NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
424823 |
2g7h   |
7122 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2g7h
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 959
_Distance_constraint_stats_list.Viol_count 1205
_Distance_constraint_stats_list.Viol_total 419.482
_Distance_constraint_stats_list.Viol_max 0.217
_Distance_constraint_stats_list.Viol_rms 0.0171
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0044
_Distance_constraint_stats_list.Viol_average_violations_only 0.0348
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.014 0.007 3 0 "[ . 1]"
1 2 ILE 1.289 0.150 6 0 "[ . 1]"
1 3 ILE 1.275 0.150 6 0 "[ . 1]"
1 4 GLN 0.061 0.037 3 0 "[ . 1]"
1 5 ILE 0.076 0.014 2 0 "[ . 1]"
1 6 GLU 0.222 0.041 10 0 "[ . 1]"
1 7 GLU 0.222 0.041 10 0 "[ . 1]"
1 8 TYR 0.167 0.038 3 0 "[ . 1]"
1 9 PHE 0.699 0.107 9 0 "[ . 1]"
1 10 ILE 0.563 0.041 8 0 "[ . 1]"
1 11 GLY 0.820 0.142 3 0 "[ . 1]"
1 12 MET 0.046 0.033 5 0 "[ . 1]"
1 13 ILE 0.270 0.038 4 0 "[ . 1]"
1 14 PHE 1.313 0.084 1 0 "[ . 1]"
1 15 LYS 0.031 0.010 4 0 "[ . 1]"
1 16 GLY 0.000 0.000 . 0 "[ . 1]"
1 17 ASN 0.006 0.006 9 0 "[ . 1]"
1 18 GLN 0.330 0.062 8 0 "[ . 1]"
1 19 LEU 0.988 0.098 9 0 "[ . 1]"
1 20 VAL 3.476 0.118 5 0 "[ . 1]"
1 21 ARG 0.964 0.111 8 0 "[ . 1]"
1 22 ASN 0.892 0.118 5 0 "[ . 1]"
1 23 THR 1.437 0.152 9 0 "[ . 1]"
1 25 PRO 0.368 0.062 9 0 "[ . 1]"
1 26 LEU 1.110 0.117 5 0 "[ . 1]"
1 27 ARG 0.672 0.117 5 0 "[ . 1]"
1 28 ARG 0.880 0.113 3 0 "[ . 1]"
1 29 GLU 0.236 0.113 3 0 "[ . 1]"
1 30 GLU 0.109 0.048 4 0 "[ . 1]"
1 31 ILE 0.302 0.049 10 0 "[ . 1]"
1 32 PHE 0.678 0.217 10 0 "[ . 1]"
1 33 ASN 0.208 0.097 2 0 "[ . 1]"
1 34 PHE 0.398 0.217 10 0 "[ . 1]"
1 35 MET 0.329 0.041 5 0 "[ . 1]"
1 36 ASP 0.177 0.041 5 0 "[ . 1]"
1 37 GLY 0.155 0.041 6 0 "[ . 1]"
1 38 GLU 0.425 0.045 1 0 "[ . 1]"
1 39 VAL 0.106 0.046 4 0 "[ . 1]"
1 40 VAL 0.882 0.118 2 0 "[ . 1]"
1 41 SER 0.802 0.118 2 0 "[ . 1]"
1 42 ASN 0.496 0.082 9 0 "[ . 1]"
1 43 PRO 1.224 0.131 8 0 "[ . 1]"
1 44 GLU 1.262 0.131 8 0 "[ . 1]"
1 45 ASP 0.359 0.077 7 0 "[ . 1]"
1 46 GLU 0.319 0.077 7 0 "[ . 1]"
1 47 HIS 0.000 0.000 . 0 "[ . 1]"
1 48 LEU 0.136 0.033 5 0 "[ . 1]"
1 49 LYS 0.401 0.075 4 0 "[ . 1]"
1 50 VAL 0.833 0.085 2 0 "[ . 1]"
1 51 ALA 0.399 0.085 2 0 "[ . 1]"
1 52 GLU 0.201 0.040 1 0 "[ . 1]"
1 53 ILE 0.200 0.031 9 0 "[ . 1]"
1 54 ILE 0.198 0.031 9 0 "[ . 1]"
1 55 LEU 0.294 0.040 1 0 "[ . 1]"
1 56 LYS 0.016 0.008 9 0 "[ . 1]"
1 57 LEU 0.384 0.071 7 0 "[ . 1]"
1 58 TYR 0.034 0.009 10 0 "[ . 1]"
1 59 PHE 0.010 0.004 3 0 "[ . 1]"
1 60 ALA 0.136 0.046 5 0 "[ . 1]"
1 61 GLU 0.348 0.108 7 0 "[ . 1]"
1 62 ILE 0.625 0.119 5 0 "[ . 1]"
1 63 ASP 0.507 0.112 4 0 "[ . 1]"
1 64 ASP 0.485 0.112 4 0 "[ . 1]"
1 65 LYS 0.099 0.032 5 0 "[ . 1]"
1 66 LYS 1.068 0.126 3 0 "[ . 1]"
1 67 VAL 0.937 0.126 3 0 "[ . 1]"
1 68 ARG 0.000 0.000 . 0 "[ . 1]"
1 69 GLU 0.373 0.067 5 0 "[ . 1]"
1 70 LEU 0.596 0.067 5 0 "[ . 1]"
1 71 ILE 2.850 0.178 2 0 "[ . 1]"
1 72 SER 1.254 0.147 8 0 "[ . 1]"
1 73 TYR 1.055 0.099 3 0 "[ . 1]"
1 74 LYS 0.112 0.090 3 0 "[ . 1]"
1 75 LEU 0.019 0.019 1 0 "[ . 1]"
1 76 GLU 0.618 0.102 6 0 "[ . 1]"
1 77 VAL 1.192 0.154 2 0 "[ . 1]"
1 78 PRO 0.042 0.037 10 0 "[ . 1]"
1 79 GLU 0.136 0.037 10 0 "[ . 1]"
1 80 PHE 0.094 0.025 6 0 "[ . 1]"
1 81 THR 0.185 0.051 9 0 "[ . 1]"
1 82 LYS 0.468 0.054 8 0 "[ . 1]"
1 83 LYS 0.521 0.068 10 0 "[ . 1]"
1 84 VAL 3.687 0.166 10 0 "[ . 1]"
1 85 LEU 0.559 0.080 6 0 "[ . 1]"
1 86 ASP 0.180 0.033 6 0 "[ . 1]"
1 87 ILE 1.473 0.085 7 0 "[ . 1]"
1 88 VAL 0.276 0.070 1 0 "[ . 1]"
1 89 LYS 0.262 0.061 2 0 "[ . 1]"
1 90 ASP 1.400 0.124 2 0 "[ . 1]"
1 91 ILE 1.076 0.143 3 0 "[ . 1]"
1 92 GLU 0.039 0.019 10 0 "[ . 1]"
1 93 PHE 0.046 0.014 6 0 "[ . 1]"
1 94 GLY 0.000 0.000 . 0 "[ . 1]"
1 95 LYS 1.137 0.121 4 0 "[ . 1]"
1 96 THR 0.382 0.038 5 0 "[ . 1]"
1 97 LEU 0.782 0.091 3 0 "[ . 1]"
1 98 THR 0.905 0.135 5 0 "[ . 1]"
1 99 TYR 0.158 0.052 8 0 "[ . 1]"
1 100 GLY 0.000 0.000 . 0 "[ . 1]"
1 101 ASP 0.000 0.000 3 0 "[ . 1]"
1 102 ILE 1.626 0.099 6 0 "[ . 1]"
1 103 ALA 1.578 0.099 6 0 "[ . 1]"
1 104 LYS 0.525 0.065 7 0 "[ . 1]"
1 105 LYS 0.076 0.046 7 0 "[ . 1]"
1 106 LEU 1.431 0.104 7 0 "[ . 1]"
1 107 ASN 0.703 0.104 7 0 "[ . 1]"
1 108 THR 0.448 0.086 5 0 "[ . 1]"
1 109 SER 0.142 0.073 9 0 "[ . 1]"
1 110 PRO 0.374 0.087 8 0 "[ . 1]"
1 111 ARG 0.000 0.000 . 0 "[ . 1]"
1 112 ALA 0.054 0.016 7 0 "[ . 1]"
1 113 VAL 0.382 0.065 4 0 "[ . 1]"
1 114 GLY 0.000 0.000 . 0 "[ . 1]"
1 115 MET 0.042 0.016 7 0 "[ . 1]"
1 116 ALA 0.362 0.065 4 0 "[ . 1]"
1 117 LEU 0.410 0.060 5 0 "[ . 1]"
1 118 LYS 0.026 0.013 6 0 "[ . 1]"
1 119 ARG 0.153 0.100 9 0 "[ . 1]"
1 120 ASN 0.141 0.100 9 0 "[ . 1]"
1 121 PRO 0.162 0.041 6 0 "[ . 1]"
1 122 LEU 0.749 0.099 3 0 "[ . 1]"
1 123 PRO 0.014 0.014 6 0 "[ . 1]"
1 124 LEU 0.415 0.092 8 0 "[ . 1]"
1 125 ILE 1.156 0.152 9 0 "[ . 1]"
1 126 ILE 0.127 0.026 6 0 "[ . 1]"
1 127 PRO 0.000 0.000 . 0 "[ . 1]"
1 128 CYS 0.722 0.085 7 0 "[ . 1]"
1 129 HIS 0.078 0.036 8 0 "[ . 1]"
1 130 ARG 0.029 0.008 6 0 "[ . 1]"
1 131 VAL 2.153 0.135 5 0 "[ . 1]"
1 132 VAL 0.254 0.038 5 0 "[ . 1]"
1 133 ALA 0.115 0.059 9 0 "[ . 1]"
1 134 LYS 0.197 0.059 9 0 "[ . 1]"
1 135 ASN 1.004 0.122 5 0 "[ . 1]"
1 136 SER 1.052 0.122 5 0 "[ . 1]"
1 137 LEU 0.180 0.081 3 0 "[ . 1]"
1 138 GLY 0.037 0.012 9 0 "[ . 1]"
1 139 GLY 0.005 0.005 5 0 "[ . 1]"
1 141 SER 0.026 0.013 6 0 "[ . 1]"
1 142 TYR 0.259 0.042 6 0 "[ . 1]"
1 143 GLY 0.276 0.076 6 0 "[ . 1]"
1 144 LEU 0.248 0.076 6 0 "[ . 1]"
1 145 ASP 0.120 0.023 1 0 "[ . 1]"
1 146 LYS 0.151 0.033 10 0 "[ . 1]"
1 147 LYS 0.027 0.013 4 0 "[ . 1]"
1 148 LYS 0.036 0.010 1 0 "[ . 1]"
1 149 PHE 0.180 0.033 10 0 "[ . 1]"
1 150 ILE 0.055 0.009 10 0 "[ . 1]"
1 151 LEU 0.021 0.007 3 0 "[ . 1]"
1 152 GLU 0.036 0.010 1 0 "[ . 1]"
1 153 ARG 0.028 0.015 7 0 "[ . 1]"
1 154 GLU 0.111 0.046 5 0 "[ . 1]"
1 155 ARG 0.002 0.002 8 0 "[ . 1]"
1 156 LEU 0.016 0.015 7 0 "[ . 1]"
1 157 ASN 0.010 0.008 7 0 "[ . 1]"
1 158 MET 0.002 0.002 8 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 ILE H 3.560 . 3.560 2.879 2.150 3.567 0.007 3 0 "[ . 1]" 1
2 1 1 MET QB 1 2 ILE H 5.000 . 5.000 3.097 2.371 3.819 . 0 0 "[ . 1]" 1
3 1 2 ILE H 1 2 ILE HB 3.400 . 3.400 2.603 2.393 2.907 . 0 0 "[ . 1]" 1
4 1 2 ILE H 1 40 VAL QG 5.000 . 5.000 3.216 1.957 4.784 . 0 0 "[ . 1]" 1
5 1 2 ILE HA 1 3 ILE H 3.400 2.400 3.400 2.308 2.250 2.382 0.150 6 0 "[ . 1]" 1
6 1 2 ILE HA 1 12 MET H 5.000 . 5.000 3.393 2.548 4.250 . 0 0 "[ . 1]" 1
7 1 2 ILE HB 1 39 VAL HA 5.000 . 5.000 3.983 2.195 5.046 0.046 4 0 "[ . 1]" 1
8 1 2 ILE HB 1 40 VAL H 5.000 2.400 5.000 3.770 3.478 4.181 . 0 0 "[ . 1]" 1
9 1 2 ILE MG 1 40 VAL H 5.000 2.400 5.000 4.961 4.675 5.037 0.037 4 0 "[ . 1]" 1
10 1 2 ILE MG 1 3 ILE H 3.400 . 3.400 2.297 1.886 3.218 . 0 0 "[ . 1]" 1
11 1 2 ILE MG 1 9 PHE QD 5.000 . 5.000 3.347 2.569 4.457 . 0 0 "[ . 1]" 1
12 1 2 ILE MG 1 10 ILE H 5.000 . 5.000 4.346 3.250 4.951 . 0 0 "[ . 1]" 1
13 1 2 ILE MD 1 32 PHE QD 5.000 . 5.000 4.142 2.591 5.046 0.046 10 0 "[ . 1]" 1
14 1 2 ILE MG 1 9 PHE QB 5.000 . 5.000 3.527 2.789 4.671 . 0 0 "[ . 1]" 1
15 1 2 ILE MD 1 35 MET QG 5.000 . 5.000 3.072 1.850 5.021 0.021 7 0 "[ . 1]" 1
16 1 2 ILE MD 1 37 GLY H 5.000 . 5.000 4.847 4.035 5.018 0.018 3 0 "[ . 1]" 1
17 1 3 ILE H 1 3 ILE HB 3.750 . 3.750 3.350 2.623 3.842 0.092 4 0 "[ . 1]" 1
18 1 3 ILE H 1 3 ILE QG 5.000 . 5.000 2.869 2.076 4.256 . 0 0 "[ . 1]" 1
19 1 3 ILE H 1 10 ILE H 5.000 . 5.000 3.465 2.610 4.165 . 0 0 "[ . 1]" 1
20 1 3 ILE HA 1 4 GLN H 2.800 . 2.800 2.199 2.143 2.338 . 0 0 "[ . 1]" 1
21 1 3 ILE MG 1 4 GLN H 3.870 . 3.870 3.263 1.967 3.907 0.037 3 0 "[ . 1]" 1
22 1 3 ILE MD 1 4 GLN H 4.660 . 4.660 3.803 2.526 4.669 0.009 8 0 "[ . 1]" 1
23 1 3 ILE QG 1 10 ILE HB 5.000 . 5.000 3.500 2.024 4.639 . 0 0 "[ . 1]" 1
24 1 4 GLN H 1 4 GLN QB 3.460 . 3.460 2.783 2.538 3.170 . 0 0 "[ . 1]" 1
25 1 4 GLN HA 1 5 ILE H 3.400 . 3.400 2.275 2.192 2.504 . 0 0 "[ . 1]" 1
26 1 4 GLN HA 1 9 PHE HA 5.000 . 5.000 2.303 1.860 2.682 . 0 0 "[ . 1]" 1
27 1 4 GLN HA 1 10 ILE H 5.000 . 5.000 3.466 2.659 4.126 . 0 0 "[ . 1]" 1
28 1 4 GLN QB 1 5 ILE H 5.000 . 5.000 3.128 2.518 3.988 . 0 0 "[ . 1]" 1
29 1 4 GLN QB 1 9 PHE QD 5.000 . 5.000 3.232 2.686 4.472 . 0 0 "[ . 1]" 1
30 1 5 ILE H 1 5 ILE HB 3.990 . 3.990 2.940 2.607 3.067 . 0 0 "[ . 1]" 1
31 1 5 ILE H 1 5 ILE MG 4.270 . 4.270 3.961 3.794 4.018 . 0 0 "[ . 1]" 1
32 1 5 ILE H 1 5 ILE MD 4.600 . 4.600 4.190 3.351 4.440 . 0 0 "[ . 1]" 1
33 1 5 ILE H 1 8 TYR H 5.000 . 5.000 3.778 2.954 4.229 . 0 0 "[ . 1]" 1
34 1 5 ILE H 1 9 PHE HA 5.000 . 5.000 3.220 2.331 3.805 . 0 0 "[ . 1]" 1
35 1 5 ILE HA 1 5 ILE MD 5.000 . 5.000 3.852 3.804 3.928 . 0 0 "[ . 1]" 1
36 1 5 ILE HA 1 6 GLU H 2.800 . 2.800 2.161 2.131 2.253 . 0 0 "[ . 1]" 1
37 1 5 ILE HA 1 8 TYR QE 5.000 . 5.000 4.974 4.874 5.014 0.014 2 0 "[ . 1]" 1
38 1 5 ILE MG 1 6 GLU H 5.000 . 5.000 2.866 2.321 3.486 . 0 0 "[ . 1]" 1
39 1 5 ILE MG 1 8 TYR H 5.000 . 5.000 4.573 4.322 4.932 . 0 0 "[ . 1]" 1
40 1 5 ILE MG 1 8 TYR QD 5.000 . 5.000 4.073 3.685 4.586 . 0 0 "[ . 1]" 1
41 1 5 ILE MD 1 8 TYR QE 4.350 . 4.350 2.308 1.934 2.836 . 0 0 "[ . 1]" 1
42 1 5 ILE MD 1 8 TYR QD 5.000 . 5.000 3.903 3.436 4.340 . 0 0 "[ . 1]" 1
43 1 5 ILE MD 1 51 ALA MB 5.000 . 5.000 1.994 1.841 2.236 . 0 0 "[ . 1]" 1
44 1 5 ILE MD 1 52 GLU H 5.000 . 5.000 4.882 4.574 5.011 0.011 6 0 "[ . 1]" 1
45 1 6 GLU HA 1 7 GLU H 3.500 . 3.500 3.522 3.513 3.541 0.041 10 0 "[ . 1]" 1
46 1 6 GLU H 1 6 GLU HA 2.800 . 2.800 2.270 2.267 2.273 . 0 0 "[ . 1]" 1
47 1 6 GLU H 1 6 GLU QG 4.650 . 4.650 3.397 2.735 4.235 . 0 0 "[ . 1]" 1
48 1 6 GLU QB 1 7 GLU H 2.800 . 2.800 1.934 1.900 2.011 . 0 0 "[ . 1]" 1
49 1 6 GLU QB 1 8 TYR H 5.000 . 5.000 3.379 3.165 3.753 . 0 0 "[ . 1]" 1
50 1 6 GLU QB 1 8 TYR QD 5.000 . 5.000 3.171 2.672 3.886 . 0 0 "[ . 1]" 1
51 1 7 GLU H 1 7 GLU QB 3.400 . 3.400 2.707 2.460 3.108 . 0 0 "[ . 1]" 1
52 1 7 GLU QB 1 8 TYR H 5.000 . 5.000 3.468 2.985 3.782 . 0 0 "[ . 1]" 1
53 1 7 GLU HA 1 8 TYR H 3.500 2.100 3.500 3.269 2.929 3.473 . 0 0 "[ . 1]" 1
54 1 8 TYR H 1 8 TYR QB 3.620 . 3.620 2.911 2.679 3.247 . 0 0 "[ . 1]" 1
55 1 8 TYR H 1 8 TYR QD 3.400 . 3.400 2.434 1.976 3.239 . 0 0 "[ . 1]" 1
56 1 8 TYR HA 1 9 PHE H 2.800 . 2.800 2.168 2.134 2.201 . 0 0 "[ . 1]" 1
57 1 8 TYR QB 1 26 LEU H 5.000 . 5.000 3.083 2.512 4.469 . 0 0 "[ . 1]" 1
58 1 8 TYR QD 1 9 PHE H 5.000 . 5.000 4.398 3.923 4.694 . 0 0 "[ . 1]" 1
59 1 8 TYR QE 1 55 LEU MD1 5.000 . 5.000 2.332 1.934 2.686 . 0 0 "[ . 1]" 1
60 1 8 TYR QE 1 54 ILE MD 5.000 . 5.000 4.400 2.997 5.003 0.003 4 0 "[ . 1]" 1
61 1 8 TYR QD 1 55 LEU MD1 5.000 . 5.000 3.475 3.058 3.839 . 0 0 "[ . 1]" 1
62 1 8 TYR QD 1 55 LEU MD2 5.000 . 5.000 4.890 4.635 5.030 0.030 6 0 "[ . 1]" 1
63 1 8 TYR QE 1 10 ILE HB 5.000 . 5.000 4.792 3.974 5.038 0.038 3 0 "[ . 1]" 1
64 1 9 PHE H 1 26 LEU HG 5.000 . 5.000 4.752 4.439 5.095 0.095 5 0 "[ . 1]" 1
65 1 9 PHE H 1 9 PHE QB 3.710 . 3.710 2.390 2.129 2.944 . 0 0 "[ . 1]" 1
66 1 9 PHE H 1 9 PHE QD 3.400 . 3.400 2.822 2.536 3.283 . 0 0 "[ . 1]" 1
67 1 9 PHE H 1 26 LEU H 3.400 . 3.400 3.170 2.808 3.481 0.081 9 0 "[ . 1]" 1
68 1 9 PHE HA 1 10 ILE H 2.800 . 2.800 2.254 2.163 2.449 . 0 0 "[ . 1]" 1
69 1 9 PHE QB 1 31 ILE MG 5.000 . 5.000 4.080 2.948 5.031 0.031 3 0 "[ . 1]" 1
70 1 9 PHE QD 1 31 ILE MG 5.000 . 5.000 2.908 1.883 3.861 . 0 0 "[ . 1]" 1
71 1 9 PHE HZ 1 28 ARG HA 5.000 . 5.000 3.872 2.365 5.107 0.107 9 0 "[ . 1]" 1
72 1 9 PHE HZ 1 31 ILE MG 5.000 . 5.000 4.076 2.694 5.002 0.002 8 0 "[ . 1]" 1
73 1 9 PHE QD 1 28 ARG QB 5.000 . 5.000 4.651 3.606 5.050 0.050 6 0 "[ . 1]" 1
74 1 10 ILE H 1 10 ILE HA 5.000 2.800 5.000 2.910 2.881 2.942 . 0 0 "[ . 1]" 1
75 1 10 ILE H 1 10 ILE HB 4.000 . 4.000 2.436 2.166 2.735 . 0 0 "[ . 1]" 1
76 1 10 ILE H 1 10 ILE QG 5.000 . 5.000 3.454 2.536 4.019 . 0 0 "[ . 1]" 1
77 1 10 ILE HA 1 11 GLY H 3.360 . 3.360 2.124 2.099 2.147 . 0 0 "[ . 1]" 1
78 1 10 ILE MG 1 11 GLY H 4.200 . 4.200 2.897 2.217 3.327 . 0 0 "[ . 1]" 1
79 1 10 ILE MG 1 23 THR H 5.000 . 5.000 4.100 2.895 5.005 0.005 9 0 "[ . 1]" 1
80 1 10 ILE QG 1 23 THR MG 5.000 . 5.000 4.917 4.552 5.041 0.041 8 0 "[ . 1]" 1
81 1 10 ILE MG 1 51 ALA HA 4.800 . 4.800 4.649 4.422 4.806 0.006 3 0 "[ . 1]" 1
82 1 10 ILE QG 1 11 GLY H 4.400 . 4.400 3.665 2.710 4.091 . 0 0 "[ . 1]" 1
83 1 10 ILE QG 1 25 PRO HA 5.000 . 5.000 4.344 3.480 5.019 0.019 1 0 "[ . 1]" 1
84 1 10 ILE MD 1 51 ALA HA 5.000 . 5.000 3.438 2.738 4.387 . 0 0 "[ . 1]" 1
85 1 10 ILE MD 1 25 PRO QB 5.000 . 5.000 4.890 3.781 5.034 0.034 3 0 "[ . 1]" 1
86 1 10 ILE MD 1 50 VAL QG 5.000 . 5.000 4.324 3.422 5.008 0.008 2 0 "[ . 1]" 1
87 1 10 ILE MD 1 55 LEU H 5.000 . 5.000 4.834 4.164 5.032 0.032 7 0 "[ . 1]" 1
88 1 11 GLY QA 1 12 MET H 3.400 . 3.400 2.386 2.216 2.524 . 0 0 "[ . 1]" 1
89 1 11 GLY H 1 23 THR MG 5.000 . 5.000 4.610 4.239 4.917 . 0 0 "[ . 1]" 1
90 1 11 GLY QA 1 23 THR MG 5.000 . 5.000 5.065 4.826 5.142 0.142 3 0 "[ . 1]" 1
91 1 12 MET H 1 12 MET QB 3.810 . 3.810 2.397 2.134 2.853 . 0 0 "[ . 1]" 1
92 1 12 MET HA 1 22 ASN HA 5.000 . 5.000 2.117 1.889 2.569 . 0 0 "[ . 1]" 1
93 1 12 MET HA 1 13 ILE H 3.400 . 3.400 2.153 2.107 2.210 . 0 0 "[ . 1]" 1
94 1 12 MET QB 1 13 ILE H 5.000 . 5.000 3.686 3.477 3.960 . 0 0 "[ . 1]" 1
95 1 12 MET QB 1 50 VAL QG 5.000 . 5.000 4.022 3.243 4.973 . 0 0 "[ . 1]" 1
96 1 12 MET QB 1 14 PHE QD 5.000 . 5.000 4.530 3.958 5.033 0.033 5 0 "[ . 1]" 1
97 1 13 ILE H 1 13 ILE MG 4.370 . 4.370 2.614 2.130 3.303 . 0 0 "[ . 1]" 1
98 1 13 ILE H 1 13 ILE MD 5.000 . 5.000 4.454 3.942 4.829 . 0 0 "[ . 1]" 1
99 1 13 ILE H 1 19 LEU HG 5.000 . 5.000 4.824 4.199 5.038 0.038 4 0 "[ . 1]" 1
100 1 13 ILE H 1 19 LEU MD1 5.000 2.400 5.000 3.327 2.678 4.041 . 0 0 "[ . 1]" 1
101 1 13 ILE H 1 21 ARG H 5.000 . 5.000 3.723 3.517 3.856 . 0 0 "[ . 1]" 1
102 1 13 ILE H 1 22 ASN HA 5.000 . 5.000 3.037 2.739 3.585 . 0 0 "[ . 1]" 1
103 1 13 ILE HA 1 13 ILE MD 4.650 . 4.650 3.612 2.632 4.173 . 0 0 "[ . 1]" 1
104 1 13 ILE HA 1 14 PHE H 2.800 . 2.800 2.165 2.134 2.223 . 0 0 "[ . 1]" 1
105 1 13 ILE HB 1 14 PHE H 5.000 . 5.000 3.869 2.950 4.366 . 0 0 "[ . 1]" 1
106 1 13 ILE MG 1 14 PHE H 4.200 2.600 4.200 4.017 3.861 4.196 . 0 0 "[ . 1]" 1
107 1 13 ILE QG 1 14 PHE QB 5.000 . 5.000 4.834 4.619 5.011 0.011 7 0 "[ . 1]" 1
108 1 13 ILE QG 1 14 PHE QD 5.000 . 5.000 4.735 4.321 5.034 0.034 3 0 "[ . 1]" 1
109 1 13 ILE QG 1 19 LEU MD1 5.000 . 5.000 4.839 3.528 5.030 0.030 8 0 "[ . 1]" 1
110 1 14 PHE H 1 14 PHE QB 3.710 . 3.710 3.121 2.598 3.265 . 0 0 "[ . 1]" 1
111 1 14 PHE H 1 14 PHE QD 4.470 . 4.470 2.631 1.932 3.101 . 0 0 "[ . 1]" 1
112 1 14 PHE HA 1 15 LYS H 2.800 . 2.800 2.424 2.150 2.498 . 0 0 "[ . 1]" 1
113 1 14 PHE HA 1 19 LEU HA 5.000 . 5.000 3.133 2.592 3.396 . 0 0 "[ . 1]" 1
114 1 14 PHE HA 1 19 LEU MD1 5.000 . 5.000 3.383 2.522 4.345 . 0 0 "[ . 1]" 1
115 1 14 PHE HA 1 20 VAL H 3.200 . 3.200 3.256 3.219 3.274 0.074 2 0 "[ . 1]" 1
116 1 14 PHE HA 1 20 VAL MG1 5.000 . 5.000 3.972 2.679 4.653 . 0 0 "[ . 1]" 1
117 1 14 PHE QB 1 15 LYS H 5.000 . 5.000 2.448 2.216 3.485 . 0 0 "[ . 1]" 1
118 1 14 PHE H 1 15 LYS H 5.000 . 5.000 4.412 3.998 4.543 . 0 0 "[ . 1]" 1
119 1 14 PHE QB 1 20 VAL MG1 5.000 . 5.000 4.850 4.077 5.084 0.084 1 0 "[ . 1]" 1
120 1 14 PHE QD 1 15 LYS H 5.000 2.100 5.000 4.039 3.653 4.722 . 0 0 "[ . 1]" 1
121 1 14 PHE QD 1 19 LEU MD1 5.000 . 5.000 1.996 1.769 2.862 . 0 0 "[ . 1]" 1
122 1 14 PHE QE 1 50 VAL QG 4.800 . 4.800 4.683 4.362 4.822 0.022 10 0 "[ . 1]" 1
123 1 14 PHE QD 1 19 LEU H 5.000 . 5.000 4.688 3.554 5.032 0.032 6 0 "[ . 1]" 1
124 1 14 PHE QE 1 71 ILE QG 5.000 . 5.000 4.614 2.146 5.016 0.016 1 0 "[ . 1]" 1
125 1 16 GLY QA 1 18 GLN H 5.000 . 5.000 3.459 3.278 3.553 . 0 0 "[ . 1]" 1
126 1 15 LYS H 1 15 LYS QB 3.720 . 3.720 2.475 2.233 2.924 . 0 0 "[ . 1]" 1
127 1 15 LYS H 1 15 LYS QG 5.000 . 5.000 2.822 1.930 4.008 . 0 0 "[ . 1]" 1
128 1 15 LYS H 1 15 LYS QE 5.000 . 5.000 4.471 3.479 4.980 . 0 0 "[ . 1]" 1
129 1 15 LYS H 1 18 GLN H 5.000 . 5.000 4.013 3.590 4.519 . 0 0 "[ . 1]" 1
130 1 15 LYS H 1 19 LEU HA 5.000 . 5.000 4.038 3.457 4.610 . 0 0 "[ . 1]" 1
131 1 15 LYS H 1 20 VAL MG1 5.000 . 5.000 4.312 3.277 4.857 . 0 0 "[ . 1]" 1
132 1 15 LYS H 1 20 VAL MG2 4.720 . 4.720 2.877 1.982 4.169 . 0 0 "[ . 1]" 1
133 1 15 LYS HA 1 15 LYS QD 5.000 . 5.000 3.537 1.997 4.149 . 0 0 "[ . 1]" 1
134 1 15 LYS QB 1 20 VAL MG1 5.000 . 5.000 4.379 2.286 5.008 0.008 4 0 "[ . 1]" 1
135 1 15 LYS QB 1 20 VAL MG2 4.000 . 4.000 3.316 2.300 3.779 . 0 0 "[ . 1]" 1
136 1 15 LYS QG 1 20 VAL MG1 4.000 . 4.000 3.542 3.028 4.010 0.010 4 0 "[ . 1]" 1
137 1 15 LYS QG 1 20 VAL MG2 4.000 . 4.000 2.483 1.887 3.521 . 0 0 "[ . 1]" 1
138 1 15 LYS QD 1 20 VAL MG2 4.000 . 4.000 2.806 1.835 4.005 0.005 4 0 "[ . 1]" 1
139 1 15 LYS QE 1 20 VAL MG2 4.000 . 4.000 2.989 2.022 4.009 0.009 4 0 "[ . 1]" 1
140 1 16 GLY QA 1 17 ASN H 5.000 . 5.000 2.197 2.114 2.787 . 0 0 "[ . 1]" 1
141 1 17 ASN H 1 17 ASN QB 3.700 . 3.700 2.564 2.157 3.046 . 0 0 "[ . 1]" 1
142 1 17 ASN HA 1 18 GLN H 3.200 . 3.200 3.051 2.963 3.154 . 0 0 "[ . 1]" 1
143 1 17 ASN QB 1 18 GLN H 5.000 3.400 5.000 3.749 3.582 4.016 . 0 0 "[ . 1]" 1
144 1 17 ASN HA 1 71 ILE MG 5.000 . 5.000 4.310 3.804 5.006 0.006 9 0 "[ . 1]" 1
145 1 18 GLN H 1 18 GLN QB 3.400 2.200 3.400 2.742 2.649 3.141 . 0 0 "[ . 1]" 1
146 1 18 GLN H 1 18 GLN QG 4.520 . 4.520 3.676 2.564 4.163 . 0 0 "[ . 1]" 1
147 1 18 GLN HA 1 19 LEU H 2.800 . 2.800 2.155 2.122 2.244 . 0 0 "[ . 1]" 1
148 1 18 GLN QB 1 19 LEU H 5.000 . 5.000 3.365 2.827 3.512 . 0 0 "[ . 1]" 1
149 1 18 GLN HA 1 72 SER QB 5.000 . 5.000 3.894 3.468 4.250 . 0 0 "[ . 1]" 1
150 1 18 GLN HA 1 73 TYR HA 5.000 . 5.000 4.984 4.734 5.062 0.062 8 0 "[ . 1]" 1
151 1 18 GLN QG 1 72 SER QB 4.555 . 4.555 2.941 1.838 4.562 0.007 9 0 "[ . 1]" 1
152 1 18 GLN QG 1 74 LYS QB 5.000 . 5.000 3.431 1.952 4.538 . 0 0 "[ . 1]" 1
153 1 18 GLN HA 1 71 ILE MD 5.000 . 5.000 4.912 4.359 5.029 0.029 2 0 "[ . 1]" 1
154 1 19 LEU QB 1 71 ILE QG 5.000 . 5.000 3.567 2.745 4.234 . 0 0 "[ . 1]" 1
155 1 19 LEU MD2 1 71 ILE HA 5.000 . 5.000 4.874 4.513 5.054 0.054 8 0 "[ . 1]" 1
156 1 19 LEU H 1 73 TYR HA 4.500 . 4.500 3.588 3.152 4.484 . 0 0 "[ . 1]" 1
157 1 19 LEU HA 1 20 VAL H 3.400 . 3.400 2.418 2.366 2.463 . 0 0 "[ . 1]" 1
158 1 19 LEU HA 1 20 VAL HA 5.000 . 5.000 4.504 4.474 4.524 . 0 0 "[ . 1]" 1
159 1 19 LEU HA 1 20 VAL MG1 5.000 . 5.000 4.849 4.312 5.079 0.079 4 0 "[ . 1]" 1
160 1 19 LEU HA 1 20 VAL MG2 5.000 . 5.000 3.501 2.758 5.098 0.098 9 0 "[ . 1]" 1
161 1 19 LEU HA 1 21 ARG H 5.000 . 5.000 4.036 3.843 4.910 . 0 0 "[ . 1]" 1
162 1 19 LEU HG 1 21 ARG H 4.800 . 4.800 2.902 2.479 4.308 . 0 0 "[ . 1]" 1
163 1 19 LEU MD1 1 20 VAL H 4.000 . 4.000 2.411 1.935 3.436 . 0 0 "[ . 1]" 1
164 1 19 LEU MD1 1 21 ARG H 5.000 . 5.000 3.106 2.225 4.145 . 0 0 "[ . 1]" 1
165 1 19 LEU MD2 1 122 LEU QB 5.000 . 5.000 4.188 3.617 5.000 . 0 0 "[ . 1]" 1
166 1 20 VAL H 1 20 VAL MG1 4.520 . 4.520 3.655 2.822 3.998 . 0 0 "[ . 1]" 1
167 1 20 VAL H 1 20 VAL MG2 4.800 . 4.800 2.887 2.350 4.015 . 0 0 "[ . 1]" 1
168 1 20 VAL H 1 21 ARG H 5.000 . 5.000 1.808 1.602 2.805 . 0 0 "[ . 1]" 1
169 1 20 VAL H 1 22 ASN H 5.000 . 5.000 5.086 5.037 5.118 0.118 5 0 "[ . 1]" 1
170 1 20 VAL HA 1 74 LYS H 5.000 . 5.000 2.661 2.109 3.394 . 0 0 "[ . 1]" 1
171 1 20 VAL HA 1 21 ARG H 3.400 . 3.400 3.469 3.437 3.511 0.111 8 0 "[ . 1]" 1
172 1 20 VAL HA 1 122 LEU QD 5.000 . 5.000 3.625 2.481 4.625 . 0 0 "[ . 1]" 1
173 1 20 VAL HB 1 76 GLU QB 4.810 . 4.810 4.465 3.811 4.847 0.037 7 0 "[ . 1]" 1
174 1 20 VAL MG1 1 21 ARG H 4.270 . 4.270 3.464 2.095 4.231 . 0 0 "[ . 1]" 1
175 1 20 VAL MG1 1 74 LYS H 5.000 . 5.000 3.482 1.822 4.977 . 0 0 "[ . 1]" 1
176 1 20 VAL MG1 1 122 LEU QD 5.000 . 5.000 4.332 2.842 5.004 0.004 5 0 "[ . 1]" 1
177 1 20 VAL MG2 1 21 ARG H 5.000 . 5.000 3.372 2.761 4.170 . 0 0 "[ . 1]" 1
178 1 20 VAL MG2 1 74 LYS H 4.600 . 4.600 3.327 2.125 4.050 . 0 0 "[ . 1]" 1
179 1 20 VAL MG2 1 74 LYS QB 4.000 . 4.000 2.921 1.692 4.004 0.004 1 0 "[ . 1]" 1
180 1 20 VAL MG2 1 76 GLU QB 5.000 . 5.000 3.876 2.119 4.868 . 0 0 "[ . 1]" 1
181 1 20 VAL MG1 1 21 ARG HA 5.000 . 5.000 4.604 3.759 5.103 0.103 1 0 "[ . 1]" 1
182 1 21 ARG H 1 22 ASN H 5.000 . 5.000 4.009 3.890 4.359 . 0 0 "[ . 1]" 1
183 1 21 ARG H 1 122 LEU QD 5.000 . 5.000 3.620 3.213 4.698 . 0 0 "[ . 1]" 1
184 1 21 ARG HA 1 21 ARG QD 5.000 . 5.000 3.442 2.481 4.273 . 0 0 "[ . 1]" 1
185 1 21 ARG HA 1 22 ASN H 3.400 . 3.400 2.157 2.105 2.188 . 0 0 "[ . 1]" 1
186 1 21 ARG HA 1 121 PRO QB 5.000 . 5.000 3.049 2.575 3.644 . 0 0 "[ . 1]" 1
187 1 21 ARG HA 1 122 LEU QD 4.500 . 4.500 2.557 1.953 4.516 0.016 8 0 "[ . 1]" 1
188 1 21 ARG QG 1 22 ASN H 4.410 . 4.410 3.065 2.722 3.812 . 0 0 "[ . 1]" 1
189 1 21 ARG QG 1 121 PRO HA 5.000 . 5.000 2.781 1.962 4.655 . 0 0 "[ . 1]" 1
190 1 21 ARG QD 1 22 ASN H 5.000 . 5.000 4.195 3.165 5.019 0.019 9 0 "[ . 1]" 1
191 1 21 ARG QD 1 121 PRO QB 5.000 . 5.000 4.165 2.537 4.962 . 0 0 "[ . 1]" 1
192 1 22 ASN H 1 121 PRO HA 5.000 . 5.000 4.694 4.490 4.963 . 0 0 "[ . 1]" 1
193 1 22 ASN H 1 121 PRO QB 5.000 . 5.000 4.519 3.965 5.010 0.010 3 0 "[ . 1]" 1
194 1 22 ASN H 1 122 LEU HA 5.000 . 5.000 3.561 3.139 3.794 . 0 0 "[ . 1]" 1
195 1 22 ASN H 1 122 LEU QD 5.000 . 5.000 2.441 1.819 4.312 . 0 0 "[ . 1]" 1
196 1 22 ASN HA 1 23 THR H 2.800 . 2.800 2.438 2.262 2.556 . 0 0 "[ . 1]" 1
197 1 22 ASN QB 1 23 THR H 5.000 . 5.000 3.995 3.921 4.041 . 0 0 "[ . 1]" 1
198 1 23 THR H 1 23 THR MG 3.930 . 3.930 2.659 2.281 3.100 . 0 0 "[ . 1]" 1
199 1 23 THR MG 1 122 LEU HG 5.000 . 5.000 4.821 4.195 5.054 0.054 1 0 "[ . 1]" 1
200 1 23 THR MG 1 122 LEU QD 5.000 . 5.000 2.893 2.122 4.797 . 0 0 "[ . 1]" 1
201 1 23 THR MG 1 125 ILE MD 5.000 . 5.000 4.779 3.642 5.152 0.152 9 0 "[ . 1]" 1
202 1 25 PRO HA 1 26 LEU H 3.400 . 3.400 3.005 2.807 3.394 . 0 0 "[ . 1]" 1
203 1 25 PRO HA 1 26 LEU HG 4.700 . 4.700 4.524 4.347 4.715 0.015 1 0 "[ . 1]" 1
204 1 25 PRO QB 1 26 LEU H 4.480 . 4.480 1.841 1.718 2.048 0.062 9 0 "[ . 1]" 1
205 1 26 LEU H 1 26 LEU HG 3.400 . 3.400 2.893 1.936 3.441 0.041 3 0 "[ . 1]" 1
206 1 26 LEU HA 1 27 ARG H 2.800 . 2.800 2.643 2.050 2.843 0.043 9 0 "[ . 1]" 1
207 1 26 LEU QB 1 27 ARG H 5.000 . 5.000 2.077 1.792 3.139 . 0 0 "[ . 1]" 1
208 1 26 LEU HG 1 27 ARG H 5.000 . 5.000 4.176 3.410 4.808 . 0 0 "[ . 1]" 1
209 1 26 LEU HG 1 27 ARG QD 5.000 . 5.000 4.971 4.488 5.117 0.117 5 0 "[ . 1]" 1
210 1 26 LEU HG 1 142 TYR QE 5.000 . 5.000 4.937 4.464 5.042 0.042 6 0 "[ . 1]" 1
211 1 27 ARG H 1 27 ARG QB 3.460 . 3.460 2.956 2.426 3.378 . 0 0 "[ . 1]" 1
212 1 27 ARG HA 1 27 ARG QD 5.000 . 5.000 3.171 1.905 4.446 . 0 0 "[ . 1]" 1
213 1 27 ARG HA 1 28 ARG H 3.400 . 3.400 2.482 2.138 3.496 0.096 1 0 "[ . 1]" 1
214 1 27 ARG HA 1 28 ARG QD 5.000 . 5.000 4.280 3.231 5.002 0.002 10 0 "[ . 1]" 1
215 1 27 ARG QD 1 28 ARG QB 5.000 . 5.000 4.915 4.519 5.078 0.078 10 0 "[ . 1]" 1
216 1 9 PHE HZ 1 28 ARG H 5.000 . 5.000 4.310 2.259 5.062 0.062 3 0 "[ . 1]" 1
217 1 28 ARG H 1 28 ARG QB 3.400 . 3.400 2.912 2.288 3.424 0.024 10 0 "[ . 1]" 1
218 1 28 ARG H 1 29 GLU H 5.000 . 5.000 3.504 1.898 4.304 . 0 0 "[ . 1]" 1
219 1 28 ARG HA 1 29 GLU H 3.400 . 3.400 2.730 2.143 3.513 0.113 3 0 "[ . 1]" 1
220 1 28 ARG HA 1 31 ILE MG 5.000 . 5.000 4.211 1.866 5.013 0.013 1 0 "[ . 1]" 1
221 1 28 ARG QB 1 29 GLU H 4.000 . 4.000 3.167 1.848 4.023 0.023 2 0 "[ . 1]" 1
222 1 29 GLU HA 1 30 GLU H 5.000 . 5.000 3.444 3.228 3.586 . 0 0 "[ . 1]" 1
223 1 29 GLU H 1 29 GLU QG 4.280 . 4.280 2.467 1.905 4.007 . 0 0 "[ . 1]" 1
224 1 29 GLU H 1 30 GLU H 4.780 . 4.780 2.751 2.590 2.935 . 0 0 "[ . 1]" 1
225 1 29 GLU QG 1 30 GLU H 4.680 . 4.680 2.652 1.868 4.232 . 0 0 "[ . 1]" 1
226 1 29 GLU QG 1 31 ILE H 5.000 2.100 5.000 4.574 2.594 5.015 0.015 10 0 "[ . 1]" 1
227 1 30 GLU H 1 30 GLU QB 3.460 . 3.460 2.515 2.236 3.000 . 0 0 "[ . 1]" 1
228 1 30 GLU H 1 31 ILE H 3.400 2.400 3.400 2.837 2.352 3.407 0.048 4 0 "[ . 1]" 1
229 1 30 GLU QB 1 31 ILE H 5.000 . 5.000 3.792 3.343 4.037 . 0 0 "[ . 1]" 1
230 1 31 ILE H 1 31 ILE MD 5.000 . 5.000 4.001 2.611 4.430 . 0 0 "[ . 1]" 1
231 1 31 ILE H 1 32 PHE H 5.000 . 5.000 2.363 2.094 2.674 . 0 0 "[ . 1]" 1
232 1 31 ILE HA 1 31 ILE MD 4.640 . 4.640 2.644 1.950 3.863 . 0 0 "[ . 1]" 1
233 1 31 ILE HA 1 34 PHE QD 5.000 2.200 5.000 3.909 3.036 4.913 . 0 0 "[ . 1]" 1
234 1 31 ILE MG 1 32 PHE H 3.800 . 3.800 2.469 1.995 3.849 0.049 10 0 "[ . 1]" 1
235 1 31 ILE MG 1 32 PHE HA 5.000 . 5.000 3.432 3.173 3.762 . 0 0 "[ . 1]" 1
236 1 31 ILE MG 1 32 PHE QD 5.000 . 5.000 2.917 1.846 3.764 . 0 0 "[ . 1]" 1
237 1 31 ILE MD 1 32 PHE H 4.630 . 4.630 4.315 3.338 4.643 0.013 3 0 "[ . 1]" 1
238 1 31 ILE MD 1 35 MET QG 5.000 . 5.000 3.894 1.897 5.008 0.008 10 0 "[ . 1]" 1
239 1 31 ILE MD 1 39 VAL QG 5.000 . 8.200 5.756 3.407 7.869 . 0 0 "[ . 1]" 1
240 1 32 PHE H 1 32 PHE QB 3.710 . 3.710 2.594 2.257 3.200 . 0 0 "[ . 1]" 1
241 1 32 PHE H 1 32 PHE QD 3.400 . 3.400 2.848 2.122 3.316 . 0 0 "[ . 1]" 1
242 1 32 PHE H 1 32 PHE QE 5.000 . 5.000 4.395 3.963 5.008 0.008 8 0 "[ . 1]" 1
243 1 32 PHE H 1 34 PHE H 4.500 . 4.500 4.375 4.013 4.717 0.217 10 0 "[ . 1]" 1
244 1 32 PHE HA 1 33 ASN H 3.400 . 3.400 3.075 2.201 3.497 0.097 2 0 "[ . 1]" 1
245 1 32 PHE HA 1 34 PHE H 4.260 . 4.260 3.655 2.793 4.299 0.039 7 0 "[ . 1]" 1
246 1 32 PHE HA 1 35 MET H 4.500 . 4.500 3.874 2.753 4.523 0.023 1 0 "[ . 1]" 1
247 1 32 PHE QD 1 33 ASN H 5.000 . 5.000 4.213 2.748 4.737 . 0 0 "[ . 1]" 1
248 1 33 ASN H 1 33 ASN QB 2.990 . 2.990 2.469 2.114 3.018 0.028 4 0 "[ . 1]" 1
249 1 33 ASN H 1 34 PHE H 2.800 . 2.800 2.458 1.878 2.823 0.023 4 0 "[ . 1]" 1
250 1 33 ASN H 1 35 MET H 5.000 . 5.000 4.162 3.674 4.675 . 0 0 "[ . 1]" 1
251 1 34 PHE H 1 35 MET H 2.800 . 2.800 2.389 1.892 2.814 0.014 9 0 "[ . 1]" 1
252 1 34 PHE QB 1 35 MET H 4.000 . 4.000 3.106 2.151 3.787 . 0 0 "[ . 1]" 1
253 1 33 ASN H 1 34 PHE QD 5.500 2.300 5.500 4.419 2.812 5.515 0.015 3 0 "[ . 1]" 1
254 1 34 PHE HA 1 35 MET H 3.800 . 3.800 3.363 2.931 3.568 . 0 0 "[ . 1]" 1
255 1 35 MET H 1 35 MET QB 3.720 . 3.720 2.527 2.068 2.942 . 0 0 "[ . 1]" 1
256 1 35 MET HA 1 36 ASP H 2.800 . 2.800 2.335 2.155 2.804 0.004 6 0 "[ . 1]" 1
257 1 35 MET QB 1 36 ASP H 4.000 3.000 4.000 3.512 3.014 4.006 0.006 3 0 "[ . 1]" 1
258 1 35 MET HA 1 38 GLU QB 5.000 . 5.000 4.884 4.286 5.030 0.030 2 0 "[ . 1]" 1
259 1 35 MET QB 1 39 VAL QG 5.000 . 5.000 4.089 1.679 5.013 0.013 8 0 "[ . 1]" 1
260 1 35 MET QG 1 36 ASP H 4.440 . 4.440 4.035 2.358 4.481 0.041 5 0 "[ . 1]" 1
261 1 36 ASP H 1 36 ASP QB 3.750 . 3.750 2.448 2.169 3.102 . 0 0 "[ . 1]" 1
262 1 36 ASP HA 1 37 GLY H 2.800 . 2.800 2.663 2.188 2.841 0.041 6 0 "[ . 1]" 1
263 1 36 ASP QB 1 37 GLY H 4.280 . 4.280 3.875 3.820 3.915 . 0 0 "[ . 1]" 1
264 1 36 ASP HA 1 37 GLY QA 5.000 . 5.000 3.982 3.895 4.062 . 0 0 "[ . 1]" 1
265 1 37 GLY H 1 38 GLU H 5.000 . 5.000 3.091 1.980 4.275 . 0 0 "[ . 1]" 1
266 1 37 GLY QA 1 38 GLU H 3.400 . 3.400 2.473 2.107 2.868 . 0 0 "[ . 1]" 1
267 1 38 GLU H 1 38 GLU QB 2.990 . 2.990 2.744 2.165 2.973 . 0 0 "[ . 1]" 1
268 1 38 GLU H 1 38 GLU QG 4.670 . 4.670 4.214 3.933 4.429 . 0 0 "[ . 1]" 1
269 1 38 GLU H 1 39 VAL H 5.000 . 5.000 3.343 2.627 4.274 . 0 0 "[ . 1]" 1
270 1 38 GLU HA 1 39 VAL H 3.600 2.200 3.600 3.390 2.939 3.561 . 0 0 "[ . 1]" 1
271 1 38 GLU HA 1 40 VAL MG1 5.000 2.100 5.000 4.759 3.709 5.032 0.032 10 0 "[ . 1]" 1
272 1 38 GLU HA 1 40 VAL MG2 4.500 2.100 4.500 3.529 2.509 4.517 0.017 8 0 "[ . 1]" 1
273 1 38 GLU QB 1 39 VAL H 5.000 . 5.000 2.265 1.790 3.802 . 0 0 "[ . 1]" 1
274 1 38 GLU QG 1 40 VAL HA 5.000 . 5.000 4.828 4.222 5.045 0.045 1 0 "[ . 1]" 1
275 1 39 VAL H 1 39 VAL HB 4.000 2.500 4.000 3.429 2.611 4.002 0.002 5 0 "[ . 1]" 1
276 1 39 VAL H 1 39 VAL QG 3.730 . 3.730 2.486 2.016 3.051 . 0 0 "[ . 1]" 1
277 1 39 VAL HA 1 40 VAL H 2.800 . 2.800 2.572 2.187 2.804 0.004 3 0 "[ . 1]" 1
278 1 39 VAL QG 1 40 VAL H 4.360 . 4.360 3.578 3.116 3.756 . 0 0 "[ . 1]" 1
279 1 39 VAL QG 1 40 VAL HA 5.000 . 5.000 3.986 3.474 4.211 . 0 0 "[ . 1]" 1
280 1 40 VAL H 1 40 VAL HB 4.000 . 4.000 3.289 2.825 3.802 . 0 0 "[ . 1]" 1
281 1 40 VAL H 1 40 VAL MG2 3.600 . 3.600 1.973 1.790 2.251 0.010 2 0 "[ . 1]" 1
282 1 40 VAL H 1 41 SER H 4.850 . 4.850 3.811 2.446 4.608 . 0 0 "[ . 1]" 1
283 1 40 VAL HA 1 41 SER H 3.400 . 3.400 2.730 2.138 3.518 0.118 2 0 "[ . 1]" 1
284 1 40 VAL HB 1 41 SER H 4.160 . 4.160 3.018 1.951 4.207 0.047 3 0 "[ . 1]" 1
285 1 40 VAL MG1 1 41 SER H 4.000 . 4.000 3.296 1.921 3.985 . 0 0 "[ . 1]" 1
286 1 40 VAL MG1 1 42 ASN HA 5.000 . 5.000 4.825 4.357 5.045 0.045 10 0 "[ . 1]" 1
287 1 41 SER H 1 41 SER QB 3.460 . 3.460 2.772 2.172 3.487 0.027 10 0 "[ . 1]" 1
288 1 41 SER HA 1 42 ASN H 3.460 . 3.460 3.311 2.137 3.542 0.082 9 0 "[ . 1]" 1
289 1 41 SER QB 1 42 ASN H 3.460 . 3.460 2.782 1.897 3.487 0.027 1 0 "[ . 1]" 1
290 1 43 PRO HA 1 44 GLU H 3.400 . 3.400 3.509 3.465 3.531 0.131 8 0 "[ . 1]" 1
291 1 43 PRO QB 1 44 GLU H 2.800 . 2.800 2.522 2.217 2.824 0.024 4 0 "[ . 1]" 1
292 1 43 PRO QB 1 44 GLU QB 5.000 . 5.000 4.095 3.148 4.645 . 0 0 "[ . 1]" 1
293 1 43 PRO HA 1 46 GLU QG 5.000 4.000 5.000 4.598 3.983 5.021 0.021 5 0 "[ . 1]" 1
294 1 44 GLU H 1 44 GLU QB 3.720 . 3.720 2.604 2.074 3.172 . 0 0 "[ . 1]" 1
295 1 44 GLU HA 1 45 ASP H 2.800 . 2.800 2.519 2.107 2.830 0.030 3 0 "[ . 1]" 1
296 1 44 GLU QB 1 45 ASP H 5.000 . 5.000 2.640 1.993 3.765 . 0 0 "[ . 1]" 1
297 1 44 GLU QB 1 46 GLU H 5.000 . 5.000 3.473 2.287 5.039 0.039 5 0 "[ . 1]" 1
298 1 45 ASP H 1 45 ASP QB 3.720 . 3.720 2.734 2.328 3.386 . 0 0 "[ . 1]" 1
299 1 45 ASP H 1 48 LEU H 5.000 . 5.000 4.520 3.012 5.033 0.033 5 0 "[ . 1]" 1
300 1 45 ASP HA 1 48 LEU H 5.000 . 5.000 3.443 2.532 4.764 . 0 0 "[ . 1]" 1
301 1 45 ASP HA 1 48 LEU QB 5.000 . 5.000 3.568 1.946 5.031 0.031 5 0 "[ . 1]" 1
302 1 45 ASP QB 1 46 GLU H 3.400 . 3.400 2.939 1.871 3.477 0.077 7 0 "[ . 1]" 1
303 1 45 ASP QB 1 46 GLU HA 5.000 . 5.000 4.122 3.533 4.751 . 0 0 "[ . 1]" 1
304 1 45 ASP QB 1 48 LEU HG 5.000 . 5.000 4.358 3.377 5.014 0.014 10 0 "[ . 1]" 1
305 1 45 ASP HA 1 48 LEU QD 5.000 . 5.000 2.789 1.879 4.756 . 0 0 "[ . 1]" 1
306 1 46 GLU H 1 46 GLU HA 2.800 . 2.800 2.709 2.328 2.771 . 0 0 "[ . 1]" 1
307 1 46 GLU H 1 46 GLU QB 3.460 . 3.460 2.545 2.213 3.483 0.023 6 0 "[ . 1]" 1
308 1 46 GLU H 1 46 GLU QG 4.900 . 4.900 2.706 1.980 4.014 . 0 0 "[ . 1]" 1
309 1 46 GLU H 1 47 HIS H 5.000 . 5.000 2.850 2.735 3.167 . 0 0 "[ . 1]" 1
310 1 46 GLU QG 1 47 HIS H 5.500 . 5.500 2.969 2.077 4.162 . 0 0 "[ . 1]" 1
311 1 47 HIS H 1 48 LEU H 3.750 . 3.750 2.193 1.953 2.709 . 0 0 "[ . 1]" 1
312 1 47 HIS H 1 48 LEU QB 5.000 . 5.000 4.052 3.758 4.582 . 0 0 "[ . 1]" 1
313 1 47 HIS QB 1 48 LEU H 4.280 . 4.280 3.022 2.232 3.857 . 0 0 "[ . 1]" 1
314 1 48 LEU H 1 48 LEU QB 3.200 . 3.200 2.572 2.202 3.168 . 0 0 "[ . 1]" 1
315 1 48 LEU QB 1 49 LYS H 5.000 . 5.000 2.929 2.072 3.640 . 0 0 "[ . 1]" 1
316 1 48 LEU HG 1 49 LYS H 3.700 . 3.700 2.727 1.974 3.732 0.032 7 0 "[ . 1]" 1
317 1 48 LEU QD 1 49 LYS H 5.000 . 5.000 2.572 1.772 3.883 . 0 0 "[ . 1]" 1
318 1 48 LEU QB 1 51 ALA MB 5.000 . 5.000 3.806 3.179 4.387 . 0 0 "[ . 1]" 1
319 1 49 LYS H 1 49 LYS HA 2.800 . 2.800 2.769 2.755 2.782 . 0 0 "[ . 1]" 1
320 1 49 LYS H 1 49 LYS QB 3.460 . 3.460 2.227 2.043 2.548 . 0 0 "[ . 1]" 1
321 1 49 LYS H 1 50 VAL H 2.800 . 2.800 2.812 2.745 2.875 0.075 4 0 "[ . 1]" 1
322 1 49 LYS QB 1 50 VAL H 2.800 . 2.800 2.611 2.381 2.861 0.061 6 0 "[ . 1]" 1
323 1 49 LYS HA 1 52 GLU H 4.500 . 4.500 4.033 3.719 4.286 . 0 0 "[ . 1]" 1
324 1 50 VAL H 1 50 VAL HB 3.400 . 3.400 2.620 2.487 2.866 . 0 0 "[ . 1]" 1
325 1 50 VAL H 1 50 VAL QG 3.240 . 3.240 2.043 1.966 2.190 . 0 0 "[ . 1]" 1
326 1 50 VAL HB 1 51 ALA H 3.800 3.400 3.800 3.725 3.315 3.858 0.085 2 0 "[ . 1]" 1
327 1 50 VAL H 1 51 ALA H 2.800 . 2.800 2.593 2.526 2.807 0.007 6 0 "[ . 1]" 1
328 1 50 VAL HA 1 53 ILE HB 5.000 . 5.000 2.511 2.050 3.040 . 0 0 "[ . 1]" 1
329 1 50 VAL HA 1 51 ALA H 4.000 . 4.000 3.519 3.410 3.596 . 0 0 "[ . 1]" 1
330 1 50 VAL HA 1 53 ILE MD 5.000 . 5.000 2.229 1.935 4.549 . 0 0 "[ . 1]" 1
331 1 50 VAL QG 1 51 ALA H 5.000 . 5.500 2.253 1.795 3.537 . 0 0 "[ . 1]" 1
332 1 50 VAL QG 1 54 ILE MD 5.000 . 5.000 1.968 1.798 2.161 0.002 5 0 "[ . 1]" 1
333 1 50 VAL QG 1 54 ILE HA 5.000 . 5.000 4.695 4.252 5.003 0.003 7 0 "[ . 1]" 1
334 1 51 ALA MB 1 54 ILE HB 5.000 . 5.000 4.475 3.958 4.891 . 0 0 "[ . 1]" 1
335 1 51 ALA MB 1 54 ILE MD 4.500 . 4.500 3.490 3.165 3.943 . 0 0 "[ . 1]" 1
336 1 51 ALA H 1 52 GLU H 3.400 . 3.400 2.891 2.769 2.955 . 0 0 "[ . 1]" 1
337 1 51 ALA HA 1 54 ILE H 4.580 . 4.580 3.615 3.378 3.895 . 0 0 "[ . 1]" 1
338 1 51 ALA HA 1 54 ILE HB 5.000 . 5.000 3.209 2.687 3.619 . 0 0 "[ . 1]" 1
339 1 51 ALA HA 1 54 ILE MG 5.000 . 5.000 4.481 4.044 4.888 . 0 0 "[ . 1]" 1
340 1 51 ALA MB 1 52 GLU H 4.430 . 4.430 2.335 2.054 2.593 . 0 0 "[ . 1]" 1
341 1 52 GLU H 1 52 GLU QB 2.990 . 2.990 2.225 2.057 2.626 . 0 0 "[ . 1]" 1
342 1 52 GLU H 1 52 GLU QG 4.440 . 4.440 3.324 1.931 4.017 . 0 0 "[ . 1]" 1
343 1 52 GLU H 1 53 ILE H 2.800 . 2.800 2.689 2.660 2.720 . 0 0 "[ . 1]" 1
344 1 52 GLU H 1 53 ILE MD 5.000 . 5.000 4.940 4.687 5.012 0.012 5 0 "[ . 1]" 1
345 1 52 GLU H 1 55 LEU H 5.000 . 5.000 4.970 4.849 5.040 0.040 1 0 "[ . 1]" 1
346 1 52 GLU HA 1 55 LEU QB 5.000 . 5.000 2.819 2.531 3.045 . 0 0 "[ . 1]" 1
347 1 52 GLU HA 1 55 LEU MD2 3.800 . 3.800 3.466 2.941 3.811 0.011 6 0 "[ . 1]" 1
348 1 53 ILE H 1 53 ILE HB 3.350 . 3.350 2.432 2.366 2.503 . 0 0 "[ . 1]" 1
349 1 53 ILE H 1 53 ILE MG 4.000 . 4.000 3.749 3.728 3.768 . 0 0 "[ . 1]" 1
350 1 53 ILE H 1 53 ILE QG 4.000 . 4.000 2.315 2.166 2.438 . 0 0 "[ . 1]" 1
351 1 53 ILE H 1 54 ILE H 2.800 . 2.800 2.705 2.644 2.781 . 0 0 "[ . 1]" 1
352 1 53 ILE HB 1 54 ILE H 5.000 . 5.000 2.460 2.297 2.602 . 0 0 "[ . 1]" 1
353 1 53 ILE MG 1 54 ILE H 5.000 2.900 5.000 3.108 3.037 3.142 . 0 0 "[ . 1]" 1
354 1 53 ILE MG 1 54 ILE HA 5.000 . 5.000 3.184 3.140 3.221 . 0 0 "[ . 1]" 1
355 1 53 ILE MG 1 54 ILE HB 5.000 2.600 5.000 5.012 4.942 5.031 0.031 9 0 "[ . 1]" 1
356 1 53 ILE MG 1 57 LEU MD1 5.000 . 5.000 3.601 2.340 4.539 . 0 0 "[ . 1]" 1
357 1 53 ILE QG 1 54 ILE H 5.000 . 5.000 4.094 3.988 4.197 . 0 0 "[ . 1]" 1
358 1 54 ILE H 1 54 ILE HB 3.920 . 3.920 2.618 2.583 2.651 . 0 0 "[ . 1]" 1
359 1 54 ILE H 1 54 ILE MD 5.000 . 5.000 3.051 2.816 3.469 . 0 0 "[ . 1]" 1
360 1 54 ILE H 1 55 LEU H 3.400 . 3.400 2.808 2.753 2.907 . 0 0 "[ . 1]" 1
361 1 54 ILE HA 1 54 ILE MD 4.270 . 4.270 3.882 3.857 3.899 . 0 0 "[ . 1]" 1
362 1 54 ILE HA 1 57 LEU H 4.940 . 4.940 3.682 3.400 4.002 . 0 0 "[ . 1]" 1
363 1 54 ILE HA 1 57 LEU MD1 5.000 . 5.000 2.568 1.992 3.318 . 0 0 "[ . 1]" 1
364 1 54 ILE MG 1 55 LEU H 4.350 . 4.350 3.424 3.156 3.576 . 0 0 "[ . 1]" 1
365 1 54 ILE MG 1 55 LEU MD1 4.470 . 4.470 3.728 3.186 4.001 . 0 0 "[ . 1]" 1
366 1 54 ILE MD 1 55 LEU H 5.000 . 5.000 4.103 3.892 4.324 . 0 0 "[ . 1]" 1
367 1 54 ILE MD 1 55 LEU MD1 5.000 . 5.000 4.786 3.836 5.005 0.005 9 0 "[ . 1]" 1
368 1 55 LEU H 1 55 LEU QB 2.990 . 2.990 2.069 2.029 2.184 . 0 0 "[ . 1]" 1
369 1 55 LEU H 1 55 LEU MD1 5.000 . 5.000 3.116 1.939 3.416 . 0 0 "[ . 1]" 1
370 1 55 LEU H 1 55 LEU MD2 5.000 . 5.000 4.086 3.985 4.288 . 0 0 "[ . 1]" 1
371 1 55 LEU HA 1 55 LEU MD1 4.780 . 4.780 2.098 1.932 2.756 . 0 0 "[ . 1]" 1
372 1 55 LEU MD1 1 59 PHE QD 5.000 . 5.000 4.299 3.885 4.991 . 0 0 "[ . 1]" 1
373 1 55 LEU MD2 1 56 LYS H 5.000 . 5.000 4.633 4.400 4.914 . 0 0 "[ . 1]" 1
374 1 56 LYS H 1 56 LYS QB 3.360 . 3.360 2.225 2.042 2.546 . 0 0 "[ . 1]" 1
375 1 56 LYS H 1 57 LEU H 3.400 . 3.400 2.884 2.699 3.045 . 0 0 "[ . 1]" 1
376 1 56 LYS HA 1 59 PHE H 5.000 . 5.000 3.629 3.368 3.956 . 0 0 "[ . 1]" 1
377 1 56 LYS HA 1 62 ILE MD 4.660 . 4.660 4.412 4.035 4.668 0.008 9 0 "[ . 1]" 1
378 1 56 LYS QB 1 62 ILE MG 4.400 . 4.400 2.724 1.798 4.255 . 0 0 "[ . 1]" 1
379 1 56 LYS QB 1 62 ILE MD 4.470 . 4.470 2.323 1.850 3.583 . 0 0 "[ . 1]" 1
380 1 57 LEU H 1 57 LEU QB 3.900 . 3.900 2.660 2.564 2.742 . 0 0 "[ . 1]" 1
381 1 57 LEU H 1 57 LEU HG 3.570 . 3.570 2.082 1.805 2.318 . 0 0 "[ . 1]" 1
382 1 57 LEU H 1 57 LEU MD1 3.800 . 3.800 3.662 3.476 3.825 0.025 10 0 "[ . 1]" 1
383 1 57 LEU H 1 57 LEU MD2 3.300 . 3.300 2.489 2.002 3.194 . 0 0 "[ . 1]" 1
384 1 57 LEU H 1 58 TYR H 3.400 . 3.400 2.707 2.605 2.820 . 0 0 "[ . 1]" 1
385 1 57 LEU HA 1 57 LEU MD2 3.740 . 3.740 3.051 1.953 3.811 0.071 7 0 "[ . 1]" 1
386 1 57 LEU H 1 62 ILE MG 4.500 . 4.500 3.939 3.184 4.524 0.024 7 0 "[ . 1]" 1
387 1 57 LEU HA 1 62 ILE H 4.530 . 4.530 3.950 2.563 4.546 0.016 5 0 "[ . 1]" 1
388 1 57 LEU HA 1 62 ILE MG 4.930 . 4.930 3.443 1.967 4.717 . 0 0 "[ . 1]" 1
389 1 57 LEU HA 1 62 ILE MD 4.660 . 4.660 3.029 1.873 4.670 0.010 6 0 "[ . 1]" 1
390 1 57 LEU HA 1 66 LYS QB 5.000 . 5.000 4.962 4.665 5.052 0.052 1 0 "[ . 1]" 1
391 1 57 LEU QB 1 58 TYR H 4.630 . 4.630 3.005 2.210 3.610 . 0 0 "[ . 1]" 1
392 1 57 LEU MD1 1 66 LYS QB 5.000 . 5.000 4.041 2.526 4.900 . 0 0 "[ . 1]" 1
393 1 57 LEU MD1 1 125 ILE HA 5.000 . 5.000 3.568 2.138 4.722 . 0 0 "[ . 1]" 1
394 1 57 LEU MD1 1 125 ILE QG 5.000 . 5.000 4.141 3.099 5.012 0.012 3 0 "[ . 1]" 1
395 1 57 LEU MD1 1 125 ILE MD 5.000 . 5.000 3.401 2.062 4.966 . 0 0 "[ . 1]" 1
396 1 57 LEU MD2 1 66 LYS HA 5.000 . 5.000 4.198 3.550 4.965 . 0 0 "[ . 1]" 1
397 1 57 LEU MD2 1 66 LYS QB 4.730 . 4.730 2.639 1.831 3.942 . 0 0 "[ . 1]" 1
398 1 58 TYR H 1 58 TYR QB 3.780 . 3.780 2.211 2.064 2.260 . 0 0 "[ . 1]" 1
399 1 58 TYR H 1 59 PHE H 5.000 . 5.000 2.687 2.610 2.795 . 0 0 "[ . 1]" 1
400 1 58 TYR HA 1 150 ILE MG 5.000 . 5.000 4.169 2.991 5.008 0.008 8 0 "[ . 1]" 1
401 1 58 TYR HA 1 150 ILE MD 4.500 . 4.500 3.594 2.753 4.507 0.007 7 0 "[ . 1]" 1
402 1 58 TYR QD 1 150 ILE QG 4.500 . 4.500 3.607 3.036 4.290 . 0 0 "[ . 1]" 1
403 1 58 TYR QD 1 150 ILE MD 4.500 . 4.500 3.302 2.625 3.975 . 0 0 "[ . 1]" 1
404 1 58 TYR QE 1 124 LEU QD 5.000 . 5.000 3.241 2.340 4.579 . 0 0 "[ . 1]" 1
405 1 58 TYR QE 1 150 ILE QG 5.000 . 5.000 3.486 2.761 4.289 . 0 0 "[ . 1]" 1
406 1 58 TYR QE 1 150 ILE MD 4.500 . 4.500 2.963 1.959 4.281 . 0 0 "[ . 1]" 1
407 1 58 TYR HA 1 124 LEU QD 5.000 . 5.000 2.814 1.909 3.300 . 0 0 "[ . 1]" 1
408 1 58 TYR QE 1 149 PHE QD 5.000 . 5.000 4.713 4.026 5.009 0.009 10 0 "[ . 1]" 1
409 1 59 PHE H 1 59 PHE QB 3.870 . 3.870 2.228 2.105 2.491 . 0 0 "[ . 1]" 1
410 1 59 PHE H 1 60 ALA H 3.400 . 3.400 2.651 2.342 3.113 . 0 0 "[ . 1]" 1
411 1 59 PHE H 1 61 GLU H 5.000 . 5.000 4.501 3.368 4.988 . 0 0 "[ . 1]" 1
412 1 59 PHE HA 1 153 ARG QB 5.000 . 5.000 4.278 3.763 5.002 0.002 2 0 "[ . 1]" 1
413 1 59 PHE QD 1 150 ILE QG 5.500 2.300 5.500 5.300 4.988 5.504 0.004 3 0 "[ . 1]" 1
414 1 57 LEU HA 1 60 ALA H 5.000 . 5.000 3.656 3.090 4.096 . 0 0 "[ . 1]" 1
415 1 60 ALA H 1 60 ALA HA 2.800 . 2.800 2.347 2.285 2.828 0.028 8 0 "[ . 1]" 1
416 1 60 ALA H 1 61 GLU H 3.400 . 3.400 3.000 1.715 3.412 0.012 7 0 "[ . 1]" 1
417 1 60 ALA MB 1 154 GLU H 4.000 . 4.000 3.856 3.136 4.046 0.046 5 0 "[ . 1]" 1
418 1 60 ALA MB 1 154 GLU HA 5.000 . 5.000 3.125 2.570 4.044 . 0 0 "[ . 1]" 1
419 1 61 GLU H 1 61 GLU QB 5.000 2.900 5.000 2.927 2.792 3.340 0.108 7 0 "[ . 1]" 1
420 1 61 GLU H 1 62 ILE H 2.800 . 2.800 2.327 1.942 2.810 0.010 6 0 "[ . 1]" 1
421 1 61 GLU QB 1 62 ILE H 5.000 . 5.000 3.563 2.456 3.987 . 0 0 "[ . 1]" 1
422 1 61 GLU QB 1 62 ILE MD 5.000 . 5.000 4.547 3.639 5.039 0.039 1 0 "[ . 1]" 1
423 1 62 ILE H 1 62 ILE HA 2.800 . 2.800 2.788 2.291 2.919 0.119 5 0 "[ . 1]" 1
424 1 62 ILE H 1 63 ASP H 5.000 . 5.000 3.361 1.976 4.658 . 0 0 "[ . 1]" 1
425 1 62 ILE HA 1 62 ILE MD 4.810 . 4.810 3.531 2.064 4.175 . 0 0 "[ . 1]" 1
426 1 62 ILE MG 1 63 ASP H 5.000 . 5.000 3.516 2.145 4.237 . 0 0 "[ . 1]" 1
427 1 62 ILE MD 1 66 LYS QE 5.000 . 5.000 3.860 2.840 5.021 0.021 1 0 "[ . 1]" 1
428 1 63 ASP HA 1 64 ASP H 3.400 . 3.400 3.090 2.320 3.512 0.112 4 0 "[ . 1]" 1
429 1 63 ASP HA 1 93 PHE QD 5.000 . 5.000 4.633 3.949 5.014 0.014 6 0 "[ . 1]" 1
430 1 63 ASP HA 1 93 PHE QE 5.000 . 5.000 4.391 3.669 4.744 . 0 0 "[ . 1]" 1
431 1 64 ASP H 1 65 LYS H 4.730 . 4.730 3.884 2.321 4.652 . 0 0 "[ . 1]" 1
432 1 65 LYS H 1 65 LYS QB 3.200 . 3.200 2.825 2.072 3.232 0.032 5 0 "[ . 1]" 1
433 1 65 LYS H 1 67 VAL H 5.000 . 5.000 4.172 2.847 5.004 0.004 8 0 "[ . 1]" 1
434 1 65 LYS H 1 66 LYS H 2.800 . 2.800 2.489 1.698 2.829 0.029 3 0 "[ . 1]" 1
435 1 66 LYS HA 1 69 GLU H 5.000 . 5.000 3.806 3.144 4.378 . 0 0 "[ . 1]" 1
436 1 66 LYS H 1 67 VAL H 3.400 . 3.400 2.489 1.794 2.984 0.006 7 0 "[ . 1]" 1
437 1 66 LYS HA 1 66 LYS QD 5.000 . 5.000 3.966 2.129 4.514 . 0 0 "[ . 1]" 1
438 1 66 LYS HA 1 67 VAL H 3.400 . 3.400 3.444 3.272 3.526 0.126 3 0 "[ . 1]" 1
439 1 66 LYS HA 1 69 GLU QB 5.000 . 5.000 3.553 2.569 4.775 . 0 0 "[ . 1]" 1
440 1 66 LYS QB 1 67 VAL H 3.400 . 3.400 3.253 2.248 3.439 0.039 6 0 "[ . 1]" 1
441 1 66 LYS QD 1 67 VAL H 5.000 . 5.000 4.019 2.805 5.010 0.010 1 0 "[ . 1]" 1
442 1 66 LYS QE 1 70 LEU QB 5.500 . 5.500 4.156 1.951 5.514 0.014 9 0 "[ . 1]" 1
443 1 66 LYS HA 1 68 ARG H 5.000 . 5.000 4.045 3.653 4.425 . 0 0 "[ . 1]" 1
444 1 66 LYS QE 1 124 LEU QD 5.000 . 5.000 4.838 4.158 5.025 0.025 10 0 "[ . 1]" 1
445 1 67 VAL H 1 67 VAL HB 2.800 . 2.800 2.583 2.506 2.724 . 0 0 "[ . 1]" 1
446 1 67 VAL H 1 68 ARG H 5.000 . 5.000 2.982 2.652 4.028 . 0 0 "[ . 1]" 1
447 1 67 VAL HA 1 70 LEU QB 4.500 . 4.500 3.111 2.059 4.440 . 0 0 "[ . 1]" 1
448 1 67 VAL HA 1 70 LEU HG 5.000 . 5.000 4.052 2.982 5.009 0.009 9 0 "[ . 1]" 1
449 1 67 VAL HA 1 70 LEU QD 4.500 . 4.500 3.123 1.802 4.519 0.019 3 0 "[ . 1]" 1
450 1 67 VAL HB 1 125 ILE MG 5.000 . 5.000 5.010 4.975 5.021 0.021 7 0 "[ . 1]" 1
451 1 68 ARG H 1 69 GLU H 3.380 . 3.380 2.763 2.286 3.228 . 0 0 "[ . 1]" 1
452 1 69 GLU H 1 69 GLU HA 2.800 . 2.800 2.777 2.754 2.827 0.027 5 0 "[ . 1]" 1
453 1 69 GLU H 1 69 GLU QB 3.460 . 3.460 2.338 2.066 2.541 . 0 0 "[ . 1]" 1
454 1 69 GLU H 1 69 GLU QG 5.000 . 5.000 2.674 1.970 4.048 . 0 0 "[ . 1]" 1
455 1 69 GLU H 1 70 LEU H 3.200 . 3.200 2.736 2.537 2.818 . 0 0 "[ . 1]" 1
456 1 69 GLU HA 1 70 LEU H 3.400 . 3.400 3.434 3.419 3.467 0.067 5 0 "[ . 1]" 1
457 1 70 LEU H 1 70 LEU QB 3.430 . 3.430 2.285 2.061 2.696 . 0 0 "[ . 1]" 1
458 1 70 LEU H 1 70 LEU QD 5.000 . 5.000 3.263 2.749 3.729 . 0 0 "[ . 1]" 1
459 1 70 LEU H 1 71 ILE H 2.800 . 2.800 2.648 2.480 2.809 0.009 9 0 "[ . 1]" 1
460 1 70 LEU HA 1 71 ILE H 3.400 . 3.400 3.289 3.132 3.424 0.024 8 0 "[ . 1]" 1
461 1 70 LEU QB 1 71 ILE H 4.710 . 4.710 3.524 3.044 3.931 . 0 0 "[ . 1]" 1
462 1 70 LEU QB 1 73 TYR QE 5.000 . 5.000 4.905 4.485 5.028 0.028 3 0 "[ . 1]" 1
463 1 70 LEU QD 1 73 TYR QE 5.000 . 5.000 3.748 1.991 5.014 0.014 4 0 "[ . 1]" 1
464 1 70 LEU QD 1 73 TYR QB 5.000 . 5.000 4.688 3.713 5.015 0.015 5 0 "[ . 1]" 1
465 1 71 ILE H 1 71 ILE MG 3.720 . 3.720 3.842 3.783 3.898 0.178 2 0 "[ . 1]" 1
466 1 71 ILE H 1 71 ILE QG 4.260 . 4.260 2.777 2.586 2.963 . 0 0 "[ . 1]" 1
467 1 71 ILE H 1 72 SER H 5.000 . 5.000 4.112 3.929 4.287 . 0 0 "[ . 1]" 1
468 1 71 ILE H 1 72 SER HA 5.000 . 5.000 5.125 5.089 5.147 0.147 8 0 "[ . 1]" 1
469 1 71 ILE HB 1 72 SER H 5.000 3.200 5.000 3.706 3.402 3.995 . 0 0 "[ . 1]" 1
470 1 71 ILE MG 1 72 SER H 5.000 . 5.000 2.322 2.085 2.547 . 0 0 "[ . 1]" 1
471 1 72 SER H 1 72 SER QB 3.400 . 3.400 2.268 2.074 2.839 . 0 0 "[ . 1]" 1
472 1 72 SER HA 1 73 TYR QE 5.000 . 6.000 4.609 4.104 4.991 . 0 0 "[ . 1]" 1
473 1 73 TYR H 1 73 TYR QD 3.400 . 3.400 2.733 2.542 2.948 . 0 0 "[ . 1]" 1
474 1 73 TYR HA 1 74 LYS H 2.800 . 2.800 2.257 2.190 2.432 . 0 0 "[ . 1]" 1
475 1 73 TYR HA 1 122 LEU HG 5.000 . 5.000 5.010 4.928 5.065 0.065 3 0 "[ . 1]" 1
476 1 73 TYR QB 1 74 LYS H 5.000 . 5.000 2.751 2.164 2.965 . 0 0 "[ . 1]" 1
477 1 73 TYR QD 1 74 LYS H 4.520 . 4.520 4.367 3.707 4.610 0.090 3 0 "[ . 1]" 1
478 1 73 TYR QD 1 82 LYS QE 5.000 . 5.000 4.802 3.941 5.019 0.019 6 0 "[ . 1]" 1
479 1 73 TYR QD 1 122 LEU HG 5.000 . 5.000 3.028 1.985 4.030 . 0 0 "[ . 1]" 1
480 1 73 TYR QD 1 125 ILE MG 5.000 . 5.000 4.289 3.334 5.085 0.085 3 0 "[ . 1]" 1
481 1 73 TYR QD 1 125 ILE QG 5.000 . 5.000 4.182 3.419 4.938 . 0 0 "[ . 1]" 1
482 1 73 TYR QE 1 82 LYS QE 5.000 . 5.000 4.572 4.034 5.004 0.004 7 0 "[ . 1]" 1
483 1 73 TYR QE 1 122 LEU HG 5.000 . 5.000 4.638 3.634 5.099 0.099 3 0 "[ . 1]" 1
484 1 73 TYR QE 1 125 ILE MG 5.000 . 5.000 3.313 1.862 4.556 . 0 0 "[ . 1]" 1
485 1 73 TYR QE 1 125 ILE QG 5.000 2.500 5.000 3.300 2.525 4.286 . 0 0 "[ . 1]" 1
486 1 73 TYR QD 1 122 LEU QB 5.000 . 5.000 3.475 1.776 4.195 0.024 3 0 "[ . 1]" 1
487 1 73 TYR QE 1 126 ILE QG 5.000 . 5.000 4.794 4.317 5.022 0.022 7 0 "[ . 1]" 1
488 1 74 LYS H 1 74 LYS QB 3.400 . 3.400 2.484 2.208 2.661 . 0 0 "[ . 1]" 1
489 1 74 LYS HA 1 75 LEU H 3.400 . 3.400 2.232 2.124 2.343 . 0 0 "[ . 1]" 1
490 1 75 LEU H 1 76 GLU H 5.000 . 5.000 3.848 3.125 4.648 . 0 0 "[ . 1]" 1
491 1 75 LEU HA 1 76 GLU H 2.800 . 2.800 2.407 2.127 2.819 0.019 1 0 "[ . 1]" 1
492 1 75 LEU HA 1 76 GLU QB 5.000 . 5.000 4.457 4.133 4.812 . 0 0 "[ . 1]" 1
493 1 75 LEU QB 1 76 GLU H 5.000 . 5.000 3.506 1.908 4.015 . 0 0 "[ . 1]" 1
494 1 75 LEU QD 1 76 GLU H 4.280 . 4.280 3.555 2.011 4.276 . 0 0 "[ . 1]" 1
495 1 75 LEU QD 1 76 GLU QB 5.500 . 5.500 4.660 4.214 5.068 . 0 0 "[ . 1]" 1
496 1 76 GLU H 1 77 VAL H 5.000 . 5.000 3.418 2.002 4.356 . 0 0 "[ . 1]" 1
497 1 76 GLU H 1 77 VAL MG2 5.000 . 5.000 4.558 3.523 5.102 0.102 6 0 "[ . 1]" 1
498 1 76 GLU HA 1 77 VAL H 2.800 . 2.800 2.396 2.136 2.855 0.055 10 0 "[ . 1]" 1
499 1 76 GLU QB 1 77 VAL HA 5.000 . 5.000 4.331 4.037 4.671 . 0 0 "[ . 1]" 1
500 1 76 GLU QB 1 77 VAL MG1 5.000 . 5.000 4.080 3.017 4.797 . 0 0 "[ . 1]" 1
501 1 76 GLU QB 1 121 PRO HA 5.000 . 5.000 4.815 3.847 5.041 0.041 6 0 "[ . 1]" 1
502 1 76 GLU QB 1 121 PRO QB 5.000 . 5.000 3.009 2.263 4.037 . 0 0 "[ . 1]" 1
503 1 77 VAL H 1 77 VAL MG1 3.400 . 3.400 2.630 1.833 3.220 . 0 0 "[ . 1]" 1
504 1 77 VAL H 1 77 VAL MG2 5.000 2.900 5.000 3.198 2.746 3.983 0.154 2 0 "[ . 1]" 1
505 1 77 VAL H 1 77 VAL HB 5.000 2.900 5.000 3.774 3.273 4.045 . 0 0 "[ . 1]" 1
506 1 77 VAL MG1 1 82 LYS H 5.000 2.100 5.000 3.827 2.738 4.945 . 0 0 "[ . 1]" 1
507 1 77 VAL MG1 1 82 LYS HA 4.500 . 4.500 4.115 2.602 4.527 0.027 3 0 "[ . 1]" 1
508 1 77 VAL MG1 1 82 LYS QB 4.500 . 4.500 3.948 3.255 4.553 0.053 9 0 "[ . 1]" 1
509 1 77 VAL MG2 1 81 THR HB 5.000 . 5.000 3.538 1.850 5.019 0.019 2 0 "[ . 1]" 1
510 1 77 VAL MG2 1 82 LYS H 5.000 . 5.000 3.957 2.492 4.985 . 0 0 "[ . 1]" 1
511 1 77 VAL MG2 1 82 LYS QB 5.000 . 5.000 4.169 2.295 5.023 0.023 7 0 "[ . 1]" 1
512 1 78 PRO HA 1 79 GLU H 2.800 . 2.800 2.537 2.149 2.837 0.037 10 0 "[ . 1]" 1
513 1 78 PRO QB 1 79 GLU H 4.040 . 4.040 3.736 2.631 4.015 . 0 0 "[ . 1]" 1
514 1 79 GLU H 1 79 GLU HA 2.800 . 2.800 2.424 2.271 2.780 . 0 0 "[ . 1]" 1
515 1 79 GLU H 1 79 GLU QB 3.460 . 3.460 3.191 3.001 3.496 0.036 5 0 "[ . 1]" 1
516 1 79 GLU H 1 79 GLU QG 4.280 . 4.280 3.434 2.741 4.259 . 0 0 "[ . 1]" 1
517 1 79 GLU QB 1 80 PHE H 3.680 . 3.680 2.661 1.933 3.705 0.025 6 0 "[ . 1]" 1
518 1 79 GLU QG 1 80 PHE H 4.280 . 4.280 3.819 2.088 4.267 . 0 0 "[ . 1]" 1
519 1 80 PHE H 1 80 PHE QB 3.740 . 3.740 3.069 2.082 3.473 . 0 0 "[ . 1]" 1
520 1 80 PHE QB 1 81 THR H 5.000 . 5.000 3.162 2.522 3.955 . 0 0 "[ . 1]" 1
521 1 80 PHE QD 1 81 THR H 5.000 . 5.000 3.397 2.319 4.547 . 0 0 "[ . 1]" 1
522 1 80 PHE QD 1 83 LYS QB 5.000 . 5.000 4.426 3.592 5.002 0.002 9 0 "[ . 1]" 1
523 1 80 PHE QD 1 84 VAL MG2 5.000 . 5.000 4.798 4.186 5.019 0.019 7 0 "[ . 1]" 1
524 1 80 PHE QD 1 112 ALA MB 5.000 . 5.000 3.638 1.925 5.011 0.011 4 0 "[ . 1]" 1
525 1 80 PHE QD 1 113 VAL QG 5.000 . 5.000 3.696 2.652 4.858 . 0 0 "[ . 1]" 1
526 1 80 PHE QD 1 116 ALA MB 5.000 . 5.000 4.024 2.883 4.986 . 0 0 "[ . 1]" 1
527 1 81 THR H 1 81 THR HB 3.400 . 3.400 3.108 2.388 3.451 0.051 9 0 "[ . 1]" 1
528 1 81 THR H 1 81 THR MG 4.110 . 4.110 3.154 2.340 3.941 . 0 0 "[ . 1]" 1
529 1 81 THR H 1 82 LYS H 2.800 . 2.800 2.016 1.612 2.804 0.004 7 0 "[ . 1]" 1
530 1 81 THR HB 1 116 ALA HA 5.000 . 5.000 4.388 3.041 5.030 0.030 10 0 "[ . 1]" 1
531 1 81 THR MG 1 82 LYS H 3.750 . 3.750 3.053 2.255 3.617 . 0 0 "[ . 1]" 1
532 1 81 THR MG 1 85 LEU QB 5.000 . 5.000 3.975 3.208 4.685 . 0 0 "[ . 1]" 1
533 1 81 THR MG 1 85 LEU HG 5.000 . 5.000 3.672 2.159 4.866 . 0 0 "[ . 1]" 1
534 1 81 THR MG 1 116 ALA MB 5.000 . 5.000 4.028 3.064 4.719 . 0 0 "[ . 1]" 1
535 1 82 LYS H 1 82 LYS QB 3.400 . 3.400 2.107 2.041 2.271 . 0 0 "[ . 1]" 1
536 1 82 LYS H 1 82 LYS QD 5.080 . 5.080 3.584 2.863 4.310 . 0 0 "[ . 1]" 1
537 1 82 LYS H 1 83 LYS H 2.800 . 2.800 2.683 2.461 2.801 0.001 3 0 "[ . 1]" 1
538 1 82 LYS H 1 84 VAL H 4.560 . 4.560 4.457 4.252 4.614 0.054 8 0 "[ . 1]" 1
539 1 82 LYS HA 1 82 LYS QD 5.000 . 5.000 2.472 2.022 3.075 . 0 0 "[ . 1]" 1
540 1 82 LYS HA 1 84 VAL H 4.800 . 4.800 4.780 4.593 4.836 0.036 1 0 "[ . 1]" 1
541 1 82 LYS HA 1 85 LEU H 4.970 . 4.970 3.613 3.376 3.778 . 0 0 "[ . 1]" 1
542 1 82 LYS HA 1 85 LEU HG 5.000 . 5.000 3.794 2.774 4.364 . 0 0 "[ . 1]" 1
543 1 82 LYS HA 1 85 LEU QB 5.000 . 5.000 2.693 2.279 2.912 . 0 0 "[ . 1]" 1
544 1 82 LYS QB 1 83 LYS H 3.400 . 3.400 2.626 2.450 2.841 . 0 0 "[ . 1]" 1
545 1 83 LYS H 1 83 LYS QB 3.050 . 3.050 2.356 2.065 2.732 . 0 0 "[ . 1]" 1
546 1 83 LYS H 1 84 VAL H 2.800 . 2.800 2.841 2.816 2.868 0.068 10 0 "[ . 1]" 1
547 1 83 LYS H 1 84 VAL MG1 5.000 . 5.000 4.906 4.686 5.055 0.055 6 0 "[ . 1]" 1
548 1 83 LYS H 1 84 VAL MG2 5.000 . 5.000 3.590 3.509 3.650 . 0 0 "[ . 1]" 1
549 1 83 LYS HA 1 83 LYS QE 5.000 . 5.000 3.722 2.345 5.011 0.011 10 0 "[ . 1]" 1
550 1 83 LYS HA 1 86 ASP QB 4.500 . 4.500 2.708 2.512 3.194 . 0 0 "[ . 1]" 1
551 1 83 LYS QB 1 84 VAL H 5.000 . 5.000 2.433 2.265 3.011 . 0 0 "[ . 1]" 1
552 1 83 LYS QB 1 84 VAL MG1 5.000 . 5.000 3.515 3.252 3.867 . 0 0 "[ . 1]" 1
553 1 83 LYS QB 1 106 LEU MD1 5.000 . 5.000 2.149 1.704 3.127 . 0 0 "[ . 1]" 1
554 1 83 LYS QE 1 84 VAL MG1 5.000 . 5.000 4.469 1.784 5.014 0.014 8 0 "[ . 1]" 1
555 1 84 VAL HA 1 117 LEU MD2 5.000 . 5.000 4.708 4.067 5.017 0.017 8 0 "[ . 1]" 1
556 1 84 VAL H 1 84 VAL HB 3.400 . 3.400 3.552 3.518 3.566 0.166 10 0 "[ . 1]" 1
557 1 84 VAL H 1 84 VAL MG2 3.400 . 3.400 1.809 1.780 1.871 0.020 1 0 "[ . 1]" 1
558 1 84 VAL H 1 85 LEU H 3.400 . 3.400 2.748 2.650 2.825 . 0 0 "[ . 1]" 1
559 1 84 VAL HA 1 106 LEU MD2 5.000 . 5.000 4.416 3.731 5.004 0.004 9 0 "[ . 1]" 1
560 1 84 VAL HB 1 85 LEU H 3.400 . 3.400 3.448 3.417 3.480 0.080 6 0 "[ . 1]" 1
561 1 84 VAL HB 1 85 LEU MD2 5.000 . 5.000 4.828 4.091 5.006 0.006 7 0 "[ . 1]" 1
562 1 84 VAL HB 1 117 LEU HG 5.000 . 5.000 4.852 3.925 5.019 0.019 7 0 "[ . 1]" 1
563 1 84 VAL MG1 1 106 LEU MD2 5.000 . 5.000 4.296 3.603 5.017 0.017 7 0 "[ . 1]" 1
564 1 84 VAL MG1 1 116 ALA MB 5.000 . 5.000 3.022 2.168 3.844 . 0 0 "[ . 1]" 1
565 1 84 VAL MG2 1 85 LEU H 4.440 . 4.440 2.066 1.927 2.158 . 0 0 "[ . 1]" 1
566 1 84 VAL MG2 1 102 ILE MG 5.000 . 5.000 4.534 3.282 5.034 0.034 6 0 "[ . 1]" 1
567 1 84 VAL MG2 1 106 LEU MD1 5.000 . 5.000 4.547 3.803 5.037 0.037 10 0 "[ . 1]" 1
568 1 84 VAL MG2 1 113 VAL HA 5.000 . 5.000 4.522 3.997 4.965 . 0 0 "[ . 1]" 1
569 1 84 VAL MG2 1 113 VAL QG 5.000 . 5.000 3.115 2.804 3.471 . 0 0 "[ . 1]" 1
570 1 84 VAL MG2 1 116 ALA MB 5.000 . 5.000 2.742 2.170 3.342 . 0 0 "[ . 1]" 1
571 1 85 LEU H 1 85 LEU QB 3.790 . 3.790 2.249 2.091 2.429 . 0 0 "[ . 1]" 1
572 1 85 LEU H 1 85 LEU HG 5.000 . 5.000 3.370 2.352 4.572 . 0 0 "[ . 1]" 1
573 1 85 LEU H 1 85 LEU MD2 4.540 . 4.540 3.654 3.219 3.829 . 0 0 "[ . 1]" 1
574 1 85 LEU H 1 86 ASP H 3.400 . 3.400 2.630 2.592 2.709 . 0 0 "[ . 1]" 1
575 1 85 LEU HA 1 85 LEU MD2 4.500 . 4.500 2.063 1.959 2.230 . 0 0 "[ . 1]" 1
576 1 85 LEU HA 1 88 VAL H 5.000 . 5.000 3.399 3.311 3.655 . 0 0 "[ . 1]" 1
577 1 85 LEU QB 1 86 ASP H 5.000 . 5.000 2.624 2.558 2.731 . 0 0 "[ . 1]" 1
578 1 85 LEU HG 1 86 ASP H 5.000 . 5.000 4.755 4.364 5.033 0.033 6 0 "[ . 1]" 1
579 1 85 LEU MD2 1 126 ILE MD 5.000 . 5.000 2.713 1.703 4.400 . 0 0 "[ . 1]" 1
580 1 85 LEU HA 1 88 VAL HB 5.000 . 5.000 3.902 3.540 4.733 . 0 0 "[ . 1]" 1
581 1 86 ASP H 1 86 ASP HA 2.800 . 2.800 2.811 2.805 2.824 0.024 5 0 "[ . 1]" 1
582 1 86 ASP H 1 86 ASP QB 3.400 . 3.400 2.218 2.071 2.552 . 0 0 "[ . 1]" 1
583 1 86 ASP H 1 87 ILE H 2.800 . 2.800 2.593 2.582 2.614 . 0 0 "[ . 1]" 1
584 1 87 ILE H 1 87 ILE HB 2.800 . 2.800 2.226 2.129 2.326 . 0 0 "[ . 1]" 1
585 1 87 ILE H 1 87 ILE HA 2.800 . 2.800 2.836 2.825 2.847 0.047 9 0 "[ . 1]" 1
586 1 87 ILE H 1 87 ILE MG 3.520 . 3.520 2.880 2.617 3.572 0.052 6 0 "[ . 1]" 1
587 1 87 ILE H 1 87 ILE QG 4.310 . 4.310 3.682 2.912 3.875 . 0 0 "[ . 1]" 1
588 1 87 ILE H 1 88 VAL H 2.800 . 2.800 2.630 2.537 2.777 . 0 0 "[ . 1]" 1
589 1 87 ILE HA 1 91 ILE H 4.240 . 4.240 4.007 3.840 4.303 0.063 9 0 "[ . 1]" 1
590 1 87 ILE HA 1 91 ILE MG 5.000 . 5.000 4.912 4.620 5.057 0.057 8 0 "[ . 1]" 1
591 1 87 ILE HB 1 88 VAL H 3.980 . 3.980 3.349 2.515 3.583 . 0 0 "[ . 1]" 1
592 1 87 ILE HA 1 89 LYS QB 5.500 2.300 5.500 4.495 4.330 4.730 . 0 0 "[ . 1]" 1
593 1 87 ILE MG 1 88 VAL H 3.730 . 3.730 1.914 1.812 2.235 0.018 5 0 "[ . 1]" 1
594 1 87 ILE MG 1 91 ILE H 5.000 . 5.000 4.212 3.802 4.602 . 0 0 "[ . 1]" 1
595 1 87 ILE MG 1 117 LEU QB 5.000 . 5.000 4.956 4.644 5.060 0.060 5 0 "[ . 1]" 1
596 1 87 ILE MG 1 128 CYS H 5.000 . 5.000 5.052 5.020 5.085 0.085 7 0 "[ . 1]" 1
597 1 87 ILE QG 1 91 ILE H 5.500 . 5.500 4.203 3.603 5.183 . 0 0 "[ . 1]" 1
598 1 87 ILE MD 1 88 VAL H 5.500 . 5.500 4.590 4.352 4.717 . 0 0 "[ . 1]" 1
599 1 87 ILE MD 1 131 VAL HB 5.000 . 5.000 5.015 4.939 5.037 0.037 7 0 "[ . 1]" 1
600 1 88 VAL H 1 88 VAL HB 3.400 . 3.400 2.462 2.320 2.670 . 0 0 "[ . 1]" 1
601 1 88 VAL H 1 89 LYS H 3.400 . 3.400 2.645 2.440 2.744 . 0 0 "[ . 1]" 1
602 1 88 VAL H 1 90 ASP H 5.500 . 5.500 4.441 4.190 4.687 . 0 0 "[ . 1]" 1
603 1 88 VAL HB 1 89 LYS H 4.090 . 4.090 3.981 3.760 4.100 0.010 6 0 "[ . 1]" 1
604 1 88 VAL MG1 1 89 LYS H 5.000 . 5.000 2.068 1.854 2.304 . 0 0 "[ . 1]" 1
605 1 88 VAL MG1 1 89 LYS HA 5.000 . 5.000 3.106 2.999 3.332 . 0 0 "[ . 1]" 1
606 1 88 VAL MG1 1 126 ILE MG 5.000 . 5.000 3.850 3.283 4.472 . 0 0 "[ . 1]" 1
607 1 88 VAL MG2 1 89 LYS H 4.200 . 4.200 3.909 3.519 4.063 . 0 0 "[ . 1]" 1
608 1 88 VAL MG2 1 91 ILE H 5.000 . 5.000 4.889 4.560 5.050 0.050 1 0 "[ . 1]" 1
609 1 88 VAL MG2 1 125 ILE QG 5.000 . 5.000 4.635 3.481 5.070 0.070 1 0 "[ . 1]" 1
610 1 89 LYS H 1 89 LYS QB 3.720 . 3.720 2.183 2.034 2.543 . 0 0 "[ . 1]" 1
611 1 89 LYS H 1 90 ASP H 2.800 . 2.800 2.817 2.770 2.861 0.061 2 0 "[ . 1]" 1
612 1 89 LYS QB 1 90 ASP H 4.700 . 4.700 2.871 2.537 3.038 . 0 0 "[ . 1]" 1
613 1 89 LYS HA 1 90 ASP H 5.000 . 5.000 3.503 3.461 3.568 . 0 0 "[ . 1]" 1
614 1 90 ASP H 1 90 ASP HA 2.800 . 2.800 2.915 2.909 2.924 0.124 2 0 "[ . 1]" 1
615 1 90 ASP H 1 90 ASP QB 3.490 . 3.490 2.518 2.282 2.657 . 0 0 "[ . 1]" 1
616 1 90 ASP H 1 91 ILE H 3.400 . 3.400 2.092 1.858 2.447 . 0 0 "[ . 1]" 1
617 1 90 ASP HA 1 91 ILE H 5.000 . 5.000 3.479 3.131 3.574 . 0 0 "[ . 1]" 1
618 1 91 ILE H 1 91 ILE HB 3.400 . 3.400 2.783 2.267 3.543 0.143 3 0 "[ . 1]" 1
619 1 91 ILE H 1 91 ILE MD 3.920 . 3.920 3.648 3.034 3.986 0.066 5 0 "[ . 1]" 1
620 1 91 ILE H 1 91 ILE MG 5.000 2.900 5.000 3.485 2.870 3.774 0.030 3 0 "[ . 1]" 1
621 1 91 ILE HA 1 92 GLU H 2.800 . 2.800 2.185 2.127 2.389 . 0 0 "[ . 1]" 1
622 1 91 ILE MG 1 92 GLU H 3.680 . 3.680 2.772 2.266 3.432 . 0 0 "[ . 1]" 1
623 1 91 ILE MG 1 96 THR H 5.000 2.400 5.000 4.582 4.084 5.013 0.013 9 0 "[ . 1]" 1
624 1 91 ILE MG 1 96 THR HA 5.000 . 5.000 4.696 4.373 5.031 0.031 7 0 "[ . 1]" 1
625 1 91 ILE MG 1 97 LEU H 5.000 . 5.000 4.454 3.675 5.022 0.022 1 0 "[ . 1]" 1
626 1 91 ILE MD 1 97 LEU H 5.000 . 5.000 4.695 3.880 5.064 0.064 8 0 "[ . 1]" 1
627 1 92 GLU H 1 92 GLU QB 3.720 . 3.720 2.599 2.043 3.276 . 0 0 "[ . 1]" 1
628 1 92 GLU H 1 92 GLU QG 3.680 . 3.680 3.096 2.317 3.699 0.019 10 0 "[ . 1]" 1
629 1 92 GLU HA 1 93 PHE H 3.400 2.100 3.400 2.836 2.366 3.354 . 0 0 "[ . 1]" 1
630 1 92 GLU QG 1 93 PHE H 5.000 . 5.000 3.250 1.940 3.951 . 0 0 "[ . 1]" 1
631 1 93 PHE H 1 93 PHE QB 3.400 . 3.400 2.392 2.073 2.594 . 0 0 "[ . 1]" 1
632 1 93 PHE H 1 93 PHE QD 5.000 . 5.000 2.731 1.963 4.033 . 0 0 "[ . 1]" 1
633 1 93 PHE QD 1 154 GLU HA 5.000 . 5.000 4.818 4.113 5.013 0.013 9 0 "[ . 1]" 1
634 1 93 PHE HA 1 94 GLY H 3.400 . 3.900 2.686 2.146 3.489 . 0 0 "[ . 1]" 1
635 1 94 GLY H 1 94 GLY QA 5.000 . 5.500 2.338 2.215 2.477 . 0 0 "[ . 1]" 1
636 1 94 GLY H 1 95 LYS H 3.980 . 3.980 2.361 1.917 2.854 . 0 0 "[ . 1]" 1
637 1 95 LYS H 1 95 LYS HA 2.800 . 2.800 2.914 2.908 2.921 0.121 4 0 "[ . 1]" 1
638 1 95 LYS H 1 95 LYS QB 3.460 . 3.460 2.364 2.224 2.598 . 0 0 "[ . 1]" 1
639 1 95 LYS HA 1 96 THR H 2.800 . 2.800 2.295 2.174 2.340 . 0 0 "[ . 1]" 1
640 1 95 LYS QB 1 96 THR H 3.680 . 3.680 2.985 2.611 3.376 . 0 0 "[ . 1]" 1
641 1 96 THR H 1 96 THR HA 5.000 2.700 5.000 2.892 2.885 2.898 . 0 0 "[ . 1]" 1
642 1 96 THR H 1 96 THR MG 4.080 . 4.080 4.024 3.989 4.038 . 0 0 "[ . 1]" 1
643 1 96 THR H 1 97 LEU QB 5.000 . 5.000 4.509 4.113 4.932 . 0 0 "[ . 1]" 1
644 1 96 THR HA 1 97 LEU H 3.200 . 3.200 2.256 2.144 2.353 . 0 0 "[ . 1]" 1
645 1 96 THR HA 1 132 VAL MG1 5.000 . 5.000 4.991 4.716 5.038 0.038 5 0 "[ . 1]" 1
646 1 96 THR HB 1 97 LEU H 5.000 2.100 5.000 4.324 4.076 4.465 . 0 0 "[ . 1]" 1
647 1 96 THR MG 1 97 LEU H 3.600 . 3.600 3.409 2.866 3.628 0.028 6 0 "[ . 1]" 1
648 1 96 THR MG 1 130 ARG H 5.000 . 5.000 4.841 4.216 5.008 0.008 6 0 "[ . 1]" 1
649 1 97 LEU H 1 131 VAL MG1 5.000 . 5.000 5.050 5.010 5.091 0.091 3 0 "[ . 1]" 1
650 1 97 LEU H 1 131 VAL MG2 5.000 . 5.000 4.125 3.997 4.266 . 0 0 "[ . 1]" 1
651 1 97 LEU HA 1 97 LEU MD2 4.120 . 4.120 3.161 1.980 3.775 . 0 0 "[ . 1]" 1
652 1 97 LEU HA 1 98 THR H 2.800 . 2.800 2.581 2.567 2.603 . 0 0 "[ . 1]" 1
653 1 97 LEU QB 1 98 THR H 4.180 . 4.180 2.196 2.041 2.515 . 0 0 "[ . 1]" 1
654 1 97 LEU QB 1 102 ILE QG 5.000 . 5.000 3.325 2.266 4.527 . 0 0 "[ . 1]" 1
655 1 97 LEU MD1 1 98 THR H 4.530 . 4.530 4.163 3.474 4.571 0.041 5 0 "[ . 1]" 1
656 1 97 LEU MD2 1 98 THR H 3.890 . 3.890 3.219 2.255 3.850 . 0 0 "[ . 1]" 1
657 1 97 LEU MD2 1 102 ILE MD 5.000 . 5.000 3.642 1.851 4.814 . 0 0 "[ . 1]" 1
658 1 98 THR H 1 98 THR MG 3.800 2.100 3.800 3.004 2.554 3.835 0.035 3 0 "[ . 1]" 1
659 1 98 THR H 1 101 ASP H 5.000 . 5.000 3.879 3.585 4.279 . 0 0 "[ . 1]" 1
660 1 98 THR H 1 101 ASP QB 4.270 . 4.270 2.992 2.347 4.270 . 3 0 "[ . 1]" 1
661 1 98 THR H 1 131 VAL MG1 5.000 . 5.000 4.254 3.895 4.647 . 0 0 "[ . 1]" 1
662 1 98 THR HA 1 99 TYR H 2.800 . 2.800 2.586 2.280 2.739 . 0 0 "[ . 1]" 1
663 1 98 THR HA 1 100 GLY H 5.000 . 5.000 4.643 4.207 4.845 . 0 0 "[ . 1]" 1
664 1 98 THR HA 1 131 VAL H 5.000 . 5.000 5.077 5.044 5.135 0.135 5 0 "[ . 1]" 1
665 1 98 THR HA 1 131 VAL MG1 5.000 . 5.000 2.844 2.121 3.100 . 0 0 "[ . 1]" 1
666 1 98 THR HA 1 132 VAL H 5.000 . 5.000 2.364 2.112 2.605 . 0 0 "[ . 1]" 1
667 1 98 THR HB 1 99 TYR H 4.770 . 4.770 2.234 1.873 3.969 . 0 0 "[ . 1]" 1
668 1 98 THR MG 1 99 TYR H 3.820 . 3.820 3.270 1.923 3.599 . 0 0 "[ . 1]" 1
669 1 98 THR MG 1 132 VAL HA 5.000 . 5.000 4.399 4.146 4.674 . 0 0 "[ . 1]" 1
670 1 98 THR MG 1 132 VAL HB 5.000 . 5.000 4.116 3.747 4.758 . 0 0 "[ . 1]" 1
671 1 98 THR MG 1 133 ALA HA 5.000 . 5.000 3.391 3.118 3.870 . 0 0 "[ . 1]" 1
672 1 98 THR MG 1 134 LYS H 3.890 . 3.890 3.806 3.323 3.900 0.010 10 0 "[ . 1]" 1
673 1 98 THR MG 1 134 LYS HA 4.510 . 4.510 2.910 2.578 3.230 . 0 0 "[ . 1]" 1
674 1 99 TYR QE 1 128 CYS HA 5.000 . 5.000 4.916 4.683 5.052 0.052 8 0 "[ . 1]" 1
675 1 99 TYR H 1 99 TYR QD 3.730 . 3.730 2.461 1.986 2.968 . 0 0 "[ . 1]" 1
676 1 99 TYR H 1 100 GLY H 5.000 . 5.000 2.673 2.469 3.068 . 0 0 "[ . 1]" 1
677 1 99 TYR H 1 110 PRO QB 4.990 . 4.990 3.995 3.580 4.876 . 0 0 "[ . 1]" 1
678 1 99 TYR H 1 131 VAL HA 5.000 . 5.000 4.230 3.777 4.496 . 0 0 "[ . 1]" 1
679 1 99 TYR H 1 131 VAL MG1 3.860 . 3.860 2.713 2.043 2.998 . 0 0 "[ . 1]" 1
680 1 99 TYR HA 1 110 PRO QB 5.000 . 5.000 3.820 3.629 4.339 . 0 0 "[ . 1]" 1
681 1 99 TYR HA 1 131 VAL MG1 4.990 . 4.990 2.111 1.906 2.576 . 0 0 "[ . 1]" 1
682 1 99 TYR QB 1 100 GLY H 5.000 . 5.000 2.554 2.306 2.906 . 0 0 "[ . 1]" 1
683 1 99 TYR QB 1 110 PRO QB 5.000 . 5.000 1.860 1.759 2.364 . 0 0 "[ . 1]" 1
684 1 99 TYR QB 1 103 ALA MB 5.000 . 5.000 3.412 2.786 3.935 . 0 0 "[ . 1]" 1
685 1 99 TYR QD 1 131 VAL MG1 5.000 . 5.000 2.426 2.251 2.651 . 0 0 "[ . 1]" 1
686 1 99 TYR QE 1 113 VAL QG 5.000 . 5.000 3.663 2.917 4.382 . 0 0 "[ . 1]" 1
687 1 99 TYR QE 1 114 GLY QA 5.000 . 5.000 2.439 2.029 2.839 . 0 0 "[ . 1]" 1
688 1 99 TYR QE 1 117 LEU HG 4.000 . 4.000 2.894 2.219 4.004 0.004 5 0 "[ . 1]" 1
689 1 99 TYR QE 1 131 VAL HB 4.000 . 4.000 3.378 3.104 3.657 . 0 0 "[ . 1]" 1
690 1 99 TYR QE 1 131 VAL MG1 4.000 . 4.000 2.954 2.614 3.254 . 0 0 "[ . 1]" 1
691 1 99 TYR QE 1 133 ALA HA 4.000 . 4.000 3.550 2.624 4.003 0.003 8 0 "[ . 1]" 1
692 1 99 TYR QE 1 133 ALA MB 4.000 . 4.000 3.307 2.513 4.020 0.020 8 0 "[ . 1]" 1
693 1 99 TYR QE 1 138 GLY QA 5.000 . 5.500 4.428 3.261 5.511 0.011 6 0 "[ . 1]" 1
694 1 100 GLY H 1 101 ASP H 4.650 . 4.650 2.934 2.667 3.286 . 0 0 "[ . 1]" 1
695 1 100 GLY QA 1 103 ALA MB 4.500 . 4.500 2.960 2.480 3.624 . 0 0 "[ . 1]" 1
696 1 101 ASP H 1 101 ASP QB 3.400 . 3.400 2.185 2.052 2.590 . 0 0 "[ . 1]" 1
697 1 101 ASP H 1 102 ILE H 3.400 . 3.400 2.818 2.711 2.961 . 0 0 "[ . 1]" 1
698 1 102 ILE H 1 102 ILE HB 3.640 . 3.640 2.763 2.601 3.027 . 0 0 "[ . 1]" 1
699 1 102 ILE H 1 102 ILE QG 4.750 . 4.750 1.928 1.873 1.967 . 0 0 "[ . 1]" 1
700 1 102 ILE H 1 102 ILE MD 4.410 . 4.410 2.721 1.938 3.361 . 0 0 "[ . 1]" 1
701 1 102 ILE H 1 103 ALA H 2.800 . 2.800 2.706 2.629 2.814 0.014 1 0 "[ . 1]" 1
702 1 102 ILE H 1 103 ALA MB 5.000 . 5.000 4.213 4.143 4.283 . 0 0 "[ . 1]" 1
703 1 102 ILE H 1 113 VAL QG 5.060 . 5.060 4.903 4.352 5.081 0.021 3 0 "[ . 1]" 1
704 1 102 ILE HA 1 102 ILE MD 4.330 . 4.330 3.891 3.776 3.951 . 0 0 "[ . 1]" 1
705 1 102 ILE HA 1 105 LYS H 4.260 . 4.260 3.521 3.366 3.617 . 0 0 "[ . 1]" 1
706 1 102 ILE HA 1 105 LYS QB 5.000 . 5.000 2.703 2.264 3.719 . 0 0 "[ . 1]" 1
707 1 102 ILE HB 1 103 ALA H 2.800 . 2.800 2.266 2.050 2.551 . 0 0 "[ . 1]" 1
708 1 102 ILE HB 1 103 ALA MB 5.000 . 5.000 3.686 3.552 3.872 . 0 0 "[ . 1]" 1
709 1 102 ILE HB 1 113 VAL HB 5.000 . 5.000 4.810 4.565 5.019 0.019 4 0 "[ . 1]" 1
710 1 102 ILE HB 1 113 VAL QG 4.000 . 4.000 3.146 2.621 3.367 . 0 0 "[ . 1]" 1
711 1 102 ILE MG 1 103 ALA H 5.000 . 5.000 3.500 3.103 3.917 . 0 0 "[ . 1]" 1
712 1 102 ILE MG 1 103 ALA HA 5.000 . 5.000 3.772 3.305 4.366 . 0 0 "[ . 1]" 1
713 1 102 ILE MG 1 105 LYS H 4.530 . 4.530 4.471 4.287 4.576 0.046 7 0 "[ . 1]" 1
714 1 102 ILE MG 1 106 LEU MD2 5.000 . 5.000 2.839 2.182 4.242 . 0 0 "[ . 1]" 1
715 1 102 ILE MG 1 106 LEU HG 5.000 . 5.000 3.649 2.619 4.634 . 0 0 "[ . 1]" 1
716 1 102 ILE QG 1 103 ALA MB 5.000 . 5.000 5.056 5.026 5.099 0.099 6 0 "[ . 1]" 1
717 1 102 ILE QG 1 131 VAL MG2 5.000 . 5.000 3.479 3.249 3.648 . 0 0 "[ . 1]" 1
718 1 102 ILE MD 1 110 PRO QB 5.000 . 5.000 5.037 5.007 5.087 0.087 8 0 "[ . 1]" 1
719 1 102 ILE MD 1 131 VAL MG1 4.380 . 4.380 1.733 1.705 1.773 0.075 2 0 "[ . 1]" 1
720 1 102 ILE MD 1 131 VAL MG2 4.130 . 4.130 2.043 1.836 2.361 . 0 0 "[ . 1]" 1
721 1 84 VAL MG1 1 103 ALA HA 5.000 4.000 5.000 5.047 5.025 5.070 0.070 2 0 "[ . 1]" 1
722 1 103 ALA H 1 103 ALA MB 2.800 . 2.800 2.034 1.989 2.085 . 0 0 "[ . 1]" 1
723 1 103 ALA H 1 104 LYS H 2.800 . 2.800 2.850 2.830 2.865 0.065 7 0 "[ . 1]" 1
724 1 103 ALA H 1 113 VAL QG 4.000 . 4.000 3.286 2.715 3.626 . 0 0 "[ . 1]" 1
725 1 103 ALA HA 1 108 THR H 4.370 . 4.370 3.905 3.499 4.403 0.033 8 0 "[ . 1]" 1
726 1 103 ALA HA 1 108 THR MG 4.370 . 4.370 2.354 1.856 3.529 . 0 0 "[ . 1]" 1
727 1 103 ALA HA 1 113 VAL QG 5.000 . 5.000 2.486 2.003 3.119 . 0 0 "[ . 1]" 1
728 1 103 ALA MB 1 104 LYS H 3.400 . 3.400 2.448 2.273 2.584 . 0 0 "[ . 1]" 1
729 1 103 ALA MB 1 109 SER HA 5.000 . 5.000 2.525 1.898 4.077 . 0 0 "[ . 1]" 1
730 1 103 ALA MB 1 110 PRO HA 4.000 . 4.000 2.403 1.830 2.916 . 0 0 "[ . 1]" 1
731 1 103 ALA MB 1 110 PRO QB 4.500 . 4.500 3.149 2.459 3.626 . 0 0 "[ . 1]" 1
732 1 103 ALA MB 1 113 VAL HB 4.000 . 4.000 3.171 2.906 3.498 . 0 0 "[ . 1]" 1
733 1 103 ALA MB 1 113 VAL QG 5.000 . 5.000 1.912 1.759 2.366 . 0 0 "[ . 1]" 1
734 1 104 LYS H 1 104 LYS QB 3.540 . 3.540 2.326 2.233 2.583 . 0 0 "[ . 1]" 1
735 1 104 LYS H 1 105 LYS H 2.800 . 2.800 2.685 2.628 2.757 . 0 0 "[ . 1]" 1
736 1 104 LYS HA 1 107 ASN H 5.000 2.300 5.000 3.929 3.276 4.785 . 0 0 "[ . 1]" 1
737 1 104 LYS QG 1 105 LYS H 4.810 . 4.810 3.671 2.126 4.399 . 0 0 "[ . 1]" 1
738 1 104 LYS QG 1 105 LYS HA 4.770 . 4.770 4.429 3.935 4.675 . 0 0 "[ . 1]" 1
739 1 104 LYS QD 1 105 LYS H 3.970 . 3.970 3.107 2.484 3.519 . 0 0 "[ . 1]" 1
740 1 104 LYS QD 1 106 LEU H 5.000 . 5.000 4.848 4.493 5.018 0.018 1 0 "[ . 1]" 1
741 1 105 LYS H 1 105 LYS QB 3.460 . 3.460 2.173 2.064 2.471 . 0 0 "[ . 1]" 1
742 1 105 LYS H 1 106 LEU H 2.800 . 2.800 2.591 2.510 2.665 . 0 0 "[ . 1]" 1
743 1 105 LYS QB 1 106 LEU H 4.830 . 4.830 2.879 2.635 3.739 . 0 0 "[ . 1]" 1
744 1 106 LEU H 1 106 LEU HA 2.800 . 2.800 2.888 2.881 2.895 0.095 2 0 "[ . 1]" 1
745 1 106 LEU H 1 106 LEU QB 3.450 . 3.450 2.705 2.449 2.977 . 0 0 "[ . 1]" 1
746 1 106 LEU H 1 106 LEU HG 2.990 . 2.990 2.205 1.875 2.997 0.007 1 0 "[ . 1]" 1
747 1 106 LEU H 1 106 LEU MD1 4.120 . 4.120 3.284 2.507 3.689 . 0 0 "[ . 1]" 1
748 1 106 LEU H 1 106 LEU MD2 5.000 . 5.000 3.034 1.992 4.179 . 0 0 "[ . 1]" 1
749 1 106 LEU H 1 107 ASN H 2.800 . 2.800 2.599 2.266 2.904 0.104 7 0 "[ . 1]" 1
750 1 106 LEU H 1 108 THR H 5.000 . 5.000 3.810 3.627 4.248 . 0 0 "[ . 1]" 1
751 1 106 LEU H 1 108 THR MG 5.000 2.500 5.000 3.931 3.532 4.527 . 0 0 "[ . 1]" 1
752 1 106 LEU HA 1 106 LEU MD1 4.360 . 4.360 3.960 3.655 4.130 . 0 0 "[ . 1]" 1
753 1 106 LEU QB 1 107 ASN H 5.000 . 5.000 2.745 1.803 3.572 . 0 0 "[ . 1]" 1
754 1 106 LEU QB 1 107 ASN HA 5.000 . 5.000 4.612 4.198 5.006 0.006 9 0 "[ . 1]" 1
755 1 106 LEU MD1 1 107 ASN H 5.000 . 5.000 3.904 2.295 4.991 . 0 0 "[ . 1]" 1
756 1 106 LEU MD2 1 113 VAL QG 5.000 . 5.000 4.015 2.921 4.887 . 0 0 "[ . 1]" 1
757 1 107 ASN H 1 107 ASN HA 2.800 . 2.800 2.491 2.270 2.805 0.005 10 0 "[ . 1]" 1
758 1 107 ASN H 1 107 ASN QB 3.670 . 3.670 3.114 2.968 3.407 . 0 0 "[ . 1]" 1
759 1 107 ASN H 1 108 THR H 2.800 . 2.800 2.244 1.885 2.680 . 0 0 "[ . 1]" 1
760 1 107 ASN HA 1 108 THR H 2.800 . 2.800 2.819 2.735 2.886 0.086 5 0 "[ . 1]" 1
761 1 108 THR H 1 108 THR HB 3.400 2.100 3.400 3.192 2.556 3.321 . 0 0 "[ . 1]" 1
762 1 108 THR H 1 108 THR MG 3.060 . 3.060 2.255 1.886 2.485 . 0 0 "[ . 1]" 1
763 1 108 THR HB 1 109 SER H 4.030 . 4.030 3.451 3.307 4.103 0.073 9 0 "[ . 1]" 1
764 1 108 THR HA 1 109 SER H 5.000 2.800 5.000 3.105 2.731 3.525 0.069 6 0 "[ . 1]" 1
765 1 108 THR MG 1 109 SER H 3.460 . 3.460 2.257 1.923 2.988 . 0 0 "[ . 1]" 1
766 1 108 THR MG 1 113 VAL H 5.000 . 5.000 3.807 2.539 4.777 . 0 0 "[ . 1]" 1
767 1 109 SER H 1 112 ALA MB 5.000 . 5.000 3.595 2.995 4.659 . 0 0 "[ . 1]" 1
768 1 109 SER QB 1 111 ARG HA 5.000 . 5.000 4.784 4.653 4.912 . 0 0 "[ . 1]" 1
769 1 109 SER QB 1 112 ALA MB 5.000 . 5.000 3.625 2.573 4.298 . 0 0 "[ . 1]" 1
770 1 110 PRO HA 1 113 VAL HB 4.200 . 4.200 2.688 2.316 3.068 . 0 0 "[ . 1]" 1
771 1 110 PRO HA 1 113 VAL QG 4.200 . 4.200 2.900 2.571 3.273 . 0 0 "[ . 1]" 1
772 1 111 ARG HA 1 114 GLY H 5.000 . 5.000 3.797 3.471 4.415 . 0 0 "[ . 1]" 1
773 1 111 ARG QB 1 112 ALA H 4.900 . 4.900 2.768 2.101 3.913 . 0 0 "[ . 1]" 1
774 1 111 ARG HA 1 112 ALA H 4.900 . 4.900 3.379 2.641 3.570 . 0 0 "[ . 1]" 1
775 1 110 PRO QB 1 111 ARG HA 5.000 . 5.000 4.057 3.890 4.245 . 0 0 "[ . 1]" 1
776 1 112 ALA H 1 112 ALA MB 3.400 . 3.400 2.297 2.041 2.896 . 0 0 "[ . 1]" 1
777 1 112 ALA H 1 113 VAL H 3.400 . 3.400 2.486 1.945 2.688 . 0 0 "[ . 1]" 1
778 1 112 ALA HA 1 113 VAL H 5.000 . 5.000 3.536 3.524 3.564 . 0 0 "[ . 1]" 1
779 1 112 ALA MB 1 115 MET QB 5.000 . 5.000 4.945 4.729 5.016 0.016 7 0 "[ . 1]" 1
780 1 112 ALA HA 1 115 MET QB 5.000 . 5.000 4.013 3.830 4.178 . 0 0 "[ . 1]" 1
781 1 113 VAL H 1 113 VAL HB 2.800 . 2.800 2.625 2.560 2.691 . 0 0 "[ . 1]" 1
782 1 113 VAL H 1 113 VAL QG 4.230 . 4.230 2.041 1.946 2.184 . 0 0 "[ . 1]" 1
783 1 113 VAL H 1 114 GLY H 3.400 . 3.400 2.599 2.567 2.622 . 0 0 "[ . 1]" 1
784 1 113 VAL HA 1 116 ALA MB 4.890 . 4.890 2.025 1.882 2.215 . 0 0 "[ . 1]" 1
785 1 113 VAL HB 1 114 GLY H 3.400 . 3.400 3.007 2.845 3.105 . 0 0 "[ . 1]" 1
786 1 113 VAL QG 1 114 GLY H 5.000 . 5.000 3.453 3.382 3.494 . 0 0 "[ . 1]" 1
787 1 113 VAL QG 1 114 GLY QA 5.000 . 5.000 3.677 3.637 3.746 . 0 0 "[ . 1]" 1
788 1 113 VAL QG 1 116 ALA HA 5.000 . 5.000 5.030 5.011 5.065 0.065 4 0 "[ . 1]" 1
789 1 113 VAL QG 1 116 ALA MB 5.000 . 5.000 2.523 2.435 2.611 . 0 0 "[ . 1]" 1
790 1 113 VAL QG 1 117 LEU QB 5.000 . 5.000 3.939 3.542 4.601 . 0 0 "[ . 1]" 1
791 1 114 GLY H 1 115 MET H 3.400 . 3.400 3.041 2.918 3.113 . 0 0 "[ . 1]" 1
792 1 114 GLY QA 1 117 LEU HG 5.000 . 5.000 3.633 3.197 4.151 . 0 0 "[ . 1]" 1
793 1 115 MET H 1 115 MET HA 2.800 . 2.800 2.791 2.787 2.795 . 0 0 "[ . 1]" 1
794 1 115 MET H 1 115 MET QB 3.480 . 3.480 2.196 2.077 2.637 . 0 0 "[ . 1]" 1
795 1 115 MET H 1 115 MET QG 4.280 . 4.280 3.226 2.282 3.913 . 0 0 "[ . 1]" 1
796 1 115 MET H 1 116 ALA H 3.400 . 3.400 2.694 2.677 2.711 . 0 0 "[ . 1]" 1
797 1 115 MET QB 1 116 ALA H 4.260 . 4.260 3.052 2.988 3.101 . 0 0 "[ . 1]" 1
798 1 116 ALA H 1 116 ALA MB 3.400 . 3.400 2.118 2.025 2.244 . 0 0 "[ . 1]" 1
799 1 116 ALA H 1 117 LEU H 3.400 . 3.400 3.254 3.087 3.338 . 0 0 "[ . 1]" 1
800 1 116 ALA HA 1 117 LEU H 5.000 3.400 5.000 3.547 3.531 3.572 . 0 0 "[ . 1]" 1
801 1 116 ALA MB 1 117 LEU H 3.400 . 3.400 1.904 1.856 1.945 . 0 0 "[ . 1]" 1
802 1 117 LEU H 1 117 LEU QB 3.890 . 3.890 2.650 2.549 2.869 . 0 0 "[ . 1]" 1
803 1 117 LEU H 1 117 LEU HG 5.000 . 5.000 1.943 1.810 1.996 . 0 0 "[ . 1]" 1
804 1 117 LEU H 1 117 LEU MD2 4.130 . 4.130 3.277 2.059 3.533 . 0 0 "[ . 1]" 1
805 1 117 LEU H 1 118 LYS H 4.350 . 4.350 2.751 2.703 2.780 . 0 0 "[ . 1]" 1
806 1 117 LEU HA 1 126 ILE MG 5.000 . 5.000 3.683 3.067 4.721 . 0 0 "[ . 1]" 1
807 1 117 LEU HA 1 126 ILE QG 5.000 . 5.000 4.819 4.172 5.026 0.026 6 0 "[ . 1]" 1
808 1 117 LEU QB 1 118 LYS H 5.000 . 5.000 3.570 2.944 3.716 . 0 0 "[ . 1]" 1
809 1 117 LEU QB 1 126 ILE HB 5.000 . 5.000 3.969 3.474 4.697 . 0 0 "[ . 1]" 1
810 1 117 LEU QB 1 126 ILE QG 5.000 . 5.000 4.493 3.877 4.812 . 0 0 "[ . 1]" 1
811 1 117 LEU QB 1 126 ILE MD 5.000 . 5.000 3.897 2.580 5.008 0.008 9 0 "[ . 1]" 1
812 1 117 LEU HG 1 131 VAL HB 5.000 . 5.000 4.965 4.756 5.038 0.038 8 0 "[ . 1]" 1
813 1 117 LEU HG 1 131 VAL MG1 5.000 . 5.000 4.481 4.050 4.728 . 0 0 "[ . 1]" 1
814 1 117 LEU MD2 1 128 CYS HA 5.000 . 5.000 2.313 1.898 4.513 . 0 0 "[ . 1]" 1
815 1 117 LEU HA 1 120 ASN H 5.000 . 5.000 3.359 3.054 3.620 . 0 0 "[ . 1]" 1
816 1 118 LYS H 1 118 LYS QB 3.460 . 3.460 2.137 2.040 2.388 . 0 0 "[ . 1]" 1
817 1 118 LYS H 1 119 ARG H 3.400 . 3.400 2.692 2.571 2.955 . 0 0 "[ . 1]" 1
818 1 118 LYS H 1 119 ARG QB 5.000 . 5.000 4.719 4.432 4.906 . 0 0 "[ . 1]" 1
819 1 118 LYS H 1 120 ASN H 5.000 . 5.000 3.928 3.733 4.171 . 0 0 "[ . 1]" 1
820 1 118 LYS HA 1 118 LYS QE 5.000 . 5.000 4.068 3.367 4.637 . 0 0 "[ . 1]" 1
821 1 118 LYS HA 1 119 ARG H 5.000 . 5.000 3.529 3.479 3.575 . 0 0 "[ . 1]" 1
822 1 118 LYS HA 1 120 ASN H 5.000 . 5.000 4.016 3.714 4.396 . 0 0 "[ . 1]" 1
823 1 118 LYS HA 1 141 SER QB 5.000 . 5.000 4.564 3.095 5.013 0.013 6 0 "[ . 1]" 1
824 1 119 ARG H 1 119 ARG QB 3.240 . 3.240 2.417 2.202 2.809 . 0 0 "[ . 1]" 1
825 1 119 ARG H 1 119 ARG QG 5.000 . 5.000 3.370 2.133 4.005 . 0 0 "[ . 1]" 1
826 1 119 ARG H 1 119 ARG QD 5.000 . 5.000 4.042 3.175 5.011 0.011 2 0 "[ . 1]" 1
827 1 119 ARG HA 1 119 ARG QD 5.000 . 5.000 3.800 3.000 4.249 . 0 0 "[ . 1]" 1
828 1 119 ARG HA 1 120 ASN QB 5.000 . 5.000 4.829 4.624 5.100 0.100 9 0 "[ . 1]" 1
829 1 120 ASN H 1 120 ASN QB 3.400 . 3.400 2.176 2.043 2.539 . 0 0 "[ . 1]" 1
830 1 122 LEU HG 1 125 ILE MG 5.000 . 5.000 4.523 3.005 5.032 0.032 1 0 "[ . 1]" 1
831 1 122 LEU HG 1 125 ILE MD 5.000 3.400 5.000 3.923 3.325 4.937 0.075 1 0 "[ . 1]" 1
832 1 122 LEU QD 1 125 ILE MG 5.000 . 5.000 3.507 2.713 4.819 . 0 0 "[ . 1]" 1
833 1 123 PRO HA 1 124 LEU H 5.000 2.300 5.000 3.246 2.463 3.561 . 0 0 "[ . 1]" 1
834 1 123 PRO QB 1 124 LEU H 4.510 . 4.510 3.182 2.437 3.904 . 0 0 "[ . 1]" 1
835 1 123 PRO QB 1 142 TYR QE 5.000 . 5.000 3.183 2.049 5.014 0.014 6 0 "[ . 1]" 1
836 1 124 LEU H 1 124 LEU QD 5.000 . 5.000 3.228 2.596 4.040 . 0 0 "[ . 1]" 1
837 1 124 LEU H 1 125 ILE MG 5.000 . 5.000 4.861 4.270 5.092 0.092 8 0 "[ . 1]" 1
838 1 124 LEU QD 1 150 ILE MG 5.000 . 5.000 4.696 3.844 5.009 0.009 10 0 "[ . 1]" 1
839 1 124 LEU QD 1 142 TYR QD 5.000 . 5.000 4.923 4.486 5.029 0.029 6 0 "[ . 1]" 1
840 1 125 ILE H 1 125 ILE HB 4.200 . 4.200 3.077 2.097 3.969 . 0 0 "[ . 1]" 1
841 1 125 ILE H 1 125 ILE QG 4.280 . 4.280 3.180 2.144 4.297 0.017 4 0 "[ . 1]" 1
842 1 125 ILE H 1 125 ILE MD 4.720 . 4.720 2.966 1.880 4.219 . 0 0 "[ . 1]" 1
843 1 125 ILE H 1 126 ILE H 4.120 . 4.120 2.450 1.834 2.766 . 0 0 "[ . 1]" 1
844 1 125 ILE HB 1 126 ILE H 4.750 . 4.750 3.520 2.666 4.366 . 0 0 "[ . 1]" 1
845 1 125 ILE QG 1 126 ILE H 5.000 . 5.000 3.568 2.265 4.807 . 0 0 "[ . 1]" 1
846 1 126 ILE H 1 126 ILE MG 3.930 . 3.930 3.675 2.751 3.792 . 0 0 "[ . 1]" 1
847 1 127 PRO HA 1 128 CYS H 3.400 . 3.400 2.912 2.685 3.214 . 0 0 "[ . 1]" 1
848 1 127 PRO HA 1 129 HIS H 5.000 . 5.000 3.300 3.087 3.662 . 0 0 "[ . 1]" 1
849 1 84 VAL MG1 1 128 CYS HA 5.000 . 5.000 4.975 4.798 5.039 0.039 2 0 "[ . 1]" 1
850 1 128 CYS H 1 129 HIS H 5.000 . 5.000 2.709 2.647 2.775 . 0 0 "[ . 1]" 1
851 1 128 CYS HA 1 131 VAL MG2 5.000 . 5.000 2.600 2.296 2.905 . 0 0 "[ . 1]" 1
852 1 129 HIS H 1 130 ARG H 4.400 . 4.400 2.656 2.600 2.737 . 0 0 "[ . 1]" 1
853 1 129 HIS H 1 130 ARG QB 5.000 . 5.000 4.698 4.419 4.899 . 0 0 "[ . 1]" 1
854 1 129 HIS H 1 131 VAL MG2 5.000 . 5.000 4.394 4.179 4.670 . 0 0 "[ . 1]" 1
855 1 129 HIS H 1 151 LEU QD 5.000 . 5.000 4.839 4.484 5.007 0.007 3 0 "[ . 1]" 1
856 1 129 HIS HA 1 131 VAL MG2 5.000 . 5.000 4.943 4.735 5.036 0.036 8 0 "[ . 1]" 1
857 1 129 HIS HA 1 151 LEU QD 5.000 . 5.000 3.267 2.989 3.491 . 0 0 "[ . 1]" 1
858 1 129 HIS QB 1 150 ILE MG 5.000 . 5.000 3.647 3.347 4.124 . 0 0 "[ . 1]" 1
859 1 129 HIS QB 1 150 ILE MD 5.000 . 5.000 4.345 3.351 4.846 . 0 0 "[ . 1]" 1
860 1 129 HIS HD2 1 150 ILE MG 5.000 . 5.000 3.787 1.975 4.814 . 0 0 "[ . 1]" 1
861 1 129 HIS HD2 1 151 LEU QD 4.000 . 4.000 3.129 2.151 4.004 0.004 7 0 "[ . 1]" 1
862 1 124 LEU QD 1 129 HIS HE1 5.000 . 5.000 3.960 2.630 5.004 0.004 9 0 "[ . 1]" 1
863 1 130 ARG H 1 130 ARG QB 3.840 . 3.840 2.410 2.205 2.562 . 0 0 "[ . 1]" 1
864 1 130 ARG H 1 131 VAL H 3.400 . 3.400 2.980 2.621 3.222 . 0 0 "[ . 1]" 1
865 1 130 ARG H 1 131 VAL HB 5.500 . 5.500 4.965 4.806 5.149 . 0 0 "[ . 1]" 1
866 1 130 ARG H 1 131 VAL MG2 4.780 . 4.780 3.225 3.102 3.383 . 0 0 "[ . 1]" 1
867 1 131 VAL H 1 131 VAL HB 3.400 2.400 3.400 3.007 2.797 3.194 . 0 0 "[ . 1]" 1
868 1 131 VAL H 1 132 VAL MG2 5.000 . 5.000 4.791 4.557 5.017 0.017 5 0 "[ . 1]" 1
869 1 131 VAL HA 1 132 VAL H 3.400 2.100 3.400 2.321 2.235 2.362 . 0 0 "[ . 1]" 1
870 1 131 VAL MG1 1 132 VAL H 5.000 . 5.000 3.623 3.423 3.715 . 0 0 "[ . 1]" 1
871 1 131 VAL MG1 1 132 VAL MG1 5.000 2.100 5.000 4.859 4.756 5.007 0.007 7 0 "[ . 1]" 1
872 1 131 VAL MG2 1 132 VAL H 5.000 . 5.000 4.382 4.352 4.429 . 0 0 "[ . 1]" 1
873 1 132 VAL H 1 132 VAL MG1 3.360 . 3.360 2.460 2.311 2.768 . 0 0 "[ . 1]" 1
874 1 132 VAL HA 1 133 ALA H 2.800 . 2.800 2.523 2.291 2.616 . 0 0 "[ . 1]" 1
875 1 132 VAL HB 1 133 ALA H 2.800 . 2.800 2.195 1.990 2.658 . 0 0 "[ . 1]" 1
876 1 132 VAL HB 1 137 LEU HA 4.200 . 4.200 3.241 2.568 4.201 0.001 6 0 "[ . 1]" 1
877 1 132 VAL HB 1 136 SER HA 4.200 . 4.200 3.099 2.706 3.797 . 0 0 "[ . 1]" 1
878 1 132 VAL MG1 1 133 ALA H 3.780 . 3.780 3.673 3.507 3.793 0.013 6 0 "[ . 1]" 1
879 1 132 VAL MG2 1 133 ALA H 3.690 . 3.690 3.076 2.767 3.586 . 0 0 "[ . 1]" 1
880 1 133 ALA HA 1 134 LYS H 3.400 . 3.400 2.657 2.236 3.459 0.059 9 0 "[ . 1]" 1
881 1 133 ALA H 1 137 LEU HA 4.930 . 4.930 3.829 2.815 4.531 . 0 0 "[ . 1]" 1
882 1 133 ALA MB 1 134 LYS H 3.400 . 3.400 2.204 1.961 2.887 . 0 0 "[ . 1]" 1
883 1 133 ALA MB 1 136 SER H 5.000 . 5.000 3.405 2.983 3.909 . 0 0 "[ . 1]" 1
884 1 133 ALA MB 1 138 GLY H 5.000 . 5.000 4.489 2.800 5.012 0.012 9 0 "[ . 1]" 1
885 1 133 ALA MB 1 138 GLY QA 5.000 . 5.000 3.338 2.641 4.576 . 0 0 "[ . 1]" 1
886 1 133 ALA MB 1 135 ASN H 5.000 . 5.000 2.960 2.601 3.986 . 0 0 "[ . 1]" 1
887 1 134 LYS H 1 134 LYS QB 3.720 . 3.720 2.212 2.044 3.045 . 0 0 "[ . 1]" 1
888 1 134 LYS QB 1 135 ASN HA 3.800 . 3.800 3.794 3.724 3.835 0.035 6 0 "[ . 1]" 1
889 1 134 LYS HA 1 135 ASN H 5.000 . 5.000 3.547 3.500 3.571 . 0 0 "[ . 1]" 1
890 1 135 ASN HA 1 136 SER H 3.400 . 3.400 3.470 3.242 3.522 0.122 5 0 "[ . 1]" 1
891 1 135 ASN QB 1 136 SER H 3.400 . 3.400 2.251 1.891 3.447 0.047 6 0 "[ . 1]" 1
892 1 135 ASN HA 1 136 SER HA 5.000 . 5.000 4.760 4.560 4.989 . 0 0 "[ . 1]" 1
893 1 136 SER QB 1 137 LEU H 3.500 . 3.500 2.882 2.070 3.450 . 0 0 "[ . 1]" 1
894 1 136 SER HA 1 137 LEU H 3.400 . 3.400 2.551 2.152 3.481 0.081 3 0 "[ . 1]" 1
895 1 137 LEU QD 1 147 LYS H 5.000 . 5.000 4.809 4.445 5.003 0.003 8 0 "[ . 1]" 1
896 1 137 LEU QD 1 147 LYS QB 5.000 . 5.000 2.627 2.327 2.753 . 0 0 "[ . 1]" 1
897 1 137 LEU QD 1 148 LYS H 5.000 . 5.000 3.747 2.932 4.165 . 0 0 "[ . 1]" 1
898 1 137 LEU QD 1 148 LYS HA 5.000 . 5.000 2.997 2.067 4.032 . 0 0 "[ . 1]" 1
899 1 137 LEU QD 1 148 LYS QB 5.000 . 5.000 3.507 2.179 4.259 . 0 0 "[ . 1]" 1
900 1 137 LEU QB 1 147 LYS QB 5.000 . 5.000 4.724 3.791 5.013 0.013 4 0 "[ . 1]" 1
901 1 137 LEU H 1 137 LEU QD 5.000 . 5.000 3.184 2.166 4.048 . 0 0 "[ . 1]" 1
902 1 137 LEU HA 1 138 GLY H 5.000 . 5.000 2.327 2.141 3.575 . 0 0 "[ . 1]" 1
903 1 139 GLY QA 1 144 LEU MD2 5.000 . 5.000 3.828 2.292 5.005 0.005 5 0 "[ . 1]" 1
904 1 141 SER QB 1 142 TYR H 5.000 . 5.000 2.806 1.959 3.997 . 0 0 "[ . 1]" 1
905 1 142 TYR H 1 142 TYR QD 5.000 . 5.000 4.274 4.002 4.501 . 0 0 "[ . 1]" 1
906 1 142 TYR H 1 143 GLY H 3.960 . 3.960 3.338 2.291 3.976 0.016 1 0 "[ . 1]" 1
907 1 142 TYR HA 1 142 TYR QE 5.000 . 5.000 4.432 4.104 4.652 . 0 0 "[ . 1]" 1
908 1 143 GLY H 1 144 LEU QB 4.280 . 4.280 4.089 3.220 4.356 0.076 6 0 "[ . 1]" 1
909 1 143 GLY H 1 144 LEU QD 4.970 . 4.970 4.384 3.705 4.990 0.020 6 0 "[ . 1]" 1
910 1 143 GLY QA 1 144 LEU QD 5.000 . 5.000 4.399 3.509 4.874 . 0 0 "[ . 1]" 1
911 1 144 LEU HA 1 147 LYS H 5.000 . 5.000 3.784 3.099 4.866 . 0 0 "[ . 1]" 1
912 1 144 LEU QB 1 145 ASP H 5.000 . 5.000 2.488 1.896 3.324 . 0 0 "[ . 1]" 1
913 1 145 ASP H 1 145 ASP HA 2.800 . 2.800 2.811 2.796 2.823 0.023 1 0 "[ . 1]" 1
914 1 145 ASP H 1 145 ASP QB 3.720 . 3.720 2.378 2.091 2.674 . 0 0 "[ . 1]" 1
915 1 145 ASP QB 1 149 PHE H 5.000 . 5.000 4.729 4.390 5.007 0.007 10 0 "[ . 1]" 1
916 1 145 ASP HA 1 148 LYS QD 5.000 . 5.000 3.195 2.151 4.632 . 0 0 "[ . 1]" 1
917 1 145 ASP HA 1 146 LYS H 4.000 . 4.000 3.494 3.428 3.560 . 0 0 "[ . 1]" 1
918 1 146 LYS H 1 147 LYS H 4.280 . 4.280 2.686 2.551 2.901 . 0 0 "[ . 1]" 1
919 1 146 LYS H 1 149 PHE QB 5.000 . 5.000 4.887 4.287 5.033 0.033 10 0 "[ . 1]" 1
920 1 146 LYS H 1 149 PHE QD 5.000 . 5.000 4.852 4.551 5.026 0.026 4 0 "[ . 1]" 1
921 1 147 LYS H 1 147 LYS QB 3.720 . 3.720 2.218 2.036 2.513 . 0 0 "[ . 1]" 1
922 1 147 LYS H 1 148 LYS H 3.760 . 3.760 2.692 2.612 2.782 . 0 0 "[ . 1]" 1
923 1 147 LYS HA 1 150 ILE MD 5.000 . 5.000 2.770 1.875 3.421 . 0 0 "[ . 1]" 1
924 1 147 LYS HA 1 150 ILE QG 5.000 . 5.000 3.912 2.922 4.546 . 0 0 "[ . 1]" 1
925 1 147 LYS QB 1 148 LYS H 5.000 . 5.000 2.743 2.472 2.911 . 0 0 "[ . 1]" 1
926 1 148 LYS H 1 148 LYS QB 3.460 . 3.460 2.229 2.050 2.760 . 0 0 "[ . 1]" 1
927 1 148 LYS H 1 149 PHE H 4.360 . 4.360 2.682 2.563 2.821 . 0 0 "[ . 1]" 1
928 1 148 LYS HA 1 148 LYS QD 5.000 . 5.000 3.708 3.202 4.072 . 0 0 "[ . 1]" 1
929 1 148 LYS QB 1 149 PHE H 3.620 . 3.620 2.573 2.272 3.192 . 0 0 "[ . 1]" 1
930 1 148 LYS HA 1 152 GLU QB 5.000 . 5.000 4.861 4.382 5.010 0.010 1 0 "[ . 1]" 1
931 1 149 PHE H 1 149 PHE QB 3.420 . 3.420 2.153 2.075 2.265 . 0 0 "[ . 1]" 1
932 1 149 PHE H 1 149 PHE QD 5.450 . 5.450 3.326 2.970 4.145 . 0 0 "[ . 1]" 1
933 1 149 PHE H 1 150 ILE H 5.000 . 5.000 2.904 2.713 3.033 . 0 0 "[ . 1]" 1
934 1 149 PHE QB 1 150 ILE QG 5.000 . 5.000 3.085 2.920 3.231 . 0 0 "[ . 1]" 1
935 1 149 PHE QD 1 150 ILE H 5.000 . 5.000 4.341 3.264 4.735 . 0 0 "[ . 1]" 1
936 1 150 ILE H 1 150 ILE QG 4.530 . 4.530 1.959 1.906 2.098 . 0 0 "[ . 1]" 1
937 1 150 ILE HA 1 153 ARG H 5.000 . 5.000 3.372 3.004 3.683 . 0 0 "[ . 1]" 1
938 1 150 ILE HB 1 151 LEU H 3.890 . 3.890 2.524 2.123 2.973 . 0 0 "[ . 1]" 1
939 1 150 ILE MG 1 151 LEU H 5.000 . 5.000 3.466 2.951 3.838 . 0 0 "[ . 1]" 1
940 1 150 ILE MG 1 151 LEU QD 5.000 . 5.000 3.358 2.231 4.103 . 0 0 "[ . 1]" 1
941 1 151 LEU H 1 151 LEU QB 3.710 . 3.710 2.115 2.051 2.252 . 0 0 "[ . 1]" 1
942 1 151 LEU H 1 151 LEU QD 5.000 . 5.000 2.668 2.032 3.285 . 0 0 "[ . 1]" 1
943 1 151 LEU H 1 152 GLU H 4.390 . 4.390 2.705 2.572 2.834 . 0 0 "[ . 1]" 1
944 1 152 GLU H 1 152 GLU QB 3.160 . 3.160 2.236 2.096 2.567 . 0 0 "[ . 1]" 1
945 1 152 GLU H 1 153 ARG H 3.400 . 3.400 2.427 2.198 2.677 . 0 0 "[ . 1]" 1
946 1 152 GLU QB 1 153 ARG H 5.000 . 5.000 2.650 2.326 3.630 . 0 0 "[ . 1]" 1
947 1 153 ARG H 1 153 ARG QB 3.420 . 3.420 2.346 2.075 2.657 . 0 0 "[ . 1]" 1
948 1 153 ARG H 1 154 GLU H 3.840 . 3.840 2.798 2.698 3.049 . 0 0 "[ . 1]" 1
949 1 153 ARG HA 1 156 LEU QB 5.000 . 5.000 2.809 2.318 3.213 . 0 0 "[ . 1]" 1
950 1 153 ARG HA 1 156 LEU QD 5.000 . 5.000 3.264 2.058 3.884 . 0 0 "[ . 1]" 1
951 1 153 ARG QB 1 156 LEU QD 5.000 . 5.000 4.684 3.995 5.015 0.015 7 0 "[ . 1]" 1
952 1 153 ARG QB 1 157 ASN QB 5.000 . 5.000 4.502 3.969 5.008 0.008 7 0 "[ . 1]" 1
953 1 154 GLU H 1 155 ARG H 5.000 . 5.000 2.879 2.679 3.043 . 0 0 "[ . 1]" 1
954 1 155 ARG HA 1 158 MET QG 5.000 . 5.000 4.337 3.337 5.002 0.002 8 0 "[ . 1]" 1
955 1 155 ARG H 1 155 ARG QB 3.810 . 3.810 2.223 2.039 2.559 . 0 0 "[ . 1]" 1
956 1 155 ARG H 1 156 LEU H 4.470 . 4.470 2.747 2.709 2.827 . 0 0 "[ . 1]" 1
957 1 156 LEU H 1 156 LEU QB 3.570 . 3.570 2.235 2.046 2.441 . 0 0 "[ . 1]" 1
958 1 156 LEU H 1 156 LEU QD 5.000 . 5.000 3.239 2.023 3.807 . 0 0 "[ . 1]" 1
959 1 158 MET H 1 158 MET QB 3.720 . 3.720 2.572 2.174 3.152 . 0 0 "[ . 1]" 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 103
_Distance_constraint_stats_list.Viol_count 285
_Distance_constraint_stats_list.Viol_total 90.686
_Distance_constraint_stats_list.Viol_max 0.165
_Distance_constraint_stats_list.Viol_rms 0.0216
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0088
_Distance_constraint_stats_list.Viol_average_violations_only 0.0318
_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 1 MET 0.139 0.043 2 0 "[ . 1]"
1 3 ILE 0.257 0.040 3 0 "[ . 1]"
1 5 ILE 0.298 0.076 5 0 "[ . 1]"
1 7 GLU 0.753 0.095 5 0 "[ . 1]"
1 8 TYR 0.298 0.076 5 0 "[ . 1]"
1 9 PHE 1.128 0.165 3 0 "[ . 1]"
1 10 ILE 0.257 0.040 3 0 "[ . 1]"
1 11 GLY 1.127 0.136 4 0 "[ . 1]"
1 12 MET 0.139 0.043 2 0 "[ . 1]"
1 13 ILE 0.608 0.119 8 0 "[ . 1]"
1 21 ARG 0.608 0.119 8 0 "[ . 1]"
1 22 ASN 0.640 0.076 8 0 "[ . 1]"
1 23 THR 1.127 0.136 4 0 "[ . 1]"
1 25 PRO 1.128 0.165 3 0 "[ . 1]"
1 26 LEU 0.753 0.095 5 0 "[ . 1]"
1 47 HIS 0.125 0.025 10 0 "[ . 1]"
1 48 LEU 0.100 0.034 6 0 "[ . 1]"
1 49 LYS 0.116 0.033 8 0 "[ . 1]"
1 50 VAL 0.010 0.007 1 0 "[ . 1]"
1 51 ALA 0.125 0.025 10 0 "[ . 1]"
1 52 GLU 0.114 0.034 6 0 "[ . 1]"
1 53 ILE 0.164 0.033 8 0 "[ . 1]"
1 54 ILE 0.010 0.007 1 0 "[ . 1]"
1 55 LEU 0.009 0.009 7 0 "[ . 1]"
1 56 LYS 0.143 0.033 8 0 "[ . 1]"
1 57 LEU 0.112 0.042 8 0 "[ . 1]"
1 58 TYR 0.000 0.000 . 0 "[ . 1]"
1 59 PHE 0.009 0.009 7 0 "[ . 1]"
1 60 ALA 0.064 0.042 8 0 "[ . 1]"
1 61 GLU 0.129 0.033 8 0 "[ . 1]"
1 68 ARG 0.133 0.030 7 0 "[ . 1]"
1 71 ILE 0.133 0.030 7 0 "[ . 1]"
1 81 THR 0.063 0.054 9 0 "[ . 1]"
1 82 LYS 0.000 0.000 . 0 "[ . 1]"
1 83 LYS 0.432 0.080 1 0 "[ . 1]"
1 84 VAL 0.968 0.114 5 0 "[ . 1]"
1 85 LEU 0.186 0.054 9 0 "[ . 1]"
1 86 ASP 0.000 0.000 . 0 "[ . 1]"
1 87 ILE 0.732 0.080 1 0 "[ . 1]"
1 88 VAL 0.968 0.114 5 0 "[ . 1]"
1 89 LYS 0.123 0.026 7 0 "[ . 1]"
1 90 ASP 0.043 0.036 5 0 "[ . 1]"
1 91 ILE 0.257 0.066 2 0 "[ . 1]"
1 92 GLU 0.275 0.057 5 0 "[ . 1]"
1 95 LYS 0.275 0.057 5 0 "[ . 1]"
1 97 LEU 0.026 0.012 9 0 "[ . 1]"
1 100 GLY 0.011 0.011 2 0 "[ . 1]"
1 101 ASP 0.141 0.035 9 0 "[ . 1]"
1 102 ILE 0.060 0.021 2 0 "[ . 1]"
1 104 LYS 0.011 0.011 2 0 "[ . 1]"
1 105 LYS 0.141 0.035 9 0 "[ . 1]"
1 106 LEU 0.060 0.021 2 0 "[ . 1]"
1 110 PRO 0.087 0.063 8 0 "[ . 1]"
1 112 ALA 0.091 0.020 9 0 "[ . 1]"
1 113 VAL 0.070 0.023 2 0 "[ . 1]"
1 114 GLY 0.087 0.063 8 0 "[ . 1]"
1 116 ALA 0.091 0.020 9 0 "[ . 1]"
1 117 LEU 0.070 0.023 2 0 "[ . 1]"
1 118 LYS 0.000 0.000 . 0 "[ . 1]"
1 121 PRO 0.640 0.076 8 0 "[ . 1]"
1 122 LEU 0.418 0.074 9 0 "[ . 1]"
1 126 ILE 0.469 0.074 9 0 "[ . 1]"
1 127 PRO 0.091 0.032 5 0 "[ . 1]"
1 128 CYS 0.065 0.024 1 0 "[ . 1]"
1 130 ARG 0.117 0.032 5 0 "[ . 1]"
1 131 VAL 0.013 0.012 10 0 "[ . 1]"
1 132 VAL 0.000 0.000 . 0 "[ . 1]"
1 144 LEU 0.046 0.046 5 0 "[ . 1]"
1 145 ASP 0.000 0.000 . 0 "[ . 1]"
1 146 LYS 0.038 0.034 4 0 "[ . 1]"
1 147 LYS 0.000 0.000 . 0 "[ . 1]"
1 148 LYS 0.046 0.046 5 0 "[ . 1]"
1 149 PHE 0.051 0.016 8 0 "[ . 1]"
1 150 ILE 0.053 0.034 4 0 "[ . 1]"
1 151 LEU 0.000 0.000 . 0 "[ . 1]"
1 152 GLU 0.000 0.000 . 0 "[ . 1]"
1 153 ARG 0.051 0.016 8 0 "[ . 1]"
1 154 GLU 0.015 0.014 5 0 "[ . 1]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET O 1 12 MET N 3.000 2.800 3.400 3.108 3.008 3.351 . 0 0 "[ . 1]" 2
2 1 1 MET O 1 12 MET H 2.000 . 2.600 2.532 2.235 2.643 0.043 2 0 "[ . 1]" 2
3 1 3 ILE N 1 10 ILE O 3.000 2.800 3.400 3.280 2.780 3.408 0.020 5 0 "[ . 1]" 2
4 1 3 ILE H 1 10 ILE O 2.000 . 2.600 2.531 2.017 2.640 0.040 3 0 "[ . 1]" 2
5 1 3 ILE O 1 10 ILE N 3.000 2.800 3.400 2.940 2.768 3.331 0.032 7 0 "[ . 1]" 2
6 1 3 ILE O 1 10 ILE H 2.000 . 2.600 2.200 1.959 2.600 . 8 0 "[ . 1]" 2
7 1 5 ILE O 1 8 TYR N 3.000 2.800 3.400 2.934 2.750 3.269 0.050 5 0 "[ . 1]" 2
8 1 5 ILE O 1 8 TYR H 2.000 . 2.600 2.104 1.833 2.472 . 0 0 "[ . 1]" 2
9 1 5 ILE N 1 8 TYR O 3.000 2.800 3.400 3.217 2.861 3.411 0.011 2 0 "[ . 1]" 2
10 1 5 ILE H 1 8 TYR O 2.000 . 2.600 2.515 2.062 2.676 0.076 5 0 "[ . 1]" 2
11 1 13 ILE N 1 21 ARG O 3.000 2.800 3.400 2.752 2.681 2.872 0.119 8 0 "[ . 1]" 2
12 1 13 ILE H 1 21 ARG O 2.000 . 2.600 1.828 1.727 2.014 . 0 0 "[ . 1]" 2
13 1 13 ILE O 1 21 ARG N 3.000 2.800 3.400 3.305 3.228 3.402 0.002 8 0 "[ . 1]" 2
14 1 13 ILE O 1 21 ARG H 2.000 . 2.600 2.512 2.349 2.627 0.027 10 0 "[ . 1]" 2
15 1 11 GLY O 1 23 THR N 3.000 2.800 3.400 3.357 3.241 3.458 0.058 8 0 "[ . 1]" 2
16 1 11 GLY O 1 23 THR H 2.000 . 2.600 2.690 2.636 2.736 0.136 4 0 "[ . 1]" 2
17 1 11 GLY N 1 23 THR O 3.000 2.800 3.400 2.918 2.758 3.414 0.042 1 0 "[ . 1]" 2
18 1 11 GLY H 1 23 THR O 2.000 . 2.600 2.127 1.814 2.611 0.011 7 0 "[ . 1]" 2
19 1 22 ASN N 1 121 PRO O 3.000 2.800 3.400 3.453 3.422 3.476 0.076 8 0 "[ . 1]" 2
20 1 22 ASN H 1 121 PRO O 2.000 . 2.600 2.578 2.467 2.667 0.067 4 0 "[ . 1]" 2
21 1 9 PHE N 1 25 PRO O 3.000 2.800 3.400 3.461 3.055 3.565 0.165 3 0 "[ . 1]" 2
22 1 9 PHE H 1 25 PRO O 2.000 . 2.600 2.546 2.124 2.665 0.065 10 0 "[ . 1]" 2
23 1 7 GLU O 1 26 LEU N 3.000 2.800 3.800 3.107 2.877 3.456 . 0 0 "[ . 1]" 2
24 1 7 GLU O 1 26 LEU H 2.000 . 2.800 2.875 2.862 2.895 0.095 5 0 "[ . 1]" 2
25 1 47 HIS O 1 51 ALA N 3.000 2.800 3.400 3.028 2.775 3.411 0.025 10 0 "[ . 1]" 2
26 1 47 HIS O 1 51 ALA H 2.000 . 2.600 2.209 1.859 2.622 0.022 5 0 "[ . 1]" 2
27 1 48 LEU O 1 52 GLU N 3.000 2.800 3.400 3.246 2.795 3.434 0.034 6 0 "[ . 1]" 2
28 1 48 LEU O 1 52 GLU H 2.000 . 2.600 2.300 1.898 2.526 . 0 0 "[ . 1]" 2
29 1 49 LYS O 1 53 ILE N 3.000 2.800 3.400 3.410 3.386 3.433 0.033 8 0 "[ . 1]" 2
30 1 49 LYS O 1 53 ILE H 2.000 . 2.600 2.564 2.516 2.596 . 0 0 "[ . 1]" 2
31 1 50 VAL O 1 54 ILE N 3.000 2.800 3.400 2.886 2.793 3.004 0.007 1 0 "[ . 1]" 2
32 1 50 VAL O 1 54 ILE H 2.000 . 2.600 1.930 1.824 2.062 . 0 0 "[ . 1]" 2
33 1 51 ALA O 1 55 LEU N 3.000 2.800 3.400 3.099 2.918 3.281 . 0 0 "[ . 1]" 2
34 1 51 ALA O 1 55 LEU H 2.000 . 2.600 2.142 1.941 2.330 . 0 0 "[ . 1]" 2
35 1 52 GLU O 1 56 LYS N 3.000 2.800 3.400 3.229 2.976 3.408 0.008 9 0 "[ . 1]" 2
36 1 52 GLU O 1 56 LYS H 2.000 . 2.600 2.354 2.117 2.528 . 0 0 "[ . 1]" 2
37 1 53 ILE O 1 57 LEU N 3.000 2.800 3.400 3.296 3.040 3.430 0.030 10 0 "[ . 1]" 2
38 1 53 ILE O 1 57 LEU H 2.000 . 2.600 2.381 2.062 2.571 . 0 0 "[ . 1]" 2
39 1 54 ILE O 1 58 TYR N 3.000 2.800 3.400 3.073 2.849 3.352 . 0 0 "[ . 1]" 2
40 1 54 ILE O 1 58 TYR H 2.000 . 2.600 2.174 1.893 2.426 . 0 0 "[ . 1]" 2
41 1 55 LEU O 1 59 PHE N 3.000 2.800 3.400 2.982 2.791 3.155 0.009 7 0 "[ . 1]" 2
42 1 55 LEU O 1 59 PHE H 2.000 . 2.600 2.112 1.890 2.282 . 0 0 "[ . 1]" 2
43 1 57 LEU O 1 60 ALA N 3.000 2.800 3.400 3.222 3.003 3.400 0.000 4 0 "[ . 1]" 2
44 1 57 LEU O 1 60 ALA H 2.000 . 2.600 2.482 2.095 2.642 0.042 8 0 "[ . 1]" 2
45 1 56 LYS O 1 61 GLU N 3.000 2.800 3.400 3.227 2.967 3.417 0.017 2 0 "[ . 1]" 2
46 1 56 LYS O 1 61 GLU H 2.000 . 2.600 2.573 2.390 2.633 0.033 8 0 "[ . 1]" 2
47 1 68 ARG O 1 71 ILE H 2.000 . 2.600 1.952 1.826 2.257 . 0 0 "[ . 1]" 2
48 1 68 ARG O 1 71 ILE N 3.000 2.800 3.400 2.841 2.770 3.158 0.030 7 0 "[ . 1]" 2
49 1 81 THR O 1 85 LEU N 3.000 2.800 3.400 3.148 2.828 3.454 0.054 9 0 "[ . 1]" 2
50 1 81 THR O 1 85 LEU H 2.000 . 2.600 2.247 1.976 2.544 . 0 0 "[ . 1]" 2
51 1 82 LYS O 1 86 ASP N 3.000 2.800 3.400 3.138 2.958 3.270 . 0 0 "[ . 1]" 2
52 1 82 LYS O 1 86 ASP H 2.000 . 2.600 2.310 2.145 2.427 . 0 0 "[ . 1]" 2
53 1 83 LYS O 1 87 ILE N 3.000 2.800 3.400 3.281 3.184 3.361 . 0 0 "[ . 1]" 2
54 1 83 LYS O 1 87 ILE H 2.000 . 2.600 2.643 2.609 2.680 0.080 1 0 "[ . 1]" 2
55 1 84 VAL O 1 88 VAL N 3.000 2.800 3.400 3.473 3.441 3.514 0.114 5 0 "[ . 1]" 2
56 1 84 VAL O 1 88 VAL H 2.000 . 2.600 2.623 2.596 2.667 0.067 5 0 "[ . 1]" 2
57 1 85 LEU O 1 89 LYS N 3.000 2.800 3.400 3.377 3.155 3.426 0.026 7 0 "[ . 1]" 2
58 1 85 LEU O 1 89 LYS H 2.000 . 2.600 2.530 2.326 2.610 0.010 9 0 "[ . 1]" 2
59 1 87 ILE O 1 90 ASP N 3.000 2.800 3.400 3.164 2.804 3.436 0.036 5 0 "[ . 1]" 2
60 1 87 ILE O 1 90 ASP H 2.000 . 2.600 2.274 1.906 2.607 0.007 2 0 "[ . 1]" 2
61 1 87 ILE O 1 91 ILE N 3.000 2.800 3.400 2.811 2.734 2.961 0.066 2 0 "[ . 1]" 2
62 1 87 ILE O 1 91 ILE H 2.000 . 2.600 1.941 1.844 2.084 . 0 0 "[ . 1]" 2
63 1 92 GLU O 1 95 LYS N 3.000 2.800 3.400 3.418 3.337 3.457 0.057 5 0 "[ . 1]" 2
64 1 92 GLU O 1 95 LYS H 2.000 . 2.600 2.523 2.370 2.611 0.011 8 0 "[ . 1]" 2
65 1 97 LEU N 1 130 ARG O 3.000 2.800 3.400 2.982 2.788 3.410 0.012 9 0 "[ . 1]" 2
66 1 97 LEU H 1 130 ARG O 2.000 . 2.600 2.327 2.103 2.565 . 0 0 "[ . 1]" 2
67 1 100 GLY O 1 104 LYS N 3.000 2.800 3.400 2.923 2.789 3.176 0.011 2 0 "[ . 1]" 2
68 1 100 GLY O 1 104 LYS H 2.000 . 2.600 2.018 1.871 2.225 . 0 0 "[ . 1]" 2
69 1 101 ASP O 1 105 LYS N 3.000 2.800 3.400 3.295 3.185 3.422 0.022 9 0 "[ . 1]" 2
70 1 101 ASP O 1 105 LYS H 2.000 . 2.600 2.553 2.345 2.635 0.035 9 0 "[ . 1]" 2
71 1 102 ILE O 1 106 LEU N 3.000 2.800 3.400 3.163 2.793 3.417 0.017 10 0 "[ . 1]" 2
72 1 102 ILE O 1 106 LEU H 2.000 . 2.600 2.375 2.021 2.621 0.021 2 0 "[ . 1]" 2
73 1 110 PRO O 1 114 GLY N 3.000 2.800 3.400 3.203 2.945 3.463 0.063 8 0 "[ . 1]" 2
74 1 110 PRO O 1 114 GLY H 2.000 . 2.600 2.481 2.315 2.578 . 0 0 "[ . 1]" 2
75 1 112 ALA O 1 116 ALA N 3.000 2.800 3.400 3.362 3.274 3.419 0.019 1 0 "[ . 1]" 2
76 1 112 ALA O 1 116 ALA H 2.000 . 2.600 2.599 2.566 2.620 0.020 9 0 "[ . 1]" 2
77 1 113 VAL O 1 117 LEU N 3.000 2.800 3.400 3.379 3.198 3.423 0.023 2 0 "[ . 1]" 2
78 1 113 VAL O 1 117 LEU H 2.000 . 2.600 2.517 2.284 2.604 0.004 2 0 "[ . 1]" 2
79 1 114 GLY O 1 118 LYS H 2.000 . 2.600 2.413 2.261 2.564 . 0 0 "[ . 1]" 2
80 1 122 LEU O 1 126 ILE N 3.000 2.800 3.400 3.374 2.891 3.474 0.074 9 0 "[ . 1]" 2
81 1 122 LEU O 1 126 ILE H 2.000 . 2.600 2.507 2.044 2.653 0.053 3 0 "[ . 1]" 2
82 1 128 CYS O 1 131 VAL N 3.000 2.800 3.400 3.052 2.841 3.253 . 0 0 "[ . 1]" 2
83 1 128 CYS O 1 131 VAL H 2.000 . 2.600 2.368 1.986 2.612 0.012 10 0 "[ . 1]" 2
84 1 126 ILE O 1 128 CYS N 3.000 2.800 3.400 2.894 2.776 3.089 0.024 1 0 "[ . 1]" 2
85 1 126 ILE O 1 128 CYS H 2.000 . 2.600 2.087 1.904 2.494 . 0 0 "[ . 1]" 2
86 1 127 PRO O 1 130 ARG N 3.000 2.800 3.400 2.844 2.768 2.975 0.032 5 0 "[ . 1]" 2
87 1 127 PRO O 1 130 ARG H 2.000 . 2.600 2.075 1.932 2.293 . 0 0 "[ . 1]" 2
88 1 97 LEU O 1 132 VAL N 3.000 2.800 3.400 3.130 2.892 3.346 . 0 0 "[ . 1]" 2
89 1 97 LEU O 1 132 VAL H 2.000 . 2.600 2.311 2.020 2.575 . 0 0 "[ . 1]" 2
90 1 144 LEU O 1 148 LYS N 3.000 2.800 3.400 3.115 2.823 3.446 0.046 5 0 "[ . 1]" 2
91 1 144 LEU O 1 148 LYS H 2.000 . 2.600 2.245 2.041 2.522 . 0 0 "[ . 1]" 2
92 1 145 ASP O 1 149 PHE N 3.000 2.800 3.400 3.055 2.936 3.272 . 0 0 "[ . 1]" 2
93 1 145 ASP O 1 149 PHE H 2.000 . 2.600 2.113 1.971 2.322 . 0 0 "[ . 1]" 2
94 1 146 LYS O 1 150 ILE N 3.000 2.800 3.400 2.991 2.766 3.405 0.034 4 0 "[ . 1]" 2
95 1 146 LYS O 1 150 ILE H 2.000 . 2.600 2.064 1.851 2.463 . 0 0 "[ . 1]" 2
96 1 147 LYS O 1 151 LEU N 3.000 2.800 3.400 3.063 2.800 3.218 . 0 0 "[ . 1]" 2
97 1 147 LYS O 1 151 LEU H 2.000 . 2.600 2.189 1.874 2.363 . 0 0 "[ . 1]" 2
98 1 148 LYS O 1 152 GLU N 3.000 2.800 3.400 3.090 2.909 3.276 . 0 0 "[ . 1]" 2
99 1 148 LYS O 1 152 GLU H 2.000 . 2.600 2.325 2.106 2.583 . 0 0 "[ . 1]" 2
100 1 149 PHE O 1 153 ARG N 3.000 2.800 3.400 2.897 2.784 3.250 0.016 8 0 "[ . 1]" 2
101 1 149 PHE O 1 153 ARG H 2.000 . 2.600 1.973 1.818 2.271 . 0 0 "[ . 1]" 2
102 1 150 ILE O 1 154 GLU N 3.000 2.800 3.400 3.052 2.799 3.414 0.014 5 0 "[ . 1]" 2
103 1 150 ILE O 1 154 GLU H 2.000 . 2.600 2.108 1.853 2.513 . 0 0 "[ . 1]" 2
stop_
save_
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