.000 2.882 2.306 3.635 . 0 0 "[ . 1 .]" 1
2923 1 105 PHE H 1 105 PHE QE 5.100 . 6.000 4.314 4.013 4.720 . 0 0 "[ . 1 .]" 1
2924 1 105 PHE H 1 106 PHE H 2.700 . 3.600 2.775 2.699 2.898 . 0 0 "[ . 1 .]" 1
2925 1 105 PHE H 1 106 PHE QB 3.100 . 5.000 4.627 4.565 4.686 . 0 0 "[ . 1 .]" 1
2926 1 105 PHE H 1 106 PHE QB 2.900 . 4.000 2.493 1.881 3.440 . 0 0 "[ . 1 .]" 1
2927 1 105 PHE HA 1 105 PHE QB 2.200 . 2.600 2.390 2.362 2.440 . 0 0 "[ . 1 .]" 1
2928 1 105 PHE HA 1 105 PHE QD 2.600 . 3.400 2.809 2.222 3.167 . 0 0 "[ . 1 .]" 1
2929 1 105 PHE HA 1 105 PHE QE 3.300 . 4.700 4.568 4.310 4.722 0.022 1 0 "[ . 1 .]" 1
2930 1 105 PHE HA 1 106 PHE H 3.100 . 4.300 3.048 2.952 3.122 . 0 0 "[ . 1 .]" 1
2931 1 105 PHE QB 1 105 PHE QD 2.600 . 3.400 2.138 2.126 2.146 . 0 0 "[ . 1 .]" 1
2932 1 105 PHE QB 1 105 PHE QE 3.100 . 4.300 3.934 3.927 3.938 . 0 0 "[ . 1 .]" 1
2933 1 105 PHE QB 1 105 PHE QE 4.100 . 6.000 3.818 3.812 3.821 . 0 0 "[ . 1 .]" 1
2934 1 106 PHE H 1 106 PHE HA 2.900 . 4.000 2.936 2.932 2.940 . 0 0 "[ . 1 .]" 1
2935 1 106 PHE H 1 106 PHE QB 3.200 . 3.300 2.367 2.308 2.416 . 0 0 "[ . 1 .]" 1
2936 1 106 PHE H 1 106 PHE QD 2.600 . 3.400 3.448 3.424 3.470 0.070 3 0 "[ . 1 .]" 1
2937 1 106 PHE HA 1 106 PHE QB 3.500 . 3.500 2.523 2.519 2.531 . 0 0 "[ . 1 .]" 1
2938 1 106 PHE HA 1 106 PHE QD 2.900 . 3.900 2.187 2.081 2.367 . 0 0 "[ . 1 .]" 1
2939 1 106 PHE HA 1 107 LEU H 2.500 . 3.300 2.420 2.096 2.745 . 0 0 "[ . 1 .]" 1
2940 1 106 PHE QB 1 106 PHE QD . . 2.700 2.209 2.166 2.236 . 0 0 "[ . 1 .]" 1
2941 1 106 PHE QB 1 107 LEU H 2.700 . 3.600 2.516 1.883 3.539 . 0 0 "[ . 1 .]" 1
2942 1 106 PHE QB 1 108 TYR QD 4.100 . 6.000 4.883 2.833 5.657 . 0 0 "[ . 1 .]" 1
2943 1 107 LEU H 1 107 LEU QB 2.900 . 3.900 2.557 2.198 2.861 . 0 0 "[ . 1 .]" 1
2944 1 107 LEU H 1 107 LEU QD 4.200 . 6.000 3.645 3.484 3.799 . 0 0 "[ . 1 .]" 1
2945 1 107 LEU H 1 107 LEU HG 5.500 . 6.000 4.940 4.608 5.213 . 0 0 "[ . 1 .]" 1
2946 1 107 LEU H 1 108 TYR H 4.700 . 6.000 3.790 3.260 4.501 . 0 0 "[ . 1 .]" 1
2947 1 107 LEU HA 1 107 LEU QB 2.500 . 3.300 2.341 2.305 2.398 . 0 0 "[ . 1 .]" 1
2948 1 107 LEU HA 1 107 LEU QD 2.100 . 2.700 2.121 1.973 2.292 . 0 0 "[ . 1 .]" 1
2949 1 107 LEU HA 1 107 LEU HG 3.000 . 4.100 3.868 3.784 3.903 . 0 0 "[ . 1 .]" 1
2950 1 107 LEU HA 1 108 TYR H 2.100 . 2.600 2.255 2.207 2.327 . 0 0 "[ . 1 .]" 1
2951 1 107 LEU QB 1 107 LEU QD 2.500 . 2.700 2.005 1.981 2.032 . 0 0 "[ . 1 .]" 1
2952 1 107 LEU QB 1 107 LEU HG 2.100 . 2.600 2.172 2.162 2.179 . 0 0 "[ . 1 .]" 1
2953 1 107 LEU QB 1 108 TYR H 2.900 . 4.000 3.991 3.843 4.044 0.044 6 0 "[ . 1 .]" 1
2954 1 107 LEU QD 1 108 TYR H 3.000 . 3.000 2.825 2.320 3.030 0.030 7 0 "[ . 1 .]" 1
2955 1 107 LEU QD 1 109 ILE H 4.200 . 6.000 3.586 3.426 3.938 . 0 0 "[ . 1 .]" 1
2956 1 107 LEU QD 1 109 ILE MD 2.900 . 4.000 1.800 1.761 1.860 0.039 15 0 "[ . 1 .]" 1
2957 1 107 LEU QD 1 109 ILE QG 2.000 . 2.500 1.663 1.562 1.721 . 0 0 "[ . 1 .]" 1
2958 1 107 LEU HG 1 108 TYR H 4.300 . 6.000 5.310 4.782 5.540 . 0 0 "[ . 1 .]" 1
2959 1 107 LEU HG 1 109 ILE MD 2.500 . 3.300 3.363 3.333 3.422 0.122 9 0 "[ . 1 .]" 1
2960 1 108 TYR H 1 108 TYR QB 2.700 . 3.600 2.533 2.194 2.977 . 0 0 "[ . 1 .]" 1
2961 1 108 TYR H 1 108 TYR QD 2.800 . 3.800 2.155 1.840 2.448 . 0 0 "[ . 1 .]" 1
2962 1 108 TYR H 1 109 ILE H 4.000 . 6.000 4.498 4.431 4.572 . 0 0 "[ . 1 .]" 1
2963 1 108 TYR HA 1 108 TYR QB 2.600 . 3.500 2.158 2.146 2.178 . 0 0 "[ . 1 .]" 1
2964 1 108 TYR HA 1 108 TYR QD 3.200 . 4.400 3.640 3.612 3.709 . 0 0 "[ . 1 .]" 1
2965 1 108 TYR HA 1 109 ILE H 2.000 . 2.500 2.122 2.039 2.188 . 0 0 "[ . 1 .]" 1
2966 1 108 TYR HA 1 109 ILE HB 3.100 . 4.300 4.343 4.329 4.359 0.059 5 0 "[ . 1 .]" 1
2967 1 108 TYR QB 1 108 TYR QD 2.500 . 3.300 2.125 2.093 2.139 . 0 0 "[ . 1 .]" 1
2968 1 108 TYR QB 1 109 ILE H . . 4.900 3.115 3.009 3.184 . 0 0 "[ . 1 .]" 1
2969 1 108 TYR QB 1 109 ILE HB 4.900 . 6.000 5.469 5.293 5.548 . 0 0 "[ . 1 .]" 1
2970 1 108 TYR QD 1 109 ILE H 4.400 . 6.000 4.228 3.971 4.701 . 0 0 "[ . 1 .]" 1
2971 1 109 ILE H 1 109 ILE HA 3.000 . 4.100 2.944 2.938 2.951 . 0 0 "[ . 1 .]" 1
2972 1 109 ILE H 1 109 ILE HB 2.600 . 3.400 2.629 2.485 2.712 . 0 0 "[ . 1 .]" 1
2973 1 109 ILE H 1 109 ILE MD 3.700 . 5.400 4.315 4.134 4.403 . 0 0 "[ . 1 .]" 1
2974 1 109 ILE H 1 109 ILE QG 2.700 . 3.600 2.838 2.621 2.958 . 0 0 "[ . 1 .]" 1
2975 1 109 ILE H 1 109 ILE QG 2.900 . 3.900 2.768 2.577 2.870 . 0 0 "[ . 1 .]" 1
2976 1 109 ILE H 1 110 ALA H 6.000 . 6.000 4.456 4.438 4.494 . 0 0 "[ . 1 .]" 1
2977 1 109 ILE HA 1 109 ILE HB 2.700 . 3.600 3.014 3.010 3.017 . 0 0 "[ . 1 .]" 1
2978 1 109 ILE HA 1 109 ILE MD 2.700 . 3.600 3.620 3.583 3.641 0.041 10 0 "[ . 1 .]" 1
2979 1 109 ILE HA 1 109 ILE QG 3.100 . 3.100 2.293 2.270 2.319 . 0 0 "[ . 1 .]" 1
2980 1 109 ILE HA 1 109 ILE QG 2.300 . 2.900 2.085 2.080 2.089 . 0 0 "[ . 1 .]" 1
2981 1 109 ILE HA 1 110 ALA H 2.100 . 2.600 2.429 2.390 2.466 . 0 0 "[ . 1 .]" 1
2982 1 109 ILE HA 1 110 ALA MB 3.000 . 4.100 3.915 3.782 3.946 . 0 0 "[ . 1 .]" 1
2983 1 109 ILE HB 1 109 ILE MD 2.300 . 3.000 2.647 2.587 2.734 . 0 0 "[ . 1 .]" 1
2984 1 109 ILE HB 1 109 ILE QG 2.600 . 3.100 2.228 2.205 2.241 . 0 0 "[ . 1 .]" 1
2985 1 109 ILE HB 1 109 ILE QG 2.100 . 2.600 1.936 1.926 1.941 . 0 0 "[ . 1 .]" 1
2986 1 109 ILE HB 1 110 ALA H 3.400 . 4.800 3.559 3.498 3.612 . 0 0 "[ . 1 .]" 1
2987 1 109 ILE MD 1 109 ILE QG 2.100 . 2.400 1.876 1.860 1.887 . 0 0 "[ . 1 .]" 1
2988 1 109 ILE MD 1 109 ILE QG 1.900 . 2.300 1.640 1.599 1.670 . 0 0 "[ . 1 .]" 1
2989 1 109 ILE MD 1 110 ALA H 4.000 . 6.000 4.240 4.186 4.276 . 0 0 "[ . 1 .]" 1
2990 1 109 ILE QG 1 110 ALA H 2.200 . 2.800 1.795 1.774 1.822 . 0 0 "[ . 1 .]" 1
2991 1 109 ILE QG 1 110 ALA HA 3.300 . 4.700 3.427 3.377 3.488 . 0 0 "[ . 1 .]" 1
2992 1 109 ILE QG 1 110 ALA MB 2.800 . 3.800 3.531 3.516 3.542 . 0 0 "[ . 1 .]" 1
2993 1 109 ILE QG 1 111 TYR H 3.400 . 4.800 4.505 4.464 4.548 . 0 0 "[ . 1 .]" 1
2994 1 109 ILE QG 1 111 TYR QB 4.500 . 6.000 3.753 3.669 3.837 . 0 0 "[ . 1 .]" 1
2995 1 109 ILE QG 1 110 ALA H 3.100 . 4.300 3.949 3.901 4.006 . 0 0 "[ . 1 .]" 1
2996 1 110 ALA H 1 110 ALA HA 2.900 . 3.900 2.944 2.940 2.950 . 0 0 "[ . 1 .]" 1
2997 1 110 ALA H 1 110 ALA MB 2.100 . 2.600 2.516 2.493 2.567 . 0 0 "[ . 1 .]" 1
2998 1 110 ALA H 1 111 TYR H 4.900 . 6.000 4.426 4.419 4.437 . 0 0 "[ . 1 .]" 1
2999 1 110 ALA HA 1 110 ALA MB 1.900 . 2.300 2.116 2.083 2.124 . 0 0 "[ . 1 .]" 1
3000 1 110 ALA HA 1 111 TYR H 1.900 . 2.300 2.370 2.340 2.396 0.096 4 0 "[ . 1 .]" 1
3001 1 110 ALA HA 1 111 TYR QD 2.800 . 3.800 3.595 3.476 3.687 . 0 0 "[ . 1 .]" 1
3002 1 110 ALA MB 1 111 TYR H 2.400 . 3.100 2.390 2.294 2.645 . 0 0 "[ . 1 .]" 1
3003 1 110 ALA MB 1 111 TYR HA 3.400 . 4.800 3.855 3.818 3.898 . 0 0 "[ . 1 .]" 1
3004 1 110 ALA MB 1 117 TYR QD 2.300 . 3.000 2.626 2.467 2.883 . 0 0 "[ . 1 .]" 1
3005 1 110 ALA MB 1 117 TYR QE 1.900 . 2.300 1.945 1.822 2.298 . 0 0 "[ . 1 .]" 1
3006 1 111 TYR H 1 111 TYR HA 2.400 . 3.100 2.919 2.912 2.927 . 0 0 "[ . 1 .]" 1
3007 1 111 TYR H 1 111 TYR QB 3.500 . 3.800 3.083 3.058 3.098 . 0 0 "[ . 1 .]" 1
3008 1 111 TYR H 1 111 TYR QD 2.500 . 3.300 3.107 2.982 3.211 . 0 0 "[ . 1 .]" 1
3009 1 111 TYR H 1 112 SER H 4.100 . 6.000 4.207 4.145 4.241 . 0 0 "[ . 1 .]" 1
3010 1 111 TYR HA 1 111 TYR QB 2.000 . 2.200 2.180 2.177 2.185 . 0 0 "[ . 1 .]" 1
3011 1 111 TYR HA 1 111 TYR QD 3.200 . 4.500 3.694 3.680 3.706 . 0 0 "[ . 1 .]" 1
3012 1 111 TYR HA 1 112 SER H 2.100 . 2.600 2.157 2.145 2.186 . 0 0 "[ . 1 .]" 1
3013 1 111 TYR HA 1 112 SER HA 3.500 . 5.000 4.427 4.412 4.439 . 0 0 "[ . 1 .]" 1
3014 1 111 TYR HA 1 112 SER QB 5.000 . 6.000 3.989 3.949 4.047 . 0 0 "[ . 1 .]" 1
3015 1 111 TYR QB 1 111 TYR QD 2.400 . 2.800 2.124 2.122 2.127 . 0 0 "[ . 1 .]" 1
3016 1 111 TYR QB 1 112 SER H 2.600 . 3.400 3.193 3.139 3.281 . 0 0 "[ . 1 .]" 1
3017 1 111 TYR QD 1 112 SER HA 3.400 . 4.900 3.503 3.408 3.608 . 0 0 "[ . 1 .]" 1
3018 1 112 SER H 1 112 SER HA 2.700 . 3.600 2.954 2.951 2.956 . 0 0 "[ . 1 .]" 1
3019 1 112 SER H 1 112 SER QB 3.100 . 4.300 2.522 2.480 2.601 . 0 0 "[ . 1 .]" 1
3020 1 112 SER H 1 112 SER HG 3.800 . 5.600 4.531 4.464 4.669 . 0 0 "[ . 1 .]" 1
3021 1 112 SER H 1 114 GLU H 6.000 . 6.000 4.334 4.223 4.472 . 0 0 "[ . 1 .]" 1
3022 1 112 SER HA 1 112 SER QB 2.400 . 3.000 2.277 2.171 2.498 . 0 0 "[ . 1 .]" 1
3023 1 112 SER HA 1 113 ASP H 2.300 . 3.000 2.434 2.391 2.462 . 0 0 "[ . 1 .]" 1
3024 1 112 SER QB 1 112 SER HG 3.000 . 4.100 2.095 2.057 2.138 . 0 0 "[ . 1 .]" 1
3025 1 112 SER QB 1 113 ASP H 3.700 . 5.000 3.070 2.906 3.224 . 0 0 "[ . 1 .]" 1
3026 1 112 SER QB 1 114 GLU H 2.900 . 4.000 2.884 2.164 3.211 . 0 0 "[ . 1 .]" 1
3027 1 112 SER QB 1 114 GLU QB 3.300 . 4.700 3.957 3.360 4.226 . 0 0 "[ . 1 .]" 1
3028 1 112 SER QB 1 114 GLU QG 3.400 . 4.800 4.597 4.009 4.777 . 0 0 "[ . 1 .]" 1
3029 1 112 SER QB 1 117 TYR QE 3.800 . 5.600 5.028 4.875 5.198 . 0 0 "[ . 1 .]" 1
3030 1 112 SER QB 1 118 GLY QA 5.200 . 6.000 2.087 1.817 2.668 . 0 0 "[ . 1 .]" 1
3031 1 112 SER HG 1 113 ASP H 3.800 . 5.600 2.156 2.034 2.286 . 0 0 "[ . 1 .]" 1
3032 1 112 SER HG 1 114 GLU H 2.800 . 3.800 2.228 1.948 2.881 . 0 0 "[ . 1 .]" 1
3033 1 112 SER HG 1 114 GLU QB 4.200 . 6.000 3.112 2.725 3.691 . 0 0 "[ . 1 .]" 1
3034 1 113 ASP H 1 113 ASP HA 2.700 . 3.600 2.902 2.881 2.916 . 0 0 "[ . 1 .]" 1
3035 1 113 ASP H 1 113 ASP QB 3.100 . 4.100 2.364 2.291 2.578 . 0 0 "[ . 1 .]" 1
3036 1 113 ASP H 1 114 GLU H 2.300 . 2.900 2.561 2.500 2.643 . 0 0 "[ . 1 .]" 1
3037 1 113 ASP H 1 114 GLU QB 4.200 . 6.000 4.427 4.107 4.583 . 0 0 "[ . 1 .]" 1
3038 1 113 ASP HA 1 113 ASP QB 2.200 . 2.800 2.337 2.184 2.397 . 0 0 "[ . 1 .]" 1
3039 1 113 ASP QB 1 114 GLU H 3.900 . 5.200 3.629 3.413 3.917 . 0 0 "[ . 1 .]" 1
3040 1 113 ASP QB 1 114 GLU QB 3.900 . 5.800 4.739 4.441 5.225 . 0 0 "[ . 1 .]" 1
3041 1 114 GLU H 1 114 GLU QB 2.600 . 3.500 2.704 2.592 2.831 . 0 0 "[ . 1 .]" 1
3042 1 114 GLU H 1 114 GLU QG 2.900 . 3.900 2.959 2.730 3.400 . 0 0 "[ . 1 .]" 1
3043 1 114 GLU H 1 115 SER H 3.900 . 5.800 4.420 4.408 4.462 . 0 0 "[ . 1 .]" 1
3044 1 114 GLU H 1 116 VAL H 4.600 . 6.000 4.167 4.069 4.444 . 0 0 "[ . 1 .]" 1
3045 1 114 GLU HA 1 114 GLU QB 2.200 . 2.800 2.342 2.291 2.441 . 0 0 "[ . 1 .]" 1
3046 1 114 GLU HA 1 114 GLU QG 2.300 . 3.000 2.504 2.317 2.832 . 0 0 "[ . 1 .]" 1
3047 1 114 GLU HA 1 115 SER H 2.000 . 2.500 2.526 2.517 2.533 0.033 1 0 "[ . 1 .]" 1
3048 1 114 GLU HA 1 116 VAL H 3.400 . 4.800 4.068 4.053 4.107 . 0 0 "[ . 1 .]" 1
3049 1 114 GLU QB 1 114 GLU QG 2.200 . 2.600 2.044 2.017 2.079 . 0 0 "[ . 1 .]" 1
3050 1 114 GLU QB 1 115 SER H 2.800 . 3.800 2.182 2.107 2.255 . 0 0 "[ . 1 .]" 1
3051 1 114 GLU QB 1 115 SER HA 5.200 . 6.000 4.296 4.271 4.316 . 0 0 "[ . 1 .]" 1
3052 1 114 GLU QB 1 116 VAL H 2.100 . 2.700 2.371 2.306 2.415 . 0 0 "[ . 1 .]" 1
3053 1 114 GLU QB 1 116 VAL QG 2.700 . 3.600 2.287 2.190 2.461 . 0 0 "[ . 1 .]" 1
3054 1 114 GLU QB 1 118 GLY QA 3.400 . 4.800 3.952 3.727 4.241 . 0 0 "[ . 1 .]" 1
3055 1 114 GLU QG 1 115 SER H 3.400 . 4.900 4.052 3.915 4.210 . 0 0 "[ . 1 .]" 1
3056 1 114 GLU QG 1 115 SER HA 4.400 . 6.000 5.954 5.917 6.009 0.009 15 0 "[ . 1 .]" 1
3057 1 114 GLU QG 1 116 VAL H 3.500 . 4.800 4.393 4.247 4.496 . 0 0 "[ . 1 .]" 1
3058 1 114 GLU QG 1 116 VAL QG 3.500 . 4.500 3.777 3.563 4.068 . 0 0 "[ . 1 .]" 1
3059 1 115 SER H 1 115 SER HA 2.700 . 3.600 2.884 2.876 2.895 . 0 0 "[ . 1 .]" 1
3060 1 115 SER H 1 115 SER QB 2.700 . 3.600 2.683 2.622 2.746 . 0 0 "[ . 1 .]" 1
3061 1 115 SER H 1 116 VAL H 2.200 . 2.800 2.621 2.520 2.655 . 0 0 "[ . 1 .]" 1
3062 1 115 SER H 1 116 VAL HA 5.100 . 6.000 5.125 5.093 5.145 . 0 0 "[ . 1 .]" 1
3063 1 115 SER H 1 116 VAL QG 3.600 . 5.300 3.154 3.109 3.189 . 0 0 "[ . 1 .]" 1
3064 1 115 SER HA 1 115 SER QB 2.100 . 2.600 2.187 2.185 2.189 . 0 0 "[ . 1 .]" 1
3065 1 115 SER HA 1 116 VAL H 2.700 . 3.600 3.244 3.211 3.322 . 0 0 "[ . 1 .]" 1
3066 1 115 SER HA 1 116 VAL HA 4.900 . 6.000 4.507 4.482 4.536 . 0 0 "[ . 1 .]" 1
3067 1 115 SER QB 1 116 VAL H 3.400 . 4.900 3.902 3.837 3.924 . 0 0 "[ . 1 .]" 1
3068 1 116 VAL H 1 116 VAL HA 2.400 . 3.100 2.935 2.929 2.944 . 0 0 "[ . 1 .]" 1
3069 1 116 VAL H 1 116 VAL HB 2.500 . 3.300 3.318 3.308 3.330 0.030 6 0 "[ . 1 .]" 1
3070 1 116 VAL H 1 116 VAL QG 2.100 . 2.600 1.981 1.930 2.026 . 0 0 "[ . 1 .]" 1
3071 1 116 VAL H 1 117 TYR H 3.200 . 4.400 4.447 4.415 4.459 0.059 4 0 "[ . 1 .]" 1
3072 1 116 VAL H 1 117 TYR HA 4.200 . 6.000 5.142 5.090 5.195 . 0 0 "[ . 1 .]" 1
3073 1 116 VAL HA 1 116 VAL HB 2.500 . 3.300 2.845 2.831 2.865 . 0 0 "[ . 1 .]" 1
3074 1 116 VAL HA 1 116 VAL QG 1.800 . 2.200 2.071 2.032 2.104 . 0 0 "[ . 1 .]" 1
3075 1 116 VAL HA 1 117 TYR H 2.100 . 2.600 2.319 2.209 2.389 . 0 0 "[ . 1 .]" 1
3076 1 116 VAL HA 1 117 TYR QB 3.500 . 5.000 4.238 4.209 4.275 . 0 0 "[ . 1 .]" 1
3077 1 116 VAL HA 1 118 GLY H 6.000 . 6.000 4.733 4.590 5.239 . 0 0 "[ . 1 .]" 1
3078 1 116 VAL HB 1 116 VAL QG 2.000 . 2.300 1.891 1.888 1.895 . 0 0 "[ . 1 .]" 1
3079 1 116 VAL HB 1 117 TYR H 2.700 . 3.600 2.973 2.795 3.378 . 0 0 "[ . 1 .]" 1
3080 1 116 VAL HB 1 119 LEU H 3.900 . 5.800 4.236 2.937 4.896 . 0 0 "[ . 1 .]" 1
3081 1 116 VAL HB 1 119 LEU QB 2.500 . 3.300 3.343 3.333 3.348 0.048 6 0 "[ . 1 .]" 1
3082 1 116 VAL QG 1 117 TYR H 2.500 . 3.300 2.646 2.420 2.899 . 0 0 "[ . 1 .]" 1
3083 1 116 VAL QG 1 117 TYR HA 3.300 . 4.700 4.595 4.517 4.689 . 0 0 "[ . 1 .]" 1
3084 1 116 VAL QG 1 117 TYR HA 3.000 . 4.200 4.025 3.975 4.141 . 0 0 "[ . 1 .]" 1
3085 1 116 VAL QG 1 117 TYR QB 3.300 . 4.700 3.830 3.775 3.937 . 0 0 "[ . 1 .]" 1
3086 1 116 VAL QG 1 117 TYR QD 4.300 . 6.000 5.182 5.174 5.194 . 0 0 "[ . 1 .]" 1
3087 1 116 VAL QG 1 117 TYR QR 3.500 . 5.000 5.019 5.010 5.029 0.029 15 0 "[ . 1 .]" 1
3088 1 116 VAL QG 1 118 GLY H 3.500 . 5.000 4.206 4.018 4.846 . 0 0 "[ . 1 .]" 1
3089 1 116 VAL QG 1 118 GLY QA 3.900 . 5.800 4.451 4.367 4.622 . 0 0 "[ . 1 .]" 1
3090 1 116 VAL QG 1 119 LEU H 4.000 . 6.000 4.554 3.411 5.083 . 0 0 "[ . 1 .]" 1
3091 1 116 VAL QG 1 119 LEU QB 3.300 . 4.600 3.480 3.424 3.589 . 0 0 "[ . 1 .]" 1
3092 1 117 TYR H 1 117 TYR HA 2.600 . 3.500 2.789 2.724 2.814 . 0 0 "[ . 1 .]" 1
3093 1 117 TYR H 1 117 TYR QB 2.300 . 2.600 2.262 2.231 2.316 . 0 0 "[ . 1 .]" 1
3094 1 117 TYR H 1 117 TYR QD 3.100 . 4.300 4.192 4.171 4.222 . 0 0 "[ . 1 .]" 1
3095 1 117 TYR H 1 118 GLY H 3.700 . 5.400 3.908 3.806 4.226 . 0 0 "[ . 1 .]" 1
3096 1 117 TYR HA 1 117 TYR QB 2.400 . 2.900 2.296 2.278 2.308 . 0 0 "[ . 1 .]" 1
3097 1 117 TYR HA 1 117 TYR QD 2.400 . 3.100 2.287 2.212 2.384 . 0 0 "[ . 1 .]" 1
3098 1 117 TYR HA 1 117 TYR QE 3.200 . 4.500 4.519 4.479 4.547 0.047 6 0 "[ . 1 .]" 1
3099 1 117 TYR HA 1 118 GLY H 2.300 . 2.900 2.396 2.179 2.461 . 0 0 "[ . 1 .]" 1
3100 1 117 TYR HA 1 119 LEU H 4.000 . 6.000 4.669 4.539 5.129 . 0 0 "[ . 1 .]" 1
3101 1 117 TYR QB 1 117 TYR QD 2.100 . 2.600 2.173 2.159 2.185 . 0 0 "[ . 1 .]" 1
3102 1 117 TYR QB 1 117 TYR QE 3.000 . 4.100 3.953 3.946 3.959 . 0 0 "[ . 1 .]" 1
3103 1 117 TYR QB 1 118 GLY H 3.600 . 4.300 4.052 3.970 4.071 . 0 0 "[ . 1 .]" 1
3104 1 117 TYR QB 1 119 LEU H 5.400 . 6.000 4.201 3.909 5.207 . 0 0 "[ . 1 .]" 1
3105 1 117 TYR QB 1 119 LEU QB 5.200 . 6.000 3.670 3.564 3.886 . 0 0 "[ . 1 .]" 1
3106 1 117 TYR QB 1 119 LEU QB 6.000 . 6.000 3.585 3.492 3.825 . 0 0 "[ . 1 .]" 1
3107 1 117 TYR QR 1 118 GLY QA 2.900 . 3.900 3.932 3.819 3.973 0.073 4 0 "[ . 1 .]" 1
3108 1 117 TYR QR 1 119 LEU H 3.600 . 5.200 4.149 3.784 5.221 0.021 11 0 "[ . 1 .]" 1
3109 1 117 TYR QR 1 119 LEU QD 2.800 . 3.700 1.995 1.881 2.161 0.019 2 0 "[ . 1 .]" 1
3110 1 117 TYR QD 1 118 GLY H 3.200 . 4.500 3.836 3.445 3.985 . 0 0 "[ . 1 .]" 1
3111 1 117 TYR QD 1 118 GLY QA 4.100 . 6.000 4.203 4.131 4.252 . 0 0 "[ . 1 .]" 1
3112 1 117 TYR QD 1 119 LEU QB 3.400 . 4.900 3.715 3.602 3.784 . 0 0 "[ . 1 .]" 1
3113 1 117 TYR QD 1 119 LEU QD 3.000 . 4.100 2.040 1.930 2.208 . 0 0 "[ . 1 .]" 1
3114 1 117 TYR QE 1 119 LEU QD 3.400 . 4.800 2.855 2.392 3.131 . 0 0 "[ . 1 .]" 1
3115 1 118 GLY H 1 118 GLY QA 2.600 . 2.600 2.199 2.193 2.204 . 0 0 "[ . 1 .]" 1
3116 1 118 GLY QA 1 119 LEU H 2.100 . 2.700 2.402 2.280 2.482 . 0 0 "[ . 1 .]" 1
3117 1 118 GLY QA 1 119 LEU QB 3.300 . 4.700 4.268 4.073 4.359 . 0 0 "[ . 1 .]" 1
3118 1 119 LEU H 1 119 LEU HA 2.400 . 3.100 2.630 2.434 2.901 . 0 0 "[ . 1 .]" 1
3119 1 119 LEU H 1 119 LEU QB 2.600 . 2.800 2.508 2.399 2.703 . 0 0 "[ . 1 .]" 1
3120 1 119 LEU H 1 119 LEU QD 2.900 . 3.900 2.856 1.991 3.819 0.009 9 0 "[ . 1 .]" 1
3121 1 119 LEU H 1 119 LEU HG 3.100 . 4.300 2.999 2.396 4.436 0.136 2 0 "[ . 1 .]" 1
3122 1 119 LEU HA 1 119 LEU QB 2.300 . 3.000 2.468 2.424 2.530 . 0 0 "[ . 1 .]" 1
3123 1 119 LEU HA 1 119 LEU QB 2.000 . 2.400 2.094 1.967 2.141 . 0 0 "[ . 1 .]" 1
3124 1 119 LEU HA 1 119 LEU QD 2.100 . 2.600 2.650 2.636 2.663 0.063 6 0 "[ . 1 .]" 1
3125 1 119 LEU HA 1 119 LEU HG 2.700 . 3.600 2.274 2.051 2.373 . 0 0 "[ . 1 .]" 1
3126 1 119 LEU QB 1 119 LEU QD 2.100 . 2.700 1.806 1.779 1.910 . 0 0 "[ . 1 .]" 1
3127 1 119 LEU QB 1 119 LEU QD 2.000 . 2.500 1.639 1.624 1.690 . 0 0 "[ . 1 .]" 1
3128 1 119 LEU QD 1 119 LEU HG 2.000 . 2.500 1.881 1.873 1.889 . 0 0 "[ . 1 .]" 1
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