NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
380732 |
1ik0   |
5004 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ik0
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 2112
_Distance_constraint_stats_list.Viol_count 1020
_Distance_constraint_stats_list.Viol_total 2564.255
_Distance_constraint_stats_list.Viol_max 0.769
_Distance_constraint_stats_list.Viol_rms 0.0159
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0013
_Distance_constraint_stats_list.Viol_average_violations_only 0.0838
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 3 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 4 VAL 2.821 0.125 14 0 "[ . 1 . 2 . 3]"
1 5 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 6 PRO 6.234 0.170 28 0 "[ . 1 . 2 . 3]"
1 7 SER 2.743 0.090 20 0 "[ . 1 . 2 . 3]"
1 8 THR 2.867 0.170 28 0 "[ . 1 . 2 . 3]"
1 9 ALA 1.844 0.138 16 0 "[ . 1 . 2 . 3]"
1 10 LEU 1.518 0.139 24 0 "[ . 1 . 2 . 3]"
1 11 ARG 0.255 0.081 19 0 "[ . 1 . 2 . 3]"
1 12 GLU 1.844 0.138 16 0 "[ . 1 . 2 . 3]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 15 GLU 0.004 0.004 3 0 "[ . 1 . 2 . 3]"
1 16 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 18 VAL 0.004 0.004 3 0 "[ . 1 . 2 . 3]"
1 19 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 20 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 21 THR 0.941 0.112 27 0 "[ . 1 . 2 . 3]"
1 22 GLN 1.302 0.076 28 0 "[ . 1 . 2 . 3]"
1 23 ASN 1.220 0.076 28 0 "[ . 1 . 2 . 3]"
1 24 GLN 0.766 0.112 27 0 "[ . 1 . 2 . 3]"
1 25 LYS 0.066 0.023 11 0 "[ . 1 . 2 . 3]"
1 26 ALA 0.066 0.023 11 0 "[ . 1 . 2 . 3]"
1 27 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 28 LEU 1.335 0.078 17 0 "[ . 1 . 2 . 3]"
1 29 CYS 1.506 0.078 17 0 "[ . 1 . 2 . 3]"
1 30 ASN 0.375 0.106 5 0 "[ . 1 . 2 . 3]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 32 SER 0.129 0.076 1 0 "[ . 1 . 2 . 3]"
1 33 MET 0.143 0.097 15 0 "[ . 1 . 2 . 3]"
1 34 VAL 0.140 0.066 15 0 "[ . 1 . 2 . 3]"
1 35 TRP 9.268 0.184 21 0 "[ . 1 . 2 . 3]"
1 36 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 37 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 38 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 39 LEU 0.107 0.048 16 0 "[ . 1 . 2 . 3]"
1 40 THR 0.136 0.075 1 0 "[ . 1 . 2 . 3]"
1 41 ALA 0.000 0.000 4 0 "[ . 1 . 2 . 3]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 43 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 44 TYR 0.081 0.061 9 0 "[ . 1 . 2 . 3]"
1 45 CYS 2.996 0.240 24 0 "[ . 1 . 2 . 3]"
1 46 ALA 0.008 0.008 10 0 "[ . 1 . 2 . 3]"
1 47 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 48 LEU 1.048 0.153 15 0 "[ . 1 . 2 . 3]"
1 49 GLU 0.989 0.151 26 0 "[ . 1 . 2 . 3]"
1 50 SER 0.640 0.092 26 0 "[ . 1 . 2 . 3]"
1 51 LEU 0.251 0.066 15 0 "[ . 1 . 2 . 3]"
1 52 ILE 1.394 0.153 15 0 "[ . 1 . 2 . 3]"
1 53 ASN 0.782 0.135 16 0 "[ . 1 . 2 . 3]"
1 54 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 56 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 57 CYS 0.231 0.048 4 0 "[ . 1 . 2 . 3]"
1 58 SER 1.832 0.208 11 0 "[ . 1 . 2 . 3]"
1 59 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 60 ILE 0.625 0.083 14 0 "[ . 1 . 2 . 3]"
1 61 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 62 LYS 1.832 0.208 11 0 "[ . 1 . 2 . 3]"
1 63 THR 0.666 0.083 14 0 "[ . 1 . 2 . 3]"
1 64 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 65 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 66 MET 0.254 0.054 4 0 "[ . 1 . 2 . 3]"
1 67 LEU 0.041 0.041 4 0 "[ . 1 . 2 . 3]"
1 68 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 69 GLY 0.254 0.054 4 0 "[ . 1 . 2 . 3]"
1 70 PHE 0.528 0.076 25 0 "[ . 1 . 2 . 3]"
1 71 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 72 PRO 0.128 0.029 26 0 "[ . 1 . 2 . 3]"
1 73 HIS 5.115 0.240 24 0 "[ . 1 . 2 . 3]"
1 74 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 75 VAL 2.306 0.208 15 0 "[ . 1 . 2 . 3]"
1 76 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 77 ALA 0.933 0.140 10 0 "[ . 1 . 2 . 3]"
1 78 GLY 0.417 0.193 26 0 "[ . 1 . 2 . 3]"
1 79 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 80 PHE 1.681 0.193 26 0 "[ . 1 . 2 . 3]"
1 81 SER 0.159 0.070 26 0 "[ . 1 . 2 . 3]"
1 82 SER 2.207 0.186 29 0 "[ . 1 . 2 . 3]"
1 83 LEU 4.421 0.352 7 0 "[ . 1 . 2 . 3]"
1 84 HIS 3.354 0.186 29 0 "[ . 1 . 2 . 3]"
1 85 VAL 0.793 0.057 1 0 "[ . 1 . 2 . 3]"
1 86 ARG 0.140 0.061 29 0 "[ . 1 . 2 . 3]"
1 87 ASP 0.005 0.005 9 0 "[ . 1 . 2 . 3]"
1 88 THR 1.023 0.179 9 0 "[ . 1 . 2 . 3]"
1 89 LYS 4.083 0.125 2 0 "[ . 1 . 2 . 3]"
1 90 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 91 GLU 0.217 0.097 15 0 "[ . 1 . 2 . 3]"
1 92 VAL 14.328 0.769 14 9 "[* * . *1 +- 2 * *.* * 3]"
1 93 ALA 6.226 0.398 14 0 "[ . 1 . 2 . 3]"
1 94 GLN 5.858 0.321 5 0 "[ . 1 . 2 . 3]"
1 95 PHE 6.653 0.232 23 0 "[ . 1 . 2 . 3]"
1 96 VAL 32.029 0.769 14 9 "[* * . *1 +- 2 * *.* * 3]"
1 97 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 98 ASP 0.225 0.048 14 0 "[ . 1 . 2 . 3]"
1 99 LEU 0.812 0.128 29 0 "[ . 1 . 2 . 3]"
1 100 LEU 0.238 0.048 14 0 "[ . 1 . 2 . 3]"
1 101 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 102 HIS 2.388 0.159 29 0 "[ . 1 . 2 . 3]"
1 103 LEU 2.160 0.159 29 0 "[ . 1 . 2 . 3]"
1 104 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 105 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 106 LEU 1.818 0.130 19 0 "[ . 1 . 2 . 3]"
1 107 PHE 1.424 0.139 24 0 "[ . 1 . 2 . 3]"
1 108 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 109 GLU 0.032 0.032 16 0 "[ . 1 . 2 . 3]"
1 110 GLY 3.460 0.152 5 0 "[ . 1 . 2 . 3]"
1 111 ARG 0.397 0.070 24 0 "[ . 1 . 2 . 3]"
1 112 PHE 7.540 0.167 14 0 "[ . 1 . 2 . 3]"
1 113 ASN 0.220 0.061 9 0 "[ . 1 . 2 . 3]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 GLY QA 1 3 PRO QD 2.500 . 4.700 2.010 1.994 2.023 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 2 GLY QA 1 3 PRO HA 4.000 . 6.000 4.093 4.073 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 2 GLY QA 1 3 PRO QG 4.000 . 7.000 3.739 3.698 3.767 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 3 PRO HB3 1 4 VAL H 4.000 . 5.000 3.191 2.756 3.870 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 3 PRO HB2 1 4 VAL H 4.000 . 5.000 3.145 2.505 3.688 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 3 PRO QD 1 4 VAL H 4.000 . 6.000 5.079 4.980 5.121 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 3 PRO QB 1 4 VAL HA 4.000 . 6.000 4.477 4.360 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 4 VAL HA 1 4 VAL QG 3.000 . 3.900 2.245 2.105 2.315 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 4 VAL H 1 4 VAL QG 3.000 . 5.200 1.746 1.703 2.084 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 4 VAL H 1 4 VAL HB 3.000 . 3.500 3.562 2.576 3.625 0.125 14 0 "[ . 1 . 2 . 3]" 1
11 1 4 VAL QG 1 8 THR H 4.000 . 7.400 4.970 4.249 5.438 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 4 VAL QG 1 9 ALA H 4.000 . 7.400 3.510 2.905 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 4 VAL HA 1 5 PRO HD3 3.000 . 4.300 2.280 2.244 2.320 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 4 VAL HA 1 5 PRO HD2 3.000 . 4.300 2.406 2.322 2.502 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 4 VAL QG 1 5 PRO HD3 4.000 . 8.400 3.674 3.259 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 4 VAL QG 1 5 PRO HD2 4.000 . 8.400 3.041 2.192 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 4 VAL QG 1 8 THR HB 4.000 . 7.400 3.514 2.450 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 4 VAL QG 1 6 PRO HA 4.000 . 7.400 4.650 4.378 4.901 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 4 VAL QG 1 5 PRO HA 4.000 . 7.400 4.430 4.237 4.564 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 4 VAL HB 1 5 PRO QD 4.000 . 6.000 2.470 2.277 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 4 VAL HA 1 8 THR MG 4.000 . 6.500 4.413 3.999 4.793 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 4 VAL QG 1 6 PRO QD 4.000 . 8.400 5.118 4.882 5.277 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 4 VAL HB 1 9 ALA MB 4.000 . 6.500 3.765 2.941 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 4 VAL HB 1 8 THR HB 4.000 . 5.000 2.871 2.303 5.038 0.038 18 0 "[ . 1 . 2 . 3]" 1
25 1 4 VAL HB 1 9 ALA H 4.000 . 5.000 3.954 3.549 4.744 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 4 VAL HA 1 5 PRO QG 4.000 . 6.000 4.026 3.983 4.057 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 5 PRO QD 1 8 THR MG 4.000 . 7.500 2.981 2.795 3.151 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 5 PRO HA 1 6 PRO HD3 3.000 . 4.300 2.292 2.255 2.337 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 5 PRO HA 1 6 PRO HD2 3.000 . 4.300 2.596 2.432 2.767 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 5 PRO QD 1 8 THR HB 4.000 . 6.000 2.562 2.337 2.764 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 5 PRO HA 1 6 PRO HA 4.000 . 5.000 4.442 4.421 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 5 PRO HA 1 9 ALA MB 4.000 . 6.500 5.160 4.943 5.312 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 5 PRO HA 1 6 PRO QB 4.000 . 6.000 4.822 4.756 4.904 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 5 PRO QB 1 6 PRO HA 4.000 . 6.000 4.620 4.560 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 5 PRO QB 1 8 THR HB 4.000 . 6.000 3.494 2.572 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 5 PRO QB 1 6 PRO QD 4.000 . 7.000 2.155 2.087 2.238 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 5 PRO QG 1 8 THR HB 4.000 . 6.000 2.663 2.327 3.069 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 6 PRO HB3 1 7 SER H 4.000 . 5.000 3.943 3.760 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 6 PRO HB2 1 7 SER H 3.000 . 3.500 2.727 2.472 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 6 PRO HB2 1 8 THR H 4.000 . 5.000 5.092 4.931 5.170 0.170 28 0 "[ . 1 . 2 . 3]" 1
41 1 6 PRO QG 1 7 SER H 4.000 . 6.000 2.615 2.228 3.134 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 6 PRO QG 1 8 THR H 4.000 . 6.000 4.941 4.574 5.368 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 6 PRO QB 1 9 ALA H 4.000 . 6.000 4.970 4.810 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 6 PRO QD 1 8 THR HB 4.000 . 6.000 5.229 4.763 5.439 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 6 PRO HA 1 9 ALA MB 4.000 . 6.500 2.782 2.526 3.152 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 6 PRO QB 1 9 ALA MB 4.000 . 7.500 4.239 3.951 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 6 PRO QD 1 9 ALA MB 4.000 . 7.500 4.963 4.809 5.089 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 6 PRO QB 1 112 PHE HD2 4.000 . 6.000 3.170 2.763 3.461 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 6 PRO QB 1 7 SER HB3 4.000 . 6.000 4.193 3.990 4.383 . 0 0 "[ . 1 . 2 . 3]" 1
50 1 6 PRO QB 1 112 PHE HB2 4.000 . 6.000 2.508 2.352 2.881 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 6 PRO HA 1 112 PHE HB2 4.000 . 5.000 5.017 4.799 5.167 0.167 14 0 "[ . 1 . 2 . 3]" 1
52 1 6 PRO QG 1 112 PHE HE2 4.000 . 6.000 4.577 4.109 5.035 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 6 PRO QG 1 112 PHE HD2 4.000 . 6.000 3.497 3.009 4.055 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 6 PRO HA 1 7 SER HA 4.000 . 5.000 4.806 4.774 4.827 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 6 PRO QG 1 7 SER HB3 4.000 . 6.000 4.098 3.726 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 6 PRO QB 1 7 SER HA 4.000 . 6.000 3.828 3.797 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 7 SER H 1 7 SER HB3 3.000 . 3.500 2.466 2.415 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 7 SER H 1 7 SER HB2 4.000 . 5.000 3.612 3.597 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 7 SER HB3 1 8 THR H 4.000 . 5.000 3.858 3.776 3.947 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 7 SER HB2 1 8 THR H 4.000 . 5.000 3.797 3.734 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 7 SER QB 1 9 ALA H 4.000 . 6.000 5.201 5.118 5.276 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 7 SER HB3 1 112 PHE HZ 4.000 . 5.000 2.950 2.640 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 7 SER HB2 1 112 PHE HZ 4.000 . 5.000 2.842 2.574 3.175 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 7 SER HA 1 112 PHE HZ 4.000 . 5.000 3.111 2.896 3.349 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 7 SER HA 1 112 PHE HD2 4.000 . 5.000 4.722 4.345 5.026 0.026 24 0 "[ . 1 . 2 . 3]" 1
66 1 7 SER HB3 1 112 PHE HD2 4.000 . 5.000 4.130 3.834 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 7 SER HB2 1 10 LEU HB3 4.000 . 5.000 4.786 4.593 5.022 0.022 2 0 "[ . 1 . 2 . 3]" 1
68 1 7 SER HA 1 112 PHE HB3 4.000 . 5.000 4.876 4.559 5.056 0.056 26 0 "[ . 1 . 2 . 3]" 1
69 1 7 SER HA 1 10 LEU QD 4.000 . 7.400 3.779 3.513 4.435 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 7 SER HB2 1 107 PHE HE1 4.000 . 5.000 2.631 2.345 2.901 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 7 SER HB2 1 107 PHE HZ 4.000 . 5.000 4.803 4.383 5.066 0.066 20 0 "[ . 1 . 2 . 3]" 1
72 1 7 SER HA 1 107 PHE HE1 4.000 . 5.000 4.130 3.814 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 7 SER HA 1 9 ALA MB 4.000 . 6.500 4.971 4.827 5.140 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 8 THR HA 1 8 THR MG 2.500 . 3.800 2.336 2.302 2.396 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 8 THR H 1 8 THR MG 3.000 . 5.000 3.777 3.768 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 8 THR H 1 8 THR HB 3.000 . 3.500 2.507 2.454 2.547 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 8 THR H 1 9 ALA MB 4.000 . 6.500 4.320 4.252 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 8 THR MG 1 9 ALA H 4.000 . 6.500 3.450 3.354 3.507 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 8 THR MG 1 12 GLU H 4.000 . 6.500 3.868 3.663 4.095 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 8 THR HB 1 12 GLU QG 4.000 . 6.000 4.758 4.387 5.037 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 8 THR HB 1 9 ALA MB 4.000 . 6.500 4.066 3.961 4.135 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 8 THR HA 1 11 ARG QD 4.000 . 6.000 3.566 2.329 5.340 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 8 THR HA 1 11 ARG QG 4.000 . 6.000 3.553 2.829 3.872 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 8 THR HA 1 12 GLU QG 4.000 . 6.000 3.953 3.670 4.156 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 8 THR HA 1 9 ALA MB 4.000 . 6.500 5.041 5.030 5.053 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 8 THR MG 1 12 GLU QG 4.000 . 7.500 2.554 2.288 2.758 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 8 THR MG 1 12 GLU HB2 4.000 . 6.500 4.054 3.784 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 8 THR MG 1 11 ARG HB2 4.000 . 6.500 3.663 3.272 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 9 ALA H 1 9 ALA MB 2.500 . 4.000 2.239 2.195 2.260 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 9 ALA MB 1 10 LEU H 3.000 . 5.000 2.482 2.334 2.585 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 9 ALA MB 1 12 GLU H 4.000 . 6.500 4.647 4.527 4.762 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 9 ALA MB 1 13 LEU H 4.000 . 6.500 4.491 4.311 4.656 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 9 ALA MB 1 70 PHE HZ 3.000 . 4.800 2.273 2.124 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 9 ALA MB 1 10 LEU HA 4.000 . 6.500 3.814 3.786 3.870 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 9 ALA HA 1 12 GLU QG 4.000 . 6.000 3.507 2.987 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 9 ALA HA 1 70 PHE HZ 4.000 . 5.000 4.567 4.247 4.925 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 9 ALA MB 1 12 GLU HB2 4.000 . 6.500 4.053 3.837 4.213 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 9 ALA MB 1 70 PHE QD 4.000 . 6.500 4.595 4.217 4.771 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 9 ALA H 1 12 GLU HB2 4.000 . 5.000 5.061 4.987 5.138 0.138 16 0 "[ . 1 . 2 . 3]" 1
100 1 9 ALA HA 1 13 LEU QB 4.000 . 5.000 4.645 4.493 4.739 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 10 LEU HB3 1 10 LEU MD1 3.000 . 4.800 3.136 2.453 3.218 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 10 LEU HB2 1 10 LEU MD1 3.000 . 4.800 2.358 2.207 3.216 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 10 LEU HB3 1 10 LEU MD2 3.000 . 4.800 2.405 2.201 3.211 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 10 LEU HB2 1 10 LEU MD2 3.000 . 4.800 2.380 2.207 2.594 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 10 LEU HA 1 10 LEU QD 3.000 . 5.000 2.138 1.984 2.224 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 10 LEU H 1 10 LEU QD 4.000 . 6.700 3.684 3.479 3.738 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 10 LEU H 1 10 LEU HB3 2.500 . 2.900 2.595 2.514 2.855 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 10 LEU H 1 10 LEU HB2 2.500 . 2.900 2.505 2.241 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 10 LEU H 1 70 PHE HZ 3.000 . 3.500 3.229 2.674 3.521 0.021 10 0 "[ . 1 . 2 . 3]" 1
110 1 10 LEU H 1 70 PHE QE 4.000 . 5.000 4.219 3.798 4.457 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 10 LEU QD 1 11 ARG H 4.000 . 7.400 3.744 3.317 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 10 LEU QB 1 11 ARG H 3.000 . 4.500 2.407 2.250 2.524 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 10 LEU QD 1 106 LEU H 4.000 . 7.400 4.061 3.787 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 10 LEU QD 1 107 PHE H 4.000 . 7.400 3.059 2.783 4.072 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 10 LEU HB3 1 107 PHE HE1 4.000 . 5.000 4.982 4.612 5.139 0.139 24 0 "[ . 1 . 2 . 3]" 1
116 1 10 LEU QD 1 112 PHE HZ 4.000 . 7.400 4.067 3.865 4.989 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 10 LEU QD 1 112 PHE HD1 4.000 . 7.400 2.388 2.238 2.686 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 10 LEU QD 1 112 PHE HE1 4.000 . 7.400 2.180 2.042 3.290 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 10 LEU HG 1 112 PHE HE1 4.000 . 5.000 4.224 2.304 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 10 LEU HB3 1 70 PHE HZ 4.000 . 5.000 4.838 4.201 5.076 0.076 25 0 "[ . 1 . 2 . 3]" 1
121 1 10 LEU HB2 1 70 PHE HZ 4.000 . 5.000 3.500 2.924 3.748 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 10 LEU HB3 1 112 PHE HZ 4.000 . 5.000 4.914 4.422 5.066 0.066 17 0 "[ . 1 . 2 . 3]" 1
123 1 10 LEU QD 1 44 TYR QE 3.000 . 5.700 3.334 3.092 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 10 LEU QD 1 107 PHE HA 3.000 . 5.700 3.111 2.768 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 10 LEU QD 1 11 ARG HA 4.000 . 7.400 4.067 3.092 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 10 LEU HA 1 14 ILE MD 4.000 . 6.500 4.390 4.257 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 10 LEU HA 1 13 LEU MD1 4.000 . 6.500 5.135 4.935 5.370 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 10 LEU HA 1 70 PHE QE 4.000 . 5.000 3.968 3.587 4.184 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 10 LEU QD 1 103 LEU HA 4.000 . 7.400 2.835 2.676 3.006 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 10 LEU QD 1 14 ILE QG 4.000 . 8.400 2.480 2.109 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 10 LEU HG 1 107 PHE HD1 4.000 . 5.000 4.466 3.664 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 10 LEU HG 1 14 ILE MD 3.000 . 4.800 2.314 2.062 3.867 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 10 LEU QD 1 103 LEU MD2 3.000 . 7.200 2.124 2.018 2.376 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 10 LEU QD 1 70 PHE HZ 3.000 . 5.700 3.579 2.947 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 10 LEU QD 1 107 PHE HB3 4.000 . 7.400 3.671 3.417 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 10 LEU QD 1 107 PHE HB2 4.000 . 7.400 2.273 2.049 3.275 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 10 LEU QD 1 112 PHE HB3 4.000 . 7.400 4.191 3.080 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 10 LEU HA 1 70 PHE HZ 3.000 . 3.300 3.112 2.694 3.344 0.044 8 0 "[ . 1 . 2 . 3]" 1
139 1 10 LEU QD 1 70 PHE QE 4.000 . 7.400 3.600 2.849 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 10 LEU QD 1 103 LEU HG 4.000 . 7.400 4.249 4.106 4.368 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 10 LEU MD1 1 14 ILE MD 4.000 . 8.000 2.708 1.908 3.139 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 10 LEU MD2 1 14 ILE MD 4.000 . 8.000 2.727 2.340 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 10 LEU QD 1 112 PHE HA 4.000 . 7.400 4.162 3.691 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 10 LEU QD 1 13 LEU QB 4.000 . 7.400 2.892 2.689 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 10 LEU QD 1 106 LEU HG 4.000 . 7.400 4.471 4.267 4.748 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 10 LEU QD 1 13 LEU MD2 4.000 . 8.900 2.801 2.571 3.112 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 10 LEU QD 1 106 LEU HB3 4.000 . 7.400 3.665 3.310 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 10 LEU HB3 1 14 ILE MD 4.000 . 6.500 4.013 3.759 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 10 LEU QD 1 103 LEU HB3 4.000 . 7.400 2.385 2.230 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 10 LEU HA 1 103 LEU MD2 4.000 . 6.500 4.510 4.242 4.769 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 10 LEU HB3 1 107 PHE HD1 4.000 . 5.000 3.662 3.160 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 11 ARG H 1 11 ARG QB 2.500 . 3.500 2.402 2.378 2.440 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 11 ARG H 1 11 ARG QG 3.000 . 4.500 2.248 2.186 2.331 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 11 ARG H 1 11 ARG QD 4.000 . 6.000 3.856 3.498 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 11 ARG HA 1 11 ARG QG 3.000 . 3.900 2.393 2.300 2.667 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 11 ARG HA 1 11 ARG QD 4.000 . 6.000 3.689 2.228 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 11 ARG H 1 107 PHE HE1 5.000 3.000 6.000 5.195 4.834 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 11 ARG H 1 107 PHE HD1 4.000 . 5.000 4.878 4.486 5.081 0.081 19 0 "[ . 1 . 2 . 3]" 1
159 1 11 ARG QG 1 12 GLU H 4.000 . 6.000 4.089 4.032 4.159 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 11 ARG QD 1 12 GLU H 4.000 . 6.000 4.865 4.524 5.243 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 11 ARG HA 1 12 GLU HA 4.000 . 5.000 4.806 4.786 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 11 ARG HA 1 14 ILE MD 4.000 . 6.500 2.664 2.406 2.986 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 11 ARG HA 1 14 ILE MG 4.000 . 6.500 4.141 3.951 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 11 ARG QD 1 107 PHE HZ 4.000 . 6.000 3.578 2.702 5.250 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 11 ARG QG 1 107 PHE HZ 4.000 . 6.000 4.297 3.718 4.845 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 11 ARG HA 1 15 GLU QG 4.000 . 6.000 3.832 3.524 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 12 GLU H 1 12 GLU HB3 4.000 . 5.000 3.601 3.589 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 12 GLU HA 1 12 GLU QG 3.000 . 3.900 2.439 2.298 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 12 GLU H 1 12 GLU HB2 3.000 . 3.500 2.402 2.377 2.432 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 12 GLU H 1 12 GLU QG 4.000 . 6.000 2.280 2.244 2.345 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 12 GLU HA 1 15 GLU QG 4.000 . 6.000 3.929 3.467 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 12 GLU H 1 13 LEU QB 4.000 . 6.000 4.428 4.316 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 12 GLU H 1 13 LEU HA 5.000 3.000 6.000 5.317 5.255 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 12 GLU QB 1 13 LEU H 3.000 . 4.500 2.596 2.506 2.668 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 12 GLU QG 1 13 LEU H 4.000 . 6.000 4.127 4.059 4.168 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 12 GLU HB2 1 13 LEU HA 4.000 . 5.000 4.459 4.393 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 13 LEU QB 1 13 LEU MD2 3.000 . 4.800 2.090 2.080 2.105 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 13 LEU HA 1 13 LEU MD2 3.000 . 4.800 3.825 3.804 3.852 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 13 LEU HA 1 13 LEU MD1 4.000 . 6.500 2.130 2.104 2.170 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 13 LEU H 1 13 LEU QB 2.500 . 2.900 2.255 2.237 2.271 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 13 LEU H 1 13 LEU MD1 4.000 . 6.500 4.088 4.067 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 13 LEU H 1 13 LEU MD2 4.000 . 6.500 4.270 4.248 4.305 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 13 LEU H 1 13 LEU HG 4.000 . 5.000 4.445 4.426 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 13 LEU HA 1 13 LEU HG 4.000 . 5.000 3.100 3.052 3.146 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 13 LEU HG 1 14 ILE H 4.000 . 5.000 3.620 3.369 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 13 LEU QB 1 14 ILE H 4.000 . 6.000 2.486 2.312 2.584 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 13 LEU QB 1 15 GLU H 4.000 . 6.000 4.864 4.778 4.955 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 13 LEU QB 1 16 GLU H 4.000 . 6.000 5.107 5.015 5.228 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 13 LEU HG 1 16 GLU H 5.000 3.000 6.000 5.394 5.208 5.604 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 13 LEU QB 1 70 PHE HZ 4.000 . 5.000 4.110 3.735 4.394 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 13 LEU HG 1 14 ILE HA 4.000 . 5.000 3.583 3.446 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 13 LEU HA 1 66 MET ME 3.000 . 4.800 3.422 2.681 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 13 LEU MD2 1 66 MET ME 3.000 . 6.300 3.927 3.732 4.038 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 13 LEU MD1 1 66 MET ME 4.000 . 8.000 1.980 1.855 2.100 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 13 LEU MD2 1 70 PHE QE 4.000 . 6.500 2.739 2.402 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 13 LEU QB 1 70 PHE QE 4.000 . 5.000 3.418 3.152 3.758 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 13 LEU QB 1 14 ILE MD 4.000 . 6.500 4.562 4.415 4.665 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 13 LEU MD2 1 66 MET QB 4.000 . 7.500 3.055 2.762 3.354 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 13 LEU MD2 1 66 MET HA 4.000 . 6.500 5.097 4.778 5.265 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 13 LEU HA 1 16 GLU QG 4.000 . 6.000 4.841 4.277 5.163 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 13 LEU HG 1 17 LEU H 4.000 . 5.000 4.304 4.120 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 13 LEU MD2 1 44 TYR QD 4.000 . 6.500 3.802 3.455 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 13 LEU MD2 1 44 TYR QE 4.000 . 6.500 2.588 2.232 2.931 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 13 LEU MD2 1 70 PHE QD 4.000 . 6.500 3.597 3.331 3.957 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 13 LEU MD1 1 63 THR HB 4.000 . 6.500 5.283 5.021 5.423 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 13 LEU MD2 1 17 LEU HG 4.000 . 6.500 4.247 4.005 4.453 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 13 LEU HG 1 17 LEU HG 4.000 . 5.000 2.970 2.697 3.211 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 13 LEU QB 1 103 LEU MD2 4.000 . 6.500 4.229 3.911 4.569 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 13 LEU MD2 1 67 LEU HG 4.000 . 6.500 3.698 3.381 3.883 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 13 LEU MD2 1 63 THR HA 4.000 . 6.500 5.119 4.776 5.344 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 13 LEU MD1 1 63 THR MG 4.000 . 8.000 2.798 2.517 3.067 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 14 ILE HA 1 14 ILE MD 4.000 . 6.500 3.809 3.793 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 14 ILE HA 1 14 ILE MG 3.000 . 4.400 2.401 2.351 2.436 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 14 ILE HA 1 14 ILE QG 3.000 . 3.900 2.353 2.327 2.381 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 14 ILE H 1 14 ILE MG 3.000 . 5.000 3.775 3.757 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 14 ILE H 1 14 ILE HB 3.000 . 3.500 2.457 2.409 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 14 ILE H 1 14 ILE MD 4.000 . 6.500 3.471 3.395 3.557 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 14 ILE H 1 14 ILE QG 2.500 . 3.900 2.229 2.168 2.274 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 14 ILE QG 1 15 GLU H 4.000 . 6.000 4.104 4.044 4.153 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 14 ILE MG 1 15 GLU H 4.000 . 6.500 3.163 3.074 3.295 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 14 ILE MD 1 15 GLU H 4.000 . 6.500 4.407 4.316 4.471 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 14 ILE MG 1 16 GLU H 4.000 . 6.500 4.909 4.862 4.988 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 14 ILE MG 1 17 LEU H 4.000 . 6.500 4.801 4.655 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 14 ILE MD 1 103 LEU H 4.000 . 6.500 5.142 4.831 5.353 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 14 ILE MD 1 104 LYS H 4.000 . 6.500 3.327 3.044 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 14 ILE MD 1 107 PHE H 4.000 . 6.500 4.450 4.238 4.638 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 14 ILE MD 1 107 PHE HA 4.000 . 6.500 5.297 5.116 5.427 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 14 ILE MD 1 104 LYS HA 3.000 . 4.800 2.294 2.129 2.543 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 14 ILE QG 1 104 LYS HA 4.000 . 6.000 4.063 3.739 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 14 ILE HA 1 15 GLU HA 4.000 . 5.000 4.814 4.771 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 14 ILE MG 1 15 GLU HA 4.000 . 6.500 3.245 3.178 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 14 ILE HB 1 15 GLU HA 4.000 . 5.000 4.397 4.307 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 14 ILE MD 1 103 LEU HA 4.000 . 6.500 4.151 3.854 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 14 ILE QG 1 104 LYS HB3 4.000 . 6.000 3.971 3.729 4.369 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 14 ILE QG 1 103 LEU HB3 4.000 . 6.000 2.356 2.211 2.495 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 14 ILE QG 1 100 LEU MD1 3.000 . 5.800 2.981 2.834 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 14 ILE QG 1 100 LEU MD2 4.000 . 7.500 5.306 5.097 5.374 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 14 ILE MD 1 104 LYS QD 4.000 . 7.500 4.466 3.971 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 14 ILE HA 1 103 LEU MD1 4.000 . 6.500 3.311 3.138 3.492 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 14 ILE HA 1 103 LEU MD2 4.000 . 6.500 5.209 5.021 5.390 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 14 ILE HA 1 100 LEU MD1 3.000 . 4.800 3.337 3.151 3.578 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 14 ILE MD 1 100 LEU MD1 3.000 . 6.300 3.584 3.340 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 14 ILE QG 1 103 LEU MD2 4.000 . 7.500 3.640 3.453 3.813 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 14 ILE HA 1 17 LEU HB2 4.000 . 5.000 2.835 2.581 3.016 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 14 ILE MD 1 103 LEU HB2 4.000 . 6.500 3.441 3.135 3.719 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 14 ILE MD 1 103 LEU HB3 4.000 . 6.500 2.707 2.376 3.001 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 14 ILE MD 1 107 PHE HB2 4.000 . 6.500 3.363 3.125 3.495 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 14 ILE MD 1 107 PHE HB3 4.000 . 6.500 4.149 3.678 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 14 ILE MG 1 104 LYS HA 4.000 . 6.500 4.153 3.822 4.512 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 14 ILE MG 1 104 LYS QE 4.000 . 7.500 4.530 3.080 5.520 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 14 ILE MG 1 104 LYS QD 4.000 . 7.500 4.258 3.687 5.176 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 14 ILE MG 1 15 GLU QG 4.000 . 7.500 3.400 3.222 3.925 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 14 ILE MG 1 15 GLU QB 4.000 . 7.500 4.487 4.402 4.611 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 14 ILE MG 1 18 VAL HB 4.000 . 6.500 3.962 3.654 4.243 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 14 ILE MG 1 103 LEU HB3 4.000 . 6.500 4.310 4.165 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 14 ILE MG 1 18 VAL MG2 3.000 . 6.300 2.451 2.198 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 14 ILE MG 1 100 LEU MD1 3.000 . 6.300 2.139 2.034 2.327 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 14 ILE MG 1 100 LEU MD2 4.000 . 8.000 3.774 3.580 3.937 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 14 ILE HB 1 15 GLU QG 4.000 . 6.000 3.403 3.225 4.591 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 14 ILE HA 1 17 LEU HG 4.000 . 5.000 3.968 3.706 4.201 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 14 ILE QG 1 107 PHE HB2 4.000 . 6.000 5.373 5.005 5.481 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 14 ILE MD 1 107 PHE HD1 4.000 . 6.500 4.578 4.339 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 14 ILE MD 1 104 LYS QE 4.000 . 7.500 4.899 3.785 5.547 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 15 GLU HA 1 15 GLU QG 3.000 . 3.900 2.410 2.294 2.755 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 15 GLU H 1 15 GLU QB 2.500 . 3.500 2.393 2.297 2.432 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 15 GLU H 1 15 GLU QG 4.000 . 6.000 2.255 2.143 3.349 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 15 GLU H 1 18 VAL H 4.000 . 5.000 4.890 4.746 5.004 0.004 3 0 "[ . 1 . 2 . 3]" 1
268 1 15 GLU QG 1 16 GLU H 4.000 . 6.000 4.168 4.119 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 15 GLU HA 1 18 VAL MG1 4.000 . 6.500 4.205 3.929 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 15 GLU HA 1 18 VAL MG2 4.000 . 6.500 3.529 3.297 3.674 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 15 GLU QB 1 16 GLU HA 4.000 . 6.000 3.904 3.879 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 15 GLU H 1 18 VAL MG2 4.000 . 6.500 4.745 4.543 4.887 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 16 GLU H 1 16 GLU QB 2.500 . 3.500 2.286 2.264 2.309 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 16 GLU H 1 16 GLU QG 4.000 . 6.000 4.011 3.980 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 16 GLU H 1 19 ASN QB 4.000 . 6.000 4.924 4.768 5.059 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 16 GLU QB 1 17 LEU H 4.000 . 6.000 2.515 2.420 2.621 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 16 GLU QB 1 19 ASN H 4.000 . 6.000 5.035 4.901 5.138 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 16 GLU HA 1 20 ILE MG 4.000 . 6.500 3.908 3.589 4.222 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 16 GLU HB3 1 19 ASN QB 4.000 . 6.000 5.214 5.024 5.356 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 16 GLU HB2 1 19 ASN QB 4.000 . 6.000 4.908 4.708 5.044 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 16 GLU H 1 18 VAL MG2 4.000 . 6.500 5.250 5.142 5.346 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 16 GLU QG 1 62 LYS QD 4.000 . 7.000 4.986 4.403 5.565 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 17 LEU HA 1 17 LEU HG 4.000 . 5.000 2.873 2.789 2.954 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 17 LEU H 1 17 LEU MD1 4.000 . 6.500 3.500 3.448 3.548 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 17 LEU H 1 17 LEU MD2 4.000 . 6.500 3.532 3.403 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 17 LEU H 1 17 LEU HG 2.500 . 2.900 2.279 2.168 2.350 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 17 LEU H 1 17 LEU HB2 3.000 . 3.500 2.451 2.412 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 17 LEU HB2 1 17 LEU MD1 3.000 . 4.800 2.281 2.238 2.328 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 17 LEU H 1 19 ASN QB 4.000 . 6.000 4.985 4.875 5.104 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 17 LEU H 1 20 ILE QG 4.000 . 6.000 4.440 4.394 4.570 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 17 LEU QB 1 18 VAL H 4.000 . 6.000 2.515 2.374 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 17 LEU HA 1 20 ILE MD 4.000 . 6.500 2.491 2.305 2.757 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 17 LEU HB2 1 103 LEU MD1 3.000 . 4.800 3.955 3.754 4.111 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 17 LEU HB3 1 20 ILE QG 4.000 . 6.000 4.101 4.008 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 17 LEU HB2 1 100 LEU MD1 4.000 . 6.500 3.498 3.097 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 17 LEU HA 1 21 THR MG 4.000 . 6.500 3.685 3.330 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 17 LEU HB2 1 20 ILE QG 4.000 . 6.000 4.799 4.715 4.992 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 17 LEU HA 1 20 ILE MG 4.000 . 6.500 3.840 3.719 4.124 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 17 LEU HB3 1 20 ILE MD 4.000 . 6.500 4.097 3.768 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 17 LEU HB3 1 100 LEU MD1 4.000 . 6.500 3.970 3.446 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 17 LEU HB3 1 100 LEU MD2 4.000 . 6.500 4.602 4.101 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 17 LEU MD2 1 20 ILE MG 4.000 . 8.000 4.419 4.280 4.736 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 18 VAL H 1 18 VAL HB 2.500 . 2.900 2.405 2.366 2.462 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 18 VAL H 1 18 VAL MG2 2.500 . 4.400 2.216 2.125 2.286 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 18 VAL H 1 18 VAL MG1 4.000 . 6.500 3.750 3.737 3.764 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 18 VAL HA 1 18 VAL MG1 3.000 . 4.400 2.413 2.373 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 18 VAL HA 1 18 VAL MG2 3.000 . 4.400 2.327 2.275 2.372 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 18 VAL HA 1 21 THR MG 4.000 . 6.500 3.739 3.546 3.959 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 18 VAL H 1 19 ASN QB 4.000 . 6.000 4.500 4.412 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 18 VAL H 1 19 ASN HA 5.000 3.000 6.000 5.328 5.280 5.432 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 18 VAL MG1 1 19 ASN H 4.000 . 6.500 3.281 3.203 3.364 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 18 VAL MG2 1 19 ASN H 4.000 . 6.500 3.920 3.866 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 18 VAL HB 1 19 ASN H 2.500 . 2.900 2.606 2.530 2.661 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 18 VAL HA 1 22 GLN QG 4.000 . 6.000 3.341 3.133 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 18 VAL MG1 1 19 ASN HA 4.000 . 6.500 3.304 3.246 3.378 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 18 VAL MG1 1 22 GLN QG 4.000 . 7.500 2.130 1.924 2.295 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 18 VAL MG1 1 19 ASN QB 4.000 . 7.500 4.292 4.035 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 18 VAL MG1 1 22 GLN H 4.000 . 6.500 3.943 3.805 4.180 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 18 VAL MG1 1 21 THR H 4.000 . 6.500 4.463 4.317 4.561 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 18 VAL MG1 1 22 GLN QB 4.000 . 7.500 3.431 3.237 3.605 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 18 VAL HA 1 100 LEU MD2 3.000 . 4.800 3.492 3.040 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 18 VAL MG2 1 22 GLN QG 3.000 . 5.800 4.028 3.824 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 19 ASN H 1 19 ASN QB 2.500 . 3.500 2.301 2.246 2.375 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 19 ASN H 1 22 GLN QG 4.000 . 6.000 4.861 4.556 5.045 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 19 ASN QB 1 20 ILE H 3.000 . 4.500 2.552 2.358 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 19 ASN QB 1 21 THR H 4.000 . 6.000 4.595 4.482 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 19 ASN QB 1 20 ILE HA 4.000 . 6.000 4.090 3.874 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 19 ASN HA 1 20 ILE MG 4.000 . 6.500 4.806 4.700 4.913 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 19 ASN QB 1 20 ILE MG 4.000 . 7.500 2.938 2.800 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 19 ASN HA 1 22 GLN QG 4.000 . 6.000 3.996 3.427 4.354 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 20 ILE HB 1 20 ILE MD 3.000 . 4.800 2.317 2.258 2.397 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 20 ILE HA 1 20 ILE MG 3.000 . 4.400 2.313 2.252 2.387 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 20 ILE HA 1 20 ILE MD 4.000 . 6.500 4.127 4.115 4.140 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 20 ILE H 1 20 ILE MD 4.000 . 6.500 3.598 3.429 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
335 1 20 ILE H 1 20 ILE MG 2.500 . 4.400 2.207 2.014 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 20 ILE H 1 20 ILE QG 3.000 . 4.500 1.943 1.784 2.143 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 20 ILE H 1 20 ILE HB 4.000 . 5.000 3.643 3.619 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 20 ILE HB 1 21 THR H 4.000 . 5.000 4.115 3.997 4.326 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 20 ILE HG13 1 21 THR H 4.000 . 6.000 2.729 2.461 3.242 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 20 ILE HG12 1 21 THR H 4.000 . 6.000 3.102 2.821 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 20 ILE MD 1 21 THR H 4.000 . 6.500 4.268 4.121 4.504 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 20 ILE MG 1 21 THR H 4.000 . 6.500 4.095 4.031 4.194 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 20 ILE QG 1 22 GLN H 4.000 . 6.000 4.499 4.356 4.658 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 20 ILE HA 1 21 THR MG 4.000 . 6.500 4.802 4.735 4.887 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 20 ILE MD 1 21 THR HA 4.000 . 6.500 4.959 4.798 5.133 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 20 ILE QG 1 21 THR HA 4.000 . 6.000 3.628 3.524 3.793 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 20 ILE QG 1 21 THR MG 4.000 . 7.500 2.183 2.124 2.257 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 20 ILE HB 1 59 ALA MB 4.000 . 6.500 4.120 3.515 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 20 ILE MG 1 59 ALA MB 4.000 . 8.000 4.303 3.634 5.084 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 20 ILE HB 1 21 THR MG 4.000 . 6.500 4.088 3.915 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
351 1 20 ILE MD 1 60 ILE HA 4.000 . 6.500 3.933 3.644 4.172 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 20 ILE MD 1 63 THR HB 4.000 . 6.500 4.921 4.724 5.194 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 20 ILE MD 1 63 THR HA 4.000 . 6.500 5.366 5.221 5.500 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 20 ILE MD 1 60 ILE HB 4.000 . 6.500 5.249 4.816 5.468 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 20 ILE MD 1 21 THR MG 4.000 . 8.000 3.178 3.020 3.396 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 20 ILE MG 1 28 LEU MD2 4.000 . 8.000 4.650 4.185 5.260 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 20 ILE HB 1 28 LEU MD2 4.000 . 6.500 3.561 3.002 4.258 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 21 THR HA 1 21 THR MG 2.500 . 3.800 2.275 2.236 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 21 THR H 1 21 THR MG 2.500 . 4.400 2.655 2.578 2.799 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 21 THR H 1 22 GLN QG 4.000 . 6.000 3.989 3.851 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 21 THR MG 1 22 GLN H 4.000 . 6.500 4.125 3.994 4.255 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 21 THR HB 1 24 GLN HB3 4.000 . 5.000 4.948 4.643 5.112 0.112 27 0 "[ . 1 . 2 . 3]" 1
363 1 21 THR HA 1 24 GLN QG 4.000 . 6.000 2.973 2.227 3.472 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 21 THR MG 1 97 LYS QE 4.000 . 7.500 4.510 3.907 5.432 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 21 THR MG 1 97 LYS HA 4.000 . 6.500 4.758 4.460 5.042 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 21 THR HB 1 97 LYS QE 4.000 . 6.000 3.943 3.159 5.181 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 21 THR MG 1 96 VAL HB 4.000 . 6.500 3.071 2.813 3.387 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 21 THR MG 1 96 VAL MG2 4.000 . 8.000 3.215 3.059 3.382 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 21 THR MG 1 96 VAL HA 4.000 . 6.500 4.975 4.794 5.176 . 0 0 "[ . 1 . 2 . 3]" 1
370 1 21 THR MG 1 22 GLN QG 4.000 . 7.500 4.909 4.718 5.105 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 21 THR MG 1 24 GLN HB3 4.000 . 6.500 4.246 3.978 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 21 THR HB 1 96 VAL MG2 4.000 . 6.500 5.379 5.299 5.490 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 21 THR HB 1 96 VAL MG1 4.000 . 6.500 3.991 3.587 4.278 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 21 THR HA 1 96 VAL MG1 5.000 . 7.500 5.001 4.629 5.387 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 21 THR HA 1 28 LEU HG 4.000 . 5.000 4.741 4.420 5.032 0.032 19 0 "[ . 1 . 2 . 3]" 1
376 1 21 THR HA 1 28 LEU MD2 4.000 . 6.500 3.865 3.034 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 21 THR HB 1 96 VAL HB 4.000 . 5.000 4.900 4.766 5.033 0.033 23 0 "[ . 1 . 2 . 3]" 1
378 1 21 THR HB 1 97 LYS QD 4.000 . 6.000 5.282 4.333 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 21 THR MG 1 28 LEU HG 4.000 . 6.500 4.300 3.846 4.911 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 21 THR MG 1 28 LEU MD2 4.000 . 8.000 3.854 2.372 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 22 GLN HA 1 22 GLN QG 2.500 . 3.500 2.416 2.272 2.731 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 22 GLN H 1 22 GLN QB 2.500 . 3.500 2.331 2.274 2.368 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 22 GLN H 1 22 GLN QG 3.000 . 4.500 2.551 2.395 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 22 GLN QG 1 23 ASN H 4.000 . 6.000 4.233 4.128 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 22 GLN QB 1 23 ASN H 3.000 . 4.500 2.698 2.386 2.960 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 22 GLN QB 1 23 ASN QB 4.000 . 7.000 3.975 3.549 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 23 ASN H 1 23 ASN QB 3.000 . 4.100 2.516 2.354 2.769 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 23 ASN HB3 1 24 GLN H 4.000 . 5.000 4.377 3.585 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 23 ASN HB2 1 24 GLN H 4.000 . 5.000 4.087 3.539 4.539 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 24 GLN H 1 24 GLN QG 4.000 . 6.000 2.461 2.224 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 24 GLN QB 1 25 LYS H 4.000 . 6.000 3.305 3.180 3.524 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 24 GLN QB 1 26 ALA H 4.000 . 6.000 4.680 3.323 4.990 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 24 GLN QG 1 26 ALA H 4.000 . 6.000 4.869 3.564 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 24 GLN QG 1 28 LEU H 4.000 . 6.000 4.805 3.882 5.255 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 24 GLN HB2 1 28 LEU HG 4.000 . 5.000 3.591 2.796 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 25 LYS HA 1 25 LYS QD 4.000 . 6.000 3.802 2.131 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 25 LYS H 1 25 LYS QB 3.000 . 4.100 2.324 2.292 2.360 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 25 LYS H 1 25 LYS QG 4.000 . 6.000 4.012 3.988 4.060 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 25 LYS HB3 1 26 ALA H 4.000 . 5.000 1.935 1.777 2.976 0.023 11 0 "[ . 1 . 2 . 3]" 1
400 1 25 LYS HB2 1 26 ALA H 4.000 . 5.000 3.480 3.376 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 25 LYS QE 1 26 ALA MB 4.000 . 7.500 4.433 2.631 5.409 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 26 ALA H 1 26 ALA MB 2.500 . 4.000 2.159 2.072 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 26 ALA MB 1 28 LEU H 5.000 . 7.500 5.555 5.433 5.669 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 26 ALA HA 1 27 PRO HD3 2.500 . 3.700 2.334 2.287 2.403 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 26 ALA HA 1 27 PRO HD2 2.500 . 3.700 2.524 2.354 2.698 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 26 ALA MB 1 27 PRO HA 4.000 . 6.500 4.512 4.471 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 26 ALA MB 1 27 PRO QD 3.000 . 5.800 2.147 2.075 2.214 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 26 ALA HA 1 27 PRO QG 4.000 . 6.000 4.098 4.063 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 26 ALA HA 1 27 PRO HA 4.000 . 5.000 4.426 4.408 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 26 ALA MB 1 27 PRO QG 4.000 . 7.500 3.689 3.586 3.833 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 26 ALA H 1 27 PRO QD 4.000 . 6.000 4.390 4.334 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 27 PRO HA 1 28 LEU QB 4.000 . 6.000 4.604 4.482 4.752 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 27 PRO QB 1 30 ASN HA 4.000 . 6.000 4.525 4.123 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 27 PRO QB 1 31 GLY H 4.000 . 6.000 2.733 2.504 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 27 PRO QB 1 32 SER H 4.000 . 6.000 4.340 3.980 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 28 LEU HA 1 28 LEU MD1 4.000 . 6.500 3.835 3.813 3.870 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 28 LEU HA 1 28 LEU MD2 3.000 . 5.000 2.159 2.110 2.214 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 28 LEU H 1 28 LEU HG 3.000 . 3.500 2.143 2.009 2.329 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 28 LEU H 1 28 LEU QB 3.000 . 4.100 2.457 2.384 2.516 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 28 LEU H 1 28 LEU MD2 4.000 . 6.500 3.397 3.226 3.558 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 28 LEU QB 1 29 CYS H 4.000 . 6.000 2.611 2.158 3.305 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 28 LEU QB 1 92 VAL QG 4.000 . 8.400 3.291 2.453 3.987 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 28 LEU MD1 1 93 ALA HA 4.000 . 6.500 4.263 2.287 5.264 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 28 LEU HG 1 92 VAL QG 4.000 . 7.400 4.502 3.447 5.016 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 29 CYS H 1 29 CYS HB3 4.000 . 5.000 3.713 3.593 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 29 CYS H 1 29 CYS HB2 4.000 . 5.000 2.519 2.300 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 29 CYS H 1 92 VAL QG 4.000 . 7.400 3.911 3.414 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 29 CYS QB 1 30 ASN H 4.000 . 6.000 2.333 2.034 2.560 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 29 CYS QB 1 32 SER H 4.000 . 6.000 2.320 2.180 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 29 CYS HA 1 57 CYS HB3 4.000 . 5.000 4.294 3.826 5.048 0.048 4 0 "[ . 1 . 2 . 3]" 1
431 1 29 CYS HB3 1 32 SER QB 3.000 . 5.000 2.581 2.294 3.304 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 29 CYS HB2 1 32 SER QB 3.000 . 5.000 2.474 2.296 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 29 CYS HB3 1 92 VAL QG 3.000 . 6.400 3.982 3.509 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 29 CYS HB2 1 92 VAL QG 3.000 . 6.400 3.055 2.751 3.512 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 29 CYS HB3 1 54 VAL MG1 4.000 . 6.500 3.597 3.064 4.250 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 29 CYS HB2 1 54 VAL MG1 4.000 . 6.500 3.909 3.383 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 29 CYS HB3 1 57 CYS HB3 4.000 . 5.000 4.947 4.801 5.037 0.037 9 0 "[ . 1 . 2 . 3]" 1
438 1 29 CYS HB2 1 60 ILE MD 4.000 . 6.500 5.114 4.767 5.322 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 29 CYS HB2 1 92 VAL HB 4.000 . 5.000 3.678 3.096 4.416 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 30 ASN H 1 30 ASN HB3 4.000 . 5.000 3.280 2.507 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 30 ASN H 1 30 ASN HB2 3.000 . 3.500 2.599 2.391 3.606 0.106 5 0 "[ . 1 . 2 . 3]" 1
442 1 30 ASN HB3 1 31 GLY H 4.000 . 5.000 4.459 4.294 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 30 ASN HB2 1 31 GLY H 4.000 . 5.000 4.382 4.206 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 31 GLY H 1 92 VAL QG 4.000 . 7.400 5.217 4.962 5.497 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 31 GLY QA 1 91 GLU QG 4.000 . 7.000 4.393 3.776 5.189 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 31 GLY QA 1 91 GLU QB 4.000 . 7.000 4.639 4.312 4.850 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 32 SER H 1 32 SER QB 2.500 . 3.500 2.478 2.392 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 32 SER QB 1 33 MET H 3.000 . 4.500 2.870 2.675 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 32 SER QB 1 92 VAL H 4.000 . 6.000 4.440 4.076 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 32 SER QB 1 92 VAL HB 4.000 . 6.000 4.077 3.682 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 32 SER QB 1 92 VAL QG 4.000 . 8.400 2.415 2.125 2.663 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 32 SER HA 1 33 MET QG 4.000 . 6.000 3.516 3.309 3.699 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 32 SER H 1 92 VAL QG 4.000 . 7.400 3.959 3.720 4.159 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 32 SER QB 1 34 VAL MG1 4.000 . 7.500 3.738 3.458 4.003 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 32 SER QB 1 54 VAL MG1 3.000 . 5.800 2.555 2.155 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 32 SER QB 1 54 VAL MG2 3.000 . 5.800 2.944 2.424 3.169 . 0 0 "[ . 1 . 2 . 3]" 1
457 1 32 SER HA 1 54 VAL MG2 4.000 . 6.500 5.158 4.677 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 32 SER QB 1 60 ILE MD 4.000 . 7.500 4.870 4.482 5.243 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 32 SER HA 1 33 MET HB2 4.000 . 5.000 4.600 4.455 4.751 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 32 SER H 1 92 VAL HB 4.000 . 5.000 4.865 4.649 5.076 0.076 1 0 "[ . 1 . 2 . 3]" 1
461 1 32 SER QB 1 33 MET HA 5.000 . 7.000 4.250 4.149 4.319 . 0 0 "[ . 1 . 2 . 3]" 1
462 1 33 MET HA 1 33 MET QG 3.000 . 3.900 2.480 2.300 2.914 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 33 MET H 1 33 MET QG 3.000 . 4.500 2.678 2.439 2.976 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 33 MET H 1 33 MET QB 3.000 . 4.100 2.539 2.450 2.630 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 33 MET HA 1 33 MET ME 4.000 . 6.500 3.715 3.068 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 33 MET HB3 1 33 MET ME 4.000 . 6.500 2.262 2.121 2.759 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 33 MET H 1 89 LYS HB3 5.000 3.000 6.000 5.274 4.778 5.625 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 33 MET H 1 34 VAL MG1 4.000 . 6.500 4.337 4.032 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 33 MET HG3 1 34 VAL H 4.000 . 6.000 5.063 4.920 5.256 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 33 MET HG2 1 34 VAL H 4.000 . 6.000 4.400 4.024 5.010 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 33 MET QB 1 34 VAL H 3.000 . 4.500 2.713 2.563 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 33 MET HA 1 92 VAL H 4.000 . 5.000 2.992 2.668 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 33 MET HA 1 91 GLU HB3 4.000 . 5.000 4.870 4.713 5.097 0.097 15 0 "[ . 1 . 2 . 3]" 1
474 1 33 MET HA 1 89 LYS HB3 4.000 . 5.000 4.401 4.166 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 33 MET HA 1 34 VAL MG1 4.000 . 6.500 3.615 3.382 3.804 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 33 MET HB3 1 34 VAL HA 4.000 . 5.000 4.639 4.495 4.780 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 33 MET QG 1 91 GLU HA 4.000 . 6.000 2.691 2.294 4.141 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 33 MET HB3 1 91 GLU HA 4.000 . 5.000 3.823 3.350 4.424 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 33 MET QG 1 89 LYS QD 4.000 . 7.000 4.594 3.900 5.093 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 33 MET QG 1 89 LYS QB 4.000 . 7.000 3.988 3.577 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 33 MET HB2 1 89 LYS QD 4.000 . 6.000 3.043 2.688 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 33 MET ME 1 89 LYS HA 4.000 . 6.500 4.303 3.936 4.798 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 33 MET ME 1 90 ILE HA 3.000 . 4.800 2.674 2.295 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 33 MET ME 1 91 GLU HA 4.000 . 6.500 3.554 3.114 4.796 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 33 MET ME 1 91 GLU QG 4.000 . 7.500 2.983 2.315 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 33 MET ME 1 91 GLU QB 4.000 . 7.500 4.456 3.986 5.720 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 33 MET ME 1 89 LYS HB3 4.000 . 6.500 3.018 2.626 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 33 MET ME 1 89 LYS QD 4.000 . 7.500 3.877 3.090 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 33 MET ME 1 89 LYS QG 4.000 . 7.500 4.347 3.915 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 33 MET HA 1 92 VAL QG 4.000 . 7.400 2.909 2.467 3.384 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 33 MET HA 1 91 GLU QG 4.000 . 6.000 4.302 3.977 4.855 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 33 MET HB2 1 89 LYS HB3 4.000 . 5.000 3.035 2.471 3.507 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 33 MET H 1 54 VAL MG2 4.000 . 6.500 4.608 4.212 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 33 MET H 1 92 VAL QG 4.000 . 7.400 4.053 3.813 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 33 MET ME 1 90 ILE MG 4.000 . 8.000 4.034 3.680 4.948 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 33 MET H 1 89 LYS QD 4.000 . 6.000 4.780 4.232 5.300 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 34 VAL HA 1 34 VAL MG1 2.500 . 4.000 2.297 2.240 2.343 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 34 VAL H 1 34 VAL MG2 2.500 . 4.400 2.031 1.946 2.126 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 34 VAL H 1 34 VAL MG1 4.000 . 6.500 3.019 2.812 3.185 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 34 VAL H 1 34 VAL HB 4.000 . 5.000 3.788 3.726 3.842 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 34 VAL H 1 35 TRP HA 5.000 3.000 6.000 5.042 4.970 5.113 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 34 VAL H 1 89 LYS QB 4.000 . 6.000 3.354 3.117 3.652 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 34 VAL MG1 1 35 TRP H 3.000 . 5.000 3.616 3.502 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 34 VAL MG2 1 35 TRP H 3.000 . 5.000 3.672 3.519 3.819 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 34 VAL HB 1 35 TRP H 2.500 . 2.900 2.567 2.472 2.632 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 34 VAL MG2 1 36 SER H 4.000 . 6.500 4.817 4.582 5.104 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 34 VAL MG2 1 94 GLN H 4.000 . 6.500 5.370 5.207 5.473 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 34 VAL MG2 1 95 PHE H 4.000 . 6.500 3.951 3.749 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 34 VAL MG2 1 96 VAL H 4.000 . 6.500 4.850 4.591 5.125 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 34 VAL MG1 1 92 VAL H 4.000 . 6.500 4.348 3.997 4.744 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 34 VAL MG2 1 92 VAL H 4.000 . 6.500 3.813 3.566 4.119 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 34 VAL H 1 92 VAL H 4.000 . 5.000 4.341 4.132 4.500 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 34 VAL H 1 91 GLU H 4.000 . 5.000 4.908 4.748 5.050 0.050 23 0 "[ . 1 . 2 . 3]" 1
514 1 34 VAL MG2 1 91 GLU H 4.000 . 6.500 4.942 4.765 5.199 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 34 VAL MG2 1 95 PHE QD 3.000 . 4.800 2.456 2.294 2.671 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 34 VAL MG1 1 95 PHE QD 4.000 . 6.500 4.268 4.101 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 34 VAL MG1 1 95 PHE QE 4.000 . 6.500 4.798 4.553 4.964 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 34 VAL MG2 1 95 PHE QE 4.000 . 6.500 3.710 3.480 3.904 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 34 VAL MG2 1 92 VAL HA 3.000 . 4.800 2.521 2.276 2.783 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 34 VAL MG1 1 92 VAL HA 4.000 . 6.500 3.481 3.229 3.784 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 34 VAL MG1 1 50 SER HB3 4.000 . 6.500 4.268 3.339 5.388 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 34 VAL MG1 1 50 SER HB2 4.000 . 6.500 4.386 3.455 5.328 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 34 VAL MG2 1 50 SER HB3 4.000 . 6.500 4.364 3.609 5.331 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 34 VAL MG2 1 50 SER HB2 4.000 . 6.500 4.488 3.566 5.362 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 34 VAL HB 1 50 SER QB 4.000 . 6.000 2.737 2.331 3.695 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 34 VAL MG2 1 95 PHE HA 4.000 . 6.500 4.071 3.955 4.212 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 34 VAL HB 1 50 SER HA 4.000 . 5.000 4.368 4.091 4.733 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 34 VAL MG2 1 36 SER HA 4.000 . 6.500 4.111 3.833 4.361 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 34 VAL HA 1 35 TRP HA 4.000 . 5.000 4.368 4.355 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 34 VAL HA 1 50 SER QB 4.000 . 6.000 4.597 4.215 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 34 VAL MG1 1 51 LEU HA 4.000 . 6.500 3.091 2.716 3.459 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 34 VAL HB 1 51 LEU HA 4.000 . 5.000 4.637 4.359 5.066 0.066 15 0 "[ . 1 . 2 . 3]" 1
533 1 34 VAL MG1 1 54 VAL H 4.000 . 6.500 4.051 3.751 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 34 VAL MG1 1 92 VAL HB 4.000 . 6.500 4.613 4.432 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 34 VAL MG2 1 92 VAL HB 4.000 . 6.500 4.684 4.417 5.031 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 34 VAL HA 1 89 LYS QD 4.000 . 6.000 4.189 3.641 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 34 VAL H 1 92 VAL HA 4.000 . 5.000 4.361 4.043 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 34 VAL MG2 1 90 ILE QG 4.000 . 7.500 2.284 2.174 2.512 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 34 VAL HA 1 90 ILE QG 4.000 . 6.000 5.037 4.932 5.207 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 34 VAL MG1 1 51 LEU MD2 3.000 . 6.300 2.634 2.289 3.090 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 34 VAL MG2 1 51 LEU MD2 4.000 . 8.000 3.647 3.318 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 34 VAL MG1 1 53 ASN HB2 4.000 . 6.500 3.541 3.040 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 34 VAL MG2 1 90 ILE MD 4.000 . 8.000 3.113 2.997 3.306 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 34 VAL HA 1 54 VAL MG2 4.000 . 6.500 3.819 3.670 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 34 VAL MG1 1 54 VAL MG2 3.000 . 6.300 1.902 1.840 1.985 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 34 VAL MG1 1 54 VAL MG1 4.000 . 8.000 3.638 3.527 3.786 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 34 VAL MG2 1 54 VAL MG1 4.000 . 8.000 5.368 5.220 5.477 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 34 VAL MG1 1 54 VAL HA 4.000 . 6.500 4.368 4.008 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 34 VAL MG2 1 95 PHE HB3 4.000 . 6.500 2.839 2.557 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 34 VAL MG2 1 95 PHE HB2 4.000 . 6.500 2.196 2.091 2.368 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 34 VAL MG2 1 35 TRP HA 4.000 . 6.500 4.485 4.320 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 34 VAL MG2 1 91 GLU HA 4.000 . 6.500 4.268 3.940 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 34 VAL MG1 1 50 SER HA 4.000 . 6.500 4.612 4.212 5.068 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 34 VAL MG1 1 92 VAL QG 3.000 . 7.200 2.065 1.943 2.293 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 34 VAL MG2 1 92 VAL QG 4.000 . 8.900 2.615 2.326 2.893 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 34 VAL MG1 1 60 ILE MD 4.000 . 8.000 4.425 4.176 4.662 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 34 VAL MG1 1 54 VAL HB 4.000 . 6.500 4.027 3.791 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 34 VAL H 1 92 VAL QG 3.000 . 5.900 3.595 3.306 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 34 VAL HB 1 95 PHE QE 4.000 . 5.000 4.449 4.168 4.658 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 34 VAL MG1 1 95 PHE HB2 4.000 . 6.500 4.249 4.060 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 34 VAL HB 1 51 LEU MD2 4.000 . 6.500 4.189 3.832 4.780 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 34 VAL MG2 1 90 ILE MG 4.000 . 8.000 4.397 4.208 4.622 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 34 VAL HB 1 92 VAL QG 4.000 . 7.400 4.250 4.078 4.502 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 35 TRP H 1 35 TRP HB3 4.000 . 5.000 3.613 3.594 3.639 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 35 TRP H 1 35 TRP HB2 4.000 . 5.000 2.418 2.355 2.486 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 35 TRP H 1 35 TRP HD1 4.000 . 5.000 2.404 2.233 2.570 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 35 TRP HB2 1 35 TRP HE1 4.000 . 5.000 4.761 4.749 4.782 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 35 TRP HA 1 35 TRP HD1 4.000 . 5.000 4.096 3.971 4.180 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 35 TRP HA 1 35 TRP HE3 4.000 . 5.000 3.118 3.006 3.329 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 35 TRP HB3 1 35 TRP HE3 4.000 . 5.000 2.648 2.595 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 35 TRP HB2 1 35 TRP HE3 4.000 . 5.000 4.162 4.127 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 35 TRP H 1 50 SER HB3 4.000 . 5.000 3.952 2.996 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 35 TRP H 1 50 SER HB2 4.000 . 5.000 4.315 2.832 5.057 0.057 24 0 "[ . 1 . 2 . 3]" 1
574 1 35 TRP HB3 1 36 SER H 3.000 . 3.500 3.235 3.110 3.333 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 35 TRP HB2 1 36 SER H 4.000 . 5.000 4.203 4.117 4.272 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 35 TRP HE3 1 88 THR H 4.000 . 5.000 4.994 4.777 5.179 0.179 9 0 "[ . 1 . 2 . 3]" 1
577 1 35 TRP HZ3 1 88 THR H 5.000 3.000 6.000 5.379 5.274 5.559 . 0 0 "[ . 1 . 2 . 3]" 1
578 1 35 TRP HE3 1 89 LYS H 4.000 . 5.000 5.037 4.987 5.090 0.090 14 0 "[ . 1 . 2 . 3]" 1
579 1 35 TRP HZ3 1 89 LYS H 4.000 . 5.000 5.067 4.908 5.125 0.125 2 0 "[ . 1 . 2 . 3]" 1
580 1 35 TRP H 1 90 ILE H 4.000 . 5.000 4.875 4.765 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 35 TRP HE1 1 89 LYS QE 4.000 . 6.000 2.913 2.548 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 35 TRP HD1 1 50 SER HA 4.000 . 5.000 3.635 3.109 3.983 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 35 TRP HE1 1 89 LYS QG 4.000 . 6.000 4.274 3.726 4.492 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 35 TRP HE1 1 89 LYS QD 4.000 . 6.000 4.463 2.457 4.778 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 35 TRP HA 1 36 SER HA 4.000 . 5.000 4.433 4.409 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 35 TRP HZ2 1 89 LYS QE 4.000 . 6.000 2.703 2.378 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 35 TRP HZ2 1 89 LYS QG 4.000 . 6.000 4.254 3.898 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 35 TRP HZ2 1 89 LYS QD 4.000 . 6.000 4.527 2.918 4.914 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 35 TRP HD1 1 89 LYS QE 4.000 . 6.000 4.219 3.088 5.371 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 35 TRP HD1 1 83 LEU QD 4.000 . 7.400 2.459 2.246 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 35 TRP HD1 1 89 LYS QG 4.000 . 6.000 4.357 3.620 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 35 TRP HH2 1 89 LYS QE 4.000 . 6.000 3.502 2.910 5.309 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 35 TRP HH2 1 89 LYS QG 4.000 . 6.000 4.224 3.868 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 35 TRP HZ3 1 88 THR HA 4.000 . 5.000 3.970 3.584 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 35 TRP HZ3 1 87 ASP HA 5.000 3.000 6.000 5.116 4.834 5.429 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 35 TRP HZ3 1 87 ASP HB2 4.000 . 5.000 4.560 4.131 5.005 0.005 9 0 "[ . 1 . 2 . 3]" 1
597 1 35 TRP HZ3 1 89 LYS QG 4.000 . 6.000 3.876 3.546 4.005 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 35 TRP HE3 1 88 THR HA 4.000 . 5.000 4.476 4.203 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 35 TRP HE3 1 83 LEU HA 4.000 . 5.000 5.082 4.985 5.184 0.184 21 0 "[ . 1 . 2 . 3]" 1
600 1 35 TRP HE3 1 87 ASP HB2 4.000 . 5.000 3.179 2.602 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 35 TRP HE3 1 89 LYS QG 4.000 . 6.000 3.512 3.149 3.657 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 35 TRP HA 1 36 SER HB3 4.000 . 5.000 4.597 4.429 4.797 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 35 TRP HD1 1 50 SER QB 4.000 . 6.000 4.365 3.608 5.095 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 35 TRP HB2 1 50 SER QB 4.000 . 6.000 3.502 2.891 3.849 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 35 TRP HH2 1 88 THR HA 5.000 3.000 6.000 5.670 5.237 6.045 0.045 6 0 "[ . 1 . 2 . 3]" 1
606 1 35 TRP HB3 1 89 LYS HA 4.000 . 5.000 4.747 4.641 4.860 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 35 TRP HA 1 90 ILE QG 4.000 . 6.000 4.240 4.101 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 35 TRP HA 1 89 LYS QG 4.000 . 6.000 2.626 2.258 2.838 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 35 TRP HB3 1 37 ILE MG 4.000 . 6.500 3.835 3.555 4.264 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 35 TRP HB3 1 83 LEU MD1 4.000 . 6.500 3.985 2.482 4.739 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 35 TRP HB2 1 83 LEU MD1 4.000 . 6.500 3.337 2.142 4.111 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 35 TRP HB2 1 83 LEU MD2 4.000 . 6.500 2.871 2.120 3.971 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 35 TRP HA 1 90 ILE MG 4.000 . 6.500 4.821 4.624 5.108 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 35 TRP HA 1 90 ILE MD 4.000 . 6.500 5.378 5.294 5.431 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 35 TRP HE1 1 53 ASN HB2 4.000 . 5.000 4.945 4.539 5.135 0.135 16 0 "[ . 1 . 2 . 3]" 1
616 1 35 TRP HD1 1 89 LYS QD 4.000 . 6.000 5.113 3.499 5.264 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 35 TRP HE1 1 83 LEU HG 5.000 3.000 6.000 5.394 4.664 6.113 0.113 11 0 "[ . 1 . 2 . 3]" 1
618 1 35 TRP HE1 1 83 LEU QB 4.000 . 6.000 4.977 4.435 5.375 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 35 TRP HE1 1 83 LEU QD 4.000 . 7.400 3.019 2.773 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 35 TRP HE3 1 87 ASP H 4.000 . 5.000 3.563 3.158 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 35 TRP HE3 1 89 LYS HB3 5.000 3.000 6.000 5.995 5.718 6.124 0.124 28 0 "[ . 1 . 2 . 3]" 1
622 1 35 TRP HB2 1 50 SER HA 4.000 . 5.000 3.761 3.483 4.009 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 35 TRP HZ3 1 87 ASP H 4.000 . 5.000 3.661 3.128 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 35 TRP HE3 1 36 SER H 4.000 . 5.000 3.801 3.593 4.080 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 35 TRP HE3 1 83 LEU QD 4.000 . 7.400 4.199 3.538 5.000 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 35 TRP HE3 1 89 LYS QE 4.000 . 6.000 4.567 4.223 5.062 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 35 TRP HE3 1 86 ARG HA 4.000 . 5.000 4.796 4.479 5.061 0.061 29 0 "[ . 1 . 2 . 3]" 1
628 1 36 SER H 1 36 SER QB 2.500 . 3.500 2.439 2.276 2.608 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 36 SER QB 1 37 ILE H 3.000 . 4.500 2.996 2.711 3.663 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 36 SER H 1 90 ILE H 4.000 . 5.000 4.070 3.850 4.290 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 36 SER H 1 90 ILE QG 4.000 . 6.000 3.602 3.376 3.838 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 36 SER H 1 90 ILE MD 4.000 . 6.500 4.285 4.127 4.461 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 36 SER H 1 90 ILE MG 4.000 . 6.500 3.733 3.516 3.969 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 36 SER HA 1 95 PHE QD 4.000 . 5.000 3.501 3.258 3.951 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 36 SER HA 1 95 PHE QE 4.000 . 5.000 4.055 3.626 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 36 SER QB 1 95 PHE QD 5.000 . 7.000 4.908 4.531 5.447 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 36 SER QB 1 37 ILE HA 4.000 . 6.000 4.508 4.405 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 36 SER HB3 1 90 ILE MD 4.000 . 6.500 3.060 2.370 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 36 SER HB2 1 90 ILE MD 4.000 . 6.500 2.980 2.481 3.436 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 36 SER HB3 1 90 ILE MG 4.000 . 6.500 2.717 2.189 3.752 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 36 SER HB2 1 90 ILE MG 4.000 . 6.500 3.280 2.300 4.020 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 36 SER HB3 1 90 ILE QG 4.000 . 6.000 3.393 2.666 4.707 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 36 SER HB2 1 90 ILE QG 4.000 . 6.000 3.926 2.748 4.453 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 36 SER HA 1 37 ILE QG 4.000 . 6.000 3.570 3.455 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 36 SER HA 1 90 ILE MD 3.000 . 4.800 2.746 2.594 3.014 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 36 SER HA 1 90 ILE MG 4.000 . 6.500 3.944 3.701 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 36 SER HA 1 90 ILE QG 4.000 . 6.000 3.181 3.025 3.379 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 36 SER QB 1 90 ILE HB 4.000 . 6.000 4.725 4.520 5.051 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 36 SER QB 1 90 ILE H 4.000 . 6.000 4.321 4.029 4.595 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 36 SER QB 1 88 THR H 4.000 . 6.000 4.291 3.067 4.963 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 36 SER H 1 88 THR H 4.000 . 5.000 4.626 4.205 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 37 ILE HB 1 37 ILE MD 3.000 . 5.000 2.284 2.234 2.322 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 37 ILE H 1 37 ILE MD 4.000 . 6.500 3.923 3.830 3.984 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 37 ILE H 1 37 ILE MG 4.000 . 6.500 3.008 2.866 3.115 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 37 ILE H 1 37 ILE QG 3.000 . 4.500 2.217 2.120 2.283 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 37 ILE H 1 37 ILE HB 4.000 . 5.000 3.829 3.769 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 37 ILE HA 1 37 ILE MD 4.000 . 6.500 4.134 4.126 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 37 ILE H 1 39 LEU MD1 4.000 . 6.500 4.857 4.643 5.275 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 37 ILE HB 1 38 ASN H 3.000 . 3.500 2.476 2.349 2.572 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 37 ILE MD 1 38 ASN H 4.000 . 6.500 4.084 3.895 4.196 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 37 ILE QG 1 38 ASN H 4.000 . 6.000 3.735 3.566 3.853 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 37 ILE H 1 95 PHE QD 4.000 . 5.000 4.500 4.327 4.748 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 37 ILE H 1 95 PHE QE 4.000 . 5.000 4.028 3.800 4.314 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 37 ILE QG 1 38 ASN HA 4.000 . 6.000 4.327 4.214 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 37 ILE MG 1 95 PHE HZ 4.000 . 6.500 4.553 4.200 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 37 ILE MG 1 50 SER QB 4.000 . 7.500 3.066 2.518 3.749 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 37 ILE MD 1 43 MET HA 3.000 . 4.800 3.174 2.918 3.321 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 37 ILE QG 1 47 ALA HA 4.000 . 6.000 3.869 3.581 4.056 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 37 ILE MG 1 47 ALA HA 4.000 . 6.500 3.514 3.148 3.910 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 37 ILE MD 1 39 LEU HA 3.000 . 4.800 3.722 3.594 3.850 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 37 ILE QG 1 95 PHE HZ 4.000 . 6.000 3.912 3.674 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 37 ILE QG 1 95 PHE QE 4.000 . 6.000 2.362 2.288 2.507 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 37 ILE QG 1 95 PHE QD 4.000 . 6.000 3.960 3.692 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 37 ILE QG 1 46 ALA MB 4.000 . 7.500 3.887 3.690 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 37 ILE QG 1 39 LEU HA 4.000 . 6.000 4.177 3.918 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 37 ILE QG 1 39 LEU MD1 3.000 . 5.800 2.796 2.539 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 37 ILE QG 1 39 LEU MD2 4.000 . 7.500 2.305 2.182 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 37 ILE MD 1 39 LEU MD1 4.000 . 8.000 2.536 2.174 2.998 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 37 ILE HA 1 46 ALA MB 4.000 . 6.500 4.767 4.428 5.210 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 37 ILE HB 1 46 ALA MB 4.000 . 6.500 2.823 2.472 3.201 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 37 ILE MD 1 46 ALA MB 4.000 . 8.000 2.220 1.955 2.419 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 37 ILE MG 1 46 ALA MB 4.000 . 8.000 2.720 2.516 2.962 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 37 ILE MG 1 47 ALA MB 4.000 . 8.000 4.484 4.189 4.761 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 37 ILE MG 1 82 SER HA 4.000 . 6.500 5.074 4.759 5.251 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 37 ILE MG 1 38 ASN QB 4.000 . 7.500 5.250 5.069 5.492 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 37 ILE MD 1 43 MET ME 4.000 . 8.000 5.452 4.979 5.567 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 37 ILE MG 1 49 GLU QG 4.000 . 7.500 3.783 3.532 4.236 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 37 ILE MD 1 95 PHE HZ 4.000 . 6.500 2.996 2.698 3.363 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 37 ILE MD 1 95 PHE QE 4.000 . 6.500 2.956 2.681 3.249 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 37 ILE MD 1 95 PHE QD 4.000 . 6.500 4.737 4.425 5.063 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 37 ILE MD 1 47 ALA HA 4.000 . 6.500 2.296 2.110 2.519 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 37 ILE MD 1 46 ALA HA 4.000 . 6.500 4.077 3.703 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 37 ILE MD 1 50 SER QB 4.000 . 7.500 3.729 3.376 4.082 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 37 ILE MD 1 43 MET QB 4.000 . 6.500 3.764 3.632 4.138 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 37 ILE MD 1 43 MET QG 4.000 . 7.500 3.959 3.664 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
696 1 37 ILE MD 1 47 ALA MB 4.000 . 8.000 2.430 2.213 2.646 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 37 ILE MD 1 99 LEU QD 4.000 . 8.900 3.589 3.333 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 37 ILE MD 1 45 CYS H 5.000 . 7.500 6.023 5.823 6.232 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 37 ILE MD 1 46 ALA H 5.000 . 7.500 4.427 4.164 4.631 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 37 ILE MG 1 46 ALA H 5.000 . 7.500 5.658 5.380 5.956 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 37 ILE H 1 90 ILE MD 4.000 . 6.500 4.011 3.802 4.319 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 37 ILE MD 1 47 ALA H 4.000 . 6.500 2.934 2.697 3.151 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 37 ILE H 1 90 ILE QG 4.000 . 6.000 5.198 5.027 5.377 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 38 ASN H 1 38 ASN QB 3.000 . 4.100 2.388 2.324 2.696 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 38 ASN H 1 39 LEU MD1 5.000 . 7.500 5.217 4.921 5.802 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 38 ASN QB 1 39 LEU H 4.000 . 6.000 3.569 3.260 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 38 ASN QB 1 40 THR H 4.000 . 6.000 4.892 4.442 5.132 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 38 ASN HA 1 39 LEU MD1 4.000 . 6.500 4.834 4.670 5.223 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 38 ASN HA 1 40 THR MG 4.000 . 6.500 4.309 4.103 4.527 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 38 ASN QB 1 46 ALA MB 4.000 . 7.500 5.116 4.693 5.542 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 38 ASN QB 1 40 THR MG 4.000 . 7.500 2.884 2.435 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 38 ASN H 1 46 ALA MB 4.000 . 6.500 4.366 4.024 4.746 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 38 ASN HA 1 39 LEU MD2 4.000 . 6.500 2.885 2.819 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 39 LEU HB3 1 39 LEU MD2 3.000 . 4.800 3.215 3.208 3.224 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 39 LEU HA 1 39 LEU MD1 3.000 . 4.800 2.133 2.084 2.238 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 39 LEU HA 1 39 LEU MD2 3.000 . 4.800 2.688 2.307 2.841 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 39 LEU H 1 39 LEU HB2 3.000 . 3.500 2.400 2.332 2.434 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 39 LEU HA 1 39 LEU HG 4.000 . 5.000 3.709 3.689 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 39 LEU H 1 39 LEU HG 4.000 . 5.000 3.801 3.688 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 39 LEU H 1 39 LEU MD2 3.000 . 5.000 1.751 1.715 1.866 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 39 LEU H 1 39 LEU MD1 4.000 . 6.500 3.624 3.464 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 39 LEU H 1 40 THR MG 4.000 . 6.500 3.838 3.682 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 39 LEU HB2 1 40 THR H 4.000 . 5.000 4.407 4.350 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 39 LEU MD1 1 40 THR H 4.000 . 6.500 3.637 3.530 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 39 LEU MD2 1 40 THR H 4.000 . 6.500 4.517 4.210 4.637 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 39 LEU MD1 1 102 HIS H 4.000 . 6.500 4.826 4.289 5.122 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 39 LEU MD1 1 102 HIS HD2 3.000 . 4.800 3.599 3.061 4.007 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 39 LEU MD2 1 102 HIS HD2 4.000 . 6.500 3.984 3.682 4.179 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 39 LEU HG 1 102 HIS HE1 4.000 . 5.000 4.560 4.223 4.940 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 39 LEU HB3 1 102 HIS HE1 4.000 . 5.000 3.230 2.975 3.570 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 39 LEU HB2 1 102 HIS HE1 4.000 . 5.000 2.933 2.703 3.233 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 39 LEU MD1 1 102 HIS HE1 4.000 . 6.500 5.013 4.714 5.300 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 39 LEU MD2 1 102 HIS HE1 4.000 . 6.500 4.787 4.526 5.158 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 39 LEU HB3 1 40 THR HA 4.000 . 5.000 4.474 4.404 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 39 LEU MD1 1 99 LEU HA 4.000 . 6.500 2.876 2.498 3.211 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 39 LEU MD1 1 43 MET HA 4.000 . 6.500 3.659 3.029 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 39 LEU HA 1 43 MET QG 4.000 . 6.000 2.293 2.233 2.620 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 39 LEU HA 1 43 MET QB 4.000 . 5.000 3.851 3.608 4.087 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 39 LEU MD1 1 43 MET QG 4.000 . 7.500 2.715 2.225 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 39 LEU MD1 1 43 MET QB 3.000 . 4.800 2.678 2.319 3.014 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 39 LEU MD2 1 43 MET QB 4.000 . 6.500 4.929 4.467 5.141 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 39 LEU MD1 1 102 HIS HB3 4.000 . 6.500 3.705 3.043 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 39 LEU MD1 1 102 HIS HB2 4.000 . 6.500 3.295 2.596 3.647 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 39 LEU MD2 1 98 ASP HB3 3.000 . 4.800 3.591 3.114 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 39 LEU MD2 1 98 ASP HB2 4.000 . 6.500 4.385 4.014 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 39 LEU MD1 1 98 ASP HB3 4.000 . 6.500 4.413 3.873 4.897 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 39 LEU MD1 1 47 ALA MB 3.000 . 6.300 3.749 3.306 3.980 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 39 LEU MD2 1 47 ALA MB 4.000 . 8.000 5.239 4.769 5.361 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 39 LEU MD1 1 95 PHE QE 4.000 . 6.500 4.671 4.362 4.938 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 39 LEU HA 1 40 THR MG 4.000 . 6.500 3.867 3.548 4.114 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 39 LEU HA 1 46 ALA MB 4.000 . 6.500 4.901 4.514 5.237 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 39 LEU MD1 1 46 ALA MB 4.000 . 8.000 4.382 3.848 4.756 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 39 LEU HA 1 43 MET ME 4.000 . 6.500 4.588 3.898 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
754 1 39 LEU HB3 1 43 MET ME 4.000 . 6.500 3.961 2.850 4.418 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 39 LEU MD1 1 43 MET ME 4.000 . 8.000 3.395 2.279 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 39 LEU MD1 1 98 ASP HB2 4.000 . 6.500 4.797 4.279 5.268 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 39 LEU HG 1 102 HIS H 4.000 . 5.000 4.861 4.601 5.048 0.048 16 0 "[ . 1 . 2 . 3]" 1
758 1 39 LEU MD1 1 47 ALA HA 4.000 . 6.500 5.156 4.836 5.395 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 39 LEU QD 1 99 LEU QD 4.000 . 9.800 2.359 2.066 2.701 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 39 LEU HA 1 102 HIS HD2 5.000 3.000 6.000 5.720 5.345 5.986 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 39 LEU HB3 1 102 HIS HD2 4.000 . 5.000 3.591 3.219 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 40 THR HA 1 40 THR MG 3.000 . 4.600 2.294 2.226 2.406 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 40 THR H 1 40 THR MG 3.000 . 5.000 3.083 2.793 3.324 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 40 THR H 1 43 MET QB 4.000 . 5.000 3.915 3.786 4.091 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 40 THR H 1 43 MET H 4.000 . 5.000 4.010 3.667 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 40 THR MG 1 41 ALA H 4.000 . 6.500 3.521 3.452 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 40 THR HA 1 102 HIS HE1 4.000 . 5.000 4.689 4.211 5.075 0.075 1 0 "[ . 1 . 2 . 3]" 1
768 1 40 THR HB 1 41 ALA MB 4.000 . 6.500 3.492 3.372 3.685 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 40 THR MG 1 102 HIS HE1 4.000 . 6.500 5.011 4.711 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 40 THR HA 1 41 ALA MB 4.000 . 6.500 4.587 4.352 4.746 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 40 THR H 1 43 MET ME 4.000 . 6.500 4.164 3.669 5.011 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 40 THR HB 1 41 ALA H 4.000 . 5.000 2.216 1.800 2.737 0.000 4 0 "[ . 1 . 2 . 3]" 1
773 1 41 ALA H 1 41 ALA MB 2.500 . 4.000 2.374 2.280 2.553 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 41 ALA MB 1 42 GLY H 3.000 . 5.000 2.083 1.793 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 41 ALA HA 1 106 LEU QD 4.000 . 7.400 4.033 3.443 4.719 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 41 ALA MB 1 42 GLY QA 4.000 . 7.500 3.440 3.364 3.602 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 41 ALA MB 1 106 LEU QD 4.000 . 8.900 4.553 3.961 5.304 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 42 GLY HA3 1 46 ALA MB 4.000 . 7.500 4.219 3.503 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 42 GLY HA2 1 46 ALA MB 4.000 . 7.500 5.067 4.456 5.397 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 42 GLY QA 1 43 MET QG 4.000 . 7.000 4.223 4.138 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 43 MET QB 1 43 MET ME 3.000 . 4.800 2.032 1.928 2.086 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 43 MET HA 1 43 MET QG 3.000 . 3.900 2.358 2.279 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 43 MET H 1 43 MET QB 2.500 . 3.500 2.481 2.406 2.658 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 43 MET H 1 43 MET QG 4.000 . 6.000 2.044 1.913 2.196 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 43 MET H 1 44 TYR QD 4.000 . 5.000 3.693 3.467 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 43 MET QB 1 44 TYR H . . 3.500 2.489 2.232 2.574 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 43 MET QB 1 45 CYS H 5.000 3.000 6.000 4.796 4.539 4.957 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 43 MET QB 1 44 TYR QD 4.000 . 5.000 3.366 2.901 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 43 MET QB 1 44 TYR QE 4.000 . 5.000 3.876 3.460 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 43 MET QB 1 44 TYR HA 4.000 . 5.000 3.852 3.772 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 43 MET QB 1 99 LEU QD 4.000 . 7.400 2.872 2.594 3.352 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 43 MET QB 1 46 ALA MB 4.000 . 6.500 4.277 4.069 4.558 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 43 MET QG 1 99 LEU QD 4.000 . 8.400 4.262 3.843 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 43 MET QG 1 46 ALA MB 4.000 . 7.500 4.200 3.907 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 43 MET ME 1 44 TYR QD 4.000 . 6.500 3.948 3.738 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 43 MET ME 1 44 TYR QE 4.000 . 6.500 3.323 2.964 3.636 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 43 MET ME 1 102 HIS HD2 4.000 . 6.500 5.348 4.898 5.462 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 43 MET ME 1 113 ASN HA 5.000 . 7.500 6.070 5.742 6.244 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 43 MET ME 1 102 HIS HA 4.000 . 6.500 4.197 4.025 4.347 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 43 MET ME 1 102 HIS HB3 4.000 . 6.500 2.265 2.111 2.374 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 43 MET ME 1 106 LEU QD 4.000 . 8.900 2.428 2.174 2.896 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 43 MET QB 1 47 ALA MB 4.000 . 6.500 3.506 3.014 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 43 MET ME 1 44 TYR HA 4.000 . 6.500 5.234 4.986 5.343 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 44 TYR H 1 44 TYR QB 2.500 . 3.500 2.439 2.363 2.523 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 44 TYR HA 1 44 TYR QD 3.000 . 3.300 2.877 2.807 2.957 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 44 TYR HA 1 44 TYR QE 4.000 . 5.000 4.554 4.493 4.616 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 44 TYR H 1 44 TYR QD 3.000 . 3.500 2.055 1.873 2.187 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 44 TYR H 1 44 TYR QE 4.000 . 5.000 4.008 3.864 4.161 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 44 TYR QB 1 44 TYR QE 4.000 . 6.000 3.964 3.958 3.973 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 44 TYR H 1 45 CYS HA 5.000 3.000 6.000 5.435 5.370 5.501 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 44 TYR H 1 45 CYS QB 4.000 . 6.000 4.826 4.640 5.002 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 44 TYR H 1 46 ALA MB 4.000 . 6.500 4.909 4.780 5.064 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 44 TYR H 1 47 ALA MB 4.000 . 6.500 4.414 4.255 4.575 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 44 TYR QD 1 45 CYS H 4.000 . 5.000 3.973 3.811 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 44 TYR QB 1 45 CYS H 3.000 . 4.500 2.438 2.333 2.560 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 44 TYR QB 1 46 ALA H 4.000 . 6.000 4.784 4.601 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 44 TYR QD 1 47 ALA MB 4.000 . 6.500 4.617 4.429 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 44 TYR QD 1 103 LEU MD2 4.000 . 6.500 4.034 3.756 4.299 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 44 TYR QD 1 113 ASN HA 4.000 . 5.000 4.488 3.537 5.061 0.061 9 0 "[ . 1 . 2 . 3]" 1
820 1 44 TYR QE 1 113 ASN HA 4.000 . 5.000 4.262 3.361 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 44 TYR QE 1 70 PHE QB 4.000 . 6.000 3.515 3.335 3.829 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 44 TYR QE 1 103 LEU MD2 3.000 . 4.800 2.711 2.284 3.024 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 44 TYR QE 1 103 LEU MD1 4.000 . 6.500 4.265 3.785 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 44 TYR QB 1 71 CYS HA 4.000 . 6.000 4.182 3.882 4.570 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 44 TYR QB 1 70 PHE HA 4.000 . 6.000 4.585 4.387 4.785 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 44 TYR HA 1 45 CYS HA 4.000 . 5.000 4.768 4.716 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 44 TYR QD 1 67 LEU QD 3.000 . 4.800 2.170 2.052 2.341 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 44 TYR QB 1 67 LEU QD 3.000 . 5.800 3.324 3.047 3.522 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 44 TYR QE 1 99 LEU QD 4.000 . 7.400 4.313 4.027 4.683 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 44 TYR QE 1 106 LEU QD 4.000 . 7.400 4.474 4.228 4.840 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 44 TYR QE 1 67 LEU QD 4.000 . 6.500 3.046 2.740 3.259 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 44 TYR QB 1 71 CYS QB 4.000 . 7.000 2.628 2.152 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 44 TYR QB 1 47 ALA MB 4.000 . 7.500 4.394 4.196 4.575 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 44 TYR QB 1 70 PHE QB 4.000 . 7.000 2.272 2.111 2.510 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 44 TYR QB 1 48 LEU HB2 4.000 . 6.000 4.460 4.235 4.694 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 44 TYR QB 1 71 CYS H 4.000 . 6.000 3.902 3.506 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 44 TYR QB 1 70 PHE H 4.000 . 6.000 4.046 3.880 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 44 TYR H 1 67 LEU QD 4.000 . 6.500 4.930 4.762 5.142 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 44 TYR H 1 70 PHE QB 4.000 . 6.000 4.576 4.330 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 44 TYR H 1 99 LEU QD 4.000 . 7.400 4.870 4.662 5.163 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 44 TYR QB 1 67 LEU HA 4.000 . 6.000 3.802 3.571 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 44 TYR QE 1 67 LEU HA 4.000 . 7.000 4.071 3.629 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 44 TYR QD 1 67 LEU QB 4.000 . 5.000 3.459 3.165 3.646 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 45 CYS H 1 45 CYS QB 2.500 . 3.500 2.444 2.285 2.674 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 45 CYS H 1 71 CYS HA 5.000 3.000 6.000 5.167 4.669 5.508 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 45 CYS H 1 47 ALA MB 4.000 . 6.500 4.736 4.609 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 45 CYS H 1 46 ALA MB 4.000 . 6.500 4.365 4.312 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 45 CYS QB 1 46 ALA H 3.000 . 4.500 2.362 2.174 2.525 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 45 CYS QB 1 49 GLU H 4.000 . 6.000 4.942 4.721 5.175 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 45 CYS HA 1 71 CYS HA 5.000 3.000 6.000 4.986 4.552 5.439 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 45 CYS HA 1 48 LEU MD1 4.000 . 6.500 5.146 4.848 5.454 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 45 CYS HA 1 48 LEU MD2 4.000 . 6.500 3.453 3.193 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 45 CYS HA 1 71 CYS QB 4.000 . 6.000 2.753 2.433 3.058 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 45 CYS HA 1 46 ALA MB 4.000 . 6.500 5.058 5.045 5.079 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 45 CYS HA 1 73 HIS HD2 4.000 . 5.000 5.070 4.675 5.240 0.240 24 0 "[ . 1 . 2 . 3]" 1
856 1 45 CYS HA 1 48 LEU HG 5.000 3.000 6.000 5.081 4.781 5.437 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 45 CYS QB 1 48 LEU MD2 4.000 . 7.500 4.732 4.442 5.087 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 45 CYS H 1 48 LEU HB3 5.000 3.000 6.000 5.244 5.074 5.463 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 45 CYS QB 1 73 HIS HE1 4.000 . 6.000 4.161 2.732 5.215 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 45 CYS QB 1 73 HIS HD2 4.000 . 6.000 3.879 3.524 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 45 CYS QB 1 71 CYS QB 4.000 . 7.000 3.807 3.604 4.062 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 45 CYS QB 1 75 VAL QG 4.000 . 8.400 4.279 3.768 5.022 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 45 CYS QB 1 46 ALA MB 4.000 . 7.500 3.731 3.537 3.864 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 45 CYS H 1 70 PHE QB 4.000 . 6.000 4.984 4.661 5.305 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 45 CYS QB 1 82 SER QB 4.000 . 7.000 5.340 4.779 5.662 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 45 CYS H 1 71 CYS QB 4.000 . 6.000 3.521 2.940 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 46 ALA H 1 46 ALA MB 2.500 . 4.000 2.235 2.197 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 46 ALA MB 1 47 ALA H 3.000 . 5.000 2.411 2.335 2.529 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 46 ALA MB 1 49 GLU H 4.000 . 6.500 4.873 4.807 4.916 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 46 ALA HA 1 49 GLU QG 4.000 . 6.000 2.313 2.232 2.405 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 46 ALA MB 1 47 ALA HA 4.000 . 6.500 3.799 3.763 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 46 ALA MB 1 82 SER QB 4.000 . 7.500 2.571 2.279 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 46 ALA MB 1 49 GLU QG 4.000 . 7.500 3.612 3.556 3.677 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 46 ALA MB 1 95 PHE HZ 5.000 . 7.500 5.462 5.315 5.622 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 46 ALA HA 1 82 SER QB 4.000 . 6.000 2.898 2.368 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 46 ALA H 1 49 GLU QG 4.000 . 6.000 4.437 4.334 4.545 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 46 ALA H 1 47 ALA MB 4.000 . 6.500 4.418 4.320 4.474 . 0 0 "[ . 1 . 2 . 3]" 1
878 1 47 ALA H 1 47 ALA MB 3.000 . 4.600 2.231 2.178 2.266 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 47 ALA H 1 95 PHE HZ 4.000 . 5.000 4.745 4.582 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 47 ALA H 1 48 LEU QB 4.000 . 6.000 4.452 4.371 4.522 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 47 ALA HA 1 95 PHE QE 4.000 . 5.000 3.390 3.083 3.581 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 47 ALA HA 1 95 PHE HZ 4.000 . 5.000 2.330 2.294 2.473 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 47 ALA MB 1 95 PHE QE 4.000 . 6.500 2.981 2.834 3.084 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 47 ALA MB 1 95 PHE HZ 4.000 . 6.500 2.207 2.072 2.323 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 47 ALA MB 1 50 SER QB 4.000 . 7.500 4.201 3.914 4.714 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 47 ALA HA 1 95 PHE QD 5.000 3.000 6.000 5.485 5.276 5.603 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 47 ALA HA 1 99 LEU QD 4.000 . 7.400 4.487 4.199 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 47 ALA MB 1 67 LEU QD 3.000 . 6.300 2.763 2.475 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 47 ALA MB 1 99 LEU HB2 4.000 . 6.500 4.284 4.154 4.432 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 47 ALA MB 1 95 PHE QD 4.000 . 6.500 4.823 4.681 4.912 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 47 ALA MB 1 49 GLU QG 4.000 . 7.500 4.881 4.803 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 47 ALA MB 1 99 LEU HB3 4.000 . 6.500 5.332 5.188 5.461 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 47 ALA MB 1 99 LEU QD 3.000 . 7.200 2.555 2.350 2.722 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 47 ALA MB 1 51 LEU MD1 4.000 . 8.000 3.213 2.883 3.535 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 47 ALA HA 1 51 LEU MD2 5.000 . 7.500 5.361 5.106 5.669 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 48 LEU HB2 1 48 LEU MD1 2.500 . 4.200 2.317 2.290 2.394 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 48 LEU HB3 1 48 LEU MD2 2.500 . 4.200 2.345 2.283 2.407 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 48 LEU HA 1 48 LEU MD1 2.500 . 4.200 2.116 2.082 2.147 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 48 LEU HA 1 48 LEU MD2 3.000 . 4.800 3.811 3.773 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 48 LEU H 1 48 LEU HB2 3.000 . 3.500 2.551 2.525 2.617 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 48 LEU H 1 48 LEU HB3 2.500 . 2.800 2.526 2.459 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 48 LEU H 1 48 LEU QD 4.000 . 6.700 3.698 3.682 3.715 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 48 LEU HA 1 48 LEU HG 4.000 . 5.000 3.131 3.084 3.270 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 48 LEU H 1 48 LEU HG 4.000 . 5.000 4.478 4.434 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 48 LEU H 1 49 GLU HA 5.000 3.000 6.000 5.494 5.478 5.509 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 48 LEU QB 1 49 GLU H 4.000 . 6.000 2.431 2.384 2.480 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 48 LEU QD 1 49 GLU H 3.000 . 5.900 3.766 3.701 3.797 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 48 LEU QB 1 50 SER H 4.000 . 6.000 4.682 4.616 4.756 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 48 LEU QD 1 51 LEU H 4.000 . 7.400 4.232 4.032 4.394 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 48 LEU QD 1 52 ILE H 4.000 . 7.400 3.749 3.398 4.057 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 48 LEU QD 1 65 ARG H 4.000 . 7.400 4.898 4.486 5.232 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 48 LEU QD 1 71 CYS H 4.000 . 7.400 4.576 4.436 4.886 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 48 LEU H 1 67 LEU QD 4.000 . 6.500 3.727 3.471 3.870 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 48 LEU QD 1 68 SER HB2 3.000 . 5.700 4.028 3.725 4.257 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 48 LEU MD1 1 64 GLN HA 3.000 . 4.800 2.763 2.363 3.142 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 48 LEU MD2 1 64 GLN HA 4.000 . 6.500 4.791 4.303 5.194 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 48 LEU MD2 1 49 GLU HA 4.000 . 6.500 4.703 4.597 4.769 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 48 LEU HG 1 49 GLU HA 4.000 . 5.000 3.461 3.343 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 48 LEU HB2 1 68 SER HA 4.000 . 5.000 4.520 4.205 4.985 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 48 LEU HA 1 67 LEU QD 4.000 . 6.500 2.885 2.433 3.259 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 48 LEU MD1 1 64 GLN HB3 4.000 . 6.500 2.815 2.355 3.304 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 48 LEU MD2 1 71 CYS HB3 4.000 . 6.500 3.081 2.416 3.789 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 48 LEU MD2 1 71 CYS HB2 4.000 . 6.500 3.858 2.742 5.169 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 48 LEU MD2 1 67 LEU HG 5.000 . 7.500 6.001 5.403 6.170 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 48 LEU MD1 1 51 LEU HB2 4.000 . 6.500 2.918 2.765 3.101 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 48 LEU MD1 1 64 GLN HB2 4.000 . 6.500 4.200 3.757 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 48 LEU HB2 1 71 CYS QB 4.000 . 6.000 3.869 3.542 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 48 LEU QD 1 67 LEU QB 4.000 . 7.400 2.384 2.124 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
929 1 48 LEU HG 1 52 ILE HB 4.000 . 5.000 4.824 4.164 5.153 0.153 15 0 "[ . 1 . 2 . 3]" 1
930 1 48 LEU QD 1 52 ILE HB 4.000 . 7.400 4.740 4.236 5.104 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 48 LEU HA 1 52 ILE MD 4.000 . 6.500 4.961 4.761 5.165 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 48 LEU QD 1 52 ILE MD 4.000 . 8.900 2.821 2.619 2.938 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 48 LEU HG 1 75 VAL HB 4.000 . 5.000 3.805 3.120 4.923 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 48 LEU HG 1 75 VAL QG 4.000 . 7.400 2.986 2.160 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 48 LEU QD 1 52 ILE HA 4.000 . 7.400 4.471 3.957 4.740 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 48 LEU QD 1 68 SER H 4.000 . 7.400 3.322 3.079 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 48 LEU QD 1 69 GLY H 4.000 . 7.400 5.020 4.791 5.225 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 48 LEU HA 1 67 LEU QB 4.000 . 5.000 3.717 3.513 3.965 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 48 LEU MD1 1 64 GLN QG 4.000 . 7.500 2.966 2.358 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 48 LEU MD1 1 52 ILE MG 4.000 . 8.000 5.003 4.605 5.228 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 48 LEU MD2 1 68 SER HB3 4.000 . 6.500 3.866 3.521 4.211 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 48 LEU HG 1 52 ILE MG 4.000 . 6.500 5.131 4.635 5.285 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 48 LEU MD2 1 73 HIS H 4.000 . 6.500 4.354 3.394 5.321 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 48 LEU HG 1 52 ILE MD 4.000 . 6.500 3.484 3.197 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 49 GLU HA 1 49 GLU QG 3.000 . 3.900 3.298 3.285 3.401 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 49 GLU H 1 49 GLU QG 4.000 . 6.000 1.836 1.772 1.918 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 49 GLU H 1 49 GLU QB 3.000 . 4.100 2.687 2.616 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 49 GLU H 1 83 LEU QD 4.000 . 7.400 5.150 4.554 5.529 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 49 GLU QG 1 50 SER H 4.000 . 6.000 2.048 1.925 2.546 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 49 GLU QB 1 50 SER QB 4.000 . 7.000 4.925 4.657 5.175 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 49 GLU HB2 1 80 PHE HD1 4.000 . 5.000 2.773 2.385 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 49 GLU HB2 1 80 PHE HE1 4.000 . 5.000 4.113 3.659 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 49 GLU QG 1 80 PHE HD1 4.000 . 6.000 4.380 4.110 4.677 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 49 GLU HA 1 80 PHE HD1 4.000 . 5.000 4.765 4.341 5.151 0.151 26 0 "[ . 1 . 2 . 3]" 1
955 1 49 GLU QG 1 50 SER QB 4.000 . 7.000 3.520 3.138 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 49 GLU HA 1 52 ILE QG 4.000 . 6.000 2.518 2.219 2.823 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 49 GLU QG 1 83 LEU QD 4.000 . 8.400 2.916 2.267 3.401 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 49 GLU QG 1 75 VAL QG 4.000 . 8.400 3.537 3.354 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 49 GLU HB3 1 75 VAL QG 3.000 . 5.700 2.160 2.025 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 49 GLU HB2 1 75 VAL QG 4.000 . 7.400 2.953 2.440 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 49 GLU HB2 1 83 LEU QB 4.000 . 6.000 5.238 4.715 5.420 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 49 GLU HA 1 52 ILE HB 4.000 . 5.000 2.621 2.343 2.766 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 49 GLU HA 1 52 ILE MD 4.000 . 6.500 4.231 3.951 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 49 GLU QB 1 52 ILE MD 4.000 . 7.500 5.384 5.154 5.650 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 49 GLU HA 1 52 ILE MG 4.000 . 6.500 3.888 3.650 3.979 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 49 GLU HB3 1 82 SER QB 5.000 . 7.000 5.224 4.845 5.801 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 49 GLU HA 1 75 VAL QG 3.000 . 5.700 2.497 2.088 3.084 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 49 GLU HB2 1 50 SER HA 4.000 . 5.000 4.326 4.249 4.451 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 49 GLU HB3 1 52 ILE MG 4.000 . 6.500 5.369 5.243 5.449 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 49 GLU HB2 1 52 ILE MG 4.000 . 6.500 5.066 4.934 5.168 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 50 SER H 1 50 SER QB 2.500 . 3.500 2.417 2.277 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 50 SER H 1 51 LEU HB2 4.000 . 5.000 4.826 4.726 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 50 SER H 1 83 LEU QD 4.000 . 7.400 3.827 3.222 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 50 SER QB 1 51 LEU H 3.000 . 4.500 2.841 2.519 3.400 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 50 SER QB 1 95 PHE QD 4.000 . 6.000 4.376 3.987 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 50 SER HB3 1 95 PHE QE 4.000 . 5.000 3.649 3.185 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 50 SER HB2 1 95 PHE HZ 4.000 . 5.000 3.989 3.180 4.932 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 50 SER HB3 1 95 PHE HZ 4.000 . 5.000 4.296 3.218 4.760 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 50 SER HB2 1 95 PHE QE 4.000 . 5.000 3.577 3.151 4.054 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 50 SER QB 1 83 LEU QD 4.000 . 8.400 3.492 2.876 4.182 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 50 SER QB 1 51 LEU MD2 4.000 . 7.500 4.001 3.728 4.571 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 50 SER HA 1 83 LEU QD 4.000 . 7.400 2.784 2.287 3.082 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 50 SER QB 1 51 LEU HA 4.000 . 6.000 4.132 3.911 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 50 SER HA 1 51 LEU HA 4.000 . 5.000 4.779 4.758 4.809 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 50 SER HA 1 80 PHE HE1 4.000 . 5.000 4.768 4.236 5.006 0.006 7 0 "[ . 1 . 2 . 3]" 1
986 1 50 SER HA 1 80 PHE HD1 4.000 . 5.000 4.975 4.846 5.092 0.092 26 0 "[ . 1 . 2 . 3]" 1
987 1 50 SER HA 1 53 ASN HB2 4.000 . 5.000 3.853 3.614 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 51 LEU HA 1 51 LEU MD1 4.000 . 6.500 3.821 3.796 3.848 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 51 LEU HA 1 51 LEU MD2 3.000 . 4.800 2.150 2.119 2.179 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 51 LEU H 1 51 LEU QB 3.000 . 4.100 2.388 2.337 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 51 LEU HA 1 51 LEU HG 4.000 . 5.000 2.888 2.809 3.008 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 51 LEU HB3 1 51 LEU MD1 3.000 . 4.800 2.448 2.357 2.499 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 51 LEU HB2 1 51 LEU MD1 3.000 . 4.800 2.274 2.237 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 51 LEU HB3 1 51 LEU MD2 3.000 . 4.800 2.252 2.237 2.272 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 51 LEU HB2 1 51 LEU MD2 3.000 . 4.800 3.216 3.211 3.221 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 51 LEU H 1 51 LEU HG 4.000 . 5.000 2.310 2.105 2.402 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 51 LEU H 1 51 LEU MD1 4.000 . 6.500 3.510 3.454 3.585 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 51 LEU H 1 51 LEU MD2 4.000 . 6.500 3.554 3.323 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 51 LEU H 1 95 PHE HZ 4.000 . 5.000 4.851 4.546 5.066 0.066 9 0 "[ . 1 . 2 . 3]" 1
1000 1 51 LEU H 1 52 ILE HB 5.000 3.000 6.000 4.704 4.573 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 51 LEU QB 1 52 ILE H 4.000 . 6.000 2.687 2.576 2.809 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 51 LEU HB2 1 53 ASN H 4.000 . 5.000 4.812 4.701 4.964 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 51 LEU MD2 1 95 PHE QD 4.000 . 6.500 3.410 3.139 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
1004 1 51 LEU MD2 1 95 PHE QE 4.000 . 6.500 3.113 2.733 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 51 LEU MD2 1 63 THR HB 4.000 . 6.500 4.933 4.533 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 51 LEU MD2 1 92 VAL HA 4.000 . 6.500 4.811 4.561 5.352 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 51 LEU HB2 1 52 ILE HA 4.000 . 5.000 4.365 4.254 4.487 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 51 LEU HA 1 52 ILE HA 4.000 . 5.000 4.877 4.847 4.899 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 51 LEU MD1 1 60 ILE QG 4.000 . 7.500 4.828 4.559 5.096 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 51 LEU MD2 1 60 ILE QG 4.000 . 7.500 4.280 3.958 4.655 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 51 LEU MD1 1 67 LEU QD 3.000 . 6.300 1.921 1.800 2.041 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 51 LEU MD1 1 63 THR MG 4.000 . 8.000 2.853 2.658 3.043 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 51 LEU MD2 1 92 VAL QG 4.000 . 8.900 3.079 2.816 3.339 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 51 LEU MD1 1 54 VAL HB 5.000 . 7.500 5.438 5.134 5.630 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 51 LEU MD1 1 60 ILE MD 4.000 . 8.000 3.642 3.239 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 51 LEU MD2 1 60 ILE MD 4.000 . 8.000 2.443 2.224 2.780 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 51 LEU MD2 1 96 VAL MG1 4.000 . 8.000 5.432 5.125 5.768 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 51 LEU HB3 1 60 ILE MD 4.000 . 6.500 3.348 2.870 3.883 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 51 LEU HB3 1 67 LEU QD 4.000 . 6.500 4.331 4.197 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 51 LEU HB2 1 67 LEU QD 4.000 . 6.500 3.851 3.666 4.032 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 51 LEU MD1 1 60 ILE MG 4.000 . 8.000 4.493 4.071 4.926 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 51 LEU HA 1 60 ILE MD 4.000 . 6.500 4.102 3.716 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 51 LEU MD2 1 64 GLN QG 4.000 . 7.500 4.006 3.199 4.824 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 51 LEU HB3 1 54 VAL H 4.000 . 5.000 4.499 4.342 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 51 LEU MD2 1 52 ILE H 4.000 . 6.500 4.744 4.676 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 51 LEU MD2 1 95 PHE HZ 4.000 . 6.500 4.240 3.878 4.682 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 51 LEU HA 1 54 VAL MG2 4.000 . 6.500 2.497 2.245 3.019 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 51 LEU MD1 1 64 GLN QG 4.000 . 7.500 2.826 2.228 3.756 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 52 ILE H 1 52 ILE MD 4.000 . 6.500 3.418 3.104 3.876 . 0 0 "[ . 1 . 2 . 3]" 1
1030 1 52 ILE H 1 52 ILE QG 4.000 . 6.000 2.273 2.104 2.450 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 52 ILE H 1 52 ILE MG 4.000 . 6.500 3.768 3.741 3.784 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 52 ILE H 1 52 ILE HB 3.000 . 3.500 2.435 2.334 2.540 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 52 ILE HA 1 52 ILE MG 3.000 . 4.400 2.484 2.398 2.562 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 52 ILE HA 1 52 ILE QG 2.500 . 3.300 2.817 2.555 2.961 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 52 ILE HA 1 52 ILE MD 4.000 . 6.500 2.104 2.073 2.214 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 52 ILE HB 1 52 ILE MD 3.000 . 4.800 3.233 3.215 3.239 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 52 ILE HB 1 53 ASN H 4.000 . 5.000 3.209 3.023 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 52 ILE HG13 1 53 ASN H 4.000 . 6.000 5.437 5.241 5.576 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 52 ILE HG12 1 53 ASN H 4.000 . 6.000 4.636 4.478 4.759 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 52 ILE MG 1 53 ASN H 3.000 . 5.000 3.685 3.539 3.795 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 52 ILE QG 1 54 VAL H 5.000 . 7.000 5.632 5.485 5.788 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 52 ILE HB 1 77 ALA HA 4.000 . 5.000 4.245 3.961 4.474 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 52 ILE QG 1 77 ALA HA 4.000 . 6.000 4.897 4.607 5.216 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 52 ILE MG 1 77 ALA HA 3.000 . 4.800 2.230 2.102 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 52 ILE HA 1 53 ASN HA 4.000 . 5.000 4.702 4.683 4.734 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 52 ILE MG 1 53 ASN HA 4.000 . 6.500 3.506 3.380 3.594 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 52 ILE HB 1 53 ASN HA 4.000 . 5.000 4.634 4.475 4.766 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 52 ILE HB 1 77 ALA H 5.000 3.000 6.000 5.898 5.063 6.140 0.140 10 0 "[ . 1 . 2 . 3]" 1
1049 1 52 ILE MG 1 78 GLY H 4.000 . 6.500 4.542 4.150 4.806 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 52 ILE MG 1 77 ALA H 4.000 . 6.500 3.151 2.514 3.360 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 52 ILE QG 1 77 ALA MB 4.000 . 7.500 5.359 5.177 5.492 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 52 ILE MG 1 53 ASN HB2 4.000 . 6.500 5.187 5.033 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 52 ILE MD 1 64 GLN QG 4.000 . 7.500 3.829 3.016 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 52 ILE MD 1 64 GLN HB3 4.000 . 6.500 3.831 3.429 4.567 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 52 ILE MD 1 76 SER HA 4.000 . 6.500 4.154 3.127 4.715 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 52 ILE MD 1 77 ALA H 4.000 . 6.500 4.828 4.300 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 52 ILE HA 1 64 GLN QG 4.000 . 6.000 4.788 4.443 5.088 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 52 ILE QG 1 75 VAL HA 4.000 . 6.000 4.868 4.664 5.139 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 52 ILE MG 1 75 VAL HA 4.000 . 6.500 5.215 5.116 5.315 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 52 ILE QG 1 76 SER HA 4.000 . 6.000 4.521 3.794 5.008 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 53 ASN H 1 53 ASN HB2 2.500 . 2.900 2.383 2.326 2.442 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 53 ASN H 1 53 ASN HB3 4.000 . 5.000 3.627 3.606 3.650 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 53 ASN H 1 54 VAL HB 4.000 . 5.000 4.674 4.532 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 53 ASN HB3 1 54 VAL H 4.000 . 5.000 4.013 3.876 4.089 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 53 ASN HB2 1 54 VAL H 4.000 . 5.000 3.211 3.001 3.378 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 53 ASN HB2 1 54 VAL HA 4.000 . 5.000 4.635 4.562 4.734 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 53 ASN HA 1 54 VAL HA 4.000 . 5.000 4.687 4.667 4.699 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 53 ASN HA 1 77 ALA MB 4.000 . 6.500 4.211 3.076 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 53 ASN HB2 1 83 LEU QD 4.000 . 7.400 4.381 3.764 4.774 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 53 ASN HB3 1 54 VAL MG2 4.000 . 6.500 4.046 3.813 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 53 ASN HB2 1 54 VAL MG2 4.000 . 6.500 3.241 3.031 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 53 ASN HB3 1 83 LEU QD 4.000 . 7.400 4.759 4.377 5.301 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 54 VAL HA 1 54 VAL MG1 2.500 . 3.800 2.304 2.240 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 54 VAL HA 1 54 VAL MG2 2.500 . 3.800 2.395 2.274 2.484 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 54 VAL H 1 54 VAL MG2 3.000 . 5.000 2.263 2.084 2.491 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 54 VAL H 1 54 VAL MG1 4.000 . 6.500 3.807 3.765 3.839 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 54 VAL H 1 54 VAL HB 3.000 . 3.500 2.546 2.416 2.652 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 54 VAL MG1 1 55 SER H 2.500 . 4.400 2.843 2.701 2.947 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 54 VAL MG2 1 55 SER H 4.000 . 6.500 4.152 4.056 4.243 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 54 VAL MG1 1 56 GLY H 4.000 . 6.500 4.805 4.566 5.056 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 54 VAL MG1 1 57 CYS H 4.000 . 6.500 3.688 3.117 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 54 VAL MG1 1 57 CYS HA 4.000 . 6.500 4.785 4.486 5.170 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 54 VAL HA 1 55 SER QB 4.000 . 6.000 4.421 4.350 4.489 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 54 VAL HB 1 57 CYS HB2 4.000 . 5.000 4.384 3.986 4.828 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 54 VAL HA 1 55 SER HA 4.000 . 5.000 4.494 4.487 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 54 VAL MG1 1 55 SER HA 4.000 . 6.500 3.788 3.650 3.977 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 54 VAL MG1 1 57 CYS HB3 3.000 . 4.800 3.645 3.385 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 54 VAL MG1 1 57 CYS HB2 3.000 . 4.800 2.580 2.265 2.941 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 54 VAL MG2 1 57 CYS HB2 4.000 . 6.500 5.062 4.742 5.369 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 54 VAL HB 1 60 ILE MD 4.000 . 6.500 2.627 2.230 3.446 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 54 VAL MG2 1 60 ILE MD 4.000 . 8.000 3.250 2.871 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 55 SER H 1 55 SER QB 2.500 . 3.500 2.591 2.518 2.667 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 56 GLY H 1 57 CYS HB2 5.000 3.000 6.000 4.778 4.549 4.965 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 57 CYS H 1 57 CYS HB3 4.000 . 5.000 3.766 3.638 3.920 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 57 CYS H 1 57 CYS HB2 3.000 . 3.500 2.607 2.376 2.845 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 57 CYS HB2 1 60 ILE H 4.000 . 5.000 4.042 3.755 4.785 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 57 CYS HA 1 60 ILE MD 4.000 . 6.500 4.852 4.641 5.160 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 57 CYS HB3 1 60 ILE MD 4.000 . 6.500 2.986 2.670 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 57 CYS HB2 1 60 ILE MD 4.000 . 6.500 2.405 2.240 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 57 CYS HB3 1 60 ILE QG 4.000 . 6.000 2.313 2.278 2.438 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 57 CYS HB2 1 60 ILE QG 4.000 . 6.000 2.443 2.235 3.100 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 57 CYS HB3 1 60 ILE MG 4.000 . 6.500 3.214 2.816 3.661 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 57 CYS HB2 1 60 ILE MG 4.000 . 6.500 4.001 3.672 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 57 CYS HA 1 60 ILE QG 4.000 . 6.000 4.179 4.030 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 58 SER QB 1 59 ALA H 3.000 . 4.500 2.676 2.546 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 58 SER QB 1 60 ILE H 4.000 . 6.000 4.625 4.336 4.972 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 58 SER QB 1 61 GLU H 4.000 . 6.000 4.630 4.384 4.781 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 58 SER QB 1 61 GLU QG 4.000 . 7.000 4.513 3.676 5.466 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 58 SER QB 1 61 GLU QB 4.000 . 7.000 4.086 3.459 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 58 SER QB 1 59 ALA MB 4.000 . 7.500 4.086 3.980 4.268 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 58 SER HA 1 61 GLU QG 3.000 . 4.300 2.974 2.063 4.127 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 58 SER HA 1 61 GLU QB 3.000 . 4.300 2.528 2.056 3.076 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 59 ALA H 1 59 ALA MB 2.500 . 4.000 2.231 2.176 2.267 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 59 ALA H 1 60 ILE MG 4.000 . 6.500 4.410 4.259 4.547 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 59 ALA MB 1 60 ILE H 3.000 . 5.000 2.876 2.562 3.110 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 59 ALA MB 1 61 GLU H 4.000 . 6.500 4.483 4.361 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 59 ALA MB 1 60 ILE HA 4.000 . 6.500 4.061 3.944 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 59 ALA MB 1 60 ILE MG 4.000 . 8.000 2.707 2.518 2.861 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 60 ILE HA 1 60 ILE MD 4.000 . 6.500 4.128 4.109 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 60 ILE HA 1 60 ILE MG 3.000 . 4.400 2.316 2.262 2.376 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 60 ILE H 1 60 ILE MG 3.000 . 5.000 2.641 2.419 2.911 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 60 ILE H 1 60 ILE MD 3.000 . 5.000 3.757 3.622 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 60 ILE H 1 60 ILE QG 3.000 . 4.500 2.021 1.910 2.163 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 60 ILE H 1 60 ILE HB 4.000 . 5.000 3.756 3.700 3.853 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 60 ILE H 1 61 GLU QG 4.000 . 6.000 4.438 3.610 5.619 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 60 ILE H 1 61 GLU QB 4.000 . 6.000 4.157 3.656 4.517 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 60 ILE QG 1 61 GLU H 4.000 . 6.000 2.925 2.728 3.308 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 60 ILE MG 1 61 GLU H 4.000 . 6.500 4.181 4.089 4.293 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 60 ILE MD 1 61 GLU H 4.000 . 6.500 4.608 4.431 4.939 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 60 ILE HA 1 63 THR HB 3.000 . 3.300 2.833 2.437 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 60 ILE HB 1 63 THR HB 4.000 . 5.000 2.831 2.343 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 60 ILE QG 1 63 THR HB 4.000 . 6.000 4.424 3.974 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 60 ILE HA 1 63 THR HA 4.000 . 5.000 4.982 4.741 5.083 0.083 14 0 "[ . 1 . 2 . 3]" 1
1134 1 60 ILE QG 1 64 GLN H 4.000 . 6.000 4.687 4.381 4.956 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 60 ILE QG 1 61 GLU HA 4.000 . 6.000 3.401 3.304 3.568 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 60 ILE MD 1 61 GLU HA 4.000 . 6.500 4.802 4.652 5.035 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 60 ILE HA 1 62 LYS HB2 4.000 . 5.000 4.500 4.214 4.716 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 60 ILE QG 1 64 GLN QG 4.000 . 7.000 3.570 3.169 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 60 ILE HA 1 63 THR MG 4.000 . 6.500 4.096 3.745 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 60 ILE MG 1 63 THR HB 4.000 . 6.500 3.786 3.548 3.998 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 60 ILE MD 1 63 THR HB 4.000 . 6.500 4.552 4.052 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 60 ILE MD 1 64 GLN QG 4.000 . 7.500 3.724 3.347 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 60 ILE MD 1 64 GLN HB2 5.000 . 7.500 5.887 5.552 6.173 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 61 GLU H 1 61 GLU QB 2.500 . 3.500 2.332 2.204 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 61 GLU H 1 61 GLU QG 3.000 . 4.500 2.902 2.236 4.028 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 61 GLU HA 1 61 GLU QG 3.000 . 4.100 2.512 2.255 3.317 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 61 GLU H 1 64 GLN H 4.000 . 5.000 4.828 4.627 4.918 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 61 GLU QB 1 62 LYS H 3.000 . 4.500 2.642 2.311 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 61 GLU QG 1 62 LYS H 4.000 . 6.000 3.699 1.741 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 61 GLU QB 1 63 THR H 4.000 . 6.000 4.680 4.509 5.085 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 61 GLU QB 1 62 LYS HA 4.000 . 6.000 4.059 3.900 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 61 GLU QB 1 62 LYS QG 4.000 . 7.000 3.431 3.023 4.259 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 61 GLU QG 1 62 LYS QG 4.000 . 7.000 4.446 2.196 5.361 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 62 LYS H 1 62 LYS HB3 4.000 . 5.000 3.614 3.597 3.634 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 62 LYS H 1 62 LYS HB2 2.500 . 2.900 2.425 2.402 2.455 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 62 LYS H 1 62 LYS QG 4.000 . 6.000 2.271 2.168 2.320 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 62 LYS HA 1 62 LYS QG 3.000 . 3.900 2.320 2.278 2.633 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 62 LYS HA 1 62 LYS QD 4.000 . 6.000 3.908 2.232 4.143 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 62 LYS HB3 1 63 THR H 4.000 . 5.000 3.589 3.543 3.655 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 62 LYS HB2 1 63 THR H 3.000 . 3.500 2.639 2.556 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 62 LYS QG 1 65 ARG H 4.000 . 6.000 5.353 5.190 5.479 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 62 LYS HB2 1 63 THR HA 4.000 . 5.000 4.386 4.338 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 62 LYS HA 1 66 MET ME 4.000 . 6.500 4.414 3.851 5.532 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 62 LYS QG 1 66 MET ME 4.000 . 7.500 4.764 4.273 5.524 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 62 LYS QD 1 66 MET ME 4.000 . 7.500 4.400 3.899 4.903 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 62 LYS HB3 1 66 MET ME 4.000 . 6.500 3.073 2.549 4.033 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 62 LYS HA 1 66 MET QG 4.000 . 6.000 4.490 4.083 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 62 LYS HB3 1 66 MET QG 4.000 . 6.000 3.944 3.669 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 62 LYS QG 1 66 MET QG 4.000 . 7.000 5.292 4.916 5.453 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 62 LYS HB2 1 62 LYS QE 4.000 . 6.000 3.787 2.187 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 63 THR HA 1 63 THR MG 3.000 . 4.600 2.331 2.302 2.362 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 63 THR H 1 63 THR MG 3.000 . 5.000 3.767 3.753 3.777 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 63 THR H 1 64 GLN QG 4.000 . 6.000 4.420 4.334 4.504 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 63 THR H 1 64 GLN QB 4.000 . 6.000 4.698 4.608 4.744 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 63 THR HB 1 64 GLN H 3.000 . 3.500 2.621 2.563 2.679 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 63 THR MG 1 64 GLN H 3.000 . 5.000 3.490 3.442 3.534 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 63 THR HB 1 64 GLN QG 4.000 . 6.000 3.407 3.323 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 63 THR HB 1 66 MET QB 5.000 . 7.000 5.375 4.898 5.557 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 63 THR HA 1 66 MET QG 4.000 . 6.000 3.653 3.262 3.933 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 63 THR HA 1 67 LEU HG 4.000 . 5.000 4.003 3.861 4.260 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 63 THR HA 1 67 LEU QD 4.000 . 6.500 4.178 4.087 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 63 THR HB 1 64 GLN HA 4.000 . 5.000 4.277 4.236 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 63 THR MG 1 64 GLN HA 4.000 . 6.500 3.518 3.459 3.582 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 63 THR HB 1 66 MET ME 4.000 . 6.500 4.515 4.361 5.435 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 63 THR HA 1 66 MET ME 4.000 . 6.500 2.138 2.042 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 63 THR MG 1 67 LEU HG 4.000 . 6.500 2.538 2.313 2.712 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 63 THR MG 1 67 LEU QD 4.000 . 8.000 2.053 1.976 2.231 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 63 THR MG 1 67 LEU QB 4.000 . 6.500 3.864 3.760 4.066 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 63 THR MG 1 64 GLN QG 4.000 . 7.500 3.838 3.672 4.054 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 63 THR MG 1 64 GLN HB2 4.000 . 6.500 5.259 5.187 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 63 THR HB 1 67 LEU QD 4.000 . 6.500 3.805 3.686 3.953 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 63 THR HB 1 67 LEU HG 4.000 . 5.000 4.863 4.647 5.041 0.041 4 0 "[ . 1 . 2 . 3]" 1
1193 1 63 THR MG 1 66 MET H 4.000 . 6.500 4.658 4.479 4.797 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 64 GLN HA 1 64 GLN QG 3.000 . 3.900 2.409 2.296 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 64 GLN H 1 64 GLN HB3 4.000 . 5.000 3.610 3.599 3.624 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 64 GLN H 1 64 GLN HB2 3.000 . 3.500 2.433 2.416 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 64 GLN H 1 64 GLN QG 3.000 . 4.500 2.234 2.180 2.260 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 64 GLN HA 1 65 ARG HA 4.000 . 5.000 4.796 4.709 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 64 GLN HB2 1 65 ARG H 3.000 . 3.500 2.612 2.430 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 64 GLN HA 1 67 LEU HG 4.000 . 5.000 3.730 3.594 3.884 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 64 GLN HA 1 67 LEU QD 4.000 . 6.500 2.356 2.271 2.620 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 64 GLN QG 1 67 LEU QD 4.000 . 7.500 3.376 3.148 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 65 ARG QB 1 65 ARG QD 3.000 . 5.300 2.242 2.107 2.771 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 65 ARG H 1 65 ARG QB 3.000 . 4.100 2.357 2.259 2.743 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 65 ARG HA 1 65 ARG QG 3.000 . 3.900 2.463 2.272 3.308 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 65 ARG H 1 65 ARG QG 3.000 . 4.500 3.058 1.775 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 65 ARG HA 1 65 ARG QD 4.000 . 6.000 3.737 2.206 4.414 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 65 ARG QB 1 66 MET H 3.000 . 4.500 2.502 2.319 3.416 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 65 ARG QG 1 66 MET H 4.000 . 6.000 3.699 1.922 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 65 ARG QB 1 69 GLY H 4.000 . 6.000 5.276 4.908 5.481 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 66 MET H 1 66 MET QB 2.500 . 3.500 2.395 2.344 2.478 . 0 0 "[ . 1 . 2 . 3]" 1
1212 1 66 MET H 1 66 MET QG 3.000 . 4.500 2.304 2.212 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 66 MET HA 1 66 MET QG 3.000 . 3.900 2.272 2.246 2.377 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 66 MET HA 1 66 MET ME 4.000 . 6.500 4.409 4.263 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 66 MET H 1 69 GLY H 4.000 . 5.000 4.913 4.768 5.054 0.054 4 0 "[ . 1 . 2 . 3]" 1
1216 1 66 MET HA 1 69 GLY QA 4.000 . 6.000 3.860 3.622 4.122 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 66 MET QG 1 67 LEU H 4.000 . 6.000 4.158 4.032 4.271 . 0 0 "[ . 1 . 2 . 3]" 1
1218 1 66 MET QB 1 67 LEU H 2.500 . 3.900 2.628 2.552 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 66 MET QG 1 69 GLY H 4.000 . 6.000 5.253 5.114 5.387 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 66 MET QB 1 69 GLY H 4.000 . 6.000 4.745 4.659 4.884 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 67 LEU H 1 67 LEU HG 2.500 . 2.900 2.319 2.250 2.415 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 67 LEU H 1 67 LEU QD 3.000 . 5.000 3.149 3.122 3.186 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 67 LEU HA 1 67 LEU QD 3.000 . 5.000 2.158 2.126 2.185 . 0 0 "[ . 1 . 2 . 3]" 1
1224 1 67 LEU HA 1 67 LEU HG 4.000 . 5.000 2.857 2.804 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 67 LEU H 1 70 PHE H 5.000 3.000 6.000 5.261 5.132 5.387 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 67 LEU QB 1 68 SER H 3.000 . 3.500 2.584 2.537 2.662 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 67 LEU HG 1 68 SER H 4.000 . 5.000 4.395 4.322 4.480 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 67 LEU QD 1 68 SER H 4.000 . 6.500 4.106 4.067 4.166 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 67 LEU QB 1 69 GLY H 4.000 . 5.000 4.651 4.560 4.678 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 67 LEU QB 1 70 PHE H 4.000 . 5.000 4.629 4.539 4.703 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 67 LEU QD 1 70 PHE H 4.000 . 6.500 4.826 4.739 4.927 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 67 LEU HA 1 70 PHE QD 4.000 . 5.000 2.696 2.387 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 67 LEU HA 1 70 PHE QE 4.000 . 5.000 4.418 4.050 4.956 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 67 LEU HA 1 70 PHE QB 4.000 . 6.000 3.368 3.126 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 67 LEU QD 1 70 PHE QB 4.000 . 7.500 3.902 3.715 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 67 LEU QD 1 71 CYS QB 4.000 . 7.500 4.777 4.577 5.023 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 67 LEU QB 1 68 SER HA 4.000 . 5.000 3.894 3.864 3.945 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 68 SER H 1 68 SER QB 3.000 . 4.100 2.441 2.391 2.514 . 0 0 "[ . 1 . 2 . 3]" 1
1239 1 68 SER H 1 71 CYS H 5.000 3.000 6.000 4.763 4.562 5.075 . 0 0 "[ . 1 . 2 . 3]" 1
1240 1 68 SER H 1 70 PHE QB 5.000 . 7.000 5.397 5.165 5.634 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 68 SER HA 1 71 CYS QB 4.000 . 6.000 2.733 2.267 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 69 GLY H 1 70 PHE QD 4.000 . 5.000 4.108 3.945 4.259 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 69 GLY H 1 70 PHE QB 4.000 . 6.000 4.850 4.727 4.982 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 70 PHE HA 1 70 PHE QE 4.000 . 5.000 4.539 4.475 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 70 PHE HA 1 70 PHE QD 3.000 . 3.300 2.861 2.755 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 70 PHE H 1 70 PHE QB 3.000 . 4.100 2.375 2.300 2.459 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 70 PHE H 1 70 PHE QD 3.000 . 3.500 2.491 2.345 2.689 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 70 PHE H 1 70 PHE QE 4.000 . 5.000 4.572 4.400 4.842 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 70 PHE QB 1 70 PHE QE 4.000 . 6.000 3.959 3.949 3.964 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 70 PHE H 1 71 CYS HA 5.000 3.000 6.000 5.005 4.948 5.067 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 70 PHE H 1 71 CYS QB 4.000 . 6.000 4.122 3.935 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
1252 1 70 PHE QD 1 71 CYS H 4.000 . 5.000 4.430 4.255 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 70 PHE HB3 1 71 CYS H 4.000 . 5.000 4.087 3.857 4.306 . 0 0 "[ . 1 . 2 . 3]" 1
1254 1 70 PHE HB2 1 71 CYS H 4.000 . 5.000 3.318 3.087 3.641 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 70 PHE QD 1 113 ASN HA 4.000 . 5.000 4.473 3.968 4.774 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 70 PHE QE 1 113 ASN HA 5.000 2.800 6.000 5.929 5.674 6.040 0.040 17 0 "[ . 1 . 2 . 3]" 1
1257 1 70 PHE HA 1 71 CYS HA 4.000 . 5.000 4.550 4.525 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1258 1 70 PHE QB 1 71 CYS HA 4.000 . 6.000 4.342 4.291 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 70 PHE QD 1 113 ASN H 4.000 . 5.000 4.313 3.263 5.010 0.010 3 0 "[ . 1 . 2 . 3]" 1
1260 1 71 CYS H 1 71 CYS QB 3.000 . 4.100 2.631 2.496 2.735 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 71 CYS H 1 72 PRO QD 4.000 . 6.000 3.248 2.922 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
1262 1 71 CYS H 1 72 PRO QG 4.000 . 6.000 4.828 4.498 5.172 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 71 CYS HA 1 72 PRO HD3 3.000 . 4.300 2.443 2.317 2.629 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 71 CYS HA 1 72 PRO HD2 3.000 . 4.300 2.302 2.271 2.370 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 71 CYS H 1 72 PRO QB 5.000 . 7.000 5.530 4.866 5.793 . 0 0 "[ . 1 . 2 . 3]" 1
1266 1 71 CYS QB 1 72 PRO QD 4.000 . 7.000 3.795 3.727 3.828 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 71 CYS HA 1 72 PRO QB 4.000 . 6.000 4.757 4.677 4.912 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 71 CYS HA 1 72 PRO QG 4.000 . 6.000 4.050 3.993 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 71 CYS QB 1 75 VAL QG 4.000 . 8.400 4.788 3.995 5.242 . 0 0 "[ . 1 . 2 . 3]" 1
1270 1 72 PRO QD 1 73 HIS H 4.000 . 6.000 3.491 2.911 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 72 PRO QG 1 73 HIS H 4.000 . 6.000 4.467 3.922 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 72 PRO QB 1 73 HIS H 4.000 . 6.000 3.619 3.053 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 72 PRO QB 1 73 HIS HD2 4.000 . 6.000 5.150 4.684 5.423 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 72 PRO QB 1 73 HIS QB 4.000 . 7.000 4.427 3.719 5.036 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 72 PRO QD 1 73 HIS HD2 5.000 . 7.000 4.296 3.504 5.044 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 72 PRO HA 1 73 HIS HA 4.000 . 5.000 4.645 4.482 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 73 HIS HA 1 73 HIS HD2 4.000 . 5.000 4.028 3.116 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 73 HIS H 1 73 HIS QB 3.000 . 4.100 2.455 2.133 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 73 HIS HA 1 75 VAL QG 5.000 . 8.400 4.834 3.871 6.278 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 73 HIS HA 1 74 LYS QG 4.000 . 6.000 3.969 3.665 4.236 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 73 HIS HA 1 74 LYS QB 4.000 . 6.000 4.422 4.351 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 73 HIS HA 1 74 LYS HA 4.000 . 5.000 4.471 4.364 4.518 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 73 HIS QB 1 74 LYS H 3.000 . 4.500 3.612 2.891 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 73 HIS HD2 1 75 VAL QG 4.000 . 7.400 4.923 2.866 5.673 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 73 HIS HE1 1 75 VAL HA 4.000 . 5.000 4.891 3.966 5.208 0.208 15 0 "[ . 1 . 2 . 3]" 1
1286 1 73 HIS HE1 1 75 VAL QG 4.000 . 7.400 2.782 2.034 4.234 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 73 HIS QB 1 74 LYS HA 4.000 . 6.000 4.785 4.471 5.071 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 73 HIS QB 1 74 LYS QB 4.000 . 7.000 5.203 4.632 5.466 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 73 HIS QB 1 74 LYS QG 4.000 . 7.000 5.146 4.788 5.267 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 73 HIS QB 1 75 VAL QG 4.000 . 8.400 3.553 2.206 5.345 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 74 LYS H 1 74 LYS QB 3.000 . 4.100 2.383 2.330 2.493 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 74 LYS H 1 74 LYS QG 4.000 . 6.000 2.395 2.195 2.539 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 74 LYS HA 1 74 LYS QD 4.000 . 6.000 3.744 2.180 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 74 LYS QB 1 74 LYS QE 4.000 . 7.000 3.233 2.104 3.825 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 74 LYS HA 1 74 LYS QE 4.000 . 6.000 4.503 3.916 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 74 LYS H 1 75 VAL QG 4.000 . 7.400 4.526 3.998 5.518 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 74 LYS QB 1 75 VAL H 4.000 . 6.000 3.306 2.702 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 74 LYS QG 1 75 VAL H 4.000 . 6.000 4.195 3.859 4.850 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 74 LYS QB 1 75 VAL HA 4.000 . 6.000 4.320 4.077 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 74 LYS HA 1 75 VAL QG 4.000 . 7.400 3.575 3.174 4.080 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 75 VAL HA 1 75 VAL QG 2.500 . 3.300 2.141 2.043 2.393 . 0 0 "[ . 1 . 2 . 3]" 1
1302 1 75 VAL H 1 75 VAL QG 3.000 . 5.200 2.286 1.749 2.724 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 75 VAL H 1 75 VAL HB 3.000 . 3.500 2.774 2.463 3.613 0.113 25 0 "[ . 1 . 2 . 3]" 1
1304 1 75 VAL QG 1 76 SER H 4.000 . 7.400 2.688 2.314 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 75 VAL QG 1 80 PHE HE1 4.000 . 7.400 4.624 4.057 5.547 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 75 VAL QG 1 76 SER QB 4.000 . 8.400 4.240 3.770 4.965 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 75 VAL HA 1 76 SER HA 4.000 . 5.000 4.457 4.431 4.480 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 75 VAL QG 1 76 SER HA 4.000 . 7.400 3.906 3.566 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 75 VAL QG 1 77 ALA HA 4.000 . 7.400 4.390 4.015 5.558 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 75 VAL HA 1 79 GLN QG 4.000 . 6.000 4.782 3.980 5.408 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 75 VAL QG 1 79 GLN QG 4.000 . 8.400 4.371 3.720 5.345 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 76 SER H 1 76 SER QB 3.000 . 4.100 2.531 2.284 2.822 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 76 SER H 1 77 ALA HA 5.000 3.000 6.000 5.443 5.282 5.602 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 76 SER HB3 1 77 ALA H 4.000 . 5.000 3.457 2.396 4.063 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 76 SER HB2 1 77 ALA H 4.000 . 5.000 3.183 2.341 3.948 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 76 SER HA 1 77 ALA HA 4.000 . 5.000 4.366 4.351 4.383 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 76 SER HB3 1 79 GLN QG 4.000 . 6.000 3.844 2.331 4.829 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 76 SER HB2 1 79 GLN QG 4.000 . 6.000 3.874 2.426 5.044 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 76 SER HB3 1 79 GLN QB 4.000 . 6.000 3.969 2.406 4.900 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 76 SER HB2 1 79 GLN QB 4.000 . 6.000 4.040 2.386 5.074 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 76 SER HB3 1 77 ALA MB 4.000 . 6.500 4.883 3.907 5.412 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 76 SER HB2 1 77 ALA MB 4.000 . 6.500 4.612 3.913 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 76 SER HA 1 77 ALA MB 4.000 . 6.500 4.197 4.113 4.269 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 76 SER HA 1 79 GLN QB 4.000 . 6.000 4.703 4.109 5.046 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 77 ALA H 1 77 ALA MB 2.500 . 4.000 2.241 2.212 2.259 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 77 ALA MB 1 79 GLN H 4.000 . 6.500 4.752 4.258 4.950 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 77 ALA MB 1 78 GLY H 3.000 . 5.000 3.075 2.486 3.240 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 78 GLY QA 1 80 PHE HE2 4.000 . 6.000 2.802 2.474 3.222 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 78 GLY H 1 80 PHE HE2 4.000 . 5.000 4.873 4.494 5.193 0.193 26 0 "[ . 1 . 2 . 3]" 1
1330 1 79 GLN H 1 79 GLN QG 4.000 . 6.000 2.510 2.322 2.690 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 79 GLN QB 1 80 PHE H 4.000 . 6.000 3.265 3.113 3.375 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 79 GLN HA 1 80 PHE HD2 4.000 . 5.000 3.983 3.688 4.201 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 79 GLN QB 1 80 PHE HD2 4.000 . 6.000 5.393 5.184 5.527 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 80 PHE H 1 80 PHE HD2 3.000 . 3.500 3.199 2.969 3.341 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 80 PHE HA 1 80 PHE HD1 2.500 . 2.900 2.649 2.502 2.856 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 80 PHE HA 1 80 PHE HE1 4.000 . 5.000 4.655 4.519 4.835 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 80 PHE HB3 1 80 PHE HD1 3.000 . 3.300 2.543 2.469 2.601 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 80 PHE HB3 1 81 SER H 4.000 . 5.000 2.900 2.744 3.104 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 80 PHE HB2 1 81 SER H 4.000 . 5.000 4.001 3.875 4.132 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 80 PHE HD1 1 83 LEU HB3 4.000 . 5.000 4.729 4.085 5.051 0.051 19 0 "[ . 1 . 2 . 3]" 1
1341 1 80 PHE HD1 1 83 LEU HB2 4.000 . 5.000 3.595 2.887 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 80 PHE HD1 1 83 LEU MD1 4.000 . 6.500 2.549 2.168 4.197 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 80 PHE HD1 1 83 LEU MD2 4.000 . 6.500 2.982 2.276 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 80 PHE HE1 1 83 LEU QD 4.000 . 7.400 2.862 2.479 3.944 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 80 PHE HE1 1 83 LEU QB 4.000 . 6.000 5.003 4.351 5.353 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 80 PHE HA 1 84 HIS HE1 4.000 . 5.000 4.813 4.372 5.054 0.054 6 0 "[ . 1 . 2 . 3]" 1
1347 1 80 PHE HD1 1 83 LEU HG 4.000 . 5.000 3.819 2.565 5.056 0.056 16 0 "[ . 1 . 2 . 3]" 1
1348 1 80 PHE HA 1 83 LEU QD 4.000 . 7.400 3.769 3.410 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 80 PHE HB3 1 83 LEU QD 4.000 . 7.400 2.726 2.284 3.117 . 0 0 "[ . 1 . 2 . 3]" 1
1350 1 80 PHE HB3 1 83 LEU QB 4.000 . 6.000 2.324 2.245 2.531 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 80 PHE HB3 1 83 LEU H 4.000 . 5.000 2.947 2.649 3.092 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 80 PHE HD1 1 83 LEU HA 5.000 3.000 6.000 5.876 5.589 6.057 0.057 27 0 "[ . 1 . 2 . 3]" 1
1353 1 80 PHE HB2 1 83 LEU QD 4.000 . 7.400 3.854 3.520 4.277 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 81 SER H 1 81 SER HB2 4.000 . 5.000 2.636 2.480 2.826 . 0 0 "[ . 1 . 2 . 3]" 1
1355 1 81 SER HB3 1 84 HIS HE1 4.000 . 5.000 4.821 4.636 5.070 0.070 26 0 "[ . 1 . 2 . 3]" 1
1356 1 82 SER QB 1 83 LEU H 4.000 . 6.000 3.373 3.231 3.545 . 0 0 "[ . 1 . 2 . 3]" 1
1357 1 82 SER HA 1 84 HIS HD2 4.000 . 5.000 4.604 3.730 5.186 0.186 29 0 "[ . 1 . 2 . 3]" 1
1358 1 82 SER HA 1 84 HIS HE1 4.000 . 5.000 5.065 4.952 5.152 0.152 15 0 "[ . 1 . 2 . 3]" 1
1359 1 82 SER QB 1 83 LEU MD1 4.000 . 7.500 3.671 2.479 5.179 . 0 0 "[ . 1 . 2 . 3]" 1
1360 1 82 SER QB 1 83 LEU MD2 4.000 . 7.500 4.162 2.572 5.509 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 82 SER HA 1 83 LEU QB 4.000 . 6.000 5.332 5.118 5.450 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 82 SER HA 1 83 LEU QD 4.000 . 7.400 4.307 3.890 4.757 . 0 0 "[ . 1 . 2 . 3]" 1
1363 1 82 SER HA 1 83 LEU HA 4.000 . 5.000 4.684 4.657 4.718 . 0 0 "[ . 1 . 2 . 3]" 1
1364 1 82 SER HA 1 85 VAL QG 4.000 . 7.400 4.278 3.064 4.755 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 83 LEU H 1 83 LEU QD 4.000 . 6.700 2.434 1.819 3.122 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 83 LEU H 1 83 LEU HG 4.000 . 5.000 3.326 2.208 4.088 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 83 LEU H 1 83 LEU QB 3.000 . 4.100 2.378 2.196 2.561 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 83 LEU HA 1 83 LEU QD 3.000 . 5.000 2.341 2.024 2.695 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 83 LEU HA 1 83 LEU HG 3.000 . 3.300 2.806 2.272 3.652 0.352 7 0 "[ . 1 . 2 . 3]" 1
1370 1 83 LEU QB 1 83 LEU QD 2.500 . 5.400 1.946 1.905 2.015 . 0 0 "[ . 1 . 2 . 3]" 1
1371 1 83 LEU QB 1 84 HIS H 4.000 . 6.000 3.708 3.455 3.782 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 83 LEU QD 1 84 HIS H 4.000 . 7.400 4.105 3.784 4.306 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 83 LEU QB 1 85 VAL H 4.000 . 6.000 4.953 4.500 5.118 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 83 LEU QB 1 84 HIS HE1 4.000 . 6.000 4.585 3.836 5.473 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 83 LEU HA 1 84 HIS QB 4.000 . 6.000 5.159 4.987 5.360 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 83 LEU QB 1 84 HIS HA 4.000 . 6.000 4.229 4.137 4.299 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 83 LEU HA 1 85 VAL QG 4.000 . 7.400 3.885 2.936 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 84 HIS HA 1 84 HIS HD2 4.000 . 5.000 4.765 2.585 4.943 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 84 HIS HB3 1 84 HIS HD2 4.000 . 5.000 3.266 3.081 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 84 HIS HB2 1 84 HIS HD2 4.000 . 5.000 3.000 2.753 3.857 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 84 HIS H 1 84 HIS HD2 4.000 . 5.000 4.202 2.599 4.654 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 84 HIS H 1 84 HIS HB3 4.000 . 5.000 3.639 3.606 3.661 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 84 HIS H 1 84 HIS HB2 3.000 . 3.500 2.631 2.440 2.852 . 0 0 "[ . 1 . 2 . 3]" 1
1384 1 84 HIS HB3 1 85 VAL H 4.000 . 5.000 3.879 3.605 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 84 HIS HB2 1 85 VAL H 4.000 . 5.000 2.725 2.536 3.402 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 84 HIS HA 1 85 VAL QG 4.000 . 7.400 4.469 4.270 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 84 HIS HD2 1 85 VAL QG 4.000 . 7.400 5.059 4.758 5.399 . 0 0 "[ . 1 . 2 . 3]" 1
1388 1 85 VAL HA 1 85 VAL QG 3.000 . 3.900 2.203 2.066 2.369 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 85 VAL H 1 85 VAL QG 2.500 . 4.600 1.839 1.714 2.077 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 85 VAL H 1 85 VAL HB 4.000 . 5.000 3.103 2.487 3.649 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 85 VAL HB 1 86 ARG H 4.000 . 5.000 3.385 2.738 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 85 VAL QG 1 86 ARG H 3.000 . 5.900 2.739 1.987 3.442 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 85 VAL QG 1 87 ASP H 4.000 . 7.400 2.866 2.120 3.644 . 0 0 "[ . 1 . 2 . 3]" 1
1394 1 85 VAL HA 1 86 ARG HB2 4.000 . 5.000 4.637 4.549 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 85 VAL QG 1 87 ASP HB2 4.000 . 7.400 3.458 2.380 4.505 . 0 0 "[ . 1 . 2 . 3]" 1
1396 1 86 ARG H 1 86 ARG QG 4.000 . 6.000 2.537 2.210 2.605 . 0 0 "[ . 1 . 2 . 3]" 1
1397 1 86 ARG H 1 86 ARG HB2 4.000 . 5.000 2.404 2.363 2.569 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 86 ARG H 1 86 ARG HB3 4.000 . 5.000 3.639 3.616 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 86 ARG HB2 1 87 ASP H 4.000 . 5.000 4.435 4.288 4.501 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 86 ARG HB3 1 87 ASP H 4.000 . 5.000 4.328 4.246 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
1401 1 87 ASP H 1 87 ASP QB 3.000 . 4.100 2.344 2.272 2.378 . 0 0 "[ . 1 . 2 . 3]" 1
1402 1 87 ASP HB2 1 88 THR H 4.000 . 5.000 3.606 3.433 3.765 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 87 ASP HB3 1 88 THR H 3.000 . 3.500 2.347 2.150 2.546 . 0 0 "[ . 1 . 2 . 3]" 1
1404 1 87 ASP HA 1 88 THR MG 4.000 . 6.500 4.089 3.313 5.515 . 0 0 "[ . 1 . 2 . 3]" 1
1405 1 88 THR HA 1 88 THR MG 3.000 . 4.400 2.451 2.257 3.206 . 0 0 "[ . 1 . 2 . 3]" 1
1406 1 88 THR H 1 88 THR MG 3.000 . 5.000 2.677 1.770 3.822 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 88 THR H 1 88 THR HB 4.000 . 5.000 3.277 2.499 3.698 . 0 0 "[ . 1 . 2 . 3]" 1
1408 1 88 THR HB 1 89 LYS H 4.000 . 5.000 3.084 2.393 3.993 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 88 THR MG 1 89 LYS H 4.000 . 6.500 3.339 1.980 4.024 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 88 THR HA 1 90 ILE MG 5.000 . 7.500 5.392 5.174 5.652 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 88 THR HA 1 89 LYS QG 4.000 . 6.000 3.644 3.464 3.840 . 0 0 "[ . 1 . 2 . 3]" 1
1412 1 88 THR HA 1 89 LYS HA 4.000 . 5.000 4.406 4.391 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 88 THR HB 1 90 ILE MG 4.000 . 6.500 4.401 3.472 5.339 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 89 LYS HA 1 89 LYS QD 4.000 . 6.000 3.983 3.949 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
1415 1 89 LYS HA 1 89 LYS QE 4.000 . 6.000 4.635 3.878 4.945 . 0 0 "[ . 1 . 2 . 3]" 1
1416 1 89 LYS H 1 89 LYS QG 4.000 . 6.000 2.379 2.138 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 89 LYS H 1 89 LYS QD 4.000 . 6.000 3.892 3.842 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
1418 1 89 LYS H 1 89 LYS QE 4.000 . 6.000 4.626 3.414 5.073 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 89 LYS H 1 89 LYS HB2 3.000 . 3.500 2.473 2.378 2.610 . 0 0 "[ . 1 . 2 . 3]" 1
1420 1 89 LYS HA 1 89 LYS QG 3.000 . 3.900 2.393 2.317 2.472 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 89 LYS HA 1 90 ILE MD 4.000 . 6.500 4.985 4.888 5.133 . 0 0 "[ . 1 . 2 . 3]" 1
1422 1 89 LYS QG 1 90 ILE H 4.000 . 6.000 3.966 3.762 4.112 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 90 ILE H 1 90 ILE HB 4.000 . 5.000 3.827 3.795 3.867 . 0 0 "[ . 1 . 2 . 3]" 1
1424 1 90 ILE H 1 90 ILE QG 3.000 . 4.500 2.115 2.010 2.189 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 90 ILE H 1 90 ILE MG 4.000 . 6.500 2.924 2.840 3.020 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 90 ILE H 1 90 ILE MD 4.000 . 6.500 3.853 3.773 3.916 . 0 0 "[ . 1 . 2 . 3]" 1
1427 1 90 ILE HA 1 90 ILE MD 4.000 . 6.500 4.138 4.128 4.152 . 0 0 "[ . 1 . 2 . 3]" 1
1428 1 90 ILE HA 1 90 ILE MG 3.000 . 4.400 2.306 2.257 2.354 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 90 ILE HB 1 90 ILE MD 2.500 . 4.200 2.314 2.238 2.372 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 90 ILE H 1 91 GLU HA 5.000 3.000 6.000 5.065 4.973 5.144 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 90 ILE HB 1 91 GLU H 3.000 . 3.500 2.587 2.471 2.681 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 90 ILE QG 1 91 GLU H 4.000 . 6.000 3.693 3.574 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
1433 1 90 ILE MG 1 91 GLU H 4.000 . 6.500 3.745 3.641 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
1434 1 90 ILE MD 1 91 GLU H 4.000 . 6.500 4.332 4.203 4.469 . 0 0 "[ . 1 . 2 . 3]" 1
1435 1 90 ILE MD 1 95 PHE QE 4.000 . 6.500 4.289 3.977 4.570 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 90 ILE QG 1 95 PHE QD 4.000 . 6.000 3.308 3.043 3.451 . 0 0 "[ . 1 . 2 . 3]" 1
1437 1 90 ILE QG 1 95 PHE QE 4.000 . 6.000 5.133 4.818 5.312 . 0 0 "[ . 1 . 2 . 3]" 1
1438 1 90 ILE MD 1 95 PHE HA 3.000 . 4.800 2.601 2.288 2.824 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 90 ILE HA 1 91 GLU QG 4.000 . 6.000 3.876 3.671 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
1440 1 90 ILE HA 1 94 GLN QB 4.000 . 6.000 4.855 4.578 5.251 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 90 ILE QG 1 95 PHE HA 4.000 . 6.000 3.961 3.728 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
1442 1 90 ILE HB 1 94 GLN QG 4.000 . 6.000 4.422 4.017 4.720 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 90 ILE MG 1 94 GLN QG 4.000 . 7.500 5.090 4.361 5.554 . 0 0 "[ . 1 . 2 . 3]" 1
1444 1 90 ILE MD 1 94 GLN QG 4.000 . 7.500 4.242 2.977 4.908 . 0 0 "[ . 1 . 2 . 3]" 1
1445 1 90 ILE HB 1 94 GLN QB 4.000 . 6.000 2.975 2.684 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 90 ILE MD 1 94 GLN QB 3.000 . 5.800 2.937 2.631 3.403 . 0 0 "[ . 1 . 2 . 3]" 1
1447 1 90 ILE QG 1 94 GLN QB 4.000 . 7.000 3.782 3.523 4.309 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 90 ILE QG 1 91 GLU HA 4.000 . 6.000 4.536 4.449 4.619 . 0 0 "[ . 1 . 2 . 3]" 1
1449 1 90 ILE QG 1 92 VAL HA 4.000 . 6.000 4.212 4.088 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
1450 1 90 ILE QG 1 95 PHE HB2 4.000 . 6.000 2.753 2.535 3.132 . 0 0 "[ . 1 . 2 . 3]" 1
1451 1 90 ILE QG 1 94 GLN QG 4.000 . 7.000 5.296 4.765 5.535 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 90 ILE MD 1 95 PHE HB2 4.000 . 6.500 2.785 2.444 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
1453 1 90 ILE MD 1 95 PHE QD 3.000 . 4.800 2.415 2.284 2.693 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 90 ILE MD 1 92 VAL HA 4.000 . 6.500 4.933 4.756 5.095 . 0 0 "[ . 1 . 2 . 3]" 1
1455 1 90 ILE MD 1 98 ASP HB2 4.000 . 6.500 4.117 3.817 4.267 . 0 0 "[ . 1 . 2 . 3]" 1
1456 1 90 ILE MD 1 95 PHE H 3.000 . 5.000 3.486 3.089 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
1457 1 90 ILE MD 1 98 ASP H 4.000 . 6.500 5.150 4.928 5.319 . 0 0 "[ . 1 . 2 . 3]" 1
1458 1 90 ILE MD 1 94 GLN H 4.000 . 6.500 4.882 4.620 5.171 . 0 0 "[ . 1 . 2 . 3]" 1
1459 1 91 GLU H 1 91 GLU HB2 4.000 . 5.000 2.430 2.367 2.520 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 91 GLU H 1 91 GLU QG 3.000 . 4.500 2.309 2.063 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
1461 1 91 GLU HA 1 91 GLU QG 2.500 . 3.300 2.410 2.294 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
1462 1 91 GLU HB3 1 92 VAL H 4.000 . 5.000 2.974 2.880 3.093 . 0 0 "[ . 1 . 2 . 3]" 1
1463 1 91 GLU HB2 1 92 VAL H 4.000 . 5.000 4.062 3.981 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 91 GLU QG 1 92 VAL H 4.000 . 6.000 4.027 3.833 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
1465 1 91 GLU QG 1 93 ALA H 4.000 . 6.000 4.837 4.706 5.008 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 91 GLU HB3 1 93 ALA H 4.000 . 5.000 2.876 2.781 3.018 . 0 0 "[ . 1 . 2 . 3]" 1
1467 1 91 GLU HB2 1 94 GLN H 4.000 . 5.000 2.888 2.682 3.068 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 91 GLU HB3 1 93 ALA MB 4.000 . 6.500 3.139 2.932 3.345 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 91 GLU HB3 1 92 VAL QG 4.000 . 7.400 4.536 4.437 4.623 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 91 GLU QG 1 92 VAL QG 4.000 . 8.400 5.112 4.907 5.496 . 0 0 "[ . 1 . 2 . 3]" 1
1471 1 91 GLU HA 1 92 VAL QG 4.000 . 7.400 3.733 3.668 3.802 . 0 0 "[ . 1 . 2 . 3]" 1
1472 1 91 GLU HB2 1 93 ALA MB 4.000 . 6.500 3.523 3.278 3.796 . 0 0 "[ . 1 . 2 . 3]" 1
1473 1 92 VAL HA 1 92 VAL QG 2.500 . 3.300 2.118 2.076 2.135 . 0 0 "[ . 1 . 2 . 3]" 1
1474 1 92 VAL H 1 92 VAL QG 2.500 . 4.600 2.195 2.104 2.243 . 0 0 "[ . 1 . 2 . 3]" 1
1475 1 92 VAL H 1 92 VAL HB 3.000 . 3.500 2.438 2.391 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 92 VAL H 1 93 ALA HA 5.000 3.000 6.000 5.394 5.339 5.422 . 0 0 "[ . 1 . 2 . 3]" 1
1477 1 92 VAL H 1 93 ALA MB 4.000 . 6.500 4.418 4.312 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
1478 1 92 VAL HB 1 93 ALA H 4.000 . 5.000 2.651 2.584 2.711 . 0 0 "[ . 1 . 2 . 3]" 1
1479 1 92 VAL QG 1 93 ALA H 3.000 . 5.900 3.141 3.081 3.167 . 0 0 "[ . 1 . 2 . 3]" 1
1480 1 92 VAL QG 1 96 VAL H 4.000 . 7.400 3.428 3.267 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
1481 1 92 VAL HA 1 95 PHE QD 4.000 . 5.000 4.148 4.038 4.252 . 0 0 "[ . 1 . 2 . 3]" 1
1482 1 92 VAL HA 1 93 ALA HA 4.000 . 5.000 4.892 4.868 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
1483 1 92 VAL HB 1 93 ALA HA 4.000 . 5.000 4.395 4.327 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 92 VAL HA 1 93 ALA MB 4.000 . 6.500 5.025 4.989 5.043 . 0 0 "[ . 1 . 2 . 3]" 1
1485 1 92 VAL QG 1 95 PHE QD 4.000 . 7.400 3.492 3.303 3.713 . 0 0 "[ . 1 . 2 . 3]" 1
1486 1 92 VAL QG 1 95 PHE HB3 4.000 . 7.400 2.911 2.746 3.067 . 0 0 "[ . 1 . 2 . 3]" 1
1487 1 92 VAL QG 1 95 PHE HB2 4.000 . 7.400 3.844 3.604 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
1488 1 92 VAL HB 1 96 VAL MG1 4.000 . 6.500 6.973 6.724 7.269 0.769 14 9 "[* * . *1 +- 2 * *.* * 3]" 1
1489 1 92 VAL QG 1 96 VAL MG1 4.000 . 8.900 4.385 4.136 4.657 . 0 0 "[ . 1 . 2 . 3]" 1
1490 1 92 VAL QG 1 93 ALA HA 4.000 . 7.400 3.302 3.262 3.348 . 0 0 "[ . 1 . 2 . 3]" 1
1491 1 92 VAL QG 1 96 VAL HB 4.000 . 7.400 4.098 3.840 4.430 . 0 0 "[ . 1 . 2 . 3]" 1
1492 1 92 VAL QG 1 93 ALA MB 4.000 . 8.900 3.945 3.886 4.022 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 93 ALA H 1 93 ALA MB 2.500 . 4.000 2.246 2.199 2.263 . 0 0 "[ . 1 . 2 . 3]" 1
1494 1 93 ALA H 1 96 VAL H 5.000 3.000 6.000 4.921 4.834 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
1495 1 93 ALA H 1 96 VAL MG1 4.000 . 6.500 6.708 6.533 6.898 0.398 14 0 "[ . 1 . 2 . 3]" 1
1496 1 93 ALA MB 1 94 GLN H 3.000 . 5.000 2.509 2.434 2.580 . 0 0 "[ . 1 . 2 . 3]" 1
1497 1 93 ALA HA 1 96 VAL MG1 4.000 . 6.500 4.722 4.521 4.923 . 0 0 "[ . 1 . 2 . 3]" 1
1498 1 93 ALA MB 1 96 VAL HB 4.000 . 6.500 4.739 4.584 4.938 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 93 ALA MB 1 94 GLN QB 4.000 . 7.500 4.057 3.623 4.274 . 0 0 "[ . 1 . 2 . 3]" 1
1500 1 93 ALA MB 1 96 VAL MG1 4.000 . 8.000 5.496 5.329 5.703 . 0 0 "[ . 1 . 2 . 3]" 1
1501 1 93 ALA MB 1 97 LYS QE 4.000 . 7.500 3.453 2.757 5.323 . 0 0 "[ . 1 . 2 . 3]" 1
1502 1 93 ALA MB 1 94 GLN QG 4.000 . 7.500 3.666 2.826 5.187 . 0 0 "[ . 1 . 2 . 3]" 1
1503 1 94 GLN H 1 94 GLN QB 2.500 . 3.500 2.347 2.280 2.454 . 0 0 "[ . 1 . 2 . 3]" 1
1504 1 94 GLN H 1 94 GLN QG 4.000 . 6.000 2.847 2.183 4.003 . 0 0 "[ . 1 . 2 . 3]" 1
1505 1 94 GLN HA 1 94 GLN QG 3.000 . 3.900 2.402 2.303 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
1506 1 94 GLN HA 1 97 LYS QD 4.000 . 6.000 3.025 2.507 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 94 GLN H 1 95 PHE HB2 4.000 . 5.000 4.842 4.751 4.940 . 0 0 "[ . 1 . 2 . 3]" 1
1508 1 94 GLN H 1 96 VAL MG1 4.000 . 6.500 6.695 6.570 6.821 0.321 5 0 "[ . 1 . 2 . 3]" 1
1509 1 94 GLN HB3 1 95 PHE H 4.000 . 5.000 3.392 2.663 3.883 . 0 0 "[ . 1 . 2 . 3]" 1
1510 1 94 GLN HB2 1 95 PHE H 4.000 . 5.000 3.074 2.591 4.015 . 0 0 "[ . 1 . 2 . 3]" 1
1511 1 94 GLN QG 1 95 PHE H 4.000 . 6.000 4.005 3.702 4.160 . 0 0 "[ . 1 . 2 . 3]" 1
1512 1 94 GLN HA 1 97 LYS QE 4.000 . 6.000 4.413 2.330 5.121 . 0 0 "[ . 1 . 2 . 3]" 1
1513 1 94 GLN QG 1 97 LYS QE 4.000 . 7.000 5.150 3.283 5.531 . 0 0 "[ . 1 . 2 . 3]" 1
1514 1 94 GLN QB 1 95 PHE HA 4.000 . 6.000 3.982 3.863 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
1515 1 94 GLN QG 1 97 LYS QD 4.000 . 7.000 4.024 3.611 5.170 . 0 0 "[ . 1 . 2 . 3]" 1
1516 1 95 PHE HB3 1 95 PHE QD 3.000 . 3.300 2.424 2.396 2.464 . 0 0 "[ . 1 . 2 . 3]" 1
1517 1 95 PHE H 1 95 PHE HB3 4.000 . 5.000 2.513 2.470 2.557 . 0 0 "[ . 1 . 2 . 3]" 1
1518 1 95 PHE H 1 95 PHE HB2 3.000 . 3.500 2.552 2.492 2.607 . 0 0 "[ . 1 . 2 . 3]" 1
1519 1 95 PHE H 1 95 PHE QD 4.000 . 5.000 4.185 4.166 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
1520 1 95 PHE QB 1 95 PHE QE 4.000 . 6.000 3.957 3.952 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 95 PHE HA 1 95 PHE QD 3.000 . 3.300 2.953 2.878 3.053 . 0 0 "[ . 1 . 2 . 3]" 1
1522 1 95 PHE HA 1 95 PHE QE 5.000 3.000 6.000 4.642 4.581 4.696 . 0 0 "[ . 1 . 2 . 3]" 1
1523 1 95 PHE QD 1 96 VAL H 4.000 . 5.000 2.960 2.828 3.105 . 0 0 "[ . 1 . 2 . 3]" 1
1524 1 95 PHE HB3 1 96 VAL H 3.000 . 3.500 2.384 2.317 2.474 . 0 0 "[ . 1 . 2 . 3]" 1
1525 1 95 PHE HB2 1 96 VAL H 4.000 . 5.000 3.787 3.726 3.845 . 0 0 "[ . 1 . 2 . 3]" 1
1526 1 95 PHE QD 1 99 LEU HB2 4.000 . 5.000 4.136 3.859 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
1527 1 95 PHE QE 1 99 LEU QD 4.000 . 7.400 2.673 2.307 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1528 1 95 PHE HA 1 99 LEU HB2 4.000 . 5.000 4.992 4.825 5.128 0.128 29 0 "[ . 1 . 2 . 3]" 1
1529 1 95 PHE HA 1 96 VAL HA 4.000 . 5.000 4.799 4.781 4.823 . 0 0 "[ . 1 . 2 . 3]" 1
1530 1 95 PHE HB3 1 96 VAL MG1 4.000 . 6.500 5.393 5.315 5.457 . 0 0 "[ . 1 . 2 . 3]" 1
1531 1 95 PHE HB2 1 96 VAL MG1 4.000 . 6.500 6.690 6.630 6.732 0.232 23 0 "[ . 1 . 2 . 3]" 1
1532 1 95 PHE QD 1 99 LEU QD 4.000 . 7.400 3.875 3.627 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
1533 1 95 PHE QD 1 96 VAL HB 4.000 . 5.000 4.615 4.474 4.820 . 0 0 "[ . 1 . 2 . 3]" 1
1534 1 95 PHE QD 1 96 VAL MG2 4.000 . 6.500 2.625 2.526 2.779 . 0 0 "[ . 1 . 2 . 3]" 1
1535 1 95 PHE QE 1 96 VAL MG2 4.000 . 6.500 4.063 3.872 4.222 . 0 0 "[ . 1 . 2 . 3]" 1
1536 1 96 VAL H 1 96 VAL MG1 2.500 . 4.400 3.773 3.764 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
1537 1 96 VAL H 1 96 VAL MG2 4.000 . 6.500 2.052 1.938 2.173 . 0 0 "[ . 1 . 2 . 3]" 1
1538 1 96 VAL H 1 96 VAL HB 3.000 . 3.500 2.536 2.474 2.617 . 0 0 "[ . 1 . 2 . 3]" 1
1539 1 96 VAL HA 1 96 VAL MG2 3.000 . 4.400 2.354 2.266 2.453 . 0 0 "[ . 1 . 2 . 3]" 1
1540 1 96 VAL HA 1 96 VAL MG1 3.000 . 4.400 2.318 2.260 2.357 . 0 0 "[ . 1 . 2 . 3]" 1
1541 1 96 VAL H 1 99 LEU H 4.000 . 5.000 4.807 4.722 4.929 . 0 0 "[ . 1 . 2 . 3]" 1
1542 1 96 VAL H 1 97 LYS QB 4.000 . 6.000 4.718 4.640 4.809 . 0 0 "[ . 1 . 2 . 3]" 1
1543 1 96 VAL H 1 97 LYS QG 4.000 . 6.000 4.502 4.347 4.650 . 0 0 "[ . 1 . 2 . 3]" 1
1544 1 96 VAL HB 1 97 LYS H 3.000 . 3.300 2.450 2.374 2.543 . 0 0 "[ . 1 . 2 . 3]" 1
1545 1 96 VAL MG2 1 97 LYS H 4.000 . 6.500 3.791 3.705 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
1546 1 96 VAL MG1 1 97 LYS H 3.000 . 4.800 3.315 3.215 3.473 . 0 0 "[ . 1 . 2 . 3]" 1
1547 1 96 VAL HA 1 97 LYS QG 4.000 . 6.000 5.177 5.065 5.237 . 0 0 "[ . 1 . 2 . 3]" 1
1548 1 96 VAL MG1 1 97 LYS HA 4.000 . 6.500 3.384 3.319 3.523 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 96 VAL HA 1 99 LEU QD 4.000 . 7.400 3.383 3.177 3.584 . 0 0 "[ . 1 . 2 . 3]" 1
1550 1 96 VAL MG1 1 97 LYS QB 4.000 . 7.500 4.625 4.490 4.768 . 0 0 "[ . 1 . 2 . 3]" 1
1551 1 96 VAL MG1 1 97 LYS QG 4.000 . 7.500 3.518 3.273 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
1552 1 96 VAL MG2 1 97 LYS HA 4.000 . 6.500 5.395 5.355 5.417 . 0 0 "[ . 1 . 2 . 3]" 1
1553 1 97 LYS QB 1 97 LYS QE 4.000 . 7.000 3.433 2.195 3.685 . 0 0 "[ . 1 . 2 . 3]" 1
1554 1 97 LYS H 1 97 LYS QG 4.000 . 6.000 2.229 2.099 2.291 . 0 0 "[ . 1 . 2 . 3]" 1
1555 1 97 LYS H 1 97 LYS QD 4.000 . 6.000 3.795 3.608 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
1556 1 97 LYS H 1 97 LYS QB 2.500 . 3.500 2.393 2.365 2.421 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 97 LYS HA 1 97 LYS QD 4.000 . 6.000 3.955 3.887 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
1558 1 97 LYS QB 1 97 LYS QD 3.000 . 5.300 2.147 2.124 2.222 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 97 LYS H 1 100 LEU H 4.000 . 5.000 4.675 4.558 4.792 . 0 0 "[ . 1 . 2 . 3]" 1
1560 1 97 LYS H 1 98 ASP HA 5.000 3.000 6.000 5.443 5.368 5.492 . 0 0 "[ . 1 . 2 . 3]" 1
1561 1 97 LYS H 1 98 ASP HB2 5.000 3.000 6.000 4.925 4.850 5.022 . 0 0 "[ . 1 . 2 . 3]" 1
1562 1 97 LYS QB 1 98 ASP H 2.500 . 3.900 2.524 2.417 2.670 . 0 0 "[ . 1 . 2 . 3]" 1
1563 1 97 LYS QG 1 98 ASP H 4.000 . 6.000 4.138 4.072 4.218 . 0 0 "[ . 1 . 2 . 3]" 1
1564 1 97 LYS HA 1 100 LEU MD2 4.000 . 6.500 3.356 3.197 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1565 1 97 LYS HA 1 98 ASP HA 4.000 . 5.000 4.807 4.777 4.829 . 0 0 "[ . 1 . 2 . 3]" 1
1566 1 97 LYS QB 1 98 ASP HA 4.000 . 6.000 3.908 3.869 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
1567 1 97 LYS QB 1 101 LEU MD2 4.000 . 7.500 3.588 3.254 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
1568 1 98 ASP H 1 98 ASP HB3 4.000 . 5.000 3.619 3.600 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
1569 1 98 ASP H 1 98 ASP HB2 3.000 . 3.500 2.438 2.399 2.481 . 0 0 "[ . 1 . 2 . 3]" 1
1570 1 98 ASP HB3 1 99 LEU H 4.000 . 5.000 3.546 3.461 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
1571 1 98 ASP HB2 1 99 LEU H 3.000 . 3.500 2.600 2.495 2.726 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 98 ASP HB2 1 100 LEU H 4.000 . 5.000 4.979 4.878 5.048 0.048 14 0 "[ . 1 . 2 . 3]" 1
1573 1 98 ASP H 1 99 LEU HB2 5.000 3.000 6.000 5.101 4.967 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
1574 1 98 ASP HA 1 99 LEU HA 4.000 . 5.000 4.808 4.774 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
1575 1 98 ASP HA 1 101 LEU MD1 4.000 . 6.500 5.348 5.006 5.570 . 0 0 "[ . 1 . 2 . 3]" 1
1576 1 98 ASP HA 1 101 LEU MD2 4.000 . 6.500 3.096 2.264 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
1577 1 98 ASP HA 1 101 LEU HG 4.000 . 5.000 4.203 3.842 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
1578 1 99 LEU H 1 99 LEU HB2 2.500 . 2.900 2.553 2.448 2.604 . 0 0 "[ . 1 . 2 . 3]" 1
1579 1 99 LEU HB3 1 99 LEU QD 3.000 . 5.000 2.277 2.219 2.343 . 0 0 "[ . 1 . 2 . 3]" 1
1580 1 99 LEU HB2 1 99 LEU QD 3.000 . 5.000 2.078 2.049 2.103 . 0 0 "[ . 1 . 2 . 3]" 1
1581 1 99 LEU HA 1 99 LEU QD 2.500 . 4.400 2.116 2.085 2.207 . 0 0 "[ . 1 . 2 . 3]" 1
1582 1 99 LEU H 1 99 LEU QD 4.000 . 6.700 3.701 3.675 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
1583 1 99 LEU H 1 99 LEU HG 4.000 . 5.000 4.455 4.434 4.483 . 0 0 "[ . 1 . 2 . 3]" 1
1584 1 99 LEU HA 1 99 LEU HG 4.000 . 5.000 3.074 2.809 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1585 1 99 LEU H 1 100 LEU HB3 4.000 . 5.000 4.793 4.714 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
1586 1 99 LEU HB3 1 100 LEU H 4.000 . 5.000 2.667 2.606 2.740 . 0 0 "[ . 1 . 2 . 3]" 1
1587 1 99 LEU HB2 1 102 HIS H 5.000 3.000 6.000 5.906 5.744 6.042 0.042 24 0 "[ . 1 . 2 . 3]" 1
1588 1 99 LEU HA 1 102 HIS HD2 4.000 . 5.000 3.656 3.210 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
1589 1 99 LEU QD 1 102 HIS HD2 4.000 . 7.400 4.466 4.065 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
1590 1 99 LEU HG 1 103 LEU MD1 4.000 . 6.500 2.195 2.068 2.383 . 0 0 "[ . 1 . 2 . 3]" 1
1591 1 99 LEU HG 1 103 LEU HG 4.000 . 5.000 2.333 2.301 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 99 LEU QD 1 103 LEU HG 4.000 . 7.400 2.673 2.449 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1593 1 99 LEU QD 1 102 HIS HB2 3.000 . 5.700 2.811 2.499 3.296 . 0 0 "[ . 1 . 2 . 3]" 1
1594 1 99 LEU QD 1 102 HIS HB3 4.000 . 7.400 3.697 3.488 4.128 . 0 0 "[ . 1 . 2 . 3]" 1
1595 1 100 LEU HB2 1 100 LEU MD2 3.000 . 4.800 2.319 2.249 2.400 . 0 0 "[ . 1 . 2 . 3]" 1
1596 1 100 LEU HB3 1 100 LEU MD2 3.000 . 4.800 2.379 2.304 2.461 . 0 0 "[ . 1 . 2 . 3]" 1
1597 1 100 LEU HB3 1 100 LEU MD1 3.000 . 4.800 3.207 3.199 3.217 . 0 0 "[ . 1 . 2 . 3]" 1
1598 1 100 LEU H 1 100 LEU HB3 2.500 . 2.900 2.488 2.417 2.566 . 0 0 "[ . 1 . 2 . 3]" 1
1599 1 100 LEU H 1 100 LEU HB2 2.500 . 2.900 2.584 2.512 2.648 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 100 LEU H 1 100 LEU MD1 4.000 . 6.500 4.067 4.007 4.113 . 0 0 "[ . 1 . 2 . 3]" 1
1601 1 100 LEU H 1 100 LEU MD2 4.000 . 6.500 4.275 4.251 4.299 . 0 0 "[ . 1 . 2 . 3]" 1
1602 1 100 LEU HA 1 100 LEU MD1 3.000 . 4.800 2.113 2.076 2.156 . 0 0 "[ . 1 . 2 . 3]" 1
1603 1 100 LEU HA 1 100 LEU MD2 3.000 . 4.800 3.794 3.762 3.838 . 0 0 "[ . 1 . 2 . 3]" 1
1604 1 100 LEU HA 1 100 LEU HG 3.000 . 3.300 3.222 3.061 3.313 0.013 13 0 "[ . 1 . 2 . 3]" 1
1605 1 100 LEU HB3 1 101 LEU H 2.500 . 2.900 2.624 2.575 2.704 . 0 0 "[ . 1 . 2 . 3]" 1
1606 1 100 LEU HB2 1 103 LEU H 5.000 3.000 6.000 5.702 5.585 5.827 . 0 0 "[ . 1 . 2 . 3]" 1
1607 1 100 LEU MD1 1 103 LEU H 4.000 . 6.500 4.247 4.055 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 100 LEU MD1 1 104 LYS H 4.000 . 6.500 3.317 3.043 3.603 . 0 0 "[ . 1 . 2 . 3]" 1
1609 1 100 LEU MD1 1 104 LYS QD 3.000 . 5.800 3.636 2.654 4.284 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 100 LEU HA 1 103 LEU MD1 4.000 . 6.500 2.319 2.272 2.477 . 0 0 "[ . 1 . 2 . 3]" 1
1611 1 100 LEU HB3 1 103 LEU MD1 4.000 . 6.500 4.901 4.819 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 100 LEU HB2 1 103 LEU MD1 4.000 . 6.500 3.934 3.809 4.080 . 0 0 "[ . 1 . 2 . 3]" 1
1613 1 100 LEU MD1 1 104 LYS QE 3.000 . 5.800 3.533 2.268 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 100 LEU MD1 1 103 LEU HB3 4.000 . 6.500 4.022 3.800 4.142 . 0 0 "[ . 1 . 2 . 3]" 1
1615 1 100 LEU MD1 1 103 LEU HB2 3.000 . 4.800 2.861 2.633 3.035 . 0 0 "[ . 1 . 2 . 3]" 1
1616 1 100 LEU HG 1 104 LYS QE 4.000 . 6.000 3.113 2.154 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1617 1 100 LEU MD2 1 104 LYS QE 4.000 . 7.500 3.916 3.195 4.844 . 0 0 "[ . 1 . 2 . 3]" 1
1618 1 100 LEU MD1 1 104 LYS QG 4.000 . 7.500 3.637 3.384 3.874 . 0 0 "[ . 1 . 2 . 3]" 1
1619 1 101 LEU H 1 101 LEU HB2 2.500 . 2.900 2.368 2.312 2.541 . 0 0 "[ . 1 . 2 . 3]" 1
1620 1 101 LEU HA 1 101 LEU MD2 3.000 . 5.000 2.369 2.207 3.008 . 0 0 "[ . 1 . 2 . 3]" 1
1621 1 101 LEU H 1 101 LEU HG 4.000 . 5.000 3.756 3.643 3.865 . 0 0 "[ . 1 . 2 . 3]" 1
1622 1 101 LEU H 1 101 LEU HB3 4.000 . 5.000 3.619 3.591 3.676 . 0 0 "[ . 1 . 2 . 3]" 1
1623 1 101 LEU HA 1 101 LEU HG 4.000 . 5.000 3.674 3.636 3.703 . 0 0 "[ . 1 . 2 . 3]" 1
1624 1 101 LEU H 1 102 HIS QB 4.000 . 6.000 4.706 4.659 4.772 . 0 0 "[ . 1 . 2 . 3]" 1
1625 1 101 LEU HB2 1 102 HIS H 3.000 . 3.500 2.690 2.506 2.798 . 0 0 "[ . 1 . 2 . 3]" 1
1626 1 101 LEU HB3 1 102 HIS H 4.000 . 5.000 3.410 3.293 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
1627 1 101 LEU MD2 1 102 HIS H 4.000 . 6.500 3.936 3.703 4.033 . 0 0 "[ . 1 . 2 . 3]" 1
1628 1 101 LEU HB3 1 102 HIS HD2 4.000 . 5.000 4.352 4.108 4.688 . 0 0 "[ . 1 . 2 . 3]" 1
1629 1 101 LEU HB2 1 102 HIS HD2 4.000 . 5.000 3.449 3.110 3.628 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 101 LEU HB3 1 102 HIS HA 4.000 . 5.000 4.186 4.114 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
1631 1 101 LEU HA 1 104 LYS QE 4.000 . 6.000 2.647 2.126 4.497 . 0 0 "[ . 1 . 2 . 3]" 1
1632 1 101 LEU MD1 1 104 LYS QE 4.000 . 7.500 2.658 1.998 4.111 . 0 0 "[ . 1 . 2 . 3]" 1
1633 1 101 LEU MD2 1 104 LYS QE 4.000 . 7.500 3.284 2.342 5.291 . 0 0 "[ . 1 . 2 . 3]" 1
1634 1 102 HIS H 1 102 HIS QB 2.500 . 3.500 2.292 2.272 2.326 . 0 0 "[ . 1 . 2 . 3]" 1
1635 1 102 HIS H 1 102 HIS HD2 4.000 . 5.000 2.778 2.674 2.889 . 0 0 "[ . 1 . 2 . 3]" 1
1636 1 102 HIS HA 1 102 HIS HD2 4.000 . 5.000 3.982 3.844 4.090 . 0 0 "[ . 1 . 2 . 3]" 1
1637 1 102 HIS HB3 1 102 HIS HD2 4.000 . 5.000 3.924 3.905 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
1638 1 102 HIS HB2 1 102 HIS HD2 4.000 . 5.000 2.849 2.821 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
1639 1 102 HIS HA 1 102 HIS HE1 4.000 . 5.000 4.767 4.700 4.925 . 0 0 "[ . 1 . 2 . 3]" 1
1640 1 102 HIS H 1 105 LYS H 5.000 3.000 6.000 4.786 4.693 4.981 . 0 0 "[ . 1 . 2 . 3]" 1
1641 1 102 HIS H 1 105 LYS QB 4.000 . 6.000 4.521 4.347 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 102 HIS H 1 103 LEU MD1 4.000 . 6.500 5.225 5.136 5.337 . 0 0 "[ . 1 . 2 . 3]" 1
1643 1 102 HIS HD2 1 103 LEU H 4.000 . 5.000 5.070 5.014 5.159 0.159 29 0 "[ . 1 . 2 . 3]" 1
1644 1 102 HIS QB 1 103 LEU H 2.500 . 3.900 2.726 2.695 2.803 . 0 0 "[ . 1 . 2 . 3]" 1
1645 1 102 HIS QB 1 104 LYS H 4.000 . 6.000 5.030 4.931 5.161 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 102 HIS QB 1 105 LYS H 4.000 . 6.000 4.654 4.577 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
1647 1 102 HIS HA 1 105 LYS QG 4.000 . 6.000 4.230 3.723 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 102 HIS HB3 1 105 LYS QB 4.000 . 6.000 4.017 3.841 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
1649 1 102 HIS HB2 1 105 LYS QB 4.000 . 6.000 4.829 4.675 5.011 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 102 HIS HB2 1 103 LEU MD1 4.000 . 6.500 5.116 5.026 5.273 . 0 0 "[ . 1 . 2 . 3]" 1
1651 1 102 HIS HB3 1 103 LEU MD2 4.000 . 6.500 4.418 4.059 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
1652 1 102 HIS HB2 1 103 LEU MD2 4.000 . 6.500 4.475 3.993 4.610 . 0 0 "[ . 1 . 2 . 3]" 1
1653 1 102 HIS HA 1 106 LEU QD 4.000 . 7.400 3.498 3.353 3.695 . 0 0 "[ . 1 . 2 . 3]" 1
1654 1 102 HIS HE1 1 105 LYS QE 4.000 . 6.000 4.608 3.580 5.414 . 0 0 "[ . 1 . 2 . 3]" 1
1655 1 102 HIS HA 1 105 LYS QE 4.000 . 6.000 4.716 2.884 5.389 . 0 0 "[ . 1 . 2 . 3]" 1
1656 1 102 HIS HE1 1 105 LYS QD 4.000 . 6.000 4.036 3.716 5.086 . 0 0 "[ . 1 . 2 . 3]" 1
1657 1 102 HIS HE1 1 106 LEU QD 4.000 . 7.400 5.186 5.091 5.499 . 0 0 "[ . 1 . 2 . 3]" 1
1658 1 103 LEU HA 1 103 LEU HG 4.000 . 5.000 2.867 2.804 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
1659 1 103 LEU HA 1 103 LEU MD1 4.000 . 6.500 3.820 3.803 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
1660 1 103 LEU HA 1 103 LEU MD2 2.500 . 4.200 2.153 2.124 2.174 . 0 0 "[ . 1 . 2 . 3]" 1
1661 1 103 LEU H 1 103 LEU QD 2.500 . 4.600 3.109 2.970 3.162 . 0 0 "[ . 1 . 2 . 3]" 1
1662 1 103 LEU H 1 103 LEU HG 2.500 . 2.900 2.229 2.051 2.305 . 0 0 "[ . 1 . 2 . 3]" 1
1663 1 103 LEU H 1 103 LEU HB3 4.000 . 5.000 3.636 3.618 3.654 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 103 LEU H 1 103 LEU HB2 4.000 . 5.000 2.487 2.450 2.610 . 0 0 "[ . 1 . 2 . 3]" 1
1665 1 103 LEU H 1 106 LEU H 5.000 3.000 6.000 5.186 5.012 5.278 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 103 LEU HB3 1 104 LYS H 4.000 . 5.000 3.361 3.231 3.536 . 0 0 "[ . 1 . 2 . 3]" 1
1667 1 103 LEU HB2 1 104 LYS H 4.000 . 5.000 2.439 2.295 2.530 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 103 LEU QD 1 104 LYS H 3.000 . 5.900 4.001 3.907 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
1669 1 103 LEU HA 1 106 LEU HG 4.000 . 5.000 4.712 4.289 5.044 0.044 1 0 "[ . 1 . 2 . 3]" 1
1670 1 104 LYS H 1 104 LYS HB3 2.500 . 2.900 2.625 2.502 2.740 . 0 0 "[ . 1 . 2 . 3]" 1
1671 1 104 LYS H 1 104 LYS QD 4.000 . 6.000 3.793 3.361 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 104 LYS H 1 104 LYS QE 4.000 . 6.000 3.951 3.005 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
1673 1 104 LYS HA 1 104 LYS QE 5.000 . 7.000 4.960 4.152 5.743 . 0 0 "[ . 1 . 2 . 3]" 1
1674 1 104 LYS QB 1 104 LYS QE 4.000 . 7.000 2.885 2.000 3.662 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 104 LYS HA 1 104 LYS QD 4.000 . 6.000 4.358 4.234 4.524 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 104 LYS H 1 105 LYS QB 4.000 . 6.000 4.387 4.296 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
1677 1 104 LYS HA 1 107 PHE HD1 5.000 3.000 6.000 5.513 5.223 5.951 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 104 LYS QE 1 105 LYS QB 4.000 . 7.000 5.071 4.303 5.645 . 0 0 "[ . 1 . 2 . 3]" 1
1679 1 105 LYS QB 1 105 LYS QE 4.000 . 7.000 3.344 2.175 3.671 . 0 0 "[ . 1 . 2 . 3]" 1
1680 1 105 LYS H 1 105 LYS QG 4.000 . 6.000 3.948 2.988 4.006 . 0 0 "[ . 1 . 2 . 3]" 1
1681 1 105 LYS H 1 105 LYS QB 3.000 . 4.100 2.263 2.159 2.295 . 0 0 "[ . 1 . 2 . 3]" 1
1682 1 105 LYS HA 1 105 LYS QG 3.000 . 3.900 2.355 2.212 2.416 . 0 0 "[ . 1 . 2 . 3]" 1
1683 1 105 LYS QG 1 106 LEU H 4.000 . 6.000 3.568 3.366 4.404 . 0 0 "[ . 1 . 2 . 3]" 1
1684 1 105 LYS H 1 108 ARG H 5.000 3.000 6.000 5.197 4.873 5.447 . 0 0 "[ . 1 . 2 . 3]" 1
1685 1 105 LYS H 1 106 LEU QD 4.000 . 7.400 3.732 3.474 3.842 . 0 0 "[ . 1 . 2 . 3]" 1
1686 1 105 LYS QG 1 109 GLU H 4.000 . 6.000 4.792 4.609 5.461 . 0 0 "[ . 1 . 2 . 3]" 1
1687 1 105 LYS QG 1 106 LEU HA 4.000 . 6.000 3.658 3.452 5.511 . 0 0 "[ . 1 . 2 . 3]" 1
1688 1 105 LYS QG 1 108 ARG QD 4.000 . 7.000 4.325 3.251 5.618 . 0 0 "[ . 1 . 2 . 3]" 1
1689 1 105 LYS QG 1 109 GLU QG 4.000 . 7.000 4.079 3.479 4.928 . 0 0 "[ . 1 . 2 . 3]" 1
1690 1 105 LYS QE 1 106 LEU QD 4.000 . 8.400 3.928 2.612 5.457 . 0 0 "[ . 1 . 2 . 3]" 1
1691 1 106 LEU HB3 1 106 LEU QD 3.000 . 5.000 2.205 2.164 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
1692 1 106 LEU HA 1 106 LEU QD 2.500 . 4.400 1.988 1.972 2.013 . 0 0 "[ . 1 . 2 . 3]" 1
1693 1 106 LEU H 1 106 LEU HG 4.000 . 5.000 3.731 3.642 3.932 . 0 0 "[ . 1 . 2 . 3]" 1
1694 1 106 LEU HA 1 106 LEU HG 4.000 . 5.000 3.680 3.645 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
1695 1 106 LEU H 1 106 LEU QD 3.000 . 5.200 1.826 1.763 2.013 . 0 0 "[ . 1 . 2 . 3]" 1
1696 1 106 LEU H 1 106 LEU HB3 4.000 . 5.000 3.603 3.584 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
1697 1 106 LEU H 1 106 LEU HB2 3.000 . 3.500 2.339 2.308 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
1698 1 106 LEU H 1 107 PHE QB 4.000 . 6.000 4.484 4.426 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
1699 1 106 LEU HA 1 111 ARG H 4.000 . 5.000 4.345 3.596 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
1700 1 106 LEU HB3 1 107 PHE H 4.000 . 5.000 3.691 3.564 3.779 . 0 0 "[ . 1 . 2 . 3]" 1
1701 1 106 LEU HB2 1 107 PHE H 3.000 . 4.000 3.000 2.801 3.108 . 0 0 "[ . 1 . 2 . 3]" 1
1702 1 106 LEU HG 1 107 PHE H 5.000 3.000 6.000 5.255 5.165 5.364 . 0 0 "[ . 1 . 2 . 3]" 1
1703 1 106 LEU QD 1 107 PHE H 4.000 . 7.400 3.815 3.668 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
1704 1 106 LEU QD 1 108 ARG H 4.000 . 7.400 4.847 4.726 4.972 . 0 0 "[ . 1 . 2 . 3]" 1
1705 1 106 LEU QD 1 109 GLU H 4.000 . 7.400 4.266 4.153 4.352 . 0 0 "[ . 1 . 2 . 3]" 1
1706 1 106 LEU QD 1 110 GLY H 4.000 . 7.400 4.895 4.660 5.051 . 0 0 "[ . 1 . 2 . 3]" 1
1707 1 106 LEU QD 1 111 ARG H 4.000 . 7.400 3.813 3.454 4.127 . 0 0 "[ . 1 . 2 . 3]" 1
1708 1 106 LEU QD 1 111 ARG QD 4.000 . 8.400 4.181 3.696 5.044 . 0 0 "[ . 1 . 2 . 3]" 1
1709 1 106 LEU HB3 1 107 PHE HA 4.000 . 5.000 4.289 4.186 4.371 . 0 0 "[ . 1 . 2 . 3]" 1
1710 1 106 LEU HB2 1 107 PHE HA 4.000 . 5.000 4.590 4.458 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
1711 1 106 LEU HA 1 109 GLU QG 4.000 . 6.000 3.838 3.405 4.627 . 0 0 "[ . 1 . 2 . 3]" 1
1712 1 106 LEU QD 1 113 ASN HA 4.000 . 7.400 5.149 4.813 5.367 . 0 0 "[ . 1 . 2 . 3]" 1
1713 1 106 LEU HB3 1 110 GLY H 4.000 . 5.000 4.952 4.720 5.073 0.073 8 0 "[ . 1 . 2 . 3]" 1
1714 1 106 LEU QD 1 111 ARG HB3 4.000 . 7.400 3.709 3.385 4.242 . 0 0 "[ . 1 . 2 . 3]" 1
1715 1 106 LEU QD 1 111 ARG HB2 4.000 . 7.400 2.948 2.515 3.547 . 0 0 "[ . 1 . 2 . 3]" 1
1716 1 106 LEU QD 1 107 PHE HA 4.000 . 7.400 5.073 5.034 5.130 . 0 0 "[ . 1 . 2 . 3]" 1
1717 1 106 LEU QD 1 109 GLU HB2 4.000 . 7.400 3.289 3.097 3.530 . 0 0 "[ . 1 . 2 . 3]" 1
1718 1 106 LEU HB2 1 112 PHE HE1 4.000 . 5.000 5.031 4.775 5.130 0.130 19 0 "[ . 1 . 2 . 3]" 1
1719 1 106 LEU HB2 1 112 PHE HD1 4.000 . 5.000 4.643 4.275 4.930 . 0 0 "[ . 1 . 2 . 3]" 1
1720 1 107 PHE HA 1 107 PHE HD1 2.500 . 2.700 2.559 2.404 2.744 0.044 17 0 "[ . 1 . 2 . 3]" 1
1721 1 107 PHE H 1 107 PHE QB 2.500 . 3.500 2.294 2.279 2.325 . 0 0 "[ . 1 . 2 . 3]" 1
1722 1 107 PHE H 1 107 PHE HD1 4.000 . 5.000 4.618 4.504 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1723 1 107 PHE HA 1 112 PHE HE1 3.000 . 3.300 2.653 2.407 2.945 . 0 0 "[ . 1 . 2 . 3]" 1
1724 1 107 PHE HA 1 112 PHE HD1 4.000 . 5.000 4.529 4.268 4.809 . 0 0 "[ . 1 . 2 . 3]" 1
1725 1 107 PHE H 1 108 ARG QB 4.000 . 6.000 4.724 4.634 4.859 . 0 0 "[ . 1 . 2 . 3]" 1
1726 1 107 PHE HD2 1 108 ARG H 4.000 . 5.000 3.669 3.417 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
1727 1 107 PHE QB 1 108 ARG H 3.000 . 4.500 2.584 2.472 2.647 . 0 0 "[ . 1 . 2 . 3]" 1
1728 1 107 PHE QB 1 109 GLU H 4.000 . 6.000 4.748 4.539 4.863 . 0 0 "[ . 1 . 2 . 3]" 1
1729 1 107 PHE QB 1 110 GLY H 5.000 . 7.000 4.750 4.635 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
1730 1 107 PHE HB2 1 112 PHE HZ 4.000 . 5.000 4.786 4.474 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
1731 1 107 PHE HB3 1 108 ARG QG 4.000 . 6.000 3.387 3.170 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
1732 1 107 PHE HB2 1 108 ARG QG 4.000 . 6.000 4.976 4.787 5.140 . 0 0 "[ . 1 . 2 . 3]" 1
1733 1 107 PHE HD2 1 108 ARG HA 4.000 . 5.000 3.455 3.140 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
1734 1 107 PHE HE1 1 110 GLY QA 4.000 . 6.000 5.249 5.158 5.338 . 0 0 "[ . 1 . 2 . 3]" 1
1735 1 108 ARG QB 1 108 ARG QD 2.500 . 4.700 2.268 2.107 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
1736 1 108 ARG H 1 108 ARG QB 2.500 . 3.500 2.417 2.369 2.511 . 0 0 "[ . 1 . 2 . 3]" 1
1737 1 108 ARG H 1 108 ARG QD 4.000 . 6.000 3.888 3.430 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
1738 1 108 ARG HA 1 108 ARG QD 4.000 . 6.000 3.575 2.232 4.162 . 0 0 "[ . 1 . 2 . 3]" 1
1739 1 108 ARG QB 1 109 GLU H 2.500 . 3.900 2.665 2.515 2.913 . 0 0 "[ . 1 . 2 . 3]" 1
1740 1 108 ARG QG 1 109 GLU H 4.000 . 6.000 4.143 3.980 4.251 . 0 0 "[ . 1 . 2 . 3]" 1
1741 1 109 GLU H 1 109 GLU QG 3.000 . 4.300 2.513 2.315 3.357 . 0 0 "[ . 1 . 2 . 3]" 1
1742 1 109 GLU HA 1 109 GLU QG 3.000 . 3.900 2.428 2.292 2.805 . 0 0 "[ . 1 . 2 . 3]" 1
1743 1 109 GLU H 1 110 GLY QA 4.000 . 6.000 4.370 4.335 4.415 . 0 0 "[ . 1 . 2 . 3]" 1
1744 1 109 GLU QG 1 110 GLY H 4.000 . 6.000 4.319 4.185 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1745 1 109 GLU HB3 1 110 GLY H 4.000 . 5.000 4.075 3.694 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
1746 1 109 GLU HB2 1 110 GLY H 4.000 . 5.000 3.263 2.789 3.418 . 0 0 "[ . 1 . 2 . 3]" 1
1747 1 109 GLU H 1 111 ARG H 4.000 . 5.000 3.840 3.738 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
1748 1 109 GLU HB2 1 111 ARG H 4.000 . 5.000 2.649 2.506 2.747 . 0 0 "[ . 1 . 2 . 3]" 1
1749 1 109 GLU HB3 1 111 ARG QG 4.000 . 6.000 2.685 2.319 3.195 . 0 0 "[ . 1 . 2 . 3]" 1
1750 1 109 GLU HB3 1 111 ARG HB2 4.000 . 5.000 3.161 2.794 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
1751 1 109 GLU QG 1 111 ARG QD 4.000 . 7.000 4.301 3.544 5.414 . 0 0 "[ . 1 . 2 . 3]" 1
1752 1 109 GLU HA 1 111 ARG QG 4.000 . 6.000 4.297 4.076 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
1753 1 109 GLU HB3 1 111 ARG QD 4.000 . 6.000 2.968 2.562 4.205 . 0 0 "[ . 1 . 2 . 3]" 1
1754 1 109 GLU HB2 1 111 ARG HB2 4.000 . 5.000 3.094 2.871 3.466 . 0 0 "[ . 1 . 2 . 3]" 1
1755 1 110 GLY H 1 112 PHE HE2 4.000 . 5.000 5.100 5.045 5.152 0.152 5 0 "[ . 1 . 2 . 3]" 1
1756 1 110 GLY H 1 111 ARG QG 4.000 . 6.000 4.631 4.441 4.829 . 0 0 "[ . 1 . 2 . 3]" 1
1757 1 110 GLY HA3 1 112 PHE HD2 4.000 . 6.000 5.111 4.943 5.276 . 0 0 "[ . 1 . 2 . 3]" 1
1758 1 110 GLY HA2 1 112 PHE HD2 4.000 . 6.000 4.414 4.307 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
1759 1 111 ARG H 1 111 ARG QG 3.000 . 4.500 2.625 2.466 2.754 . 0 0 "[ . 1 . 2 . 3]" 1
1760 1 111 ARG H 1 111 ARG HB2 3.000 . 3.500 2.425 2.379 2.515 . 0 0 "[ . 1 . 2 . 3]" 1
1761 1 111 ARG H 1 111 ARG HB3 4.000 . 5.000 3.660 3.641 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
1762 1 111 ARG H 1 111 ARG QD 4.000 . 6.000 4.061 3.947 4.567 . 0 0 "[ . 1 . 2 . 3]" 1
1763 1 111 ARG HA 1 111 ARG QD 4.000 . 6.000 3.984 3.754 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
1764 1 111 ARG H 1 112 PHE HD1 5.000 3.000 6.000 5.979 5.810 6.070 0.070 24 0 "[ . 1 . 2 . 3]" 1
1765 1 111 ARG H 1 112 PHE HE1 5.000 3.000 6.000 5.862 5.643 6.009 0.009 11 0 "[ . 1 . 2 . 3]" 1
1766 1 111 ARG HB3 1 112 PHE H 4.000 . 5.000 3.920 3.769 4.010 . 0 0 "[ . 1 . 2 . 3]" 1
1767 1 111 ARG HB2 1 112 PHE H 4.000 . 5.000 4.484 4.419 4.523 . 0 0 "[ . 1 . 2 . 3]" 1
1768 1 111 ARG QG 1 112 PHE H 4.000 . 6.000 4.287 4.209 4.362 . 0 0 "[ . 1 . 2 . 3]" 1
1769 1 111 ARG QB 1 112 PHE HA 4.000 . 6.000 4.435 4.380 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
1770 1 112 PHE HA 1 112 PHE HE1 4.000 . 5.000 4.749 4.670 4.808 . 0 0 "[ . 1 . 2 . 3]" 1
1771 1 112 PHE HA 1 112 PHE HD1 2.500 . 2.700 2.743 2.664 2.819 0.119 18 0 "[ . 1 . 2 . 3]" 1
1772 1 112 PHE H 1 112 PHE HB2 2.500 . 2.900 2.528 2.493 2.574 . 0 0 "[ . 1 . 2 . 3]" 1
1773 1 112 PHE H 1 112 PHE HB3 4.000 . 5.000 3.651 3.625 3.685 . 0 0 "[ . 1 . 2 . 3]" 1
1774 1 112 PHE H 1 112 PHE HD1 4.000 . 5.000 4.510 4.427 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
1775 1 112 PHE HD1 1 113 ASN H 4.000 . 5.000 4.248 4.057 4.518 . 0 0 "[ . 1 . 2 . 3]" 1
1776 1 112 PHE HB3 1 113 ASN H 4.000 . 5.000 3.206 2.613 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1777 1 7 SER H 1 8 THR H 2.500 . 2.900 2.737 2.664 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
1778 1 8 THR H 1 9 ALA H 2.500 . 2.900 2.645 2.579 2.695 . 0 0 "[ . 1 . 2 . 3]" 1
1779 1 9 ALA H 1 10 LEU H 2.500 . 2.900 2.724 2.672 2.839 . 0 0 "[ . 1 . 2 . 3]" 1
1780 1 10 LEU H 1 11 ARG H 2.500 . 2.900 2.787 2.670 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
1781 1 12 GLU H 1 13 LEU H 2.500 . 2.900 2.659 2.570 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
1782 1 13 LEU H 1 14 ILE H 2.500 . 2.900 2.681 2.638 2.751 . 0 0 "[ . 1 . 2 . 3]" 1
1783 1 14 ILE H 1 15 GLU H 3.000 . 3.500 2.803 2.712 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
1784 1 15 GLU H 1 16 GLU H 2.500 . 2.900 2.799 2.753 2.846 . 0 0 "[ . 1 . 2 . 3]" 1
1785 1 16 GLU H 1 17 LEU H 2.500 . 2.900 2.674 2.623 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
1786 1 17 LEU H 1 18 VAL H 2.500 . 2.900 2.737 2.675 2.791 . 0 0 "[ . 1 . 2 . 3]" 1
1787 1 18 VAL H 1 19 ASN H 2.500 . 2.900 2.689 2.630 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
1788 1 19 ASN H 1 20 ILE H 3.000 . 3.500 2.842 2.811 2.880 . 0 0 "[ . 1 . 2 . 3]" 1
1789 1 20 ILE H 1 21 THR H 2.500 . 2.900 2.615 2.574 2.651 . 0 0 "[ . 1 . 2 . 3]" 1
1790 1 21 THR H 1 22 GLN H 2.500 . 2.900 2.267 2.183 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
1791 1 22 GLN H 1 23 ASN H 4.000 . 5.000 2.530 2.429 2.638 . 0 0 "[ . 1 . 2 . 3]" 1
1792 1 24 GLN H 1 25 LYS H 4.000 . 5.000 4.558 4.461 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
1793 1 25 LYS H 1 26 ALA H 3.000 . 3.500 2.836 2.268 2.939 . 0 0 "[ . 1 . 2 . 3]" 1
1794 1 30 ASN H 1 31 GLY H 4.000 . 5.000 3.442 3.267 3.837 . 0 0 "[ . 1 . 2 . 3]" 1
1795 1 31 GLY H 1 32 SER H 3.000 . 3.500 2.458 2.259 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
1796 1 32 SER H 1 33 MET H 4.000 . 5.000 4.656 4.627 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
1797 1 33 MET H 1 34 VAL H 4.000 . 5.000 4.536 4.452 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1798 1 34 VAL H 1 35 TRP H 4.000 . 5.000 4.497 4.483 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
1799 1 35 TRP H 1 36 SER H 4.000 . 5.000 4.606 4.574 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
1800 1 36 SER H 1 37 ILE H 4.000 . 5.000 4.664 4.628 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
1801 1 39 LEU H 1 40 THR H 4.000 . 5.000 4.445 4.306 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
1802 1 40 THR H 1 41 ALA H 4.000 . 5.000 3.370 2.812 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
1803 1 41 ALA H 1 42 GLY H 4.000 . 5.000 2.581 2.155 3.190 . 0 0 "[ . 1 . 2 . 3]" 1
1804 1 42 GLY H 1 43 MET H 4.000 . 5.000 3.290 2.973 3.552 . 0 0 "[ . 1 . 2 . 3]" 1
1805 1 43 MET H 1 44 TYR H 3.000 . 3.500 2.739 2.642 2.864 . 0 0 "[ . 1 . 2 . 3]" 1
1806 1 44 TYR H 1 45 CYS H 2.500 . 2.900 2.808 2.712 2.902 0.002 8 0 "[ . 1 . 2 . 3]" 1
1807 1 45 CYS H 1 46 ALA H 2.500 . 2.900 2.727 2.667 2.799 . 0 0 "[ . 1 . 2 . 3]" 1
1808 1 46 ALA H 1 47 ALA H 3.000 . 3.500 2.767 2.690 2.819 . 0 0 "[ . 1 . 2 . 3]" 1
1809 1 47 ALA H 1 48 LEU H 3.000 . 3.500 2.697 2.627 2.763 . 0 0 "[ . 1 . 2 . 3]" 1
1810 1 48 LEU H 1 49 GLU H 2.500 . 2.900 2.920 2.899 2.940 0.040 6 0 "[ . 1 . 2 . 3]" 1
1811 1 49 GLU H 1 50 SER H 2.500 . 2.900 2.777 2.733 2.842 . 0 0 "[ . 1 . 2 . 3]" 1
1812 1 50 SER H 1 51 LEU H 2.500 . 2.900 2.684 2.630 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
1813 1 51 LEU H 1 52 ILE H 2.500 . 2.900 2.602 2.543 2.637 . 0 0 "[ . 1 . 2 . 3]" 1
1814 1 52 ILE H 1 53 ASN H 3.000 . 3.500 2.772 2.683 2.836 . 0 0 "[ . 1 . 2 . 3]" 1
1815 1 53 ASN H 1 54 VAL H 2.500 . 2.900 2.365 2.276 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
1816 1 54 VAL H 1 55 SER H 4.000 . 5.000 4.471 4.436 4.523 . 0 0 "[ . 1 . 2 . 3]" 1
1817 1 55 SER H 1 56 GLY H 4.000 . 5.000 4.483 4.453 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
1818 1 56 GLY H 1 57 CYS H 3.000 . 3.500 2.463 2.292 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
1819 1 59 ALA H 1 60 ILE H 3.000 . 3.500 2.914 2.811 2.987 . 0 0 "[ . 1 . 2 . 3]" 1
1820 1 60 ILE H 1 61 GLU H 2.500 . 2.900 2.213 1.852 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
1821 1 61 GLU H 1 62 LYS H 3.000 . 3.500 2.716 2.645 2.794 . 0 0 "[ . 1 . 2 . 3]" 1
1822 1 62 LYS H 1 63 THR H 4.000 . 5.000 2.642 2.584 2.697 . 0 0 "[ . 1 . 2 . 3]" 1
1823 1 63 THR H 1 64 GLN H 3.000 . 3.500 2.739 2.666 2.773 . 0 0 "[ . 1 . 2 . 3]" 1
1824 1 65 ARG H 1 66 MET H 2.500 . 2.900 2.746 2.614 2.811 . 0 0 "[ . 1 . 2 . 3]" 1
1825 1 66 MET H 1 67 LEU H 2.500 . 2.900 2.725 2.668 2.793 . 0 0 "[ . 1 . 2 . 3]" 1
1826 1 67 LEU H 1 68 SER H 3.000 . 3.500 2.665 2.545 2.734 . 0 0 "[ . 1 . 2 . 3]" 1
1827 1 68 SER H 1 69 GLY H 2.500 . 2.900 2.711 2.653 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
1828 1 73 HIS H 1 74 LYS H 4.000 . 5.000 4.352 4.071 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
1829 1 76 SER H 1 77 ALA H 4.000 . 5.000 4.586 4.548 4.614 . 0 0 "[ . 1 . 2 . 3]" 1
1830 1 78 GLY H 1 79 GLN H 3.000 . 3.500 2.205 2.033 2.749 . 0 0 "[ . 1 . 2 . 3]" 1
1831 1 79 GLN H 1 80 PHE H 4.000 . 5.000 4.512 4.460 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
1832 1 80 PHE H 1 81 SER H 4.000 . 5.000 4.464 4.414 4.492 . 0 0 "[ . 1 . 2 . 3]" 1
1833 1 82 SER H 1 83 LEU H 4.000 . 5.000 2.408 2.106 2.571 . 0 0 "[ . 1 . 2 . 3]" 1
1834 1 83 LEU H 1 84 HIS H 4.000 . 5.000 2.856 2.495 3.003 . 0 0 "[ . 1 . 2 . 3]" 1
1835 1 84 HIS H 1 85 VAL H 4.000 . 5.000 2.474 2.343 2.577 . 0 0 "[ . 1 . 2 . 3]" 1
1836 1 85 VAL H 1 86 ARG H 4.000 . 5.000 4.656 4.638 4.671 . 0 0 "[ . 1 . 2 . 3]" 1
1837 1 86 ARG H 1 87 ASP H 4.000 . 5.000 3.612 3.234 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
1838 1 87 ASP H 1 88 THR H 4.000 . 5.000 4.607 4.562 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
1839 1 89 LYS H 1 90 ILE H 4.000 . 5.000 4.636 4.610 4.650 . 0 0 "[ . 1 . 2 . 3]" 1
1840 1 90 ILE H 1 91 GLU H 4.000 . 5.000 4.485 4.453 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
1841 1 91 GLU H 1 92 VAL H 4.000 . 5.000 4.670 4.639 4.691 . 0 0 "[ . 1 . 2 . 3]" 1
1842 1 92 VAL H 1 93 ALA H 4.000 . 5.000 2.775 2.703 2.813 . 0 0 "[ . 1 . 2 . 3]" 1
1843 1 93 ALA H 1 94 GLN H 3.000 . 3.500 2.853 2.775 2.982 . 0 0 "[ . 1 . 2 . 3]" 1
1844 1 94 GLN H 1 95 PHE H 2.500 . 2.900 2.472 2.414 2.547 . 0 0 "[ . 1 . 2 . 3]" 1
1845 1 95 PHE H 1 96 VAL H 3.000 . 3.500 2.806 2.754 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
1846 1 96 VAL H 1 97 LYS H 3.000 . 3.500 2.786 2.704 2.859 . 0 0 "[ . 1 . 2 . 3]" 1
1847 1 97 LYS H 1 98 ASP H 3.000 . 3.500 2.828 2.731 2.911 . 0 0 "[ . 1 . 2 . 3]" 1
1848 1 98 ASP H 1 99 LEU H 3.000 . 3.500 2.689 2.645 2.752 . 0 0 "[ . 1 . 2 . 3]" 1
1849 1 99 LEU H 1 100 LEU H 3.000 . 3.500 2.644 2.577 2.706 . 0 0 "[ . 1 . 2 . 3]" 1
1850 1 100 LEU H 1 101 LEU H 3.000 . 3.500 2.907 2.858 2.975 . 0 0 "[ . 1 . 2 . 3]" 1
1851 1 101 LEU H 1 102 HIS H 3.000 . 3.500 2.795 2.752 2.868 . 0 0 "[ . 1 . 2 . 3]" 1
1852 1 102 HIS H 1 103 LEU H 2.500 . 2.900 2.705 2.629 2.750 . 0 0 "[ . 1 . 2 . 3]" 1
1853 1 103 LEU H 1 104 LYS H 3.000 . 3.500 2.945 2.863 3.084 . 0 0 "[ . 1 . 2 . 3]" 1
1854 1 104 LYS H 1 105 LYS H 2.500 . 2.900 2.612 2.548 2.678 . 0 0 "[ . 1 . 2 . 3]" 1
1855 1 105 LYS H 1 106 LEU H 2.500 . 2.900 2.799 2.700 2.857 . 0 0 "[ . 1 . 2 . 3]" 1
1856 1 106 LEU H 1 107 PHE H 3.000 . 3.500 2.678 2.625 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
1857 1 107 PHE H 1 108 ARG H 3.000 . 3.500 2.742 2.677 2.844 . 0 0 "[ . 1 . 2 . 3]" 1
1858 1 108 ARG H 1 109 GLU H 3.000 . 3.500 2.732 2.626 2.800 . 0 0 "[ . 1 . 2 . 3]" 1
1859 1 109 GLU H 1 110 GLY H 3.000 . 3.500 2.418 2.372 2.471 . 0 0 "[ . 1 . 2 . 3]" 1
1860 1 111 ARG H 1 112 PHE H 4.000 . 5.000 4.160 4.052 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
1861 1 8 THR H 1 10 LEU H 4.000 . 5.000 4.191 4.055 4.366 . 0 0 "[ . 1 . 2 . 3]" 1
1862 1 10 LEU H 1 12 GLU H 4.000 . 5.000 4.165 4.089 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
1863 1 16 GLU H 1 18 VAL H 4.000 . 5.000 4.188 4.071 4.296 . 0 0 "[ . 1 . 2 . 3]" 1
1864 1 17 LEU H 1 19 ASN H 4.000 . 5.000 4.223 4.119 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
1865 1 18 VAL H 1 20 ILE H 4.000 . 5.000 4.361 4.291 4.530 . 0 0 "[ . 1 . 2 . 3]" 1
1866 1 19 ASN H 1 21 THR H 4.000 . 5.000 4.126 3.988 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
1867 1 20 ILE H 1 22 GLN H 4.000 . 5.000 4.183 4.077 4.285 . 0 0 "[ . 1 . 2 . 3]" 1
1868 1 21 THR H 1 23 ASN H 4.000 . 5.000 4.138 3.898 4.693 . 0 0 "[ . 1 . 2 . 3]" 1
1869 1 30 ASN H 1 32 SER H 4.000 . 5.000 3.547 3.395 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
1870 1 44 TYR H 1 46 ALA H 4.000 . 5.000 4.355 4.222 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
1871 1 46 ALA H 1 48 LEU H 4.000 . 5.000 4.141 4.009 4.244 . 0 0 "[ . 1 . 2 . 3]" 1
1872 1 49 GLU H 1 51 LEU H 4.000 . 5.000 4.278 4.193 4.361 . 0 0 "[ . 1 . 2 . 3]" 1
1873 1 50 SER H 1 52 ILE H 4.000 . 5.000 4.081 3.952 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
1874 1 51 LEU H 1 53 ASN H 4.000 . 5.000 4.104 4.015 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
1875 1 52 ILE H 1 54 VAL H 4.000 . 5.000 4.207 4.072 4.361 . 0 0 "[ . 1 . 2 . 3]" 1
1876 1 59 ALA H 1 61 GLU H 4.000 . 5.000 4.164 4.016 4.287 . 0 0 "[ . 1 . 2 . 3]" 1
1877 1 60 ILE H 1 62 LYS H 4.000 . 5.000 4.510 4.184 4.895 . 0 0 "[ . 1 . 2 . 3]" 1
1878 1 61 GLU H 1 63 THR H 4.000 . 5.000 4.052 3.904 4.152 . 0 0 "[ . 1 . 2 . 3]" 1
1879 1 62 LYS H 1 64 GLN H 4.000 . 5.000 4.187 4.072 4.290 . 0 0 "[ . 1 . 2 . 3]" 1
1880 1 64 GLN H 1 66 MET H 4.000 . 5.000 4.336 4.052 4.458 . 0 0 "[ . 1 . 2 . 3]" 1
1881 1 65 ARG H 1 67 LEU H 4.000 . 5.000 4.147 4.083 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
1882 1 66 MET H 1 68 SER H 4.000 . 5.000 4.160 3.993 4.277 . 0 0 "[ . 1 . 2 . 3]" 1
1883 1 67 LEU H 1 69 GLY H 4.000 . 5.000 4.155 4.077 4.248 . 0 0 "[ . 1 . 2 . 3]" 1
1884 1 68 SER H 1 70 PHE H 4.000 . 5.000 4.168 4.047 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
1885 1 92 VAL H 1 94 GLN H 4.000 . 5.000 4.367 4.208 4.551 . 0 0 "[ . 1 . 2 . 3]" 1
1886 1 93 ALA H 1 95 PHE H 4.000 . 5.000 4.100 3.997 4.247 . 0 0 "[ . 1 . 2 . 3]" 1
1887 1 94 GLN H 1 96 VAL H 4.000 . 5.000 4.304 4.207 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
1888 1 95 PHE H 1 97 LYS H 4.000 . 5.000 4.293 4.096 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
1889 1 96 VAL H 1 98 ASP H 4.000 . 5.000 4.326 4.177 4.478 . 0 0 "[ . 1 . 2 . 3]" 1
1890 1 97 LYS H 1 99 LEU H 4.000 . 5.000 4.187 4.085 4.331 . 0 0 "[ . 1 . 2 . 3]" 1
1891 1 98 ASP H 1 100 LEU H 4.000 . 5.000 4.084 4.003 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
1892 1 99 LEU H 1 101 LEU H 4.000 . 5.000 4.448 4.373 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
1893 1 100 LEU H 1 102 HIS H 4.000 . 5.000 4.426 4.324 4.571 . 0 0 "[ . 1 . 2 . 3]" 1
1894 1 101 LEU H 1 103 LEU H 4.000 . 5.000 4.259 4.188 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
1895 1 102 HIS H 1 104 LYS H 4.000 . 5.000 4.618 4.476 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
1896 1 103 LEU H 1 105 LYS H 4.000 . 5.000 3.929 3.835 4.046 . 0 0 "[ . 1 . 2 . 3]" 1
1897 1 104 LYS H 1 106 LEU H 4.000 . 5.000 4.674 4.521 4.753 . 0 0 "[ . 1 . 2 . 3]" 1
1898 1 105 LYS H 1 107 PHE H 4.000 . 5.000 4.000 3.891 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
1899 1 106 LEU H 1 108 ARG H 4.000 . 5.000 4.431 4.274 4.666 . 0 0 "[ . 1 . 2 . 3]" 1
1900 1 107 PHE H 1 109 GLU H 4.000 . 5.000 4.239 4.043 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
1901 1 108 ARG H 1 110 GLY H 4.000 . 5.000 3.907 3.732 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
1902 1 6 PRO HA 1 7 SER H 3.000 . 3.500 3.578 3.565 3.590 0.090 20 0 "[ . 1 . 2 . 3]" 1
1903 1 8 THR HA 1 9 ALA H 4.000 . 5.000 3.560 3.546 3.574 . 0 0 "[ . 1 . 2 . 3]" 1
1904 1 9 ALA HA 1 10 LEU H 4.000 . 5.000 3.561 3.545 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1905 1 10 LEU HA 1 11 ARG H 4.000 . 5.000 3.583 3.564 3.600 . 0 0 "[ . 1 . 2 . 3]" 1
1906 1 11 ARG HA 1 12 GLU H 4.000 . 5.000 3.554 3.537 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1907 1 12 GLU HA 1 13 LEU H 4.000 . 5.000 3.545 3.522 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1908 1 13 LEU HA 1 14 ILE H 4.000 . 5.000 3.582 3.570 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
1909 1 14 ILE HA 1 15 GLU H 4.000 . 5.000 3.575 3.561 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1910 1 15 GLU HA 1 16 GLU H 4.000 . 5.000 3.570 3.555 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1911 1 16 GLU HA 1 17 LEU H 4.000 . 5.000 3.578 3.559 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
1912 1 17 LEU HA 1 18 VAL H 4.000 . 5.000 3.553 3.541 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
1913 1 18 VAL HA 1 19 ASN H 4.000 . 5.000 3.557 3.536 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
1914 1 19 ASN HA 1 20 ILE H 4.000 . 5.000 3.577 3.564 3.588 . 0 0 "[ . 1 . 2 . 3]" 1
1915 1 20 ILE HA 1 21 THR H 4.000 . 5.000 3.478 3.424 3.505 . 0 0 "[ . 1 . 2 . 3]" 1
1916 1 21 THR HA 1 22 GLN H 3.000 . 3.500 3.473 3.369 3.529 0.029 14 0 "[ . 1 . 2 . 3]" 1
1917 1 22 GLN HA 1 23 ASN H 3.000 . 3.500 3.540 3.480 3.576 0.076 28 0 "[ . 1 . 2 . 3]" 1
1918 1 24 GLN HA 1 25 LYS H 3.000 . 3.500 2.194 2.168 2.215 . 0 0 "[ . 1 . 2 . 3]" 1
1919 1 25 LYS HA 1 26 ALA H 4.000 . 5.000 3.549 3.456 3.569 . 0 0 "[ . 1 . 2 . 3]" 1
1920 1 28 LEU HA 1 29 CYS H 3.000 . 3.500 3.515 3.326 3.578 0.078 17 0 "[ . 1 . 2 . 3]" 1
1921 1 29 CYS HA 1 30 ASN H 2.500 . 2.900 2.494 2.409 2.667 . 0 0 "[ . 1 . 2 . 3]" 1
1922 1 30 ASN HA 1 31 GLY H 2.500 . 2.900 2.771 2.512 2.879 . 0 0 "[ . 1 . 2 . 3]" 1
1923 1 31 GLY QA 1 32 SER H 4.000 . 6.000 2.859 2.798 2.926 . 0 0 "[ . 1 . 2 . 3]" 1
1924 1 32 SER HA 1 33 MET H 2.500 . 2.900 2.253 2.208 2.312 . 0 0 "[ . 1 . 2 . 3]" 1
1925 1 33 MET HA 1 34 VAL H 2.500 . 2.900 2.350 2.280 2.412 . 0 0 "[ . 1 . 2 . 3]" 1
1926 1 34 VAL HA 1 35 TRP H 2.500 . 2.900 2.379 2.353 2.413 . 0 0 "[ . 1 . 2 . 3]" 1
1927 1 35 TRP HA 1 36 SER H 2.500 . 2.900 2.216 2.183 2.256 . 0 0 "[ . 1 . 2 . 3]" 1
1928 1 36 SER HA 1 37 ILE H 2.500 . 2.900 2.320 2.235 2.379 . 0 0 "[ . 1 . 2 . 3]" 1
1929 1 37 ILE HA 1 38 ASN H 2.500 . 2.900 2.419 2.374 2.469 . 0 0 "[ . 1 . 2 . 3]" 1
1930 1 38 ASN HA 1 39 LEU H 3.000 . 3.500 2.204 2.183 2.218 . 0 0 "[ . 1 . 2 . 3]" 1
1931 1 39 LEU HA 1 40 THR H 2.500 . 2.900 2.189 2.164 2.208 . 0 0 "[ . 1 . 2 . 3]" 1
1932 1 40 THR HA 1 41 ALA H 4.000 . 5.000 3.397 2.470 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
1933 1 41 ALA HA 1 42 GLY H 4.000 . 5.000 3.575 3.540 3.597 . 0 0 "[ . 1 . 2 . 3]" 1
1934 1 42 GLY QA 1 43 MET H 2.500 . 3.900 2.741 2.645 2.814 . 0 0 "[ . 1 . 2 . 3]" 1
1935 1 43 MET HA 1 44 TYR H 4.000 . 5.000 3.559 3.540 3.581 . 0 0 "[ . 1 . 2 . 3]" 1
1936 1 44 TYR HA 1 45 CYS H 4.000 . 5.000 3.575 3.552 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
1937 1 45 CYS HA 1 46 ALA H 4.000 . 5.000 3.580 3.567 3.596 . 0 0 "[ . 1 . 2 . 3]" 1
1938 1 46 ALA HA 1 47 ALA H 4.000 . 5.000 3.566 3.548 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
1939 1 47 ALA HA 1 48 LEU H 4.000 . 5.000 3.550 3.526 3.563 . 0 0 "[ . 1 . 2 . 3]" 1
1940 1 48 LEU HA 1 49 GLU H 4.000 . 5.000 3.610 3.597 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
1941 1 50 SER HA 1 51 LEU H 4.000 . 5.000 3.553 3.537 3.572 . 0 0 "[ . 1 . 2 . 3]" 1
1942 1 51 LEU HA 1 52 ILE H 4.000 . 5.000 3.540 3.513 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1943 1 52 ILE HA 1 53 ASN H 4.000 . 5.000 3.437 3.382 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
1944 1 53 ASN HA 1 54 VAL H 3.000 . 3.500 3.424 3.380 3.484 . 0 0 "[ . 1 . 2 . 3]" 1
1945 1 54 VAL HA 1 55 SER H 2.500 . 2.900 2.188 2.172 2.203 . 0 0 "[ . 1 . 2 . 3]" 1
1946 1 55 SER HA 1 56 GLY H 2.500 . 2.900 2.296 2.256 2.345 . 0 0 "[ . 1 . 2 . 3]" 1
1947 1 56 GLY QA 1 57 CYS H 3.000 . 4.500 2.879 2.726 2.943 . 0 0 "[ . 1 . 2 . 3]" 1
1948 1 57 CYS HA 1 58 SER H 2.500 . 2.900 2.287 2.236 2.341 . 0 0 "[ . 1 . 2 . 3]" 1
1949 1 59 ALA HA 1 60 ILE H 4.000 . 5.000 3.506 3.401 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1950 1 60 ILE HA 1 61 GLU H 4.000 . 5.000 3.332 3.146 3.415 . 0 0 "[ . 1 . 2 . 3]" 1
1951 1 61 GLU HA 1 62 LYS H 4.000 . 5.000 3.556 3.529 3.579 . 0 0 "[ . 1 . 2 . 3]" 1
1952 1 62 LYS HA 1 63 THR H 4.000 . 5.000 3.540 3.524 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
1953 1 63 THR HA 1 64 GLN H 4.000 . 5.000 3.556 3.543 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1954 1 64 GLN HA 1 65 ARG H 4.000 . 5.000 3.571 3.548 3.612 . 0 0 "[ . 1 . 2 . 3]" 1
1955 1 66 MET HA 1 67 LEU H 4.000 . 5.000 3.563 3.547 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
1956 1 68 SER HA 1 69 GLY H 4.000 . 5.000 3.546 3.533 3.553 . 0 0 "[ . 1 . 2 . 3]" 1
1957 1 69 GLY QA 1 70 PHE H 3.000 . 4.500 2.828 2.798 2.872 . 0 0 "[ . 1 . 2 . 3]" 1
1958 1 70 PHE HA 1 71 CYS H 3.000 . 3.500 3.377 3.235 3.483 . 0 0 "[ . 1 . 2 . 3]" 1
1959 1 72 PRO HA 1 73 HIS H 3.000 . 3.500 3.189 2.931 3.529 0.029 26 0 "[ . 1 . 2 . 3]" 1
1960 1 73 HIS HA 1 74 LYS H 2.500 . 2.900 2.199 2.148 2.313 . 0 0 "[ . 1 . 2 . 3]" 1
1961 1 74 LYS HA 1 75 VAL H 2.500 . 2.900 2.275 2.187 2.445 . 0 0 "[ . 1 . 2 . 3]" 1
1962 1 75 VAL HA 1 76 SER H 2.500 . 2.900 2.189 2.150 2.228 . 0 0 "[ . 1 . 2 . 3]" 1
1963 1 76 SER HA 1 77 ALA H 2.500 . 2.900 2.421 2.302 2.528 . 0 0 "[ . 1 . 2 . 3]" 1
1964 1 78 GLY QA 1 79 GLN H 4.000 . 6.000 2.812 2.731 2.909 . 0 0 "[ . 1 . 2 . 3]" 1
1965 1 79 GLN HA 1 80 PHE H 2.500 . 2.900 2.184 2.155 2.207 . 0 0 "[ . 1 . 2 . 3]" 1
1966 1 82 SER HA 1 83 LEU H 3.000 . 3.500 3.351 3.221 3.416 . 0 0 "[ . 1 . 2 . 3]" 1
1967 1 83 LEU HA 1 84 HIS H 3.000 . 3.500 3.062 2.960 3.198 . 0 0 "[ . 1 . 2 . 3]" 1
1968 1 84 HIS HA 1 85 VAL H 3.000 . 3.500 3.513 3.297 3.557 0.057 1 0 "[ . 1 . 2 . 3]" 1
1969 1 85 VAL HA 1 86 ARG H 3.000 . 3.500 2.308 2.259 2.361 . 0 0 "[ . 1 . 2 . 3]" 1
1970 1 86 ARG HA 1 87 ASP H 2.500 . 2.900 2.548 2.441 2.761 . 0 0 "[ . 1 . 2 . 3]" 1
1971 1 87 ASP HA 1 88 THR H 3.000 . 3.500 2.508 2.413 2.579 . 0 0 "[ . 1 . 2 . 3]" 1
1972 1 88 THR HA 1 89 LYS H 2.500 . 2.900 2.379 2.290 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
1973 1 89 LYS HA 1 90 ILE H 2.500 . 2.900 2.330 2.262 2.384 . 0 0 "[ . 1 . 2 . 3]" 1
1974 1 90 ILE HA 1 91 GLU H 2.500 . 2.900 2.396 2.368 2.433 . 0 0 "[ . 1 . 2 . 3]" 1
1975 1 91 GLU HA 1 92 VAL H 2.500 . 2.900 2.267 2.211 2.306 . 0 0 "[ . 1 . 2 . 3]" 1
1976 1 92 VAL HA 1 93 ALA H 4.000 . 5.000 3.562 3.542 3.573 . 0 0 "[ . 1 . 2 . 3]" 1
1977 1 95 PHE HA 1 96 VAL H 4.000 . 5.000 3.579 3.569 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
1978 1 96 VAL HA 1 97 LYS H 4.000 . 5.000 3.581 3.563 3.604 . 0 0 "[ . 1 . 2 . 3]" 1
1979 1 97 LYS HA 1 98 ASP H 4.000 . 5.000 3.589 3.570 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
1980 1 98 ASP HA 1 99 LEU H 4.000 . 5.000 3.538 3.521 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1981 1 101 LEU HA 1 102 HIS H 4.000 . 5.000 3.565 3.548 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1982 1 102 HIS HA 1 103 LEU H 4.000 . 5.000 3.575 3.563 3.586 . 0 0 "[ . 1 . 2 . 3]" 1
1983 1 106 LEU HA 1 107 PHE H 4.000 . 5.000 3.504 3.473 3.537 . 0 0 "[ . 1 . 2 . 3]" 1
1984 1 109 GLU HA 1 110 GLY H 3.000 . 3.500 3.422 3.370 3.532 0.032 16 0 "[ . 1 . 2 . 3]" 1
1985 1 110 GLY QA 1 111 ARG H 3.000 . 4.500 2.935 2.917 2.953 . 0 0 "[ . 1 . 2 . 3]" 1
1986 1 111 ARG HA 1 112 PHE H 2.500 . 2.900 2.232 2.190 2.270 . 0 0 "[ . 1 . 2 . 3]" 1
1987 1 6 PRO HA 1 8 THR H 4.000 . 5.000 4.479 4.329 4.612 . 0 0 "[ . 1 . 2 . 3]" 1
1988 1 9 ALA HA 1 11 ARG H 4.000 . 5.000 4.628 4.450 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
1989 1 10 LEU HA 1 12 GLU H 4.000 . 5.000 4.492 4.365 4.656 . 0 0 "[ . 1 . 2 . 3]" 1
1990 1 11 ARG HA 1 13 LEU H 4.000 . 5.000 4.365 4.247 4.480 . 0 0 "[ . 1 . 2 . 3]" 1
1991 1 12 GLU HA 1 14 ILE H 4.000 . 5.000 4.671 4.548 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
1992 1 13 LEU HA 1 15 GLU H 4.000 . 5.000 4.669 4.509 4.821 . 0 0 "[ . 1 . 2 . 3]" 1
1993 1 14 ILE HA 1 16 GLU H 4.000 . 5.000 4.472 4.378 4.559 . 0 0 "[ . 1 . 2 . 3]" 1
1994 1 15 GLU HA 1 17 LEU H 4.000 . 5.000 4.680 4.545 4.826 . 0 0 "[ . 1 . 2 . 3]" 1
1995 1 16 GLU HA 1 18 VAL H 4.000 . 5.000 4.480 4.305 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1996 1 17 LEU HA 1 19 ASN H 4.000 . 5.000 4.531 4.408 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
1997 1 18 VAL HA 1 20 ILE H 4.000 . 5.000 4.494 4.385 4.673 . 0 0 "[ . 1 . 2 . 3]" 1
1998 1 21 THR HA 1 23 ASN H 4.000 . 5.000 4.363 3.964 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
1999 1 29 CYS HA 1 31 GLY H 4.000 . 5.000 4.226 4.068 4.700 . 0 0 "[ . 1 . 2 . 3]" 1
2000 1 43 MET HA 1 45 CYS H 4.000 . 5.000 4.593 4.370 4.815 . 0 0 "[ . 1 . 2 . 3]" 1
2001 1 44 TYR HA 1 46 ALA H 4.000 . 5.000 4.873 4.744 5.008 0.008 10 0 "[ . 1 . 2 . 3]" 1
2002 1 47 ALA HA 1 49 GLU H 4.000 . 5.000 4.707 4.676 4.757 . 0 0 "[ . 1 . 2 . 3]" 1
2003 1 51 LEU HA 1 53 ASN H 4.000 . 5.000 3.499 3.282 3.669 . 0 0 "[ . 1 . 2 . 3]" 1
2004 1 52 ILE HA 1 54 VAL H 4.000 . 5.000 3.785 3.670 4.002 . 0 0 "[ . 1 . 2 . 3]" 1
2005 1 58 SER HA 1 60 ILE H 4.000 . 5.000 3.690 3.198 4.074 . 0 0 "[ . 1 . 2 . 3]" 1
2006 1 60 ILE HA 1 62 LYS H 4.000 . 5.000 3.946 3.782 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
2007 1 61 GLU HA 1 63 THR H 4.000 . 5.000 4.327 4.256 4.403 . 0 0 "[ . 1 . 2 . 3]" 1
2008 1 67 LEU HA 1 69 GLY H 4.000 . 5.000 4.219 4.030 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
2009 1 69 GLY QA 1 71 CYS H 4.000 . 6.000 3.742 3.559 3.944 . 0 0 "[ . 1 . 2 . 3]" 1
2010 1 71 CYS HA 1 73 HIS H 4.000 . 5.000 3.633 3.254 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
2011 1 83 LEU HA 1 85 VAL H 4.000 . 5.000 3.704 3.241 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
2012 1 85 VAL HA 1 87 ASP H 4.000 . 5.000 4.664 4.223 4.908 . 0 0 "[ . 1 . 2 . 3]" 1
2013 1 91 GLU HA 1 93 ALA H 4.000 . 5.000 4.212 4.121 4.337 . 0 0 "[ . 1 . 2 . 3]" 1
2014 1 92 VAL HA 1 94 GLN H 4.000 . 5.000 4.243 4.151 4.388 . 0 0 "[ . 1 . 2 . 3]" 1
2015 1 94 GLN HA 1 96 VAL H 4.000 . 5.000 4.542 4.397 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
2016 1 96 VAL HA 1 98 ASP H 4.000 . 5.000 4.634 4.531 4.758 . 0 0 "[ . 1 . 2 . 3]" 1
2017 1 97 LYS HA 1 99 LEU H 4.000 . 5.000 4.378 4.279 4.477 . 0 0 "[ . 1 . 2 . 3]" 1
2018 1 98 ASP HA 1 100 LEU H 4.000 . 5.000 4.312 4.243 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
2019 1 102 HIS HA 1 104 LYS H 4.000 . 5.000 4.691 4.566 4.848 . 0 0 "[ . 1 . 2 . 3]" 1
2020 1 106 LEU HA 1 108 ARG H 4.000 . 5.000 4.180 4.048 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
2021 1 109 GLU HA 1 111 ARG H 4.000 . 5.000 4.128 3.893 4.404 . 0 0 "[ . 1 . 2 . 3]" 1
2022 1 6 PRO HA 1 9 ALA H 4.000 . 5.000 3.594 3.378 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
2023 1 8 THR HA 1 11 ARG H 4.000 . 5.000 3.488 3.271 3.642 . 0 0 "[ . 1 . 2 . 3]" 1
2024 1 9 ALA HA 1 12 GLU H 4.000 . 5.000 3.520 3.330 3.667 . 0 0 "[ . 1 . 2 . 3]" 1
2025 1 10 LEU HA 1 13 LEU H 4.000 . 5.000 3.388 3.252 3.643 . 0 0 "[ . 1 . 2 . 3]" 1
2026 1 11 ARG HA 1 14 ILE H 4.000 . 5.000 3.465 3.222 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
2027 1 12 GLU HA 1 15 GLU H 4.000 . 5.000 3.814 3.594 4.004 . 0 0 "[ . 1 . 2 . 3]" 1
2028 1 13 LEU HA 1 16 GLU H 4.000 . 5.000 3.603 3.466 3.798 . 0 0 "[ . 1 . 2 . 3]" 1
2029 1 14 ILE HA 1 17 LEU H 4.000 . 5.000 3.608 3.437 3.757 . 0 0 "[ . 1 . 2 . 3]" 1
2030 1 15 GLU HA 1 18 VAL H 4.000 . 5.000 3.761 3.619 3.880 . 0 0 "[ . 1 . 2 . 3]" 1
2031 1 16 GLU HA 1 19 ASN H 4.000 . 5.000 3.478 3.301 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
2032 1 17 LEU HA 1 20 ILE H 4.000 . 5.000 3.737 3.667 3.860 . 0 0 "[ . 1 . 2 . 3]" 1
2033 1 18 VAL HA 1 21 THR H 4.000 . 5.000 3.477 3.368 3.583 . 0 0 "[ . 1 . 2 . 3]" 1
2034 1 29 CYS HA 1 32 SER H 4.000 . 5.000 4.560 4.404 4.771 . 0 0 "[ . 1 . 2 . 3]" 1
2035 1 44 TYR HA 1 47 ALA H 4.000 . 5.000 3.820 3.683 3.948 . 0 0 "[ . 1 . 2 . 3]" 1
2036 1 45 CYS HA 1 48 LEU H 4.000 . 5.000 3.551 3.297 3.800 . 0 0 "[ . 1 . 2 . 3]" 1
2037 1 46 ALA HA 1 49 GLU H 4.000 . 5.000 3.740 3.629 3.821 . 0 0 "[ . 1 . 2 . 3]" 1
2038 1 48 LEU HA 1 51 LEU H 4.000 . 5.000 3.473 3.335 3.614 . 0 0 "[ . 1 . 2 . 3]" 1
2039 1 49 GLU HA 1 52 ILE H 4.000 . 5.000 3.238 3.142 3.358 . 0 0 "[ . 1 . 2 . 3]" 1
2040 1 60 ILE HA 1 63 THR H 4.000 . 5.000 2.937 2.819 3.030 . 0 0 "[ . 1 . 2 . 3]" 1
2041 1 63 THR HA 1 66 MET H 4.000 . 5.000 3.472 3.302 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
2042 1 64 GLN HA 1 67 LEU H 4.000 . 5.000 3.534 3.336 3.714 . 0 0 "[ . 1 . 2 . 3]" 1
2043 1 91 GLU HA 1 94 GLN H 4.000 . 5.000 4.700 4.532 4.906 . 0 0 "[ . 1 . 2 . 3]" 1
2044 1 93 ALA HA 1 96 VAL H 4.000 . 5.000 3.814 3.696 4.023 . 0 0 "[ . 1 . 2 . 3]" 1
2045 1 95 PHE HA 1 98 ASP H 4.000 . 5.000 3.741 3.652 3.905 . 0 0 "[ . 1 . 2 . 3]" 1
2046 1 96 VAL HA 1 99 LEU H 4.000 . 5.000 3.589 3.473 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
2047 1 98 ASP HA 1 101 LEU H 4.000 . 5.000 3.655 3.511 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
2048 1 102 HIS HA 1 105 LYS H 4.000 . 5.000 3.304 3.202 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
2049 1 106 LEU HA 1 109 GLU H 4.000 . 5.000 3.312 3.163 3.447 . 0 0 "[ . 1 . 2 . 3]" 1
2050 1 9 ALA HA 1 13 LEU H 4.000 . 5.000 4.025 3.948 4.125 . 0 0 "[ . 1 . 2 . 3]" 1
2051 1 11 ARG HA 1 15 GLU H 4.000 . 5.000 3.856 3.596 4.144 . 0 0 "[ . 1 . 2 . 3]" 1
2052 1 12 GLU HA 1 16 GLU H 4.000 . 5.000 4.183 3.927 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
2053 1 13 LEU HA 1 17 LEU H 4.000 . 5.000 3.970 3.838 4.163 . 0 0 "[ . 1 . 2 . 3]" 1
2054 1 14 ILE HA 1 18 VAL H 4.000 . 5.000 3.981 3.776 4.198 . 0 0 "[ . 1 . 2 . 3]" 1
2055 1 15 GLU HA 1 19 ASN H 4.000 . 5.000 4.111 3.906 4.314 . 0 0 "[ . 1 . 2 . 3]" 1
2056 1 16 GLU HA 1 20 ILE H 4.000 . 5.000 4.244 4.023 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
2057 1 17 LEU HA 1 21 THR H 4.000 . 5.000 4.611 4.334 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
2058 1 18 VAL HA 1 22 GLN H 4.000 . 5.000 4.079 3.887 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
2059 1 24 GLN HA 1 26 ALA H 4.000 . 5.000 4.751 3.488 4.972 . 0 0 "[ . 1 . 2 . 3]" 1
2060 1 45 CYS HA 1 49 GLU H 4.000 . 5.000 4.272 4.069 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
2061 1 58 SER HA 1 62 LYS H 4.000 . 5.000 4.916 4.172 5.208 0.208 11 0 "[ . 1 . 2 . 3]" 1
2062 1 64 GLN HA 1 68 SER H 4.000 . 5.000 4.155 3.905 4.359 . 0 0 "[ . 1 . 2 . 3]" 1
2063 1 94 GLN HA 1 98 ASP H 4.000 . 5.000 3.863 3.695 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
2064 1 96 VAL HA 1 100 LEU H 4.000 . 5.000 4.214 4.019 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
2065 1 106 LEU HA 1 110 GLY H 4.000 . 5.000 4.511 4.186 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
2066 1 7 SER HA 1 10 LEU HB2 4.000 . 5.000 3.645 3.119 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
2067 1 8 THR HA 1 11 ARG HB2 4.000 . 5.000 2.797 2.380 3.136 . 0 0 "[ . 1 . 2 . 3]" 1
2068 1 9 ALA HA 1 12 GLU HB3 4.000 . 5.000 4.175 3.992 4.326 . 0 0 "[ . 1 . 2 . 3]" 1
2069 1 9 ALA HA 1 12 GLU HB2 4.000 . 5.000 2.580 2.433 2.714 . 0 0 "[ . 1 . 2 . 3]" 1
2070 1 10 LEU HA 1 13 LEU QB 4.000 . 5.000 2.550 2.368 2.860 . 0 0 "[ . 1 . 2 . 3]" 1
2071 1 11 ARG HA 1 14 ILE HB 4.000 . 5.000 2.737 2.497 3.058 . 0 0 "[ . 1 . 2 . 3]" 1
2072 1 12 GLU HA 1 15 GLU QB 4.000 . 6.000 2.955 2.671 3.142 . 0 0 "[ . 1 . 2 . 3]" 1
2073 1 13 LEU HA 1 16 GLU HB3 4.000 . 5.000 3.025 2.821 3.247 . 0 0 "[ . 1 . 2 . 3]" 1
2074 1 13 LEU HA 1 16 GLU HB2 4.000 . 5.000 3.863 3.520 4.098 . 0 0 "[ . 1 . 2 . 3]" 1
2075 1 14 ILE HA 1 17 LEU HB3 4.000 . 5.000 4.472 4.207 4.672 . 0 0 "[ . 1 . 2 . 3]" 1
2076 1 15 GLU HA 1 18 VAL HB 4.000 . 5.000 2.936 2.663 3.141 . 0 0 "[ . 1 . 2 . 3]" 1
2077 1 16 GLU HA 1 19 ASN QB 3.000 . 4.300 2.666 2.368 2.825 . 0 0 "[ . 1 . 2 . 3]" 1
2078 1 17 LEU HA 1 20 ILE HB 5.000 3.000 6.000 5.158 5.061 5.383 . 0 0 "[ . 1 . 2 . 3]" 1
2079 1 18 VAL HA 1 21 THR HB 4.000 . 5.000 4.639 4.314 4.857 . 0 0 "[ . 1 . 2 . 3]" 1
2080 1 19 ASN HA 1 22 GLN QB 4.000 . 6.000 3.172 2.913 3.460 . 0 0 "[ . 1 . 2 . 3]" 1
2081 1 21 THR HA 1 24 GLN HB3 4.000 . 5.000 2.654 2.380 2.894 . 0 0 "[ . 1 . 2 . 3]" 1
2082 1 43 MET HA 1 46 ALA MB 4.000 . 6.500 2.624 2.360 2.887 . 0 0 "[ . 1 . 2 . 3]" 1
2083 1 44 TYR HA 1 47 ALA MB 4.000 . 6.500 2.685 2.453 2.922 . 0 0 "[ . 1 . 2 . 3]" 1
2084 1 45 CYS HA 1 48 LEU HB3 4.000 . 5.000 2.806 2.545 3.129 . 0 0 "[ . 1 . 2 . 3]" 1
2085 1 45 CYS HA 1 48 LEU HB2 4.000 . 5.000 3.461 3.091 3.823 . 0 0 "[ . 1 . 2 . 3]" 1
2086 1 46 ALA HA 1 49 GLU HB3 4.000 . 5.000 4.510 4.398 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
2087 1 47 ALA HA 1 50 SER HB3 4.000 . 5.000 3.870 2.897 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
2088 1 47 ALA HA 1 50 SER HB2 4.000 . 5.000 3.525 2.718 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
2089 1 48 LEU HA 1 51 LEU HB3 4.000 . 5.000 4.498 4.168 4.723 . 0 0 "[ . 1 . 2 . 3]" 1
2090 1 48 LEU HA 1 51 LEU HB2 4.000 . 5.000 2.867 2.517 3.142 . 0 0 "[ . 1 . 2 . 3]" 1
2091 1 61 GLU HA 1 64 GLN HB3 4.000 . 5.000 4.565 4.223 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
2092 1 61 GLU HA 1 64 GLN HB2 4.000 . 5.000 3.032 2.670 3.318 . 0 0 "[ . 1 . 2 . 3]" 1
2093 1 62 LYS HA 1 65 ARG QB 4.000 . 6.000 3.088 2.712 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
2094 1 63 THR HA 1 66 MET QB 4.000 . 6.000 2.741 2.291 2.949 . 0 0 "[ . 1 . 2 . 3]" 1
2095 1 64 GLN HA 1 67 LEU QB 4.000 . 5.000 2.676 2.419 2.891 . 0 0 "[ . 1 . 2 . 3]" 1
2096 1 92 VAL HA 1 95 PHE HB2 4.000 . 5.000 2.863 2.553 3.153 . 0 0 "[ . 1 . 2 . 3]" 1
2097 1 93 ALA HA 1 96 VAL HB 4.000 . 5.000 3.420 3.206 3.632 . 0 0 "[ . 1 . 2 . 3]" 1
2098 1 94 GLN HA 1 97 LYS QB 4.000 . 6.000 2.658 2.341 2.970 . 0 0 "[ . 1 . 2 . 3]" 1
2099 1 95 PHE HA 1 98 ASP HB3 4.000 . 5.000 4.572 4.273 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
2100 1 95 PHE HA 1 98 ASP HB2 4.000 . 5.000 2.952 2.700 3.161 . 0 0 "[ . 1 . 2 . 3]" 1
2101 1 96 VAL HA 1 99 LEU HB3 4.000 . 5.000 2.749 2.527 3.039 . 0 0 "[ . 1 . 2 . 3]" 1
2102 1 97 LYS HA 1 100 LEU HB3 4.000 . 5.000 2.689 2.521 2.887 . 0 0 "[ . 1 . 2 . 3]" 1
2103 1 97 LYS HA 1 100 LEU HB2 4.000 . 5.000 3.072 2.874 3.241 . 0 0 "[ . 1 . 2 . 3]" 1
2104 1 98 ASP HA 1 101 LEU HB2 4.000 . 5.000 3.551 3.354 3.924 . 0 0 "[ . 1 . 2 . 3]" 1
2105 1 99 LEU HA 1 102 HIS HB2 4.000 . 5.000 3.011 2.839 3.240 . 0 0 "[ . 1 . 2 . 3]" 1
2106 1 100 LEU HA 1 103 LEU HB3 4.000 . 5.000 4.332 4.205 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
2107 1 100 LEU HA 1 103 LEU HB2 4.000 . 5.000 2.737 2.609 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
2108 1 102 HIS HA 1 105 LYS HB3 4.000 . 5.000 2.514 2.328 3.878 . 0 0 "[ . 1 . 2 . 3]" 1
2109 1 102 HIS HA 1 105 LYS HB2 4.000 . 5.000 2.739 2.392 3.145 . 0 0 "[ . 1 . 2 . 3]" 1
2110 1 104 LYS HA 1 107 PHE HB2 4.000 . 5.000 3.062 2.811 3.366 . 0 0 "[ . 1 . 2 . 3]" 1
2111 1 105 LYS HA 1 108 ARG QB 4.000 . 6.000 3.596 2.892 4.022 . 0 0 "[ . 1 . 2 . 3]" 1
2112 1 106 LEU HA 1 109 GLU HB2 4.000 . 5.000 3.031 2.712 3.326 . 0 0 "[ . 1 . 2 . 3]" 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 54
_Distance_constraint_stats_list.Viol_count 290
_Distance_constraint_stats_list.Viol_total 504.364
_Distance_constraint_stats_list.Viol_max 0.225
_Distance_constraint_stats_list.Viol_rms 0.0287
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0104
_Distance_constraint_stats_list.Viol_average_violations_only 0.0580
_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 9 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 10 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 11 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 12 GLU 0.189 0.052 12 0 "[ . 1 . 2 . 3]"
1 13 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 16 GLU 0.329 0.068 26 0 "[ . 1 . 2 . 3]"
1 17 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 18 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 19 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 20 ILE 0.139 0.068 26 0 "[ . 1 . 2 . 3]"
1 32 SER 3.330 0.181 15 0 "[ . 1 . 2 . 3]"
1 33 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 34 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 36 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 44 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 45 CYS 0.347 0.056 20 0 "[ . 1 . 2 . 3]"
1 46 ALA 2.851 0.128 11 0 "[ . 1 . 2 . 3]"
1 47 ALA 0.024 0.018 21 0 "[ . 1 . 2 . 3]"
1 48 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 49 GLU 0.347 0.056 20 0 "[ . 1 . 2 . 3]"
1 50 SER 2.851 0.128 11 0 "[ . 1 . 2 . 3]"
1 51 LEU 0.024 0.018 21 0 "[ . 1 . 2 . 3]"
1 62 LYS 0.056 0.029 9 0 "[ . 1 . 2 . 3]"
1 63 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 66 MET 0.056 0.029 9 0 "[ . 1 . 2 . 3]"
1 67 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 89 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 90 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 91 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 92 VAL 3.330 0.181 15 0 "[ . 1 . 2 . 3]"
1 93 ALA 2.533 0.102 10 0 "[ . 1 . 2 . 3]"
1 94 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 95 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 96 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 97 LYS 8.112 0.225 17 0 "[ . 1 . 2 . 3]"
1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 99 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 100 LEU 1.763 0.118 1 0 "[ . 1 . 2 . 3]"
1 101 LEU 5.579 0.225 17 0 "[ . 1 . 2 . 3]"
1 103 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 104 LYS 1.763 0.118 1 0 "[ . 1 . 2 . 3]"
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 9 ALA O 1 13 LEU H 1.800 . 2.300 1.904 1.791 2.083 . 0 0 "[ . 1 . 2 . 3]" 2
2 1 9 ALA O 1 13 LEU N 2.800 2.400 3.300 2.813 2.711 2.977 . 0 0 "[ . 1 . 2 . 3]" 2
3 1 10 LEU O 1 14 ILE H 1.800 . 2.300 1.796 1.658 2.074 . 0 0 "[ . 1 . 2 . 3]" 2
4 1 10 LEU O 1 14 ILE N 2.800 2.400 3.300 2.763 2.632 3.027 . 0 0 "[ . 1 . 2 . 3]" 2
5 1 11 ARG O 1 15 GLU H 1.800 . 2.300 2.014 1.852 2.143 . 0 0 "[ . 1 . 2 . 3]" 2
6 1 11 ARG O 1 15 GLU N 2.800 2.400 3.300 2.984 2.828 3.117 . 0 0 "[ . 1 . 2 . 3]" 2
7 1 12 GLU O 1 16 GLU H 1.800 . 2.300 2.246 2.017 2.352 0.052 12 0 "[ . 1 . 2 . 3]" 2
8 1 12 GLU O 1 16 GLU N 2.800 2.400 3.300 3.166 2.942 3.281 . 0 0 "[ . 1 . 2 . 3]" 2
9 1 13 LEU O 1 17 LEU H 1.800 . 2.300 1.965 1.857 2.089 . 0 0 "[ . 1 . 2 . 3]" 2
10 1 13 LEU O 1 17 LEU N 2.800 2.400 3.300 2.929 2.820 3.037 . 0 0 "[ . 1 . 2 . 3]" 2
11 1 14 ILE O 1 18 VAL H 1.800 . 2.300 2.029 1.875 2.170 . 0 0 "[ . 1 . 2 . 3]" 2
12 1 14 ILE O 1 18 VAL N 2.800 2.400 3.300 2.988 2.828 3.119 . 0 0 "[ . 1 . 2 . 3]" 2
13 1 15 GLU O 1 19 ASN H 1.800 . 2.300 2.147 2.009 2.267 . 0 0 "[ . 1 . 2 . 3]" 2
14 1 15 GLU O 1 19 ASN N 2.800 2.400 3.300 3.071 2.917 3.185 . 0 0 "[ . 1 . 2 . 3]" 2
15 1 16 GLU O 1 20 ILE H 1.800 . 2.300 2.244 2.044 2.368 0.068 26 0 "[ . 1 . 2 . 3]" 2
16 1 16 GLU O 1 20 ILE N 2.800 2.400 3.300 3.192 3.010 3.304 0.004 26 0 "[ . 1 . 2 . 3]" 2
17 1 44 TYR O 1 48 LEU H 1.800 . 2.300 2.009 1.859 2.208 . 0 0 "[ . 1 . 2 . 3]" 2
18 1 44 TYR O 1 48 LEU N 2.800 2.400 3.300 2.894 2.757 3.092 . 0 0 "[ . 1 . 2 . 3]" 2
19 1 45 CYS O 1 49 GLU H 1.800 . 2.300 2.227 2.084 2.356 0.056 20 0 "[ . 1 . 2 . 3]" 2
20 1 45 CYS O 1 49 GLU N 2.800 2.400 3.300 3.193 3.055 3.318 0.018 10 0 "[ . 1 . 2 . 3]" 2
21 1 46 ALA O 1 50 SER H 1.800 . 2.300 2.373 2.321 2.428 0.128 11 0 "[ . 1 . 2 . 3]" 2
22 1 46 ALA O 1 50 SER N 2.800 2.400 3.300 3.318 3.263 3.383 0.083 11 0 "[ . 1 . 2 . 3]" 2
23 1 47 ALA O 1 51 LEU H 1.800 . 2.300 2.176 1.950 2.318 0.018 21 0 "[ . 1 . 2 . 3]" 2
24 1 47 ALA O 1 51 LEU N 2.800 2.400 3.300 3.095 2.885 3.230 . 0 0 "[ . 1 . 2 . 3]" 2
25 1 62 LYS O 1 66 MET H 1.800 . 2.300 2.160 1.961 2.329 0.029 9 0 "[ . 1 . 2 . 3]" 2
26 1 62 LYS O 1 66 MET N 2.800 2.400 3.300 3.125 2.937 3.285 . 0 0 "[ . 1 . 2 . 3]" 2
27 1 63 THR O 1 67 LEU H 1.800 . 2.300 1.929 1.789 2.085 . 0 0 "[ . 1 . 2 . 3]" 2
28 1 63 THR O 1 67 LEU N 2.800 2.400 3.300 2.877 2.686 3.030 . 0 0 "[ . 1 . 2 . 3]" 2
29 1 92 VAL O 1 96 VAL H 1.800 . 2.300 1.932 1.836 2.026 . 0 0 "[ . 1 . 2 . 3]" 2
30 1 92 VAL O 1 96 VAL N 2.800 2.400 3.300 2.900 2.811 2.984 . 0 0 "[ . 1 . 2 . 3]" 2
31 1 93 ALA O 1 97 LYS H 1.800 . 2.300 2.361 2.320 2.402 0.102 10 0 "[ . 1 . 2 . 3]" 2
32 1 93 ALA O 1 97 LYS N 2.800 2.400 3.300 3.323 3.284 3.377 0.077 29 0 "[ . 1 . 2 . 3]" 2
33 1 94 GLN O 1 98 ASP H 1.800 . 2.300 1.916 1.789 2.081 . 0 0 "[ . 1 . 2 . 3]" 2
34 1 94 GLN O 1 98 ASP N 2.800 2.400 3.300 2.880 2.732 3.053 . 0 0 "[ . 1 . 2 . 3]" 2
35 1 95 PHE O 1 99 LEU H 1.800 . 2.300 2.092 1.992 2.199 . 0 0 "[ . 1 . 2 . 3]" 2
36 1 95 PHE O 1 99 LEU N 2.800 2.400 3.300 3.025 2.934 3.130 . 0 0 "[ . 1 . 2 . 3]" 2
37 1 96 VAL O 1 100 LEU H 1.800 . 2.300 1.995 1.845 2.145 . 0 0 "[ . 1 . 2 . 3]" 2
38 1 96 VAL O 1 100 LEU N 2.800 2.400 3.300 2.883 2.716 3.038 . 0 0 "[ . 1 . 2 . 3]" 2
39 1 97 LYS O 1 101 LEU H 1.800 . 2.300 2.436 2.397 2.525 0.225 17 0 "[ . 1 . 2 . 3]" 2
40 1 97 LYS O 1 101 LEU N 2.800 2.400 3.300 3.350 3.312 3.419 0.119 17 0 "[ . 1 . 2 . 3]" 2
41 1 99 LEU O 1 103 LEU H 1.800 . 2.300 1.975 1.898 2.072 . 0 0 "[ . 1 . 2 . 3]" 2
42 1 99 LEU O 1 103 LEU N 2.800 2.400 3.300 2.926 2.849 3.015 . 0 0 "[ . 1 . 2 . 3]" 2
43 1 100 LEU O 1 104 LYS H 1.800 . 2.300 2.329 2.231 2.418 0.118 1 0 "[ . 1 . 2 . 3]" 2
44 1 100 LEU O 1 104 LYS N 2.800 2.400 3.300 3.305 3.210 3.381 0.081 1 0 "[ . 1 . 2 . 3]" 2
45 1 36 SER H 1 89 LYS HA 4.000 . 5.000 2.933 2.717 3.203 . 0 0 "[ . 1 . 2 . 3]" 2
46 1 33 MET HA 1 90 ILE H 4.000 . 5.000 4.387 4.230 4.535 . 0 0 "[ . 1 . 2 . 3]" 2
47 1 33 MET HA 1 91 GLU HA 2.500 . 2.700 2.499 2.331 2.689 . 0 0 "[ . 1 . 2 . 3]" 2
48 1 34 VAL H 1 91 GLU HA 4.000 . 5.000 3.932 3.783 4.082 . 0 0 "[ . 1 . 2 . 3]" 2
49 1 34 VAL H 1 90 ILE O 1.800 . 2.300 1.843 1.683 1.980 . 0 0 "[ . 1 . 2 . 3]" 2
50 1 34 VAL N 1 90 ILE O 2.800 2.400 3.300 2.786 2.633 2.932 . 0 0 "[ . 1 . 2 . 3]" 2
51 1 34 VAL O 1 90 ILE H 1.800 . 2.300 1.818 1.704 1.905 . 0 0 "[ . 1 . 2 . 3]" 2
52 1 34 VAL O 1 90 ILE N 2.800 2.400 3.300 2.766 2.654 2.868 . 0 0 "[ . 1 . 2 . 3]" 2
53 1 32 SER O 1 92 VAL H 1.800 . 2.300 2.399 2.311 2.481 0.181 15 0 "[ . 1 . 2 . 3]" 2
54 1 32 SER O 1 92 VAL N 2.800 2.400 3.300 3.300 3.208 3.384 0.084 15 0 "[ . 1 . 2 . 3]" 2
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