NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
545512 |
2lgj   |
17811 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lgj
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 1113
_Distance_constraint_stats_list.Viol_count 200
_Distance_constraint_stats_list.Viol_total 176.914
_Distance_constraint_stats_list.Viol_max 1.122
_Distance_constraint_stats_list.Viol_rms 0.0213
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0016
_Distance_constraint_stats_list.Viol_average_violations_only 0.0885
_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 0.000 0.000 . 0 "[ . 1]"
1 2 ALA 0.000 0.000 . 0 "[ . 1]"
1 3 GLU 0.000 0.000 . 0 "[ . 1]"
1 5 LEU 0.008 0.008 8 0 "[ . 1]"
1 6 LEU 0.675 0.362 2 0 "[ . 1]"
1 7 VAL 0.000 0.000 . 0 "[ . 1]"
1 8 VAL 0.000 0.000 . 0 "[ . 1]"
1 9 GLY 0.063 0.021 9 0 "[ . 1]"
1 10 LEU 2.293 1.122 5 2 "[ + -]"
1 11 GLY 0.000 0.000 . 0 "[ . 1]"
1 12 ASN 0.000 0.000 . 0 "[ . 1]"
1 13 PRO 0.786 0.113 3 0 "[ . 1]"
1 17 TYR 0.058 0.033 5 0 "[ . 1]"
1 18 ALA 0.027 0.027 6 0 "[ . 1]"
1 19 LYS 0.040 0.040 4 0 "[ . 1]"
1 20 THR 0.517 0.110 2 0 "[ . 1]"
1 21 ARG 0.000 0.000 . 0 "[ . 1]"
1 22 HIS 0.029 0.029 5 0 "[ . 1]"
1 23 ASN 0.000 0.000 . 0 "[ . 1]"
1 24 LEU 0.012 0.012 9 0 "[ . 1]"
1 25 GLY 0.055 0.030 5 0 "[ . 1]"
1 26 PHE 0.042 0.018 2 0 "[ . 1]"
1 27 MET 0.673 0.113 3 0 "[ . 1]"
1 28 VAL 0.000 0.000 . 0 "[ . 1]"
1 29 ALA 0.000 0.000 . 0 "[ . 1]"
1 30 ASP 0.000 0.000 . 0 "[ . 1]"
1 31 VAL 0.836 0.836 6 1 "[ .+ 1]"
1 32 LEU 0.011 0.011 1 0 "[ . 1]"
1 33 ALA 0.026 0.026 3 0 "[ . 1]"
1 34 GLY 0.000 0.000 . 0 "[ . 1]"
1 35 ARG 2.150 0.302 8 0 "[ . 1]"
1 36 ILE 0.000 0.000 . 0 "[ . 1]"
1 37 GLY 0.000 0.000 . 0 "[ . 1]"
1 38 SER 2.176 0.302 8 0 "[ . 1]"
1 39 ALA 0.022 0.022 2 0 "[ . 1]"
1 40 PHE 0.000 0.000 . 0 "[ . 1]"
1 41 LYS 0.138 0.120 4 0 "[ . 1]"
1 42 VAL 0.000 0.000 . 0 "[ . 1]"
1 43 HIS 0.608 0.227 2 0 "[ . 1]"
1 45 LYS 0.000 0.000 . 0 "[ . 1]"
1 46 SER 1.254 0.256 2 0 "[ . 1]"
1 47 GLY 0.000 0.000 . 0 "[ . 1]"
1 48 ALA 0.554 0.227 2 0 "[ . 1]"
1 49 GLU 0.037 0.025 6 0 "[ . 1]"
1 50 VAL 0.159 0.120 4 0 "[ . 1]"
1 51 VAL 0.022 0.022 2 0 "[ . 1]"
1 52 THR 0.008 0.008 8 0 "[ . 1]"
1 53 GLY 0.000 0.000 . 0 "[ . 1]"
1 54 ARG 0.701 0.550 5 1 "[ + 1]"
1 55 LEU 0.701 0.550 5 1 "[ + 1]"
1 56 ALA 0.076 0.076 5 0 "[ . 1]"
1 57 GLY 0.000 0.000 . 0 "[ . 1]"
1 58 THR 0.008 0.008 8 0 "[ . 1]"
1 59 SER 0.000 0.000 . 0 "[ . 1]"
1 60 VAL 0.000 0.000 . 0 "[ . 1]"
1 61 VAL 0.000 0.000 . 0 "[ . 1]"
1 62 LEU 0.000 0.000 . 0 "[ . 1]"
1 63 ALA 0.021 0.021 9 0 "[ . 1]"
1 64 LYS 0.025 0.025 6 0 "[ . 1]"
1 65 PRO 0.000 0.000 . 0 "[ . 1]"
1 66 ARG 0.861 0.126 1 0 "[ . 1]"
1 67 CYS 0.000 0.000 . 0 "[ . 1]"
1 68 TYR 1.392 0.402 10 0 "[ . 1]"
1 69 MET 0.126 0.061 8 0 "[ . 1]"
1 70 ASN 0.000 0.000 . 0 "[ . 1]"
1 71 GLU 0.000 0.000 . 0 "[ . 1]"
1 72 SER 0.000 0.000 . 0 "[ . 1]"
1 73 GLY 0.126 0.061 8 0 "[ . 1]"
1 74 ARG 0.347 0.078 9 0 "[ . 1]"
1 75 GLN 0.000 0.000 . 0 "[ . 1]"
1 76 VAL 0.000 0.000 . 0 "[ . 1]"
1 77 GLY 0.000 0.000 . 0 "[ . 1]"
1 78 PRO 1.027 0.233 7 0 "[ . 1]"
1 79 LEU 0.629 0.256 2 0 "[ . 1]"
1 80 ALA 0.000 0.000 . 0 "[ . 1]"
1 81 LYS 0.169 0.091 5 0 "[ . 1]"
1 82 PHE 0.000 0.000 . 0 "[ . 1]"
1 83 TYR 0.000 0.000 . 0 "[ . 1]"
1 84 SER 0.000 0.000 . 0 "[ . 1]"
1 85 VAL 0.000 0.000 . 0 "[ . 1]"
1 86 PRO 0.000 0.000 . 0 "[ . 1]"
1 87 PRO 0.020 0.020 1 0 "[ . 1]"
1 88 GLN 0.000 0.000 . 0 "[ . 1]"
1 89 GLN 0.000 0.000 . 0 "[ . 1]"
1 90 ILE 0.281 0.126 6 0 "[ . 1]"
1 91 VAL 0.744 0.362 2 0 "[ . 1]"
1 92 VAL 0.000 0.000 . 0 "[ . 1]"
1 93 ILE 0.000 0.000 . 0 "[ . 1]"
1 94 HIS 0.097 0.042 8 0 "[ . 1]"
1 95 ASP 0.012 0.012 9 0 "[ . 1]"
1 96 GLU 0.000 0.000 . 0 "[ . 1]"
1 97 LEU 0.000 0.000 . 0 "[ . 1]"
1 98 ASP 0.000 0.000 . 0 "[ . 1]"
1 99 ILE 0.000 0.000 . 0 "[ . 1]"
1 100 ASP 0.000 0.000 . 0 "[ . 1]"
1 101 PHE 0.000 0.000 . 0 "[ . 1]"
1 102 GLY 0.346 0.098 6 0 "[ . 1]"
1 103 ARG 0.264 0.103 6 0 "[ . 1]"
1 104 ILE 0.223 0.067 2 0 "[ . 1]"
1 105 ARG 0.290 0.083 2 0 "[ . 1]"
1 106 LEU 0.000 0.000 . 0 "[ . 1]"
1 107 LYS 0.095 0.053 5 0 "[ . 1]"
1 108 LEU 0.040 0.040 8 0 "[ . 1]"
1 109 GLY 0.000 0.000 . 0 "[ . 1]"
1 110 GLY 0.000 0.000 . 0 "[ . 1]"
1 113 GLY 0.000 0.000 . 0 "[ . 1]"
1 115 HIS 0.000 0.000 . 0 "[ . 1]"
1 116 ASN 0.187 0.126 8 0 "[ . 1]"
1 117 GLY 0.152 0.058 1 0 "[ . 1]"
1 118 LEU 0.042 0.042 8 0 "[ . 1]"
1 119 ARG 0.000 0.000 . 0 "[ . 1]"
1 120 SER 0.126 0.126 8 0 "[ . 1]"
1 121 VAL 2.445 1.122 5 2 "[ + -]"
1 122 ALA 0.020 0.020 5 0 "[ . 1]"
1 123 SER 0.000 0.000 . 0 "[ . 1]"
1 124 ALA 0.000 0.000 . 0 "[ . 1]"
1 125 LEU 0.000 0.000 . 0 "[ . 1]"
1 126 GLY 0.000 0.000 . 0 "[ . 1]"
1 127 THR 0.020 0.020 5 0 "[ . 1]"
1 128 LYS 0.000 0.000 . 0 "[ . 1]"
1 129 ASN 0.000 0.000 . 0 "[ . 1]"
1 131 HIS 0.260 0.126 6 0 "[ . 1]"
1 132 ARG 0.245 0.069 10 0 "[ . 1]"
1 133 VAL 0.086 0.057 2 0 "[ . 1]"
1 134 ARG 0.081 0.059 10 0 "[ . 1]"
1 135 ILE 0.050 0.050 9 0 "[ . 1]"
1 136 GLY 0.000 0.000 . 0 "[ . 1]"
1 137 VAL 0.000 0.000 . 0 "[ . 1]"
1 138 GLY 0.000 0.000 . 0 "[ . 1]"
1 139 ARG 0.040 0.040 7 0 "[ . 1]"
1 141 PRO 0.000 0.000 . 0 "[ . 1]"
1 142 GLY 0.000 0.000 . 0 "[ . 1]"
1 144 LYS 0.857 0.151 4 0 "[ . 1]"
1 145 ASP 0.000 0.000 . 0 "[ . 1]"
1 146 PRO 0.040 0.040 7 0 "[ . 1]"
1 147 ALA 0.825 0.151 4 0 "[ . 1]"
1 148 ALA 0.070 0.048 1 0 "[ . 1]"
1 149 PHE 0.000 0.000 . 0 "[ . 1]"
1 150 VAL 0.070 0.048 1 0 "[ . 1]"
1 151 LEU 0.575 0.110 2 0 "[ . 1]"
1 152 GLU 0.000 0.000 . 0 "[ . 1]"
1 153 ASN 0.040 0.040 4 0 "[ . 1]"
1 154 PHE 0.000 0.000 . 0 "[ . 1]"
1 155 THR 0.039 0.026 1 0 "[ . 1]"
1 156 ALA 0.000 0.000 . 0 "[ . 1]"
1 157 ALA 0.089 0.068 6 0 "[ . 1]"
1 158 GLU 0.000 0.000 . 0 "[ . 1]"
1 159 ARG 0.465 0.137 5 0 "[ . 1]"
1 160 ALA 0.318 0.098 6 0 "[ . 1]"
1 161 GLU 0.089 0.068 6 0 "[ . 1]"
1 162 VAL 0.033 0.033 6 0 "[ . 1]"
1 163 PRO 0.426 0.137 5 0 "[ . 1]"
1 164 THR 0.000 0.000 . 0 "[ . 1]"
1 165 ILE 0.085 0.033 6 0 "[ . 1]"
1 166 VAL 0.000 0.000 . 0 "[ . 1]"
1 167 GLU 0.018 0.018 2 0 "[ . 1]"
1 168 GLN 0.000 0.000 . 0 "[ . 1]"
1 169 ALA 0.111 0.057 2 0 "[ . 1]"
1 170 ALA 0.851 0.836 6 1 "[ .+ 1]"
1 171 ASP 0.050 0.032 7 0 "[ . 1]"
1 172 ALA 0.000 0.000 . 0 "[ . 1]"
1 173 THR 0.000 0.000 . 0 "[ . 1]"
1 174 GLU 0.026 0.015 7 0 "[ . 1]"
1 175 LEU 0.653 0.105 9 0 "[ . 1]"
1 176 LEU 0.176 0.076 5 0 "[ . 1]"
1 177 ILE 0.000 0.000 . 0 "[ . 1]"
1 178 ALA 0.621 0.105 9 0 "[ . 1]"
1 179 GLN 0.000 0.000 . 0 "[ . 1]"
1 180 GLY 0.044 0.025 10 0 "[ . 1]"
1 181 LEU 0.040 0.040 8 0 "[ . 1]"
1 182 GLU 0.048 0.048 5 0 "[ . 1]"
1 183 PRO 0.000 0.000 . 0 "[ . 1]"
1 184 ALA 0.000 0.000 . 0 "[ . 1]"
1 185 GLN 0.056 0.027 1 0 "[ . 1]"
1 186 ASN 0.048 0.048 5 0 "[ . 1]"
1 187 THR 0.000 0.000 . 0 "[ . 1]"
1 188 VAL 0.025 0.025 2 0 "[ . 1]"
1 189 HIS 0.339 0.103 6 0 "[ . 1]"
1 190 ALA 0.000 0.000 . 0 "[ . 1]"
1 191 TRP 0.838 0.494 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 H1 1 1 MET HB2 6.500 . 6.500 3.313 2.437 4.198 . 0 0 "[ . 1]" 1
2 1 1 MET H1 1 1 MET HB3 6.500 . 6.500 3.542 2.461 4.202 . 0 0 "[ . 1]" 1
3 1 1 MET H1 1 1 MET HG2 6.500 . 6.500 3.776 2.167 5.061 . 0 0 "[ . 1]" 1
4 1 1 MET H1 1 1 MET QG 6.500 . 6.500 3.183 2.077 3.955 . 0 0 "[ . 1]" 1
5 1 1 MET H1 1 1 MET HG3 6.500 . 6.500 3.646 2.114 5.026 . 0 0 "[ . 1]" 1
6 1 1 MET HA 1 2 ALA H 4.500 . 4.500 2.291 2.133 2.577 . 0 0 "[ . 1]" 1
7 1 1 MET QB 1 2 ALA H 4.500 . 4.500 2.956 1.987 3.912 . 0 0 "[ . 1]" 1
8 1 1 MET QG 1 2 ALA H 6.500 . 6.500 3.855 3.161 4.538 . 0 0 "[ . 1]" 1
9 1 1 MET HG2 1 2 ALA H 6.500 . 6.500 4.716 3.639 5.681 . 0 0 "[ . 1]" 1
10 1 1 MET HG3 1 2 ALA H 6.500 . 6.500 4.230 3.239 5.746 . 0 0 "[ . 1]" 1
11 1 2 ALA H 1 3 GLU H 6.500 . 6.500 3.791 2.343 4.431 . 0 0 "[ . 1]" 1
12 1 2 ALA MB 1 3 GLU H 4.500 . 4.500 3.138 1.882 3.691 . 0 0 "[ . 1]" 1
13 1 5 LEU H 1 5 LEU MD1 4.500 . 4.500 3.469 3.101 3.835 . 0 0 "[ . 1]" 1
14 1 5 LEU H 1 5 LEU MD2 4.500 . 4.500 2.956 1.825 3.540 . 0 0 "[ . 1]" 1
15 1 5 LEU H 1 59 SER O 4.500 . 4.500 2.653 1.834 3.660 . 0 0 "[ . 1]" 1
16 1 5 LEU H 1 60 VAL HA 6.500 . 6.500 2.555 2.107 2.889 . 0 0 "[ . 1]" 1
17 1 5 LEU H 1 61 VAL H 6.500 . 6.500 3.818 3.523 4.143 . 0 0 "[ . 1]" 1
18 1 5 LEU QD 1 91 VAL QG 6.500 . 6.500 3.404 1.958 5.044 . 0 0 "[ . 1]" 1
19 1 5 LEU MD1 1 58 THR HB 6.500 . 6.500 4.932 3.379 6.490 . 0 0 "[ . 1]" 1
20 1 5 LEU MD2 1 58 THR HB 6.500 . 6.500 4.371 2.591 6.508 0.008 8 0 "[ . 1]" 1
21 1 5 LEU N 1 59 SER O 4.500 . 4.500 3.472 2.785 4.257 . 0 0 "[ . 1]" 1
22 1 5 LEU O 1 61 VAL H 4.500 . 4.500 1.807 1.721 1.933 . 0 0 "[ . 1]" 1
23 1 5 LEU O 1 61 VAL N 4.500 . 4.500 2.776 2.701 2.862 . 0 0 "[ . 1]" 1
24 1 6 LEU H 1 7 VAL H 6.500 . 6.500 4.350 4.276 4.504 . 0 0 "[ . 1]" 1
25 1 6 LEU H 1 90 ILE HA 6.500 . 6.500 3.242 2.366 4.117 . 0 0 "[ . 1]" 1
26 1 6 LEU H 1 91 VAL H 6.500 . 6.500 4.198 3.593 5.033 . 0 0 "[ . 1]" 1
27 1 6 LEU H 1 91 VAL QG 4.500 . 4.500 4.194 3.752 4.862 0.362 2 0 "[ . 1]" 1
28 1 6 LEU HA 1 61 VAL H 6.500 . 6.500 3.081 2.893 3.312 . 0 0 "[ . 1]" 1
29 1 6 LEU HA 1 61 VAL HB 6.500 . 6.500 2.659 2.119 4.075 . 0 0 "[ . 1]" 1
30 1 6 LEU HA 1 61 VAL MG1 6.500 . 6.500 3.891 3.482 4.522 . 0 0 "[ . 1]" 1
31 1 6 LEU HA 1 61 VAL MG2 6.500 . 6.500 3.605 1.740 4.226 . 0 0 "[ . 1]" 1
32 1 6 LEU QB 1 7 VAL H 6.500 . 6.500 3.831 3.680 3.907 . 0 0 "[ . 1]" 1
33 1 6 LEU QB 1 91 VAL QG 6.500 . 6.500 4.559 4.034 4.953 . 0 0 "[ . 1]" 1
34 1 6 LEU QD 1 7 VAL H 4.500 . 4.500 2.493 2.196 2.781 . 0 0 "[ . 1]" 1
35 1 6 LEU QD 1 61 VAL HB 6.500 . 6.500 2.437 2.137 3.035 . 0 0 "[ . 1]" 1
36 1 6 LEU QD 1 61 VAL QG 6.500 . 6.500 2.347 2.001 2.724 . 0 0 "[ . 1]" 1
37 1 6 LEU QD 1 79 LEU QB 6.500 . 6.500 3.304 2.279 4.630 . 0 0 "[ . 1]" 1
38 1 6 LEU QD 1 80 ALA HA 6.500 . 6.500 3.074 2.227 4.131 . 0 0 "[ . 1]" 1
39 1 6 LEU QD 1 80 ALA MB 6.500 . 6.500 2.908 2.093 3.942 . 0 0 "[ . 1]" 1
40 1 6 LEU HG 1 7 VAL H 6.500 . 6.500 3.402 2.926 3.716 . 0 0 "[ . 1]" 1
41 1 6 LEU HG 1 8 VAL H 6.500 . 6.500 4.079 3.826 4.292 . 0 0 "[ . 1]" 1
42 1 6 LEU O 1 91 VAL H 4.500 . 4.500 2.083 1.756 2.705 . 0 0 "[ . 1]" 1
43 1 6 LEU O 1 91 VAL N 4.500 . 4.500 3.046 2.737 3.643 . 0 0 "[ . 1]" 1
44 1 7 VAL H 1 61 VAL H 6.500 . 6.500 3.624 3.326 3.792 . 0 0 "[ . 1]" 1
45 1 7 VAL H 1 61 VAL HB 6.500 . 6.500 3.737 3.260 4.869 . 0 0 "[ . 1]" 1
46 1 7 VAL H 1 61 VAL O 4.500 . 4.500 1.892 1.733 2.175 . 0 0 "[ . 1]" 1
47 1 7 VAL H 1 62 LEU HA 6.500 . 6.500 3.122 2.845 3.365 . 0 0 "[ . 1]" 1
48 1 7 VAL HA 1 8 VAL H 4.500 . 4.500 2.149 2.133 2.168 . 0 0 "[ . 1]" 1
49 1 7 VAL HA 1 91 VAL H 6.500 . 6.500 3.108 2.815 3.526 . 0 0 "[ . 1]" 1
50 1 7 VAL HA 1 91 VAL QG 6.500 . 6.500 2.149 1.973 2.359 . 0 0 "[ . 1]" 1
51 1 7 VAL HB 1 8 VAL H 6.500 . 6.500 4.248 4.160 4.323 . 0 0 "[ . 1]" 1
52 1 7 VAL HB 1 63 ALA H 6.500 . 6.500 3.677 3.187 4.070 . 0 0 "[ . 1]" 1
53 1 7 VAL QG 1 8 VAL H 4.500 . 4.500 2.912 2.820 3.019 . 0 0 "[ . 1]" 1
54 1 7 VAL QG 1 91 VAL QG 6.500 . 6.500 1.848 1.774 1.936 . 0 0 "[ . 1]" 1
55 1 7 VAL N 1 61 VAL O 4.500 . 4.500 2.862 2.713 3.148 . 0 0 "[ . 1]" 1
56 1 7 VAL O 1 63 ALA H 4.500 . 4.500 2.011 1.790 2.477 . 0 0 "[ . 1]" 1
57 1 7 VAL O 1 63 ALA N 4.500 . 4.500 2.976 2.721 3.453 . 0 0 "[ . 1]" 1
58 1 8 VAL H 1 9 GLY H 6.500 . 6.500 4.388 4.254 4.480 . 0 0 "[ . 1]" 1
59 1 8 VAL H 1 91 VAL O 4.500 . 4.500 1.975 1.799 2.294 . 0 0 "[ . 1]" 1
60 1 8 VAL H 1 93 ILE H 6.500 . 6.500 3.966 3.534 4.483 . 0 0 "[ . 1]" 1
61 1 8 VAL HA 1 63 ALA H 6.500 . 6.500 3.255 2.736 3.896 . 0 0 "[ . 1]" 1
62 1 8 VAL HA 1 63 ALA MB 6.500 . 6.500 3.084 2.285 4.295 . 0 0 "[ . 1]" 1
63 1 8 VAL HB 1 9 GLY H 6.500 . 6.500 3.836 2.375 4.305 . 0 0 "[ . 1]" 1
64 1 8 VAL HB 1 92 VAL QG 6.500 . 6.500 2.262 1.504 3.702 . 0 0 "[ . 1]" 1
65 1 8 VAL QG 1 63 ALA MB 6.500 . 6.500 2.507 1.701 3.661 . 0 0 "[ . 1]" 1
66 1 8 VAL QG 1 76 VAL QG 6.500 . 6.500 2.129 1.688 2.656 . 0 0 "[ . 1]" 1
67 1 8 VAL MG1 1 9 GLY H 6.500 . 6.500 2.930 2.326 3.668 . 0 0 "[ . 1]" 1
68 1 8 VAL MG1 1 76 VAL MG2 4.500 . 4.500 2.580 1.746 3.101 . 0 0 "[ . 1]" 1
69 1 8 VAL MG2 1 9 GLY H 6.500 . 6.500 3.989 3.440 4.189 . 0 0 "[ . 1]" 1
70 1 8 VAL MG2 1 76 VAL MG1 4.500 . 4.500 3.062 2.403 4.251 . 0 0 "[ . 1]" 1
71 1 8 VAL N 1 91 VAL O 4.500 . 4.500 2.935 2.767 3.235 . 0 0 "[ . 1]" 1
72 1 8 VAL O 1 93 ILE H 4.500 . 4.500 1.980 1.793 2.278 . 0 0 "[ . 1]" 1
73 1 8 VAL O 1 93 ILE N 4.500 . 4.500 2.894 2.719 3.191 . 0 0 "[ . 1]" 1
74 1 9 GLY H 1 10 LEU H 6.500 . 6.500 4.372 4.044 4.524 . 0 0 "[ . 1]" 1
75 1 9 GLY H 1 26 PHE HA 6.500 . 6.500 5.938 4.881 6.518 0.018 2 0 "[ . 1]" 1
76 1 9 GLY H 1 29 ALA MB 6.500 . 6.500 4.794 3.855 5.658 . 0 0 "[ . 1]" 1
77 1 9 GLY H 1 63 ALA H 6.500 . 6.500 4.373 3.744 5.592 . 0 0 "[ . 1]" 1
78 1 9 GLY H 1 63 ALA O 4.500 . 4.500 2.666 1.896 3.789 . 0 0 "[ . 1]" 1
79 1 9 GLY H 1 64 LYS HA 6.500 . 6.500 3.624 2.829 4.272 . 0 0 "[ . 1]" 1
80 1 9 GLY QA 1 25 GLY QA 6.500 . 6.500 2.542 2.092 3.011 . 0 0 "[ . 1]" 1
81 1 9 GLY QA 1 93 ILE H 6.500 . 6.500 2.736 2.304 3.373 . 0 0 "[ . 1]" 1
82 1 9 GLY QA 1 93 ILE MD 6.500 . 6.500 4.098 2.743 5.268 . 0 0 "[ . 1]" 1
83 1 9 GLY N 1 63 ALA O 4.500 . 4.500 3.582 2.874 4.521 0.021 9 0 "[ . 1]" 1
84 1 10 LEU H 1 25 GLY H 6.500 . 6.500 3.733 2.814 4.837 . 0 0 "[ . 1]" 1
85 1 10 LEU H 1 92 VAL QG 6.500 . 6.500 4.265 3.316 5.685 . 0 0 "[ . 1]" 1
86 1 10 LEU H 1 93 ILE H 6.500 . 6.500 4.603 3.535 5.714 . 0 0 "[ . 1]" 1
87 1 10 LEU H 1 93 ILE O 4.500 . 4.500 3.079 2.210 3.920 . 0 0 "[ . 1]" 1
88 1 10 LEU H 1 94 HIS HA 6.500 . 6.500 4.402 3.858 4.877 . 0 0 "[ . 1]" 1
89 1 10 LEU H 1 95 ASP H 6.500 . 6.500 6.163 5.609 6.410 . 0 0 "[ . 1]" 1
90 1 10 LEU HA 1 25 GLY H 6.500 . 6.500 5.275 4.569 6.474 . 0 0 "[ . 1]" 1
91 1 10 LEU QB 1 11 GLY H 6.500 . 6.500 3.408 2.576 3.833 . 0 0 "[ . 1]" 1
92 1 10 LEU QB 1 93 ILE MG 6.500 . 6.500 4.711 3.530 6.464 . 0 0 "[ . 1]" 1
93 1 10 LEU QD 1 11 GLY H 6.500 . 6.500 2.860 2.238 3.719 . 0 0 "[ . 1]" 1
94 1 10 LEU HG 1 121 VAL QG 6.500 . 6.500 6.038 4.065 7.622 1.122 5 2 "[ + -]" 1
95 1 11 GLY H 1 12 ASN H 6.500 . 6.500 4.374 4.108 4.557 . 0 0 "[ . 1]" 1
96 1 11 GLY QA 1 26 PHE H 6.500 . 6.500 3.188 2.424 3.959 . 0 0 "[ . 1]" 1
97 1 11 GLY QA 1 26 PHE HA 6.500 . 6.500 3.883 2.867 5.671 . 0 0 "[ . 1]" 1
98 1 13 PRO QB 1 66 ARG QG 6.500 . 6.500 5.520 3.150 6.545 0.045 7 0 "[ . 1]" 1
99 1 13 PRO QD 1 18 ALA MB 6.500 . 6.500 4.653 2.326 6.527 0.027 6 0 "[ . 1]" 1
100 1 13 PRO QD 1 27 MET QG 6.500 . 6.500 6.567 6.514 6.613 0.113 3 0 "[ . 1]" 1
101 1 13 PRO QD 1 68 TYR QB 6.500 . 6.500 4.993 2.923 6.264 . 0 0 "[ . 1]" 1
102 1 17 TYR H 1 17 TYR HD2 4.500 . 4.500 2.672 2.307 3.568 . 0 0 "[ . 1]" 1
103 1 17 TYR H 1 20 THR MG 6.500 . 6.500 4.696 3.881 5.197 . 0 0 "[ . 1]" 1
104 1 17 TYR HA 1 18 ALA HA 6.500 . 6.500 4.745 4.700 4.803 . 0 0 "[ . 1]" 1
105 1 17 TYR HA 1 18 ALA MB 6.500 . 6.500 4.928 4.785 5.022 . 0 0 "[ . 1]" 1
106 1 17 TYR HA 1 20 THR MG 6.500 . 6.500 2.518 1.680 3.143 . 0 0 "[ . 1]" 1
107 1 17 TYR QB 1 20 THR MG 6.500 . 6.500 3.687 2.722 4.706 . 0 0 "[ . 1]" 1
108 1 17 TYR HB2 1 18 ALA H 6.500 . 6.500 3.312 2.669 4.267 . 0 0 "[ . 1]" 1
109 1 17 TYR HB3 1 18 ALA H 6.500 . 6.500 4.123 3.703 4.481 . 0 0 "[ . 1]" 1
110 1 17 TYR HD1 1 151 LEU HA 4.500 . 4.500 3.481 2.692 4.533 0.033 5 0 "[ . 1]" 1
111 1 17 TYR HD1 1 151 LEU QD 4.000 . 4.000 3.374 2.614 4.025 0.025 3 0 "[ . 1]" 1
112 1 18 ALA H 1 19 LYS H 6.500 . 6.500 2.569 2.411 2.760 . 0 0 "[ . 1]" 1
113 1 18 ALA MB 1 19 LYS H 4.500 . 4.500 3.176 3.012 3.319 . 0 0 "[ . 1]" 1
114 1 18 ALA MB 1 20 THR H 6.500 . 6.500 4.418 4.312 4.536 . 0 0 "[ . 1]" 1
115 1 19 LYS H 1 19 LYS HD2 6.500 . 6.500 3.484 2.083 5.873 . 0 0 "[ . 1]" 1
116 1 19 LYS H 1 19 LYS HD3 6.500 . 6.500 3.421 2.274 5.101 . 0 0 "[ . 1]" 1
117 1 19 LYS H 1 19 LYS HE2 6.500 . 6.500 4.700 3.717 5.604 . 0 0 "[ . 1]" 1
118 1 19 LYS H 1 19 LYS HE3 6.500 . 6.500 4.779 4.002 5.651 . 0 0 "[ . 1]" 1
119 1 19 LYS H 1 20 THR H 4.500 . 4.500 2.465 2.245 2.754 . 0 0 "[ . 1]" 1
120 1 19 LYS H 1 20 THR MG 6.500 . 6.500 3.159 2.779 3.341 . 0 0 "[ . 1]" 1
121 1 19 LYS HA 1 19 LYS HE2 6.500 . 6.500 4.192 1.466 5.315 . 0 0 "[ . 1]" 1
122 1 19 LYS HA 1 19 LYS HE3 6.500 . 6.500 4.697 2.770 5.480 . 0 0 "[ . 1]" 1
123 1 19 LYS HA 1 20 THR H 6.500 . 6.500 3.110 3.018 3.320 . 0 0 "[ . 1]" 1
124 1 19 LYS QB 1 20 THR H 6.500 . 6.500 3.608 3.256 3.709 . 0 0 "[ . 1]" 1
125 1 19 LYS QB 1 153 ASN H 6.500 . 6.500 5.168 3.125 6.540 0.040 4 0 "[ . 1]" 1
126 1 19 LYS QG 1 20 THR H 6.500 . 6.500 4.744 4.407 4.920 . 0 0 "[ . 1]" 1
127 1 20 THR H 1 20 THR MG 4.500 . 4.500 2.602 2.414 2.852 . 0 0 "[ . 1]" 1
128 1 20 THR H 1 21 ARG H 6.500 . 6.500 4.470 4.368 4.554 . 0 0 "[ . 1]" 1
129 1 20 THR HA 1 151 LEU HA 6.500 . 6.500 6.454 5.574 6.610 0.110 2 0 "[ . 1]" 1
130 1 20 THR MG 1 21 ARG H 6.500 . 6.500 3.653 3.438 3.925 . 0 0 "[ . 1]" 1
131 1 20 THR MG 1 153 ASN H 6.500 . 6.500 2.360 1.441 3.102 . 0 0 "[ . 1]" 1
132 1 20 THR O 1 23 ASN H 4.500 . 4.500 2.951 2.246 3.558 . 0 0 "[ . 1]" 1
133 1 20 THR O 1 23 ASN N 4.500 . 4.500 3.857 3.170 4.439 . 0 0 "[ . 1]" 1
134 1 21 ARG H 1 21 ARG HD2 6.500 . 6.500 4.685 3.128 5.839 . 0 0 "[ . 1]" 1
135 1 21 ARG H 1 21 ARG HD3 6.500 . 6.500 4.120 2.461 5.540 . 0 0 "[ . 1]" 1
136 1 21 ARG H 1 22 HIS H 6.500 . 6.500 2.574 2.450 2.864 . 0 0 "[ . 1]" 1
137 1 21 ARG HA 1 24 LEU QB 6.500 . 6.500 4.366 3.188 6.031 . 0 0 "[ . 1]" 1
138 1 21 ARG QG 1 22 HIS H 6.500 . 6.500 3.932 2.957 4.950 . 0 0 "[ . 1]" 1
139 1 21 ARG QG 1 23 ASN H 6.500 . 6.500 4.903 4.294 5.608 . 0 0 "[ . 1]" 1
140 1 21 ARG O 1 24 LEU H 4.500 . 4.500 2.921 2.223 3.561 . 0 0 "[ . 1]" 1
141 1 21 ARG O 1 24 LEU N 4.500 . 4.500 3.694 3.072 4.415 . 0 0 "[ . 1]" 1
142 1 22 HIS H 1 22 HIS HD2 6.500 . 6.500 4.487 3.186 5.267 . 0 0 "[ . 1]" 1
143 1 22 HIS H 1 23 ASN H 6.500 . 6.500 2.504 2.284 2.741 . 0 0 "[ . 1]" 1
144 1 22 HIS HA 1 22 HIS HD2 4.500 . 4.500 3.472 2.105 4.529 0.029 5 0 "[ . 1]" 1
145 1 22 HIS QB 1 150 VAL QG 6.500 . 6.500 2.968 1.685 4.633 . 0 0 "[ . 1]" 1
146 1 23 ASN H 1 24 LEU H 6.500 . 6.500 2.563 2.272 3.004 . 0 0 "[ . 1]" 1
147 1 24 LEU H 1 25 GLY H 6.500 . 6.500 2.745 2.589 2.898 . 0 0 "[ . 1]" 1
148 1 24 LEU H 1 95 ASP QB 6.500 . 6.500 4.694 3.668 5.233 . 0 0 "[ . 1]" 1
149 1 24 LEU HA 1 26 PHE H 6.500 . 6.500 4.512 3.888 4.945 . 0 0 "[ . 1]" 1
150 1 24 LEU QB 1 27 MET H 6.500 . 6.500 4.810 4.355 5.182 . 0 0 "[ . 1]" 1
151 1 24 LEU QB 1 95 ASP HA 6.500 . 6.500 5.556 4.922 6.495 . 0 0 "[ . 1]" 1
152 1 24 LEU HB2 1 25 GLY H 6.500 . 6.500 3.677 2.467 4.147 . 0 0 "[ . 1]" 1
153 1 24 LEU HB3 1 25 GLY H 6.500 . 6.500 4.056 3.615 4.369 . 0 0 "[ . 1]" 1
154 1 24 LEU QD 1 25 GLY H 6.500 . 6.500 2.334 1.672 3.989 . 0 0 "[ . 1]" 1
155 1 24 LEU QD 1 135 ILE MG 6.500 . 6.500 2.456 2.005 2.759 . 0 0 "[ . 1]" 1
156 1 24 LEU MD1 1 95 ASP H 6.500 . 6.500 3.533 2.287 4.205 . 0 0 "[ . 1]" 1
157 1 24 LEU MD2 1 95 ASP H 6.500 . 6.500 4.014 2.645 6.512 0.012 9 0 "[ . 1]" 1
158 1 24 LEU HG 1 25 GLY H 6.500 . 6.500 3.470 2.240 4.429 . 0 0 "[ . 1]" 1
159 1 24 LEU O 1 27 MET H 4.500 . 4.500 2.780 2.355 3.261 . 0 0 "[ . 1]" 1
160 1 24 LEU O 1 27 MET N 4.500 . 4.500 3.271 3.003 3.462 . 0 0 "[ . 1]" 1
161 1 25 GLY H 1 26 PHE H 6.500 . 6.500 2.772 2.604 3.090 . 0 0 "[ . 1]" 1
162 1 25 GLY H 1 27 MET H 6.500 . 6.500 4.020 3.770 4.183 . 0 0 "[ . 1]" 1
163 1 25 GLY QA 1 27 MET H 6.500 . 6.500 4.015 3.825 4.400 . 0 0 "[ . 1]" 1
164 1 25 GLY QA 1 28 VAL HB 6.500 . 6.500 3.495 3.090 4.278 . 0 0 "[ . 1]" 1
165 1 25 GLY QA 1 93 ILE MG 6.500 . 6.500 2.715 2.113 5.406 . 0 0 "[ . 1]" 1
166 1 25 GLY HA2 1 94 HIS HA 6.500 . 6.500 5.831 4.813 6.530 0.030 5 0 "[ . 1]" 1
167 1 25 GLY HA3 1 94 HIS HA 6.500 . 6.500 5.441 4.708 6.338 . 0 0 "[ . 1]" 1
168 1 25 GLY O 1 29 ALA H 4.500 . 4.500 2.291 1.850 3.142 . 0 0 "[ . 1]" 1
169 1 25 GLY O 1 29 ALA N 4.500 . 4.500 3.196 2.770 3.949 . 0 0 "[ . 1]" 1
170 1 26 PHE H 1 27 MET H 4.500 . 4.500 2.582 2.316 2.757 . 0 0 "[ . 1]" 1
171 1 26 PHE H 1 28 VAL H 6.500 . 6.500 4.378 4.026 4.584 . 0 0 "[ . 1]" 1
172 1 26 PHE H 1 29 ALA MB 6.500 . 6.500 4.747 4.594 5.067 . 0 0 "[ . 1]" 1
173 1 26 PHE HA 1 29 ALA MB 6.500 . 6.500 2.979 2.516 3.388 . 0 0 "[ . 1]" 1
174 1 26 PHE O 1 30 ASP H 4.500 . 4.500 2.402 1.939 2.873 . 0 0 "[ . 1]" 1
175 1 26 PHE O 1 30 ASP N 4.500 . 4.500 3.228 2.821 3.800 . 0 0 "[ . 1]" 1
176 1 27 MET H 1 27 MET HB3 4.000 . 4.000 3.593 3.567 3.626 . 0 0 "[ . 1]" 1
177 1 27 MET H 1 28 VAL H 6.500 . 6.500 2.697 2.503 2.869 . 0 0 "[ . 1]" 1
178 1 27 MET H 1 29 ALA H 6.500 . 6.500 4.108 3.933 4.326 . 0 0 "[ . 1]" 1
179 1 27 MET HA 1 29 ALA H 6.500 . 6.500 4.607 4.262 5.106 . 0 0 "[ . 1]" 1
180 1 27 MET HA 1 30 ASP H 6.500 . 6.500 3.879 3.149 4.794 . 0 0 "[ . 1]" 1
181 1 27 MET HA 1 30 ASP HB2 6.500 . 6.500 3.904 2.764 5.404 . 0 0 "[ . 1]" 1
182 1 27 MET HA 1 30 ASP HB3 6.500 . 6.500 3.744 2.495 5.936 . 0 0 "[ . 1]" 1
183 1 27 MET HA 1 31 VAL H 6.500 . 6.500 4.556 3.900 5.399 . 0 0 "[ . 1]" 1
184 1 27 MET O 1 31 VAL H 4.500 . 4.500 2.527 1.785 3.430 . 0 0 "[ . 1]" 1
185 1 27 MET O 1 31 VAL N 4.500 . 4.500 3.444 2.756 4.324 . 0 0 "[ . 1]" 1
186 1 28 VAL H 1 28 VAL MG1 4.500 . 4.500 3.784 3.771 3.803 . 0 0 "[ . 1]" 1
187 1 28 VAL H 1 29 ALA H 4.500 . 4.500 2.590 2.368 2.765 . 0 0 "[ . 1]" 1
188 1 28 VAL H 1 30 ASP H 6.500 . 6.500 4.127 3.742 4.659 . 0 0 "[ . 1]" 1
189 1 28 VAL HA 1 30 ASP H 6.500 . 6.500 4.285 3.799 4.780 . 0 0 "[ . 1]" 1
190 1 28 VAL HA 1 31 VAL H 6.500 . 6.500 3.672 3.367 4.128 . 0 0 "[ . 1]" 1
191 1 28 VAL HA 1 32 LEU H 6.500 . 6.500 4.340 3.796 5.221 . 0 0 "[ . 1]" 1
192 1 28 VAL HB 1 29 ALA H 4.500 . 4.500 2.676 2.573 2.903 . 0 0 "[ . 1]" 1
193 1 28 VAL HB 1 93 ILE MG 6.500 . 6.500 4.059 2.947 6.236 . 0 0 "[ . 1]" 1
194 1 28 VAL QG 1 29 ALA H 6.500 . 6.500 3.232 3.156 3.372 . 0 0 "[ . 1]" 1
195 1 28 VAL QG 1 30 ASP H 6.500 . 6.500 4.556 4.263 4.822 . 0 0 "[ . 1]" 1
196 1 28 VAL QG 1 93 ILE MG 6.500 . 6.500 3.731 2.675 4.884 . 0 0 "[ . 1]" 1
197 1 28 VAL QG 1 135 ILE MD 6.500 . 6.500 3.825 2.776 4.996 . 0 0 "[ . 1]" 1
198 1 28 VAL QG 1 166 VAL H 6.500 . 6.500 4.886 3.708 5.674 . 0 0 "[ . 1]" 1
199 1 28 VAL QG 1 166 VAL HA 6.500 . 6.500 3.282 2.025 4.144 . 0 0 "[ . 1]" 1
200 1 28 VAL QG 1 166 VAL QG 6.500 . 6.500 2.758 1.664 4.108 . 0 0 "[ . 1]" 1
201 1 28 VAL QG 1 170 ALA MB 6.500 . 6.500 4.270 3.034 5.792 . 0 0 "[ . 1]" 1
202 1 28 VAL O 1 32 LEU H 4.500 . 4.500 2.333 1.928 3.054 . 0 0 "[ . 1]" 1
203 1 28 VAL O 1 32 LEU N 4.500 . 4.500 3.245 2.868 3.972 . 0 0 "[ . 1]" 1
204 1 29 ALA H 1 31 VAL H 6.500 . 6.500 4.331 4.185 4.653 . 0 0 "[ . 1]" 1
205 1 29 ALA H 1 32 LEU QD 6.500 . 6.500 4.074 3.752 4.752 . 0 0 "[ . 1]" 1
206 1 29 ALA HA 1 32 LEU QB 6.500 . 6.500 3.997 3.177 4.508 . 0 0 "[ . 1]" 1
207 1 29 ALA HA 1 32 LEU HG 6.500 . 6.500 2.801 1.997 4.352 . 0 0 "[ . 1]" 1
208 1 29 ALA MB 1 30 ASP H 4.500 . 4.500 2.667 2.327 2.965 . 0 0 "[ . 1]" 1
209 1 29 ALA MB 1 62 LEU MD1 6.500 . 6.500 2.441 1.604 4.504 . 0 0 "[ . 1]" 1
210 1 29 ALA MB 1 62 LEU MD2 6.500 . 6.500 2.413 1.653 4.779 . 0 0 "[ . 1]" 1
211 1 29 ALA O 1 33 ALA H 4.500 . 4.500 2.574 1.989 3.234 . 0 0 "[ . 1]" 1
212 1 29 ALA O 1 33 ALA N 4.500 . 4.500 3.450 2.932 4.061 . 0 0 "[ . 1]" 1
213 1 30 ASP H 1 31 VAL H 4.500 . 4.500 2.603 2.493 2.826 . 0 0 "[ . 1]" 1
214 1 30 ASP H 1 31 VAL MG1 6.500 . 6.500 4.107 3.966 4.469 . 0 0 "[ . 1]" 1
215 1 30 ASP H 1 31 VAL QG 4.500 . 4.500 3.537 3.444 3.727 . 0 0 "[ . 1]" 1
216 1 30 ASP H 1 31 VAL MG2 6.500 . 6.500 3.866 3.704 4.021 . 0 0 "[ . 1]" 1
217 1 30 ASP HA 1 33 ALA MB 6.500 . 6.500 3.148 2.706 3.787 . 0 0 "[ . 1]" 1
218 1 30 ASP HA 1 34 GLY H 6.500 . 6.500 4.475 3.645 5.543 . 0 0 "[ . 1]" 1
219 1 30 ASP QB 1 31 VAL H 6.500 . 6.500 2.608 2.441 2.813 . 0 0 "[ . 1]" 1
220 1 30 ASP HB2 1 31 VAL H 6.500 . 6.500 3.678 2.826 3.927 . 0 0 "[ . 1]" 1
221 1 30 ASP HB3 1 31 VAL H 6.500 . 6.500 2.810 2.470 3.658 . 0 0 "[ . 1]" 1
222 1 30 ASP O 1 34 GLY H 4.500 . 4.500 2.373 1.959 3.243 . 0 0 "[ . 1]" 1
223 1 30 ASP O 1 34 GLY N 4.500 . 4.500 3.260 2.856 4.007 . 0 0 "[ . 1]" 1
224 1 31 VAL H 1 32 LEU H 6.500 . 6.500 2.604 2.497 2.740 . 0 0 "[ . 1]" 1
225 1 31 VAL QG 1 170 ALA HA 6.500 . 6.500 5.804 4.170 7.336 0.836 6 1 "[ .+ 1]" 1
226 1 31 VAL QG 1 170 ALA MB 6.500 . 6.500 4.359 2.593 5.941 . 0 0 "[ . 1]" 1
227 1 31 VAL O 1 35 ARG H 4.500 . 4.500 2.732 2.258 3.228 . 0 0 "[ . 1]" 1
228 1 31 VAL O 1 35 ARG N 4.500 . 4.500 3.395 3.051 3.831 . 0 0 "[ . 1]" 1
229 1 32 LEU HA 1 33 ALA H 4.500 . 4.500 3.493 3.445 3.567 . 0 0 "[ . 1]" 1
230 1 32 LEU HA 1 34 GLY H 6.500 . 6.500 4.291 3.790 4.669 . 0 0 "[ . 1]" 1
231 1 32 LEU HA 1 35 ARG H 6.500 . 6.500 3.483 3.218 3.755 . 0 0 "[ . 1]" 1
232 1 32 LEU HA 1 35 ARG QB 6.500 . 6.500 3.130 2.453 3.821 . 0 0 "[ . 1]" 1
233 1 32 LEU HA 1 36 ILE H 6.500 . 6.500 4.918 4.379 5.776 . 0 0 "[ . 1]" 1
234 1 32 LEU QD 1 174 GLU QB 6.500 . 6.500 5.568 5.066 6.432 . 0 0 "[ . 1]" 1
235 1 32 LEU QD 1 174 GLU QG 6.500 . 6.500 5.416 3.635 6.511 0.011 1 0 "[ . 1]" 1
236 1 32 LEU O 1 36 ILE H 4.500 . 4.500 2.845 2.300 3.598 . 0 0 "[ . 1]" 1
237 1 32 LEU O 1 36 ILE N 4.500 . 4.500 3.722 3.226 4.415 . 0 0 "[ . 1]" 1
238 1 33 ALA H 1 34 GLY H 6.500 . 6.500 2.566 2.436 2.752 . 0 0 "[ . 1]" 1
239 1 33 ALA H 1 35 ARG H 6.500 . 6.500 3.972 3.787 4.109 . 0 0 "[ . 1]" 1
240 1 33 ALA HA 1 36 ILE H 6.500 . 6.500 3.744 3.499 4.228 . 0 0 "[ . 1]" 1
241 1 33 ALA HA 1 36 ILE HB 6.500 . 6.500 4.304 3.224 5.074 . 0 0 "[ . 1]" 1
242 1 33 ALA HA 1 38 SER HA 6.500 . 6.500 5.900 4.894 6.526 0.026 3 0 "[ . 1]" 1
243 1 33 ALA HA 1 62 LEU QD 6.500 . 6.500 4.947 3.766 6.340 . 0 0 "[ . 1]" 1
244 1 33 ALA MB 1 34 GLY H 4.500 . 4.500 2.576 2.395 2.862 . 0 0 "[ . 1]" 1
245 1 33 ALA MB 1 35 ARG H 6.500 . 6.500 4.309 4.169 4.465 . 0 0 "[ . 1]" 1
246 1 33 ALA MB 1 36 ILE H 6.500 . 6.500 4.794 4.548 5.123 . 0 0 "[ . 1]" 1
247 1 33 ALA MB 1 38 SER QB 6.500 . 6.500 2.478 1.872 3.232 . 0 0 "[ . 1]" 1
248 1 33 ALA MB 1 51 VAL HB 6.500 . 6.500 4.150 3.608 4.865 . 0 0 "[ . 1]" 1
249 1 33 ALA MB 1 51 VAL MG1 6.500 . 6.500 2.661 2.092 3.603 . 0 0 "[ . 1]" 1
250 1 33 ALA MB 1 51 VAL MG2 6.500 . 6.500 2.694 2.092 4.286 . 0 0 "[ . 1]" 1
251 1 33 ALA MB 1 62 LEU QD 6.500 . 6.500 3.325 2.478 4.433 . 0 0 "[ . 1]" 1
252 1 34 GLY QA 1 35 ARG H 4.500 . 4.500 2.867 2.827 2.892 . 0 0 "[ . 1]" 1
253 1 35 ARG H 1 35 ARG HD2 6.500 . 6.500 4.594 3.968 5.973 . 0 0 "[ . 1]" 1
254 1 35 ARG H 1 35 ARG HD3 6.500 . 6.500 4.290 3.499 4.990 . 0 0 "[ . 1]" 1
255 1 35 ARG H 1 36 ILE H 6.500 . 6.500 2.570 2.337 2.768 . 0 0 "[ . 1]" 1
256 1 35 ARG H 1 37 GLY H 6.500 . 6.500 3.735 3.575 3.969 . 0 0 "[ . 1]" 1
257 1 35 ARG HA 1 38 SER QB 6.500 . 6.500 6.715 6.633 6.802 0.302 8 0 "[ . 1]" 1
258 1 35 ARG QB 1 36 ILE H 6.500 . 6.500 2.644 2.278 3.025 . 0 0 "[ . 1]" 1
259 1 36 ILE H 1 36 ILE MD 4.500 . 4.500 3.031 1.582 4.224 . 0 0 "[ . 1]" 1
260 1 36 ILE H 1 36 ILE MG 4.500 . 4.500 2.884 1.889 3.810 . 0 0 "[ . 1]" 1
261 1 36 ILE H 1 37 GLY H 6.500 . 6.500 2.426 2.265 2.614 . 0 0 "[ . 1]" 1
262 1 36 ILE HA 1 37 GLY H 4.500 . 4.500 3.381 3.334 3.499 . 0 0 "[ . 1]" 1
263 1 36 ILE HA 1 38 SER H 6.500 . 6.500 5.250 4.432 6.019 . 0 0 "[ . 1]" 1
264 1 36 ILE HB 1 37 GLY H 6.500 . 6.500 3.742 2.924 4.265 . 0 0 "[ . 1]" 1
265 1 36 ILE HB 1 38 SER H 6.500 . 6.500 4.604 2.741 6.073 . 0 0 "[ . 1]" 1
266 1 36 ILE HB 1 38 SER QB 6.500 . 6.500 3.976 2.288 5.126 . 0 0 "[ . 1]" 1
267 1 36 ILE QG 1 55 LEU QD 6.500 . 6.500 3.241 2.052 4.719 . 0 0 "[ . 1]" 1
268 1 36 ILE MG 1 37 GLY H 6.500 . 6.500 3.243 2.702 4.053 . 0 0 "[ . 1]" 1
269 1 36 ILE MG 1 38 SER H 6.500 . 6.500 3.590 2.830 4.595 . 0 0 "[ . 1]" 1
270 1 36 ILE MG 1 51 VAL QG 6.500 . 6.500 4.968 3.528 6.472 . 0 0 "[ . 1]" 1
271 1 37 GLY H 1 38 SER H 4.500 . 4.500 2.311 2.034 2.570 . 0 0 "[ . 1]" 1
272 1 38 SER H 1 39 ALA H 6.500 . 6.500 4.314 4.034 4.571 . 0 0 "[ . 1]" 1
273 1 38 SER HA 1 39 ALA H 4.500 . 4.500 2.189 2.122 2.288 . 0 0 "[ . 1]" 1
274 1 38 SER QB 1 39 ALA H 6.500 . 6.500 3.259 2.663 3.850 . 0 0 "[ . 1]" 1
275 1 38 SER QB 1 51 VAL QG 6.500 . 6.500 2.593 1.720 3.244 . 0 0 "[ . 1]" 1
276 1 39 ALA H 1 51 VAL HB 6.500 . 6.500 5.443 4.268 6.522 0.022 2 0 "[ . 1]" 1
277 1 39 ALA HA 1 40 PHE H 4.500 . 4.500 2.191 2.135 2.299 . 0 0 "[ . 1]" 1
278 1 39 ALA HA 1 51 VAL MG1 6.500 . 6.500 4.904 3.979 6.135 . 0 0 "[ . 1]" 1
279 1 39 ALA HA 1 51 VAL MG2 6.500 . 6.500 3.563 2.583 4.622 . 0 0 "[ . 1]" 1
280 1 40 PHE H 1 40 PHE QD 4.500 . 4.500 3.073 1.884 4.349 . 0 0 "[ . 1]" 1
281 1 40 PHE H 1 41 LYS H 6.500 . 6.500 4.387 4.017 4.586 . 0 0 "[ . 1]" 1
282 1 40 PHE H 1 51 VAL HB 6.500 . 6.500 3.496 2.432 4.876 . 0 0 "[ . 1]" 1
283 1 40 PHE HA 1 41 LYS H 4.500 . 4.500 2.539 2.183 3.112 . 0 0 "[ . 1]" 1
284 1 40 PHE HA 1 51 VAL HA 6.500 . 6.500 3.925 2.829 4.920 . 0 0 "[ . 1]" 1
285 1 40 PHE QB 1 41 LYS H 6.500 . 6.500 2.491 1.561 2.954 . 0 0 "[ . 1]" 1
286 1 40 PHE QB 1 49 GLU QB 6.500 . 6.500 4.386 2.986 5.772 . 0 0 "[ . 1]" 1
287 1 40 PHE QB 1 50 VAL H 6.500 . 6.500 4.129 3.319 5.911 . 0 0 "[ . 1]" 1
288 1 40 PHE QB 1 51 VAL QG 6.500 . 6.500 2.515 2.047 4.004 . 0 0 "[ . 1]" 1
289 1 40 PHE QD 1 41 LYS H 4.500 . 4.500 3.277 2.232 4.056 . 0 0 "[ . 1]" 1
290 1 40 PHE QD 1 50 VAL H 6.500 . 6.500 4.533 3.484 6.056 . 0 0 "[ . 1]" 1
291 1 40 PHE QD 1 51 VAL H 6.500 . 6.500 5.133 3.980 6.374 . 0 0 "[ . 1]" 1
292 1 40 PHE QD 1 51 VAL MG1 6.500 . 6.500 4.241 2.869 5.319 . 0 0 "[ . 1]" 1
293 1 41 LYS H 1 41 LYS HD2 6.500 . 6.500 4.518 2.400 5.427 . 0 0 "[ . 1]" 1
294 1 41 LYS H 1 41 LYS HD3 6.500 . 6.500 4.449 3.149 5.224 . 0 0 "[ . 1]" 1
295 1 41 LYS H 1 41 LYS HE2 6.500 . 6.500 5.427 4.920 6.463 . 0 0 "[ . 1]" 1
296 1 41 LYS H 1 41 LYS HE3 6.500 . 6.500 5.270 4.793 5.664 . 0 0 "[ . 1]" 1
297 1 41 LYS H 1 50 VAL H 6.500 . 6.500 3.888 2.787 4.936 . 0 0 "[ . 1]" 1
298 1 41 LYS H 1 50 VAL MG2 6.500 . 6.500 4.884 3.238 6.620 0.120 4 0 "[ . 1]" 1
299 1 41 LYS H 1 50 VAL O 4.500 . 4.500 2.979 1.873 3.974 . 0 0 "[ . 1]" 1
300 1 41 LYS HA 1 41 LYS HE2 6.500 . 6.500 4.887 4.094 5.688 . 0 0 "[ . 1]" 1
301 1 41 LYS HA 1 41 LYS HE3 6.500 . 6.500 4.731 4.191 5.378 . 0 0 "[ . 1]" 1
302 1 41 LYS HA 1 42 VAL H 4.500 . 4.500 2.437 2.161 2.558 . 0 0 "[ . 1]" 1
303 1 41 LYS HB2 1 42 VAL H 6.500 . 6.500 2.574 2.096 4.121 . 0 0 "[ . 1]" 1
304 1 41 LYS HB3 1 42 VAL H 6.500 . 6.500 3.454 2.335 3.702 . 0 0 "[ . 1]" 1
305 1 41 LYS N 1 50 VAL O 4.500 . 4.500 3.672 2.850 4.450 . 0 0 "[ . 1]" 1
306 1 41 LYS O 1 50 VAL H 4.500 . 4.500 2.474 1.844 3.304 . 0 0 "[ . 1]" 1
307 1 41 LYS O 1 50 VAL N 4.500 . 4.500 3.371 2.785 4.085 . 0 0 "[ . 1]" 1
308 1 42 VAL H 1 43 HIS H 6.500 . 6.500 4.424 4.214 4.622 . 0 0 "[ . 1]" 1
309 1 42 VAL HA 1 49 GLU HA 6.500 . 6.500 2.319 1.516 3.054 . 0 0 "[ . 1]" 1
310 1 42 VAL HA 1 50 VAL H 6.500 . 6.500 3.411 2.653 4.352 . 0 0 "[ . 1]" 1
311 1 42 VAL HB 1 43 HIS H 6.500 . 6.500 4.245 4.106 4.376 . 0 0 "[ . 1]" 1
312 1 42 VAL QG 1 43 HIS H 6.500 . 6.500 2.825 2.537 3.172 . 0 0 "[ . 1]" 1
313 1 43 HIS H 1 48 ALA H 6.500 . 6.500 4.858 4.122 6.245 . 0 0 "[ . 1]" 1
314 1 43 HIS H 1 48 ALA O 4.500 . 4.500 2.728 1.700 3.833 . 0 0 "[ . 1]" 1
315 1 43 HIS H 1 49 GLU HA 6.500 . 6.500 3.087 1.752 4.585 . 0 0 "[ . 1]" 1
316 1 43 HIS QB 1 50 VAL QG 6.500 . 6.500 2.492 1.926 2.903 . 0 0 "[ . 1]" 1
317 1 43 HIS QB 1 79 LEU MD1 6.500 . 6.500 5.784 4.352 6.555 0.055 2 0 "[ . 1]" 1
318 1 43 HIS HB2 1 49 GLU HA 6.500 . 6.500 5.022 3.425 6.192 . 0 0 "[ . 1]" 1
319 1 43 HIS HB3 1 49 GLU HA 6.500 . 6.500 5.076 2.836 6.333 . 0 0 "[ . 1]" 1
320 1 43 HIS N 1 48 ALA O 4.500 . 4.500 3.528 2.675 4.435 . 0 0 "[ . 1]" 1
321 1 43 HIS O 1 48 ALA H 4.500 . 4.500 4.128 3.696 4.436 . 0 0 "[ . 1]" 1
322 1 43 HIS O 1 48 ALA N 4.500 . 4.500 4.374 3.281 4.727 0.227 2 0 "[ . 1]" 1
323 1 45 LYS HA 1 45 LYS HE2 6.500 . 6.500 4.459 2.742 5.839 . 0 0 "[ . 1]" 1
324 1 45 LYS HA 1 45 LYS HE3 6.500 . 6.500 4.267 2.278 4.961 . 0 0 "[ . 1]" 1
325 1 46 SER H 1 47 GLY H 6.500 . 6.500 2.576 2.022 2.932 . 0 0 "[ . 1]" 1
326 1 46 SER HA 1 78 PRO HB2 4.500 . 4.500 3.982 2.151 4.733 0.233 7 0 "[ . 1]" 1
327 1 46 SER HA 1 78 PRO HB3 6.500 . 6.500 5.076 3.145 6.046 . 0 0 "[ . 1]" 1
328 1 46 SER QB 1 79 LEU QB 6.500 . 6.500 3.838 2.414 4.882 . 0 0 "[ . 1]" 1
329 1 46 SER HB2 1 78 PRO HB3 6.500 . 6.500 4.890 3.529 6.245 . 0 0 "[ . 1]" 1
330 1 46 SER HB2 1 79 LEU MD1 6.500 . 6.500 4.800 2.083 6.756 0.256 2 0 "[ . 1]" 1
331 1 46 SER HB3 1 78 PRO HB2 4.500 . 4.500 3.413 2.492 4.696 0.196 5 0 "[ . 1]" 1
332 1 46 SER HB3 1 79 LEU MD2 6.500 . 6.500 4.589 3.144 6.665 0.165 7 0 "[ . 1]" 1
333 1 47 GLY H 1 48 ALA H 4.500 . 4.500 2.916 2.066 3.598 . 0 0 "[ . 1]" 1
334 1 47 GLY H 1 48 ALA MB 6.500 . 6.500 4.408 3.212 5.142 . 0 0 "[ . 1]" 1
335 1 48 ALA H 1 49 GLU H 6.500 . 6.500 4.292 2.934 4.600 . 0 0 "[ . 1]" 1
336 1 48 ALA HA 1 49 GLU H 4.500 . 4.500 2.544 2.242 3.572 . 0 0 "[ . 1]" 1
337 1 48 ALA HA 1 65 PRO HA 6.500 . 6.500 4.531 3.183 6.400 . 0 0 "[ . 1]" 1
338 1 48 ALA MB 1 49 GLU H 4.500 . 4.500 2.596 1.951 3.601 . 0 0 "[ . 1]" 1
339 1 48 ALA MB 1 50 VAL H 6.500 . 6.500 4.902 4.190 5.616 . 0 0 "[ . 1]" 1
340 1 48 ALA MB 1 50 VAL QG 6.500 . 6.500 2.965 1.752 4.535 . 0 0 "[ . 1]" 1
341 1 48 ALA MB 1 63 ALA MB 6.500 . 6.500 3.540 2.343 5.518 . 0 0 "[ . 1]" 1
342 1 48 ALA MB 1 65 PRO HA 6.500 . 6.500 3.381 2.197 6.229 . 0 0 "[ . 1]" 1
343 1 48 ALA MB 1 79 LEU QD 6.500 . 6.500 3.071 1.708 5.757 . 0 0 "[ . 1]" 1
344 1 49 GLU H 1 49 GLU HG2 4.500 . 4.500 3.658 3.360 4.160 . 0 0 "[ . 1]" 1
345 1 49 GLU H 1 49 GLU HG3 4.500 . 4.500 2.622 1.993 3.355 . 0 0 "[ . 1]" 1
346 1 49 GLU H 1 50 VAL H 6.500 . 6.500 4.426 4.136 4.594 . 0 0 "[ . 1]" 1
347 1 49 GLU H 1 50 VAL MG1 6.500 . 6.500 4.865 3.225 6.512 0.012 2 0 "[ . 1]" 1
348 1 49 GLU H 1 50 VAL MG2 6.500 . 6.500 4.723 3.685 5.801 . 0 0 "[ . 1]" 1
349 1 49 GLU H 1 64 LYS H 6.500 . 6.500 3.684 3.058 4.290 . 0 0 "[ . 1]" 1
350 1 49 GLU H 1 64 LYS O 4.500 . 4.500 2.781 2.202 4.014 . 0 0 "[ . 1]" 1
351 1 49 GLU HA 1 50 VAL H 4.500 . 4.500 2.173 2.106 2.258 . 0 0 "[ . 1]" 1
352 1 49 GLU QB 1 64 LYS H 6.500 . 6.500 3.312 2.741 3.717 . 0 0 "[ . 1]" 1
353 1 49 GLU HB2 1 50 VAL H 6.500 . 6.500 4.251 3.955 4.401 . 0 0 "[ . 1]" 1
354 1 49 GLU HB3 1 50 VAL H 6.500 . 6.500 3.374 2.963 3.567 . 0 0 "[ . 1]" 1
355 1 49 GLU QG 1 50 VAL H 6.500 . 6.500 4.157 4.059 4.297 . 0 0 "[ . 1]" 1
356 1 49 GLU QG 1 64 LYS H 6.500 . 6.500 5.065 4.724 5.554 . 0 0 "[ . 1]" 1
357 1 49 GLU N 1 64 LYS O 4.500 . 4.500 3.544 3.033 4.525 0.025 6 0 "[ . 1]" 1
358 1 49 GLU O 1 64 LYS H 4.500 . 4.500 2.015 1.666 3.063 . 0 0 "[ . 1]" 1
359 1 49 GLU O 1 64 LYS N 4.500 . 4.500 2.928 2.624 3.732 . 0 0 "[ . 1]" 1
360 1 50 VAL HA 1 51 VAL H 4.500 . 4.500 2.181 2.137 2.242 . 0 0 "[ . 1]" 1
361 1 50 VAL HA 1 63 ALA HA 6.500 . 6.500 2.522 2.172 2.946 . 0 0 "[ . 1]" 1
362 1 50 VAL HB 1 51 VAL H 6.500 . 6.500 3.390 2.738 4.159 . 0 0 "[ . 1]" 1
363 1 50 VAL HB 1 52 THR MG 6.500 . 6.500 5.000 3.562 6.508 0.008 8 0 "[ . 1]" 1
364 1 50 VAL HB 1 61 VAL QG 6.500 . 6.500 3.444 2.377 5.311 . 0 0 "[ . 1]" 1
365 1 50 VAL QG 1 52 THR H 6.500 . 6.500 3.962 3.343 4.773 . 0 0 "[ . 1]" 1
366 1 50 VAL QG 1 52 THR MG 6.500 . 6.500 3.924 3.199 4.846 . 0 0 "[ . 1]" 1
367 1 50 VAL QG 1 61 VAL QG 6.500 . 6.500 2.571 1.888 3.233 . 0 0 "[ . 1]" 1
368 1 50 VAL QG 1 63 ALA HA 6.500 . 6.500 2.539 1.611 3.283 . 0 0 "[ . 1]" 1
369 1 50 VAL MG1 1 51 VAL H 6.500 . 6.500 3.292 2.488 3.935 . 0 0 "[ . 1]" 1
370 1 50 VAL MG2 1 51 VAL H 6.500 . 6.500 3.895 3.728 4.087 . 0 0 "[ . 1]" 1
371 1 51 VAL H 1 52 THR H 6.500 . 6.500 4.228 4.089 4.386 . 0 0 "[ . 1]" 1
372 1 51 VAL H 1 62 LEU H 4.500 . 4.500 3.288 2.995 3.589 . 0 0 "[ . 1]" 1
373 1 51 VAL H 1 62 LEU O 4.500 . 4.500 2.012 1.776 2.356 . 0 0 "[ . 1]" 1
374 1 51 VAL H 1 63 ALA HA 6.500 . 6.500 3.810 3.236 4.391 . 0 0 "[ . 1]" 1
375 1 51 VAL H 1 63 ALA MB 6.500 . 6.500 4.750 4.152 5.337 . 0 0 "[ . 1]" 1
376 1 51 VAL HA 1 52 THR H 4.000 . 4.000 2.147 2.103 2.208 . 0 0 "[ . 1]" 1
377 1 51 VAL HA 1 52 THR MG 6.500 . 6.500 4.643 3.631 5.436 . 0 0 "[ . 1]" 1
378 1 51 VAL HB 1 52 THR H 6.500 . 6.500 4.221 4.086 4.299 . 0 0 "[ . 1]" 1
379 1 51 VAL HB 1 62 LEU QD 6.500 . 6.500 4.555 4.172 5.383 . 0 0 "[ . 1]" 1
380 1 51 VAL QG 1 52 THR H 4.500 . 4.500 2.789 2.410 3.052 . 0 0 "[ . 1]" 1
381 1 51 VAL MG1 1 52 THR H 6.500 . 6.500 4.137 3.912 4.301 . 0 0 "[ . 1]" 1
382 1 51 VAL MG1 1 53 GLY H 6.500 . 6.500 4.635 3.898 5.258 . 0 0 "[ . 1]" 1
383 1 51 VAL MG2 1 52 THR H 6.500 . 6.500 2.836 2.433 3.122 . 0 0 "[ . 1]" 1
384 1 51 VAL MG2 1 53 GLY H 6.500 . 6.500 4.001 3.533 4.426 . 0 0 "[ . 1]" 1
385 1 51 VAL N 1 62 LEU O 4.500 . 4.500 2.959 2.759 3.237 . 0 0 "[ . 1]" 1
386 1 51 VAL O 1 62 LEU H 4.500 . 4.500 2.187 1.851 2.653 . 0 0 "[ . 1]" 1
387 1 51 VAL O 1 62 LEU N 4.500 . 4.500 3.136 2.807 3.593 . 0 0 "[ . 1]" 1
388 1 52 THR H 1 53 GLY H 6.500 . 6.500 4.356 4.211 4.489 . 0 0 "[ . 1]" 1
389 1 52 THR HA 1 53 GLY H 4.500 . 4.500 2.143 2.115 2.185 . 0 0 "[ . 1]" 1
390 1 52 THR HA 1 61 VAL HA 6.500 . 6.500 2.811 2.461 3.409 . 0 0 "[ . 1]" 1
391 1 52 THR HA 1 62 LEU H 6.500 . 6.500 3.504 2.914 3.999 . 0 0 "[ . 1]" 1
392 1 52 THR MG 1 53 GLY H 4.500 . 4.500 3.413 2.502 4.128 . 0 0 "[ . 1]" 1
393 1 52 THR MG 1 61 VAL MG1 6.500 . 6.500 3.300 1.929 4.705 . 0 0 "[ . 1]" 1
394 1 52 THR MG 1 61 VAL MG2 6.500 . 6.500 2.845 1.706 4.208 . 0 0 "[ . 1]" 1
395 1 53 GLY H 1 54 ARG H 6.500 . 6.500 4.367 4.268 4.469 . 0 0 "[ . 1]" 1
396 1 53 GLY H 1 60 VAL H 6.500 . 6.500 3.305 3.156 3.437 . 0 0 "[ . 1]" 1
397 1 53 GLY H 1 60 VAL QG 6.500 . 6.500 3.201 2.749 3.578 . 0 0 "[ . 1]" 1
398 1 53 GLY H 1 60 VAL O 4.500 . 4.500 2.338 2.036 2.689 . 0 0 "[ . 1]" 1
399 1 53 GLY H 1 61 VAL HA 4.500 . 4.500 3.851 3.513 4.213 . 0 0 "[ . 1]" 1
400 1 53 GLY H 1 61 VAL QG 6.500 . 6.500 4.338 3.546 4.705 . 0 0 "[ . 1]" 1
401 1 53 GLY QA 1 54 ARG H 4.000 . 4.000 2.265 2.230 2.289 . 0 0 "[ . 1]" 1
402 1 53 GLY N 1 60 VAL O 4.500 . 4.500 3.262 3.014 3.665 . 0 0 "[ . 1]" 1
403 1 53 GLY O 1 60 VAL H 4.500 . 4.500 1.785 1.717 1.884 . 0 0 "[ . 1]" 1
404 1 53 GLY O 1 60 VAL N 4.500 . 4.500 2.745 2.676 2.862 . 0 0 "[ . 1]" 1
405 1 54 ARG H 1 54 ARG HD2 6.500 . 6.500 4.975 4.723 5.467 . 0 0 "[ . 1]" 1
406 1 54 ARG H 1 54 ARG HD3 6.500 . 6.500 4.635 4.201 5.208 . 0 0 "[ . 1]" 1
407 1 54 ARG H 1 54 ARG HG2 4.000 . 4.000 2.473 1.933 3.857 . 0 0 "[ . 1]" 1
408 1 54 ARG H 1 54 ARG HG3 4.000 . 4.000 3.025 2.772 3.281 . 0 0 "[ . 1]" 1
409 1 54 ARG H 1 55 LEU H 6.500 . 6.500 4.163 3.933 4.378 . 0 0 "[ . 1]" 1
410 1 54 ARG HA 1 55 LEU H 4.500 . 4.500 2.145 2.106 2.217 . 0 0 "[ . 1]" 1
411 1 54 ARG HA 1 59 SER HA 6.500 . 6.500 2.023 1.738 2.328 . 0 0 "[ . 1]" 1
412 1 54 ARG HD3 1 55 LEU H 6.500 . 6.500 6.261 5.471 7.050 0.550 5 1 "[ + 1]" 1
413 1 55 LEU H 1 55 LEU HG 4.000 . 4.000 2.736 1.887 3.964 . 0 0 "[ . 1]" 1
414 1 55 LEU H 1 56 ALA H 6.500 . 6.500 4.430 4.319 4.506 . 0 0 "[ . 1]" 1
415 1 55 LEU H 1 58 THR H 6.500 . 6.500 4.245 3.572 4.726 . 0 0 "[ . 1]" 1
416 1 55 LEU H 1 58 THR O 4.500 . 4.500 2.443 2.132 2.935 . 0 0 "[ . 1]" 1
417 1 55 LEU HA 1 56 ALA H 4.500 . 4.500 2.198 2.118 2.336 . 0 0 "[ . 1]" 1
418 1 55 LEU HA 1 57 GLY H 6.500 . 6.500 3.880 3.154 4.590 . 0 0 "[ . 1]" 1
419 1 55 LEU HA 1 57 GLY QA 6.500 . 6.500 5.265 4.977 5.547 . 0 0 "[ . 1]" 1
420 1 55 LEU HA 1 60 VAL QG 6.500 . 6.500 4.522 3.767 5.378 . 0 0 "[ . 1]" 1
421 1 55 LEU QD 1 56 ALA H 4.500 . 4.500 3.558 3.431 3.907 . 0 0 "[ . 1]" 1
422 1 55 LEU N 1 58 THR O 4.500 . 4.500 3.147 2.923 3.501 . 0 0 "[ . 1]" 1
423 1 55 LEU O 1 58 THR H 4.500 . 4.500 2.661 2.183 3.216 . 0 0 "[ . 1]" 1
424 1 55 LEU O 1 58 THR N 4.500 . 4.500 3.339 3.009 3.641 . 0 0 "[ . 1]" 1
425 1 56 ALA H 1 57 GLY H 6.500 . 6.500 3.322 2.676 3.921 . 0 0 "[ . 1]" 1
426 1 56 ALA MB 1 57 GLY H 6.500 . 6.500 2.638 1.976 3.461 . 0 0 "[ . 1]" 1
427 1 56 ALA MB 1 58 THR H 6.500 . 6.500 3.216 3.016 3.489 . 0 0 "[ . 1]" 1
428 1 56 ALA MB 1 176 LEU QB 6.500 . 6.500 5.943 5.365 6.576 0.076 5 0 "[ . 1]" 1
429 1 56 ALA MB 1 177 ILE MD 6.500 . 6.500 4.160 2.755 5.926 . 0 0 "[ . 1]" 1
430 1 56 ALA MB 1 178 ALA MB 6.500 . 6.500 2.316 1.792 2.905 . 0 0 "[ . 1]" 1
431 1 57 GLY H 1 58 THR H 6.500 . 6.500 2.154 1.778 2.685 . 0 0 "[ . 1]" 1
432 1 58 THR H 1 59 SER H 6.500 . 6.500 4.526 4.329 4.616 . 0 0 "[ . 1]" 1
433 1 58 THR HA 1 59 SER H 4.500 . 4.500 2.205 2.157 2.253 . 0 0 "[ . 1]" 1
434 1 58 THR HB 1 177 ILE MD 6.500 . 6.500 4.080 3.084 4.859 . 0 0 "[ . 1]" 1
435 1 58 THR MG 1 59 SER H 4.500 . 4.500 2.534 2.269 3.149 . 0 0 "[ . 1]" 1
436 1 59 SER HA 1 60 VAL H 4.500 . 4.500 2.183 2.133 2.249 . 0 0 "[ . 1]" 1
437 1 59 SER HB2 1 60 VAL H 6.500 . 6.500 3.864 2.983 4.280 . 0 0 "[ . 1]" 1
438 1 59 SER HB3 1 60 VAL H 6.500 . 6.500 3.628 2.925 4.242 . 0 0 "[ . 1]" 1
439 1 60 VAL H 1 61 VAL H 6.500 . 6.500 4.423 4.354 4.499 . 0 0 "[ . 1]" 1
440 1 60 VAL HA 1 61 VAL H 4.500 . 4.500 2.291 2.148 2.468 . 0 0 "[ . 1]" 1
441 1 60 VAL HA 1 61 VAL QG 6.500 . 6.500 3.402 3.251 3.585 . 0 0 "[ . 1]" 1
442 1 60 VAL HB 1 61 VAL H 4.500 . 4.500 2.649 2.200 3.108 . 0 0 "[ . 1]" 1
443 1 61 VAL H 1 62 LEU H 6.500 . 6.500 4.154 4.090 4.243 . 0 0 "[ . 1]" 1
444 1 61 VAL HA 1 62 LEU H 4.500 . 4.500 2.154 2.118 2.179 . 0 0 "[ . 1]" 1
445 1 61 VAL QG 1 62 LEU H 4.500 . 4.500 3.115 2.956 3.592 . 0 0 "[ . 1]" 1
446 1 61 VAL MG1 1 62 LEU H 6.500 . 6.500 3.219 3.021 3.874 . 0 0 "[ . 1]" 1
447 1 61 VAL MG2 1 62 LEU H 6.500 . 6.500 4.216 4.093 4.282 . 0 0 "[ . 1]" 1
448 1 62 LEU H 1 63 ALA H 6.500 . 6.500 4.368 4.152 4.484 . 0 0 "[ . 1]" 1
449 1 62 LEU H 1 63 ALA MB 6.500 . 6.500 4.950 4.698 5.249 . 0 0 "[ . 1]" 1
450 1 62 LEU HA 1 63 ALA H 4.500 . 4.500 2.148 2.118 2.171 . 0 0 "[ . 1]" 1
451 1 62 LEU QD 1 63 ALA H 6.500 . 6.500 2.681 2.168 4.389 . 0 0 "[ . 1]" 1
452 1 62 LEU MD1 1 63 ALA H 6.500 . 6.500 2.965 2.187 4.879 . 0 0 "[ . 1]" 1
453 1 62 LEU MD2 1 63 ALA H 6.500 . 6.500 3.722 2.312 5.068 . 0 0 "[ . 1]" 1
454 1 63 ALA H 1 64 LYS H 6.500 . 6.500 4.398 4.290 4.484 . 0 0 "[ . 1]" 1
455 1 63 ALA HA 1 64 LYS H 4.500 . 4.500 2.182 2.106 2.463 . 0 0 "[ . 1]" 1
456 1 63 ALA MB 1 64 LYS H 4.500 . 4.500 2.939 2.327 3.177 . 0 0 "[ . 1]" 1
457 1 63 ALA MB 1 79 LEU QD 6.500 . 6.500 2.673 1.937 3.286 . 0 0 "[ . 1]" 1
458 1 63 ALA MB 1 79 LEU HG 6.500 . 6.500 3.512 2.526 5.223 . 0 0 "[ . 1]" 1
459 1 64 LYS H 1 64 LYS HD2 6.500 . 6.500 3.812 2.010 5.149 . 0 0 "[ . 1]" 1
460 1 64 LYS H 1 64 LYS HD3 6.500 . 6.500 3.447 1.668 5.247 . 0 0 "[ . 1]" 1
461 1 64 LYS H 1 64 LYS HE2 6.500 . 6.500 4.765 3.936 5.803 . 0 0 "[ . 1]" 1
462 1 64 LYS H 1 64 LYS HE3 6.500 . 6.500 4.501 2.769 5.949 . 0 0 "[ . 1]" 1
463 1 64 LYS HA 1 64 LYS HE2 6.500 . 6.500 5.304 4.318 6.295 . 0 0 "[ . 1]" 1
464 1 64 LYS HA 1 64 LYS HE3 6.500 . 6.500 4.953 3.889 6.017 . 0 0 "[ . 1]" 1
465 1 65 PRO QG 1 72 SER QB 6.500 . 6.500 3.201 2.216 5.251 . 0 0 "[ . 1]" 1
466 1 66 ARG H 1 66 ARG HD2 6.500 . 6.500 4.635 3.782 5.043 . 0 0 "[ . 1]" 1
467 1 66 ARG H 1 66 ARG HD3 6.500 . 6.500 4.944 3.642 5.351 . 0 0 "[ . 1]" 1
468 1 66 ARG H 1 67 CYS H 4.500 . 4.500 2.299 2.115 2.400 . 0 0 "[ . 1]" 1
469 1 66 ARG H 1 68 TYR H 6.500 . 6.500 6.567 6.497 6.626 0.126 1 0 "[ . 1]" 1
470 1 66 ARG HA 1 67 CYS H 6.500 . 6.500 3.096 3.023 3.383 . 0 0 "[ . 1]" 1
471 1 66 ARG QB 1 67 CYS H 4.500 . 4.500 3.516 3.013 3.645 . 0 0 "[ . 1]" 1
472 1 66 ARG QB 1 68 TYR H 6.500 . 6.500 6.370 5.961 6.540 0.040 1 0 "[ . 1]" 1
473 1 67 CYS H 1 68 TYR H 6.500 . 6.500 4.439 4.365 4.509 . 0 0 "[ . 1]" 1
474 1 67 CYS HA 1 68 TYR H 4.500 . 4.500 2.463 2.213 2.590 . 0 0 "[ . 1]" 1
475 1 67 CYS QB 1 68 TYR H 6.500 . 6.500 2.329 2.052 2.967 . 0 0 "[ . 1]" 1
476 1 67 CYS QB 1 71 GLU QB 6.500 . 6.500 2.259 1.603 3.576 . 0 0 "[ . 1]" 1
477 1 67 CYS QB 1 75 GLN QG 6.500 . 6.500 3.450 2.694 4.240 . 0 0 "[ . 1]" 1
478 1 68 TYR H 1 68 TYR HD1 4.500 . 4.500 3.358 1.799 4.902 0.402 10 0 "[ . 1]" 1
479 1 68 TYR QB 1 69 MET H 6.500 . 6.500 2.031 1.687 2.435 . 0 0 "[ . 1]" 1
480 1 68 TYR QB 1 71 GLU H 6.500 . 6.500 3.870 3.069 4.916 . 0 0 "[ . 1]" 1
481 1 68 TYR HB2 1 69 MET H 6.500 . 6.500 2.812 1.693 3.814 . 0 0 "[ . 1]" 1
482 1 68 TYR HB3 1 69 MET H 6.500 . 6.500 2.605 1.772 3.635 . 0 0 "[ . 1]" 1
483 1 68 TYR O 1 72 SER H 4.500 . 4.500 2.440 1.872 2.969 . 0 0 "[ . 1]" 1
484 1 68 TYR O 1 72 SER N 4.500 . 4.500 3.040 2.760 3.466 . 0 0 "[ . 1]" 1
485 1 69 MET HA 1 71 GLU H 6.500 . 6.500 4.317 3.807 5.212 . 0 0 "[ . 1]" 1
486 1 69 MET HA 1 72 SER H 6.500 . 6.500 3.471 3.007 4.022 . 0 0 "[ . 1]" 1
487 1 69 MET HA 1 72 SER QB 6.500 . 6.500 2.655 1.747 3.382 . 0 0 "[ . 1]" 1
488 1 69 MET HA 1 117 GLY QA 6.500 . 6.500 4.371 3.173 5.673 . 0 0 "[ . 1]" 1
489 1 69 MET QG 1 117 GLY QA 6.500 . 6.500 3.130 1.922 4.284 . 0 0 "[ . 1]" 1
490 1 69 MET O 1 73 GLY H 4.500 . 4.500 3.547 3.124 3.756 . 0 0 "[ . 1]" 1
491 1 69 MET O 1 73 GLY N 4.500 . 4.500 4.393 3.986 4.561 0.061 8 0 "[ . 1]" 1
492 1 70 ASN HA 1 116 ASN QB 6.500 . 6.500 5.024 4.420 5.685 . 0 0 "[ . 1]" 1
493 1 70 ASN HA 1 116 ASN HB3 6.500 . 6.500 5.327 4.775 6.189 . 0 0 "[ . 1]" 1
494 1 71 GLU H 1 72 SER H 4.500 . 4.500 2.354 2.105 2.684 . 0 0 "[ . 1]" 1
495 1 71 GLU H 1 73 GLY H 6.500 . 6.500 4.565 4.039 4.837 . 0 0 "[ . 1]" 1
496 1 71 GLU HA 1 74 ARG HB2 6.500 . 6.500 3.473 2.805 4.132 . 0 0 "[ . 1]" 1
497 1 71 GLU HA 1 74 ARG HB3 6.500 . 6.500 4.680 2.560 5.825 . 0 0 "[ . 1]" 1
498 1 71 GLU QG 1 72 SER H 6.500 . 6.500 4.126 3.321 4.833 . 0 0 "[ . 1]" 1
499 1 72 SER H 1 73 GLY H 6.500 . 6.500 2.696 2.545 2.823 . 0 0 "[ . 1]" 1
500 1 72 SER HA 1 74 ARG H 6.500 . 6.500 3.974 3.781 4.251 . 0 0 "[ . 1]" 1
501 1 72 SER QB 1 121 VAL QG 6.500 . 6.500 3.318 1.805 4.513 . 0 0 "[ . 1]" 1
502 1 72 SER O 1 76 VAL H 4.500 . 4.500 2.714 1.906 3.450 . 0 0 "[ . 1]" 1
503 1 72 SER O 1 76 VAL N 4.500 . 4.500 3.516 2.882 4.199 . 0 0 "[ . 1]" 1
504 1 73 GLY H 1 74 ARG H 6.500 . 6.500 2.638 2.512 2.710 . 0 0 "[ . 1]" 1
505 1 73 GLY H 1 75 GLN H 6.500 . 6.500 4.198 3.979 4.543 . 0 0 "[ . 1]" 1
506 1 73 GLY H 1 121 VAL QG 6.500 . 6.500 2.953 2.045 3.720 . 0 0 "[ . 1]" 1
507 1 73 GLY H 1 124 ALA MB 6.500 . 6.500 4.940 4.198 5.747 . 0 0 "[ . 1]" 1
508 1 73 GLY QA 1 74 ARG QD 6.500 . 6.500 4.122 2.969 6.204 . 0 0 "[ . 1]" 1
509 1 73 GLY QA 1 75 GLN H 6.500 . 6.500 3.745 3.473 4.029 . 0 0 "[ . 1]" 1
510 1 73 GLY QA 1 120 SER HA 6.500 . 6.500 4.958 4.072 5.902 . 0 0 "[ . 1]" 1
511 1 73 GLY QA 1 120 SER QB 6.500 . 6.500 3.655 2.323 4.536 . 0 0 "[ . 1]" 1
512 1 73 GLY QA 1 121 VAL HA 6.500 . 6.500 2.203 1.468 2.756 . 0 0 "[ . 1]" 1
513 1 73 GLY HA2 1 124 ALA MB 6.500 . 6.500 3.798 2.957 4.343 . 0 0 "[ . 1]" 1
514 1 73 GLY HA3 1 124 ALA MB 6.500 . 6.500 3.235 2.344 4.241 . 0 0 "[ . 1]" 1
515 1 73 GLY O 1 77 GLY H 4.500 . 4.500 3.034 2.234 3.677 . 0 0 "[ . 1]" 1
516 1 73 GLY O 1 77 GLY N 4.500 . 4.500 3.855 3.005 4.493 . 0 0 "[ . 1]" 1
517 1 74 ARG H 1 74 ARG HD2 6.500 . 6.500 3.977 2.146 5.997 . 0 0 "[ . 1]" 1
518 1 74 ARG H 1 74 ARG HD3 6.500 . 6.500 3.459 1.948 4.959 . 0 0 "[ . 1]" 1
519 1 74 ARG H 1 75 GLN H 4.500 . 4.500 2.447 2.298 2.639 . 0 0 "[ . 1]" 1
520 1 74 ARG QB 1 78 PRO QG 6.500 . 6.500 4.883 3.929 6.073 . 0 0 "[ . 1]" 1
521 1 74 ARG O 1 78 PRO N 4.500 . 4.500 4.485 4.214 4.578 0.078 9 0 "[ . 1]" 1
522 1 75 GLN H 1 77 GLY H 6.500 . 6.500 4.046 3.380 4.612 . 0 0 "[ . 1]" 1
523 1 75 GLN O 1 79 LEU H 4.500 . 4.500 2.532 2.176 3.283 . 0 0 "[ . 1]" 1
524 1 75 GLN O 1 79 LEU N 4.500 . 4.500 3.392 3.098 4.117 . 0 0 "[ . 1]" 1
525 1 76 VAL O 1 80 ALA H 4.500 . 4.500 1.968 1.797 2.206 . 0 0 "[ . 1]" 1
526 1 76 VAL O 1 80 ALA N 4.500 . 4.500 2.914 2.762 3.150 . 0 0 "[ . 1]" 1
527 1 77 GLY H 1 79 LEU H 6.500 . 6.500 4.022 3.845 4.220 . 0 0 "[ . 1]" 1
528 1 77 GLY H 1 124 ALA MB 6.500 . 6.500 4.108 2.457 5.096 . 0 0 "[ . 1]" 1
529 1 77 GLY H 1 125 LEU QD 6.500 . 6.500 3.828 3.067 4.767 . 0 0 "[ . 1]" 1
530 1 77 GLY QA 1 79 LEU H 6.500 . 6.500 3.936 3.683 4.098 . 0 0 "[ . 1]" 1
531 1 77 GLY QA 1 80 ALA H 6.500 . 6.500 3.888 3.595 4.279 . 0 0 "[ . 1]" 1
532 1 77 GLY QA 1 80 ALA MB 6.500 . 6.500 3.480 3.093 4.010 . 0 0 "[ . 1]" 1
533 1 77 GLY QA 1 81 LYS H 6.500 . 6.500 4.573 4.220 5.292 . 0 0 "[ . 1]" 1
534 1 77 GLY QA 1 124 ALA MB 6.500 . 6.500 3.883 2.716 4.795 . 0 0 "[ . 1]" 1
535 1 77 GLY QA 1 125 LEU QD 6.500 . 6.500 2.941 1.828 4.197 . 0 0 "[ . 1]" 1
536 1 77 GLY O 1 81 LYS H 4.500 . 4.500 2.634 2.388 3.306 . 0 0 "[ . 1]" 1
537 1 77 GLY O 1 81 LYS N 4.500 . 4.500 3.526 3.301 4.115 . 0 0 "[ . 1]" 1
538 1 78 PRO HA 1 81 LYS QB 6.500 . 6.500 3.471 2.521 5.508 . 0 0 "[ . 1]" 1
539 1 78 PRO O 1 82 PHE H 4.500 . 4.500 2.371 1.828 3.265 . 0 0 "[ . 1]" 1
540 1 78 PRO O 1 82 PHE N 4.500 . 4.500 3.208 2.758 4.026 . 0 0 "[ . 1]" 1
541 1 79 LEU H 1 80 ALA H 4.500 . 4.500 2.743 2.420 2.946 . 0 0 "[ . 1]" 1
542 1 79 LEU HA 1 82 PHE HA 6.500 . 6.500 5.855 5.549 6.232 . 0 0 "[ . 1]" 1
543 1 79 LEU HA 1 83 TYR H 6.500 . 6.500 4.636 4.107 5.108 . 0 0 "[ . 1]" 1
544 1 79 LEU QB 1 80 ALA H 4.500 . 4.500 2.397 2.204 2.590 . 0 0 "[ . 1]" 1
545 1 79 LEU QD 1 83 TYR QD 4.000 . 4.000 2.289 1.727 3.347 . 0 0 "[ . 1]" 1
546 1 79 LEU MD1 1 80 ALA H 6.500 . 6.500 3.781 3.360 4.431 . 0 0 "[ . 1]" 1
547 1 79 LEU MD1 1 82 PHE H 6.500 . 6.500 4.666 4.356 5.100 . 0 0 "[ . 1]" 1
548 1 79 LEU MD2 1 80 ALA H 6.500 . 6.500 4.342 3.860 4.642 . 0 0 "[ . 1]" 1
549 1 79 LEU MD2 1 82 PHE H 6.500 . 6.500 5.233 4.156 6.481 . 0 0 "[ . 1]" 1
550 1 79 LEU O 1 83 TYR H 4.500 . 4.500 2.525 2.189 2.855 . 0 0 "[ . 1]" 1
551 1 79 LEU O 1 83 TYR N 4.500 . 4.500 3.417 3.145 3.787 . 0 0 "[ . 1]" 1
552 1 80 ALA H 1 81 LYS H 4.500 . 4.500 2.716 2.542 3.051 . 0 0 "[ . 1]" 1
553 1 80 ALA H 1 82 PHE H 6.500 . 6.500 4.214 4.053 4.316 . 0 0 "[ . 1]" 1
554 1 80 ALA MB 1 81 LYS H 6.500 . 6.500 2.631 2.184 2.812 . 0 0 "[ . 1]" 1
555 1 80 ALA MB 1 90 ILE MD 6.500 . 6.500 3.745 2.402 5.472 . 0 0 "[ . 1]" 1
556 1 80 ALA MB 1 125 LEU QD 6.500 . 6.500 3.361 2.190 4.162 . 0 0 "[ . 1]" 1
557 1 81 LYS H 1 81 LYS HD2 6.500 . 6.500 4.445 2.251 5.953 . 0 0 "[ . 1]" 1
558 1 81 LYS H 1 81 LYS HD3 6.500 . 6.500 4.634 2.804 5.134 . 0 0 "[ . 1]" 1
559 1 81 LYS H 1 81 LYS HE2 6.500 . 6.500 5.090 3.779 6.591 0.091 5 0 "[ . 1]" 1
560 1 81 LYS H 1 81 LYS HE3 6.500 . 6.500 4.948 3.906 6.530 0.030 10 0 "[ . 1]" 1
561 1 81 LYS H 1 82 PHE H 6.500 . 6.500 2.535 2.453 2.596 . 0 0 "[ . 1]" 1
562 1 81 LYS HA 1 81 LYS HE2 6.500 . 6.500 4.614 1.367 5.939 . 0 0 "[ . 1]" 1
563 1 81 LYS HA 1 81 LYS HE3 6.500 . 6.500 4.809 2.708 5.405 . 0 0 "[ . 1]" 1
564 1 82 PHE H 1 83 TYR H 6.500 . 6.500 2.606 2.435 2.800 . 0 0 "[ . 1]" 1
565 1 82 PHE QB 1 83 TYR H 6.500 . 6.500 2.732 2.373 3.049 . 0 0 "[ . 1]" 1
566 1 83 TYR HA 1 83 TYR QD . . 4.000 2.840 2.408 3.710 . 0 0 "[ . 1]" 1
567 1 83 TYR QB 1 84 SER H 6.500 . 6.500 3.298 3.090 3.698 . 0 0 "[ . 1]" 1
568 1 83 TYR QB 1 85 VAL H 6.500 . 6.500 3.414 2.876 3.999 . 0 0 "[ . 1]" 1
569 1 83 TYR HB2 1 84 SER H 6.500 . 6.500 3.471 3.202 3.977 . 0 0 "[ . 1]" 1
570 1 83 TYR HB3 1 84 SER H 6.500 . 6.500 4.144 4.017 4.397 . 0 0 "[ . 1]" 1
571 1 84 SER H 1 85 VAL H 4.500 . 4.500 2.753 2.592 3.070 . 0 0 "[ . 1]" 1
572 1 86 PRO O 1 88 GLN H 4.500 . 4.500 2.720 1.817 3.674 . 0 0 "[ . 1]" 1
573 1 86 PRO O 1 88 GLN N 4.500 . 4.500 3.045 2.704 3.464 . 0 0 "[ . 1]" 1
574 1 86 PRO O 1 89 GLN H 4.500 . 4.500 2.427 1.987 3.296 . 0 0 "[ . 1]" 1
575 1 86 PRO O 1 89 GLN N 4.500 . 4.500 3.268 2.943 3.954 . 0 0 "[ . 1]" 1
576 1 87 PRO O 1 90 ILE H 4.500 . 4.500 3.162 2.065 4.031 . 0 0 "[ . 1]" 1
577 1 87 PRO O 1 90 ILE N 4.500 . 4.500 3.970 2.983 4.520 0.020 1 0 "[ . 1]" 1
578 1 88 GLN O 1 90 ILE H 4.500 . 4.500 3.080 2.166 3.724 . 0 0 "[ . 1]" 1
579 1 88 GLN O 1 90 ILE N 4.500 . 4.500 3.640 2.966 4.275 . 0 0 "[ . 1]" 1
580 1 90 ILE H 1 91 VAL H 6.500 . 6.500 4.465 4.301 4.580 . 0 0 "[ . 1]" 1
581 1 90 ILE MD 1 125 LEU QD . . 4.500 3.012 2.119 3.743 . 0 0 "[ . 1]" 1
582 1 90 ILE O 1 131 HIS H 4.500 . 4.500 3.449 1.878 4.567 0.067 6 0 "[ . 1]" 1
583 1 90 ILE O 1 131 HIS N 4.500 . 4.500 3.890 2.831 4.626 0.126 6 0 "[ . 1]" 1
584 1 91 VAL HA 1 92 VAL H 4.500 . 4.500 2.185 2.115 2.260 . 0 0 "[ . 1]" 1
585 1 91 VAL HA 1 132 ARG HA 6.500 . 6.500 4.568 3.146 6.569 0.069 10 0 "[ . 1]" 1
586 1 91 VAL QG 1 92 VAL H 6.500 . 6.500 3.029 2.388 3.492 . 0 0 "[ . 1]" 1
587 1 91 VAL QG 1 133 VAL QG 6.500 . 6.500 2.784 2.000 3.670 . 0 0 "[ . 1]" 1
588 1 91 VAL QG 1 173 THR MG 6.500 . 6.500 4.331 3.792 5.009 . 0 0 "[ . 1]" 1
589 1 92 VAL H 1 131 HIS O 4.500 . 4.500 2.779 1.816 3.563 . 0 0 "[ . 1]" 1
590 1 92 VAL H 1 132 ARG HA 6.500 . 6.500 3.155 1.959 5.330 . 0 0 "[ . 1]" 1
591 1 92 VAL H 1 133 VAL H 6.500 . 6.500 3.782 3.014 5.138 . 0 0 "[ . 1]" 1
592 1 92 VAL HA 1 93 ILE H 4.500 . 4.500 2.127 2.105 2.152 . 0 0 "[ . 1]" 1
593 1 92 VAL QG 1 118 LEU QD 6.500 . 6.500 3.932 2.360 5.578 . 0 0 "[ . 1]" 1
594 1 92 VAL QG 1 121 VAL QG 6.500 . 6.500 2.830 1.560 4.059 . 0 0 "[ . 1]" 1
595 1 92 VAL QG 1 132 ARG QB 6.500 . 6.500 4.082 2.206 6.463 . 0 0 "[ . 1]" 1
596 1 92 VAL MG1 1 93 ILE H 6.500 . 6.500 3.157 2.642 4.051 . 0 0 "[ . 1]" 1
597 1 92 VAL MG2 1 93 ILE H 6.500 . 6.500 3.633 2.549 4.151 . 0 0 "[ . 1]" 1
598 1 92 VAL N 1 131 HIS O 4.500 . 4.500 3.610 2.773 4.261 . 0 0 "[ . 1]" 1
599 1 92 VAL O 1 133 VAL H 4.500 . 4.500 2.143 1.752 3.729 . 0 0 "[ . 1]" 1
600 1 92 VAL O 1 133 VAL N 4.500 . 4.500 3.057 2.727 4.420 . 0 0 "[ . 1]" 1
601 1 93 ILE H 1 94 HIS H 6.500 . 6.500 4.461 4.300 4.608 . 0 0 "[ . 1]" 1
602 1 93 ILE HA 1 133 VAL H 6.500 . 6.500 3.333 2.779 4.916 . 0 0 "[ . 1]" 1
603 1 93 ILE HA 1 133 VAL HB 6.500 . 6.500 2.348 1.718 2.964 . 0 0 "[ . 1]" 1
604 1 93 ILE HA 1 133 VAL QG 6.500 . 6.500 3.153 2.851 3.467 . 0 0 "[ . 1]" 1
605 1 93 ILE HB 1 94 HIS H 6.500 . 6.500 4.115 3.482 4.347 . 0 0 "[ . 1]" 1
606 1 93 ILE MD 1 94 HIS H 6.500 . 6.500 4.171 3.615 5.195 . 0 0 "[ . 1]" 1
607 1 93 ILE QG 1 94 HIS H 6.500 . 6.500 3.902 2.703 4.806 . 0 0 "[ . 1]" 1
608 1 93 ILE MG 1 94 HIS H 6.500 . 6.500 3.421 2.393 4.235 . 0 0 "[ . 1]" 1
609 1 94 HIS H 1 95 ASP H 6.500 . 6.500 4.382 4.323 4.433 . 0 0 "[ . 1]" 1
610 1 94 HIS H 1 133 VAL H 6.500 . 6.500 3.807 3.238 4.551 . 0 0 "[ . 1]" 1
611 1 94 HIS H 1 133 VAL O 4.500 . 4.500 2.294 1.709 3.368 . 0 0 "[ . 1]" 1
612 1 94 HIS H 1 134 ARG HA 6.500 . 6.500 3.901 2.944 5.406 . 0 0 "[ . 1]" 1
613 1 94 HIS QB 1 95 ASP H 6.500 . 6.500 2.990 2.378 3.486 . 0 0 "[ . 1]" 1
614 1 94 HIS QB 1 118 LEU QD 6.500 . 6.500 3.410 2.053 4.802 . 0 0 "[ . 1]" 1
615 1 94 HIS QB 1 118 LEU HG 6.500 . 6.500 5.318 3.225 6.542 0.042 8 0 "[ . 1]" 1
616 1 94 HIS N 1 133 VAL O 4.500 . 4.500 3.191 2.689 3.988 . 0 0 "[ . 1]" 1
617 1 94 HIS O 1 135 ILE H 4.500 . 4.500 2.138 1.809 2.737 . 0 0 "[ . 1]" 1
618 1 94 HIS O 1 135 ILE N 4.500 . 4.500 3.082 2.768 3.529 . 0 0 "[ . 1]" 1
619 1 95 ASP H 1 96 GLU H 6.500 . 6.500 4.536 4.449 4.590 . 0 0 "[ . 1]" 1
620 1 95 ASP H 1 135 ILE MD 6.500 . 6.500 4.979 4.325 6.226 . 0 0 "[ . 1]" 1
621 1 95 ASP HA 1 96 GLU H 6.500 . 6.500 2.221 2.121 2.310 . 0 0 "[ . 1]" 1
622 1 95 ASP HA 1 135 ILE H 6.500 . 6.500 3.055 2.713 3.704 . 0 0 "[ . 1]" 1
623 1 95 ASP HA 1 135 ILE HB 6.500 . 6.500 2.629 2.019 3.522 . 0 0 "[ . 1]" 1
624 1 95 ASP QB 1 96 GLU H 6.500 . 6.500 2.996 2.663 3.781 . 0 0 "[ . 1]" 1
625 1 95 ASP QB 1 135 ILE MD 6.500 . 6.500 4.796 4.304 5.602 . 0 0 "[ . 1]" 1
626 1 95 ASP QB 1 137 VAL QG 6.500 . 6.500 2.217 1.593 3.866 . 0 0 "[ . 1]" 1
627 1 96 GLU H 1 97 LEU H 6.500 . 6.500 4.163 3.805 4.394 . 0 0 "[ . 1]" 1
628 1 96 GLU H 1 135 ILE H 6.500 . 6.500 3.411 3.049 3.725 . 0 0 "[ . 1]" 1
629 1 96 GLU H 1 135 ILE HB 4.500 . 4.500 3.738 3.245 4.253 . 0 0 "[ . 1]" 1
630 1 96 GLU H 1 135 ILE MG 6.500 . 6.500 4.044 3.721 4.709 . 0 0 "[ . 1]" 1
631 1 96 GLU H 1 135 ILE O 4.500 . 4.500 1.863 1.691 2.190 . 0 0 "[ . 1]" 1
632 1 96 GLU H 1 136 GLY HA2 6.500 . 6.500 3.503 3.050 3.833 . 0 0 "[ . 1]" 1
633 1 96 GLU H 1 136 GLY QA 6.500 . 6.500 3.442 3.012 3.753 . 0 0 "[ . 1]" 1
634 1 96 GLU H 1 136 GLY HA3 6.500 . 6.500 5.068 4.665 5.345 . 0 0 "[ . 1]" 1
635 1 96 GLU H 1 137 VAL MG1 6.500 . 6.500 3.124 2.540 4.226 . 0 0 "[ . 1]" 1
636 1 96 GLU H 1 137 VAL QG 6.500 . 6.500 2.683 2.181 3.315 . 0 0 "[ . 1]" 1
637 1 96 GLU H 1 137 VAL MG2 6.500 . 6.500 3.464 2.208 5.193 . 0 0 "[ . 1]" 1
638 1 96 GLU HA 1 97 LEU H 4.500 . 4.500 2.151 2.090 2.285 . 0 0 "[ . 1]" 1
639 1 96 GLU HA 1 98 ASP H 6.500 . 6.500 3.492 2.962 3.869 . 0 0 "[ . 1]" 1
640 1 96 GLU QG 1 134 ARG HA 6.500 . 6.500 3.910 2.013 5.547 . 0 0 "[ . 1]" 1
641 1 96 GLU N 1 135 ILE O 4.500 . 4.500 2.800 2.671 3.099 . 0 0 "[ . 1]" 1
642 1 96 GLU O 1 137 VAL H 4.500 . 4.500 2.256 1.869 3.094 . 0 0 "[ . 1]" 1
643 1 96 GLU O 1 137 VAL N 4.500 . 4.500 3.201 2.842 4.032 . 0 0 "[ . 1]" 1
644 1 97 LEU QB 1 98 ASP H 6.500 . 6.500 3.791 3.634 3.895 . 0 0 "[ . 1]" 1
645 1 97 LEU QB 1 137 VAL QG 6.500 . 6.500 3.231 2.414 5.051 . 0 0 "[ . 1]" 1
646 1 97 LEU QD 1 98 ASP H 6.500 . 6.500 2.777 2.395 3.109 . 0 0 "[ . 1]" 1
647 1 97 LEU QD 1 137 VAL QG 6.500 . 6.500 4.040 3.455 5.505 . 0 0 "[ . 1]" 1
648 1 97 LEU QD 1 146 PRO QB 6.500 . 6.500 2.685 1.874 3.789 . 0 0 "[ . 1]" 1
649 1 97 LEU QD 1 146 PRO QG 6.500 . 6.500 2.565 1.744 3.477 . 0 0 "[ . 1]" 1
650 1 97 LEU QD 1 150 VAL QG 6.500 . 6.500 4.217 3.175 4.555 . 0 0 "[ . 1]" 1
651 1 97 LEU HG 1 98 ASP H 6.500 . 6.500 3.231 2.644 3.747 . 0 0 "[ . 1]" 1
652 1 98 ASP H 1 99 ILE H 6.500 . 6.500 2.585 2.282 2.890 . 0 0 "[ . 1]" 1
653 1 98 ASP H 1 113 GLY QA 6.500 . 6.500 4.167 2.351 5.504 . 0 0 "[ . 1]" 1
654 1 98 ASP HA 1 99 ILE H 4.500 . 4.500 3.479 3.353 3.556 . 0 0 "[ . 1]" 1
655 1 98 ASP HB2 1 99 ILE H 6.500 . 6.500 3.873 2.731 4.275 . 0 0 "[ . 1]" 1
656 1 98 ASP HB3 1 99 ILE H 6.500 . 6.500 3.018 2.511 4.163 . 0 0 "[ . 1]" 1
657 1 99 ILE H 1 100 ASP H 6.500 . 6.500 4.464 4.376 4.569 . 0 0 "[ . 1]" 1
658 1 99 ILE HB 1 100 ASP H 6.500 . 6.500 3.427 2.011 4.227 . 0 0 "[ . 1]" 1
659 1 99 ILE QG 1 100 ASP H 6.500 . 6.500 4.147 3.601 4.542 . 0 0 "[ . 1]" 1
660 1 99 ILE MG 1 100 ASP H 6.500 . 6.500 2.618 2.118 3.404 . 0 0 "[ . 1]" 1
661 1 100 ASP H 1 101 PHE H 6.500 . 6.500 4.570 4.366 4.646 . 0 0 "[ . 1]" 1
662 1 100 ASP HA 1 101 PHE H 4.500 . 4.500 2.423 2.270 2.770 . 0 0 "[ . 1]" 1
663 1 100 ASP HA 1 138 GLY QA 6.500 . 6.500 1.970 1.553 3.047 . 0 0 "[ . 1]" 1
664 1 100 ASP HB2 1 101 PHE H 6.500 . 6.500 3.106 1.849 3.886 . 0 0 "[ . 1]" 1
665 1 100 ASP HB3 1 101 PHE H 6.500 . 6.500 2.942 2.182 3.768 . 0 0 "[ . 1]" 1
666 1 101 PHE H 1 158 GLU QB 6.500 . 6.500 5.332 3.205 6.349 . 0 0 "[ . 1]" 1
667 1 101 PHE HA 1 102 GLY H 4.500 . 4.500 2.151 2.094 2.205 . 0 0 "[ . 1]" 1
668 1 101 PHE HA 1 136 GLY QA 6.500 . 6.500 3.536 3.275 3.985 . 0 0 "[ . 1]" 1
669 1 101 PHE HA 1 137 VAL HA 6.500 . 6.500 3.152 2.310 4.165 . 0 0 "[ . 1]" 1
670 1 101 PHE QB 1 102 GLY H 6.500 . 6.500 3.349 2.888 3.703 . 0 0 "[ . 1]" 1
671 1 101 PHE QD 1 137 VAL HA 4.500 . 4.500 3.178 1.262 4.387 . 0 0 "[ . 1]" 1
672 1 102 GLY H 1 103 ARG H 4.500 . 4.500 2.749 2.161 3.926 . 0 0 "[ . 1]" 1
673 1 102 GLY H 1 137 VAL HA 6.500 . 6.500 4.503 3.670 6.085 . 0 0 "[ . 1]" 1
674 1 102 GLY H 1 165 ILE MD 6.500 . 6.500 3.093 1.992 4.028 . 0 0 "[ . 1]" 1
675 1 102 GLY H 1 165 ILE MG 6.500 . 6.500 5.637 4.641 6.527 0.027 2 0 "[ . 1]" 1
676 1 102 GLY QA 1 160 ALA MB 6.500 . 6.500 6.189 5.612 6.598 0.098 6 0 "[ . 1]" 1
677 1 102 GLY HA2 1 165 ILE MD 6.500 . 6.500 3.023 1.939 4.214 . 0 0 "[ . 1]" 1
678 1 102 GLY HA3 1 165 ILE MD 6.500 . 6.500 4.252 3.471 5.607 . 0 0 "[ . 1]" 1
679 1 103 ARG H 1 103 ARG HD2 6.500 . 6.500 4.336 1.580 5.447 . 0 0 "[ . 1]" 1
680 1 103 ARG H 1 103 ARG HD3 6.500 . 6.500 4.021 3.325 4.691 . 0 0 "[ . 1]" 1
681 1 103 ARG H 1 103 ARG HG3 4.500 . 4.500 3.816 2.079 4.542 0.042 10 0 "[ . 1]" 1
682 1 103 ARG H 1 104 ILE MG 6.500 . 6.500 4.499 4.080 4.941 . 0 0 "[ . 1]" 1
683 1 103 ARG H 1 136 GLY H 6.500 . 6.500 4.727 3.595 6.454 . 0 0 "[ . 1]" 1
684 1 103 ARG H 1 165 ILE MD 6.500 . 6.500 4.439 3.211 6.245 . 0 0 "[ . 1]" 1
685 1 103 ARG HA 1 104 ILE H 4.500 . 4.500 2.302 2.100 2.432 . 0 0 "[ . 1]" 1
686 1 103 ARG QB 1 104 ILE H 6.500 . 6.500 2.745 2.306 3.672 . 0 0 "[ . 1]" 1
687 1 103 ARG QD 1 104 ILE H 6.500 . 6.500 3.594 2.927 4.655 . 0 0 "[ . 1]" 1
688 1 103 ARG QD 1 189 HIS HA 6.500 . 6.500 4.483 3.169 6.349 . 0 0 "[ . 1]" 1
689 1 103 ARG QG 1 189 HIS QB 6.500 . 6.500 5.971 4.546 6.603 0.103 6 0 "[ . 1]" 1
690 1 104 ILE H 1 105 ARG H 6.500 . 6.500 4.480 4.372 4.555 . 0 0 "[ . 1]" 1
691 1 104 ILE HA 1 105 ARG H 4.500 . 4.500 2.336 2.162 2.453 . 0 0 "[ . 1]" 1
692 1 104 ILE HA 1 135 ILE HB 6.500 . 6.500 5.787 5.250 6.550 0.050 9 0 "[ . 1]" 1
693 1 104 ILE HA 1 136 GLY H 6.500 . 6.500 2.532 2.214 3.115 . 0 0 "[ . 1]" 1
694 1 104 ILE HB 1 105 ARG H 6.500 . 6.500 2.607 2.355 3.041 . 0 0 "[ . 1]" 1
695 1 104 ILE HB 1 135 ILE MG 6.500 . 6.500 4.108 3.750 4.567 . 0 0 "[ . 1]" 1
696 1 104 ILE MD 1 105 ARG H 4.500 . 4.500 4.269 2.987 4.567 0.067 2 0 "[ . 1]" 1
697 1 104 ILE MD 1 133 VAL QG 6.500 . 6.500 3.257 2.172 5.534 . 0 0 "[ . 1]" 1
698 1 104 ILE MD 1 135 ILE MG 6.500 . 6.500 4.343 3.783 5.019 . 0 0 "[ . 1]" 1
699 1 104 ILE MD 1 165 ILE QG 6.500 . 6.500 4.413 2.666 6.154 . 0 0 "[ . 1]" 1
700 1 104 ILE MD 1 169 ALA MB 6.500 . 6.500 3.679 2.669 5.126 . 0 0 "[ . 1]" 1
701 1 104 ILE QG 1 105 ARG H 6.500 . 6.500 3.684 3.434 4.005 . 0 0 "[ . 1]" 1
702 1 104 ILE QG 1 165 ILE QG 6.500 . 6.500 4.688 3.451 6.321 . 0 0 "[ . 1]" 1
703 1 104 ILE QG 1 169 ALA MB 6.500 . 6.500 4.770 2.725 5.643 . 0 0 "[ . 1]" 1
704 1 104 ILE QG 1 172 ALA MB 6.500 . 6.500 4.763 3.640 5.824 . 0 0 "[ . 1]" 1
705 1 104 ILE MG 1 135 ILE MG 6.500 . 6.500 2.047 1.737 2.466 . 0 0 "[ . 1]" 1
706 1 104 ILE MG 1 165 ILE MG 6.500 . 6.500 3.063 2.136 4.016 . 0 0 "[ . 1]" 1
707 1 105 ARG H 1 106 LEU H 6.500 . 6.500 4.280 4.072 4.400 . 0 0 "[ . 1]" 1
708 1 105 ARG H 1 134 ARG H 6.500 . 6.500 3.628 3.154 4.333 . 0 0 "[ . 1]" 1
709 1 105 ARG H 1 134 ARG O 4.500 . 4.500 1.991 1.753 2.571 . 0 0 "[ . 1]" 1
710 1 105 ARG HA 1 189 HIS HA 6.500 . 6.500 6.041 5.251 6.583 0.083 2 0 "[ . 1]" 1
711 1 105 ARG QB 1 106 LEU H 6.500 . 6.500 3.006 2.294 3.777 . 0 0 "[ . 1]" 1
712 1 105 ARG N 1 134 ARG O 4.500 . 4.500 2.957 2.735 3.545 . 0 0 "[ . 1]" 1
713 1 105 ARG O 1 134 ARG H 4.500 . 4.500 2.075 1.753 2.905 . 0 0 "[ . 1]" 1
714 1 105 ARG O 1 134 ARG N 4.500 . 4.500 2.963 2.669 3.800 . 0 0 "[ . 1]" 1
715 1 106 LEU HA 1 133 VAL HA 6.500 . 6.500 2.565 1.885 3.465 . 0 0 "[ . 1]" 1
716 1 106 LEU HA 1 134 ARG H 6.500 . 6.500 2.894 2.373 3.707 . 0 0 "[ . 1]" 1
717 1 106 LEU QB 1 185 GLN QB 6.500 . 6.500 3.505 2.460 4.466 . 0 0 "[ . 1]" 1
718 1 106 LEU QD 1 172 ALA MB 6.500 . 6.500 4.010 2.523 5.177 . 0 0 "[ . 1]" 1
719 1 106 LEU QD 1 185 GLN HA 6.500 . 6.500 2.758 2.033 3.441 . 0 0 "[ . 1]" 1
720 1 107 LYS H 1 132 ARG O 4.500 . 4.500 2.497 1.791 3.566 . 0 0 "[ . 1]" 1
721 1 107 LYS HA 1 107 LYS HE2 6.500 . 6.500 4.883 3.475 5.406 . 0 0 "[ . 1]" 1
722 1 107 LYS HA 1 107 LYS HE3 6.500 . 6.500 4.504 1.770 5.190 . 0 0 "[ . 1]" 1
723 1 107 LYS N 1 132 ARG O 4.500 . 4.500 3.404 2.769 4.408 . 0 0 "[ . 1]" 1
724 1 107 LYS O 1 132 ARG H 4.500 . 4.500 3.296 2.062 4.067 . 0 0 "[ . 1]" 1
725 1 107 LYS O 1 132 ARG N 4.500 . 4.500 3.975 3.023 4.553 0.053 5 0 "[ . 1]" 1
726 1 108 LEU H 1 108 LEU HG 4.500 . 4.500 2.488 1.800 3.195 . 0 0 "[ . 1]" 1
727 1 108 LEU H 1 109 GLY H 6.500 . 6.500 4.213 3.923 4.516 . 0 0 "[ . 1]" 1
728 1 108 LEU H 1 181 LEU QD 6.500 . 6.500 4.875 2.215 6.540 0.040 8 0 "[ . 1]" 1
729 1 108 LEU QB 1 181 LEU QD 6.500 . 6.500 4.189 2.300 5.822 . 0 0 "[ . 1]" 1
730 1 108 LEU QD 1 109 GLY H 6.500 . 6.500 4.236 3.817 4.503 . 0 0 "[ . 1]" 1
731 1 108 LEU HG 1 109 GLY H 6.500 . 6.500 4.848 4.362 5.256 . 0 0 "[ . 1]" 1
732 1 109 GLY H 1 110 GLY H 6.500 . 6.500 4.278 4.092 4.373 . 0 0 "[ . 1]" 1
733 1 109 GLY QA 1 110 GLY H 4.500 . 4.500 2.229 2.111 2.321 . 0 0 "[ . 1]" 1
734 1 109 GLY QA 1 128 LYS QB 6.500 . 6.500 4.122 2.373 5.377 . 0 0 "[ . 1]" 1
735 1 110 GLY QA 1 132 ARG QD 6.500 . 6.500 4.046 2.972 5.545 . 0 0 "[ . 1]" 1
736 1 113 GLY H 1 115 HIS H 6.500 . 6.500 4.446 2.499 5.587 . 0 0 "[ . 1]" 1
737 1 115 HIS O 1 119 ARG H 4.500 . 4.500 2.417 1.733 3.576 . 0 0 "[ . 1]" 1
738 1 115 HIS O 1 119 ARG N 4.500 . 4.500 3.302 2.667 4.437 . 0 0 "[ . 1]" 1
739 1 116 ASN QB 1 147 ALA MB 6.500 . 6.500 5.816 4.230 6.561 0.061 2 0 "[ . 1]" 1
740 1 116 ASN O 1 120 SER H 4.500 . 4.500 2.467 1.753 3.726 . 0 0 "[ . 1]" 1
741 1 116 ASN O 1 120 SER N 4.500 . 4.500 3.389 2.725 4.626 0.126 8 0 "[ . 1]" 1
742 1 117 GLY H 1 118 LEU H 6.500 . 6.500 2.654 2.209 2.959 . 0 0 "[ . 1]" 1
743 1 117 GLY H 1 118 LEU QD 6.500 . 6.500 4.629 4.199 5.045 . 0 0 "[ . 1]" 1
744 1 117 GLY H 1 118 LEU HG 6.500 . 6.500 4.273 3.693 4.883 . 0 0 "[ . 1]" 1
745 1 117 GLY H 1 119 ARG H 6.500 . 6.500 4.259 3.451 4.994 . 0 0 "[ . 1]" 1
746 1 117 GLY QA 1 121 VAL HA 6.500 . 6.500 6.317 5.798 6.558 0.058 1 0 "[ . 1]" 1
747 1 117 GLY O 1 121 VAL H 4.500 . 4.500 2.825 2.287 3.333 . 0 0 "[ . 1]" 1
748 1 117 GLY O 1 121 VAL N 4.500 . 4.500 3.740 3.258 4.265 . 0 0 "[ . 1]" 1
749 1 118 LEU H 1 120 SER H 6.500 . 6.500 3.999 3.590 4.433 . 0 0 "[ . 1]" 1
750 1 118 LEU HA 1 121 VAL HB 6.500 . 6.500 3.397 2.729 3.951 . 0 0 "[ . 1]" 1
751 1 118 LEU HB2 1 119 ARG H 6.500 . 6.500 2.736 2.418 3.014 . 0 0 "[ . 1]" 1
752 1 118 LEU HB3 1 119 ARG H 6.500 . 6.500 3.693 3.165 3.932 . 0 0 "[ . 1]" 1
753 1 118 LEU QD 1 119 ARG H 6.500 . 6.500 4.119 3.956 4.242 . 0 0 "[ . 1]" 1
754 1 118 LEU HG 1 119 ARG H 6.500 . 6.500 4.408 4.200 4.519 . 0 0 "[ . 1]" 1
755 1 118 LEU O 1 122 ALA H 4.500 . 4.500 2.165 1.811 2.656 . 0 0 "[ . 1]" 1
756 1 118 LEU O 1 122 ALA N 4.500 . 4.500 3.078 2.767 3.460 . 0 0 "[ . 1]" 1
757 1 119 ARG H 1 119 ARG HD2 6.500 . 6.500 4.089 1.817 5.128 . 0 0 "[ . 1]" 1
758 1 119 ARG H 1 119 ARG HD3 6.500 . 6.500 4.443 2.829 4.976 . 0 0 "[ . 1]" 1
759 1 119 ARG H 1 120 SER H 4.500 . 4.500 2.564 2.392 2.924 . 0 0 "[ . 1]" 1
760 1 119 ARG HA 1 121 VAL HB 6.500 . 6.500 5.420 4.642 6.021 . 0 0 "[ . 1]" 1
761 1 119 ARG HA 1 121 VAL QG 6.500 . 6.500 5.290 4.768 5.685 . 0 0 "[ . 1]" 1
762 1 119 ARG HA 1 122 ALA H 6.500 . 6.500 3.443 2.877 4.204 . 0 0 "[ . 1]" 1
763 1 119 ARG HA 1 123 SER H 4.500 . 4.500 3.794 3.135 4.367 . 0 0 "[ . 1]" 1
764 1 119 ARG QB 1 120 SER H 4.500 . 4.500 2.823 2.478 3.676 . 0 0 "[ . 1]" 1
765 1 119 ARG QD 1 120 SER H 6.500 . 6.500 4.460 3.382 5.039 . 0 0 "[ . 1]" 1
766 1 119 ARG O 1 123 SER H 4.500 . 4.500 1.998 1.741 2.560 . 0 0 "[ . 1]" 1
767 1 119 ARG O 1 123 SER N 4.500 . 4.500 2.930 2.707 3.458 . 0 0 "[ . 1]" 1
768 1 120 SER H 1 121 VAL QG 6.500 . 6.500 3.999 3.835 4.172 . 0 0 "[ . 1]" 1
769 1 120 SER H 1 122 ALA H 6.500 . 6.500 4.127 3.856 4.254 . 0 0 "[ . 1]" 1
770 1 120 SER HA 1 123 SER QB 6.500 . 6.500 3.403 2.672 4.375 . 0 0 "[ . 1]" 1
771 1 120 SER O 1 124 ALA H 4.500 . 4.500 2.466 1.948 3.326 . 0 0 "[ . 1]" 1
772 1 120 SER O 1 124 ALA N 4.500 . 4.500 3.278 2.868 4.011 . 0 0 "[ . 1]" 1
773 1 121 VAL H 1 122 ALA H 6.500 . 6.500 2.576 2.390 2.728 . 0 0 "[ . 1]" 1
774 1 121 VAL HA 1 124 ALA MB 6.500 . 6.500 2.826 2.598 3.030 . 0 0 "[ . 1]" 1
775 1 121 VAL HB 1 122 ALA H 6.500 . 6.500 2.596 2.470 2.824 . 0 0 "[ . 1]" 1
776 1 121 VAL QG 1 122 ALA H 4.500 . 4.500 3.226 3.160 3.349 . 0 0 "[ . 1]" 1
777 1 121 VAL QG 1 125 LEU QD 6.500 . 6.500 2.335 2.071 3.133 . 0 0 "[ . 1]" 1
778 1 121 VAL MG1 1 122 ALA H 6.500 . 6.500 3.519 3.395 3.727 . 0 0 "[ . 1]" 1
779 1 121 VAL MG2 1 122 ALA H 6.500 . 6.500 3.755 3.634 3.840 . 0 0 "[ . 1]" 1
780 1 121 VAL O 1 125 LEU H 4.500 . 4.500 2.289 1.947 3.309 . 0 0 "[ . 1]" 1
781 1 121 VAL O 1 125 LEU N 4.500 . 4.500 3.228 2.919 4.241 . 0 0 "[ . 1]" 1
782 1 122 ALA H 1 123 SER H 4.500 . 4.500 2.703 2.575 2.910 . 0 0 "[ . 1]" 1
783 1 122 ALA H 1 124 ALA H 6.500 . 6.500 4.031 3.736 4.179 . 0 0 "[ . 1]" 1
784 1 122 ALA HA 1 124 ALA H 6.500 . 6.500 4.267 4.090 4.534 . 0 0 "[ . 1]" 1
785 1 122 ALA HA 1 125 LEU H 6.500 . 6.500 3.840 3.438 4.317 . 0 0 "[ . 1]" 1
786 1 122 ALA HA 1 125 LEU QB 6.500 . 6.500 3.841 3.003 6.028 . 0 0 "[ . 1]" 1
787 1 122 ALA MB 1 123 SER H 4.500 . 4.500 2.494 2.292 2.779 . 0 0 "[ . 1]" 1
788 1 122 ALA MB 1 127 THR H 6.500 . 6.500 4.183 3.244 5.462 . 0 0 "[ . 1]" 1
789 1 122 ALA MB 1 127 THR HA 6.500 . 6.500 4.760 3.499 6.520 0.020 5 0 "[ . 1]" 1
790 1 123 SER H 1 124 ALA H 4.500 . 4.500 2.562 2.412 2.682 . 0 0 "[ . 1]" 1
791 1 123 SER H 1 124 ALA MB 6.500 . 6.500 4.258 4.142 4.372 . 0 0 "[ . 1]" 1
792 1 123 SER HA 1 124 ALA H 4.500 . 4.500 3.487 3.438 3.539 . 0 0 "[ . 1]" 1
793 1 123 SER QB 1 124 ALA H 6.500 . 6.500 2.913 2.585 3.558 . 0 0 "[ . 1]" 1
794 1 124 ALA H 1 125 LEU H 4.500 . 4.500 2.627 2.494 2.975 . 0 0 "[ . 1]" 1
795 1 124 ALA H 1 126 GLY H 6.500 . 6.500 3.801 3.601 3.955 . 0 0 "[ . 1]" 1
796 1 124 ALA HA 1 126 GLY H 6.500 . 6.500 4.494 4.044 4.948 . 0 0 "[ . 1]" 1
797 1 124 ALA MB 1 125 LEU H 4.500 . 4.500 2.472 2.278 2.759 . 0 0 "[ . 1]" 1
798 1 125 LEU H 1 126 GLY H 4.500 . 4.500 2.354 2.075 2.503 . 0 0 "[ . 1]" 1
799 1 125 LEU H 1 127 THR H 6.500 . 6.500 3.969 3.250 4.462 . 0 0 "[ . 1]" 1
800 1 125 LEU HB2 1 126 GLY H 6.500 . 6.500 3.139 2.618 4.331 . 0 0 "[ . 1]" 1
801 1 125 LEU HB2 1 127 THR H 6.500 . 6.500 3.288 2.520 5.174 . 0 0 "[ . 1]" 1
802 1 125 LEU HB3 1 126 GLY H 6.500 . 6.500 3.932 3.665 4.457 . 0 0 "[ . 1]" 1
803 1 125 LEU HB3 1 127 THR H 6.500 . 6.500 3.916 2.770 5.427 . 0 0 "[ . 1]" 1
804 1 125 LEU MD1 1 126 GLY H 6.500 . 6.500 4.706 4.407 5.119 . 0 0 "[ . 1]" 1
805 1 125 LEU MD2 1 126 GLY H 6.500 . 6.500 4.340 2.766 4.698 . 0 0 "[ . 1]" 1
806 1 125 LEU HG 1 126 GLY H 6.500 . 6.500 4.152 2.853 4.633 . 0 0 "[ . 1]" 1
807 1 126 GLY H 1 127 THR H 4.000 . 4.000 2.418 2.229 2.681 . 0 0 "[ . 1]" 1
808 1 126 GLY QA 1 127 THR H 4.500 . 4.500 2.834 2.682 2.921 . 0 0 "[ . 1]" 1
809 1 127 THR H 1 127 THR MG 4.500 . 4.500 2.360 1.840 2.724 . 0 0 "[ . 1]" 1
810 1 127 THR HA 1 129 ASN H 6.500 . 6.500 4.751 3.953 5.927 . 0 0 "[ . 1]" 1
811 1 127 THR MG 1 128 LYS H 6.500 . 6.500 3.163 2.948 3.550 . 0 0 "[ . 1]" 1
812 1 128 LYS H 1 128 LYS HD2 6.500 . 6.500 2.946 1.359 4.668 . 0 0 "[ . 1]" 1
813 1 128 LYS H 1 128 LYS HD3 6.500 . 6.500 3.448 2.554 4.706 . 0 0 "[ . 1]" 1
814 1 128 LYS H 1 128 LYS HE2 6.500 . 6.500 5.033 4.299 5.515 . 0 0 "[ . 1]" 1
815 1 128 LYS H 1 128 LYS HE3 6.500 . 6.500 4.769 3.738 5.636 . 0 0 "[ . 1]" 1
816 1 128 LYS H 1 129 ASN H 6.500 . 6.500 2.776 2.071 3.496 . 0 0 "[ . 1]" 1
817 1 128 LYS HA 1 128 LYS HE2 6.500 . 6.500 5.137 4.126 6.179 . 0 0 "[ . 1]" 1
818 1 128 LYS HA 1 128 LYS HE3 6.500 . 6.500 4.950 4.307 5.797 . 0 0 "[ . 1]" 1
819 1 128 LYS QD 1 129 ASN H 6.500 . 6.500 3.857 1.711 5.141 . 0 0 "[ . 1]" 1
820 1 132 ARG H 1 132 ARG HD2 6.500 . 6.500 4.460 3.015 6.029 . 0 0 "[ . 1]" 1
821 1 132 ARG H 1 132 ARG HD3 6.500 . 6.500 4.715 3.619 5.805 . 0 0 "[ . 1]" 1
822 1 132 ARG H 1 133 VAL H 6.500 . 6.500 4.264 3.923 4.572 . 0 0 "[ . 1]" 1
823 1 132 ARG H 1 134 ARG H 6.500 . 6.500 6.362 6.156 6.559 0.059 10 0 "[ . 1]" 1
824 1 132 ARG HB2 1 133 VAL H 6.500 . 6.500 3.995 2.678 4.587 . 0 0 "[ . 1]" 1
825 1 132 ARG HB3 1 133 VAL H 6.500 . 6.500 3.575 2.362 4.253 . 0 0 "[ . 1]" 1
826 1 132 ARG QG 1 133 VAL H 6.500 . 6.500 3.743 2.721 4.390 . 0 0 "[ . 1]" 1
827 1 133 VAL H 1 133 VAL MG1 4.500 . 4.500 3.843 3.799 3.883 . 0 0 "[ . 1]" 1
828 1 133 VAL H 1 134 ARG QG 6.500 . 6.500 4.548 3.704 5.242 . 0 0 "[ . 1]" 1
829 1 133 VAL QG 1 135 ILE HB 6.500 . 6.500 4.774 4.262 5.402 . 0 0 "[ . 1]" 1
830 1 133 VAL QG 1 169 ALA HA 6.500 . 6.500 5.652 4.382 6.557 0.057 2 0 "[ . 1]" 1
831 1 133 VAL QG 1 176 LEU QB 6.500 . 6.500 5.213 4.392 6.145 . 0 0 "[ . 1]" 1
832 1 133 VAL MG1 1 134 ARG H 6.500 . 6.500 2.853 2.310 3.218 . 0 0 "[ . 1]" 1
833 1 133 VAL MG2 1 134 ARG H 6.500 . 6.500 4.143 4.009 4.279 . 0 0 "[ . 1]" 1
834 1 134 ARG H 1 134 ARG HD2 6.500 . 6.500 4.677 4.087 5.219 . 0 0 "[ . 1]" 1
835 1 134 ARG H 1 134 ARG HD3 6.500 . 6.500 4.832 3.847 5.187 . 0 0 "[ . 1]" 1
836 1 134 ARG H 1 134 ARG HG2 4.500 . 4.500 3.520 2.530 4.066 . 0 0 "[ . 1]" 1
837 1 134 ARG H 1 134 ARG HG3 4.500 . 4.500 2.823 2.408 3.870 . 0 0 "[ . 1]" 1
838 1 134 ARG H 1 135 ILE H 6.500 . 6.500 4.229 4.002 4.389 . 0 0 "[ . 1]" 1
839 1 135 ILE H 1 136 GLY H 6.500 . 6.500 4.356 4.244 4.489 . 0 0 "[ . 1]" 1
840 1 135 ILE HB 1 136 GLY H 6.500 . 6.500 4.355 4.153 4.437 . 0 0 "[ . 1]" 1
841 1 135 ILE MD 1 136 GLY H 6.500 . 6.500 4.893 4.550 5.364 . 0 0 "[ . 1]" 1
842 1 135 ILE MG 1 136 GLY H 6.500 . 6.500 2.942 2.624 3.147 . 0 0 "[ . 1]" 1
843 1 136 GLY H 1 137 VAL H 6.500 . 6.500 4.354 4.202 4.449 . 0 0 "[ . 1]" 1
844 1 137 VAL H 1 138 GLY H 6.500 . 6.500 2.132 2.046 2.266 . 0 0 "[ . 1]" 1
845 1 137 VAL HB 1 138 GLY H 6.500 . 6.500 4.166 4.078 4.323 . 0 0 "[ . 1]" 1
846 1 137 VAL QG 1 138 GLY H 6.500 . 6.500 2.750 2.548 2.999 . 0 0 "[ . 1]" 1
847 1 138 GLY H 1 139 ARG H 6.500 . 6.500 4.264 3.882 4.546 . 0 0 "[ . 1]" 1
848 1 139 ARG H 1 139 ARG HD2 6.500 . 6.500 4.086 2.841 4.762 . 0 0 "[ . 1]" 1
849 1 139 ARG H 1 139 ARG HD3 6.500 . 6.500 4.005 1.997 5.199 . 0 0 "[ . 1]" 1
850 1 139 ARG HA 1 146 PRO QG 6.500 . 6.500 4.810 3.477 6.540 0.040 7 0 "[ . 1]" 1
851 1 141 PRO HA 1 142 GLY H 4.500 . 4.500 2.389 2.133 3.237 . 0 0 "[ . 1]" 1
852 1 144 LYS H 1 144 LYS HD2 6.500 . 6.500 5.133 4.594 6.011 . 0 0 "[ . 1]" 1
853 1 144 LYS H 1 144 LYS HD3 6.500 . 6.500 4.341 3.606 6.056 . 0 0 "[ . 1]" 1
854 1 144 LYS H 1 144 LYS HE2 6.500 . 6.500 5.633 4.101 6.495 . 0 0 "[ . 1]" 1
855 1 144 LYS H 1 144 LYS HE3 6.500 . 6.500 5.787 4.743 6.562 0.062 10 0 "[ . 1]" 1
856 1 144 LYS H 1 145 ASP H 6.500 . 6.500 4.435 4.262 4.562 . 0 0 "[ . 1]" 1
857 1 144 LYS HA 1 144 LYS HE2 6.500 . 6.500 4.038 1.667 4.880 . 0 0 "[ . 1]" 1
858 1 144 LYS HA 1 144 LYS HE3 6.500 . 6.500 4.203 3.406 4.685 . 0 0 "[ . 1]" 1
859 1 144 LYS HA 1 145 ASP H 4.500 . 4.500 2.273 2.098 2.381 . 0 0 "[ . 1]" 1
860 1 144 LYS HA 1 147 ALA MB 6.500 . 6.500 6.527 6.204 6.651 0.151 4 0 "[ . 1]" 1
861 1 144 LYS QB 1 145 ASP H 6.500 . 6.500 2.946 2.511 3.725 . 0 0 "[ . 1]" 1
862 1 144 LYS HD2 1 145 ASP H 6.500 . 6.500 3.901 3.469 4.755 . 0 0 "[ . 1]" 1
863 1 144 LYS HD3 1 145 ASP H 6.500 . 6.500 3.504 2.293 4.310 . 0 0 "[ . 1]" 1
864 1 144 LYS QE 1 145 ASP H 6.500 . 6.500 4.913 3.295 5.791 . 0 0 "[ . 1]" 1
865 1 145 ASP HA 1 149 PHE H 6.500 . 6.500 6.019 5.207 6.382 . 0 0 "[ . 1]" 1
866 1 146 PRO O 1 150 VAL H 4.500 . 4.500 2.115 1.900 3.050 . 0 0 "[ . 1]" 1
867 1 146 PRO O 1 150 VAL N 4.500 . 4.500 2.927 2.733 3.654 . 0 0 "[ . 1]" 1
868 1 147 ALA H 1 148 ALA H 4.500 . 4.500 2.740 2.558 2.908 . 0 0 "[ . 1]" 1
869 1 147 ALA H 1 150 VAL QG 6.500 . 6.500 4.390 4.219 4.527 . 0 0 "[ . 1]" 1
870 1 147 ALA HA 1 150 VAL QG 6.500 . 6.500 2.566 2.191 3.169 . 0 0 "[ . 1]" 1
871 1 147 ALA MB 1 148 ALA MB 6.500 . 6.500 3.634 3.509 3.803 . 0 0 "[ . 1]" 1
872 1 147 ALA MB 1 150 VAL QG 6.500 . 6.500 3.670 3.244 4.300 . 0 0 "[ . 1]" 1
873 1 148 ALA H 1 149 PHE H 4.500 . 4.500 2.372 2.215 2.537 . 0 0 "[ . 1]" 1
874 1 148 ALA H 1 150 VAL H 6.500 . 6.500 3.869 3.661 4.023 . 0 0 "[ . 1]" 1
875 1 148 ALA HA 1 149 PHE H 6.500 . 6.500 3.505 3.439 3.581 . 0 0 "[ . 1]" 1
876 1 148 ALA HA 1 150 VAL HB 6.500 . 6.500 6.231 5.857 6.548 0.048 1 0 "[ . 1]" 1
877 1 148 ALA MB 1 149 PHE H 4.500 . 4.500 2.649 2.331 2.931 . 0 0 "[ . 1]" 1
878 1 149 PHE H 1 150 VAL H 6.500 . 6.500 2.479 2.330 2.670 . 0 0 "[ . 1]" 1
879 1 149 PHE H 1 150 VAL QG 6.500 . 6.500 3.884 3.515 4.275 . 0 0 "[ . 1]" 1
880 1 149 PHE H 1 151 LEU H 6.500 . 6.500 4.291 3.939 4.562 . 0 0 "[ . 1]" 1
881 1 149 PHE HA 1 151 LEU H 6.500 . 6.500 3.682 3.403 3.879 . 0 0 "[ . 1]" 1
882 1 149 PHE QB 1 150 VAL H 6.500 . 6.500 3.011 2.774 3.176 . 0 0 "[ . 1]" 1
883 1 150 VAL H 1 150 VAL MG2 4.500 . 4.500 3.597 2.132 3.811 . 0 0 "[ . 1]" 1
884 1 150 VAL H 1 151 LEU H 6.500 . 6.500 2.652 2.366 2.815 . 0 0 "[ . 1]" 1
885 1 150 VAL QG 1 151 LEU H 6.500 . 6.500 2.689 2.356 3.115 . 0 0 "[ . 1]" 1
886 1 152 GLU H 1 153 ASN H 6.500 . 6.500 3.792 3.532 4.205 . 0 0 "[ . 1]" 1
887 1 152 GLU HA 1 153 ASN H 4.500 . 4.500 2.159 2.117 2.205 . 0 0 "[ . 1]" 1
888 1 152 GLU HB2 1 153 ASN H 6.500 . 6.500 3.711 2.949 3.995 . 0 0 "[ . 1]" 1
889 1 152 GLU HB3 1 153 ASN H 6.500 . 6.500 4.338 4.048 4.467 . 0 0 "[ . 1]" 1
890 1 153 ASN H 1 154 PHE H 6.500 . 6.500 3.962 2.026 4.573 . 0 0 "[ . 1]" 1
891 1 153 ASN QB 1 154 PHE H 6.500 . 6.500 3.656 2.509 3.958 . 0 0 "[ . 1]" 1
892 1 153 ASN HB2 1 154 PHE H 6.500 . 6.500 4.226 3.632 4.580 . 0 0 "[ . 1]" 1
893 1 153 ASN HB3 1 154 PHE H 6.500 . 6.500 4.051 2.558 4.381 . 0 0 "[ . 1]" 1
894 1 154 PHE H 1 155 THR H 6.500 . 6.500 3.748 2.247 4.510 . 0 0 "[ . 1]" 1
895 1 154 PHE QB 1 155 THR H 6.500 . 6.500 3.316 2.222 4.035 . 0 0 "[ . 1]" 1
896 1 155 THR H 1 156 ALA H 6.500 . 6.500 4.366 4.256 4.509 . 0 0 "[ . 1]" 1
897 1 155 THR H 1 157 ALA H 6.500 . 6.500 5.242 4.354 5.812 . 0 0 "[ . 1]" 1
898 1 155 THR H 1 159 ARG HG2 6.500 . 6.500 4.363 2.895 6.254 . 0 0 "[ . 1]" 1
899 1 155 THR H 1 159 ARG HG3 6.500 . 6.500 4.945 2.892 6.526 0.026 1 0 "[ . 1]" 1
900 1 155 THR HA 1 157 ALA H 6.500 . 6.500 4.080 3.640 4.826 . 0 0 "[ . 1]" 1
901 1 156 ALA H 1 157 ALA H 6.500 . 6.500 2.609 2.366 2.776 . 0 0 "[ . 1]" 1
902 1 156 ALA H 1 158 GLU H 6.500 . 6.500 4.462 3.995 4.727 . 0 0 "[ . 1]" 1
903 1 156 ALA HA 1 158 GLU H 6.500 . 6.500 4.464 3.930 5.119 . 0 0 "[ . 1]" 1
904 1 156 ALA HA 1 159 ARG QB 6.500 . 6.500 3.012 2.237 4.006 . 0 0 "[ . 1]" 1
905 1 156 ALA MB 1 157 ALA H 6.500 . 6.500 2.717 2.347 2.998 . 0 0 "[ . 1]" 1
906 1 156 ALA O 1 160 ALA H 4.500 . 4.500 2.818 2.255 3.626 . 0 0 "[ . 1]" 1
907 1 156 ALA O 1 160 ALA N 4.500 . 4.500 3.556 3.123 4.300 . 0 0 "[ . 1]" 1
908 1 157 ALA H 1 158 GLU H 6.500 . 6.500 2.761 2.644 2.907 . 0 0 "[ . 1]" 1
909 1 157 ALA H 1 159 ARG H 6.500 . 6.500 4.088 3.865 4.314 . 0 0 "[ . 1]" 1
910 1 157 ALA HA 1 159 ARG H 6.500 . 6.500 4.292 3.721 4.726 . 0 0 "[ . 1]" 1
911 1 157 ALA HA 1 160 ALA H 6.500 . 6.500 3.871 3.587 4.114 . 0 0 "[ . 1]" 1
912 1 157 ALA HA 1 160 ALA MB 6.500 . 6.500 3.362 2.864 3.835 . 0 0 "[ . 1]" 1
913 1 157 ALA HA 1 161 GLU H 6.500 . 6.500 5.592 4.996 6.181 . 0 0 "[ . 1]" 1
914 1 157 ALA MB 1 158 GLU H 4.500 . 4.500 2.545 2.265 2.960 . 0 0 "[ . 1]" 1
915 1 157 ALA O 1 161 GLU H 4.500 . 4.500 3.347 2.753 3.854 . 0 0 "[ . 1]" 1
916 1 157 ALA O 1 161 GLU N 4.500 . 4.500 4.095 3.394 4.568 0.068 6 0 "[ . 1]" 1
917 1 158 GLU H 1 159 ARG H 4.500 . 4.500 2.505 2.346 2.683 . 0 0 "[ . 1]" 1
918 1 158 GLU H 1 159 ARG QB 6.500 . 6.500 4.527 4.081 4.689 . 0 0 "[ . 1]" 1
919 1 158 GLU H 1 160 ALA H 6.500 . 6.500 4.119 3.829 4.432 . 0 0 "[ . 1]" 1
920 1 158 GLU QB 1 159 ARG H 6.500 . 6.500 3.485 2.848 3.696 . 0 0 "[ . 1]" 1
921 1 158 GLU QG 1 160 ALA H 6.500 . 6.500 4.847 4.344 5.728 . 0 0 "[ . 1]" 1
922 1 158 GLU O 1 162 VAL H 4.500 . 4.500 2.845 2.204 3.351 . 0 0 "[ . 1]" 1
923 1 158 GLU O 1 162 VAL N 4.500 . 4.500 3.435 2.942 3.880 . 0 0 "[ . 1]" 1
924 1 159 ARG H 1 159 ARG HD2 6.500 . 6.500 4.473 3.375 5.944 . 0 0 "[ . 1]" 1
925 1 159 ARG H 1 159 ARG HD3 6.500 . 6.500 4.255 3.435 4.943 . 0 0 "[ . 1]" 1
926 1 159 ARG H 1 160 ALA H 6.500 . 6.500 2.593 2.381 2.751 . 0 0 "[ . 1]" 1
927 1 159 ARG H 1 161 GLU H 6.500 . 6.500 4.304 4.088 4.613 . 0 0 "[ . 1]" 1
928 1 159 ARG HA 1 161 GLU H 6.500 . 6.500 4.044 3.692 4.454 . 0 0 "[ . 1]" 1
929 1 159 ARG HA 1 162 VAL H 6.500 . 6.500 3.469 3.339 3.713 . 0 0 "[ . 1]" 1
930 1 159 ARG HA 1 162 VAL HB 6.500 . 6.500 3.530 3.165 3.861 . 0 0 "[ . 1]" 1
931 1 159 ARG QB 1 160 ALA H 4.500 . 4.500 2.874 2.588 3.031 . 0 0 "[ . 1]" 1
932 1 159 ARG O 1 163 PRO N 4.500 . 4.500 4.542 4.494 4.637 0.137 5 0 "[ . 1]" 1
933 1 160 ALA H 1 161 GLU H 4.500 . 4.500 2.611 2.379 2.921 . 0 0 "[ . 1]" 1
934 1 160 ALA H 1 162 VAL H 6.500 . 6.500 4.008 3.949 4.081 . 0 0 "[ . 1]" 1
935 1 160 ALA HA 1 163 PRO QB 6.500 . 6.500 5.913 5.381 6.432 . 0 0 "[ . 1]" 1
936 1 160 ALA MB 1 161 GLU H 4.500 . 4.500 2.778 2.399 3.037 . 0 0 "[ . 1]" 1
937 1 161 GLU H 1 162 VAL H 6.500 . 6.500 2.333 2.094 2.516 . 0 0 "[ . 1]" 1
938 1 161 GLU HA 1 164 THR HB 6.500 . 6.500 3.108 2.244 4.465 . 0 0 "[ . 1]" 1
939 1 161 GLU QG 1 162 VAL H 6.500 . 6.500 4.444 4.140 4.696 . 0 0 "[ . 1]" 1
940 1 162 VAL H 1 164 THR H 6.500 . 6.500 4.074 3.840 4.351 . 0 0 "[ . 1]" 1
941 1 162 VAL H 1 165 ILE MD 6.500 . 6.500 4.788 4.277 6.533 0.033 6 0 "[ . 1]" 1
942 1 162 VAL O 1 166 VAL H 4.500 . 4.500 2.168 1.941 2.863 . 0 0 "[ . 1]" 1
943 1 162 VAL O 1 166 VAL N 4.500 . 4.500 3.114 2.925 3.763 . 0 0 "[ . 1]" 1
944 1 163 PRO HA 1 166 VAL HB 6.500 . 6.500 3.064 2.749 3.619 . 0 0 "[ . 1]" 1
945 1 163 PRO HA 1 166 VAL QG 6.500 . 6.500 2.940 2.492 3.554 . 0 0 "[ . 1]" 1
946 1 163 PRO O 1 167 GLU H 4.500 . 4.500 2.512 1.948 3.223 . 0 0 "[ . 1]" 1
947 1 163 PRO O 1 167 GLU N 4.500 . 4.500 3.449 2.912 4.148 . 0 0 "[ . 1]" 1
948 1 164 THR H 1 164 THR MG 4.500 . 4.500 3.626 2.521 3.774 . 0 0 "[ . 1]" 1
949 1 164 THR H 1 165 ILE H 4.500 . 4.500 2.660 2.461 2.882 . 0 0 "[ . 1]" 1
950 1 164 THR H 1 165 ILE MD 6.500 . 6.500 4.821 3.796 5.851 . 0 0 "[ . 1]" 1
951 1 164 THR H 1 166 VAL H 6.500 . 6.500 4.137 3.928 4.341 . 0 0 "[ . 1]" 1
952 1 164 THR HB 1 165 ILE H 6.500 . 6.500 2.540 2.224 3.421 . 0 0 "[ . 1]" 1
953 1 164 THR MG 1 165 ILE H 6.500 . 6.500 3.573 3.296 4.061 . 0 0 "[ . 1]" 1
954 1 164 THR O 1 168 GLN H 4.500 . 4.500 2.294 1.910 2.940 . 0 0 "[ . 1]" 1
955 1 164 THR O 1 168 GLN N 4.500 . 4.500 3.234 2.846 3.882 . 0 0 "[ . 1]" 1
956 1 165 ILE H 1 166 VAL H 6.500 . 6.500 2.685 2.589 2.813 . 0 0 "[ . 1]" 1
957 1 165 ILE HA 1 168 GLN QB 6.500 . 6.500 2.811 1.853 3.718 . 0 0 "[ . 1]" 1
958 1 165 ILE HB 1 166 VAL H 6.500 . 6.500 2.833 2.405 3.868 . 0 0 "[ . 1]" 1
959 1 165 ILE MD 1 166 VAL H 6.500 . 6.500 4.432 4.214 4.762 . 0 0 "[ . 1]" 1
960 1 165 ILE QG 1 169 ALA H 6.500 . 6.500 5.269 3.920 5.991 . 0 0 "[ . 1]" 1
961 1 165 ILE HG12 1 166 VAL H 6.500 . 6.500 5.112 4.907 5.354 . 0 0 "[ . 1]" 1
962 1 165 ILE HG13 1 166 VAL H 6.500 . 6.500 4.607 4.127 5.159 . 0 0 "[ . 1]" 1
963 1 165 ILE MG 1 166 VAL H 4.500 . 4.500 3.085 2.348 3.506 . 0 0 "[ . 1]" 1
964 1 165 ILE MG 1 169 ALA H 4.500 . 4.500 3.871 3.432 4.525 0.025 6 0 "[ . 1]" 1
965 1 165 ILE O 1 169 ALA H 4.500 . 4.500 1.880 1.728 2.142 . 0 0 "[ . 1]" 1
966 1 165 ILE O 1 169 ALA N 4.500 . 4.500 2.807 2.701 3.002 . 0 0 "[ . 1]" 1
967 1 166 VAL H 1 166 VAL MG1 4.500 . 4.500 3.774 3.760 3.784 . 0 0 "[ . 1]" 1
968 1 166 VAL H 1 167 GLU H 6.500 . 6.500 2.838 2.702 2.885 . 0 0 "[ . 1]" 1
969 1 166 VAL H 1 168 GLN H 6.500 . 6.500 4.251 3.975 4.552 . 0 0 "[ . 1]" 1
970 1 166 VAL HA 1 169 ALA H 6.500 . 6.500 3.844 3.631 4.130 . 0 0 "[ . 1]" 1
971 1 166 VAL HA 1 169 ALA MB 6.500 . 6.500 3.005 2.656 3.457 . 0 0 "[ . 1]" 1
972 1 166 VAL HB 1 167 GLU H 4.500 . 4.500 2.474 2.329 2.716 . 0 0 "[ . 1]" 1
973 1 166 VAL QG 1 167 GLU H 6.500 . 6.500 3.102 3.018 3.236 . 0 0 "[ . 1]" 1
974 1 166 VAL O 1 170 ALA H 4.500 . 4.500 2.406 1.933 2.915 . 0 0 "[ . 1]" 1
975 1 166 VAL O 1 170 ALA N 4.500 . 4.500 3.269 2.860 3.717 . 0 0 "[ . 1]" 1
976 1 167 GLU H 1 168 GLN H 6.500 . 6.500 2.649 2.365 2.808 . 0 0 "[ . 1]" 1
977 1 167 GLU H 1 169 ALA H 6.500 . 6.500 4.165 4.009 4.357 . 0 0 "[ . 1]" 1
978 1 167 GLU HA 1 170 ALA MB 6.500 . 6.500 3.108 2.400 3.968 . 0 0 "[ . 1]" 1
979 1 167 GLU QB 1 168 GLN H 4.500 . 4.500 2.562 2.320 2.823 . 0 0 "[ . 1]" 1
980 1 167 GLU O 1 171 ASP H 4.500 . 4.500 2.627 1.893 3.688 . 0 0 "[ . 1]" 1
981 1 167 GLU O 1 171 ASP N 4.500 . 4.500 3.514 2.830 4.518 0.018 2 0 "[ . 1]" 1
982 1 168 GLN H 1 169 ALA H 6.500 . 6.500 2.641 2.510 2.757 . 0 0 "[ . 1]" 1
983 1 168 GLN H 1 169 ALA MB 6.500 . 6.500 4.323 4.201 4.431 . 0 0 "[ . 1]" 1
984 1 168 GLN HA 1 171 ASP QB 6.500 . 6.500 3.303 2.489 4.052 . 0 0 "[ . 1]" 1
985 1 168 GLN HB2 1 169 ALA H 6.500 . 6.500 3.047 2.448 3.982 . 0 0 "[ . 1]" 1
986 1 168 GLN HB3 1 169 ALA H 6.500 . 6.500 3.303 2.485 3.911 . 0 0 "[ . 1]" 1
987 1 168 GLN QG 1 169 ALA H 6.500 . 6.500 4.016 3.414 4.264 . 0 0 "[ . 1]" 1
988 1 168 GLN O 1 172 ALA H 4.500 . 4.500 2.223 1.822 2.785 . 0 0 "[ . 1]" 1
989 1 168 GLN O 1 172 ALA N 4.500 . 4.500 3.162 2.778 3.729 . 0 0 "[ . 1]" 1
990 1 169 ALA H 1 170 ALA H 4.500 . 4.500 2.681 2.577 2.901 . 0 0 "[ . 1]" 1
991 1 169 ALA H 1 171 ASP H 6.500 . 6.500 4.333 3.855 4.678 . 0 0 "[ . 1]" 1
992 1 169 ALA HA 1 172 ALA H 6.500 . 6.500 3.572 3.234 4.012 . 0 0 "[ . 1]" 1
993 1 169 ALA HA 1 172 ALA HA 6.500 . 6.500 5.607 5.321 6.030 . 0 0 "[ . 1]" 1
994 1 169 ALA HA 1 172 ALA MB 6.500 . 6.500 2.832 2.618 3.207 . 0 0 "[ . 1]" 1
995 1 169 ALA O 1 173 THR H 4.500 . 4.500 2.038 1.772 2.925 . 0 0 "[ . 1]" 1
996 1 169 ALA O 1 173 THR N 4.500 . 4.500 2.962 2.731 3.804 . 0 0 "[ . 1]" 1
997 1 170 ALA H 1 171 ASP H 6.500 . 6.500 2.696 2.448 2.850 . 0 0 "[ . 1]" 1
998 1 170 ALA H 1 172 ALA H 6.500 . 6.500 4.175 3.857 4.350 . 0 0 "[ . 1]" 1
999 1 170 ALA HA 1 172 ALA H 6.500 . 6.500 4.563 4.230 4.723 . 0 0 "[ . 1]" 1
1000 1 170 ALA HA 1 173 THR H 6.500 . 6.500 3.804 3.359 4.381 . 0 0 "[ . 1]" 1
1001 1 170 ALA HA 1 174 GLU H 6.500 . 6.500 4.464 3.814 5.351 . 0 0 "[ . 1]" 1
1002 1 170 ALA MB 1 171 ASP H 4.500 . 4.500 2.555 2.344 2.874 . 0 0 "[ . 1]" 1
1003 1 170 ALA O 1 174 GLU H 4.500 . 4.500 2.660 1.859 3.701 . 0 0 "[ . 1]" 1
1004 1 170 ALA O 1 174 GLU N 4.500 . 4.500 3.564 2.821 4.515 0.015 7 0 "[ . 1]" 1
1005 1 171 ASP H 1 172 ALA H 6.500 . 6.500 2.560 2.377 2.699 . 0 0 "[ . 1]" 1
1006 1 171 ASP H 1 173 THR H 6.500 . 6.500 4.129 3.880 4.302 . 0 0 "[ . 1]" 1
1007 1 171 ASP HA 1 174 GLU QB 6.500 . 6.500 3.457 2.700 4.172 . 0 0 "[ . 1]" 1
1008 1 171 ASP HB2 1 172 ALA H 6.500 . 6.500 3.492 2.474 3.946 . 0 0 "[ . 1]" 1
1009 1 171 ASP HB3 1 172 ALA H 6.500 . 6.500 2.922 2.511 3.809 . 0 0 "[ . 1]" 1
1010 1 171 ASP O 1 175 LEU H 4.500 . 4.500 2.750 1.982 3.707 . 0 0 "[ . 1]" 1
1011 1 171 ASP O 1 175 LEU N 4.500 . 4.500 3.631 2.941 4.532 0.032 7 0 "[ . 1]" 1
1012 1 172 ALA H 1 173 THR H 4.500 . 4.500 2.631 2.567 2.718 . 0 0 "[ . 1]" 1
1013 1 172 ALA H 1 174 GLU H 6.500 . 6.500 4.286 4.135 4.527 . 0 0 "[ . 1]" 1
1014 1 172 ALA H 1 187 THR MG 6.500 . 6.500 5.214 3.987 6.153 . 0 0 "[ . 1]" 1
1015 1 172 ALA HA 1 175 LEU QB 6.500 . 6.500 3.160 2.604 3.529 . 0 0 "[ . 1]" 1
1016 1 172 ALA HA 1 188 VAL QG 6.500 . 6.500 4.287 3.176 5.505 . 0 0 "[ . 1]" 1
1017 1 172 ALA MB 1 173 THR H 4.500 . 4.500 2.591 2.437 2.808 . 0 0 "[ . 1]" 1
1018 1 172 ALA MB 1 176 LEU QB 6.500 . 6.500 4.680 3.934 5.836 . 0 0 "[ . 1]" 1
1019 1 172 ALA MB 1 188 VAL QG 6.500 . 6.500 2.425 1.918 3.131 . 0 0 "[ . 1]" 1
1020 1 172 ALA O 1 176 LEU H 4.500 . 4.500 2.280 1.983 2.878 . 0 0 "[ . 1]" 1
1021 1 172 ALA O 1 176 LEU N 4.500 . 4.500 3.136 2.825 3.718 . 0 0 "[ . 1]" 1
1022 1 173 THR H 1 173 THR MG 4.500 . 4.500 2.987 2.372 3.779 . 0 0 "[ . 1]" 1
1023 1 173 THR HA 1 175 LEU H 6.500 . 6.500 4.334 3.952 4.754 . 0 0 "[ . 1]" 1
1024 1 173 THR HA 1 176 LEU QB 6.500 . 6.500 2.738 1.886 3.640 . 0 0 "[ . 1]" 1
1025 1 173 THR MG 1 174 GLU H 6.500 . 6.500 3.872 3.462 4.218 . 0 0 "[ . 1]" 1
1026 1 173 THR MG 1 177 ILE MD 6.500 . 6.500 4.100 2.248 5.959 . 0 0 "[ . 1]" 1
1027 1 173 THR O 1 177 ILE H 4.500 . 4.500 2.427 1.976 3.115 . 0 0 "[ . 1]" 1
1028 1 173 THR O 1 177 ILE N 4.500 . 4.500 3.344 2.909 3.984 . 0 0 "[ . 1]" 1
1029 1 174 GLU H 1 175 LEU H 6.500 . 6.500 2.682 2.551 2.895 . 0 0 "[ . 1]" 1
1030 1 174 GLU HA 1 177 ILE HB 6.500 . 6.500 3.529 2.804 6.017 . 0 0 "[ . 1]" 1
1031 1 174 GLU HA 1 177 ILE MD 6.500 . 6.500 3.576 2.117 5.401 . 0 0 "[ . 1]" 1
1032 1 174 GLU HG2 1 175 LEU H 6.500 . 6.500 4.309 3.657 5.070 . 0 0 "[ . 1]" 1
1033 1 174 GLU HG3 1 175 LEU H 6.500 . 6.500 4.797 4.445 5.276 . 0 0 "[ . 1]" 1
1034 1 174 GLU O 1 178 ALA H 4.500 . 4.500 2.100 1.857 2.370 . 0 0 "[ . 1]" 1
1035 1 174 GLU O 1 178 ALA N 4.500 . 4.500 2.908 2.735 3.121 . 0 0 "[ . 1]" 1
1036 1 175 LEU H 1 176 LEU H 6.500 . 6.500 2.506 2.385 2.594 . 0 0 "[ . 1]" 1
1037 1 175 LEU HA 1 178 ALA MB 6.500 . 6.500 2.051 1.917 2.349 . 0 0 "[ . 1]" 1
1038 1 175 LEU QB 1 184 ALA MB 6.500 . 6.500 2.920 2.208 4.011 . 0 0 "[ . 1]" 1
1039 1 175 LEU QD 1 184 ALA H 6.500 . 6.500 3.443 2.991 4.304 . 0 0 "[ . 1]" 1
1040 1 175 LEU QD 1 187 THR H 6.500 . 6.500 4.734 3.913 5.649 . 0 0 "[ . 1]" 1
1041 1 175 LEU MD1 1 176 LEU H 6.500 . 6.500 4.667 4.625 4.731 . 0 0 "[ . 1]" 1
1042 1 175 LEU MD2 1 176 LEU H 6.500 . 6.500 4.567 4.442 4.703 . 0 0 "[ . 1]" 1
1043 1 175 LEU HG 1 178 ALA HA 6.500 . 6.500 6.562 6.511 6.605 0.105 9 0 "[ . 1]" 1
1044 1 175 LEU HG 1 181 LEU HA 6.500 . 6.500 5.680 5.216 6.056 . 0 0 "[ . 1]" 1
1045 1 175 LEU O 1 179 GLN H 4.500 . 4.500 2.010 1.777 2.722 . 0 0 "[ . 1]" 1
1046 1 175 LEU O 1 179 GLN N 4.500 . 4.500 2.961 2.711 3.657 . 0 0 "[ . 1]" 1
1047 1 176 LEU H 1 177 ILE H 6.500 . 6.500 2.683 2.521 2.902 . 0 0 "[ . 1]" 1
1048 1 176 LEU HA 1 178 ALA H 6.500 . 6.500 4.324 4.118 4.580 . 0 0 "[ . 1]" 1
1049 1 176 LEU HA 1 179 GLN H 6.500 . 6.500 4.026 3.565 4.405 . 0 0 "[ . 1]" 1
1050 1 176 LEU HA 1 184 ALA MB 6.500 . 6.500 3.136 2.666 3.928 . 0 0 "[ . 1]" 1
1051 1 176 LEU HB2 1 177 ILE H 6.500 . 6.500 3.078 2.291 3.783 . 0 0 "[ . 1]" 1
1052 1 176 LEU HB3 1 177 ILE H 6.500 . 6.500 2.914 2.319 3.559 . 0 0 "[ . 1]" 1
1053 1 176 LEU QD 1 177 ILE MD 6.500 . 6.500 4.193 2.433 4.851 . 0 0 "[ . 1]" 1
1054 1 176 LEU QD 1 180 GLY QA 6.500 . 6.500 4.217 3.200 5.062 . 0 0 "[ . 1]" 1
1055 1 176 LEU QD 1 181 LEU HA 6.500 . 6.500 2.307 1.479 3.178 . 0 0 "[ . 1]" 1
1056 1 176 LEU MD1 1 185 GLN H 6.500 . 6.500 5.257 4.260 6.514 0.014 9 0 "[ . 1]" 1
1057 1 176 LEU MD2 1 185 GLN H 6.500 . 6.500 5.193 3.610 6.527 0.027 1 0 "[ . 1]" 1
1058 1 176 LEU HG 1 180 GLY QA 6.500 . 6.500 5.379 4.119 6.525 0.025 10 0 "[ . 1]" 1
1059 1 177 ILE H 1 178 ALA H 6.500 . 6.500 2.420 2.326 2.613 . 0 0 "[ . 1]" 1
1060 1 177 ILE H 1 179 GLN H 6.500 . 6.500 4.425 4.117 5.091 . 0 0 "[ . 1]" 1
1061 1 177 ILE HB 1 178 ALA H 6.500 . 6.500 2.962 2.625 3.923 . 0 0 "[ . 1]" 1
1062 1 177 ILE MD 1 178 ALA H 6.500 . 6.500 4.637 4.203 4.822 . 0 0 "[ . 1]" 1
1063 1 178 ALA H 1 179 GLN H 6.500 . 6.500 2.767 2.588 3.129 . 0 0 "[ . 1]" 1
1064 1 178 ALA H 1 180 GLY H 6.500 . 6.500 4.714 4.260 4.974 . 0 0 "[ . 1]" 1
1065 1 178 ALA HA 1 180 GLY H 6.500 . 6.500 5.826 5.374 6.105 . 0 0 "[ . 1]" 1
1066 1 178 ALA MB 1 179 GLN H 6.500 . 6.500 2.355 2.038 2.548 . 0 0 "[ . 1]" 1
1067 1 179 GLN H 1 180 GLY H 4.500 . 4.500 2.324 1.836 2.631 . 0 0 "[ . 1]" 1
1068 1 179 GLN QB 1 180 GLY H 6.500 . 6.500 2.207 1.835 2.758 . 0 0 "[ . 1]" 1
1069 1 181 LEU O 1 185 GLN H 4.500 . 4.500 2.023 1.843 2.336 . 0 0 "[ . 1]" 1
1070 1 181 LEU O 1 185 GLN N 4.500 . 4.500 2.949 2.796 3.246 . 0 0 "[ . 1]" 1
1071 1 182 GLU H 1 184 ALA H 6.500 . 6.500 3.969 3.844 4.162 . 0 0 "[ . 1]" 1
1072 1 182 GLU HA 1 184 ALA H 6.500 . 6.500 4.174 3.974 4.386 . 0 0 "[ . 1]" 1
1073 1 182 GLU HA 1 185 GLN H 6.500 . 6.500 3.570 2.987 4.178 . 0 0 "[ . 1]" 1
1074 1 182 GLU O 1 186 ASN H 4.500 . 4.500 2.542 1.945 3.765 . 0 0 "[ . 1]" 1
1075 1 182 GLU O 1 186 ASN N 4.500 . 4.500 3.389 2.876 4.548 0.048 5 0 "[ . 1]" 1
1076 1 183 PRO HA 1 186 ASN QB 6.500 . 6.500 2.930 2.533 4.225 . 0 0 "[ . 1]" 1
1077 1 183 PRO O 1 187 THR H 4.500 . 4.500 2.335 1.825 3.003 . 0 0 "[ . 1]" 1
1078 1 183 PRO O 1 187 THR N 4.500 . 4.500 3.209 2.799 3.739 . 0 0 "[ . 1]" 1
1079 1 184 ALA H 1 185 GLN H 6.500 . 6.500 2.638 2.514 2.724 . 0 0 "[ . 1]" 1
1080 1 184 ALA HA 1 187 THR H 6.500 . 6.500 3.453 3.173 3.691 . 0 0 "[ . 1]" 1
1081 1 184 ALA MB 1 185 GLN H 6.500 . 6.500 2.488 2.299 2.899 . 0 0 "[ . 1]" 1
1082 1 185 GLN H 1 186 ASN H 6.500 . 6.500 2.635 2.482 2.737 . 0 0 "[ . 1]" 1
1083 1 185 GLN H 1 187 THR H 6.500 . 6.500 4.311 4.034 4.684 . 0 0 "[ . 1]" 1
1084 1 185 GLN HA 1 187 THR H 6.500 . 6.500 4.468 3.741 4.945 . 0 0 "[ . 1]" 1
1085 1 185 GLN HA 1 188 VAL H 6.500 . 6.500 3.720 2.997 4.352 . 0 0 "[ . 1]" 1
1086 1 185 GLN HA 1 188 VAL HB 6.500 . 6.500 4.473 2.594 5.207 . 0 0 "[ . 1]" 1
1087 1 185 GLN HA 1 188 VAL QG 6.500 . 6.500 2.316 1.723 3.351 . 0 0 "[ . 1]" 1
1088 1 185 GLN HB2 1 186 ASN H 6.500 . 6.500 3.726 2.572 4.127 . 0 0 "[ . 1]" 1
1089 1 185 GLN HB3 1 186 ASN H 6.500 . 6.500 4.022 3.394 4.275 . 0 0 "[ . 1]" 1
1090 1 185 GLN QG 1 186 ASN H 6.500 . 6.500 2.790 2.154 4.169 . 0 0 "[ . 1]" 1
1091 1 186 ASN H 1 187 THR H 6.500 . 6.500 2.564 2.378 2.745 . 0 0 "[ . 1]" 1
1092 1 186 ASN HA 1 188 VAL H 6.500 . 6.500 4.516 4.221 4.778 . 0 0 "[ . 1]" 1
1093 1 186 ASN HA 1 189 HIS H 6.500 . 6.500 3.781 3.379 4.042 . 0 0 "[ . 1]" 1
1094 1 186 ASN QB 1 187 THR H 6.500 . 6.500 2.605 2.315 2.971 . 0 0 "[ . 1]" 1
1095 1 187 THR H 1 188 VAL H 6.500 . 6.500 2.663 2.381 2.842 . 0 0 "[ . 1]" 1
1096 1 187 THR H 1 189 HIS H 6.500 . 6.500 4.058 3.734 4.375 . 0 0 "[ . 1]" 1
1097 1 187 THR HA 1 189 HIS H 6.500 . 6.500 4.040 3.838 4.459 . 0 0 "[ . 1]" 1
1098 1 187 THR HA 1 190 ALA MB 6.500 . 6.500 3.019 2.014 5.922 . 0 0 "[ . 1]" 1
1099 1 187 THR MG 1 188 VAL H 6.500 . 6.500 2.908 1.936 3.823 . 0 0 "[ . 1]" 1
1100 1 187 THR MG 1 189 HIS H 6.500 . 6.500 4.557 3.989 5.114 . 0 0 "[ . 1]" 1
1101 1 188 VAL H 1 189 HIS H 6.500 . 6.500 2.591 2.435 2.834 . 0 0 "[ . 1]" 1
1102 1 188 VAL HA 1 191 TRP HB2 6.500 . 6.500 4.108 2.723 5.895 . 0 0 "[ . 1]" 1
1103 1 188 VAL HA 1 191 TRP HB3 6.500 . 6.500 5.466 4.337 6.525 0.025 2 0 "[ . 1]" 1
1104 1 188 VAL MG1 1 189 HIS H 6.500 . 6.500 3.527 2.340 4.303 . 0 0 "[ . 1]" 1
1105 1 188 VAL MG2 1 189 HIS H 6.500 . 6.500 3.337 2.543 4.157 . 0 0 "[ . 1]" 1
1106 1 189 HIS H 1 190 ALA H 6.500 . 6.500 2.344 1.935 2.676 . 0 0 "[ . 1]" 1
1107 1 189 HIS H 1 190 ALA MB 6.500 . 6.500 3.979 3.757 4.532 . 0 0 "[ . 1]" 1
1108 1 189 HIS H 1 191 TRP H 6.500 . 6.500 4.027 3.426 4.484 . 0 0 "[ . 1]" 1
1109 1 189 HIS QB 1 190 ALA H 6.500 . 6.500 3.342 2.789 3.960 . 0 0 "[ . 1]" 1
1110 1 190 ALA H 1 191 TRP H 4.500 . 4.500 2.288 1.775 2.521 . 0 0 "[ . 1]" 1
1111 1 190 ALA MB 1 191 TRP H 4.500 . 4.500 3.093 2.639 3.502 . 0 0 "[ . 1]" 1
1112 1 191 TRP H 1 191 TRP HD1 4.000 . 4.000 2.725 2.220 3.694 . 0 0 "[ . 1]" 1
1113 1 191 TRP HA 1 191 TRP HD1 4.000 . 4.000 3.874 2.770 4.494 0.494 8 0 "[ . 1]" 1
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