NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
394878 |
1rh8   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1rh8
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 1636
_Distance_constraint_stats_list.Viol_count 1225
_Distance_constraint_stats_list.Viol_total 656.016
_Distance_constraint_stats_list.Viol_max 0.174
_Distance_constraint_stats_list.Viol_rms 0.0077
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0010
_Distance_constraint_stats_list.Viol_average_violations_only 0.0268
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 ALA 0.003 0.003 11 0 "[ . 1 . 2]"
1 2 SER 0.289 0.100 6 0 "[ . 1 . 2]"
1 3 HIS 0.519 0.100 6 0 "[ . 1 . 2]"
1 4 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ILE 0.483 0.048 10 0 "[ . 1 . 2]"
1 6 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 GLU 0.112 0.014 2 0 "[ . 1 . 2]"
1 9 ILE 0.064 0.044 13 0 "[ . 1 . 2]"
1 10 GLN 0.137 0.015 14 0 "[ . 1 . 2]"
1 11 LEU 0.449 0.064 3 0 "[ . 1 . 2]"
1 12 GLN 0.034 0.016 18 0 "[ . 1 . 2]"
1 13 ILE 0.471 0.132 9 0 "[ . 1 . 2]"
1 14 ASN 1.053 0.053 15 0 "[ . 1 . 2]"
1 15 TYR 0.036 0.015 2 0 "[ . 1 . 2]"
1 16 ASP 0.946 0.054 20 0 "[ . 1 . 2]"
1 17 LEU 0.540 0.035 13 0 "[ . 1 . 2]"
1 18 GLY 0.819 0.035 13 0 "[ . 1 . 2]"
1 19 ASN 0.315 0.028 5 0 "[ . 1 . 2]"
1 20 LEU 1.365 0.054 20 0 "[ . 1 . 2]"
1 21 ILE 0.342 0.076 13 0 "[ . 1 . 2]"
1 22 ILE 0.317 0.033 1 0 "[ . 1 . 2]"
1 23 HIS 0.057 0.016 18 0 "[ . 1 . 2]"
1 24 ILE 0.679 0.064 1 0 "[ . 1 . 2]"
1 25 LEU 0.467 0.038 15 0 "[ . 1 . 2]"
1 26 GLN 0.348 0.026 11 0 "[ . 1 . 2]"
1 27 ALA 0.384 0.052 15 0 "[ . 1 . 2]"
1 28 ARG 0.018 0.007 6 0 "[ . 1 . 2]"
1 29 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.485 0.084 5 0 "[ . 1 . 2]"
1 31 VAL 1.422 0.130 8 0 "[ . 1 . 2]"
1 32 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 ASN 0.002 0.002 2 0 "[ . 1 . 2]"
1 36 ASN 0.002 0.002 2 0 "[ . 1 . 2]"
1 37 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 TYR 0.248 0.126 19 0 "[ . 1 . 2]"
1 39 SER 0.248 0.126 19 0 "[ . 1 . 2]"
1 40 ASP 0.027 0.008 17 0 "[ . 1 . 2]"
1 41 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 PHE 0.153 0.012 9 0 "[ . 1 . 2]"
1 43 VAL 0.445 0.038 18 0 "[ . 1 . 2]"
1 44 LYS 0.187 0.069 2 0 "[ . 1 . 2]"
1 45 VAL 1.445 0.103 19 0 "[ . 1 . 2]"
1 46 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 LEU 5.539 0.174 19 0 "[ . 1 . 2]"
1 48 LEU 0.542 0.072 2 0 "[ . 1 . 2]"
1 51 ARG 0.086 0.025 4 0 "[ . 1 . 2]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 GLN 0.191 0.062 17 0 "[ . 1 . 2]"
1 54 VAL 0.543 0.069 2 0 "[ . 1 . 2]"
1 55 MET 0.055 0.025 17 0 "[ . 1 . 2]"
1 56 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.664 0.046 20 0 "[ . 1 . 2]"
1 58 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 SER 0.028 0.014 7 0 "[ . 1 . 2]"
1 62 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLU 0.394 0.103 7 0 "[ . 1 . 2]"
1 64 TYR 0.296 0.103 7 0 "[ . 1 . 2]"
1 65 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ARG 0.127 0.051 7 0 "[ . 1 . 2]"
1 67 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LYS 0.109 0.033 17 0 "[ . 1 . 2]"
1 74 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LEU 0.056 0.014 2 0 "[ . 1 . 2]"
1 76 ASN 0.109 0.033 17 0 "[ . 1 . 2]"
1 77 PRO 0.437 0.084 5 0 "[ . 1 . 2]"
1 78 GLU 0.242 0.052 15 0 "[ . 1 . 2]"
1 79 TRP 0.712 0.038 15 0 "[ . 1 . 2]"
1 80 ASN 0.006 0.006 14 0 "[ . 1 . 2]"
1 81 GLN 0.064 0.016 5 0 "[ . 1 . 2]"
1 82 THR 0.377 0.029 9 0 "[ . 1 . 2]"
1 83 VAL 0.403 0.037 11 0 "[ . 1 . 2]"
1 84 ILE 0.462 0.076 13 0 "[ . 1 . 2]"
1 85 TYR 0.039 0.023 5 0 "[ . 1 . 2]"
1 86 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 SER 0.994 0.052 8 0 "[ . 1 . 2]"
1 88 ILE 1.559 0.126 10 0 "[ . 1 . 2]"
1 89 SER 0.068 0.019 18 0 "[ . 1 . 2]"
1 90 MET 2.335 0.144 13 0 "[ . 1 . 2]"
1 91 GLU 0.362 0.083 2 0 "[ . 1 . 2]"
1 92 GLN 0.288 0.025 13 0 "[ . 1 . 2]"
1 93 LEU 2.556 0.135 18 0 "[ . 1 . 2]"
1 94 MET 0.522 0.060 13 0 "[ . 1 . 2]"
1 95 LYS 0.043 0.021 11 0 "[ . 1 . 2]"
1 96 LYS 4.040 0.143 8 0 "[ . 1 . 2]"
1 97 THR 0.695 0.126 18 0 "[ . 1 . 2]"
1 98 LEU 1.269 0.103 19 0 "[ . 1 . 2]"
1 99 GLU 0.130 0.066 16 0 "[ . 1 . 2]"
1 100 VAL 0.283 0.064 3 0 "[ . 1 . 2]"
1 101 THR 0.281 0.042 1 0 "[ . 1 . 2]"
1 102 VAL 1.285 0.066 3 0 "[ . 1 . 2]"
1 103 TRP 0.278 0.022 17 0 "[ . 1 . 2]"
1 104 ASP 0.074 0.038 5 0 "[ . 1 . 2]"
1 105 TYR 0.164 0.012 9 0 "[ . 1 . 2]"
1 106 ASP 0.004 0.004 13 0 "[ . 1 . 2]"
1 107 ARG 0.097 0.038 12 0 "[ . 1 . 2]"
1 108 PHE 0.016 0.007 16 0 "[ . 1 . 2]"
1 109 SER 0.109 0.038 12 0 "[ . 1 . 2]"
1 110 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 ASN 0.049 0.010 1 0 "[ . 1 . 2]"
1 112 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 PHE 1.191 0.056 17 0 "[ . 1 . 2]"
1 114 LEU 1.284 0.130 8 0 "[ . 1 . 2]"
1 115 GLY 0.902 0.056 17 0 "[ . 1 . 2]"
1 116 GLU 0.087 0.013 17 0 "[ . 1 . 2]"
1 117 VAL 2.926 0.139 8 0 "[ . 1 . 2]"
1 118 LEU 0.303 0.126 18 0 "[ . 1 . 2]"
1 119 ILE 0.080 0.017 2 0 "[ . 1 . 2]"
1 120 ASP 0.048 0.025 10 0 "[ . 1 . 2]"
1 121 LEU 3.117 0.174 19 0 "[ . 1 . 2]"
1 122 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 SER 0.095 0.020 2 0 "[ . 1 . 2]"
1 124 THR 0.251 0.100 18 0 "[ . 1 . 2]"
1 125 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 HIS 0.099 0.028 2 0 "[ . 1 . 2]"
1 127 LEU 2.412 0.144 13 0 "[ . 1 . 2]"
1 128 ASP 0.383 0.086 9 0 "[ . 1 . 2]"
1 129 ASN 1.473 0.137 2 0 "[ . 1 . 2]"
1 130 THR 0.038 0.011 10 0 "[ . 1 . 2]"
1 131 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 ARG 0.293 0.027 11 0 "[ . 1 . 2]"
1 133 TRP 0.044 0.011 9 0 "[ . 1 . 2]"
1 134 TYR 0.873 0.093 10 0 "[ . 1 . 2]"
1 135 PRO 0.075 0.014 2 0 "[ . 1 . 2]"
1 136 LEU 1.810 0.139 8 0 "[ . 1 . 2]"
1 137 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 138 GLU 0.295 0.032 7 0 "[ . 1 . 2]"
1 139 GLN 0.020 0.019 20 0 "[ . 1 . 2]"
1 140 THR 0.001 0.001 10 0 "[ . 1 . 2]"
1 141 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 43 VAL MG2 1 79 TRP HE3 5.500 . 5.500 3.660 3.468 3.884 . 0 0 "[ . 1 . 2]" 1
2 1 43 VAL MG2 1 100 VAL HA 6.500 . 6.500 5.381 5.183 5.417 . 0 0 "[ . 1 . 2]" 1
3 1 9 ILE MD 1 43 VAL MG1 6.000 . 6.000 2.790 2.462 3.341 . 0 0 "[ . 1 . 2]" 1
4 1 47 LEU MD1 1 121 LEU MD1 3.800 . 3.800 1.764 1.680 1.849 0.120 12 0 "[ . 1 . 2]" 1
5 1 47 LEU MD2 1 99 GLU H 6.500 . 6.500 4.639 4.523 4.812 . 0 0 "[ . 1 . 2]" 1
6 1 20 LEU QB 1 47 LEU MD2 6.000 . 6.000 3.566 3.238 3.869 . 0 0 "[ . 1 . 2]" 1
7 1 47 LEU MD2 1 88 ILE MD 4.500 . 4.500 2.591 2.483 3.023 . 0 0 "[ . 1 . 2]" 1
8 1 46 TYR QB 1 54 VAL MG2 4.500 . 4.500 3.126 2.922 3.311 . 0 0 "[ . 1 . 2]" 1
9 1 44 LYS HA 1 57 VAL MG2 5.500 . 5.500 3.781 3.431 4.162 . 0 0 "[ . 1 . 2]" 1
10 1 5 ILE HA 1 5 ILE MD 3.300 . 3.300 2.161 1.959 2.263 . 0 0 "[ . 1 . 2]" 1
11 1 5 ILE MD 1 115 GLY QA 6.000 . 6.000 3.589 3.247 3.714 . 0 0 "[ . 1 . 2]" 1
12 1 5 ILE MD 1 138 GLU QG 6.000 . 6.000 4.097 3.684 4.469 . 0 0 "[ . 1 . 2]" 1
13 1 5 ILE MD 1 31 VAL HB 5.500 . 5.500 3.985 3.729 4.288 . 0 0 "[ . 1 . 2]" 1
14 1 5 ILE MD 1 114 LEU QB 5.500 . 5.500 4.082 4.067 4.088 . 0 0 "[ . 1 . 2]" 1
15 1 9 ILE MG 1 134 TYR QD 6.500 . 6.500 2.655 2.187 3.262 . 0 0 "[ . 1 . 2]" 1
16 1 9 ILE MG 1 136 LEU HG 5.500 . 5.500 3.172 2.731 3.982 . 0 0 "[ . 1 . 2]" 1
17 1 24 ILE MD 1 83 VAL H 5.500 . 5.500 4.124 3.835 4.585 . 0 0 "[ . 1 . 2]" 1
18 1 24 ILE MD 1 82 THR HA 5.500 . 5.500 4.087 3.608 4.589 . 0 0 "[ . 1 . 2]" 1
19 1 24 ILE MD 1 81 GLN QB 6.000 . 6.000 3.324 2.837 4.152 . 0 0 "[ . 1 . 2]" 1
20 1 24 ILE MD 1 57 VAL HA 5.500 . 5.500 3.953 3.583 4.593 . 0 0 "[ . 1 . 2]" 1
21 1 60 ALA MB 1 80 ASN QB 6.000 . 6.000 2.976 2.327 3.569 . 0 0 "[ . 1 . 2]" 1
22 1 64 TYR QD 1 65 LYS QG . . 4.500 3.050 2.463 3.481 . 0 0 "[ . 1 . 2]" 1
23 1 21 ILE MD 1 84 ILE MG 4.500 . 4.500 2.781 2.678 2.875 . 0 0 "[ . 1 . 2]" 1
24 1 13 ILE MD 1 119 ILE QG 7.000 . 7.000 4.223 3.946 4.883 . 0 0 "[ . 1 . 2]" 1
25 1 88 ILE MD 1 93 LEU HA 5.500 . 5.500 3.399 3.080 4.078 . 0 0 "[ . 1 . 2]" 1
26 1 93 LEU MD2 1 124 THR MG 6.000 . 6.000 3.107 2.442 3.575 . 0 0 "[ . 1 . 2]" 1
27 1 20 LEU MD1 1 93 LEU MD2 4.500 . 4.500 2.790 1.889 3.124 . 0 0 "[ . 1 . 2]" 1
28 1 93 LEU MD2 1 127 LEU MD1 4.500 . 4.500 2.946 2.666 3.140 . 0 0 "[ . 1 . 2]" 1
29 1 9 ILE MG 1 100 VAL MG2 4.500 . 4.500 3.120 3.033 3.130 . 0 0 "[ . 1 . 2]" 1
30 1 44 LYS H 1 102 VAL MG2 6.500 . 6.500 4.659 4.564 4.775 . 0 0 "[ . 1 . 2]" 1
31 1 102 VAL MG2 1 116 GLU H 5.500 . 5.500 4.331 4.223 4.423 . 0 0 "[ . 1 . 2]" 1
32 1 119 ILE MG 1 124 THR HB 5.500 . 5.500 3.103 2.778 4.619 . 0 0 "[ . 1 . 2]" 1
33 1 119 ILE MG 1 126 HIS QB 5.500 . 5.500 4.013 3.499 4.094 . 0 0 "[ . 1 . 2]" 1
34 1 119 ILE MG 1 124 THR MG 6.000 . 6.000 4.028 2.770 4.169 . 0 0 "[ . 1 . 2]" 1
35 1 19 ASN HA 1 21 ILE MD 5.500 . 5.500 4.585 4.551 4.595 . 0 0 "[ . 1 . 2]" 1
36 1 13 ILE MG 1 22 ILE HA 4.000 . 4.000 3.349 3.333 3.368 . 0 0 "[ . 1 . 2]" 1
37 1 13 ILE MG 1 22 ILE QG 4.500 . 4.500 2.331 2.226 2.462 . 0 0 "[ . 1 . 2]" 1
38 1 45 VAL H 1 56 VAL MG2 5.500 . 5.500 4.579 4.530 4.598 . 0 0 "[ . 1 . 2]" 1
39 1 42 PHE HA 1 56 VAL MG1 6.500 . 6.500 4.535 4.264 4.815 . 0 0 "[ . 1 . 2]" 1
40 1 44 LYS QE 1 56 VAL MG1 6.000 . 6.000 3.456 3.056 3.774 . 0 0 "[ . 1 . 2]" 1
41 1 9 ILE MG 1 100 VAL H 6.500 . 6.500 4.886 4.740 5.102 . 0 0 "[ . 1 . 2]" 1
42 1 71 VAL H 1 71 VAL MG2 4.000 . 4.000 1.977 1.888 2.609 . 0 0 "[ . 1 . 2]" 1
43 1 70 TYR QD 1 71 VAL MG2 6.500 . 6.500 3.815 1.825 4.823 . 0 0 "[ . 1 . 2]" 1
44 1 48 LEU HG 1 97 THR MG 4.000 . 4.000 3.204 2.938 3.344 . 0 0 "[ . 1 . 2]" 1
45 1 97 THR MG 1 118 LEU MD2 4.500 . 4.500 1.917 1.674 2.451 0.126 18 0 "[ . 1 . 2]" 1
46 1 31 VAL MG2 1 114 LEU MD2 6.000 . 6.000 3.913 3.677 4.146 . 0 0 "[ . 1 . 2]" 1
47 1 13 ILE MD 1 22 ILE HA 4.000 . 4.000 2.799 2.554 2.989 . 0 0 "[ . 1 . 2]" 1
48 1 13 ILE MD 1 126 HIS QB 6.000 . 6.000 4.138 3.967 4.457 . 0 0 "[ . 1 . 2]" 1
49 1 13 ILE MD 1 22 ILE HB 5.500 . 5.500 3.969 3.734 4.177 . 0 0 "[ . 1 . 2]" 1
50 1 5 ILE MG 1 114 LEU HA 5.500 . 5.500 3.374 3.193 3.609 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE MG 1 138 GLU QG 6.000 . 6.000 2.966 2.698 3.215 . 0 0 "[ . 1 . 2]" 1
52 1 11 LEU MD1 1 24 ILE HA 5.500 . 5.500 4.322 4.091 4.591 . 0 0 "[ . 1 . 2]" 1
53 1 45 VAL MG1 1 55 MET QG 7.000 . 7.000 4.765 4.049 5.201 . 0 0 "[ . 1 . 2]" 1
54 1 101 THR HA 1 117 VAL MG2 5.500 . 5.500 4.385 4.139 4.568 . 0 0 "[ . 1 . 2]" 1
55 1 9 ILE HB 1 117 VAL MG2 5.500 . 5.500 3.219 2.548 3.516 . 0 0 "[ . 1 . 2]" 1
56 1 9 ILE MD 1 102 VAL HA 6.500 . 6.500 4.403 3.985 5.432 . 0 0 "[ . 1 . 2]" 1
57 1 5 ILE H 1 6 THR MG 5.500 . 5.500 4.023 3.923 4.146 . 0 0 "[ . 1 . 2]" 1
58 1 20 LEU QB 1 85 TYR QE 6.500 . 6.500 4.639 4.124 5.101 . 0 0 "[ . 1 . 2]" 1
59 1 22 ILE HB 1 85 TYR QE 6.000 . 6.000 4.158 3.732 4.584 . 0 0 "[ . 1 . 2]" 1
60 1 44 LYS QG 1 103 TRP HD1 4.000 . 4.000 2.828 2.016 3.519 . 0 0 "[ . 1 . 2]" 1
61 1 79 TRP HZ2 1 102 VAL MG2 5.500 . 5.500 4.139 3.857 4.410 . 0 0 "[ . 1 . 2]" 1
62 1 119 ILE MG 1 126 HIS HE1 5.500 . 5.500 4.163 2.332 4.596 . 0 0 "[ . 1 . 2]" 1
63 1 21 ILE HA 1 82 THR MG 5.500 . 5.500 4.230 3.956 4.405 . 0 0 "[ . 1 . 2]" 1
64 1 13 ILE MG 1 23 HIS H 6.500 . 6.500 4.816 4.744 4.895 . 0 0 "[ . 1 . 2]" 1
65 1 117 VAL MG1 1 135 PRO QB 6.000 . 6.000 4.138 3.708 4.455 . 0 0 "[ . 1 . 2]" 1
66 1 20 LEU MD1 1 127 LEU MD2 3.800 . 3.800 2.525 2.333 2.657 . 0 0 "[ . 1 . 2]" 1
67 1 93 LEU MD2 1 127 LEU MD2 6.000 . 6.000 3.249 2.882 3.800 . 0 0 "[ . 1 . 2]" 1
68 1 7 GLY H 1 136 LEU MD1 5.500 . 5.500 4.241 4.004 4.583 . 0 0 "[ . 1 . 2]" 1
69 1 8 GLU H 1 136 LEU MD1 5.500 . 5.500 3.022 2.844 3.285 . 0 0 "[ . 1 . 2]" 1
70 1 28 ARG H 1 136 LEU MD1 5.500 . 5.500 3.911 3.617 4.126 . 0 0 "[ . 1 . 2]" 1
71 1 30 LEU MD2 1 114 LEU QB 4.500 . 4.500 3.100 2.715 3.341 . 0 0 "[ . 1 . 2]" 1
72 1 46 TYR QE 1 48 LEU MD2 6.500 . 6.500 2.661 1.892 2.962 . 0 0 "[ . 1 . 2]" 1
73 1 48 LEU MD2 1 97 THR HB 5.500 . 5.500 3.570 3.179 4.033 . 0 0 "[ . 1 . 2]" 1
74 1 48 LEU MD2 1 99 GLU QB 6.000 . 6.000 2.536 1.813 3.296 . 0 0 "[ . 1 . 2]" 1
75 1 47 LEU MD2 1 121 LEU MD2 6.000 . 6.000 3.794 3.570 4.173 . 0 0 "[ . 1 . 2]" 1
76 1 15 TYR HA 1 21 ILE QG 5.500 . 5.500 4.163 4.052 4.329 . 0 0 "[ . 1 . 2]" 1
77 1 15 TYR HA 1 127 LEU MD2 5.500 . 5.500 3.905 3.671 4.197 . 0 0 "[ . 1 . 2]" 1
78 1 19 ASN HA 1 86 LYS QG 5.500 . 5.500 3.933 3.738 4.204 . 0 0 "[ . 1 . 2]" 1
79 1 105 TYR QD 1 109 SER HA 6.000 . 6.000 3.155 2.255 4.392 . 0 0 "[ . 1 . 2]" 1
80 1 60 ALA MB 1 81 GLN HA 6.500 . 6.500 5.100 4.784 5.409 . 0 0 "[ . 1 . 2]" 1
81 1 22 ILE QG 1 85 TYR QD 6.500 . 6.500 4.344 4.031 4.700 . 0 0 "[ . 1 . 2]" 1
82 1 22 ILE MD 1 85 TYR QD 4.500 . 4.500 2.506 2.163 2.808 . 0 0 "[ . 1 . 2]" 1
83 1 101 THR HB 1 113 PHE QE 6.000 . 6.000 2.893 2.445 3.218 . 0 0 "[ . 1 . 2]" 1
84 1 113 PHE QE 1 116 GLU QB 4.500 . 4.500 1.989 1.950 2.151 . 0 0 "[ . 1 . 2]" 1
85 1 101 THR MG 1 113 PHE QE 4.500 . 4.500 3.017 2.416 3.338 . 0 0 "[ . 1 . 2]" 1
86 1 5 ILE QG 1 113 PHE QE 6.500 . 6.500 1.950 1.900 1.984 . 0 0 "[ . 1 . 2]" 1
87 1 113 PHE HZ 1 116 GLU QB 4.000 . 4.000 2.231 1.918 2.350 . 0 0 "[ . 1 . 2]" 1
88 1 101 THR MG 1 113 PHE HZ 6.500 . 6.500 4.606 4.112 4.970 . 0 0 "[ . 1 . 2]" 1
89 1 105 TYR QD 1 111 ASN H 6.000 . 6.000 5.017 4.286 5.357 . 0 0 "[ . 1 . 2]" 1
90 1 101 THR HA 1 116 GLU QG 5.500 . 5.500 3.531 3.391 3.672 . 0 0 "[ . 1 . 2]" 1
91 1 55 MET ME 1 85 TYR HA 5.500 . 5.500 3.897 2.918 4.562 . 0 0 "[ . 1 . 2]" 1
92 1 55 MET QG 1 83 VAL MG2 . . 5.500 2.865 2.233 4.083 . 0 0 "[ . 1 . 2]" 1
93 1 88 ILE MD 1 96 LYS QD 5.500 . 5.500 3.505 3.234 4.082 . 0 0 "[ . 1 . 2]" 1
94 1 47 LEU HG 1 96 LYS QG 5.000 . 5.000 3.140 2.799 3.259 . 0 0 "[ . 1 . 2]" 1
95 1 88 ILE MD 1 96 LYS QG 4.000 . 4.000 2.956 2.745 2.980 . 0 0 "[ . 1 . 2]" 1
96 1 44 LYS HA 1 54 VAL MG1 6.500 . 6.500 5.081 4.838 5.408 . 0 0 "[ . 1 . 2]" 1
97 1 44 LYS QD 1 46 TYR QD 6.500 . 6.500 4.351 4.100 4.756 . 0 0 "[ . 1 . 2]" 1
98 1 115 GLY QA 1 136 LEU HG 5.500 . 5.500 4.258 4.073 4.420 . 0 0 "[ . 1 . 2]" 1
99 1 43 VAL HB 1 100 VAL MG1 5.500 . 5.500 4.075 3.848 4.304 . 0 0 "[ . 1 . 2]" 1
100 1 25 LEU MD1 1 131 PRO QD 6.000 . 6.000 4.321 4.060 4.459 . 0 0 "[ . 1 . 2]" 1
101 1 97 THR MG 1 118 LEU HA 5.500 . 5.500 3.219 3.008 3.551 . 0 0 "[ . 1 . 2]" 1
102 1 94 MET ME 1 124 THR MG 4.500 . 4.500 2.933 2.742 3.125 . 0 0 "[ . 1 . 2]" 1
103 1 67 ARG HA 1 70 TYR QE 6.000 . 6.000 3.308 2.023 4.483 . 0 0 "[ . 1 . 2]" 1
104 1 60 ALA MB 1 64 TYR QE 4.500 . 4.500 1.911 1.808 2.309 . 0 0 "[ . 1 . 2]" 1
105 1 132 ARG QG 1 134 TYR QE 6.500 . 6.500 3.956 2.319 5.147 . 0 0 "[ . 1 . 2]" 1
106 1 42 PHE QD 1 105 TYR QD 4.500 . 4.500 2.906 2.599 3.435 . 0 0 "[ . 1 . 2]" 1
107 1 42 PHE QD 1 44 LYS QD 6.500 . 6.500 4.631 4.338 4.795 . 0 0 "[ . 1 . 2]" 1
108 1 10 GLN QB 1 26 GLN QG 6.000 . 6.000 3.344 2.605 4.547 . 0 0 "[ . 1 . 2]" 1
109 1 28 ARG QD 1 133 TRP HZ2 5.500 . 5.500 4.140 3.264 4.908 . 0 0 "[ . 1 . 2]" 1
110 1 113 PHE QB 1 139 GLN QE 4.500 . 4.500 2.714 1.781 3.573 0.019 20 0 "[ . 1 . 2]" 1
111 1 23 HIS HE1 1 82 THR MG 5.500 . 5.500 2.611 2.247 4.150 . 0 0 "[ . 1 . 2]" 1
112 1 3 HIS HE1 1 114 LEU HA 5.000 . 5.000 3.582 2.755 4.610 . 0 0 "[ . 1 . 2]" 1
113 1 28 ARG QB 1 76 ASN QD 6.000 . 6.000 3.284 1.999 4.384 . 0 0 "[ . 1 . 2]" 1
114 1 43 VAL HA 1 102 VAL MG2 5.500 . 5.500 3.991 3.883 4.090 . 0 0 "[ . 1 . 2]" 1
115 1 22 ILE MD 1 84 ILE HA 5.500 . 5.500 3.253 3.048 3.552 . 0 0 "[ . 1 . 2]" 1
116 1 22 ILE QG 1 98 LEU MD2 3.800 . 3.800 1.912 1.837 2.031 . 0 0 "[ . 1 . 2]" 1
117 1 65 LYS QE 1 78 GLU H 5.500 . 5.500 3.357 1.885 4.909 . 0 0 "[ . 1 . 2]" 1
118 1 65 LYS QE 1 78 GLU QG 4.500 . 4.500 2.953 1.836 3.663 . 0 0 "[ . 1 . 2]" 1
119 1 27 ALA MB 1 77 PRO QG 3.800 . 3.800 2.565 1.912 2.826 . 0 0 "[ . 1 . 2]" 1
120 1 72 GLN HA 1 76 ASN QD 5.500 . 5.500 3.732 2.735 4.905 . 0 0 "[ . 1 . 2]" 1
121 1 70 TYR QD 1 71 VAL MG1 6.500 . 6.500 3.661 1.863 4.647 . 0 0 "[ . 1 . 2]" 1
122 1 71 VAL HA 1 71 VAL MG1 3.300 . 3.300 2.276 2.135 2.423 . 0 0 "[ . 1 . 2]" 1
123 1 114 LEU H 1 115 GLY H 2.800 . 2.800 1.824 1.791 1.897 0.009 7 0 "[ . 1 . 2]" 1
124 1 5 ILE MG 1 116 GLU H 5.500 . 5.500 3.367 3.149 3.549 . 0 0 "[ . 1 . 2]" 1
125 1 9 ILE MG 1 117 VAL H 6.500 . 6.500 4.464 4.228 4.692 . 0 0 "[ . 1 . 2]" 1
126 1 117 VAL H 1 117 VAL MG2 4.000 . 4.000 2.578 2.458 2.701 . 0 0 "[ . 1 . 2]" 1
127 1 116 GLU QG 1 118 LEU H 5.500 . 5.500 4.621 3.987 4.904 . 0 0 "[ . 1 . 2]" 1
128 1 99 GLU QG 1 118 LEU H 5.500 . 5.500 4.551 4.255 4.870 . 0 0 "[ . 1 . 2]" 1
129 1 94 MET HA 1 121 LEU H 6.000 . 6.000 4.645 4.335 5.159 . 0 0 "[ . 1 . 2]" 1
130 1 119 ILE MG 1 121 LEU H 5.500 . 5.500 4.500 4.306 4.586 . 0 0 "[ . 1 . 2]" 1
131 1 97 THR MG 1 122 SER H 6.500 . 6.500 5.027 4.910 5.141 . 0 0 "[ . 1 . 2]" 1
132 1 124 THR H 1 127 LEU HG 5.000 . 5.000 4.782 4.636 5.100 0.100 18 0 "[ . 1 . 2]" 1
133 1 119 ILE MG 1 126 HIS H 6.500 . 6.500 4.698 4.007 4.902 . 0 0 "[ . 1 . 2]" 1
134 1 127 LEU MD2 1 129 ASN H 5.500 . 5.500 4.506 3.839 4.630 . 0 0 "[ . 1 . 2]" 1
135 1 126 HIS QB 1 132 ARG H 6.500 . 6.500 4.475 3.987 4.899 . 0 0 "[ . 1 . 2]" 1
136 1 117 VAL MG1 1 134 TYR H 5.500 . 5.500 4.522 4.299 4.605 . 0 0 "[ . 1 . 2]" 1
137 1 9 ILE HB 1 136 LEU H 6.000 . 6.000 5.554 5.079 5.897 . 0 0 "[ . 1 . 2]" 1
138 1 5 ILE QG 1 138 GLU H 5.500 . 5.500 4.885 4.668 4.911 . 0 0 "[ . 1 . 2]" 1
139 1 43 VAL HA 1 103 TRP HE1 6.000 . 6.000 5.180 4.582 5.727 . 0 0 "[ . 1 . 2]" 1
140 1 44 LYS QG 1 103 TRP HE1 5.500 . 5.500 3.793 3.004 4.673 . 0 0 "[ . 1 . 2]" 1
141 1 43 VAL HA 1 79 TRP HE1 6.000 . 6.000 5.740 5.364 6.005 0.005 9 0 "[ . 1 . 2]" 1
142 1 26 GLN QE 1 133 TRP HE1 6.500 . 6.500 5.425 4.676 5.798 . 0 0 "[ . 1 . 2]" 1
143 1 19 ASN QD 1 86 LYS QG 6.000 . 6.000 2.233 2.039 2.600 . 0 0 "[ . 1 . 2]" 1
144 1 59 ASN HA 1 81 GLN QE . . 3.500 3.128 3.121 3.141 . 0 0 "[ . 1 . 2]" 1
145 1 113 PHE HZ 1 115 GLY H 3.500 . 3.500 3.544 3.534 3.556 0.056 17 0 "[ . 1 . 2]" 1
146 1 103 TRP HA 1 115 GLY H 5.000 . 5.000 4.438 4.281 4.543 . 0 0 "[ . 1 . 2]" 1
147 1 102 VAL MG1 1 115 GLY H 5.500 . 5.500 4.411 4.322 4.491 . 0 0 "[ . 1 . 2]" 1
148 1 102 VAL MG2 1 115 GLY H 4.000 . 4.000 3.336 3.330 3.342 . 0 0 "[ . 1 . 2]" 1
149 1 113 PHE QD 1 115 GLY H 4.000 . 4.000 3.358 3.225 3.493 . 0 0 "[ . 1 . 2]" 1
150 1 1 ALA HA 1 2 SER H 2.800 . 2.800 2.369 2.139 2.803 0.003 11 0 "[ . 1 . 2]" 1
151 1 3 HIS H 1 3 HIS HD2 5.000 . 5.000 3.295 2.159 5.084 0.084 16 0 "[ . 1 . 2]" 1
152 1 2 SER HA 1 3 HIS H 2.800 . 2.800 2.405 2.142 2.900 0.100 6 0 "[ . 1 . 2]" 1
153 1 2 SER QB 1 3 HIS H 4.000 . 4.000 3.149 2.009 3.700 . 0 0 "[ . 1 . 2]" 1
154 1 66 ARG H 1 66 ARG QB 3.300 . 3.300 2.422 2.212 2.618 . 0 0 "[ . 1 . 2]" 1
155 1 65 LYS QG 1 66 ARG H 4.000 . 4.000 3.630 3.600 3.662 . 0 0 "[ . 1 . 2]" 1
156 1 4 PRO HA 1 5 ILE H 2.800 . 2.800 2.265 2.223 2.295 . 0 0 "[ . 1 . 2]" 1
157 1 4 PRO QB 1 5 ILE H 3.300 . 3.300 2.852 2.783 2.961 . 0 0 "[ . 1 . 2]" 1
158 1 5 ILE H 1 5 ILE HB 2.800 . 2.800 2.614 2.574 2.667 . 0 0 "[ . 1 . 2]" 1
159 1 5 ILE H 1 5 ILE QG 3.500 . 3.500 2.207 2.048 2.379 . 0 0 "[ . 1 . 2]" 1
160 1 5 ILE H 1 5 ILE MD 4.000 . 4.000 3.298 3.014 3.339 . 0 0 "[ . 1 . 2]" 1
161 1 5 ILE HA 1 6 THR H 2.800 . 2.800 2.148 2.140 2.157 . 0 0 "[ . 1 . 2]" 1
162 1 6 THR H 1 30 LEU HA 5.000 . 5.000 3.856 3.711 4.102 . 0 0 "[ . 1 . 2]" 1
163 1 5 ILE HB 1 6 THR H 5.000 . 5.000 4.222 4.086 4.288 . 0 0 "[ . 1 . 2]" 1
164 1 6 THR H 1 31 VAL HB 5.000 . 5.000 2.897 2.650 3.117 . 0 0 "[ . 1 . 2]" 1
165 1 5 ILE QG 1 6 THR H 5.500 . 5.500 4.768 4.692 4.804 . 0 0 "[ . 1 . 2]" 1
166 1 6 THR H 1 6 THR MG 4.000 . 4.000 3.336 3.323 3.344 . 0 0 "[ . 1 . 2]" 1
167 1 5 ILE MG 1 6 THR H 3.300 . 3.300 2.662 2.420 2.753 . 0 0 "[ . 1 . 2]" 1
168 1 7 GLY H 1 29 ASN QD 6.500 . 6.500 4.340 1.963 5.793 . 0 0 "[ . 1 . 2]" 1
169 1 6 THR HA 1 7 GLY H 2.800 . 2.800 2.564 2.501 2.606 . 0 0 "[ . 1 . 2]" 1
170 1 6 THR HB 1 7 GLY H 2.800 . 2.800 2.055 1.970 2.172 . 0 0 "[ . 1 . 2]" 1
171 1 7 GLY H 1 29 ASN HA 6.000 . 6.000 5.481 5.327 5.789 . 0 0 "[ . 1 . 2]" 1
172 1 7 GLY H 1 30 LEU HA 5.000 . 5.000 4.222 3.917 4.589 . 0 0 "[ . 1 . 2]" 1
173 1 7 GLY H 1 29 ASN QB 4.000 . 4.000 3.120 2.933 3.574 . 0 0 "[ . 1 . 2]" 1
174 1 7 GLY H 1 136 LEU QB 5.500 . 5.500 4.718 4.318 4.907 . 0 0 "[ . 1 . 2]" 1
175 1 6 THR MG 1 7 GLY H 4.000 . 4.000 3.341 3.335 3.349 . 0 0 "[ . 1 . 2]" 1
176 1 8 GLU H 1 28 ARG H 3.500 . 3.500 2.633 2.492 2.804 . 0 0 "[ . 1 . 2]" 1
177 1 8 GLU H 1 136 LEU H 5.000 . 5.000 4.777 4.557 5.003 0.003 9 0 "[ . 1 . 2]" 1
178 1 8 GLU H 1 133 TRP HE3 5.000 . 5.000 4.474 4.071 4.814 . 0 0 "[ . 1 . 2]" 1
179 1 8 GLU H 1 133 TRP HZ3 5.000 . 5.000 4.663 4.108 4.960 . 0 0 "[ . 1 . 2]" 1
180 1 8 GLU H 1 27 ALA HA 5.000 . 5.000 4.473 4.323 4.586 . 0 0 "[ . 1 . 2]" 1
181 1 7 GLY QA 1 8 GLU H 2.800 . 2.800 2.254 2.236 2.274 . 0 0 "[ . 1 . 2]" 1
182 1 8 GLU H 1 29 ASN HA 6.000 . 6.000 5.452 5.279 5.631 . 0 0 "[ . 1 . 2]" 1
183 1 8 GLU H 1 29 ASN QB 4.000 . 4.000 3.163 2.961 3.515 . 0 0 "[ . 1 . 2]" 1
184 1 8 GLU H 1 8 GLU QG 4.000 . 4.000 2.737 2.487 2.907 . 0 0 "[ . 1 . 2]" 1
185 1 8 GLU H 1 8 GLU QB 3.500 . 3.500 2.704 2.579 2.779 . 0 0 "[ . 1 . 2]" 1
186 1 8 GLU H 1 28 ARG QB 5.500 . 5.500 4.477 4.279 4.718 . 0 0 "[ . 1 . 2]" 1
187 1 8 GLU H 1 136 LEU HG 5.000 . 5.000 4.555 4.373 4.987 . 0 0 "[ . 1 . 2]" 1
188 1 8 GLU H 1 28 ARG QG 4.000 . 4.000 2.860 2.419 3.120 . 0 0 "[ . 1 . 2]" 1
189 1 8 GLU H 1 30 LEU MD2 5.500 . 5.500 3.833 3.564 4.200 . 0 0 "[ . 1 . 2]" 1
190 1 9 ILE H 1 134 TYR H 3.500 . 3.500 2.778 2.172 3.377 . 0 0 "[ . 1 . 2]" 1
191 1 9 ILE H 1 136 LEU H 5.000 . 5.000 4.072 3.787 4.713 . 0 0 "[ . 1 . 2]" 1
192 1 9 ILE H 1 134 TYR QD 6.000 . 6.000 4.319 4.133 4.720 . 0 0 "[ . 1 . 2]" 1
193 1 9 ILE H 1 133 TRP HE3 5.000 . 5.000 3.745 2.982 4.471 . 0 0 "[ . 1 . 2]" 1
194 1 9 ILE H 1 133 TRP HZ3 6.000 . 6.000 5.249 4.508 5.934 . 0 0 "[ . 1 . 2]" 1
195 1 8 GLU HA 1 9 ILE H 2.800 . 2.800 2.447 2.241 2.675 . 0 0 "[ . 1 . 2]" 1
196 1 9 ILE H 1 133 TRP HA 5.000 . 5.000 4.391 4.042 4.913 . 0 0 "[ . 1 . 2]" 1
197 1 9 ILE H 1 135 PRO HA 5.000 . 5.000 3.967 3.764 4.108 . 0 0 "[ . 1 . 2]" 1
198 1 9 ILE H 1 134 TYR QB 4.000 . 4.000 3.366 3.180 3.565 . 0 0 "[ . 1 . 2]" 1
199 1 8 GLU QB 1 9 ILE H 4.000 . 4.000 2.397 1.995 2.836 . 0 0 "[ . 1 . 2]" 1
200 1 8 GLU QG 1 9 ILE H 5.500 . 5.500 4.099 3.900 4.203 . 0 0 "[ . 1 . 2]" 1
201 1 9 ILE H 1 9 ILE HB 3.500 . 3.500 2.989 2.583 3.246 . 0 0 "[ . 1 . 2]" 1
202 1 9 ILE H 1 136 LEU HG 3.500 . 3.500 2.824 2.349 3.405 . 0 0 "[ . 1 . 2]" 1
203 1 9 ILE H 1 9 ILE MG 3.300 . 3.300 2.184 1.965 2.720 . 0 0 "[ . 1 . 2]" 1
204 1 9 ILE H 1 117 VAL MG2 5.500 . 5.500 3.367 2.983 3.693 . 0 0 "[ . 1 . 2]" 1
205 1 9 ILE H 1 136 LEU MD1 5.500 . 5.500 3.370 2.936 3.623 . 0 0 "[ . 1 . 2]" 1
206 1 9 ILE H 1 136 LEU MD2 5.500 . 5.500 3.274 2.685 4.325 . 0 0 "[ . 1 . 2]" 1
207 1 10 GLN H 1 26 GLN H . . 3.500 3.023 2.850 3.106 . 0 0 "[ . 1 . 2]" 1
208 1 10 GLN H 1 133 TRP HZ3 5.000 . 5.000 3.603 3.245 4.088 . 0 0 "[ . 1 . 2]" 1
209 1 10 GLN H 1 133 TRP HE3 6.000 . 6.000 3.705 3.233 4.195 . 0 0 "[ . 1 . 2]" 1
210 1 10 GLN H 1 79 TRP HH2 5.000 . 5.000 5.002 4.914 5.015 0.015 14 0 "[ . 1 . 2]" 1
211 1 10 GLN H 1 27 ALA HA 3.500 . 3.500 2.917 2.678 3.155 . 0 0 "[ . 1 . 2]" 1
212 1 9 ILE HA 1 10 GLN H 2.800 . 2.800 2.200 2.150 2.251 . 0 0 "[ . 1 . 2]" 1
213 1 10 GLN H 1 26 GLN QG 5.500 . 5.500 4.262 3.811 4.906 . 0 0 "[ . 1 . 2]" 1
214 1 9 ILE QG 1 10 GLN H 4.000 . 4.000 2.256 1.970 3.412 . 0 0 "[ . 1 . 2]" 1
215 1 10 GLN H 1 27 ALA MB 5.500 . 5.500 3.613 3.377 3.905 . 0 0 "[ . 1 . 2]" 1
216 1 9 ILE MG 1 10 GLN H 5.500 . 5.500 3.732 3.346 3.923 . 0 0 "[ . 1 . 2]" 1
217 1 9 ILE MD 1 10 GLN H 4.500 . 4.500 3.451 1.975 3.752 . 0 0 "[ . 1 . 2]" 1
218 1 10 GLN H 1 10 GLN QG 5.000 . 5.000 3.997 3.872 4.068 . 0 0 "[ . 1 . 2]" 1
219 1 10 GLN H 1 10 GLN QB 3.500 . 3.500 2.387 2.266 2.476 . 0 0 "[ . 1 . 2]" 1
220 1 11 LEU H 1 134 TYR H 5.000 . 5.000 4.587 3.995 4.991 . 0 0 "[ . 1 . 2]" 1
221 1 11 LEU H 1 134 TYR QD 4.000 . 4.000 3.020 2.533 3.175 . 0 0 "[ . 1 . 2]" 1
222 1 11 LEU H 1 134 TYR QE 4.000 . 4.000 2.154 1.901 2.501 . 0 0 "[ . 1 . 2]" 1
223 1 10 GLN HA 1 11 LEU H 2.800 . 2.800 2.158 2.145 2.174 . 0 0 "[ . 1 . 2]" 1
224 1 11 LEU H 1 133 TRP HA 5.000 . 5.000 3.799 3.528 4.001 . 0 0 "[ . 1 . 2]" 1
225 1 11 LEU H 1 131 PRO HA 5.000 . 5.000 4.049 3.863 4.314 . 0 0 "[ . 1 . 2]" 1
226 1 11 LEU H 1 134 TYR QB 6.000 . 6.000 5.243 4.780 5.364 . 0 0 "[ . 1 . 2]" 1
227 1 11 LEU H 1 11 LEU QB 3.500 . 3.500 3.066 2.946 3.153 . 0 0 "[ . 1 . 2]" 1
228 1 11 LEU H 1 11 LEU HG 3.500 . 3.500 2.939 2.512 3.332 . 0 0 "[ . 1 . 2]" 1
229 1 10 GLN QG 1 11 LEU H 4.000 . 4.000 2.838 2.696 2.999 . 0 0 "[ . 1 . 2]" 1
230 1 11 LEU H 1 11 LEU MD2 5.500 . 5.500 4.239 3.831 4.480 . 0 0 "[ . 1 . 2]" 1
231 1 11 LEU H 1 25 LEU MD1 5.500 . 5.500 3.706 3.390 3.850 . 0 0 "[ . 1 . 2]" 1
232 1 11 LEU H 1 11 LEU MD1 5.500 . 5.500 2.988 2.554 3.710 . 0 0 "[ . 1 . 2]" 1
233 1 10 GLN QB 1 11 LEU H 5.000 . 5.000 3.647 3.466 3.717 . 0 0 "[ . 1 . 2]" 1
234 1 12 GLN H 1 23 HIS H 3.500 . 3.500 2.814 2.627 2.945 . 0 0 "[ . 1 . 2]" 1
235 1 12 GLN H 1 25 LEU H 5.000 . 5.000 4.330 3.985 5.002 0.002 1 0 "[ . 1 . 2]" 1
236 1 12 GLN H 1 134 TYR QE 6.000 . 6.000 5.018 4.663 5.356 . 0 0 "[ . 1 . 2]" 1
237 1 11 LEU HA 1 12 GLN H 2.800 . 2.800 2.372 2.282 2.441 . 0 0 "[ . 1 . 2]" 1
238 1 12 GLN H 1 23 HIS HA 5.000 . 5.000 4.434 4.265 4.642 . 0 0 "[ . 1 . 2]" 1
239 1 12 GLN H 1 131 PRO HA 5.000 . 5.000 4.305 3.872 4.615 . 0 0 "[ . 1 . 2]" 1
240 1 12 GLN H 1 23 HIS QB 5.000 . 5.000 2.589 2.390 2.812 . 0 0 "[ . 1 . 2]" 1
241 1 12 GLN H 1 12 GLN QB 3.500 . 3.500 2.503 2.375 2.554 . 0 0 "[ . 1 . 2]" 1
242 1 11 LEU QB 1 12 GLN H 4.000 . 4.000 2.474 2.289 2.685 . 0 0 "[ . 1 . 2]" 1
243 1 11 LEU MD2 1 12 GLN H 5.500 . 5.500 4.236 4.002 4.583 . 0 0 "[ . 1 . 2]" 1
244 1 12 GLN H 1 25 LEU MD1 4.000 . 4.000 3.353 3.346 3.359 . 0 0 "[ . 1 . 2]" 1
245 1 12 GLN HA 1 13 ILE H 2.800 . 2.800 2.166 2.147 2.253 . 0 0 "[ . 1 . 2]" 1
246 1 13 ILE H 1 13 ILE HB 2.800 . 2.800 2.746 2.687 2.844 0.044 10 0 "[ . 1 . 2]" 1
247 1 13 ILE H 1 13 ILE QG 3.300 . 3.300 2.105 1.971 2.543 . 0 0 "[ . 1 . 2]" 1
248 1 13 ILE H 1 13 ILE MD 5.500 . 5.500 3.252 3.055 3.752 . 0 0 "[ . 1 . 2]" 1
249 1 14 ASN H 1 23 HIS H 5.000 . 5.000 4.915 4.794 5.009 0.009 13 0 "[ . 1 . 2]" 1
250 1 14 ASN H 1 21 ILE H 3.500 . 3.500 3.490 3.423 3.514 0.014 1 0 "[ . 1 . 2]" 1
251 1 14 ASN H 1 14 ASN QD 5.500 . 5.500 4.662 4.377 4.910 . 0 0 "[ . 1 . 2]" 1
252 1 13 ILE HA 1 14 ASN H 2.800 . 2.800 2.208 2.142 2.244 . 0 0 "[ . 1 . 2]" 1
253 1 14 ASN H 1 22 ILE HA 3.500 . 3.500 3.423 3.269 3.517 0.017 12 0 "[ . 1 . 2]" 1
254 1 14 ASN H 1 14 ASN QB 3.500 . 3.500 2.879 2.780 2.903 . 0 0 "[ . 1 . 2]" 1
255 1 13 ILE HB 1 14 ASN H 5.000 . 5.000 3.759 3.673 4.022 . 0 0 "[ . 1 . 2]" 1
256 1 14 ASN H 1 21 ILE HB 3.500 . 3.500 3.491 3.211 3.522 0.022 14 0 "[ . 1 . 2]" 1
257 1 14 ASN H 1 22 ILE QG 5.500 . 5.500 3.638 3.457 3.823 . 0 0 "[ . 1 . 2]" 1
258 1 13 ILE MG 1 14 ASN H 3.300 . 3.300 2.211 2.036 2.573 . 0 0 "[ . 1 . 2]" 1
259 1 13 ILE MD 1 14 ASN H 5.500 . 5.500 3.851 3.711 3.943 . 0 0 "[ . 1 . 2]" 1
260 1 14 ASN H 1 21 ILE MG 5.500 . 5.500 4.263 4.000 4.387 . 0 0 "[ . 1 . 2]" 1
261 1 15 TYR H 1 129 ASN H 5.000 . 5.000 4.865 4.559 5.015 0.015 13 0 "[ . 1 . 2]" 1
262 1 14 ASN QD 1 15 TYR H 5.000 . 5.000 3.486 2.655 4.195 . 0 0 "[ . 1 . 2]" 1
263 1 15 TYR H 1 15 TYR QD 4.000 . 4.000 3.602 3.580 3.621 . 0 0 "[ . 1 . 2]" 1
264 1 14 ASN HA 1 15 TYR H 2.800 . 2.800 2.158 2.141 2.199 . 0 0 "[ . 1 . 2]" 1
265 1 15 TYR H 1 127 LEU HA 5.000 . 5.000 3.943 3.215 5.015 0.015 2 0 "[ . 1 . 2]" 1
266 1 15 TYR H 1 15 TYR QB 3.300 . 3.300 2.312 2.214 2.352 . 0 0 "[ . 1 . 2]" 1
267 1 14 ASN QB 1 15 TYR H 5.000 . 5.000 3.751 3.575 3.893 . 0 0 "[ . 1 . 2]" 1
268 1 15 TYR H 1 127 LEU QB 4.000 . 4.000 3.251 2.892 3.551 . 0 0 "[ . 1 . 2]" 1
269 1 15 TYR H 1 127 LEU HG 6.000 . 6.000 5.111 4.656 5.586 . 0 0 "[ . 1 . 2]" 1
270 1 15 TYR H 1 20 LEU MD1 5.500 . 5.500 4.252 3.941 4.559 . 0 0 "[ . 1 . 2]" 1
271 1 15 TYR H 1 127 LEU MD1 5.500 . 5.500 3.921 3.323 4.300 . 0 0 "[ . 1 . 2]" 1
272 1 15 TYR H 1 127 LEU MD2 4.000 . 4.000 2.374 1.956 2.979 . 0 0 "[ . 1 . 2]" 1
273 1 15 TYR H 1 20 LEU HA 5.000 . 5.000 4.791 4.635 4.985 . 0 0 "[ . 1 . 2]" 1
274 1 16 ASP H 1 21 ILE H 5.000 . 5.000 3.853 3.745 3.954 . 0 0 "[ . 1 . 2]" 1
275 1 16 ASP H 1 20 LEU H 5.000 . 5.000 4.902 4.873 4.944 . 0 0 "[ . 1 . 2]" 1
276 1 16 ASP H 1 19 ASN H 3.500 . 3.500 3.082 2.990 3.140 . 0 0 "[ . 1 . 2]" 1
277 1 15 TYR QD 1 16 ASP H 4.000 . 4.000 3.572 3.564 3.593 . 0 0 "[ . 1 . 2]" 1
278 1 15 TYR QE 1 16 ASP H 6.000 . 6.000 4.655 4.618 4.706 . 0 0 "[ . 1 . 2]" 1
279 1 15 TYR HA 1 16 ASP H 2.800 . 2.800 2.170 2.155 2.178 . 0 0 "[ . 1 . 2]" 1
280 1 16 ASP H 1 20 LEU HA 3.500 . 3.500 3.532 3.484 3.554 0.054 20 0 "[ . 1 . 2]" 1
281 1 16 ASP H 1 19 ASN QB 5.500 . 5.500 3.512 3.421 3.643 . 0 0 "[ . 1 . 2]" 1
282 1 16 ASP H 1 16 ASP QB 3.300 . 3.300 2.751 2.711 3.000 . 0 0 "[ . 1 . 2]" 1
283 1 16 ASP H 1 21 ILE HB 5.000 . 5.000 4.913 4.663 5.012 0.012 18 0 "[ . 1 . 2]" 1
284 1 16 ASP H 1 21 ILE QG 5.500 . 5.500 4.093 3.898 4.236 . 0 0 "[ . 1 . 2]" 1
285 1 16 ASP H 1 21 ILE MD 3.300 . 3.300 2.123 1.941 2.237 . 0 0 "[ . 1 . 2]" 1
286 1 17 LEU H 1 19 ASN H 5.000 . 5.000 4.068 4.047 4.123 . 0 0 "[ . 1 . 2]" 1
287 1 17 LEU H 1 18 GLY H 2.800 . 2.800 2.795 2.733 2.820 0.020 20 0 "[ . 1 . 2]" 1
288 1 15 TYR QD 1 17 LEU H 6.000 . 6.000 5.358 5.345 5.372 . 0 0 "[ . 1 . 2]" 1
289 1 15 TYR QE 1 17 LEU H 6.000 . 6.000 4.849 4.825 4.889 . 0 0 "[ . 1 . 2]" 1
290 1 103 TRP H 1 103 TRP HD1 3.500 . 3.500 2.971 2.762 3.146 . 0 0 "[ . 1 . 2]" 1
291 1 16 ASP HA 1 17 LEU H 2.800 . 2.800 2.275 2.245 2.300 . 0 0 "[ . 1 . 2]" 1
292 1 88 ILE HA 1 89 SER H 2.800 . 2.800 2.149 2.141 2.154 . 0 0 "[ . 1 . 2]" 1
293 1 102 VAL HA 1 103 TRP H 2.800 . 2.800 2.195 2.160 2.235 . 0 0 "[ . 1 . 2]" 1
294 1 16 ASP QB 1 17 LEU H 4.000 . 4.000 2.942 2.702 3.276 . 0 0 "[ . 1 . 2]" 1
295 1 16 ASP H 1 18 GLY H 5.000 . 5.000 4.401 4.351 4.426 . 0 0 "[ . 1 . 2]" 1
296 1 18 GLY H 1 19 ASN H 2.800 . 2.800 2.608 2.589 2.622 . 0 0 "[ . 1 . 2]" 1
297 1 15 TYR QD 1 18 GLY H 6.000 . 6.000 4.518 4.460 4.585 . 0 0 "[ . 1 . 2]" 1
298 1 15 TYR QE 1 18 GLY H 4.000 . 4.000 3.420 3.341 3.516 . 0 0 "[ . 1 . 2]" 1
299 1 16 ASP HA 1 18 GLY H 3.500 . 3.500 3.513 3.482 3.527 0.027 9 0 "[ . 1 . 2]" 1
300 1 17 LEU HA 1 18 GLY H 2.800 . 2.800 2.822 2.811 2.835 0.035 13 0 "[ . 1 . 2]" 1
301 1 18 GLY H 1 19 ASN QB 5.500 . 5.500 4.926 4.909 4.943 . 0 0 "[ . 1 . 2]" 1
302 1 16 ASP QB 1 18 GLY H 5.500 . 5.500 4.785 4.693 4.901 . 0 0 "[ . 1 . 2]" 1
303 1 17 LEU QB 1 18 GLY H 5.500 . 5.500 3.827 3.812 3.841 . 0 0 "[ . 1 . 2]" 1
304 1 17 LEU QD 1 18 GLY H 6.000 . 6.000 4.040 3.708 4.318 . 0 0 "[ . 1 . 2]" 1
305 1 15 TYR QD 1 19 ASN H 6.000 . 6.000 3.825 3.729 3.924 . 0 0 "[ . 1 . 2]" 1
306 1 15 TYR QE 1 19 ASN H 4.000 . 4.000 3.574 3.564 3.589 . 0 0 "[ . 1 . 2]" 1
307 1 15 TYR HA 1 19 ASN H 5.000 . 5.000 4.758 4.663 4.848 . 0 0 "[ . 1 . 2]" 1
308 1 16 ASP HA 1 19 ASN H 5.000 . 5.000 4.107 4.054 4.148 . 0 0 "[ . 1 . 2]" 1
309 1 17 LEU HA 1 19 ASN H 5.000 . 5.000 4.267 4.226 4.369 . 0 0 "[ . 1 . 2]" 1
310 1 19 ASN H 1 19 ASN QB 3.300 . 3.300 2.649 2.611 2.707 . 0 0 "[ . 1 . 2]" 1
311 1 17 LEU QB 1 19 ASN H 5.000 . 5.000 3.465 3.380 3.614 . 0 0 "[ . 1 . 2]" 1
312 1 19 ASN H 1 21 ILE MD 5.500 . 5.500 3.949 3.751 4.023 . 0 0 "[ . 1 . 2]" 1
313 1 19 ASN H 1 84 ILE MG 5.500 . 5.500 4.614 4.598 4.630 . 0 0 "[ . 1 . 2]" 1
314 1 20 LEU H 1 85 TYR H 3.500 . 3.500 2.864 2.664 3.020 . 0 0 "[ . 1 . 2]" 1
315 1 20 LEU H 1 88 ILE H 5.000 . 5.000 4.324 4.205 4.507 . 0 0 "[ . 1 . 2]" 1
316 1 20 LEU H 1 87 SER H 5.000 . 5.000 5.034 5.021 5.052 0.052 8 0 "[ . 1 . 2]" 1
317 1 15 TYR QD 1 20 LEU H 6.000 . 6.000 3.601 3.464 3.834 . 0 0 "[ . 1 . 2]" 1
318 1 15 TYR QE 1 20 LEU H 6.000 . 6.000 4.814 4.633 5.011 . 0 0 "[ . 1 . 2]" 1
319 1 19 ASN HA 1 20 LEU H 2.800 . 2.800 2.156 2.147 2.170 . 0 0 "[ . 1 . 2]" 1
320 1 20 LEU H 1 86 LYS HA 5.000 . 5.000 3.637 3.360 4.115 . 0 0 "[ . 1 . 2]" 1
321 1 19 ASN QB 1 20 LEU H 3.500 . 3.500 3.130 3.069 3.143 . 0 0 "[ . 1 . 2]" 1
322 1 20 LEU H 1 85 TYR QB 5.500 . 5.500 2.835 2.354 3.063 . 0 0 "[ . 1 . 2]" 1
323 1 20 LEU H 1 88 ILE HB 5.000 . 5.000 3.469 3.176 3.675 . 0 0 "[ . 1 . 2]" 1
324 1 20 LEU H 1 20 LEU HG 5.000 . 5.000 4.433 4.401 4.476 . 0 0 "[ . 1 . 2]" 1
325 1 20 LEU H 1 20 LEU QB 3.500 . 3.500 2.288 2.264 2.314 . 0 0 "[ . 1 . 2]" 1
326 1 20 LEU H 1 20 LEU MD1 5.500 . 5.500 4.210 4.092 4.304 . 0 0 "[ . 1 . 2]" 1
327 1 20 LEU H 1 84 ILE MG 5.500 . 5.500 3.239 3.072 3.673 . 0 0 "[ . 1 . 2]" 1
328 1 20 LEU H 1 20 LEU MD2 5.500 . 5.500 4.207 4.113 4.275 . 0 0 "[ . 1 . 2]" 1
329 1 15 TYR QD 1 21 ILE H 6.000 . 6.000 4.558 4.443 4.639 . 0 0 "[ . 1 . 2]" 1
330 1 15 TYR HA 1 21 ILE H 3.500 . 3.500 2.307 2.245 2.456 . 0 0 "[ . 1 . 2]" 1
331 1 20 LEU HA 1 21 ILE H 2.800 . 2.800 2.148 2.138 2.162 . 0 0 "[ . 1 . 2]" 1
332 1 21 ILE H 1 85 TYR QB 6.500 . 6.500 5.587 5.247 5.797 . 0 0 "[ . 1 . 2]" 1
333 1 14 ASN QB 1 21 ILE H 5.000 . 5.000 4.191 4.016 4.426 . 0 0 "[ . 1 . 2]" 1
334 1 20 LEU QB 1 21 ILE H 5.500 . 5.500 3.829 3.792 3.880 . 0 0 "[ . 1 . 2]" 1
335 1 21 ILE H 1 21 ILE HB 2.800 . 2.800 2.675 2.611 2.729 . 0 0 "[ . 1 . 2]" 1
336 1 20 LEU HG 1 21 ILE H 5.000 . 5.000 2.996 2.763 3.197 . 0 0 "[ . 1 . 2]" 1
337 1 21 ILE H 1 21 ILE QG 4.000 . 4.000 3.106 3.039 3.188 . 0 0 "[ . 1 . 2]" 1
338 1 21 ILE H 1 21 ILE MD 3.300 . 3.300 2.013 1.920 2.422 . 0 0 "[ . 1 . 2]" 1
339 1 22 ILE H 1 82 THR HA 5.000 . 5.000 4.625 4.478 4.768 . 0 0 "[ . 1 . 2]" 1
340 1 22 ILE H 1 84 ILE HA 3.500 . 3.500 3.298 3.080 3.527 0.027 13 0 "[ . 1 . 2]" 1
341 1 21 ILE HA 1 22 ILE H 2.800 . 2.800 2.157 2.133 2.181 . 0 0 "[ . 1 . 2]" 1
342 1 22 ILE H 1 22 ILE HB 2.800 . 2.800 2.805 2.741 2.833 0.033 1 0 "[ . 1 . 2]" 1
343 1 21 ILE HB 1 22 ILE H 5.000 . 5.000 4.030 3.935 4.112 . 0 0 "[ . 1 . 2]" 1
344 1 22 ILE H 1 22 ILE QG 4.000 . 4.000 3.407 3.315 3.490 . 0 0 "[ . 1 . 2]" 1
345 1 22 ILE H 1 22 ILE MD 4.000 . 4.000 2.282 2.018 2.588 . 0 0 "[ . 1 . 2]" 1
346 1 21 ILE MG 1 22 ILE H 3.300 . 3.300 2.366 2.043 2.600 . 0 0 "[ . 1 . 2]" 1
347 1 23 HIS H 1 23 HIS HD2 3.500 . 3.500 2.144 2.009 2.573 . 0 0 "[ . 1 . 2]" 1
348 1 11 LEU HA 1 23 HIS H 5.000 . 5.000 4.829 4.715 5.007 0.007 20 0 "[ . 1 . 2]" 1
349 1 13 ILE HA 1 23 HIS H 3.500 . 3.500 3.413 3.317 3.504 0.004 10 0 "[ . 1 . 2]" 1
350 1 22 ILE HA 1 23 HIS H 2.800 . 2.800 2.184 2.165 2.208 . 0 0 "[ . 1 . 2]" 1
351 1 23 HIS H 1 23 HIS QB 3.500 . 3.500 2.719 2.660 2.798 . 0 0 "[ . 1 . 2]" 1
352 1 12 GLN QB 1 23 HIS H 5.500 . 5.500 3.426 3.143 3.780 . 0 0 "[ . 1 . 2]" 1
353 1 22 ILE QG 1 23 HIS H 5.500 . 5.500 4.286 4.186 4.390 . 0 0 "[ . 1 . 2]" 1
354 1 13 ILE QG 1 23 HIS H 5.500 . 5.500 4.881 4.410 4.917 . 0 0 "[ . 1 . 2]" 1
355 1 22 ILE MG 1 23 HIS H 3.300 . 3.300 2.411 2.247 2.680 . 0 0 "[ . 1 . 2]" 1
356 1 24 ILE H 1 83 VAL H 5.000 . 5.000 4.567 4.396 4.718 . 0 0 "[ . 1 . 2]" 1
357 1 24 ILE H 1 81 GLN H 5.000 . 5.000 3.334 2.794 3.675 . 0 0 "[ . 1 . 2]" 1
358 1 24 ILE H 1 82 THR HA 3.500 . 3.500 3.311 3.145 3.476 . 0 0 "[ . 1 . 2]" 1
359 1 23 HIS HA 1 24 ILE H 2.800 . 2.800 2.145 2.132 2.166 . 0 0 "[ . 1 . 2]" 1
360 1 23 HIS QB 1 24 ILE H 5.000 . 5.000 3.300 2.964 3.495 . 0 0 "[ . 1 . 2]" 1
361 1 24 ILE H 1 81 GLN QB 5.500 . 5.500 3.318 2.995 3.652 . 0 0 "[ . 1 . 2]" 1
362 1 24 ILE H 1 24 ILE HB 2.800 . 2.800 2.620 2.494 2.864 0.064 1 0 "[ . 1 . 2]" 1
363 1 24 ILE H 1 24 ILE QG 5.000 . 5.000 2.595 1.817 3.000 . 0 0 "[ . 1 . 2]" 1
364 1 24 ILE H 1 24 ILE MD 4.000 . 4.000 2.462 2.051 3.059 . 0 0 "[ . 1 . 2]" 1
365 1 25 LEU H 1 26 GLN H 3.500 . 3.500 3.012 2.606 3.111 . 0 0 "[ . 1 . 2]" 1
366 1 11 LEU HA 1 25 LEU H 3.500 . 3.500 2.434 2.116 3.092 . 0 0 "[ . 1 . 2]" 1
367 1 24 ILE HA 1 25 LEU H 2.800 . 2.800 2.157 2.141 2.258 . 0 0 "[ . 1 . 2]" 1
368 1 25 LEU H 1 25 LEU QB 3.500 . 3.500 2.353 2.276 2.624 . 0 0 "[ . 1 . 2]" 1
369 1 25 LEU H 1 25 LEU HG 2.800 . 2.800 2.815 2.785 2.834 0.034 11 0 "[ . 1 . 2]" 1
370 1 11 LEU QB 1 25 LEU H 5.500 . 5.500 3.475 3.159 4.019 . 0 0 "[ . 1 . 2]" 1
371 1 24 ILE QG 1 25 LEU H 5.500 . 5.500 4.422 4.200 4.863 . 0 0 "[ . 1 . 2]" 1
372 1 11 LEU MD2 1 25 LEU H 4.000 . 4.000 3.146 2.641 3.360 . 0 0 "[ . 1 . 2]" 1
373 1 25 LEU H 1 25 LEU MD1 5.500 . 5.500 3.613 3.450 3.906 . 0 0 "[ . 1 . 2]" 1
374 1 24 ILE MG 1 25 LEU H 5.500 . 5.500 2.750 2.206 3.088 . 0 0 "[ . 1 . 2]" 1
375 1 11 LEU HA 1 26 GLN H 5.000 . 5.000 4.524 4.373 4.691 . 0 0 "[ . 1 . 2]" 1
376 1 26 GLN H 1 78 GLU HA 5.000 . 5.000 4.461 4.255 4.619 . 0 0 "[ . 1 . 2]" 1
377 1 24 ILE HA 1 26 GLN H 5.000 . 5.000 5.000 4.820 5.025 0.025 13 0 "[ . 1 . 2]" 1
378 1 25 LEU QB 1 26 GLN H 3.300 . 3.300 1.963 1.925 2.005 . 0 0 "[ . 1 . 2]" 1
379 1 10 GLN QG 1 26 GLN H 5.500 . 5.500 4.395 4.170 4.738 . 0 0 "[ . 1 . 2]" 1
380 1 25 LEU MD2 1 26 GLN H 5.500 . 5.500 4.280 4.206 4.475 . 0 0 "[ . 1 . 2]" 1
381 1 25 LEU MD1 1 26 GLN H 5.500 . 5.500 3.794 3.764 3.882 . 0 0 "[ . 1 . 2]" 1
382 1 10 GLN QB 1 26 GLN H 3.500 . 3.500 2.227 1.983 2.616 . 0 0 "[ . 1 . 2]" 1
383 1 10 GLN H 1 27 ALA H 5.000 . 5.000 4.450 4.209 4.686 . 0 0 "[ . 1 . 2]" 1
384 1 27 ALA H 1 79 TRP H 6.000 . 6.000 5.603 5.492 5.759 . 0 0 "[ . 1 . 2]" 1
385 1 27 ALA H 1 79 TRP HE3 5.000 . 5.000 4.673 4.103 5.004 0.004 1 0 "[ . 1 . 2]" 1
386 1 27 ALA H 1 79 TRP HH2 3.500 . 3.500 3.379 3.098 3.524 0.024 19 0 "[ . 1 . 2]" 1
387 1 9 ILE HA 1 27 ALA H 5.000 . 5.000 4.449 4.246 4.664 . 0 0 "[ . 1 . 2]" 1
388 1 26 GLN HA 1 27 ALA H 2.800 . 2.800 2.368 2.248 2.455 . 0 0 "[ . 1 . 2]" 1
389 1 27 ALA H 1 78 GLU HA 3.500 . 3.500 3.475 3.299 3.552 0.052 15 0 "[ . 1 . 2]" 1
390 1 27 ALA H 1 77 PRO QD 5.500 . 5.500 2.844 2.421 3.242 . 0 0 "[ . 1 . 2]" 1
391 1 26 GLN QG 1 27 ALA H 3.500 . 3.500 2.778 2.073 3.149 . 0 0 "[ . 1 . 2]" 1
392 1 27 ALA H 1 27 ALA MB 3.300 . 3.300 2.384 2.262 2.532 . 0 0 "[ . 1 . 2]" 1
393 1 27 ALA H 1 77 PRO QG 5.500 . 5.500 3.276 2.919 3.479 . 0 0 "[ . 1 . 2]" 1
394 1 28 ARG H 1 133 TRP HE3 5.000 . 5.000 3.639 3.145 4.096 . 0 0 "[ . 1 . 2]" 1
395 1 28 ARG H 1 133 TRP HZ3 3.500 . 3.500 2.507 2.064 2.980 . 0 0 "[ . 1 . 2]" 1
396 1 28 ARG H 1 133 TRP HH2 5.000 . 5.000 4.503 3.887 4.999 . 0 0 "[ . 1 . 2]" 1
397 1 27 ALA HA 1 28 ARG H 2.800 . 2.800 2.318 2.262 2.426 . 0 0 "[ . 1 . 2]" 1
398 1 7 GLY QA 1 28 ARG H 5.500 . 5.500 3.983 3.821 4.139 . 0 0 "[ . 1 . 2]" 1
399 1 28 ARG H 1 28 ARG QD 5.500 . 5.500 4.324 4.136 4.543 . 0 0 "[ . 1 . 2]" 1
400 1 8 GLU QB 1 28 ARG H 5.500 . 5.500 3.605 3.370 3.827 . 0 0 "[ . 1 . 2]" 1
401 1 8 GLU QG 1 28 ARG H 5.500 . 5.500 4.702 4.534 4.802 . 0 0 "[ . 1 . 2]" 1
402 1 27 ALA MB 1 28 ARG H . . 3.300 2.670 2.452 2.762 . 0 0 "[ . 1 . 2]" 1
403 1 28 ARG H 1 28 ARG QG 3.300 . 3.300 2.420 2.232 2.608 . 0 0 "[ . 1 . 2]" 1
404 1 29 ASN H 1 30 LEU H 2.800 . 2.800 2.684 2.599 2.748 . 0 0 "[ . 1 . 2]" 1
405 1 28 ARG HA 1 29 ASN H 2.800 . 2.800 2.383 2.270 2.451 . 0 0 "[ . 1 . 2]" 1
406 1 29 ASN H 1 29 ASN QB 3.500 . 3.500 3.043 2.907 3.125 . 0 0 "[ . 1 . 2]" 1
407 1 29 ASN H 1 76 ASN QB 5.500 . 5.500 4.289 3.943 4.742 . 0 0 "[ . 1 . 2]" 1
408 1 28 ARG QD 1 29 ASN H 5.500 . 5.500 4.484 3.935 4.902 . 0 0 "[ . 1 . 2]" 1
409 1 28 ARG QB 1 29 ASN H 3.300 . 3.300 2.434 2.282 2.671 . 0 0 "[ . 1 . 2]" 1
410 1 28 ARG QG 1 29 ASN H 5.500 . 5.500 3.533 3.338 3.923 . 0 0 "[ . 1 . 2]" 1
411 1 61 SER H 1 64 TYR QD 6.000 . 6.000 3.551 3.379 3.789 . 0 0 "[ . 1 . 2]" 1
412 1 28 ARG HA 1 30 LEU H 5.000 . 5.000 3.345 3.229 3.586 . 0 0 "[ . 1 . 2]" 1
413 1 30 LEU H 1 75 LEU HA 5.000 . 5.000 3.776 3.298 4.142 . 0 0 "[ . 1 . 2]" 1
414 1 61 SER H 1 61 SER QB 3.300 . 3.300 2.235 2.059 2.881 . 0 0 "[ . 1 . 2]" 1
415 1 7 GLY QA 1 30 LEU H 5.500 . 5.500 3.398 3.125 3.704 . 0 0 "[ . 1 . 2]" 1
416 1 29 ASN QB 1 30 LEU H 5.500 . 5.500 3.805 3.733 3.861 . 0 0 "[ . 1 . 2]" 1
417 1 30 LEU H 1 30 LEU QB 3.500 . 3.500 2.241 2.206 2.325 . 0 0 "[ . 1 . 2]" 1
418 1 30 LEU H 1 30 LEU HG 2.800 . 2.800 2.772 2.591 2.809 0.009 15 0 "[ . 1 . 2]" 1
419 1 60 ALA MB 1 61 SER H 3.500 . 3.500 2.010 1.941 2.227 . 0 0 "[ . 1 . 2]" 1
420 1 30 LEU H 1 75 LEU MD2 5.500 . 5.500 4.495 4.030 4.584 . 0 0 "[ . 1 . 2]" 1
421 1 31 VAL H 1 32 PRO QD 5.500 . 5.500 4.172 4.067 4.309 . 0 0 "[ . 1 . 2]" 1
422 1 31 VAL H 1 31 VAL HB 3.500 . 3.500 2.653 2.560 2.765 . 0 0 "[ . 1 . 2]" 1
423 1 30 LEU QB 1 31 VAL H 5.000 . 5.000 2.077 1.962 2.456 . 0 0 "[ . 1 . 2]" 1
424 1 31 VAL H 1 31 VAL MG1 . . 3.300 2.005 1.930 2.170 . 0 0 "[ . 1 . 2]" 1
425 1 32 PRO HA 1 33 ARG H 2.800 . 2.800 2.252 2.178 2.424 . 0 0 "[ . 1 . 2]" 1
426 1 32 PRO QB 1 33 ARG H 3.500 . 3.500 2.915 2.467 3.122 . 0 0 "[ . 1 . 2]" 1
427 1 32 PRO QG 1 33 ARG H 5.500 . 5.500 4.423 4.083 4.633 . 0 0 "[ . 1 . 2]" 1
428 1 33 ARG H 1 33 ARG QB 3.500 . 3.500 2.711 2.161 3.126 . 0 0 "[ . 1 . 2]" 1
429 1 33 ARG H 1 75 LEU MD2 5.500 . 5.500 3.964 2.666 4.455 . 0 0 "[ . 1 . 2]" 1
430 1 33 ARG HA 1 34 ASP H 2.800 . 2.800 2.302 2.142 2.672 . 0 0 "[ . 1 . 2]" 1
431 1 34 ASP H 1 34 ASP QB 2.800 . 2.800 2.375 2.192 2.505 . 0 0 "[ . 1 . 2]" 1
432 1 33 ARG QB 1 34 ASP H 4.000 . 4.000 3.079 1.976 3.570 . 0 0 "[ . 1 . 2]" 1
433 1 34 ASP QB 1 35 ASN H 3.500 . 3.500 2.929 2.551 3.122 . 0 0 "[ . 1 . 2]" 1
434 1 35 ASN H 1 36 ASN H 3.500 . 3.500 2.876 2.428 3.502 0.002 2 0 "[ . 1 . 2]" 1
435 1 36 ASN H 1 36 ASN QB 3.300 . 3.300 2.736 2.208 2.966 . 0 0 "[ . 1 . 2]" 1
436 1 38 TYR H 1 39 SER H 2.800 . 2.800 2.098 1.806 2.926 0.126 19 0 "[ . 1 . 2]" 1
437 1 38 TYR H 1 38 TYR QD 3.300 . 3.300 2.818 2.555 2.965 . 0 0 "[ . 1 . 2]" 1
438 1 37 GLY QA 1 38 TYR H 3.300 . 3.300 2.279 2.110 2.764 . 0 0 "[ . 1 . 2]" 1
439 1 128 ASP H 1 128 ASP QB 3.300 . 3.300 2.345 2.102 2.750 . 0 0 "[ . 1 . 2]" 1
440 1 127 LEU QB 1 128 ASP H 4.000 . 4.000 2.502 1.760 2.659 0.040 10 0 "[ . 1 . 2]" 1
441 1 127 LEU HG 1 128 ASP H 5.000 . 5.000 4.631 4.299 4.742 . 0 0 "[ . 1 . 2]" 1
442 1 127 LEU MD1 1 128 ASP H 5.500 . 5.500 4.446 3.576 4.605 . 0 0 "[ . 1 . 2]" 1
443 1 127 LEU MD2 1 128 ASP H 5.500 . 5.500 4.482 3.819 4.594 . 0 0 "[ . 1 . 2]" 1
444 1 39 SER H 1 39 SER QB 3.500 . 3.500 2.380 2.091 2.826 . 0 0 "[ . 1 . 2]" 1
445 1 38 TYR QB 1 39 SER H 4.000 . 4.000 3.252 2.615 3.421 . 0 0 "[ . 1 . 2]" 1
446 1 38 TYR QD 1 39 SER H 4.000 . 4.000 2.991 1.938 3.695 . 0 0 "[ . 1 . 2]" 1
447 1 42 PHE H 1 103 TRP H 3.500 . 3.500 3.152 2.916 3.498 . 0 0 "[ . 1 . 2]" 1
448 1 42 PHE H 1 42 PHE QD 3.300 . 3.300 2.516 2.247 2.773 . 0 0 "[ . 1 . 2]" 1
449 1 42 PHE H 1 79 TRP HZ2 5.000 . 5.000 4.925 4.688 5.009 0.009 5 0 "[ . 1 . 2]" 1
450 1 42 PHE H 1 42 PHE QE 6.000 . 6.000 3.881 3.773 4.010 . 0 0 "[ . 1 . 2]" 1
451 1 41 PRO HA 1 42 PHE H 2.800 . 2.800 2.217 2.147 2.315 . 0 0 "[ . 1 . 2]" 1
452 1 42 PHE H 1 104 ASP HA 3.500 . 3.500 3.156 2.745 3.390 . 0 0 "[ . 1 . 2]" 1
453 1 42 PHE H 1 102 VAL HA 5.000 . 5.000 4.902 4.599 5.006 0.006 1 0 "[ . 1 . 2]" 1
454 1 41 PRO QB 1 42 PHE H 4.000 . 4.000 3.012 2.694 3.295 . 0 0 "[ . 1 . 2]" 1
455 1 41 PRO QG 1 42 PHE H 5.500 . 5.500 4.573 4.232 4.810 . 0 0 "[ . 1 . 2]" 1
456 1 42 PHE H 1 102 VAL MG1 5.500 . 5.500 3.822 3.566 3.955 . 0 0 "[ . 1 . 2]" 1
457 1 42 PHE H 1 114 LEU MD1 5.500 . 5.500 4.310 3.980 4.583 . 0 0 "[ . 1 . 2]" 1
458 1 43 VAL H 1 79 TRP HE1 5.000 . 5.000 4.248 3.971 4.678 . 0 0 "[ . 1 . 2]" 1
459 1 43 VAL H 1 57 VAL H 3.500 . 3.500 2.896 2.704 3.151 . 0 0 "[ . 1 . 2]" 1
460 1 42 PHE QD 1 43 VAL H 4.000 . 4.000 3.551 3.388 3.585 . 0 0 "[ . 1 . 2]" 1
461 1 42 PHE HA 1 43 VAL H 2.800 . 2.800 2.471 2.437 2.481 . 0 0 "[ . 1 . 2]" 1
462 1 42 PHE QB 1 43 VAL H 3.300 . 3.300 2.276 2.261 2.331 . 0 0 "[ . 1 . 2]" 1
463 1 43 VAL H 1 57 VAL HB 3.500 . 3.500 2.347 1.979 2.573 . 0 0 "[ . 1 . 2]" 1
464 1 43 VAL H 1 43 VAL HB 2.800 . 2.800 2.615 2.537 2.692 . 0 0 "[ . 1 . 2]" 1
465 1 43 VAL H 1 56 VAL MG1 5.500 . 5.500 3.341 3.053 3.622 . 0 0 "[ . 1 . 2]" 1
466 1 43 VAL H 1 43 VAL MG2 4.000 . 4.000 2.844 2.694 2.979 . 0 0 "[ . 1 . 2]" 1
467 1 44 LYS H 1 101 THR H 3.500 . 3.500 2.696 2.603 2.802 . 0 0 "[ . 1 . 2]" 1
468 1 44 LYS H 1 103 TRP HD1 4.000 . 4.000 3.175 2.701 3.346 . 0 0 "[ . 1 . 2]" 1
469 1 43 VAL HA 1 44 LYS H 2.800 . 2.800 2.272 2.204 2.308 . 0 0 "[ . 1 . 2]" 1
470 1 44 LYS H 1 100 VAL HA 5.000 . 5.000 4.447 4.308 4.632 . 0 0 "[ . 1 . 2]" 1
471 1 44 LYS H 1 102 VAL HA 5.000 . 5.000 3.618 3.550 3.686 . 0 0 "[ . 1 . 2]" 1
472 1 44 LYS H 1 44 LYS QB 3.500 . 3.500 2.562 2.445 2.850 . 0 0 "[ . 1 . 2]" 1
473 1 44 LYS H 1 44 LYS QG 4.000 . 4.000 3.296 2.632 3.571 . 0 0 "[ . 1 . 2]" 1
474 1 43 VAL HB 1 44 LYS H 5.000 . 5.000 3.810 3.710 3.940 . 0 0 "[ . 1 . 2]" 1
475 1 44 LYS H 1 100 VAL MG1 5.500 . 5.500 3.784 3.398 4.009 . 0 0 "[ . 1 . 2]" 1
476 1 43 VAL MG1 1 44 LYS H 3.300 . 3.300 1.991 1.903 2.256 . 0 0 "[ . 1 . 2]" 1
477 1 43 VAL MG2 1 44 LYS H 5.500 . 5.500 3.732 3.618 3.883 . 0 0 "[ . 1 . 2]" 1
478 1 44 LYS H 1 103 TRP HE1 5.000 . 5.000 4.066 3.489 4.583 . 0 0 "[ . 1 . 2]" 1
479 1 45 VAL H 1 55 MET H 5.000 . 5.000 3.245 3.053 3.506 . 0 0 "[ . 1 . 2]" 1
480 1 44 LYS HA 1 45 VAL H 2.800 . 2.800 2.168 2.159 2.189 . 0 0 "[ . 1 . 2]" 1
481 1 45 VAL H 1 56 VAL HA 5.000 . 5.000 3.620 3.441 3.988 . 0 0 "[ . 1 . 2]" 1
482 1 45 VAL H 1 54 VAL HA 5.000 . 5.000 4.679 4.132 4.992 . 0 0 "[ . 1 . 2]" 1
483 1 45 VAL H 1 45 VAL HB 2.800 . 2.800 2.570 2.485 2.645 . 0 0 "[ . 1 . 2]" 1
484 1 45 VAL H 1 55 MET QB 5.500 . 5.500 3.247 2.778 3.626 . 0 0 "[ . 1 . 2]" 1
485 1 44 LYS QB 1 45 VAL H 4.000 . 4.000 3.455 3.236 3.578 . 0 0 "[ . 1 . 2]" 1
486 1 44 LYS QG 1 45 VAL H 5.500 . 5.500 4.062 3.797 4.516 . 0 0 "[ . 1 . 2]" 1
487 1 45 VAL H 1 45 VAL MG2 4.000 . 4.000 2.979 2.844 3.084 . 0 0 "[ . 1 . 2]" 1
488 1 45 VAL H 1 54 VAL MG2 4.000 . 4.000 3.274 2.745 3.342 . 0 0 "[ . 1 . 2]" 1
489 1 46 TYR H 1 99 GLU H 3.500 . 3.500 3.175 3.037 3.317 . 0 0 "[ . 1 . 2]" 1
490 1 46 TYR H 1 46 TYR QD 4.000 . 4.000 3.281 3.196 3.345 . 0 0 "[ . 1 . 2]" 1
491 1 46 TYR H 1 46 TYR QE 6.000 . 6.000 4.411 4.323 4.503 . 0 0 "[ . 1 . 2]" 1
492 1 45 VAL HA 1 46 TYR H 2.800 . 2.800 2.129 2.119 2.143 . 0 0 "[ . 1 . 2]" 1
493 1 46 TYR H 1 46 TYR QB 3.500 . 3.500 3.172 3.150 3.196 . 0 0 "[ . 1 . 2]" 1
494 1 46 TYR H 1 99 GLU QB 5.000 . 5.000 3.311 3.088 3.571 . 0 0 "[ . 1 . 2]" 1
495 1 45 VAL MG1 1 46 TYR H 3.300 . 3.300 2.718 2.515 2.755 . 0 0 "[ . 1 . 2]" 1
496 1 45 VAL MG2 1 46 TYR H 5.500 . 5.500 3.927 3.825 3.991 . 0 0 "[ . 1 . 2]" 1
497 1 47 LEU H 1 53 GLN H 5.000 . 5.000 4.926 4.392 5.062 0.062 17 0 "[ . 1 . 2]" 1
498 1 46 TYR QD 1 47 LEU H 4.000 . 4.000 3.505 3.219 3.572 . 0 0 "[ . 1 . 2]" 1
499 1 46 TYR HA 1 47 LEU H 2.800 . 2.800 2.357 2.264 2.538 . 0 0 "[ . 1 . 2]" 1
500 1 46 TYR QB 1 47 LEU H 3.500 . 3.500 2.564 2.237 2.707 . 0 0 "[ . 1 . 2]" 1
501 1 47 LEU H 1 47 LEU QB 2.800 . 2.800 2.123 2.072 2.209 . 0 0 "[ . 1 . 2]" 1
502 1 47 LEU H 1 47 LEU HG 5.000 . 5.000 4.548 4.422 4.694 . 0 0 "[ . 1 . 2]" 1
503 1 48 LEU H 1 99 GLU H 5.000 . 5.000 4.584 4.282 5.001 0.001 8 0 "[ . 1 . 2]" 1
504 1 48 LEU H 1 97 THR H 3.500 . 3.500 2.452 2.239 2.676 . 0 0 "[ . 1 . 2]" 1
505 1 48 LEU H 1 96 LYS HA 5.000 . 5.000 4.143 3.761 4.713 . 0 0 "[ . 1 . 2]" 1
506 1 47 LEU HA 1 48 LEU H 2.800 . 2.800 2.258 2.201 2.351 . 0 0 "[ . 1 . 2]" 1
507 1 48 LEU H 1 97 THR HB 3.500 . 3.500 3.484 3.317 3.551 0.051 8 0 "[ . 1 . 2]" 1
508 1 48 LEU H 1 48 LEU QB 3.300 . 3.300 2.466 2.201 2.929 . 0 0 "[ . 1 . 2]" 1
509 1 48 LEU H 1 48 LEU HG 2.800 . 2.800 2.403 1.938 2.813 0.013 4 0 "[ . 1 . 2]" 1
510 1 47 LEU QB 1 48 LEU H 5.500 . 5.500 3.116 2.935 3.280 . 0 0 "[ . 1 . 2]" 1
511 1 47 LEU HG 1 48 LEU H 5.000 . 5.000 4.389 4.127 4.700 . 0 0 "[ . 1 . 2]" 1
512 1 48 LEU H 1 48 LEU MD1 5.500 . 5.500 3.802 3.623 3.969 . 0 0 "[ . 1 . 2]" 1
513 1 47 LEU QD 1 48 LEU H 4.500 . 4.500 2.137 1.943 2.472 . 0 0 "[ . 1 . 2]" 1
514 1 51 ARG H 1 51 ARG HB3 3.500 . 3.500 3.323 2.557 3.525 0.025 4 0 "[ . 1 . 2]" 1
515 1 51 ARG H 1 51 ARG QG 4.000 . 4.000 3.077 2.155 3.567 . 0 0 "[ . 1 . 2]" 1
516 1 51 ARG QB 1 52 GLY H 4.000 . 4.000 2.522 1.940 3.580 . 0 0 "[ . 1 . 2]" 1
517 1 53 GLN H 1 53 GLN QG 4.000 . 4.000 3.085 2.249 3.616 . 0 0 "[ . 1 . 2]" 1
518 1 53 GLN H 1 53 GLN QB 3.300 . 3.300 2.402 2.095 2.976 . 0 0 "[ . 1 . 2]" 1
519 1 53 GLN HA 1 54 VAL H 2.800 . 2.800 2.204 2.143 2.256 . 0 0 "[ . 1 . 2]" 1
520 1 53 GLN QG 1 54 VAL H 4.000 . 4.000 3.425 2.565 3.587 . 0 0 "[ . 1 . 2]" 1
521 1 54 VAL H 1 54 VAL HB 2.800 . 2.800 2.808 2.699 2.850 0.050 9 0 "[ . 1 . 2]" 1
522 1 54 VAL H 1 54 VAL MG1 3.300 . 3.300 1.950 1.908 2.046 . 0 0 "[ . 1 . 2]" 1
523 1 44 LYS HA 1 55 MET H 5.000 . 5.000 4.464 4.273 4.715 . 0 0 "[ . 1 . 2]" 1
524 1 46 TYR HA 1 55 MET H 5.000 . 5.000 3.663 3.453 3.926 . 0 0 "[ . 1 . 2]" 1
525 1 54 VAL HA 1 55 MET H 2.800 . 2.800 2.146 2.133 2.162 . 0 0 "[ . 1 . 2]" 1
526 1 55 MET H 1 55 MET QB 3.300 . 3.300 2.373 2.185 2.548 . 0 0 "[ . 1 . 2]" 1
527 1 45 VAL MG1 1 55 MET H 5.500 . 5.500 4.606 4.594 4.619 . 0 0 "[ . 1 . 2]" 1
528 1 54 VAL MG1 1 55 MET H 5.500 . 5.500 4.055 3.945 4.158 . 0 0 "[ . 1 . 2]" 1
529 1 54 VAL MG2 1 55 MET H 3.300 . 3.300 2.666 2.472 2.760 . 0 0 "[ . 1 . 2]" 1
530 1 55 MET HA 1 56 VAL H 2.800 . 2.800 2.164 2.135 2.324 . 0 0 "[ . 1 . 2]" 1
531 1 55 MET QG 1 56 VAL H 5.000 . 5.000 3.403 2.600 4.486 . 0 0 "[ . 1 . 2]" 1
532 1 56 VAL H 1 56 VAL MG2 3.300 . 3.300 2.389 2.187 2.758 . 0 0 "[ . 1 . 2]" 1
533 1 45 VAL HA 1 99 GLU H 5.000 . 5.000 4.315 4.015 4.507 . 0 0 "[ . 1 . 2]" 1
534 1 98 LEU HA 1 99 GLU H 2.800 . 2.800 2.149 2.140 2.165 . 0 0 "[ . 1 . 2]" 1
535 1 99 GLU H 1 99 GLU QB 3.300 . 3.300 2.415 2.272 2.523 . 0 0 "[ . 1 . 2]" 1
536 1 57 VAL H 1 57 VAL HB 2.800 . 2.800 2.540 2.380 2.650 . 0 0 "[ . 1 . 2]" 1
537 1 98 LEU HG 1 99 GLU H 3.500 . 3.500 3.108 2.787 3.389 . 0 0 "[ . 1 . 2]" 1
538 1 45 VAL MG1 1 99 GLU H 5.500 . 5.500 3.252 2.859 3.529 . 0 0 "[ . 1 . 2]" 1
539 1 57 VAL H 1 57 VAL QG . . 3.800 2.362 2.103 2.551 . 0 0 "[ . 1 . 2]" 1
540 1 58 GLN H 1 81 GLN QE . . 5.000 4.184 3.480 4.436 . 0 0 "[ . 1 . 2]" 1
541 1 12 GLN H 1 23 HIS HD2 5.000 . 5.000 4.352 3.872 5.016 0.016 18 0 "[ . 1 . 2]" 1
542 1 57 VAL HA 1 58 GLN H 2.800 . 2.800 2.219 2.137 2.310 . 0 0 "[ . 1 . 2]" 1
543 1 58 GLN H 1 58 GLN QB 3.300 . 3.300 2.324 2.116 2.799 . 0 0 "[ . 1 . 2]" 1
544 1 57 VAL QG 1 58 GLN H 3.800 . 3.800 2.147 1.907 2.505 . 0 0 "[ . 1 . 2]" 1
545 1 58 GLN HA 1 59 ASN H 2.800 . 2.800 2.492 2.429 2.503 . 0 0 "[ . 1 . 2]" 1
546 1 59 ASN H 1 59 ASN QB 3.500 . 3.500 2.320 2.142 2.781 . 0 0 "[ . 1 . 2]" 1
547 1 58 GLN QG 1 59 ASN H 5.500 . 5.500 2.814 1.932 3.973 . 0 0 "[ . 1 . 2]" 1
548 1 58 GLN QB 1 59 ASN H 4.000 . 4.000 2.562 2.206 3.142 . 0 0 "[ . 1 . 2]" 1
549 1 59 ASN HA 1 60 ALA H 2.800 . 2.800 2.314 2.163 2.391 . 0 0 "[ . 1 . 2]" 1
550 1 59 ASN QB 1 60 ALA H 4.000 . 4.000 2.779 2.399 3.216 . 0 0 "[ . 1 . 2]" 1
551 1 60 ALA H 1 60 ALA MB 3.300 . 3.300 2.311 2.125 2.487 . 0 0 "[ . 1 . 2]" 1
552 1 63 GLU H 1 64 TYR H 2.800 . 2.800 2.776 2.693 2.903 0.103 7 0 "[ . 1 . 2]" 1
553 1 61 SER HA 1 63 GLU H 5.000 . 5.000 3.663 3.414 4.673 . 0 0 "[ . 1 . 2]" 1
554 1 63 GLU H 1 63 GLU QG 4.000 . 4.000 2.849 1.980 3.596 . 0 0 "[ . 1 . 2]" 1
555 1 63 GLU H 1 63 GLU QB 3.300 . 3.300 2.265 2.042 2.540 . 0 0 "[ . 1 . 2]" 1
556 1 62 ALA MB 1 63 GLU H 4.000 . 4.000 2.817 2.424 2.971 . 0 0 "[ . 1 . 2]" 1
557 1 64 TYR H 1 64 TYR QD 3.300 . 3.300 2.914 2.823 2.997 . 0 0 "[ . 1 . 2]" 1
558 1 61 SER HA 1 64 TYR H 5.000 . 5.000 4.699 4.562 5.014 0.014 7 0 "[ . 1 . 2]" 1
559 1 62 ALA HA 1 64 TYR H 5.000 . 5.000 3.943 3.795 4.065 . 0 0 "[ . 1 . 2]" 1
560 1 64 TYR H 1 64 TYR QB 3.300 . 3.300 2.333 2.223 2.427 . 0 0 "[ . 1 . 2]" 1
561 1 63 GLU QG 1 64 TYR H 5.500 . 5.500 3.127 1.870 4.556 . 0 0 "[ . 1 . 2]" 1
562 1 63 GLU QB 1 64 TYR H 4.000 . 4.000 3.174 2.716 3.585 . 0 0 "[ . 1 . 2]" 1
563 1 62 ALA MB 1 64 TYR H 5.500 . 5.500 4.498 4.164 4.590 . 0 0 "[ . 1 . 2]" 1
564 1 64 TYR QD 1 65 LYS H 4.000 . 4.000 3.291 2.770 3.536 . 0 0 "[ . 1 . 2]" 1
565 1 62 ALA HA 1 65 LYS H 3.500 . 3.500 2.952 2.854 3.066 . 0 0 "[ . 1 . 2]" 1
566 1 63 GLU HA 1 65 LYS H 5.000 . 5.000 4.528 4.380 4.720 . 0 0 "[ . 1 . 2]" 1
567 1 64 TYR QB 1 65 LYS H 4.000 . 4.000 3.469 3.280 3.568 . 0 0 "[ . 1 . 2]" 1
568 1 65 LYS H 1 65 LYS QB 3.300 . 3.300 2.585 2.433 2.647 . 0 0 "[ . 1 . 2]" 1
569 1 65 LYS H 1 65 LYS QD 4.000 . 4.000 3.512 3.127 3.625 . 0 0 "[ . 1 . 2]" 1
570 1 64 TYR QD 1 66 ARG H 6.000 . 6.000 5.311 5.032 5.372 . 0 0 "[ . 1 . 2]" 1
571 1 63 GLU HA 1 66 ARG H 5.000 . 5.000 4.144 3.985 4.402 . 0 0 "[ . 1 . 2]" 1
572 1 66 ARG H 1 66 ARG QG 4.000 . 4.000 2.413 2.097 2.714 . 0 0 "[ . 1 . 2]" 1
573 1 65 LYS H 1 67 ARG H 5.000 . 5.000 3.866 3.636 3.999 . 0 0 "[ . 1 . 2]" 1
574 1 74 SER QB 1 75 LEU H 4.000 . 4.000 3.137 2.410 3.578 . 0 0 "[ . 1 . 2]" 1
575 1 75 LEU H 1 75 LEU HG 2.800 . 2.800 2.643 2.140 2.814 0.014 2 0 "[ . 1 . 2]" 1
576 1 75 LEU H 1 75 LEU MD1 5.500 . 5.500 3.948 3.675 4.085 . 0 0 "[ . 1 . 2]" 1
577 1 75 LEU H 1 75 LEU MD2 5.500 . 5.500 3.395 2.962 3.570 . 0 0 "[ . 1 . 2]" 1
578 1 74 SER H 1 75 LEU H 2.800 . 2.800 2.348 2.076 2.783 . 0 0 "[ . 1 . 2]" 1
579 1 74 SER H 1 74 SER QB 3.300 . 3.300 2.497 2.266 2.871 . 0 0 "[ . 1 . 2]" 1
580 1 73 LYS QB 1 74 SER H 4.000 . 4.000 2.694 1.945 3.162 . 0 0 "[ . 1 . 2]" 1
581 1 73 LYS QG 1 74 SER H 5.500 . 5.500 3.443 1.830 4.728 . 0 0 "[ . 1 . 2]" 1
582 1 74 SER H 1 76 ASN H 5.000 . 5.000 4.158 3.658 4.598 . 0 0 "[ . 1 . 2]" 1
583 1 76 ASN H 1 76 ASN QD 5.500 . 5.500 3.730 2.200 4.767 . 0 0 "[ . 1 . 2]" 1
584 1 73 LYS HA 1 76 ASN H 5.000 . 5.000 4.838 4.206 5.033 0.033 17 0 "[ . 1 . 2]" 1
585 1 76 ASN H 1 77 PRO QD 4.000 . 4.000 3.527 3.388 3.619 . 0 0 "[ . 1 . 2]" 1
586 1 76 ASN H 1 76 ASN QB 3.300 . 3.300 2.840 2.631 2.955 . 0 0 "[ . 1 . 2]" 1
587 1 75 LEU QB 1 76 ASN H 4.000 . 4.000 2.426 2.290 2.609 . 0 0 "[ . 1 . 2]" 1
588 1 75 LEU MD1 1 76 ASN H 5.500 . 5.500 4.459 4.302 4.589 . 0 0 "[ . 1 . 2]" 1
589 1 75 LEU MD2 1 76 ASN H 5.500 . 5.500 4.549 4.496 4.597 . 0 0 "[ . 1 . 2]" 1
590 1 77 PRO HA 1 78 GLU H 2.800 . 2.800 2.208 2.161 2.292 . 0 0 "[ . 1 . 2]" 1
591 1 78 GLU H 1 78 GLU QB 3.500 . 3.500 2.747 2.333 3.051 . 0 0 "[ . 1 . 2]" 1
592 1 79 TRP H 1 80 ASN H 2.800 . 2.800 1.990 1.898 2.105 . 0 0 "[ . 1 . 2]" 1
593 1 26 GLN H 1 79 TRP H 5.000 . 5.000 4.745 4.585 4.828 . 0 0 "[ . 1 . 2]" 1
594 1 79 TRP H 1 79 TRP HE3 3.500 . 3.500 3.277 3.009 3.519 0.019 15 0 "[ . 1 . 2]" 1
595 1 26 GLN HA 1 79 TRP H 3.500 . 3.500 3.493 3.369 3.526 0.026 11 0 "[ . 1 . 2]" 1
596 1 25 LEU HA 1 79 TRP H 3.500 . 3.500 3.451 3.182 3.538 0.038 15 0 "[ . 1 . 2]" 1
597 1 78 GLU HA 1 79 TRP H 2.800 . 2.800 2.464 2.349 2.538 . 0 0 "[ . 1 . 2]" 1
598 1 79 TRP H 1 79 TRP QB 3.500 . 3.500 2.865 2.803 2.941 . 0 0 "[ . 1 . 2]" 1
599 1 26 GLN QB 1 79 TRP H 4.000 . 4.000 3.173 3.093 3.298 . 0 0 "[ . 1 . 2]" 1
600 1 78 GLU QG 1 79 TRP H 5.500 . 5.500 3.482 3.258 3.651 . 0 0 "[ . 1 . 2]" 1
601 1 78 GLU QB 1 79 TRP H 4.000 . 4.000 2.267 2.055 2.547 . 0 0 "[ . 1 . 2]" 1
602 1 24 ILE MG 1 79 TRP H 5.500 . 5.500 4.558 4.454 4.587 . 0 0 "[ . 1 . 2]" 1
603 1 80 ASN H 1 81 GLN H 3.500 . 3.500 2.891 2.774 3.025 . 0 0 "[ . 1 . 2]" 1
604 1 26 GLN H 1 80 ASN H 5.000 . 5.000 4.817 4.600 4.973 . 0 0 "[ . 1 . 2]" 1
605 1 79 TRP HE3 1 80 ASN H 5.000 . 5.000 3.479 3.202 3.805 . 0 0 "[ . 1 . 2]" 1
606 1 26 GLN HA 1 80 ASN H 5.000 . 5.000 4.633 4.399 4.829 . 0 0 "[ . 1 . 2]" 1
607 1 78 GLU HA 1 80 ASN H 5.000 . 5.000 4.279 4.106 4.402 . 0 0 "[ . 1 . 2]" 1
608 1 78 GLU QG 1 80 ASN H 5.500 . 5.500 4.869 4.639 4.932 . 0 0 "[ . 1 . 2]" 1
609 1 24 ILE HB 1 80 ASN H 5.000 . 5.000 4.570 3.614 5.006 0.006 14 0 "[ . 1 . 2]" 1
610 1 25 LEU MD2 1 80 ASN H . . 4.000 3.368 3.351 3.381 . 0 0 "[ . 1 . 2]" 1
611 1 24 ILE MG 1 80 ASN H 5.500 . 5.500 4.202 4.071 4.358 . 0 0 "[ . 1 . 2]" 1
612 1 79 TRP H 1 81 GLN H 5.000 . 5.000 4.669 4.576 4.784 . 0 0 "[ . 1 . 2]" 1
613 1 23 HIS HA 1 81 GLN H 5.000 . 5.000 4.683 4.551 4.786 . 0 0 "[ . 1 . 2]" 1
614 1 80 ASN HA 1 81 GLN H 2.800 . 2.800 2.705 2.668 2.754 . 0 0 "[ . 1 . 2]" 1
615 1 79 TRP QB 1 81 GLN H 4.000 . 4.000 2.889 2.781 3.015 . 0 0 "[ . 1 . 2]" 1
616 1 81 GLN H 1 81 GLN QG 4.000 . 4.000 2.920 2.731 3.109 . 0 0 "[ . 1 . 2]" 1
617 1 81 GLN H 1 81 GLN QB 3.300 . 3.300 2.452 2.367 2.601 . 0 0 "[ . 1 . 2]" 1
618 1 24 ILE HB 1 81 GLN H 3.500 . 3.500 3.212 2.532 3.510 0.010 2 0 "[ . 1 . 2]" 1
619 1 24 ILE QG 1 81 GLN H 6.500 . 6.500 4.823 3.373 5.410 . 0 0 "[ . 1 . 2]" 1
620 1 25 LEU MD2 1 81 GLN H 5.500 . 5.500 4.272 4.054 4.456 . 0 0 "[ . 1 . 2]" 1
621 1 57 VAL QG 1 81 GLN H 5.000 . 5.000 3.435 3.132 3.710 . 0 0 "[ . 1 . 2]" 1
622 1 81 GLN HA 1 82 THR H 2.800 . 2.800 2.508 2.440 2.555 . 0 0 "[ . 1 . 2]" 1
623 1 82 THR H 1 82 THR HB 2.800 . 2.800 2.819 2.804 2.829 0.029 9 0 "[ . 1 . 2]" 1
624 1 23 HIS QB 1 82 THR H 5.500 . 5.500 4.918 4.910 4.931 . 0 0 "[ . 1 . 2]" 1
625 1 81 GLN QG 1 82 THR H 4.500 . 4.500 4.040 4.022 4.066 . 0 0 "[ . 1 . 2]" 1
626 1 81 GLN QB 1 82 THR H 4.000 . 4.000 2.137 2.036 2.281 . 0 0 "[ . 1 . 2]" 1
627 1 57 VAL QG 1 82 THR H 6.000 . 6.000 4.337 4.112 4.464 . 0 0 "[ . 1 . 2]" 1
628 1 23 HIS H 1 83 VAL H 5.000 . 5.000 4.682 4.536 4.792 . 0 0 "[ . 1 . 2]" 1
629 1 22 ILE H 1 83 VAL H 3.500 . 3.500 2.873 2.717 3.097 . 0 0 "[ . 1 . 2]" 1
630 1 82 THR HA 1 83 VAL H 2.800 . 2.800 2.183 2.148 2.235 . 0 0 "[ . 1 . 2]" 1
631 1 23 HIS HA 1 83 VAL H 3.500 . 3.500 3.191 3.063 3.347 . 0 0 "[ . 1 . 2]" 1
632 1 21 ILE HA 1 83 VAL H 5.000 . 5.000 4.431 4.271 4.610 . 0 0 "[ . 1 . 2]" 1
633 1 82 THR HB 1 83 VAL H 5.000 . 5.000 4.057 3.883 4.212 . 0 0 "[ . 1 . 2]" 1
634 1 83 VAL H 1 83 VAL HB 3.500 . 3.500 2.889 2.772 3.044 . 0 0 "[ . 1 . 2]" 1
635 1 24 ILE QG 1 83 VAL H 6.500 . 6.500 5.409 4.391 5.805 . 0 0 "[ . 1 . 2]" 1
636 1 22 ILE MD 1 83 VAL H 5.500 . 5.500 4.306 4.087 4.564 . 0 0 "[ . 1 . 2]" 1
637 1 21 ILE HA 1 84 ILE H 5.000 . 5.000 4.548 4.463 4.670 . 0 0 "[ . 1 . 2]" 1
638 1 83 VAL HA 1 84 ILE H 2.800 . 2.800 2.373 2.320 2.421 . 0 0 "[ . 1 . 2]" 1
639 1 83 VAL HB 1 84 ILE H 3.500 . 3.500 3.517 3.486 3.537 0.037 11 0 "[ . 1 . 2]" 1
640 1 55 MET ME 1 84 ILE H 5.500 . 5.500 3.691 2.712 4.352 . 0 0 "[ . 1 . 2]" 1
641 1 136 LEU H 1 136 LEU QB 3.300 . 3.300 2.541 2.324 2.662 . 0 0 "[ . 1 . 2]" 1
642 1 84 ILE H 1 84 ILE QG 4.000 . 4.000 2.998 2.609 3.567 . 0 0 "[ . 1 . 2]" 1
643 1 83 VAL MG1 1 84 ILE H 4.000 . 4.000 1.893 1.867 1.918 . 0 0 "[ . 1 . 2]" 1
644 1 85 TYR H 1 85 TYR QD 4.000 . 4.000 3.442 2.567 3.594 . 0 0 "[ . 1 . 2]" 1
645 1 84 ILE HA 1 85 TYR H 2.800 . 2.800 2.252 2.152 2.284 . 0 0 "[ . 1 . 2]" 1
646 1 21 ILE HA 1 85 TYR H 5.000 . 5.000 3.560 3.500 3.672 . 0 0 "[ . 1 . 2]" 1
647 1 85 TYR H 1 85 TYR QB 3.300 . 3.300 2.626 2.453 2.730 . 0 0 "[ . 1 . 2]" 1
648 1 20 LEU QB 1 85 TYR H 5.500 . 5.500 3.219 3.053 3.372 . 0 0 "[ . 1 . 2]" 1
649 1 84 ILE HB 1 85 TYR H 5.000 . 5.000 3.657 3.559 3.875 . 0 0 "[ . 1 . 2]" 1
650 1 84 ILE QG 1 85 TYR H 5.500 . 5.500 4.043 3.920 4.705 . 0 0 "[ . 1 . 2]" 1
651 1 21 ILE MD 1 85 TYR H 5.500 . 5.500 4.480 4.364 4.589 . 0 0 "[ . 1 . 2]" 1
652 1 84 ILE MG 1 85 TYR H . . 3.300 1.976 1.868 2.477 . 0 0 "[ . 1 . 2]" 1
653 1 20 LEU H 1 86 LYS H 5.000 . 5.000 4.604 4.374 4.770 . 0 0 "[ . 1 . 2]" 1
654 1 85 TYR QD 1 86 LYS H 6.000 . 6.000 4.395 4.193 4.812 . 0 0 "[ . 1 . 2]" 1
655 1 85 TYR HA 1 86 LYS H 2.800 . 2.800 2.344 2.319 2.377 . 0 0 "[ . 1 . 2]" 1
656 1 85 TYR QB 1 86 LYS H 5.000 . 5.000 3.840 3.819 3.866 . 0 0 "[ . 1 . 2]" 1
657 1 19 ASN QB 1 86 LYS H 5.500 . 5.500 3.503 3.284 3.731 . 0 0 "[ . 1 . 2]" 1
658 1 86 LYS H 1 86 LYS QB 3.300 . 3.300 2.573 2.402 2.661 . 0 0 "[ . 1 . 2]" 1
659 1 86 LYS H 1 86 LYS QG 4.000 . 4.000 2.188 1.950 2.742 . 0 0 "[ . 1 . 2]" 1
660 1 84 ILE MG 1 86 LYS H 5.500 . 5.500 2.797 2.682 3.141 . 0 0 "[ . 1 . 2]" 1
661 1 19 ASN HA 1 86 LYS H 5.000 . 5.000 4.432 4.313 4.593 . 0 0 "[ . 1 . 2]" 1
662 1 87 SER H 1 88 ILE H . . 2.800 2.291 2.173 2.341 . 0 0 "[ . 1 . 2]" 1
663 1 19 ASN H 1 87 SER H 5.000 . 5.000 5.015 4.989 5.028 0.028 5 0 "[ . 1 . 2]" 1
664 1 12 GLN QE 1 130 THR H 6.500 . 6.500 4.331 3.470 5.611 . 0 0 "[ . 1 . 2]" 1
665 1 19 ASN HA 1 87 SER H 3.500 . 3.500 3.271 3.246 3.286 . 0 0 "[ . 1 . 2]" 1
666 1 86 LYS HA 1 87 SER H 2.800 . 2.800 2.241 2.132 2.303 . 0 0 "[ . 1 . 2]" 1
667 1 19 ASN QB 1 87 SER H 5.000 . 5.000 4.149 4.009 4.252 . 0 0 "[ . 1 . 2]" 1
668 1 86 LYS QB 1 87 SER H 4.000 . 4.000 2.716 2.575 3.079 . 0 0 "[ . 1 . 2]" 1
669 1 86 LYS QG 1 87 SER H 5.500 . 5.500 4.102 3.982 4.182 . 0 0 "[ . 1 . 2]" 1
670 1 84 ILE MG 1 87 SER H 6.500 . 6.500 5.223 5.002 5.425 . 0 0 "[ . 1 . 2]" 1
671 1 19 ASN H 1 88 ILE H 6.000 . 6.000 4.985 4.818 5.073 . 0 0 "[ . 1 . 2]" 1
672 1 15 TYR QD 1 88 ILE H 7.000 . 7.000 5.447 5.247 5.613 . 0 0 "[ . 1 . 2]" 1
673 1 15 TYR QE 1 88 ILE H 6.000 . 6.000 4.482 4.373 4.683 . 0 0 "[ . 1 . 2]" 1
674 1 19 ASN HA 1 88 ILE H 3.500 . 3.500 3.110 2.927 3.209 . 0 0 "[ . 1 . 2]" 1
675 1 87 SER QB 1 88 ILE H 5.000 . 5.000 3.845 3.778 4.053 . 0 0 "[ . 1 . 2]" 1
676 1 18 GLY QA 1 88 ILE H 5.500 . 5.500 3.839 3.666 4.012 . 0 0 "[ . 1 . 2]" 1
677 1 19 ASN QB 1 88 ILE H 5.500 . 5.500 4.862 4.663 4.917 . 0 0 "[ . 1 . 2]" 1
678 1 88 ILE H 1 88 ILE HB 2.800 . 2.800 2.617 2.532 2.757 . 0 0 "[ . 1 . 2]" 1
679 1 88 ILE H 1 88 ILE MG 4.000 . 4.000 3.334 3.083 3.358 . 0 0 "[ . 1 . 2]" 1
680 1 88 ILE H 1 88 ILE MD 5.500 . 5.500 4.512 4.228 4.590 . 0 0 "[ . 1 . 2]" 1
681 1 44 LYS H 1 103 TRP H 5.000 . 5.000 4.705 4.160 4.956 . 0 0 "[ . 1 . 2]" 1
682 1 89 SER H 1 92 GLN QB 4.000 . 4.000 3.267 2.962 3.480 . 0 0 "[ . 1 . 2]" 1
683 1 89 SER H 1 89 SER QB 3.300 . 3.300 2.496 2.205 2.958 . 0 0 "[ . 1 . 2]" 1
684 1 88 ILE QG 1 89 SER H 4.000 . 4.000 3.518 3.161 3.574 . 0 0 "[ . 1 . 2]" 1
685 1 90 MET H 1 91 GLU H 3.500 . 3.500 2.795 2.714 2.911 . 0 0 "[ . 1 . 2]" 1
686 1 15 TYR QE 1 90 MET H 6.000 . 6.000 3.627 3.045 3.947 . 0 0 "[ . 1 . 2]" 1
687 1 90 MET H 1 92 GLN H 5.000 . 5.000 4.808 4.649 4.884 . 0 0 "[ . 1 . 2]" 1
688 1 89 SER HA 1 90 MET H 2.800 . 2.800 2.364 2.285 2.434 . 0 0 "[ . 1 . 2]" 1
689 1 89 SER QB 1 90 MET H 4.000 . 4.000 2.784 2.404 3.499 . 0 0 "[ . 1 . 2]" 1
690 1 90 MET H 1 90 MET QG 4.000 . 4.000 3.002 2.547 3.674 . 0 0 "[ . 1 . 2]" 1
691 1 90 MET H 1 90 MET QB 3.300 . 3.300 2.187 2.022 2.364 . 0 0 "[ . 1 . 2]" 1
692 1 89 SER H 1 91 GLU H 5.000 . 5.000 4.528 4.387 4.792 . 0 0 "[ . 1 . 2]" 1
693 1 91 GLU H 1 93 LEU H 5.000 . 5.000 3.670 3.583 3.885 . 0 0 "[ . 1 . 2]" 1
694 1 91 GLU H 1 92 GLN H 2.800 . 2.800 2.810 2.780 2.825 0.025 13 0 "[ . 1 . 2]" 1
695 1 15 TYR QE 1 91 GLU H 7.000 . 7.000 5.882 5.272 6.156 . 0 0 "[ . 1 . 2]" 1
696 1 89 SER HA 1 91 GLU H 5.000 . 5.000 4.050 3.955 4.162 . 0 0 "[ . 1 . 2]" 1
697 1 89 SER QB 1 91 GLU H 4.000 . 4.000 2.620 2.237 3.165 . 0 0 "[ . 1 . 2]" 1
698 1 90 MET QG 1 91 GLU H 5.500 . 5.500 4.474 4.339 4.554 . 0 0 "[ . 1 . 2]" 1
699 1 91 GLU H 1 91 GLU QG 3.300 . 3.300 1.924 1.717 2.048 0.083 2 0 "[ . 1 . 2]" 1
700 1 90 MET QB 1 91 GLU H 4.000 . 4.000 2.993 2.878 3.058 . 0 0 "[ . 1 . 2]" 1
701 1 91 GLU H 1 91 GLU QB 3.300 . 3.300 2.714 2.637 2.841 . 0 0 "[ . 1 . 2]" 1
702 1 91 GLU H 1 93 LEU QB 6.500 . 6.500 4.040 3.962 4.251 . 0 0 "[ . 1 . 2]" 1
703 1 89 SER H 1 92 GLN H 5.000 . 5.000 3.642 3.390 3.861 . 0 0 "[ . 1 . 2]" 1
704 1 92 GLN H 1 93 LEU H 2.800 . 2.800 2.249 2.121 2.376 . 0 0 "[ . 1 . 2]" 1
705 1 89 SER HA 1 92 GLN H 5.000 . 5.000 4.970 4.790 5.019 0.019 18 0 "[ . 1 . 2]" 1
706 1 89 SER QB 1 92 GLN H 5.500 . 5.500 3.476 2.900 4.276 . 0 0 "[ . 1 . 2]" 1
707 1 92 GLN H 1 92 GLN QG 3.500 . 3.500 2.659 2.298 3.132 . 0 0 "[ . 1 . 2]" 1
708 1 91 GLU QG 1 92 GLN H 4.000 . 4.000 2.899 1.844 3.571 . 0 0 "[ . 1 . 2]" 1
709 1 91 GLU QB 1 92 GLN H 3.300 . 3.300 2.516 2.118 2.988 . 0 0 "[ . 1 . 2]" 1
710 1 92 GLN H 1 92 GLN QB 3.300 . 3.300 2.382 2.124 2.560 . 0 0 "[ . 1 . 2]" 1
711 1 88 ILE MG 1 92 GLN H 6.500 . 6.500 4.756 4.655 4.867 . 0 0 "[ . 1 . 2]" 1
712 1 90 MET HA 1 93 LEU H 3.500 . 3.500 3.376 3.196 3.466 . 0 0 "[ . 1 . 2]" 1
713 1 92 GLN QG 1 93 LEU H 5.500 . 5.500 4.082 2.331 4.383 . 0 0 "[ . 1 . 2]" 1
714 1 92 GLN QB 1 93 LEU H 3.500 . 3.500 2.844 2.630 3.159 . 0 0 "[ . 1 . 2]" 1
715 1 93 LEU H 1 93 LEU QB 3.300 . 3.300 2.166 2.073 2.206 . 0 0 "[ . 1 . 2]" 1
716 1 93 LEU H 1 93 LEU HG 5.000 . 5.000 4.376 4.172 4.528 . 0 0 "[ . 1 . 2]" 1
717 1 88 ILE QG 1 93 LEU H 5.500 . 5.500 4.232 3.439 4.439 . 0 0 "[ . 1 . 2]" 1
718 1 88 ILE MG 1 93 LEU H . . 4.000 3.345 3.334 3.374 . 0 0 "[ . 1 . 2]" 1
719 1 93 LEU H 1 93 LEU MD1 5.500 . 5.500 4.184 3.625 4.411 . 0 0 "[ . 1 . 2]" 1
720 1 93 LEU H 1 93 LEU MD2 5.500 . 5.500 4.035 3.874 4.139 . 0 0 "[ . 1 . 2]" 1
721 1 93 LEU H 1 94 MET H 2.800 . 2.800 2.816 2.665 2.860 0.060 13 0 "[ . 1 . 2]" 1
722 1 91 GLU H 1 94 MET H 5.000 . 5.000 4.706 4.538 5.010 0.010 6 0 "[ . 1 . 2]" 1
723 1 94 MET H 1 96 LYS H 5.000 . 5.000 4.030 3.872 4.133 . 0 0 "[ . 1 . 2]" 1
724 1 94 MET H 1 95 LYS H 2.800 . 2.800 2.705 2.612 2.821 0.021 11 0 "[ . 1 . 2]" 1
725 1 91 GLU HA 1 94 MET H 5.000 . 5.000 4.407 4.165 4.621 . 0 0 "[ . 1 . 2]" 1
726 1 94 MET H 1 94 MET QG 3.300 . 3.300 2.388 1.917 2.956 . 0 0 "[ . 1 . 2]" 1
727 1 94 MET H 1 94 MET QB 3.300 . 3.300 2.450 2.313 2.621 . 0 0 "[ . 1 . 2]" 1
728 1 93 LEU QB 1 94 MET H 3.500 . 3.500 2.474 2.273 2.844 . 0 0 "[ . 1 . 2]" 1
729 1 93 LEU MD1 1 94 MET H 5.500 . 5.500 4.532 4.299 4.589 . 0 0 "[ . 1 . 2]" 1
730 1 93 LEU MD2 1 94 MET H 5.500 . 5.500 3.373 2.452 4.265 . 0 0 "[ . 1 . 2]" 1
731 1 93 LEU H 1 95 LYS H 5.000 . 5.000 4.055 3.799 4.382 . 0 0 "[ . 1 . 2]" 1
732 1 95 LYS H 1 96 LYS H 2.800 . 2.800 2.440 2.188 2.678 . 0 0 "[ . 1 . 2]" 1
733 1 93 LEU HA 1 95 LYS H 5.000 . 5.000 4.079 3.692 4.569 . 0 0 "[ . 1 . 2]" 1
734 1 95 LYS H 1 95 LYS QE 5.500 . 5.500 4.433 2.644 4.900 . 0 0 "[ . 1 . 2]" 1
735 1 94 MET QG 1 95 LYS H 5.500 . 5.500 4.183 3.881 4.710 . 0 0 "[ . 1 . 2]" 1
736 1 94 MET QB 1 95 LYS H 4.000 . 4.000 2.809 2.474 3.153 . 0 0 "[ . 1 . 2]" 1
737 1 95 LYS H 1 95 LYS QB 3.300 . 3.300 2.475 2.335 2.643 . 0 0 "[ . 1 . 2]" 1
738 1 95 LYS H 1 95 LYS QG 3.300 . 3.300 2.351 1.948 2.676 . 0 0 "[ . 1 . 2]" 1
739 1 96 LYS H 1 121 LEU H 5.000 . 5.000 5.009 5.004 5.018 0.018 8 0 "[ . 1 . 2]" 1
740 1 94 MET HA 1 96 LYS H 5.000 . 5.000 3.911 3.768 4.065 . 0 0 "[ . 1 . 2]" 1
741 1 93 LEU HA 1 96 LYS H 3.500 . 3.500 3.335 3.089 3.503 0.003 6 0 "[ . 1 . 2]" 1
742 1 96 LYS H 1 96 LYS QE 5.500 . 5.500 4.663 4.379 4.912 . 0 0 "[ . 1 . 2]" 1
743 1 96 LYS H 1 96 LYS QB 3.300 . 3.300 2.690 2.508 2.981 . 0 0 "[ . 1 . 2]" 1
744 1 96 LYS H 1 96 LYS QG 3.500 . 3.500 2.263 1.689 2.501 0.111 5 0 "[ . 1 . 2]" 1
745 1 96 LYS H 1 96 LYS QD 5.500 . 5.500 4.039 2.860 4.247 . 0 0 "[ . 1 . 2]" 1
746 1 95 LYS QG 1 96 LYS H 5.000 . 5.000 3.892 2.549 4.359 . 0 0 "[ . 1 . 2]" 1
747 1 47 LEU HG 1 96 LYS H 5.000 . 5.000 5.028 5.000 5.103 0.103 8 0 "[ . 1 . 2]" 1
748 1 47 LEU MD1 1 96 LYS H 5.500 . 5.500 4.113 4.003 4.499 . 0 0 "[ . 1 . 2]" 1
749 1 96 LYS HA 1 97 THR H 2.800 . 2.800 2.297 2.190 2.510 . 0 0 "[ . 1 . 2]" 1
750 1 48 LEU HA 1 97 THR H 5.000 . 5.000 4.812 4.479 5.072 0.072 2 0 "[ . 1 . 2]" 1
751 1 97 THR H 1 97 THR HB 2.800 . 2.800 2.645 2.540 2.783 . 0 0 "[ . 1 . 2]" 1
752 1 96 LYS QG 1 97 THR H 5.500 . 5.500 4.426 4.220 4.568 . 0 0 "[ . 1 . 2]" 1
753 1 96 LYS QB 1 97 THR H 3.500 . 3.500 2.710 2.256 2.912 . 0 0 "[ . 1 . 2]" 1
754 1 96 LYS QD 1 97 THR H 5.500 . 5.500 4.159 3.770 4.454 . 0 0 "[ . 1 . 2]" 1
755 1 48 LEU QB 1 97 THR H 5.000 . 5.000 2.679 1.971 3.691 . 0 0 "[ . 1 . 2]" 1
756 1 97 THR H 1 121 LEU QD 5.500 . 5.500 3.915 3.649 4.085 . 0 0 "[ . 1 . 2]" 1
757 1 47 LEU QD 1 97 THR H 6.000 . 6.000 2.051 1.872 2.301 . 0 0 "[ . 1 . 2]" 1
758 1 98 LEU H 1 120 ASP H 5.000 . 5.000 4.922 4.807 5.025 0.025 10 0 "[ . 1 . 2]" 1
759 1 98 LEU H 1 121 LEU H 3.500 . 3.500 3.339 3.081 3.493 . 0 0 "[ . 1 . 2]" 1
760 1 98 LEU H 1 118 LEU HA 6.000 . 6.000 5.361 5.054 5.808 . 0 0 "[ . 1 . 2]" 1
761 1 97 THR HA 1 98 LEU H 2.800 . 2.800 2.157 2.142 2.172 . 0 0 "[ . 1 . 2]" 1
762 1 98 LEU H 1 120 ASP HA 5.000 . 5.000 3.631 3.405 3.858 . 0 0 "[ . 1 . 2]" 1
763 1 98 LEU H 1 119 ILE HA 5.000 . 5.000 4.970 4.873 5.017 0.017 2 0 "[ . 1 . 2]" 1
764 1 97 THR HB 1 98 LEU H 5.000 . 5.000 4.161 4.097 4.254 . 0 0 "[ . 1 . 2]" 1
765 1 98 LEU H 1 121 LEU QB 5.500 . 5.500 4.326 4.095 4.595 . 0 0 "[ . 1 . 2]" 1
766 1 98 LEU H 1 98 LEU QB 3.300 . 3.300 2.270 2.258 2.279 . 0 0 "[ . 1 . 2]" 1
767 1 98 LEU H 1 121 LEU HG 5.000 . 5.000 2.400 2.168 2.678 . 0 0 "[ . 1 . 2]" 1
768 1 97 THR MG 1 98 LEU H 3.300 . 3.300 2.536 2.319 2.755 . 0 0 "[ . 1 . 2]" 1
769 1 98 LEU H 1 119 ILE MG 5.500 . 5.500 4.046 3.855 4.220 . 0 0 "[ . 1 . 2]" 1
770 1 47 LEU QD 1 98 LEU H 6.000 . 6.000 3.006 2.888 3.090 . 0 0 "[ . 1 . 2]" 1
771 1 47 LEU HA 1 99 GLU H 5.000 . 5.000 3.517 3.364 3.735 . 0 0 "[ . 1 . 2]" 1
772 1 46 TYR QB 1 99 GLU H 6.000 . 6.000 5.297 5.103 5.357 . 0 0 "[ . 1 . 2]" 1
773 1 47 LEU QD 1 99 GLU H 6.000 . 6.000 3.633 3.343 3.750 . 0 0 "[ . 1 . 2]" 1
774 1 56 VAL QG 1 57 VAL H 4.500 . 4.500 1.976 1.896 2.230 . 0 0 "[ . 1 . 2]" 1
775 1 100 VAL H 1 117 VAL H 5.000 . 5.000 3.188 3.094 3.273 . 0 0 "[ . 1 . 2]" 1
776 1 100 VAL H 1 116 GLU HA 5.000 . 5.000 4.986 4.912 5.013 0.013 17 0 "[ . 1 . 2]" 1
777 1 100 VAL H 1 118 LEU HA 5.000 . 5.000 3.640 3.393 3.852 . 0 0 "[ . 1 . 2]" 1
778 1 99 GLU HA 1 100 VAL H 2.800 . 2.800 2.158 2.133 2.186 . 0 0 "[ . 1 . 2]" 1
779 1 99 GLU QB 1 100 VAL H 5.500 . 5.500 3.891 3.693 3.957 . 0 0 "[ . 1 . 2]" 1
780 1 99 GLU QG 1 100 VAL H 4.000 . 4.000 3.274 3.027 3.564 . 0 0 "[ . 1 . 2]" 1
781 1 100 VAL H 1 100 VAL HB 3.500 . 3.500 2.640 2.595 2.711 . 0 0 "[ . 1 . 2]" 1
782 1 100 VAL H 1 117 VAL HB 5.000 . 5.000 3.095 2.727 3.286 . 0 0 "[ . 1 . 2]" 1
783 1 98 LEU HG 1 100 VAL H 5.000 . 5.000 4.141 3.856 4.393 . 0 0 "[ . 1 . 2]" 1
784 1 100 VAL H 1 117 VAL MG2 5.500 . 5.500 4.250 3.823 4.508 . 0 0 "[ . 1 . 2]" 1
785 1 100 VAL H 1 100 VAL QG 4.000 . 4.000 2.159 1.952 2.326 . 0 0 "[ . 1 . 2]" 1
786 1 45 VAL HA 1 101 THR H 3.500 . 3.500 3.514 3.499 3.542 0.042 1 0 "[ . 1 . 2]" 1
787 1 100 VAL HA 1 101 THR H 2.800 . 2.800 2.169 2.159 2.184 . 0 0 "[ . 1 . 2]" 1
788 1 44 LYS QB 1 101 THR H 5.500 . 5.500 3.707 3.454 3.862 . 0 0 "[ . 1 . 2]" 1
789 1 100 VAL HB 1 101 THR H 5.000 . 5.000 4.121 4.043 4.231 . 0 0 "[ . 1 . 2]" 1
790 1 101 THR H 1 101 THR MG 4.000 . 4.000 3.013 2.657 3.327 . 0 0 "[ . 1 . 2]" 1
791 1 100 VAL MG1 1 101 THR H 4.000 . 4.000 2.572 2.384 2.837 . 0 0 "[ . 1 . 2]" 1
792 1 43 VAL MG1 1 101 THR H 4.000 . 4.000 2.528 2.369 2.692 . 0 0 "[ . 1 . 2]" 1
793 1 43 VAL MG2 1 101 THR H 5.500 . 5.500 4.597 4.589 4.610 . 0 0 "[ . 1 . 2]" 1
794 1 101 THR H 1 103 TRP HE1 5.000 . 5.000 4.554 4.158 5.001 0.001 11 0 "[ . 1 . 2]" 1
795 1 102 VAL H 1 117 VAL H 5.000 . 5.000 5.014 5.002 5.038 0.038 17 0 "[ . 1 . 2]" 1
796 1 102 VAL H 1 113 PHE QE 6.000 . 6.000 3.502 3.189 3.748 . 0 0 "[ . 1 . 2]" 1
797 1 102 VAL H 1 103 TRP HD1 5.000 . 5.000 4.400 3.974 4.656 . 0 0 "[ . 1 . 2]" 1
798 1 102 VAL H 1 113 PHE QD 7.000 . 7.000 4.512 4.250 4.732 . 0 0 "[ . 1 . 2]" 1
799 1 102 VAL H 1 116 GLU HA 3.500 . 3.500 3.462 3.396 3.506 0.006 2 0 "[ . 1 . 2]" 1
800 1 101 THR HA 1 102 VAL H 2.800 . 2.800 2.138 2.127 2.150 . 0 0 "[ . 1 . 2]" 1
801 1 101 THR HB 1 102 VAL H 3.500 . 3.500 3.326 3.261 3.440 . 0 0 "[ . 1 . 2]" 1
802 1 102 VAL H 1 116 GLU QB 5.500 . 5.500 4.429 4.284 4.527 . 0 0 "[ . 1 . 2]" 1
803 1 101 THR MG 1 102 VAL H 5.500 . 5.500 4.009 3.696 4.178 . 0 0 "[ . 1 . 2]" 1
804 1 102 VAL H 1 102 VAL HB 2.800 . 2.800 2.848 2.832 2.866 0.066 3 0 "[ . 1 . 2]" 1
805 1 102 VAL H 1 102 VAL MG2 3.300 . 3.300 2.100 1.948 2.194 . 0 0 "[ . 1 . 2]" 1
806 1 102 VAL H 1 136 LEU MD2 5.500 . 5.500 3.458 3.267 3.723 . 0 0 "[ . 1 . 2]" 1
807 1 102 VAL H 1 103 TRP HE1 5.000 . 5.000 4.664 4.453 5.005 0.005 17 0 "[ . 1 . 2]" 1
808 1 43 VAL HA 1 103 TRP H 3.500 . 3.500 3.049 2.683 3.251 . 0 0 "[ . 1 . 2]" 1
809 1 41 PRO QB 1 103 TRP H 5.500 . 5.500 4.077 3.678 4.557 . 0 0 "[ . 1 . 2]" 1
810 1 43 VAL MG2 1 103 TRP H 5.500 . 5.500 3.804 3.600 3.993 . 0 0 "[ . 1 . 2]" 1
811 1 104 ASP H 1 112 ASP H 5.000 . 5.000 3.137 2.658 3.539 . 0 0 "[ . 1 . 2]" 1
812 1 104 ASP H 1 114 LEU H 5.000 . 5.000 4.788 4.482 5.004 0.004 18 0 "[ . 1 . 2]" 1
813 1 103 TRP HE3 1 104 ASP H 5.000 . 5.000 3.937 3.638 4.242 . 0 0 "[ . 1 . 2]" 1
814 1 42 PHE QE 1 104 ASP H 6.000 . 6.000 4.576 4.123 4.860 . 0 0 "[ . 1 . 2]" 1
815 1 103 TRP HA 1 104 ASP H 2.800 . 2.800 2.235 2.167 2.328 . 0 0 "[ . 1 . 2]" 1
816 1 103 TRP QB 1 104 ASP H 4.000 . 4.000 2.823 2.592 3.082 . 0 0 "[ . 1 . 2]" 1
817 1 104 ASP H 1 114 LEU HG 5.000 . 5.000 3.744 2.709 5.000 0.000 5 0 "[ . 1 . 2]" 1
818 1 104 ASP H 1 114 LEU MD1 4.000 . 4.000 3.321 3.178 3.345 . 0 0 "[ . 1 . 2]" 1
819 1 40 ASP H 1 105 TYR H 5.000 . 5.000 4.802 3.792 5.008 0.008 17 0 "[ . 1 . 2]" 1
820 1 105 TYR H 1 105 TYR QD 4.000 . 4.000 3.090 1.977 3.487 . 0 0 "[ . 1 . 2]" 1
821 1 42 PHE QD 1 105 TYR H 6.000 . 6.000 3.845 3.538 4.377 . 0 0 "[ . 1 . 2]" 1
822 1 42 PHE HZ 1 105 TYR H 5.000 . 5.000 4.945 4.444 5.012 0.012 9 0 "[ . 1 . 2]" 1
823 1 42 PHE QE 1 105 TYR H 6.000 . 6.000 2.892 2.532 3.248 . 0 0 "[ . 1 . 2]" 1
824 1 41 PRO HA 1 105 TYR H 5.000 . 5.000 3.480 3.038 3.972 . 0 0 "[ . 1 . 2]" 1
825 1 105 TYR H 1 111 ASN HA 5.000 . 5.000 4.749 3.788 4.997 . 0 0 "[ . 1 . 2]" 1
826 1 104 ASP HA 1 105 TYR H 2.800 . 2.800 2.213 2.149 2.301 . 0 0 "[ . 1 . 2]" 1
827 1 105 TYR H 1 105 TYR QB 3.500 . 3.500 2.162 2.081 2.652 . 0 0 "[ . 1 . 2]" 1
828 1 104 ASP QB 1 105 TYR H 4.000 . 4.000 3.391 2.968 3.577 . 0 0 "[ . 1 . 2]" 1
829 1 105 TYR H 1 114 LEU MD1 6.500 . 6.500 5.117 4.869 5.351 . 0 0 "[ . 1 . 2]" 1
830 1 105 TYR QD 1 106 ASP H 5.000 . 5.000 3.166 2.596 4.312 . 0 0 "[ . 1 . 2]" 1
831 1 105 TYR HA 1 106 ASP H 2.800 . 2.800 2.182 2.134 2.278 . 0 0 "[ . 1 . 2]" 1
832 1 106 ASP H 1 111 ASN HA 5.000 . 5.000 3.404 1.994 4.735 . 0 0 "[ . 1 . 2]" 1
833 1 106 ASP H 1 106 ASP QB 3.500 . 3.500 2.348 2.041 2.850 . 0 0 "[ . 1 . 2]" 1
834 1 106 ASP H 1 112 ASP H 5.000 . 5.000 3.836 3.329 4.414 . 0 0 "[ . 1 . 2]" 1
835 1 105 TYR QB 1 106 ASP H 4.000 . 4.000 3.197 2.821 3.478 . 0 0 "[ . 1 . 2]" 1
836 1 107 ARG H 1 108 PHE H 3.500 . 3.500 2.500 2.158 2.700 . 0 0 "[ . 1 . 2]" 1
837 1 106 ASP HA 1 107 ARG H 2.800 . 2.800 2.645 2.350 2.804 0.004 13 0 "[ . 1 . 2]" 1
838 1 106 ASP QB 1 107 ARG H 3.300 . 3.300 2.309 1.948 2.851 . 0 0 "[ . 1 . 2]" 1
839 1 107 ARG H 1 107 ARG QD 5.500 . 5.500 3.816 2.163 4.619 . 0 0 "[ . 1 . 2]" 1
840 1 107 ARG H 1 107 ARG QB 3.500 . 3.500 2.392 2.036 2.630 . 0 0 "[ . 1 . 2]" 1
841 1 107 ARG H 1 107 ARG QG 4.000 . 4.000 2.563 2.042 3.567 . 0 0 "[ . 1 . 2]" 1
842 1 108 PHE H 1 110 SER H 5.000 . 5.000 4.026 3.311 4.984 . 0 0 "[ . 1 . 2]" 1
843 1 108 PHE H 1 109 SER H 2.800 . 2.800 2.636 2.109 2.807 0.007 16 0 "[ . 1 . 2]" 1
844 1 108 PHE H 1 108 PHE QD 4.000 . 4.000 2.961 2.103 3.565 . 0 0 "[ . 1 . 2]" 1
845 1 108 PHE H 1 108 PHE QB 3.300 . 3.300 2.302 2.056 2.963 . 0 0 "[ . 1 . 2]" 1
846 1 106 ASP QB 1 108 PHE H 5.000 . 5.000 2.488 2.218 3.180 . 0 0 "[ . 1 . 2]" 1
847 1 107 ARG QB 1 108 PHE H 4.000 . 4.000 2.892 2.299 3.569 . 0 0 "[ . 1 . 2]" 1
848 1 107 ARG QG 1 108 PHE H 5.500 . 5.500 4.151 2.264 4.723 . 0 0 "[ . 1 . 2]" 1
849 1 109 SER H 1 110 SER H 2.800 . 2.800 2.399 1.921 2.697 . 0 0 "[ . 1 . 2]" 1
850 1 108 PHE QD 1 109 SER H 6.000 . 6.000 4.418 2.889 5.005 . 0 0 "[ . 1 . 2]" 1
851 1 105 TYR QE 1 109 SER H 7.000 . 7.000 6.069 5.004 6.244 . 0 0 "[ . 1 . 2]" 1
852 1 107 ARG HA 1 109 SER H 5.000 . 5.000 4.272 3.450 5.038 0.038 12 0 "[ . 1 . 2]" 1
853 1 108 PHE QB 1 109 SER H 4.000 . 4.000 3.027 2.125 3.595 . 0 0 "[ . 1 . 2]" 1
854 1 108 PHE QD 1 110 SER H 6.000 . 6.000 4.897 2.539 5.350 . 0 0 "[ . 1 . 2]" 1
855 1 110 SER H 1 110 SER QB 3.300 . 3.300 2.401 2.075 2.843 . 0 0 "[ . 1 . 2]" 1
856 1 108 PHE QB 1 110 SER H 5.000 . 5.000 3.386 2.971 4.222 . 0 0 "[ . 1 . 2]" 1
857 1 105 TYR HA 1 111 ASN H 5.000 . 5.000 4.895 4.030 5.010 0.010 1 0 "[ . 1 . 2]" 1
858 1 110 SER HA 1 111 ASN H 2.800 . 2.800 2.450 2.147 2.761 . 0 0 "[ . 1 . 2]" 1
859 1 110 SER QB 1 111 ASN H 4.000 . 4.000 2.704 1.973 3.593 . 0 0 "[ . 1 . 2]" 1
860 1 103 TRP HE3 1 112 ASP H 5.000 . 5.000 3.903 3.138 4.438 . 0 0 "[ . 1 . 2]" 1
861 1 105 TYR HA 1 112 ASP H 5.000 . 5.000 3.334 2.438 3.733 . 0 0 "[ . 1 . 2]" 1
862 1 111 ASN HA 1 112 ASP H 2.800 . 2.800 2.248 2.144 2.586 . 0 0 "[ . 1 . 2]" 1
863 1 106 ASP QB 1 112 ASP H 5.500 . 5.500 4.165 3.480 4.906 . 0 0 "[ . 1 . 2]" 1
864 1 104 ASP H 1 113 PHE H 5.000 . 5.000 4.781 4.644 4.923 . 0 0 "[ . 1 . 2]" 1
865 1 103 TRP HE3 1 113 PHE H 5.000 . 5.000 3.290 2.960 3.724 . 0 0 "[ . 1 . 2]" 1
866 1 103 TRP HZ3 1 113 PHE H 5.000 . 5.000 3.224 2.613 3.575 . 0 0 "[ . 1 . 2]" 1
867 1 112 ASP HA 1 113 PHE H 2.800 . 2.800 2.227 2.149 2.346 . 0 0 "[ . 1 . 2]" 1
868 1 113 PHE H 1 113 PHE QB 3.300 . 3.300 2.250 2.234 2.264 . 0 0 "[ . 1 . 2]" 1
869 1 112 ASP QB 1 113 PHE H 5.500 . 5.500 3.217 2.662 3.678 . 0 0 "[ . 1 . 2]" 1
870 1 103 TRP H 1 114 LEU H 5.000 . 5.000 5.009 4.928 5.022 0.022 17 0 "[ . 1 . 2]" 1
871 1 113 PHE QE 1 114 LEU H 6.000 . 6.000 3.610 3.526 3.790 . 0 0 "[ . 1 . 2]" 1
872 1 113 PHE QD 1 114 LEU H 4.000 . 4.000 2.746 2.622 2.988 . 0 0 "[ . 1 . 2]" 1
873 1 103 TRP HA 1 114 LEU H 3.500 . 3.500 3.185 3.106 3.241 . 0 0 "[ . 1 . 2]" 1
874 1 113 PHE HA 1 114 LEU H 2.800 . 2.800 2.332 2.285 2.364 . 0 0 "[ . 1 . 2]" 1
875 1 113 PHE QB 1 114 LEU H 4.000 . 4.000 3.412 3.372 3.456 . 0 0 "[ . 1 . 2]" 1
876 1 114 LEU H 1 114 LEU QB 3.300 . 3.300 2.604 2.546 2.656 . 0 0 "[ . 1 . 2]" 1
877 1 114 LEU H 1 114 LEU MD1 5.500 . 5.500 4.525 4.445 4.586 . 0 0 "[ . 1 . 2]" 1
878 1 116 GLU H 1 137 LYS H 2.800 . 2.800 2.034 1.953 2.633 . 0 0 "[ . 1 . 2]" 1
879 1 113 PHE HZ 1 116 GLU H 5.000 . 5.000 2.378 2.203 2.585 . 0 0 "[ . 1 . 2]" 1
880 1 113 PHE QE 1 116 GLU H 6.000 . 6.000 3.589 3.407 3.767 . 0 0 "[ . 1 . 2]" 1
881 1 116 GLU H 1 137 LYS HA 5.000 . 5.000 4.308 4.202 4.433 . 0 0 "[ . 1 . 2]" 1
882 1 115 GLY QA 1 116 GLU H 2.800 . 2.800 2.189 2.167 2.224 . 0 0 "[ . 1 . 2]" 1
883 1 116 GLU H 1 136 LEU QB 5.000 . 5.000 2.336 2.093 2.767 . 0 0 "[ . 1 . 2]" 1
884 1 116 GLU H 1 136 LEU MD2 . . 4.000 3.052 2.420 3.300 . 0 0 "[ . 1 . 2]" 1
885 1 113 PHE HZ 1 117 VAL H 6.000 . 6.000 5.644 5.466 5.716 . 0 0 "[ . 1 . 2]" 1
886 1 113 PHE QE 1 117 VAL H 7.000 . 7.000 5.301 5.082 5.489 . 0 0 "[ . 1 . 2]" 1
887 1 116 GLU HA 1 117 VAL H 2.800 . 2.800 2.152 2.141 2.166 . 0 0 "[ . 1 . 2]" 1
888 1 101 THR HA 1 117 VAL H 3.500 . 3.500 3.423 3.330 3.479 . 0 0 "[ . 1 . 2]" 1
889 1 99 GLU HA 1 117 VAL H 5.000 . 5.000 4.406 4.283 4.519 . 0 0 "[ . 1 . 2]" 1
890 1 101 THR HB 1 117 VAL H 6.000 . 6.000 5.428 5.136 5.697 . 0 0 "[ . 1 . 2]" 1
891 1 116 GLU QG 1 117 VAL H 3.300 . 3.300 2.693 2.419 2.917 . 0 0 "[ . 1 . 2]" 1
892 1 117 VAL H 1 117 VAL HB 3.500 . 3.500 2.864 2.794 2.985 . 0 0 "[ . 1 . 2]" 1
893 1 101 THR MG 1 117 VAL H 4.000 . 4.000 3.250 3.001 3.335 . 0 0 "[ . 1 . 2]" 1
894 1 117 VAL H 1 136 LEU MD2 5.500 . 5.500 3.542 3.143 3.949 . 0 0 "[ . 1 . 2]" 1
895 1 99 GLU HA 1 118 LEU H 5.000 . 5.000 4.800 4.629 4.974 . 0 0 "[ . 1 . 2]" 1
896 1 117 VAL HA 1 118 LEU H 2.800 . 2.800 2.225 2.143 2.320 . 0 0 "[ . 1 . 2]" 1
897 1 118 LEU H 1 118 LEU QB 3.300 . 3.300 2.356 2.222 2.507 . 0 0 "[ . 1 . 2]" 1
898 1 117 VAL MG1 1 118 LEU H . . 3.300 2.110 1.902 2.717 . 0 0 "[ . 1 . 2]" 1
899 1 118 LEU HA 1 119 ILE H 2.800 . 2.800 2.148 2.139 2.172 . 0 0 "[ . 1 . 2]" 1
900 1 99 GLU HA 1 119 ILE H 3.500 . 3.500 3.181 2.838 3.367 . 0 0 "[ . 1 . 2]" 1
901 1 97 THR HA 1 119 ILE H 5.000 . 5.000 4.895 4.691 5.011 0.011 13 0 "[ . 1 . 2]" 1
902 1 99 GLU QG 1 119 ILE H 5.500 . 5.500 4.554 3.794 4.893 . 0 0 "[ . 1 . 2]" 1
903 1 118 LEU QB 1 119 ILE H 4.000 . 4.000 3.407 3.244 3.567 . 0 0 "[ . 1 . 2]" 1
904 1 119 ILE H 1 119 ILE QG 3.300 . 3.300 2.887 2.714 2.943 . 0 0 "[ . 1 . 2]" 1
905 1 97 THR MG 1 119 ILE H 4.000 . 4.000 2.571 2.361 2.944 . 0 0 "[ . 1 . 2]" 1
906 1 118 LEU QD 1 119 ILE H 4.500 . 4.500 3.105 2.719 3.300 . 0 0 "[ . 1 . 2]" 1
907 1 119 ILE HA 1 120 ASP H 2.800 . 2.800 2.186 2.145 2.195 . 0 0 "[ . 1 . 2]" 1
908 1 120 ASP H 1 120 ASP QB 3.300 . 3.300 2.363 2.081 2.640 . 0 0 "[ . 1 . 2]" 1
909 1 119 ILE QG 1 120 ASP H 5.500 . 5.500 4.392 4.345 4.422 . 0 0 "[ . 1 . 2]" 1
910 1 97 THR MG 1 120 ASP H 5.500 . 5.500 2.982 2.780 3.241 . 0 0 "[ . 1 . 2]" 1
911 1 119 ILE MG 1 120 ASP H 4.000 . 4.000 3.187 2.863 3.264 . 0 0 "[ . 1 . 2]" 1
912 1 121 LEU H 1 122 SER H . . 2.800 2.591 2.532 2.687 . 0 0 "[ . 1 . 2]" 1
913 1 121 LEU H 1 123 SER H 5.000 . 5.000 4.446 4.191 4.613 . 0 0 "[ . 1 . 2]" 1
914 1 97 THR HA 1 121 LEU H 2.800 . 2.800 2.209 2.007 2.446 . 0 0 "[ . 1 . 2]" 1
915 1 120 ASP HA 1 121 LEU H 2.800 . 2.800 2.148 2.140 2.165 . 0 0 "[ . 1 . 2]" 1
916 1 120 ASP QB 1 121 LEU H . . 4.000 3.410 3.295 3.559 . 0 0 "[ . 1 . 2]" 1
917 1 121 LEU H 1 121 LEU QB 3.500 . 3.500 2.420 2.280 2.551 . 0 0 "[ . 1 . 2]" 1
918 1 121 LEU H 1 121 LEU HG 2.800 . 2.800 2.365 2.062 2.651 . 0 0 "[ . 1 . 2]" 1
919 1 98 LEU QB 1 121 LEU H 6.500 . 6.500 4.689 4.496 4.901 . 0 0 "[ . 1 . 2]" 1
920 1 97 THR MG 1 121 LEU H 5.500 . 5.500 3.458 3.189 3.656 . 0 0 "[ . 1 . 2]" 1
921 1 122 SER H 1 123 SER H 2.800 . 2.800 2.610 2.468 2.745 . 0 0 "[ . 1 . 2]" 1
922 1 120 ASP HA 1 122 SER H 5.000 . 5.000 3.481 3.387 3.692 . 0 0 "[ . 1 . 2]" 1
923 1 122 SER H 1 122 SER QB 2.800 . 2.800 2.277 2.072 2.520 . 0 0 "[ . 1 . 2]" 1
924 1 120 ASP QB 1 122 SER H 5.000 . 5.000 2.654 2.514 2.927 . 0 0 "[ . 1 . 2]" 1
925 1 121 LEU QB 1 122 SER H 4.000 . 4.000 3.251 2.931 3.448 . 0 0 "[ . 1 . 2]" 1
926 1 122 SER H 1 124 THR MG 5.500 . 5.500 4.305 3.916 4.459 . 0 0 "[ . 1 . 2]" 1
927 1 123 SER H 1 124 THR H 3.500 . 3.500 1.986 1.899 2.155 . 0 0 "[ . 1 . 2]" 1
928 1 122 SER QB 1 123 SER H 5.500 . 5.500 3.389 2.914 3.703 . 0 0 "[ . 1 . 2]" 1
929 1 121 LEU HA 1 123 SER H 3.500 . 3.500 3.470 3.235 3.520 0.020 2 0 "[ . 1 . 2]" 1
930 1 123 SER H 1 123 SER QB 3.300 . 3.300 2.664 2.594 2.718 . 0 0 "[ . 1 . 2]" 1
931 1 120 ASP QB 1 123 SER H 5.000 . 5.000 3.458 3.218 4.080 . 0 0 "[ . 1 . 2]" 1
932 1 121 LEU QB 1 123 SER H 5.500 . 5.500 4.569 4.450 4.654 . 0 0 "[ . 1 . 2]" 1
933 1 94 MET ME 1 123 SER H 5.500 . 5.500 3.560 2.930 3.885 . 0 0 "[ . 1 . 2]" 1
934 1 123 SER H 1 124 THR MG 5.500 . 5.500 3.620 2.950 3.821 . 0 0 "[ . 1 . 2]" 1
935 1 119 ILE MG 1 123 SER H 6.500 . 6.500 5.246 5.072 5.397 . 0 0 "[ . 1 . 2]" 1
936 1 123 SER QB 1 124 THR H 4.000 . 4.000 3.561 2.325 3.717 . 0 0 "[ . 1 . 2]" 1
937 1 124 THR H 1 124 THR MG 3.300 . 3.300 2.257 2.144 2.648 . 0 0 "[ . 1 . 2]" 1
938 1 126 HIS H 1 127 LEU H 2.800 . 2.800 2.633 2.228 2.741 . 0 0 "[ . 1 . 2]" 1
939 1 126 HIS H 1 126 HIS HD2 3.500 . 3.500 3.356 1.945 3.528 0.028 2 0 "[ . 1 . 2]" 1
940 1 124 THR HB 1 126 HIS H 5.000 . 5.000 4.532 3.603 4.837 . 0 0 "[ . 1 . 2]" 1
941 1 124 THR HA 1 126 HIS H 5.000 . 5.000 3.158 2.946 3.278 . 0 0 "[ . 1 . 2]" 1
942 1 125 SER QB 1 126 HIS H 4.000 . 4.000 3.302 3.121 3.570 . 0 0 "[ . 1 . 2]" 1
943 1 126 HIS H 1 126 HIS QB 2.800 . 2.800 2.510 2.430 2.544 . 0 0 "[ . 1 . 2]" 1
944 1 124 THR MG 1 126 HIS H 5.500 . 5.500 4.290 4.146 4.599 . 0 0 "[ . 1 . 2]" 1
945 1 14 ASN HA 1 127 LEU H 6.000 . 6.000 5.386 4.813 6.004 0.004 10 0 "[ . 1 . 2]" 1
946 1 125 SER HA 1 127 LEU H 5.000 . 5.000 3.358 3.254 3.752 . 0 0 "[ . 1 . 2]" 1
947 1 124 THR HA 1 127 LEU H 5.000 . 5.000 4.731 3.962 4.953 . 0 0 "[ . 1 . 2]" 1
948 1 125 SER QB 1 127 LEU H 5.500 . 5.500 4.530 4.446 4.784 . 0 0 "[ . 1 . 2]" 1
949 1 126 HIS QB 1 127 LEU H 5.000 . 5.000 3.527 3.258 3.963 . 0 0 "[ . 1 . 2]" 1
950 1 13 ILE HB 1 127 LEU H 5.000 . 5.000 3.971 3.675 4.191 . 0 0 "[ . 1 . 2]" 1
951 1 127 LEU H 1 127 LEU QB 3.300 . 3.300 2.247 2.176 2.420 . 0 0 "[ . 1 . 2]" 1
952 1 127 LEU H 1 127 LEU HG 2.800 . 2.800 2.652 2.399 2.805 0.005 14 0 "[ . 1 . 2]" 1
953 1 124 THR MG 1 127 LEU H 5.500 . 5.500 3.860 3.651 4.589 . 0 0 "[ . 1 . 2]" 1
954 1 127 LEU H 1 127 LEU MD2 5.500 . 5.500 3.686 3.188 3.902 . 0 0 "[ . 1 . 2]" 1
955 1 128 ASP H 1 129 ASN H 3.500 . 3.500 3.395 2.936 3.504 0.004 3 0 "[ . 1 . 2]" 1
956 1 128 ASP H 1 130 THR H 5.000 . 5.000 4.777 4.116 5.011 0.011 10 0 "[ . 1 . 2]" 1
957 1 127 LEU H 1 128 ASP H 3.500 . 3.500 2.876 2.615 3.586 0.086 9 0 "[ . 1 . 2]" 1
958 1 129 ASN H 1 130 THR H 3.500 . 3.500 3.231 2.895 3.447 . 0 0 "[ . 1 . 2]" 1
959 1 127 LEU H 1 129 ASN H 5.000 . 5.000 5.025 4.855 5.137 0.137 2 0 "[ . 1 . 2]" 1
960 1 14 ASN HA 1 129 ASN H 3.500 . 3.500 3.067 2.872 3.224 . 0 0 "[ . 1 . 2]" 1
961 1 129 ASN H 1 129 ASN QB 3.500 . 3.500 2.812 2.741 2.905 . 0 0 "[ . 1 . 2]" 1
962 1 128 ASP QB 1 129 ASN H 5.000 . 5.000 3.898 3.669 4.050 . 0 0 "[ . 1 . 2]" 1
963 1 14 ASN QB 1 129 ASN H 5.000 . 5.000 2.906 2.736 3.098 . 0 0 "[ . 1 . 2]" 1
964 1 12 GLN QG 1 129 ASN H 5.000 . 5.000 4.207 3.872 4.461 . 0 0 "[ . 1 . 2]" 1
965 1 13 ILE H 1 129 ASN H 5.000 . 5.000 4.905 4.514 5.016 0.016 19 0 "[ . 1 . 2]" 1
966 1 14 ASN H 1 129 ASN H 5.000 . 5.000 5.038 5.014 5.053 0.053 15 0 "[ . 1 . 2]" 1
967 1 13 ILE H 1 130 THR H 5.000 . 5.000 3.319 2.844 3.766 . 0 0 "[ . 1 . 2]" 1
968 1 130 THR H 1 131 PRO QD 5.500 . 5.500 3.960 3.752 4.259 . 0 0 "[ . 1 . 2]" 1
969 1 129 ASN QB 1 130 THR H 5.500 . 5.500 3.979 3.912 4.049 . 0 0 "[ . 1 . 2]" 1
970 1 12 GLN QG 1 130 THR H 5.000 . 5.000 2.635 2.002 2.996 . 0 0 "[ . 1 . 2]" 1
971 1 12 GLN QB 1 130 THR H 5.500 . 5.500 4.590 4.011 4.917 . 0 0 "[ . 1 . 2]" 1
972 1 130 THR H 1 130 THR MG 4.000 . 4.000 3.315 3.092 3.410 . 0 0 "[ . 1 . 2]" 1
973 1 13 ILE H 1 132 ARG H 5.000 . 5.000 4.942 4.567 5.027 0.027 11 0 "[ . 1 . 2]" 1
974 1 11 LEU H 1 132 ARG H 3.500 . 3.500 3.163 3.032 3.309 . 0 0 "[ . 1 . 2]" 1
975 1 132 ARG H 1 134 TYR QD 6.000 . 6.000 4.847 4.415 5.174 . 0 0 "[ . 1 . 2]" 1
976 1 132 ARG H 1 134 TYR QE 4.000 . 4.000 2.996 2.538 3.380 . 0 0 "[ . 1 . 2]" 1
977 1 11 LEU HA 1 132 ARG H 5.000 . 5.000 4.990 4.855 5.020 0.020 8 0 "[ . 1 . 2]" 1
978 1 10 GLN HA 1 132 ARG H 5.000 . 5.000 4.451 4.257 4.578 . 0 0 "[ . 1 . 2]" 1
979 1 131 PRO HA 1 132 ARG H 2.800 . 2.800 2.199 2.156 2.302 . 0 0 "[ . 1 . 2]" 1
980 1 132 ARG H 1 132 ARG QD 5.500 . 5.500 4.425 3.844 4.867 . 0 0 "[ . 1 . 2]" 1
981 1 12 GLN QG 1 132 ARG H 5.500 . 5.500 4.604 3.983 4.903 . 0 0 "[ . 1 . 2]" 1
982 1 11 LEU QB 1 132 ARG H 5.500 . 5.500 4.784 4.618 4.911 . 0 0 "[ . 1 . 2]" 1
983 1 132 ARG H 1 132 ARG QB 3.300 . 3.300 2.663 2.398 2.965 . 0 0 "[ . 1 . 2]" 1
984 1 132 ARG H 1 132 ARG QG 4.000 . 4.000 2.957 2.228 3.580 . 0 0 "[ . 1 . 2]" 1
985 1 25 LEU MD1 1 132 ARG H 5.500 . 5.500 4.184 3.864 4.498 . 0 0 "[ . 1 . 2]" 1
986 1 10 GLN QG 1 132 ARG H 5.500 . 5.500 3.489 3.152 3.818 . 0 0 "[ . 1 . 2]" 1
987 1 133 TRP H 1 133 TRP HD1 3.500 . 3.500 2.670 2.311 2.833 . 0 0 "[ . 1 . 2]" 1
988 1 133 TRP H 1 134 TYR QE 6.000 . 6.000 5.009 4.648 5.366 . 0 0 "[ . 1 . 2]" 1
989 1 132 ARG HA 1 133 TRP H 2.800 . 2.800 2.373 2.235 2.509 . 0 0 "[ . 1 . 2]" 1
990 1 133 TRP H 1 133 TRP QB 3.300 . 3.300 2.398 2.336 2.503 . 0 0 "[ . 1 . 2]" 1
991 1 132 ARG QD 1 133 TRP H 5.500 . 5.500 3.559 2.595 4.664 . 0 0 "[ . 1 . 2]" 1
992 1 132 ARG QG 1 133 TRP H 5.000 . 5.000 3.864 3.125 4.442 . 0 0 "[ . 1 . 2]" 1
993 1 132 ARG QB 1 133 TRP H 4.000 . 4.000 2.521 2.278 2.896 . 0 0 "[ . 1 . 2]" 1
994 1 10 GLN QG 1 133 TRP H 5.500 . 5.500 3.561 3.056 3.849 . 0 0 "[ . 1 . 2]" 1
995 1 133 TRP HE3 1 134 TYR H 5.000 . 5.000 3.756 3.118 4.462 . 0 0 "[ . 1 . 2]" 1
996 1 134 TYR H 1 134 TYR QD 3.300 . 3.300 2.316 1.981 2.845 . 0 0 "[ . 1 . 2]" 1
997 1 8 GLU HA 1 134 TYR H 5.000 . 5.000 4.798 4.378 5.010 0.010 18 0 "[ . 1 . 2]" 1
998 1 133 TRP HA 1 134 TYR H 2.800 . 2.800 2.196 2.139 2.340 . 0 0 "[ . 1 . 2]" 1
999 1 134 TYR H 1 135 PRO QD 5.500 . 5.500 4.178 3.909 4.371 . 0 0 "[ . 1 . 2]" 1
1000 1 8 GLU QB 1 134 TYR H 5.000 . 5.000 3.179 2.640 3.753 . 0 0 "[ . 1 . 2]" 1
1001 1 117 VAL MG2 1 134 TYR H 5.500 . 5.500 4.485 4.263 4.572 . 0 0 "[ . 1 . 2]" 1
1002 1 9 ILE MG 1 134 TYR H 5.500 . 5.500 2.916 2.712 3.292 . 0 0 "[ . 1 . 2]" 1
1003 1 10 GLN QG 1 134 TYR H 5.500 . 5.500 4.511 3.759 4.827 . 0 0 "[ . 1 . 2]" 1
1004 1 8 GLU HA 1 136 LEU H 2.800 . 2.800 2.307 1.987 2.582 . 0 0 "[ . 1 . 2]" 1
1005 1 135 PRO HA 1 136 LEU H 2.800 . 2.800 2.150 2.137 2.173 . 0 0 "[ . 1 . 2]" 1
1006 1 7 GLY HA2 1 136 LEU H 6.500 . 6.500 5.336 5.175 5.436 . 0 0 "[ . 1 . 2]" 1
1007 1 8 GLU QG 1 136 LEU H . . 4.000 2.979 2.726 3.250 . 0 0 "[ . 1 . 2]" 1
1008 1 136 LEU H 1 136 LEU HG 3.500 . 3.500 2.309 2.059 2.951 . 0 0 "[ . 1 . 2]" 1
1009 1 136 LEU H 1 136 LEU MD2 5.500 . 5.500 3.768 3.615 4.135 . 0 0 "[ . 1 . 2]" 1
1010 1 113 PHE HZ 1 137 LYS H 5.000 . 5.000 3.965 3.776 4.539 . 0 0 "[ . 1 . 2]" 1
1011 1 117 VAL HA 1 137 LYS H 5.000 . 5.000 3.713 3.272 3.985 . 0 0 "[ . 1 . 2]" 1
1012 1 136 LEU HA 1 137 LYS H 2.800 . 2.800 2.263 2.148 2.326 . 0 0 "[ . 1 . 2]" 1
1013 1 115 GLY QA 1 137 LYS H 5.500 . 5.500 3.656 3.537 4.226 . 0 0 "[ . 1 . 2]" 1
1014 1 137 LYS H 1 137 LYS QB 3.300 . 3.300 2.723 2.297 2.947 . 0 0 "[ . 1 . 2]" 1
1015 1 137 LYS H 1 137 LYS QD 5.500 . 5.500 4.019 3.138 4.909 . 0 0 "[ . 1 . 2]" 1
1016 1 137 LYS H 1 137 LYS QG 4.000 . 4.000 2.637 1.998 3.485 . 0 0 "[ . 1 . 2]" 1
1017 1 136 LEU QB 1 137 LYS H 4.000 . 4.000 2.763 2.555 3.356 . 0 0 "[ . 1 . 2]" 1
1018 1 5 ILE MG 1 137 LYS H 5.500 . 5.500 4.030 3.893 4.460 . 0 0 "[ . 1 . 2]" 1
1019 1 117 VAL MG2 1 137 LYS H 5.500 . 5.500 3.281 2.986 3.530 . 0 0 "[ . 1 . 2]" 1
1020 1 136 LEU MD2 1 137 LYS H 5.500 . 5.500 3.673 3.077 4.005 . 0 0 "[ . 1 . 2]" 1
1021 1 113 PHE HZ 1 138 GLU H 5.000 . 5.000 5.015 5.000 5.032 0.032 7 0 "[ . 1 . 2]" 1
1022 1 113 PHE QE 1 138 GLU H 6.000 . 6.000 4.680 4.569 4.828 . 0 0 "[ . 1 . 2]" 1
1023 1 137 LYS HA 1 138 GLU H 2.800 . 2.800 2.585 2.410 2.672 . 0 0 "[ . 1 . 2]" 1
1024 1 137 LYS QE 1 138 GLU H 5.500 . 5.500 4.507 3.643 4.901 . 0 0 "[ . 1 . 2]" 1
1025 1 138 GLU H 1 138 GLU QG 3.300 . 3.300 2.459 2.142 2.813 . 0 0 "[ . 1 . 2]" 1
1026 1 137 LYS QD 1 138 GLU H 5.500 . 5.500 3.983 2.582 4.863 . 0 0 "[ . 1 . 2]" 1
1027 1 137 LYS QG 1 138 GLU H 4.000 . 4.000 3.218 2.717 3.575 . 0 0 "[ . 1 . 2]" 1
1028 1 138 GLU H 1 138 GLU QB 3.300 . 3.300 2.572 2.418 2.681 . 0 0 "[ . 1 . 2]" 1
1029 1 5 ILE MG 1 138 GLU H 5.500 . 5.500 4.100 3.862 4.487 . 0 0 "[ . 1 . 2]" 1
1030 1 113 PHE HZ 1 139 GLN H 5.000 . 5.000 3.935 3.170 4.515 . 0 0 "[ . 1 . 2]" 1
1031 1 113 PHE QE 1 139 GLN H 4.000 . 4.000 2.655 2.119 3.107 . 0 0 "[ . 1 . 2]" 1
1032 1 113 PHE QD 1 139 GLN H 6.000 . 6.000 3.450 3.030 3.814 . 0 0 "[ . 1 . 2]" 1
1033 1 138 GLU HA 1 139 GLN H 2.800 . 2.800 2.317 2.200 2.473 . 0 0 "[ . 1 . 2]" 1
1034 1 138 GLU QG 1 139 GLN H 5.500 . 5.500 4.121 3.826 4.342 . 0 0 "[ . 1 . 2]" 1
1035 1 138 GLU QB 1 139 GLN H 3.300 . 3.300 2.633 2.291 2.946 . 0 0 "[ . 1 . 2]" 1
1036 1 139 GLN H 1 139 GLN QG 4.000 . 4.000 2.794 2.049 3.566 . 0 0 "[ . 1 . 2]" 1
1037 1 139 GLN H 1 139 GLN QB 2.800 . 2.800 2.305 2.041 2.516 . 0 0 "[ . 1 . 2]" 1
1038 1 5 ILE MD 1 139 GLN H 5.500 . 5.500 4.291 3.879 4.583 . 0 0 "[ . 1 . 2]" 1
1039 1 139 GLN HA 1 140 THR H 2.800 . 2.800 2.235 2.139 2.459 . 0 0 "[ . 1 . 2]" 1
1040 1 140 THR H 1 140 THR HB 2.800 . 2.800 2.650 2.384 2.801 0.001 10 0 "[ . 1 . 2]" 1
1041 1 139 GLN QG 1 140 THR H 5.500 . 5.500 3.821 2.483 4.470 . 0 0 "[ . 1 . 2]" 1
1042 1 139 GLN QB 1 140 THR H 5.500 . 5.500 3.243 2.432 3.773 . 0 0 "[ . 1 . 2]" 1
1043 1 140 THR HA 1 141 GLU H 2.800 . 2.800 2.189 2.139 2.293 . 0 0 "[ . 1 . 2]" 1
1044 1 141 GLU H 1 141 GLU QB 3.300 . 3.300 2.425 2.219 2.935 . 0 0 "[ . 1 . 2]" 1
1045 1 140 THR MG 1 141 GLU H 4.000 . 4.000 2.834 2.023 3.347 . 0 0 "[ . 1 . 2]" 1
1046 1 141 GLU HA 1 142 SER H 2.800 . 2.800 2.194 2.139 2.352 . 0 0 "[ . 1 . 2]" 1
1047 1 142 SER H 1 142 SER QB 3.300 . 3.300 2.697 2.181 2.944 . 0 0 "[ . 1 . 2]" 1
1048 1 141 GLU QG 1 142 SER H 5.500 . 5.500 3.919 2.824 4.429 . 0 0 "[ . 1 . 2]" 1
1049 1 141 GLU QB 1 142 SER H 5.000 . 5.000 3.685 3.106 3.975 . 0 0 "[ . 1 . 2]" 1
1050 1 140 THR MG 1 142 SER H 5.500 . 5.500 4.094 3.052 4.539 . 0 0 "[ . 1 . 2]" 1
1051 1 103 TRP HE1 1 113 PHE QD 6.000 . 6.000 3.928 3.167 4.408 . 0 0 "[ . 1 . 2]" 1
1052 1 101 THR HA 1 103 TRP HE1 5.000 . 5.000 4.273 4.161 4.448 . 0 0 "[ . 1 . 2]" 1
1053 1 101 THR HB 1 103 TRP HE1 2.800 . 2.800 2.063 1.926 2.316 . 0 0 "[ . 1 . 2]" 1
1054 1 44 LYS QB 1 103 TRP HE1 4.000 . 4.000 2.510 1.980 3.389 . 0 0 "[ . 1 . 2]" 1
1055 1 44 LYS QD 1 103 TRP HE1 4.000 . 4.000 3.233 2.910 3.569 . 0 0 "[ . 1 . 2]" 1
1056 1 101 THR MG 1 103 TRP HE1 4.000 . 4.000 3.215 2.897 3.342 . 0 0 "[ . 1 . 2]" 1
1057 1 44 LYS QE 1 103 TRP HE1 5.500 . 5.500 4.172 3.315 4.708 . 0 0 "[ . 1 . 2]" 1
1058 1 42 PHE H 1 79 TRP HE1 5.000 . 5.000 4.315 4.133 4.517 . 0 0 "[ . 1 . 2]" 1
1059 1 42 PHE HA 1 79 TRP HE1 3.500 . 3.500 2.426 2.194 2.709 . 0 0 "[ . 1 . 2]" 1
1060 1 42 PHE QB 1 79 TRP HE1 5.500 . 5.500 4.157 3.962 4.365 . 0 0 "[ . 1 . 2]" 1
1061 1 41 PRO QB 1 79 TRP HE1 5.000 . 5.000 3.524 3.065 3.970 . 0 0 "[ . 1 . 2]" 1
1062 1 41 PRO QG 1 79 TRP HE1 5.500 . 5.500 4.195 2.727 4.925 . 0 0 "[ . 1 . 2]" 1
1063 1 79 TRP HE1 1 102 VAL MG1 5.500 . 5.500 4.230 3.941 4.482 . 0 0 "[ . 1 . 2]" 1
1064 1 77 PRO QG 1 79 TRP HE1 5.500 . 5.500 4.320 4.109 4.605 . 0 0 "[ . 1 . 2]" 1
1065 1 57 VAL QG 1 79 TRP HE1 6.000 . 6.000 4.431 4.152 4.465 . 0 0 "[ . 1 . 2]" 1
1066 1 43 VAL MG2 1 79 TRP HE1 5.500 . 5.500 3.507 3.114 3.786 . 0 0 "[ . 1 . 2]" 1
1067 1 133 TRP H 1 133 TRP HE1 5.000 . 5.000 4.928 4.499 5.011 0.011 9 0 "[ . 1 . 2]" 1
1068 1 10 GLN QE 1 133 TRP HE1 3.500 . 3.500 2.559 2.116 3.116 . 0 0 "[ . 1 . 2]" 1
1069 1 10 GLN QG 1 133 TRP HE1 5.000 . 5.000 3.345 3.026 3.986 . 0 0 "[ . 1 . 2]" 1
1070 1 10 GLN QB 1 133 TRP HE1 5.500 . 5.500 4.577 4.308 4.902 . 0 0 "[ . 1 . 2]" 1
1071 1 28 ARG HA 1 28 ARG HE 5.000 . 5.000 4.699 4.338 5.007 0.007 6 0 "[ . 1 . 2]" 1
1072 1 12 GLN QE 1 129 ASN QD 4.000 . 4.000 2.467 1.925 3.176 . 0 0 "[ . 1 . 2]" 1
1073 1 10 GLN QE 1 133 TRP HZ2 5.000 . 5.000 3.497 2.868 4.304 . 0 0 "[ . 1 . 2]" 1
1074 1 10 GLN QE 1 131 PRO QB . . 4.500 2.991 1.983 3.471 . 0 0 "[ . 1 . 2]" 1
1075 1 17 LEU QB 1 19 ASN QD 4.000 . 4.000 2.773 2.428 3.043 . 0 0 "[ . 1 . 2]" 1
1076 1 17 LEU QD 1 19 ASN QD 6.500 . 6.500 3.559 3.218 4.154 . 0 0 "[ . 1 . 2]" 1
1077 1 19 ASN QD 1 84 ILE MG 6.000 . 6.000 3.103 2.873 3.280 . 0 0 "[ . 1 . 2]" 1
1078 1 29 ASN H 1 76 ASN H 6.000 . 6.000 5.599 5.254 5.938 . 0 0 "[ . 1 . 2]" 1
1079 1 29 ASN H 1 76 ASN QD 5.500 . 5.500 3.655 3.135 4.102 . 0 0 "[ . 1 . 2]" 1
1080 1 12 GLN QE 1 129 ASN HA 5.000 . 5.000 3.404 2.156 4.458 . 0 0 "[ . 1 . 2]" 1
1081 1 9 ILE QG 1 26 GLN H 6.500 . 6.500 4.072 3.512 5.352 . 0 0 "[ . 1 . 2]" 1
1082 1 80 ASN HA 1 80 ASN QD 4.000 . 4.000 3.068 2.065 3.564 . 0 0 "[ . 1 . 2]" 1
1083 1 78 GLU QG 1 80 ASN QD . . 4.500 3.151 2.676 3.574 . 0 0 "[ . 1 . 2]" 1
1084 1 78 GLU QB 1 80 ASN QD 4.000 . 4.000 2.440 1.956 2.919 . 0 0 "[ . 1 . 2]" 1
1085 1 14 ASN QD 1 16 ASP QB 4.000 . 4.000 2.841 2.427 3.173 . 0 0 "[ . 1 . 2]" 1
1086 1 14 ASN QD 1 21 ILE HB 5.000 . 5.000 3.466 3.115 3.839 . 0 0 "[ . 1 . 2]" 1
1087 1 14 ASN QD 1 21 ILE MD 4.000 . 4.000 2.514 2.085 2.908 . 0 0 "[ . 1 . 2]" 1
1088 1 57 VAL QG 1 81 GLN QE 6.000 . 6.000 3.715 3.351 3.969 . 0 0 "[ . 1 . 2]" 1
1089 1 60 ALA MB 1 81 GLN QE 4.000 . 4.000 2.748 2.393 2.973 . 0 0 "[ . 1 . 2]" 1
1090 1 39 SER HA 1 40 ASP H 2.800 . 2.800 2.218 2.142 2.321 . 0 0 "[ . 1 . 2]" 1
1091 1 119 ILE H 1 119 ILE HB 2.800 . 2.800 2.709 2.609 2.796 . 0 0 "[ . 1 . 2]" 1
1092 1 43 VAL MG2 1 79 TRP HZ2 5.500 . 5.500 2.803 2.528 3.041 . 0 0 "[ . 1 . 2]" 1
1093 1 43 VAL MG2 1 79 TRP HH2 4.000 . 4.000 3.085 2.880 3.332 . 0 0 "[ . 1 . 2]" 1
1094 1 42 PHE HA 1 43 VAL MG2 5.500 . 5.500 3.392 3.233 3.522 . 0 0 "[ . 1 . 2]" 1
1095 1 43 VAL HA 1 43 VAL MG2 3.300 . 3.300 2.384 2.251 2.465 . 0 0 "[ . 1 . 2]" 1
1096 1 43 VAL MG2 1 102 VAL HA 4.000 . 4.000 2.722 2.580 2.863 . 0 0 "[ . 1 . 2]" 1
1097 1 24 ILE HB 1 43 VAL MG2 5.500 . 5.500 4.143 3.813 4.612 . 0 0 "[ . 1 . 2]" 1
1098 1 43 VAL MG2 1 57 VAL HB 5.500 . 5.500 3.690 3.434 3.963 . 0 0 "[ . 1 . 2]" 1
1099 1 43 VAL MG2 1 102 VAL HB 5.500 . 5.500 4.423 4.276 4.547 . 0 0 "[ . 1 . 2]" 1
1100 1 43 VAL MG2 1 102 VAL MG1 6.000 . 6.000 2.304 2.156 2.454 . 0 0 "[ . 1 . 2]" 1
1101 1 43 VAL MG1 1 45 VAL H 5.500 . 5.500 3.587 3.365 3.869 . 0 0 "[ . 1 . 2]" 1
1102 1 43 VAL MG1 1 103 TRP HD1 5.500 . 5.500 4.353 4.076 4.582 . 0 0 "[ . 1 . 2]" 1
1103 1 43 VAL HA 1 43 VAL MG1 3.300 . 3.300 2.419 2.337 2.479 . 0 0 "[ . 1 . 2]" 1
1104 1 43 VAL MG1 1 100 VAL HA 5.500 . 5.500 3.260 3.031 3.448 . 0 0 "[ . 1 . 2]" 1
1105 1 43 VAL MG1 1 102 VAL HA 5.500 . 5.500 3.260 2.920 3.524 . 0 0 "[ . 1 . 2]" 1
1106 1 43 VAL MG1 1 45 VAL HB 5.500 . 5.500 3.915 3.760 4.080 . 0 0 "[ . 1 . 2]" 1
1107 1 47 LEU MD1 1 99 GLU H 5.500 . 5.500 3.799 3.426 3.916 . 0 0 "[ . 1 . 2]" 1
1108 1 47 LEU MD1 1 48 LEU H 5.500 . 5.500 2.142 1.946 2.481 . 0 0 "[ . 1 . 2]" 1
1109 1 47 LEU MD1 1 97 THR H 5.500 . 5.500 2.053 1.873 2.305 . 0 0 "[ . 1 . 2]" 1
1110 1 47 LEU MD1 1 85 TYR QD 6.500 . 6.500 4.781 4.576 4.846 . 0 0 "[ . 1 . 2]" 1
1111 1 47 LEU MD1 1 85 TYR QE 6.500 . 6.500 4.628 4.249 4.823 . 0 0 "[ . 1 . 2]" 1
1112 1 47 LEU HA 1 47 LEU MD1 3.300 . 3.300 1.875 1.778 1.924 0.022 5 0 "[ . 1 . 2]" 1
1113 1 47 LEU MD1 1 96 LYS QB 4.500 . 4.500 1.787 1.701 2.070 0.099 10 0 "[ . 1 . 2]" 1
1114 1 47 LEU MD1 1 96 LYS QG 6.000 . 6.000 3.534 3.406 3.627 . 0 0 "[ . 1 . 2]" 1
1115 1 47 LEU MD1 1 96 LYS QD 4.500 . 4.500 3.187 1.750 3.361 0.050 5 0 "[ . 1 . 2]" 1
1116 1 47 LEU H 1 47 LEU MD1 5.500 . 5.500 3.944 3.809 4.052 . 0 0 "[ . 1 . 2]" 1
1117 1 47 LEU MD1 1 96 LYS HA 5.500 . 5.500 3.186 2.993 3.441 . 0 0 "[ . 1 . 2]" 1
1118 1 47 LEU QB 1 85 TYR QE 6.500 . 6.500 4.553 2.492 5.161 . 0 0 "[ . 1 . 2]" 1
1119 1 47 LEU MD2 1 98 LEU H 5.500 . 5.500 4.591 4.581 4.607 . 0 0 "[ . 1 . 2]" 1
1120 1 47 LEU H 1 47 LEU MD2 5.500 . 5.500 2.967 2.683 3.365 . 0 0 "[ . 1 . 2]" 1
1121 1 47 LEU MD2 1 85 TYR QD 6.500 . 6.500 2.503 2.147 2.745 . 0 0 "[ . 1 . 2]" 1
1122 1 47 LEU MD2 1 85 TYR QE 6.500 . 6.500 2.809 2.164 3.035 . 0 0 "[ . 1 . 2]" 1
1123 1 47 LEU MD2 1 98 LEU HA 4.000 . 4.000 3.314 3.192 3.354 . 0 0 "[ . 1 . 2]" 1
1124 1 47 LEU MD2 1 85 TYR QB 6.000 . 6.000 3.287 3.099 3.459 . 0 0 "[ . 1 . 2]" 1
1125 1 47 LEU MD2 1 96 LYS QB 4.500 . 4.500 3.199 3.006 3.368 . 0 0 "[ . 1 . 2]" 1
1126 1 47 LEU MD2 1 88 ILE QG 6.000 . 6.000 4.451 4.359 4.466 . 0 0 "[ . 1 . 2]" 1
1127 1 47 LEU MD2 1 96 LYS QG 6.000 . 6.000 4.218 3.704 4.398 . 0 0 "[ . 1 . 2]" 1
1128 1 48 LEU MD1 1 97 THR HB 4.000 . 4.000 2.009 1.915 2.550 . 0 0 "[ . 1 . 2]" 1
1129 1 48 LEU MD1 1 99 GLU QB 6.000 . 6.000 3.938 2.211 4.453 . 0 0 "[ . 1 . 2]" 1
1130 1 48 LEU MD1 1 97 THR MG 6.000 . 6.000 2.513 2.144 2.912 . 0 0 "[ . 1 . 2]" 1
1131 1 3 HIS HE1 1 114 LEU MD2 5.500 . 5.500 3.569 2.374 4.580 . 0 0 "[ . 1 . 2]" 1
1132 1 46 TYR QE 1 54 VAL MG2 4.500 . 4.500 2.811 2.489 3.014 . 0 0 "[ . 1 . 2]" 1
1133 1 114 LEU HA 1 114 LEU MD2 4.000 . 4.000 2.200 1.921 2.911 . 0 0 "[ . 1 . 2]" 1
1134 1 44 LYS QB 1 54 VAL MG2 . . 5.500 1.891 1.858 1.925 . 0 0 "[ . 1 . 2]" 1
1135 1 46 TYR QE 1 54 VAL MG1 6.500 . 6.500 4.651 4.422 4.801 . 0 0 "[ . 1 . 2]" 1
1136 1 44 LYS HA 1 56 VAL MG2 4.000 . 4.000 3.332 3.252 3.355 . 0 0 "[ . 1 . 2]" 1
1137 1 56 VAL HA 1 56 VAL MG2 3.300 . 3.300 2.358 2.300 2.473 . 0 0 "[ . 1 . 2]" 1
1138 1 44 LYS QE 1 56 VAL MG2 6.000 . 6.000 2.746 2.313 3.115 . 0 0 "[ . 1 . 2]" 1
1139 1 44 LYS QD 1 56 VAL MG2 4.500 . 4.500 2.930 2.471 3.033 . 0 0 "[ . 1 . 2]" 1
1140 1 44 LYS QG 1 56 VAL MG2 4.500 . 4.500 2.027 1.889 2.769 . 0 0 "[ . 1 . 2]" 1
1141 1 54 VAL MG2 1 56 VAL MG2 4.500 . 4.500 2.665 2.415 3.015 . 0 0 "[ . 1 . 2]" 1
1142 1 56 VAL MG1 1 57 VAL H 4.000 . 4.000 1.982 1.900 2.242 . 0 0 "[ . 1 . 2]" 1
1143 1 42 PHE QD 1 56 VAL MG1 4.500 . 4.500 2.368 1.936 2.812 . 0 0 "[ . 1 . 2]" 1
1144 1 44 LYS HA 1 56 VAL MG1 5.500 . 5.500 3.749 3.587 4.029 . 0 0 "[ . 1 . 2]" 1
1145 1 56 VAL HA 1 56 VAL MG1 3.300 . 3.300 2.313 2.214 2.405 . 0 0 "[ . 1 . 2]" 1
1146 1 42 PHE QB 1 56 VAL MG1 6.000 . 6.000 2.520 2.308 2.843 . 0 0 "[ . 1 . 2]" 1
1147 1 44 LYS QD 1 56 VAL MG1 6.000 . 6.000 4.390 4.009 4.457 . 0 0 "[ . 1 . 2]" 1
1148 1 44 LYS QG 1 56 VAL MG1 6.000 . 6.000 2.848 2.718 2.981 . 0 0 "[ . 1 . 2]" 1
1149 1 45 VAL HB 1 57 VAL MG2 5.500 . 5.500 4.169 3.834 4.527 . 0 0 "[ . 1 . 2]" 1
1150 1 43 VAL HB 1 57 VAL MG2 3.300 . 3.300 1.825 1.762 1.890 0.038 18 0 "[ . 1 . 2]" 1
1151 1 43 VAL MG2 1 57 VAL MG2 6.000 . 6.000 3.026 2.890 3.125 . 0 0 "[ . 1 . 2]" 1
1152 1 5 ILE MD 1 6 THR H 5.500 . 5.500 3.870 3.711 3.947 . 0 0 "[ . 1 . 2]" 1
1153 1 5 ILE MD 1 113 PHE QE 4.500 . 4.500 2.727 2.487 2.995 . 0 0 "[ . 1 . 2]" 1
1154 1 5 ILE MD 1 113 PHE QD 4.500 . 4.500 1.991 1.875 2.375 . 0 0 "[ . 1 . 2]" 1
1155 1 5 ILE MD 1 114 LEU HA 4.000 . 4.000 2.405 2.298 2.578 . 0 0 "[ . 1 . 2]" 1
1156 1 9 ILE MD 1 79 TRP HE3 5.500 . 5.500 3.628 3.227 3.995 . 0 0 "[ . 1 . 2]" 1
1157 1 9 ILE MD 1 79 TRP HZ3 5.500 . 5.500 2.161 1.830 2.504 . 0 0 "[ . 1 . 2]" 1
1158 1 9 ILE MD 1 79 TRP HH2 4.000 . 4.000 2.279 1.896 3.123 . 0 0 "[ . 1 . 2]" 1
1159 1 9 ILE HA 1 9 ILE MD 4.000 . 4.000 3.067 2.510 3.334 . 0 0 "[ . 1 . 2]" 1
1160 1 9 ILE MD 1 43 VAL MG2 4.500 . 4.500 2.182 1.899 2.621 . 0 0 "[ . 1 . 2]" 1
1161 1 9 ILE MG 1 134 TYR QB 4.500 . 4.500 2.025 1.844 2.155 . 0 0 "[ . 1 . 2]" 1
1162 1 9 ILE MG 1 136 LEU MD2 4.500 . 4.500 2.133 1.894 2.885 . 0 0 "[ . 1 . 2]" 1
1163 1 17 LEU H 1 17 LEU MD2 4.000 . 4.000 2.708 2.058 3.283 . 0 0 "[ . 1 . 2]" 1
1164 1 17 LEU HA 1 17 LEU MD2 3.300 . 3.300 2.128 1.938 2.465 . 0 0 "[ . 1 . 2]" 1
1165 1 21 ILE MG 1 23 HIS HE1 5.500 . 5.500 3.295 2.945 4.113 . 0 0 "[ . 1 . 2]" 1
1166 1 21 ILE MG 1 23 HIS HD2 5.500 . 5.500 2.759 2.124 3.190 . 0 0 "[ . 1 . 2]" 1
1167 1 21 ILE MG 1 84 ILE HA 5.500 . 5.500 3.361 3.262 3.479 . 0 0 "[ . 1 . 2]" 1
1168 1 21 ILE HA 1 21 ILE MG 3.300 . 3.300 2.285 2.207 2.396 . 0 0 "[ . 1 . 2]" 1
1169 1 21 ILE MG 1 82 THR HB 5.500 . 5.500 4.348 3.975 4.588 . 0 0 "[ . 1 . 2]" 1
1170 1 14 ASN QB 1 21 ILE MG 5.500 . 5.500 3.408 3.267 3.654 . 0 0 "[ . 1 . 2]" 1
1171 1 21 ILE MG 1 84 ILE MD 4.500 . 4.500 2.561 1.724 2.994 0.076 13 0 "[ . 1 . 2]" 1
1172 1 13 ILE HA 1 22 ILE MG 5.500 . 5.500 3.331 3.091 3.529 . 0 0 "[ . 1 . 2]" 1
1173 1 13 ILE QG 1 22 ILE MG 6.000 . 6.000 3.620 3.397 3.749 . 0 0 "[ . 1 . 2]" 1
1174 1 22 ILE MD 1 85 TYR QE 4.500 . 4.500 2.188 1.867 2.635 . 0 0 "[ . 1 . 2]" 1
1175 1 13 ILE HA 1 22 ILE MD 5.500 . 5.500 4.580 4.541 4.593 . 0 0 "[ . 1 . 2]" 1
1176 1 47 LEU QD 1 88 ILE MG 6.500 . 6.500 3.617 3.192 3.966 . 0 0 "[ . 1 . 2]" 1
1177 1 24 ILE MG 1 79 TRP HE3 4.000 . 4.000 2.037 1.949 2.244 . 0 0 "[ . 1 . 2]" 1
1178 1 24 ILE MG 1 79 TRP HZ3 5.500 . 5.500 2.859 2.513 3.505 . 0 0 "[ . 1 . 2]" 1
1179 1 24 ILE MG 1 26 GLN HA 5.500 . 5.500 4.087 3.914 4.354 . 0 0 "[ . 1 . 2]" 1
1180 1 24 ILE MG 1 79 TRP QB 5.500 . 5.500 2.615 2.170 2.929 . 0 0 "[ . 1 . 2]" 1
1181 1 11 LEU MD2 1 24 ILE MG 4.500 . 4.500 2.206 1.926 2.499 . 0 0 "[ . 1 . 2]" 1
1182 1 24 ILE MG 1 43 VAL MG2 4.500 . 4.500 2.026 1.795 2.413 0.005 12 0 "[ . 1 . 2]" 1
1183 1 24 ILE MD 1 45 VAL HB 4.000 . 4.000 3.331 3.279 3.343 . 0 0 "[ . 1 . 2]" 1
1184 1 24 ILE MD 1 43 VAL MG2 6.000 . 6.000 4.128 3.936 4.181 . 0 0 "[ . 1 . 2]" 1
1185 1 11 LEU HA 1 25 LEU MD1 . . 4.000 2.724 2.490 2.877 . 0 0 "[ . 1 . 2]" 1
1186 1 12 GLN HA 1 25 LEU MD1 5.500 . 5.500 4.022 3.789 4.333 . 0 0 "[ . 1 . 2]" 1
1187 1 23 HIS QB 1 25 LEU MD1 5.500 . 5.500 3.853 3.666 4.045 . 0 0 "[ . 1 . 2]" 1
1188 1 93 LEU HA 1 93 LEU MD1 4.000 . 4.000 2.663 1.952 3.188 . 0 0 "[ . 1 . 2]" 1
1189 1 90 MET QG 1 93 LEU MD1 6.000 . 6.000 4.326 3.888 4.480 . 0 0 "[ . 1 . 2]" 1
1190 1 12 GLN QG 1 25 LEU MD1 6.000 . 6.000 4.028 3.517 4.456 . 0 0 "[ . 1 . 2]" 1
1191 1 10 GLN QG 1 25 LEU MD1 4.500 . 4.500 2.885 2.642 3.100 . 0 0 "[ . 1 . 2]" 1
1192 1 10 GLN QB 1 25 LEU MD1 6.000 . 6.000 2.814 2.466 3.019 . 0 0 "[ . 1 . 2]" 1
1193 1 25 LEU MD2 1 79 TRP H 5.500 . 5.500 4.578 4.510 4.620 . 0 0 "[ . 1 . 2]" 1
1194 1 25 LEU H 1 25 LEU MD2 5.500 . 5.500 3.943 3.825 4.019 . 0 0 "[ . 1 . 2]" 1
1195 1 11 LEU HA 1 25 LEU MD2 5.500 . 5.500 4.433 3.920 4.590 . 0 0 "[ . 1 . 2]" 1
1196 1 25 LEU MD2 1 80 ASN HA 5.500 . 5.500 2.179 2.026 2.327 . 0 0 "[ . 1 . 2]" 1
1197 1 23 HIS QB 1 25 LEU MD2 5.500 . 5.500 3.629 3.153 3.831 . 0 0 "[ . 1 . 2]" 1
1198 1 25 LEU MD2 1 80 ASN QB 6.000 . 6.000 3.396 3.082 3.763 . 0 0 "[ . 1 . 2]" 1
1199 1 3 HIS HE1 1 31 VAL MG1 5.500 . 5.500 3.504 2.448 4.582 . 0 0 "[ . 1 . 2]" 1
1200 1 5 ILE HA 1 31 VAL MG1 5.500 . 5.500 3.470 3.103 3.891 . 0 0 "[ . 1 . 2]" 1
1201 1 31 VAL MG1 1 32 PRO QD 6.000 . 6.000 4.047 3.938 4.085 . 0 0 "[ . 1 . 2]" 1
1202 1 3 HIS QB 1 31 VAL MG1 6.000 . 6.000 3.254 2.498 4.458 . 0 0 "[ . 1 . 2]" 1
1203 1 31 VAL MG1 1 114 LEU MD2 4.500 . 4.500 1.778 1.670 1.946 0.130 8 0 "[ . 1 . 2]" 1
1204 1 8 GLU H 1 27 ALA MB 5.500 . 5.500 3.839 3.654 3.961 . 0 0 "[ . 1 . 2]" 1
1205 1 27 ALA MB 1 79 TRP HZ2 5.000 . 5.000 3.682 3.429 4.023 . 0 0 "[ . 1 . 2]" 1
1206 1 27 ALA MB 1 79 TRP HH2 3.300 . 3.300 2.062 1.814 2.410 . 0 0 "[ . 1 . 2]" 1
1207 1 9 ILE HA 1 27 ALA MB 4.000 . 4.000 2.237 1.957 2.503 . 0 0 "[ . 1 . 2]" 1
1208 1 27 ALA MB 1 77 PRO QD 4.500 . 4.500 2.394 1.955 2.711 . 0 0 "[ . 1 . 2]" 1
1209 1 9 ILE QG 1 27 ALA MB 4.500 . 4.500 2.895 1.941 3.344 . 0 0 "[ . 1 . 2]" 1
1210 1 27 ALA MB 1 102 VAL MG1 4.500 . 4.500 3.130 3.122 3.135 . 0 0 "[ . 1 . 2]" 1
1211 1 27 ALA MB 1 30 LEU MD1 4.500 . 4.500 2.236 1.905 2.595 . 0 0 "[ . 1 . 2]" 1
1212 1 27 ALA MB 1 43 VAL MG2 7.000 . 7.000 4.150 4.051 4.262 . 0 0 "[ . 1 . 2]" 1
1213 1 64 TYR HA 1 64 TYR QD 4.000 . 4.000 3.517 3.447 3.572 . 0 0 "[ . 1 . 2]" 1
1214 1 61 SER QB 1 64 TYR QD . . 4.500 1.997 1.848 2.153 . 0 0 "[ . 1 . 2]" 1
1215 1 64 TYR QD 1 67 ARG QB 6.500 . 6.500 4.679 4.095 5.181 . 0 0 "[ . 1 . 2]" 1
1216 1 83 VAL MG1 1 85 TYR QD 6.500 . 6.500 3.512 3.114 3.972 . 0 0 "[ . 1 . 2]" 1
1217 1 83 VAL MG1 1 85 TYR QE 5.000 . 5.000 2.672 2.229 3.214 . 0 0 "[ . 1 . 2]" 1
1218 1 32 PRO QD 1 75 LEU MD2 6.000 . 6.000 3.569 3.285 3.924 . 0 0 "[ . 1 . 2]" 1
1219 1 55 MET QG 1 83 VAL MG1 3.800 . 3.800 1.866 1.775 2.527 0.025 17 0 "[ . 1 . 2]" 1
1220 1 19 ASN HA 1 84 ILE MG 5.500 . 5.500 3.549 3.444 3.818 . 0 0 "[ . 1 . 2]" 1
1221 1 84 ILE HA 1 84 ILE MG 3.300 . 3.300 2.235 2.087 2.297 . 0 0 "[ . 1 . 2]" 1
1222 1 21 ILE HA 1 84 ILE MG 5.500 . 5.500 2.929 2.732 3.174 . 0 0 "[ . 1 . 2]" 1
1223 1 84 ILE MG 1 86 LYS QE 4.500 . 4.500 2.743 2.037 3.282 . 0 0 "[ . 1 . 2]" 1
1224 1 19 ASN QB 1 84 ILE MG 4.000 . 4.000 1.852 1.822 1.896 . 0 0 "[ . 1 . 2]" 1
1225 1 84 ILE MD 1 85 TYR H 5.500 . 5.500 4.586 3.981 4.674 . 0 0 "[ . 1 . 2]" 1
1226 1 84 ILE H 1 84 ILE MD 5.500 . 5.500 3.695 2.141 4.359 . 0 0 "[ . 1 . 2]" 1
1227 1 21 ILE HA 1 84 ILE MD 5.500 . 5.500 3.920 2.166 4.410 . 0 0 "[ . 1 . 2]" 1
1228 1 84 ILE MD 1 86 LYS QE 6.000 . 6.000 3.436 2.291 4.454 . 0 0 "[ . 1 . 2]" 1
1229 1 85 TYR QD 1 88 ILE MD 6.500 . 6.500 3.534 2.345 4.401 . 0 0 "[ . 1 . 2]" 1
1230 1 85 TYR QB 1 88 ILE MD 4.500 . 4.500 2.537 2.089 2.875 . 0 0 "[ . 1 . 2]" 1
1231 1 20 LEU QB 1 88 ILE MD 6.000 . 6.000 3.329 2.966 3.880 . 0 0 "[ . 1 . 2]" 1
1232 1 47 LEU QD 1 88 ILE MD 5.000 . 5.000 2.560 2.456 2.979 . 0 0 "[ . 1 . 2]" 1
1233 1 20 LEU H 1 88 ILE MG 5.500 . 5.500 3.139 2.828 3.331 . 0 0 "[ . 1 . 2]" 1
1234 1 15 TYR QE 1 88 ILE MG 4.500 . 4.500 3.150 2.841 3.347 . 0 0 "[ . 1 . 2]" 1
1235 1 19 ASN HA 1 88 ILE MG 5.500 . 5.500 3.685 3.185 3.839 . 0 0 "[ . 1 . 2]" 1
1236 1 88 ILE MG 1 93 LEU HA 4.000 . 4.000 2.887 2.665 3.161 . 0 0 "[ . 1 . 2]" 1
1237 1 88 ILE MG 1 90 MET HA 5.500 . 5.500 4.317 3.999 4.526 . 0 0 "[ . 1 . 2]" 1
1238 1 85 TYR QB 1 88 ILE MG . . 5.500 3.517 2.962 3.784 . 0 0 "[ . 1 . 2]" 1
1239 1 20 LEU QB 1 88 ILE MG 4.500 . 4.500 2.372 2.166 2.524 . 0 0 "[ . 1 . 2]" 1
1240 1 88 ILE MG 1 93 LEU MD2 6.000 . 6.000 3.461 3.165 3.742 . 0 0 "[ . 1 . 2]" 1
1241 1 15 TYR QD 1 93 LEU MD2 4.500 . 4.500 3.274 2.889 3.361 . 0 0 "[ . 1 . 2]" 1
1242 1 15 TYR QE 1 93 LEU MD2 6.500 . 6.500 3.838 3.352 4.055 . 0 0 "[ . 1 . 2]" 1
1243 1 90 MET HA 1 93 LEU MD2 4.000 . 4.000 1.924 1.849 1.981 . 0 0 "[ . 1 . 2]" 1
1244 1 90 MET QG 1 93 LEU MD2 6.000 . 6.000 2.244 1.914 2.506 . 0 0 "[ . 1 . 2]" 1
1245 1 15 TYR QB 1 93 LEU MD2 5.500 . 5.500 3.056 2.579 3.234 . 0 0 "[ . 1 . 2]" 1
1246 1 90 MET QB 1 93 LEU MD2 4.500 . 4.500 3.349 3.264 3.380 . 0 0 "[ . 1 . 2]" 1
1247 1 90 MET ME 1 93 LEU MD2 4.500 . 4.500 1.740 1.665 1.881 0.135 18 0 "[ . 1 . 2]" 1
1248 1 98 LEU MD1 1 99 GLU H 4.000 . 4.000 3.276 3.015 3.338 . 0 0 "[ . 1 . 2]" 1
1249 1 98 LEU H 1 98 LEU MD1 5.500 . 5.500 4.121 4.050 4.217 . 0 0 "[ . 1 . 2]" 1
1250 1 46 TYR H 1 98 LEU MD1 5.500 . 5.500 3.918 3.672 4.142 . 0 0 "[ . 1 . 2]" 1
1251 1 85 TYR QD 1 98 LEU MD1 6.500 . 6.500 3.587 3.316 4.335 . 0 0 "[ . 1 . 2]" 1
1252 1 85 TYR QE 1 98 LEU MD1 4.500 . 4.500 2.335 2.059 3.340 . 0 0 "[ . 1 . 2]" 1
1253 1 45 VAL HA 1 98 LEU MD1 5.500 . 5.500 4.327 4.058 4.471 . 0 0 "[ . 1 . 2]" 1
1254 1 98 LEU HA 1 98 LEU MD1 3.300 . 3.300 2.392 2.226 2.500 . 0 0 "[ . 1 . 2]" 1
1255 1 45 VAL MG1 1 98 LEU MD1 4.500 . 4.500 1.742 1.697 1.804 0.103 19 0 "[ . 1 . 2]" 1
1256 1 47 LEU QD 1 98 LEU MD1 5.000 . 5.000 2.454 2.285 2.565 . 0 0 "[ . 1 . 2]" 1
1257 1 98 LEU MD1 1 119 ILE MD 6.000 . 6.000 4.164 4.143 4.176 . 0 0 "[ . 1 . 2]" 1
1258 1 117 VAL MG1 1 134 TYR QD 4.500 . 4.500 2.981 2.390 3.219 . 0 0 "[ . 1 . 2]" 1
1259 1 117 VAL HA 1 117 VAL MG1 3.300 . 3.300 2.172 2.069 2.255 . 0 0 "[ . 1 . 2]" 1
1260 1 117 VAL MG1 1 135 PRO QD 5.500 . 5.500 3.061 2.593 3.393 . 0 0 "[ . 1 . 2]" 1
1261 1 117 VAL MG1 1 119 ILE MD . . 3.800 2.634 2.529 2.645 . 0 0 "[ . 1 . 2]" 1
1262 1 43 VAL MG2 1 100 VAL MG1 6.000 . 6.000 3.044 2.962 3.114 . 0 0 "[ . 1 . 2]" 1
1263 1 100 VAL H 1 100 VAL MG2 3.300 . 3.300 2.172 1.958 2.347 . 0 0 "[ . 1 . 2]" 1
1264 1 100 VAL MG2 1 117 VAL HB 5.500 . 5.500 3.106 2.856 3.267 . 0 0 "[ . 1 . 2]" 1
1265 1 98 LEU HG 1 100 VAL MG2 4.000 . 4.000 2.791 2.626 3.052 . 0 0 "[ . 1 . 2]" 1
1266 1 11 LEU QB 1 100 VAL MG2 6.000 . 6.000 3.784 3.596 3.892 . 0 0 "[ . 1 . 2]" 1
1267 1 11 LEU MD1 1 100 VAL MG2 . . 3.800 1.996 1.736 2.342 0.064 3 0 "[ . 1 . 2]" 1
1268 1 100 VAL MG2 1 119 ILE MD 6.000 . 6.000 1.930 1.816 2.177 . 0 0 "[ . 1 . 2]" 1
1269 1 102 VAL MG1 1 103 TRP H 4.000 . 4.000 2.598 2.473 3.041 . 0 0 "[ . 1 . 2]" 1
1270 1 43 VAL H 1 102 VAL MG1 5.500 . 5.500 4.591 4.586 4.598 . 0 0 "[ . 1 . 2]" 1
1271 1 79 TRP HZ2 1 102 VAL MG1 . . 4.000 2.418 2.184 2.624 . 0 0 "[ . 1 . 2]" 1
1272 1 79 TRP HH2 1 102 VAL MG1 4.000 . 4.000 2.663 2.517 2.913 . 0 0 "[ . 1 . 2]" 1
1273 1 43 VAL HA 1 102 VAL MG1 5.500 . 5.500 3.275 3.172 3.343 . 0 0 "[ . 1 . 2]" 1
1274 1 41 PRO QB 1 102 VAL MG1 5.500 . 5.500 2.674 2.504 2.856 . 0 0 "[ . 1 . 2]" 1
1275 1 42 PHE HA 1 102 VAL MG1 5.500 . 5.500 4.301 4.209 4.356 . 0 0 "[ . 1 . 2]" 1
1276 1 102 VAL MG2 1 103 TRP H 5.500 . 5.500 4.268 4.223 4.377 . 0 0 "[ . 1 . 2]" 1
1277 1 79 TRP HH2 1 102 VAL MG2 5.500 . 5.500 3.232 3.040 3.516 . 0 0 "[ . 1 . 2]" 1
1278 1 101 THR HA 1 102 VAL MG2 5.500 . 5.500 3.333 3.260 3.387 . 0 0 "[ . 1 . 2]" 1
1279 1 43 VAL MG2 1 102 VAL MG2 4.500 . 4.500 2.635 2.459 2.912 . 0 0 "[ . 1 . 2]" 1
1280 1 98 LEU H 1 121 LEU MD1 4.000 . 4.000 3.177 2.427 3.339 . 0 0 "[ . 1 . 2]" 1
1281 1 97 THR H 1 121 LEU MD1 5.500 . 5.500 3.975 3.696 4.167 . 0 0 "[ . 1 . 2]" 1
1282 1 96 LYS H 1 121 LEU MD1 5.500 . 5.500 3.675 3.265 4.210 . 0 0 "[ . 1 . 2]" 1
1283 1 121 LEU H 1 121 LEU MD1 5.500 . 5.500 3.467 2.882 3.777 . 0 0 "[ . 1 . 2]" 1
1284 1 41 PRO HA 1 114 LEU MD1 5.500 . 5.500 3.709 3.464 4.008 . 0 0 "[ . 1 . 2]" 1
1285 1 103 TRP HA 1 114 LEU MD1 5.500 . 5.500 3.594 3.341 3.967 . 0 0 "[ . 1 . 2]" 1
1286 1 97 THR HA 1 121 LEU MD1 5.500 . 5.500 3.283 2.402 3.587 . 0 0 "[ . 1 . 2]" 1
1287 1 93 LEU HA 1 121 LEU MD1 5.500 . 5.500 3.265 2.953 4.074 . 0 0 "[ . 1 . 2]" 1
1288 1 104 ASP QB 1 114 LEU MD1 . . 4.000 1.867 1.762 2.024 0.038 5 0 "[ . 1 . 2]" 1
1289 1 47 LEU QD 1 121 LEU MD1 5.000 . 5.000 1.698 1.626 1.800 0.174 19 0 "[ . 1 . 2]" 1
1290 1 118 LEU MD2 1 119 ILE H 4.000 . 4.000 3.131 2.731 3.333 . 0 0 "[ . 1 . 2]" 1
1291 1 118 LEU H 1 118 LEU MD2 5.500 . 5.500 4.260 4.011 4.457 . 0 0 "[ . 1 . 2]" 1
1292 1 118 LEU HA 1 118 LEU MD2 3.300 . 3.300 2.109 1.948 2.320 . 0 0 "[ . 1 . 2]" 1
1293 1 99 GLU HA 1 118 LEU MD2 4.000 . 4.000 2.802 2.242 3.182 . 0 0 "[ . 1 . 2]" 1
1294 1 99 GLU QG 1 118 LEU MD2 3.800 . 3.800 2.060 1.738 2.798 0.062 16 0 "[ . 1 . 2]" 1
1295 1 99 GLU QB 1 118 LEU MD2 6.000 . 6.000 2.333 1.936 3.369 . 0 0 "[ . 1 . 2]" 1
1296 1 119 ILE HA 1 119 ILE MG 3.300 . 3.300 2.300 2.203 2.388 . 0 0 "[ . 1 . 2]" 1
1297 1 119 ILE MG 1 134 TYR QD 6.500 . 6.500 3.611 3.252 3.890 . 0 0 "[ . 1 . 2]" 1
1298 1 119 ILE MG 1 134 TYR QE 6.500 . 6.500 2.640 2.228 3.153 . 0 0 "[ . 1 . 2]" 1
1299 1 119 ILE MD 1 134 TYR QD 6.500 . 6.500 3.449 2.857 3.845 . 0 0 "[ . 1 . 2]" 1
1300 1 119 ILE MD 1 134 TYR QE 6.500 . 6.500 3.669 2.648 4.230 . 0 0 "[ . 1 . 2]" 1
1301 1 118 LEU HA 1 119 ILE MD 5.500 . 5.500 3.791 3.352 4.333 . 0 0 "[ . 1 . 2]" 1
1302 1 119 ILE MD 1 134 TYR QB 6.000 . 6.000 3.412 3.243 3.641 . 0 0 "[ . 1 . 2]" 1
1303 1 100 VAL HB 1 119 ILE MD 5.500 . 5.500 3.312 3.056 3.819 . 0 0 "[ . 1 . 2]" 1
1304 1 117 VAL HB 1 119 ILE MD 4.000 . 4.000 2.772 2.544 3.075 . 0 0 "[ . 1 . 2]" 1
1305 1 98 LEU QB 1 119 ILE MD 6.000 . 6.000 2.590 2.321 3.006 . 0 0 "[ . 1 . 2]" 1
1306 1 14 ASN H 1 21 ILE MD 5.500 . 5.500 4.345 4.185 4.431 . 0 0 "[ . 1 . 2]" 1
1307 1 15 TYR H 1 21 ILE MD 5.500 . 5.500 3.995 3.895 4.156 . 0 0 "[ . 1 . 2]" 1
1308 1 19 ASN QD 1 21 ILE MD 6.000 . 6.000 4.268 4.120 4.377 . 0 0 "[ . 1 . 2]" 1
1309 1 15 TYR HA 1 21 ILE MD 5.500 . 5.500 2.081 1.906 2.433 . 0 0 "[ . 1 . 2]" 1
1310 1 20 LEU HA 1 21 ILE MD 5.500 . 5.500 2.856 2.735 3.287 . 0 0 "[ . 1 . 2]" 1
1311 1 16 ASP HA 1 21 ILE MD 5.500 . 5.500 4.131 3.858 4.283 . 0 0 "[ . 1 . 2]" 1
1312 1 19 ASN QB 1 21 ILE MD 4.500 . 4.500 2.814 2.708 2.914 . 0 0 "[ . 1 . 2]" 1
1313 1 14 ASN QB 1 21 ILE MD 4.500 . 4.500 3.199 2.995 3.342 . 0 0 "[ . 1 . 2]" 1
1314 1 16 ASP QB 1 21 ILE MD 4.500 . 4.500 2.503 2.155 2.957 . 0 0 "[ . 1 . 2]" 1
1315 1 130 THR HA 1 130 THR MG 3.300 . 3.300 2.408 2.155 2.812 . 0 0 "[ . 1 . 2]" 1
1316 1 130 THR MG 1 131 PRO QD 4.500 . 4.500 3.281 3.044 3.354 . 0 0 "[ . 1 . 2]" 1
1317 1 8 GLU HA 1 136 LEU MD2 5.500 . 5.500 3.646 3.480 4.120 . 0 0 "[ . 1 . 2]" 1
1318 1 101 THR HA 1 136 LEU MD2 5.500 . 5.500 3.871 3.670 4.090 . 0 0 "[ . 1 . 2]" 1
1319 1 117 VAL HA 1 136 LEU MD2 5.500 . 5.500 4.301 3.928 4.589 . 0 0 "[ . 1 . 2]" 1
1320 1 136 LEU HA 1 136 LEU MD2 3.300 . 3.300 2.605 2.342 2.762 . 0 0 "[ . 1 . 2]" 1
1321 1 115 GLY QA 1 136 LEU MD2 5.500 . 5.500 2.465 1.923 2.795 . 0 0 "[ . 1 . 2]" 1
1322 1 9 ILE QG 1 136 LEU MD2 6.000 . 6.000 3.600 2.746 4.009 . 0 0 "[ . 1 . 2]" 1
1323 1 117 VAL HB 1 136 LEU MD2 5.500 . 5.500 3.775 3.604 4.060 . 0 0 "[ . 1 . 2]" 1
1324 1 9 ILE HB 1 136 LEU MD2 3.300 . 3.300 2.025 1.863 2.457 . 0 0 "[ . 1 . 2]" 1
1325 1 117 VAL MG2 1 136 LEU MD2 3.800 . 3.800 1.716 1.661 1.855 0.139 8 0 "[ . 1 . 2]" 1
1326 1 44 LYS QE 1 54 VAL MG2 . . 5.500 3.556 3.093 3.891 . 0 0 "[ . 1 . 2]" 1
1327 1 44 LYS HA 1 54 VAL MG2 5.500 . 5.500 3.080 2.847 3.317 . 0 0 "[ . 1 . 2]" 1
1328 1 46 TYR QD 1 54 VAL MG2 6.500 . 6.500 1.994 1.897 2.149 . 0 0 "[ . 1 . 2]" 1
1329 1 45 VAL HA 1 45 VAL MG2 3.300 . 3.300 2.283 2.173 2.360 . 0 0 "[ . 1 . 2]" 1
1330 1 43 VAL MG2 1 45 VAL MG2 7.000 . 7.000 4.207 4.038 4.353 . 0 0 "[ . 1 . 2]" 1
1331 1 13 ILE MG 1 21 ILE H 5.500 . 5.500 4.197 3.985 4.341 . 0 0 "[ . 1 . 2]" 1
1332 1 13 ILE HA 1 13 ILE MG 3.300 . 3.300 2.198 2.088 2.285 . 0 0 "[ . 1 . 2]" 1
1333 1 13 ILE MG 1 20 LEU MD1 4.500 . 4.500 2.625 2.503 2.791 . 0 0 "[ . 1 . 2]" 1
1334 1 13 ILE MG 1 119 ILE MG 6.000 . 6.000 3.921 3.610 4.162 . 0 0 "[ . 1 . 2]" 1
1335 1 62 ALA MB 1 66 ARG QB 6.000 . 6.000 3.789 2.374 4.451 . 0 0 "[ . 1 . 2]" 1
1336 1 63 GLU QG 1 67 ARG QD 6.000 . 6.000 4.639 2.866 4.778 . 0 0 "[ . 1 . 2]" 1
1337 1 61 SER QB 1 64 TYR QB . . 3.800 2.984 2.594 3.038 . 0 0 "[ . 1 . 2]" 1
1338 1 46 TYR QD 1 54 VAL MG1 6.500 . 6.500 3.883 3.547 4.040 . 0 0 "[ . 1 . 2]" 1
1339 1 56 VAL MG2 1 57 VAL H 5.500 . 5.500 3.883 3.812 3.999 . 0 0 "[ . 1 . 2]" 1
1340 1 42 PHE QD 1 56 VAL MG2 6.500 . 6.500 3.675 3.297 3.985 . 0 0 "[ . 1 . 2]" 1
1341 1 42 PHE QE 1 56 VAL MG1 6.500 . 6.500 3.799 3.326 4.298 . 0 0 "[ . 1 . 2]" 1
1342 1 17 LEU MD2 1 18 GLY H 5.500 . 5.500 4.399 4.198 4.498 . 0 0 "[ . 1 . 2]" 1
1343 1 23 HIS H 1 24 ILE MD 5.500 . 5.500 4.508 4.228 4.596 . 0 0 "[ . 1 . 2]" 1
1344 1 6 THR H 1 31 VAL MG1 5.500 . 5.500 3.783 3.384 4.155 . 0 0 "[ . 1 . 2]" 1
1345 1 3 HIS HA 1 31 VAL MG2 5.500 . 5.500 3.192 2.553 3.739 . 0 0 "[ . 1 . 2]" 1
1346 1 97 THR HA 1 97 THR MG 3.300 . 3.300 2.424 2.309 2.493 . 0 0 "[ . 1 . 2]" 1
1347 1 5 ILE HA 1 31 VAL MG2 5.500 . 5.500 4.033 3.785 4.242 . 0 0 "[ . 1 . 2]" 1
1348 1 31 VAL HA 1 31 VAL MG2 3.300 . 3.300 2.270 2.221 2.406 . 0 0 "[ . 1 . 2]" 1
1349 1 31 VAL MG2 1 32 PRO QD 3.300 . 3.300 2.377 2.107 2.459 . 0 0 "[ . 1 . 2]" 1
1350 1 3 HIS QB 1 31 VAL MG2 5.500 . 5.500 2.151 1.797 4.017 0.003 2 0 "[ . 1 . 2]" 1
1351 1 97 THR MG 1 120 ASP QB 5.500 . 5.500 3.332 2.600 3.732 . 0 0 "[ . 1 . 2]" 1
1352 1 4 PRO QB 1 31 VAL MG2 6.000 . 6.000 3.896 3.538 4.123 . 0 0 "[ . 1 . 2]" 1
1353 1 5 ILE MG 1 138 GLU QB 5.500 . 5.500 4.017 3.839 4.087 . 0 0 "[ . 1 . 2]" 1
1354 1 13 ILE MD 1 119 ILE MD 4.500 . 4.500 3.037 2.845 3.129 . 0 0 "[ . 1 . 2]" 1
1355 1 117 VAL MG1 1 134 TYR QB 4.500 . 4.500 1.758 1.707 1.807 0.093 10 0 "[ . 1 . 2]" 1
1356 1 5 ILE MG 1 113 PHE QE 6.500 . 6.500 2.162 1.899 2.534 . 0 0 "[ . 1 . 2]" 1
1357 1 5 ILE HA 1 5 ILE MG 3.300 . 3.300 2.303 2.217 2.352 . 0 0 "[ . 1 . 2]" 1
1358 1 5 ILE MG 1 115 GLY QA 4.500 . 4.500 2.015 1.882 2.108 . 0 0 "[ . 1 . 2]" 1
1359 1 20 LEU MD1 1 21 ILE H 4.000 . 4.000 3.342 2.997 3.667 . 0 0 "[ . 1 . 2]" 1
1360 1 14 ASN H 1 20 LEU MD1 5.500 . 5.500 3.881 3.696 4.287 . 0 0 "[ . 1 . 2]" 1
1361 1 15 TYR QE 1 20 LEU MD1 6.500 . 6.500 4.841 4.812 4.863 . 0 0 "[ . 1 . 2]" 1
1362 1 15 TYR QD 1 20 LEU MD1 4.500 . 4.500 3.008 2.911 3.092 . 0 0 "[ . 1 . 2]" 1
1363 1 15 TYR HA 1 20 LEU MD1 5.500 . 5.500 3.528 3.233 3.873 . 0 0 "[ . 1 . 2]" 1
1364 1 20 LEU HA 1 20 LEU MD1 3.300 . 3.300 2.517 2.198 2.766 . 0 0 "[ . 1 . 2]" 1
1365 1 15 TYR QB 1 20 LEU MD1 5.500 . 5.500 2.047 1.915 2.318 . 0 0 "[ . 1 . 2]" 1
1366 1 20 LEU MD1 1 121 LEU MD1 3.800 . 3.800 2.360 2.064 2.642 . 0 0 "[ . 1 . 2]" 1
1367 1 11 LEU MD1 1 12 GLN H 5.500 . 5.500 4.607 4.596 4.627 . 0 0 "[ . 1 . 2]" 1
1368 1 11 LEU MD1 1 134 TYR QD 6.500 . 6.500 2.212 1.877 2.958 . 0 0 "[ . 1 . 2]" 1
1369 1 11 LEU MD1 1 134 TYR QE 6.500 . 6.500 2.574 2.251 3.271 . 0 0 "[ . 1 . 2]" 1
1370 1 9 ILE MG 1 11 LEU MD1 4.500 . 4.500 1.982 1.756 2.513 0.044 13 0 "[ . 1 . 2]" 1
1371 1 11 LEU MD1 1 119 ILE MD 4.500 . 4.500 2.721 2.187 3.124 . 0 0 "[ . 1 . 2]" 1
1372 1 45 VAL MG1 1 47 LEU H 6.500 . 6.500 4.705 4.561 4.908 . 0 0 "[ . 1 . 2]" 1
1373 1 45 VAL MG1 1 85 TYR QD 6.500 . 6.500 4.606 4.410 4.830 . 0 0 "[ . 1 . 2]" 1
1374 1 45 VAL MG1 1 85 TYR QE 4.500 . 4.500 2.688 2.375 3.255 . 0 0 "[ . 1 . 2]" 1
1375 1 45 VAL MG1 1 100 VAL HA 5.500 . 5.500 3.475 3.180 3.717 . 0 0 "[ . 1 . 2]" 1
1376 1 45 VAL MG1 1 55 MET QB 6.000 . 6.000 3.793 3.519 4.454 . 0 0 "[ . 1 . 2]" 1
1377 1 45 VAL MG1 1 98 LEU HG 5.500 . 5.500 2.251 1.959 2.615 . 0 0 "[ . 1 . 2]" 1
1378 1 45 VAL MG1 1 47 LEU QD 7.500 . 7.500 3.719 3.578 3.805 . 0 0 "[ . 1 . 2]" 1
1379 1 118 LEU H 1 118 LEU MD1 5.500 . 5.500 3.996 3.651 4.201 . 0 0 "[ . 1 . 2]" 1
1380 1 99 GLU QG 1 118 LEU MD1 6.000 . 6.000 3.495 2.999 3.920 . 0 0 "[ . 1 . 2]" 1
1381 1 9 ILE HA 1 27 ALA HA . . 2.800 2.114 1.956 2.393 . 0 0 "[ . 1 . 2]" 1
1382 1 101 THR HA 1 116 GLU QB 5.500 . 5.500 3.538 3.350 3.654 . 0 0 "[ . 1 . 2]" 1
1383 1 101 THR HA 1 116 GLU HA . . 2.800 2.138 1.980 2.194 . 0 0 "[ . 1 . 2]" 1
1384 1 63 GLU HA 1 66 ARG QB 4.000 . 4.000 3.329 2.992 3.649 . 0 0 "[ . 1 . 2]" 1
1385 1 101 THR MG 1 103 TRP HZ2 5.500 . 5.500 3.590 2.911 4.369 . 0 0 "[ . 1 . 2]" 1
1386 1 46 TYR QE 1 101 THR MG 6.500 . 6.500 3.632 3.262 3.941 . 0 0 "[ . 1 . 2]" 1
1387 1 101 THR MG 1 113 PHE QD 6.500 . 6.500 4.193 3.533 4.581 . 0 0 "[ . 1 . 2]" 1
1388 1 101 THR MG 1 116 GLU HA 4.000 . 4.000 2.631 2.097 2.832 . 0 0 "[ . 1 . 2]" 1
1389 1 101 THR HA 1 101 THR MG 3.300 . 3.300 2.356 2.126 2.526 . 0 0 "[ . 1 . 2]" 1
1390 1 101 THR MG 1 116 GLU QB 4.500 . 4.500 2.644 1.981 2.994 . 0 0 "[ . 1 . 2]" 1
1391 1 101 THR MG 1 116 GLU QG 4.500 . 4.500 1.871 1.808 1.937 . 0 0 "[ . 1 . 2]" 1
1392 1 117 VAL MG2 1 136 LEU H 5.500 . 5.500 3.494 3.198 3.803 . 0 0 "[ . 1 . 2]" 1
1393 1 117 VAL MG2 1 134 TYR QD 6.500 . 6.500 4.379 4.202 4.545 . 0 0 "[ . 1 . 2]" 1
1394 1 117 VAL MG2 1 134 TYR HA 5.500 . 5.500 4.543 4.444 4.591 . 0 0 "[ . 1 . 2]" 1
1395 1 117 VAL HA 1 117 VAL MG2 3.300 . 3.300 2.551 2.518 2.593 . 0 0 "[ . 1 . 2]" 1
1396 1 117 VAL MG2 1 136 LEU HA 4.000 . 4.000 1.871 1.791 1.950 0.009 7 0 "[ . 1 . 2]" 1
1397 1 117 VAL MG2 1 135 PRO QD 6.000 . 6.000 4.262 3.977 4.460 . 0 0 "[ . 1 . 2]" 1
1398 1 117 VAL MG2 1 134 TYR QB 3.800 . 3.800 2.630 2.434 2.783 . 0 0 "[ . 1 . 2]" 1
1399 1 100 VAL HB 1 117 VAL MG2 4.000 . 4.000 2.782 2.343 3.140 . 0 0 "[ . 1 . 2]" 1
1400 1 57 VAL MG1 1 58 GLN H 3.300 . 3.300 2.158 1.912 2.529 . 0 0 "[ . 1 . 2]" 1
1401 1 43 VAL H 1 57 VAL QG 4.500 . 4.500 2.903 2.794 3.018 . 0 0 "[ . 1 . 2]" 1
1402 1 57 VAL MG1 1 81 GLN H 5.500 . 5.500 3.503 3.217 3.776 . 0 0 "[ . 1 . 2]" 1
1403 1 57 VAL MG1 1 79 TRP HD1 4.000 . 4.000 3.166 2.841 3.340 . 0 0 "[ . 1 . 2]" 1
1404 1 57 VAL QG 1 79 TRP QB 4.000 . 4.000 1.992 1.781 2.289 0.019 9 0 "[ . 1 . 2]" 1
1405 1 57 VAL MG1 1 81 GLN QG 4.500 . 4.500 1.928 1.789 2.330 0.011 9 0 "[ . 1 . 2]" 1
1406 1 57 VAL QG 1 81 GLN QB 3.800 . 3.800 1.902 1.784 2.165 0.016 5 0 "[ . 1 . 2]" 1
1407 1 24 ILE HB 1 57 VAL QG 4.500 . 4.500 2.054 1.924 2.310 . 0 0 "[ . 1 . 2]" 1
1408 1 6 THR HA 1 6 THR MG 3.300 . 3.300 2.254 2.159 2.345 . 0 0 "[ . 1 . 2]" 1
1409 1 6 THR MG 1 31 VAL HA 5.500 . 5.500 4.508 4.076 4.592 . 0 0 "[ . 1 . 2]" 1
1410 1 4 PRO QG 1 6 THR MG 4.500 . 4.500 3.342 3.339 3.347 . 0 0 "[ . 1 . 2]" 1
1411 1 4 PRO QB 1 6 THR MG 4.500 . 4.500 2.943 2.823 3.050 . 0 0 "[ . 1 . 2]" 1
1412 1 24 ILE MG 1 81 GLN H 5.500 . 5.500 4.186 4.085 4.298 . 0 0 "[ . 1 . 2]" 1
1413 1 10 GLN QB 1 25 LEU MD2 6.000 . 6.000 4.467 4.455 4.476 . 0 0 "[ . 1 . 2]" 1
1414 1 9 ILE H 1 27 ALA MB 5.500 . 5.500 4.250 4.038 4.494 . 0 0 "[ . 1 . 2]" 1
1415 1 27 ALA HA 1 133 TRP HZ3 3.500 . 3.500 2.166 1.957 2.586 . 0 0 "[ . 1 . 2]" 1
1416 1 27 ALA HA 1 133 TRP HH2 5.000 . 5.000 4.195 3.780 4.619 . 0 0 "[ . 1 . 2]" 1
1417 1 62 ALA MB 1 66 ARG QD 6.000 . 6.000 3.799 3.028 4.473 . 0 0 "[ . 1 . 2]" 1
1418 1 55 MET ME 1 85 TYR QE . . 4.500 1.991 1.823 2.848 . 0 0 "[ . 1 . 2]" 1
1419 1 55 MET QG 1 85 TYR QE 6.500 . 6.500 2.826 1.806 4.256 . 0 0 "[ . 1 . 2]" 1
1420 1 47 LEU QD 1 85 TYR QE 5.000 . 5.000 2.784 2.157 3.003 . 0 0 "[ . 1 . 2]" 1
1421 1 15 TYR QD 1 93 LEU MD1 4.500 . 4.500 2.956 2.276 3.348 . 0 0 "[ . 1 . 2]" 1
1422 1 15 TYR QE 1 93 LEU MD1 6.500 . 6.500 4.069 3.187 4.586 . 0 0 "[ . 1 . 2]" 1
1423 1 47 LEU H 1 98 LEU MD1 5.500 . 5.500 4.514 4.297 4.590 . 0 0 "[ . 1 . 2]" 1
1424 1 117 VAL MG1 1 136 LEU H 5.500 . 5.500 4.592 4.582 4.605 . 0 0 "[ . 1 . 2]" 1
1425 1 43 VAL HA 1 103 TRP HD1 3.500 . 3.500 3.177 2.815 3.513 0.013 17 0 "[ . 1 . 2]" 1
1426 1 31 VAL H 1 114 LEU MD1 5.500 . 5.500 4.581 4.507 4.589 . 0 0 "[ . 1 . 2]" 1
1427 1 30 LEU MD1 1 79 TRP HH2 5.500 . 5.500 3.722 3.393 4.220 . 0 0 "[ . 1 . 2]" 1
1428 1 97 THR HB 1 118 LEU MD2 5.500 . 5.500 3.148 2.776 3.910 . 0 0 "[ . 1 . 2]" 1
1429 1 117 VAL MG2 1 119 ILE MD 6.000 . 6.000 3.968 3.772 4.171 . 0 0 "[ . 1 . 2]" 1
1430 1 82 THR MG 1 83 VAL H 3.300 . 3.300 2.457 2.060 2.751 . 0 0 "[ . 1 . 2]" 1
1431 1 45 VAL MG2 1 101 THR H 5.500 . 5.500 2.834 2.704 3.029 . 0 0 "[ . 1 . 2]" 1
1432 1 82 THR MG 1 84 ILE QG 4.500 . 4.500 3.097 2.919 3.346 . 0 0 "[ . 1 . 2]" 1
1433 1 24 ILE MD 1 45 VAL MG2 3.800 . 3.800 2.455 2.158 2.638 . 0 0 "[ . 1 . 2]" 1
1434 1 13 ILE MG 1 127 LEU H 5.500 . 5.500 4.455 4.106 4.593 . 0 0 "[ . 1 . 2]" 1
1435 1 9 ILE MG 1 43 VAL MG2 7.000 . 7.000 4.646 4.245 4.856 . 0 0 "[ . 1 . 2]" 1
1436 1 17 LEU MD1 1 19 ASN QD 6.000 . 6.000 3.682 3.263 4.453 . 0 0 "[ . 1 . 2]" 1
1437 1 15 TYR QD 1 127 LEU MD1 6.500 . 6.500 3.621 2.829 4.355 . 0 0 "[ . 1 . 2]" 1
1438 1 11 LEU MD2 1 24 ILE HA 3.300 . 3.300 2.022 1.833 2.252 . 0 0 "[ . 1 . 2]" 1
1439 1 15 TYR QB 1 127 LEU MD1 5.500 . 5.500 2.867 2.498 3.411 . 0 0 "[ . 1 . 2]" 1
1440 1 11 LEU MD2 1 119 ILE MD 6.000 . 6.000 3.998 3.767 4.179 . 0 0 "[ . 1 . 2]" 1
1441 1 21 ILE H 1 127 LEU MD2 6.500 . 6.500 4.473 4.283 4.586 . 0 0 "[ . 1 . 2]" 1
1442 1 15 TYR QD 1 127 LEU MD2 6.500 . 6.500 3.747 3.546 4.373 . 0 0 "[ . 1 . 2]" 1
1443 1 14 ASN HA 1 127 LEU MD2 5.500 . 5.500 2.514 2.322 2.738 . 0 0 "[ . 1 . 2]" 1
1444 1 127 LEU HA 1 127 LEU MD2 3.300 . 3.300 1.989 1.878 2.335 . 0 0 "[ . 1 . 2]" 1
1445 1 15 TYR QB 1 127 LEU MD2 4.000 . 4.000 1.999 1.830 2.551 . 0 0 "[ . 1 . 2]" 1
1446 1 13 ILE HB 1 127 LEU MD2 4.000 . 4.000 3.239 2.651 3.348 . 0 0 "[ . 1 . 2]" 1
1447 1 13 ILE MG 1 127 LEU MD2 3.800 . 3.800 1.921 1.668 2.098 0.132 9 0 "[ . 1 . 2]" 1
1448 1 24 ILE H 1 57 VAL QG 6.000 . 6.000 3.581 3.374 3.815 . 0 0 "[ . 1 . 2]" 1
1449 1 136 LEU H 1 136 LEU MD1 5.500 . 5.500 3.177 3.014 3.428 . 0 0 "[ . 1 . 2]" 1
1450 1 8 GLU HA 1 136 LEU MD1 . . 4.000 2.365 2.223 2.808 . 0 0 "[ . 1 . 2]" 1
1451 1 115 GLY QA 1 136 LEU MD1 5.500 . 5.500 2.687 2.430 2.896 . 0 0 "[ . 1 . 2]" 1
1452 1 7 GLY QA 1 136 LEU MD1 6.000 . 6.000 2.838 2.572 3.101 . 0 0 "[ . 1 . 2]" 1
1453 1 30 LEU MD1 1 77 PRO QD 5.000 . 5.000 1.794 1.716 1.905 0.084 5 0 "[ . 1 . 2]" 1
1454 1 30 LEU MD1 1 31 VAL H 5.500 . 5.500 3.950 3.820 4.292 . 0 0 "[ . 1 . 2]" 1
1455 1 116 GLU HA 1 136 LEU MD2 5.500 . 5.500 3.333 2.967 3.537 . 0 0 "[ . 1 . 2]" 1
1456 1 30 LEU H 1 30 LEU MD2 5.500 . 5.500 3.625 3.435 3.766 . 0 0 "[ . 1 . 2]" 1
1457 1 30 LEU MD2 1 31 VAL H 5.500 . 5.500 2.753 2.578 3.000 . 0 0 "[ . 1 . 2]" 1
1458 1 7 GLY QA 1 30 LEU MD2 . . 4.000 2.301 1.969 2.761 . 0 0 "[ . 1 . 2]" 1
1459 1 30 LEU HA 1 30 LEU MD2 3.300 . 3.300 1.997 1.923 2.094 . 0 0 "[ . 1 . 2]" 1
1460 1 30 LEU MD2 1 77 PRO QD 6.000 . 6.000 3.868 3.685 3.995 . 0 0 "[ . 1 . 2]" 1
1461 1 98 LEU H 1 121 LEU MD2 5.500 . 5.500 3.296 2.448 3.916 . 0 0 "[ . 1 . 2]" 1
1462 1 48 LEU H 1 48 LEU MD2 5.500 . 5.500 3.099 2.509 3.630 . 0 0 "[ . 1 . 2]" 1
1463 1 48 LEU MD2 1 97 THR H 5.500 . 5.500 4.493 4.072 4.615 . 0 0 "[ . 1 . 2]" 1
1464 1 121 LEU H 1 121 LEU MD2 5.500 . 5.500 3.547 3.066 3.982 . 0 0 "[ . 1 . 2]" 1
1465 1 46 TYR QD 1 48 LEU MD2 6.500 . 6.500 3.337 2.034 4.000 . 0 0 "[ . 1 . 2]" 1
1466 1 97 THR HA 1 121 LEU MD2 5.500 . 5.500 4.177 3.372 4.615 . 0 0 "[ . 1 . 2]" 1
1467 1 48 LEU HA 1 48 LEU MD2 3.300 . 3.300 2.014 1.896 2.272 . 0 0 "[ . 1 . 2]" 1
1468 1 121 LEU HA 1 121 LEU MD2 3.300 . 3.300 2.224 1.956 2.703 . 0 0 "[ . 1 . 2]" 1
1469 1 98 LEU QB 1 121 LEU MD2 4.500 . 4.500 2.413 1.904 3.015 . 0 0 "[ . 1 . 2]" 1
1470 1 15 TYR HA 1 15 TYR QD 4.000 . 4.000 3.265 3.232 3.302 . 0 0 "[ . 1 . 2]" 1
1471 1 15 TYR HA 1 20 LEU HA 3.500 . 3.500 2.280 2.174 2.379 . 0 0 "[ . 1 . 2]" 1
1472 1 15 TYR QE 1 19 ASN HA 6.000 . 6.000 4.248 4.107 4.435 . 0 0 "[ . 1 . 2]" 1
1473 1 19 ASN HA 1 86 LYS HA 3.500 . 3.500 2.226 1.993 2.706 . 0 0 "[ . 1 . 2]" 1
1474 1 15 TYR QE 1 18 GLY QA 6.500 . 6.500 2.057 1.967 2.232 . 0 0 "[ . 1 . 2]" 1
1475 1 15 TYR QE 1 90 MET QG 6.500 . 6.500 3.502 2.344 5.163 . 0 0 "[ . 1 . 2]" 1
1476 1 15 TYR QE 1 90 MET ME 6.500 . 6.500 3.743 3.434 3.968 . 0 0 "[ . 1 . 2]" 1
1477 1 15 TYR QE 1 90 MET QB 6.500 . 6.500 4.319 3.740 4.671 . 0 0 "[ . 1 . 2]" 1
1478 1 42 PHE HZ 1 105 TYR QD 6.000 . 6.000 4.297 3.890 4.435 . 0 0 "[ . 1 . 2]" 1
1479 1 11 LEU HG 1 134 TYR QD 6.000 . 6.000 3.616 2.410 4.400 . 0 0 "[ . 1 . 2]" 1
1480 1 11 LEU QB 1 134 TYR QD . . 6.000 4.125 3.854 4.659 . 0 0 "[ . 1 . 2]" 1
1481 1 11 LEU MD2 1 24 ILE H 5.500 . 5.500 4.118 3.791 4.585 . 0 0 "[ . 1 . 2]" 1
1482 1 24 ILE MG 1 26 GLN H 5.500 . 5.500 4.132 3.895 4.467 . 0 0 "[ . 1 . 2]" 1
1483 1 8 GLU HA 1 135 PRO HA 2.800 . 2.800 2.777 2.582 2.814 0.014 2 0 "[ . 1 . 2]" 1
1484 1 8 GLU HA 1 136 LEU HG 3.500 . 3.500 2.062 1.945 2.524 . 0 0 "[ . 1 . 2]" 1
1485 1 30 LEU H 1 75 LEU QB 5.500 . 5.500 4.210 3.524 4.878 . 0 0 "[ . 1 . 2]" 1
1486 1 57 VAL QG 1 79 TRP HD1 6.000 . 6.000 3.135 2.828 3.303 . 0 0 "[ . 1 . 2]" 1
1487 1 84 ILE H 1 85 TYR QD 6.000 . 6.000 4.454 3.891 4.962 . 0 0 "[ . 1 . 2]" 1
1488 1 15 TYR QD 1 20 LEU HA 4.000 . 4.000 2.691 2.547 2.808 . 0 0 "[ . 1 . 2]" 1
1489 1 20 LEU QB 1 85 TYR QD 4.500 . 4.500 2.688 1.971 3.547 . 0 0 "[ . 1 . 2]" 1
1490 1 47 LEU QD 1 85 TYR QD 4.500 . 4.500 2.494 2.144 2.730 . 0 0 "[ . 1 . 2]" 1
1491 1 99 GLU HA 1 118 LEU HA 3.500 . 3.500 2.414 2.265 2.677 . 0 0 "[ . 1 . 2]" 1
1492 1 11 LEU HA 1 24 ILE HA . . 3.500 3.027 2.732 3.388 . 0 0 "[ . 1 . 2]" 1
1493 1 101 THR HA 1 113 PHE QE 6.000 . 6.000 3.363 3.198 3.514 . 0 0 "[ . 1 . 2]" 1
1494 1 113 PHE QE 1 138 GLU HA 4.000 . 4.000 1.977 1.930 2.045 . 0 0 "[ . 1 . 2]" 1
1495 1 113 PHE HA 1 113 PHE QD 4.000 . 4.000 2.559 2.468 2.698 . 0 0 "[ . 1 . 2]" 1
1496 1 113 PHE QD 1 139 GLN QE 4.500 . 4.500 3.068 2.438 3.565 . 0 0 "[ . 1 . 2]" 1
1497 1 42 PHE QE 1 105 TYR QE 7.000 . 7.000 3.314 2.792 4.142 . 0 0 "[ . 1 . 2]" 1
1498 1 78 GLU HA 1 79 TRP HE3 5.000 . 5.000 3.658 3.366 3.951 . 0 0 "[ . 1 . 2]" 1
1499 1 42 PHE QD 1 105 TYR QE 4.500 . 4.500 3.537 3.393 3.580 . 0 0 "[ . 1 . 2]" 1
1500 1 47 LEU QD 1 96 LYS QE 5.000 . 5.000 2.975 1.657 3.310 0.143 8 0 "[ . 1 . 2]" 1
1501 1 88 ILE MD 1 96 LYS QE 4.000 . 4.000 1.783 1.676 2.368 0.124 13 0 "[ . 1 . 2]" 1
1502 1 47 LEU HG 1 96 LYS QE 4.000 . 4.000 2.365 1.790 2.817 0.010 8 0 "[ . 1 . 2]" 1
1503 1 55 MET H 1 55 MET ME 5.500 . 5.500 4.422 3.934 4.616 . 0 0 "[ . 1 . 2]" 1
1504 1 55 MET ME 1 85 TYR QD 6.500 . 6.500 2.739 2.171 3.226 . 0 0 "[ . 1 . 2]" 1
1505 1 55 MET HA 1 55 MET ME 5.500 . 5.500 3.821 3.018 4.587 . 0 0 "[ . 1 . 2]" 1
1506 1 53 GLN QG 1 55 MET ME 4.500 . 4.500 3.245 2.908 3.346 . 0 0 "[ . 1 . 2]" 1
1507 1 55 MET ME 1 83 VAL MG2 6.000 . 6.000 4.134 3.695 4.173 . 0 0 "[ . 1 . 2]" 1
1508 1 55 MET ME 1 83 VAL MG1 4.500 . 4.500 2.171 1.878 2.523 . 0 0 "[ . 1 . 2]" 1
1509 1 55 MET QB 1 85 TYR QE 4.500 . 4.500 2.794 2.290 3.586 . 0 0 "[ . 1 . 2]" 1
1510 1 12 GLN QB 1 23 HIS QB 6.000 . 6.000 2.212 1.938 2.433 . 0 0 "[ . 1 . 2]" 1
1511 1 25 LEU MD1 1 131 PRO QB 4.000 . 4.000 2.060 1.824 2.300 . 0 0 "[ . 1 . 2]" 1
1512 1 10 GLN QG 1 131 PRO QB 5.500 . 5.500 3.334 2.946 3.616 . 0 0 "[ . 1 . 2]" 1
1513 1 93 LEU HA 1 96 LYS QD 5.500 . 5.500 4.303 1.970 4.782 . 0 0 "[ . 1 . 2]" 1
1514 1 96 LYS HA 1 96 LYS QD 4.000 . 4.000 3.258 2.908 3.752 . 0 0 "[ . 1 . 2]" 1
1515 1 47 LEU HG 1 96 LYS QD 5.000 . 5.000 2.700 2.082 3.027 . 0 0 "[ . 1 . 2]" 1
1516 1 47 LEU QD 1 96 LYS QD 6.000 . 6.000 3.062 1.735 3.243 0.065 5 0 "[ . 1 . 2]" 1
1517 1 93 LEU HA 1 96 LYS QG 3.500 . 3.500 2.269 1.727 2.573 0.073 8 0 "[ . 1 . 2]" 1
1518 1 47 LEU QD 1 96 LYS QG 6.000 . 6.000 3.360 3.148 3.443 . 0 0 "[ . 1 . 2]" 1
1519 1 47 LEU QD 1 96 LYS QB 6.000 . 6.000 1.777 1.695 2.052 0.105 10 0 "[ . 1 . 2]" 1
1520 1 43 VAL HA 1 102 VAL HA 2.800 . 2.800 2.224 2.171 2.262 . 0 0 "[ . 1 . 2]" 1
1521 1 78 GLU H 1 78 GLU QG 4.000 . 4.000 2.506 1.946 3.216 . 0 0 "[ . 1 . 2]" 1
1522 1 44 LYS QD 1 56 VAL QG 4.500 . 4.500 2.888 2.453 2.981 . 0 0 "[ . 1 . 2]" 1
1523 1 44 LYS QD 1 54 VAL MG2 4.500 . 4.500 1.853 1.731 2.226 0.069 2 0 "[ . 1 . 2]" 1
1524 1 42 PHE QE 1 44 LYS QE 4.000 . 4.000 1.983 1.855 2.163 . 0 0 "[ . 1 . 2]" 1
1525 1 44 LYS QE 1 56 VAL QG 4.500 . 4.500 2.639 2.263 2.974 . 0 0 "[ . 1 . 2]" 1
1526 1 44 LYS HA 1 56 VAL HA 2.800 . 2.800 2.392 2.165 2.694 . 0 0 "[ . 1 . 2]" 1
1527 1 115 GLY QA 1 136 LEU QB 5.500 . 5.500 2.098 1.909 2.348 . 0 0 "[ . 1 . 2]" 1
1528 1 102 VAL MG2 1 115 GLY QA 3.300 . 3.300 2.456 2.451 2.462 . 0 0 "[ . 1 . 2]" 1
1529 1 41 PRO QB 1 79 TRP HZ2 3.500 . 3.500 2.932 2.731 3.129 . 0 0 "[ . 1 . 2]" 1
1530 1 77 PRO QG 1 79 TRP HZ2 5.500 . 5.500 2.581 2.289 2.968 . 0 0 "[ . 1 . 2]" 1
1531 1 43 VAL HB 1 57 VAL HB 2.800 . 2.800 2.812 2.750 2.827 0.027 7 0 "[ . 1 . 2]" 1
1532 1 32 PRO QG 1 75 LEU MD2 5.500 . 5.500 3.423 2.362 3.881 . 0 0 "[ . 1 . 2]" 1
1533 1 32 PRO QB 1 75 LEU MD1 5.500 . 5.500 4.073 3.990 4.090 . 0 0 "[ . 1 . 2]" 1
1534 1 20 LEU MD2 1 85 TYR QD 4.500 . 4.500 2.084 1.849 3.350 . 0 0 "[ . 1 . 2]" 1
1535 1 20 LEU MD2 1 85 TYR QE 6.500 . 6.500 2.961 2.416 3.991 . 0 0 "[ . 1 . 2]" 1
1536 1 20 LEU MD2 1 85 TYR QB 5.500 . 5.500 3.007 2.649 3.279 . 0 0 "[ . 1 . 2]" 1
1537 1 20 LEU MD2 1 47 LEU QD 5.000 . 5.000 2.086 1.867 2.394 . 0 0 "[ . 1 . 2]" 1
1538 1 90 MET H 1 90 MET ME 5.500 . 5.500 4.488 4.155 4.601 . 0 0 "[ . 1 . 2]" 1
1539 1 15 TYR QD 1 90 MET ME 4.500 . 4.500 3.101 2.695 3.345 . 0 0 "[ . 1 . 2]" 1
1540 1 90 MET HA 1 90 MET ME 4.000 . 4.000 3.218 2.822 3.366 . 0 0 "[ . 1 . 2]" 1
1541 1 15 TYR QB 1 90 MET ME 5.500 . 5.500 3.024 2.106 3.460 . 0 0 "[ . 1 . 2]" 1
1542 1 90 MET ME 1 124 THR MG 4.500 . 4.500 3.138 3.129 3.149 . 0 0 "[ . 1 . 2]" 1
1543 1 90 MET ME 1 127 LEU MD1 4.500 . 4.500 1.811 1.656 2.206 0.144 13 0 "[ . 1 . 2]" 1
1544 1 94 MET ME 1 122 SER HA 4.000 . 4.000 2.627 2.051 3.014 . 0 0 "[ . 1 . 2]" 1
1545 1 94 MET ME 1 122 SER QB 5.500 . 5.500 4.059 3.823 4.125 . 0 0 "[ . 1 . 2]" 1
1546 1 94 MET HA 1 94 MET ME 4.000 . 4.000 2.951 2.453 3.342 . 0 0 "[ . 1 . 2]" 1
1547 1 90 MET QG 1 94 MET ME 6.000 . 6.000 3.547 2.067 4.413 . 0 0 "[ . 1 . 2]" 1
1548 1 94 MET ME 1 127 LEU MD1 4.500 . 4.500 3.121 2.999 3.154 . 0 0 "[ . 1 . 2]" 1
1549 1 93 LEU MD2 1 94 MET ME 4.500 . 4.500 2.787 2.322 3.126 . 0 0 "[ . 1 . 2]" 1
1550 1 121 LEU MD2 1 124 THR MG 4.500 . 4.500 2.274 1.866 2.638 . 0 0 "[ . 1 . 2]" 1
1551 1 13 ILE MG 1 124 THR MG 4.500 . 4.500 3.133 3.128 3.139 . 0 0 "[ . 1 . 2]" 1
1552 1 98 LEU QB 1 119 ILE HB 3.500 . 3.500 2.069 1.992 2.151 . 0 0 "[ . 1 . 2]" 1
1553 1 47 LEU MD1 1 98 LEU QB 5.500 . 5.500 3.059 2.786 3.248 . 0 0 "[ . 1 . 2]" 1
1554 1 46 TYR QD 1 48 LEU HA 6.000 . 6.000 3.479 3.206 3.714 . 0 0 "[ . 1 . 2]" 1
1555 1 46 TYR QD 1 54 VAL HB 6.000 . 6.000 2.443 1.921 2.662 . 0 0 "[ . 1 . 2]" 1
1556 1 61 SER H 1 64 TYR QE 6.000 . 6.000 3.162 2.409 3.537 . 0 0 "[ . 1 . 2]" 1
1557 1 46 TYR QE 1 48 LEU HA 6.000 . 6.000 3.638 2.912 4.145 . 0 0 "[ . 1 . 2]" 1
1558 1 61 SER QB 1 64 TYR QE 4.500 . 4.500 3.425 2.750 3.581 . 0 0 "[ . 1 . 2]" 1
1559 1 46 TYR QE 1 54 VAL HB 4.000 . 4.000 3.575 3.566 3.589 . 0 0 "[ . 1 . 2]" 1
1560 1 46 TYR HD1 1 54 VAL HA 6.000 . 6.000 5.302 5.108 5.500 . 0 0 "[ . 1 . 2]" 1
1561 1 15 TYR QE 1 88 ILE HB 6.000 . 6.000 5.102 4.842 5.283 . 0 0 "[ . 1 . 2]" 1
1562 1 76 ASN HA 1 77 PRO QD 3.300 . 3.300 2.040 2.002 2.057 . 0 0 "[ . 1 . 2]" 1
1563 1 29 ASN H 1 76 ASN HA 5.000 . 5.000 4.299 4.130 4.528 . 0 0 "[ . 1 . 2]" 1
1564 1 28 ARG QG 1 133 TRP HZ3 5.500 . 5.500 2.447 2.212 2.680 . 0 0 "[ . 1 . 2]" 1
1565 1 31 VAL HA 1 32 PRO QD 3.300 . 3.300 1.950 1.897 1.988 . 0 0 "[ . 1 . 2]" 1
1566 1 134 TYR HA 1 135 PRO QD 3.300 . 3.300 1.970 1.872 2.040 . 0 0 "[ . 1 . 2]" 1
1567 1 83 VAL H 1 83 VAL MG2 3.300 . 3.300 2.696 2.537 2.755 . 0 0 "[ . 1 . 2]" 1
1568 1 93 LEU HA 1 96 LYS QB 4.000 . 4.000 3.080 2.606 3.708 . 0 0 "[ . 1 . 2]" 1
1569 1 93 LEU HA 1 96 LYS QE 5.500 . 5.500 3.391 2.049 3.819 . 0 0 "[ . 1 . 2]" 1
1570 1 103 TRP HE3 1 111 ASN QB 4.000 . 4.000 3.139 2.769 3.565 . 0 0 "[ . 1 . 2]" 1
1571 1 103 TRP HZ3 1 113 PHE QB 4.000 . 4.000 2.713 2.292 3.403 . 0 0 "[ . 1 . 2]" 1
1572 1 103 TRP HZ2 1 113 PHE QB 5.500 . 5.500 4.395 3.759 4.886 . 0 0 "[ . 1 . 2]" 1
1573 1 103 TRP HH2 1 113 PHE QB 4.000 . 4.000 3.268 2.903 3.537 . 0 0 "[ . 1 . 2]" 1
1574 1 105 TYR HA 1 111 ASN HA 3.500 . 3.500 2.645 2.170 3.328 . 0 0 "[ . 1 . 2]" 1
1575 1 113 PHE HZ 1 139 GLN HA 5.000 . 5.000 4.559 3.726 5.001 0.001 13 0 "[ . 1 . 2]" 1
1576 1 113 PHE QE 1 139 GLN HA 6.000 . 6.000 4.409 3.625 4.860 . 0 0 "[ . 1 . 2]" 1
1577 1 94 MET HA 1 122 SER HA 2.800 . 2.800 2.113 1.925 2.784 . 0 0 "[ . 1 . 2]" 1
1578 1 126 HIS HE1 1 134 TYR QE 4.000 . 4.000 2.772 2.131 3.590 . 0 0 "[ . 1 . 2]" 1
1579 1 38 TYR H 1 73 LYS QB 5.500 . 5.500 4.572 3.800 4.907 . 0 0 "[ . 1 . 2]" 1
1580 1 8 GLU QB 1 133 TRP HE3 3.500 . 3.500 2.535 2.260 2.786 . 0 0 "[ . 1 . 2]" 1
1581 1 8 GLU QG 1 133 TRP HE3 5.500 . 5.500 4.579 4.371 4.782 . 0 0 "[ . 1 . 2]" 1
1582 1 66 ARG HA 1 66 ARG QD 4.000 . 4.000 3.254 2.852 3.638 . 0 0 "[ . 1 . 2]" 1
1583 1 63 GLU HA 1 66 ARG QD 5.500 . 5.500 4.454 2.572 4.910 . 0 0 "[ . 1 . 2]" 1
1584 1 63 GLU HA 1 67 ARG QG 5.500 . 5.500 4.889 4.633 4.929 . 0 0 "[ . 1 . 2]" 1
1585 1 3 HIS HE1 1 5 ILE MD 4.000 . 4.000 2.964 2.475 3.350 . 0 0 "[ . 1 . 2]" 1
1586 1 57 VAL HB 1 81 GLN QB 5.500 . 5.500 4.531 4.347 4.852 . 0 0 "[ . 1 . 2]" 1
1587 1 57 VAL HB 1 81 GLN QG 5.500 . 5.500 4.329 4.136 4.776 . 0 0 "[ . 1 . 2]" 1
1588 1 28 ARG QB 1 133 TRP HZ3 5.500 . 5.500 2.940 2.565 3.441 . 0 0 "[ . 1 . 2]" 1
1589 1 47 LEU QD 1 88 ILE QG 6.500 . 6.500 4.285 4.215 4.307 . 0 0 "[ . 1 . 2]" 1
1590 1 7 GLY QA 1 29 ASN QB 3.500 . 3.500 1.868 1.801 1.938 . 0 0 "[ . 1 . 2]" 1
1591 1 44 LYS QG 1 56 VAL QG 5.000 . 5.000 1.975 1.856 2.549 . 0 0 "[ . 1 . 2]" 1
1592 1 41 PRO QB 1 114 LEU MD1 5.500 . 5.500 2.225 2.011 2.381 . 0 0 "[ . 1 . 2]" 1
1593 1 44 LYS QB 1 56 VAL QG 6.500 . 6.500 3.538 3.028 3.720 . 0 0 "[ . 1 . 2]" 1
1594 1 137 LYS HA 1 138 GLU QG 5.500 . 5.500 3.449 3.270 3.629 . 0 0 "[ . 1 . 2]" 1
1595 1 5 ILE QG 1 138 GLU QG 4.000 . 4.000 2.683 2.182 3.160 . 0 0 "[ . 1 . 2]" 1
1596 1 62 ALA HA 1 65 LYS QB 4.000 . 4.000 2.248 2.029 2.511 . 0 0 "[ . 1 . 2]" 1
1597 1 62 ALA HA 1 66 ARG QG 4.000 . 4.000 3.494 2.856 3.724 . 0 0 "[ . 1 . 2]" 1
1598 1 22 ILE H 1 83 VAL MG1 5.500 . 5.500 4.455 4.131 4.595 . 0 0 "[ . 1 . 2]" 1
1599 1 10 GLN QB 1 25 LEU QB 5.500 . 5.500 2.148 2.036 2.286 . 0 0 "[ . 1 . 2]" 1
1600 1 99 GLU QG 1 118 LEU QD 4.500 . 4.500 2.042 1.734 2.707 0.066 16 0 "[ . 1 . 2]" 1
1601 1 64 TYR HA 1 67 ARG QB 4.000 . 4.000 3.091 2.554 3.569 . 0 0 "[ . 1 . 2]" 1
1602 1 64 TYR HA 1 67 ARG QG 5.500 . 5.500 4.131 3.497 4.919 . 0 0 "[ . 1 . 2]" 1
1603 1 20 LEU QB 1 85 TYR QB 4.500 . 4.500 2.014 1.777 2.263 0.023 5 0 "[ . 1 . 2]" 1
1604 1 11 LEU QB 1 134 TYR QE 4.500 . 4.500 3.002 2.445 3.544 . 0 0 "[ . 1 . 2]" 1
1605 1 48 LEU QB 1 97 THR HB 4.000 . 4.000 2.988 2.402 3.547 . 0 0 "[ . 1 . 2]" 1
1606 1 48 LEU HG 1 97 THR HB 3.500 . 3.500 2.029 1.916 2.433 . 0 0 "[ . 1 . 2]" 1
1607 1 118 LEU QB 1 137 LYS QE 6.000 . 6.000 4.045 3.344 4.676 . 0 0 "[ . 1 . 2]" 1
1608 1 118 LEU MD1 1 137 LYS QE 5.000 . 5.000 3.001 2.400 3.596 . 0 0 "[ . 1 . 2]" 1
1609 1 41 PRO QG 1 77 PRO QG 4.500 . 4.500 2.170 1.866 2.776 . 0 0 "[ . 1 . 2]" 1
1610 1 20 LEU MD1 1 47 LEU QD 6.000 . 6.000 3.725 3.715 3.734 . 0 0 "[ . 1 . 2]" 1
1611 1 15 TYR QD 1 20 LEU QB 6.000 . 6.000 2.896 2.666 3.158 . 0 0 "[ . 1 . 2]" 1
1612 1 83 VAL MG2 1 85 TYR QE 6.500 . 6.500 4.538 4.251 4.832 . 0 0 "[ . 1 . 2]" 1
1613 1 25 LEU HA 1 80 ASN H 3.500 . 3.500 2.105 1.976 2.185 . 0 0 "[ . 1 . 2]" 1
1614 1 94 MET QB 1 122 SER HA 3.300 . 3.300 2.175 1.865 2.723 . 0 0 "[ . 1 . 2]" 1
1615 1 124 THR HB 1 127 LEU MD1 5.500 . 5.500 4.262 2.135 4.586 . 0 0 "[ . 1 . 2]" 1
1616 1 26 GLN QG 1 133 TRP HH2 4.000 . 4.000 2.562 1.970 3.467 . 0 0 "[ . 1 . 2]" 1
1617 1 28 ARG QB 1 76 ASN HA 5.500 . 5.500 4.165 3.913 4.524 . 0 0 "[ . 1 . 2]" 1
1618 1 63 GLU HA 1 66 ARG QG 4.000 . 4.000 3.059 1.749 3.576 0.051 7 0 "[ . 1 . 2]" 1
1619 1 30 LEU MD1 1 41 PRO QG 4.500 . 4.500 3.314 3.092 3.350 . 0 0 "[ . 1 . 2]" 1
1620 1 56 VAL H 1 56 VAL HB 2.800 . 2.800 2.599 2.527 2.771 . 0 0 "[ . 1 . 2]" 1
1621 1 94 MET HA 1 122 SER H 5.000 . 5.000 3.423 3.009 3.866 . 0 0 "[ . 1 . 2]" 1
1622 1 24 ILE QG 1 57 VAL MG2 4.500 . 4.500 2.148 1.754 2.440 0.046 20 0 "[ . 1 . 2]" 1
1623 1 88 ILE MG 1 93 LEU QB 4.500 . 4.500 1.857 1.674 2.539 0.126 10 0 "[ . 1 . 2]" 1
1624 1 26 GLN QE 1 133 TRP HZ2 4.000 . 4.000 3.116 2.534 3.565 . 0 0 "[ . 1 . 2]" 1
1625 1 5 ILE H 1 31 VAL HB 5.000 . 5.000 5.024 5.006 5.048 0.048 10 0 "[ . 1 . 2]" 1
1626 1 72 GLN HA 1 76 ASN H 3.500 . 3.500 2.378 2.031 3.166 . 0 0 "[ . 1 . 2]" 1
1627 1 72 GLN QB 1 76 ASN H 5.500 . 5.500 3.857 2.937 4.648 . 0 0 "[ . 1 . 2]" 1
1628 1 67 ARG QG 1 70 TYR QD 6.500 . 6.500 5.152 4.948 5.194 . 0 0 "[ . 1 . 2]" 1
1629 1 68 THR MG 1 72 GLN QG 4.500 . 4.500 3.282 3.041 3.343 . 0 0 "[ . 1 . 2]" 1
1630 1 64 TYR QD 1 68 THR MG 6.500 . 6.500 2.839 2.192 3.842 . 0 0 "[ . 1 . 2]" 1
1631 1 64 TYR QE 1 68 THR MG 6.500 . 6.500 2.835 2.335 3.976 . 0 0 "[ . 1 . 2]" 1
1632 1 68 THR MG 1 72 GLN QB 3.800 . 3.800 2.793 2.549 2.839 . 0 0 "[ . 1 . 2]" 1
1633 1 65 LYS QD 1 68 THR MG 3.800 . 3.800 2.836 2.823 2.847 . 0 0 "[ . 1 . 2]" 1
1634 1 68 THR MG 1 72 GLN QE 6.000 . 6.000 3.704 2.259 4.452 . 0 0 "[ . 1 . 2]" 1
1635 1 65 LYS QE 1 68 THR MG 6.000 . 6.000 3.842 3.196 4.399 . 0 0 "[ . 1 . 2]" 1
1636 1 12 GLN QG 1 129 ASN HA 5.500 . 5.500 2.225 1.916 2.826 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 116
_Distance_constraint_stats_list.Viol_count 79
_Distance_constraint_stats_list.Viol_total 16.172
_Distance_constraint_stats_list.Viol_max 0.053
_Distance_constraint_stats_list.Viol_rms 0.0024
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0102
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 GLY 0.004 0.004 9 0 "[ . 1 . 2]"
1 8 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ILE 0.003 0.003 5 0 "[ . 1 . 2]"
1 14 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ASN 0.001 0.001 3 0 "[ . 1 . 2]"
1 20 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 ILE 0.167 0.022 5 0 "[ . 1 . 2]"
1 25 LEU 0.016 0.016 1 0 "[ . 1 . 2]"
1 26 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 ASN 0.018 0.010 18 0 "[ . 1 . 2]"
1 30 LEU 0.047 0.014 2 0 "[ . 1 . 2]"
1 41 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LEU 0.047 0.014 2 0 "[ . 1 . 2]"
1 76 ASN 0.018 0.010 18 0 "[ . 1 . 2]"
1 77 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ASN 0.016 0.016 1 0 "[ . 1 . 2]"
1 81 GLN 0.167 0.022 5 0 "[ . 1 . 2]"
1 83 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 SER 0.001 0.001 3 0 "[ . 1 . 2]"
1 88 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 GLN 0.078 0.015 7 0 "[ . 1 . 2]"
1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LYS 0.152 0.053 5 0 "[ . 1 . 2]"
1 97 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 VAL 0.010 0.006 17 0 "[ . 1 . 2]"
1 103 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 ASP 0.013 0.005 6 0 "[ . 1 . 2]"
1 110 SER 0.013 0.005 6 0 "[ . 1 . 2]"
1 112 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 GLY 0.010 0.006 17 0 "[ . 1 . 2]"
1 116 GLU 0.024 0.015 9 0 "[ . 1 . 2]"
1 117 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 ASP 0.186 0.037 5 0 "[ . 1 . 2]"
1 121 LEU 0.075 0.053 5 0 "[ . 1 . 2]"
1 123 SER 0.186 0.037 5 0 "[ . 1 . 2]"
1 124 THR 0.168 0.021 12 0 "[ . 1 . 2]"
1 127 LEU 0.168 0.021 12 0 "[ . 1 . 2]"
1 129 ASN 0.003 0.003 5 0 "[ . 1 . 2]"
1 132 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 134 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 LEU 0.004 0.004 9 0 "[ . 1 . 2]"
1 137 LYS 0.024 0.015 9 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 41 PRO O 1 79 TRP HE1 2.000 . 2.500 1.892 1.641 2.114 . 0 0 "[ . 1 . 2]" 2
2 1 101 THR OG1 1 103 TRP HE1 2.000 . 2.500 2.069 1.696 2.340 . 0 0 "[ . 1 . 2]" 2
3 1 8 GLU H 1 28 ARG O 2.000 . 2.500 1.859 1.688 2.077 . 0 0 "[ . 1 . 2]" 2
4 1 9 ILE H 1 134 TYR O 2.000 . 2.500 1.838 1.703 2.051 . 0 0 "[ . 1 . 2]" 2
5 1 10 GLN H 1 26 GLN O 2.000 . 2.500 1.723 1.606 1.964 . 0 0 "[ . 1 . 2]" 2
6 1 11 LEU H 1 132 ARG O 2.000 . 2.500 2.224 1.982 2.422 . 0 0 "[ . 1 . 2]" 2
7 1 12 GLN H 1 23 HIS O 2.000 . 2.500 1.881 1.651 2.204 . 0 0 "[ . 1 . 2]" 2
8 1 14 ASN H 1 21 ILE O 2.000 . 2.500 1.858 1.765 1.971 . 0 0 "[ . 1 . 2]" 2
9 1 16 ASP H 1 19 ASN O 2.000 . 2.500 1.815 1.777 1.862 . 0 0 "[ . 1 . 2]" 2
10 1 16 ASP O 1 19 ASN H 2.000 . 2.500 1.790 1.721 1.928 . 0 0 "[ . 1 . 2]" 2
11 1 20 LEU H 1 85 TYR O 2.000 . 2.500 2.275 2.184 2.481 . 0 0 "[ . 1 . 2]" 2
12 1 14 ASN O 1 21 ILE H 2.000 . 2.500 1.813 1.725 2.255 . 0 0 "[ . 1 . 2]" 2
13 1 22 ILE H 1 83 VAL O 2.000 . 2.500 1.783 1.659 2.028 . 0 0 "[ . 1 . 2]" 2
14 1 12 GLN O 1 23 HIS H 2.000 . 2.500 1.886 1.667 2.242 . 0 0 "[ . 1 . 2]" 2
15 1 24 ILE H 1 81 GLN O 2.000 . 2.500 2.369 1.977 2.522 0.022 5 0 "[ . 1 . 2]" 2
16 1 10 GLN O 1 25 LEU H 2.000 . 2.500 1.984 1.801 2.283 . 0 0 "[ . 1 . 2]" 2
17 1 27 ALA H 1 77 PRO O 2.000 . 2.500 2.030 1.801 2.364 . 0 0 "[ . 1 . 2]" 2
18 1 8 GLU O 1 28 ARG H 2.000 . 2.500 2.028 1.740 2.257 . 0 0 "[ . 1 . 2]" 2
19 1 29 ASN H 1 76 ASN OD1 2.000 . 2.500 2.262 2.036 2.510 0.010 18 0 "[ . 1 . 2]" 2
20 1 30 LEU H 1 75 LEU O 2.000 . 2.500 2.389 2.134 2.514 0.014 2 0 "[ . 1 . 2]" 2
21 1 42 PHE H 1 103 TRP O 2.000 . 2.500 1.719 1.622 1.862 . 0 0 "[ . 1 . 2]" 2
22 1 44 LYS H 1 101 THR O 2.000 . 2.500 1.701 1.630 1.802 . 0 0 "[ . 1 . 2]" 2
23 1 45 VAL H 1 55 MET O 2.000 . 2.500 1.923 1.667 2.321 . 0 0 "[ . 1 . 2]" 2
24 1 48 LEU H 1 97 THR O 2.000 . 2.500 2.270 1.912 2.461 . 0 0 "[ . 1 . 2]" 2
25 1 45 VAL O 1 55 MET H 2.000 . 2.500 2.272 2.135 2.464 . 0 0 "[ . 1 . 2]" 2
26 1 43 VAL O 1 57 VAL H 2.000 . 2.500 2.124 1.802 2.321 . 0 0 "[ . 1 . 2]" 2
27 1 25 LEU O 1 79 TRP H 2.000 . 2.500 1.698 1.584 1.786 . 0 0 "[ . 1 . 2]" 2
28 1 25 LEU O 1 80 ASN H 2.000 . 2.500 2.212 1.979 2.516 0.016 1 0 "[ . 1 . 2]" 2
29 1 24 ILE O 1 81 GLN H 2.000 . 2.500 1.889 1.681 2.076 . 0 0 "[ . 1 . 2]" 2
30 1 22 ILE O 1 83 VAL H 2.000 . 2.500 1.835 1.679 2.136 . 0 0 "[ . 1 . 2]" 2
31 1 20 LEU O 1 85 TYR H 2.000 . 2.500 1.770 1.631 1.931 . 0 0 "[ . 1 . 2]" 2
32 1 19 ASN OD1 1 87 SER H 2.000 . 2.500 2.405 2.273 2.501 0.001 3 0 "[ . 1 . 2]" 2
33 1 18 GLY O 1 88 ILE H 2.000 . 2.500 1.982 1.857 2.106 . 0 0 "[ . 1 . 2]" 2
34 1 89 SER O 1 93 LEU H 2.000 . 2.500 1.636 1.577 1.757 . 0 0 "[ . 1 . 2]" 2
35 1 90 MET O 1 94 MET H 2.000 . 2.500 2.150 1.923 2.415 . 0 0 "[ . 1 . 2]" 2
36 1 92 GLN O 1 96 LYS H 2.000 . 2.500 2.462 2.307 2.515 0.015 7 0 "[ . 1 . 2]" 2
37 1 98 LEU H 1 119 ILE O 2.000 . 2.500 1.964 1.861 2.083 . 0 0 "[ . 1 . 2]" 2
38 1 46 TYR O 1 99 GLU H 2.000 . 2.500 2.299 1.968 2.466 . 0 0 "[ . 1 . 2]" 2
39 1 100 VAL H 1 117 VAL O 2.000 . 2.500 1.993 1.762 2.343 . 0 0 "[ . 1 . 2]" 2
40 1 44 LYS O 1 101 THR H 2.000 . 2.500 2.064 1.855 2.271 . 0 0 "[ . 1 . 2]" 2
41 1 102 VAL H 1 115 GLY O 2.000 . 2.500 1.659 1.621 1.686 . 0 0 "[ . 1 . 2]" 2
42 1 42 PHE O 1 103 TRP H 2.000 . 2.500 1.675 1.621 1.780 . 0 0 "[ . 1 . 2]" 2
43 1 104 ASP H 1 112 ASP O 2.000 . 2.500 1.733 1.625 1.932 . 0 0 "[ . 1 . 2]" 2
44 1 106 ASP H 1 110 SER O 2.000 . 2.500 2.209 1.673 2.505 0.005 6 0 "[ . 1 . 2]" 2
45 1 104 ASP O 1 112 ASP H 2.000 . 2.500 1.790 1.655 2.085 . 0 0 "[ . 1 . 2]" 2
46 1 102 VAL O 1 114 LEU H 2.000 . 2.500 2.046 1.981 2.146 . 0 0 "[ . 1 . 2]" 2
47 1 102 VAL O 1 115 GLY H 2.000 . 2.500 2.425 2.315 2.506 0.006 17 0 "[ . 1 . 2]" 2
48 1 116 GLU H 1 137 LYS O 2.000 . 2.500 2.337 2.037 2.515 0.015 9 0 "[ . 1 . 2]" 2
49 1 100 VAL O 1 117 VAL H 2.000 . 2.500 1.636 1.612 1.672 . 0 0 "[ . 1 . 2]" 2
50 1 98 LEU O 1 119 ILE H 2.000 . 2.500 1.746 1.661 1.938 . 0 0 "[ . 1 . 2]" 2
51 1 96 LYS O 1 121 LEU H 2.000 . 2.500 2.422 2.294 2.553 0.053 5 0 "[ . 1 . 2]" 2
52 1 120 ASP O 1 123 SER H 2.000 . 2.500 2.481 2.240 2.537 0.037 5 0 "[ . 1 . 2]" 2
53 1 124 THR O 1 127 LEU H 2.000 . 2.500 2.481 2.280 2.521 0.021 12 0 "[ . 1 . 2]" 2
54 1 13 ILE O 1 129 ASN H 2.000 . 2.500 2.431 2.367 2.503 0.003 5 0 "[ . 1 . 2]" 2
55 1 11 LEU O 1 132 ARG H 2.000 . 2.500 2.239 2.015 2.366 . 0 0 "[ . 1 . 2]" 2
56 1 9 ILE O 1 134 TYR H 2.000 . 2.500 1.679 1.597 1.898 . 0 0 "[ . 1 . 2]" 2
57 1 7 GLY O 1 136 LEU H 2.000 . 2.500 2.369 2.210 2.504 0.004 9 0 "[ . 1 . 2]" 2
58 1 116 GLU O 1 137 LYS H 2.000 . 2.500 1.765 1.644 1.951 . 0 0 "[ . 1 . 2]" 2
59 1 8 GLU N 1 28 ARG O 3.000 2.300 3.500 2.725 2.579 2.899 . 0 0 "[ . 1 . 2]" 2
60 1 9 ILE N 1 134 TYR O 3.000 2.300 3.500 2.779 2.587 3.019 . 0 0 "[ . 1 . 2]" 2
61 1 10 GLN N 1 26 GLN O 3.000 2.300 3.500 2.575 2.524 2.699 . 0 0 "[ . 1 . 2]" 2
62 1 11 LEU N 1 132 ARG O 3.000 2.300 3.500 3.153 2.912 3.359 . 0 0 "[ . 1 . 2]" 2
63 1 12 GLN N 1 23 HIS O 3.000 2.300 3.500 2.805 2.565 3.147 . 0 0 "[ . 1 . 2]" 2
64 1 14 ASN N 1 21 ILE O 3.000 2.300 3.500 2.758 2.648 2.892 . 0 0 "[ . 1 . 2]" 2
65 1 16 ASP N 1 19 ASN O 3.000 2.300 3.500 2.749 2.712 2.809 . 0 0 "[ . 1 . 2]" 2
66 1 16 ASP O 1 19 ASN N 3.000 2.300 3.500 2.669 2.590 2.811 . 0 0 "[ . 1 . 2]" 2
67 1 20 LEU N 1 85 TYR O 3.000 2.300 3.500 3.227 3.136 3.430 . 0 0 "[ . 1 . 2]" 2
68 1 14 ASN O 1 21 ILE N 3.000 2.300 3.500 2.616 2.534 3.017 . 0 0 "[ . 1 . 2]" 2
69 1 22 ILE N 1 83 VAL O 3.000 2.300 3.500 2.718 2.605 2.927 . 0 0 "[ . 1 . 2]" 2
70 1 12 GLN O 1 23 HIS N 3.000 2.300 3.500 2.804 2.634 3.125 . 0 0 "[ . 1 . 2]" 2
71 1 24 ILE N 1 81 GLN O 3.000 2.300 3.500 2.943 2.690 3.082 . 0 0 "[ . 1 . 2]" 2
72 1 10 GLN O 1 25 LEU N 3.000 2.300 3.500 2.809 2.647 3.102 . 0 0 "[ . 1 . 2]" 2
73 1 27 ALA N 1 77 PRO O 3.000 2.300 3.500 2.972 2.724 3.319 . 0 0 "[ . 1 . 2]" 2
74 1 8 GLU O 1 28 ARG N 3.000 2.300 3.500 2.877 2.649 3.101 . 0 0 "[ . 1 . 2]" 2
75 1 29 ASN N 1 76 ASN OD1 3.000 2.300 3.500 3.099 2.867 3.367 . 0 0 "[ . 1 . 2]" 2
76 1 30 LEU N 1 75 LEU O 3.000 2.300 3.500 3.288 3.058 3.441 . 0 0 "[ . 1 . 2]" 2
77 1 42 PHE N 1 103 TRP O 3.000 2.300 3.500 2.657 2.578 2.808 . 0 0 "[ . 1 . 2]" 2
78 1 44 LYS N 1 101 THR O 3.000 2.300 3.500 2.597 2.551 2.683 . 0 0 "[ . 1 . 2]" 2
79 1 45 VAL N 1 55 MET O 3.000 2.300 3.500 2.879 2.646 3.123 . 0 0 "[ . 1 . 2]" 2
80 1 48 LEU N 1 97 THR O 3.000 2.300 3.500 3.128 2.790 3.334 . 0 0 "[ . 1 . 2]" 2
81 1 45 VAL O 1 55 MET N 3.000 2.300 3.500 3.152 3.037 3.396 . 0 0 "[ . 1 . 2]" 2
82 1 43 VAL O 1 57 VAL N 3.000 2.300 3.500 2.945 2.708 3.174 . 0 0 "[ . 1 . 2]" 2
83 1 25 LEU O 1 79 TRP N 3.000 2.300 3.500 2.480 2.425 2.540 . 0 0 "[ . 1 . 2]" 2
84 1 25 LEU O 1 80 ASN N 3.000 2.300 3.500 3.136 2.928 3.364 . 0 0 "[ . 1 . 2]" 2
85 1 24 ILE O 1 81 GLN N 3.000 2.300 3.500 2.804 2.561 3.006 . 0 0 "[ . 1 . 2]" 2
86 1 22 ILE O 1 83 VAL N 3.000 2.300 3.500 2.740 2.596 2.995 . 0 0 "[ . 1 . 2]" 2
87 1 20 LEU O 1 85 TYR N 3.000 2.300 3.500 2.586 2.536 2.747 . 0 0 "[ . 1 . 2]" 2
88 1 19 ASN OD1 1 87 SER N 3.000 2.300 3.500 3.290 3.208 3.370 . 0 0 "[ . 1 . 2]" 2
89 1 18 GLY O 1 88 ILE N 3.000 2.300 3.500 2.858 2.707 2.970 . 0 0 "[ . 1 . 2]" 2
90 1 89 SER O 1 93 LEU N 3.000 2.300 3.500 2.569 2.512 2.712 . 0 0 "[ . 1 . 2]" 2
91 1 90 MET O 1 94 MET N 3.000 2.300 3.500 3.078 2.853 3.377 . 0 0 "[ . 1 . 2]" 2
92 1 92 GLN O 1 96 LYS N 3.000 2.300 3.500 3.081 2.966 3.169 . 0 0 "[ . 1 . 2]" 2
93 1 98 LEU N 1 119 ILE O 3.000 2.300 3.500 2.801 2.581 2.943 . 0 0 "[ . 1 . 2]" 2
94 1 46 TYR O 1 99 GLU N 3.000 2.300 3.500 3.242 2.946 3.364 . 0 0 "[ . 1 . 2]" 2
95 1 100 VAL N 1 117 VAL O 3.000 2.300 3.500 2.775 2.625 2.999 . 0 0 "[ . 1 . 2]" 2
96 1 44 LYS O 1 101 THR N 3.000 2.300 3.500 2.900 2.740 3.041 . 0 0 "[ . 1 . 2]" 2
97 1 102 VAL N 1 115 GLY O 3.000 2.300 3.500 2.587 2.561 2.612 . 0 0 "[ . 1 . 2]" 2
98 1 42 PHE O 1 103 TRP N 3.000 2.300 3.500 2.637 2.561 2.747 . 0 0 "[ . 1 . 2]" 2
99 1 104 ASP N 1 112 ASP O 3.000 2.300 3.500 2.670 2.572 2.830 . 0 0 "[ . 1 . 2]" 2
100 1 106 ASP N 1 110 SER O 3.000 2.300 3.500 3.073 2.549 3.409 . 0 0 "[ . 1 . 2]" 2
101 1 104 ASP O 1 112 ASP N 3.000 2.300 3.500 2.677 2.573 2.953 . 0 0 "[ . 1 . 2]" 2
102 1 102 VAL O 1 114 LEU N 3.000 2.300 3.500 2.721 2.585 2.876 . 0 0 "[ . 1 . 2]" 2
103 1 102 VAL O 1 115 GLY N 3.000 2.300 3.500 3.270 3.151 3.343 . 0 0 "[ . 1 . 2]" 2
104 1 116 GLU N 1 137 LYS O 3.000 2.300 3.500 3.098 2.859 3.308 . 0 0 "[ . 1 . 2]" 2
105 1 100 VAL O 1 117 VAL N 3.000 2.300 3.500 2.586 2.559 2.642 . 0 0 "[ . 1 . 2]" 2
106 1 98 LEU O 1 119 ILE N 3.000 2.300 3.500 2.669 2.562 2.841 . 0 0 "[ . 1 . 2]" 2
107 1 96 LYS O 1 121 LEU N 3.000 2.300 3.500 3.270 3.129 3.377 . 0 0 "[ . 1 . 2]" 2
108 1 120 ASP O 1 123 SER N 3.000 2.300 3.500 3.444 3.167 3.519 0.019 5 0 "[ . 1 . 2]" 2
109 1 124 THR O 1 127 LEU N 3.000 2.300 3.500 3.344 3.135 3.434 . 0 0 "[ . 1 . 2]" 2
110 1 13 ILE O 1 129 ASN N 3.000 2.300 3.500 3.097 3.019 3.223 . 0 0 "[ . 1 . 2]" 2
111 1 11 LEU O 1 132 ARG N 3.000 2.300 3.500 3.140 2.891 3.319 . 0 0 "[ . 1 . 2]" 2
112 1 9 ILE O 1 134 TYR N 3.000 2.300 3.500 2.580 2.548 2.630 . 0 0 "[ . 1 . 2]" 2
113 1 7 GLY O 1 136 LEU N 3.000 2.300 3.500 3.250 3.098 3.372 . 0 0 "[ . 1 . 2]" 2
114 1 116 GLU O 1 137 LYS N 3.000 2.300 3.500 2.628 2.554 2.792 . 0 0 "[ . 1 . 2]" 2
115 1 41 PRO O 1 79 TRP NE1 3.000 2.300 3.500 2.849 2.609 3.081 . 0 0 "[ . 1 . 2]" 2
116 1 101 THR OG1 1 103 TRP NE1 3.000 2.300 3.500 2.956 2.625 3.214 . 0 0 "[ . 1 . 2]" 2
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