NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
558560 |
4b6v   |
18663 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_4b6v
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 2225
_Distance_constraint_stats_list.Viol_count 1265
_Distance_constraint_stats_list.Viol_total 1437.169
_Distance_constraint_stats_list.Viol_max 0.580
_Distance_constraint_stats_list.Viol_rms 0.0335
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0065
_Distance_constraint_stats_list.Viol_average_violations_only 0.1136
_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 0.264 0.108 3 0 "[ . 1]"
1 2 ALA 0.108 0.108 3 0 "[ . 1]"
1 3 LEU 0.156 0.101 3 0 "[ . 1]"
1 12 ALA 0.968 0.407 6 0 "[ . 1]"
1 13 ASN 1.245 0.407 6 0 "[ . 1]"
1 14 GLU 0.194 0.093 6 0 "[ . 1]"
1 15 PRO 0.000 0.000 . 0 "[ . 1]"
1 16 LEU 0.139 0.060 1 0 "[ . 1]"
1 17 ASP 1.528 0.408 3 0 "[ . 1]"
1 18 LYS 0.825 0.408 3 0 "[ . 1]"
1 19 ALA 0.374 0.223 5 0 "[ . 1]"
1 20 LEU 2.258 0.580 1 1 "[+ . 1]"
1 21 SER 0.789 0.580 1 1 "[+ . 1]"
1 22 ALA 0.410 0.318 5 0 "[ . 1]"
1 23 LEU 1.378 0.424 5 0 "[ . 1]"
1 24 PRO 0.000 0.000 . 0 "[ . 1]"
1 26 GLU 0.854 0.346 3 0 "[ . 1]"
1 27 PRO 1.530 0.308 5 0 "[ . 1]"
1 28 GLY 0.000 0.000 . 0 "[ . 1]"
1 29 GLY 3.168 0.346 3 0 "[ . 1]"
1 30 VAL 0.573 0.136 5 0 "[ . 1]"
1 31 PRO 3.248 0.273 4 0 "[ . 1]"
1 32 LEU 6.068 0.253 4 0 "[ . 1]"
1 33 HIS 4.230 0.296 6 0 "[ . 1]"
1 34 SER 1.039 0.179 9 0 "[ . 1]"
1 36 TRP 3.882 0.296 6 0 "[ . 1]"
1 37 THR 0.425 0.073 6 0 "[ . 1]"
1 38 PHE 0.056 0.047 2 0 "[ . 1]"
1 39 TRP 6.947 0.319 4 0 "[ . 1]"
1 40 LEU 5.066 0.266 8 0 "[ . 1]"
1 41 ASP 0.490 0.145 7 0 "[ . 1]"
1 42 ARG 2.891 0.482 4 0 "[ . 1]"
1 43 SER 3.263 0.482 4 0 "[ . 1]"
1 44 LEU 2.400 0.248 7 0 "[ . 1]"
1 45 PRO 0.000 0.000 . 0 "[ . 1]"
1 46 GLY 0.000 0.000 . 0 "[ . 1]"
1 47 ALA 2.076 0.256 10 0 "[ . 1]"
1 48 THR 1.499 0.255 7 0 "[ . 1]"
1 49 ALA 1.492 0.255 7 0 "[ . 1]"
1 50 ALA 0.111 0.054 7 0 "[ . 1]"
1 51 GLU 1.603 0.244 3 0 "[ . 1]"
1 52 CYS 0.374 0.141 6 0 "[ . 1]"
1 53 ALA 0.760 0.201 5 0 "[ . 1]"
1 54 SER 2.888 0.337 10 0 "[ . 1]"
1 55 ASN 7.458 0.337 10 0 "[ . 1]"
1 56 LEU 1.845 0.221 4 0 "[ . 1]"
1 57 LYS 1.726 0.319 4 0 "[ . 1]"
1 58 LYS 2.513 0.244 5 0 "[ . 1]"
1 59 ILE 0.801 0.219 4 0 "[ . 1]"
1 60 TYR 1.361 0.242 3 0 "[ . 1]"
1 61 THR 1.915 0.179 3 0 "[ . 1]"
1 62 VAL 0.000 0.000 . 0 "[ . 1]"
1 63 GLN 6.569 0.221 4 0 "[ . 1]"
1 64 THR 0.174 0.062 2 0 "[ . 1]"
1 65 VAL 6.139 0.273 4 0 "[ . 1]"
1 66 GLN 2.243 0.206 10 0 "[ . 1]"
1 67 ILE 0.863 0.144 5 0 "[ . 1]"
1 68 PHE 0.000 0.000 . 0 "[ . 1]"
1 69 TRP 1.051 0.165 6 0 "[ . 1]"
1 70 SER 1.038 0.176 4 0 "[ . 1]"
1 71 VAL 0.901 0.179 4 0 "[ . 1]"
1 72 TYR 0.073 0.061 8 0 "[ . 1]"
1 73 ASN 0.459 0.080 5 0 "[ . 1]"
1 74 ASN 1.586 0.179 4 0 "[ . 1]"
1 75 ILE 0.242 0.182 8 0 "[ . 1]"
1 76 PRO 0.000 0.000 . 0 "[ . 1]"
1 77 PRO 0.000 0.000 . 0 "[ . 1]"
1 78 VAL 1.939 0.302 2 0 "[ . 1]"
1 79 THR 0.352 0.126 9 0 "[ . 1]"
1 80 SER 1.168 0.151 3 0 "[ . 1]"
1 81 LEU 6.225 0.370 1 0 "[ . 1]"
1 82 PRO 0.000 0.000 . 0 "[ . 1]"
1 83 LEU 0.434 0.174 6 0 "[ . 1]"
1 84 ARG 2.256 0.294 6 0 "[ . 1]"
1 85 CYS 7.561 0.294 6 0 "[ . 1]"
1 86 SER 2.271 0.266 8 0 "[ . 1]"
1 87 TYR 3.241 0.335 5 0 "[ . 1]"
1 88 HIS 0.480 0.166 3 0 "[ . 1]"
1 89 LEU 0.274 0.091 4 0 "[ . 1]"
1 90 MET 0.388 0.100 9 0 "[ . 1]"
1 91 ARG 1.521 0.185 4 0 "[ . 1]"
1 92 GLY 1.662 0.243 1 0 "[ . 1]"
1 93 GLU 1.066 0.179 6 0 "[ . 1]"
1 94 ARG 0.691 0.181 9 0 "[ . 1]"
1 95 ARG 0.355 0.160 8 0 "[ . 1]"
1 96 PRO 0.000 0.000 . 0 "[ . 1]"
1 97 LEU 0.881 0.196 2 0 "[ . 1]"
1 98 TRP 2.074 0.262 2 0 "[ . 1]"
1 99 GLU 0.230 0.087 5 0 "[ . 1]"
1 100 GLU 1.380 0.196 2 0 "[ . 1]"
1 101 GLU 2.147 0.329 9 0 "[ . 1]"
1 102 SER 0.337 0.182 2 0 "[ . 1]"
1 103 ASN 3.425 0.329 9 0 "[ . 1]"
1 104 ALA 2.112 0.262 2 0 "[ . 1]"
1 105 LYS 2.155 0.299 5 0 "[ . 1]"
1 106 GLY 3.838 0.520 10 1 "[ . +]"
1 107 GLY 4.098 0.355 8 0 "[ . 1]"
1 108 VAL 5.312 0.318 7 0 "[ . 1]"
1 109 TRP 5.571 0.222 1 0 "[ . 1]"
1 110 LYS 3.467 0.318 7 0 "[ . 1]"
1 111 MET 0.986 0.305 6 0 "[ . 1]"
1 112 LYS 2.972 0.206 5 0 "[ . 1]"
1 113 VAL 2.128 0.245 8 0 "[ . 1]"
1 114 PRO 0.055 0.055 6 0 "[ . 1]"
1 115 LYS 0.089 0.052 2 0 "[ . 1]"
1 116 ASP 0.617 0.379 7 0 "[ . 1]"
1 117 SER 0.000 0.000 . 0 "[ . 1]"
1 118 THR 2.919 0.407 10 0 "[ . 1]"
1 119 SER 0.000 0.000 . 0 "[ . 1]"
1 120 THR 1.791 0.243 2 0 "[ . 1]"
1 121 VAL 0.634 0.407 10 0 "[ . 1]"
1 122 TRP 0.342 0.078 7 0 "[ . 1]"
1 123 LYS 0.516 0.091 2 0 "[ . 1]"
1 124 GLU 0.928 0.130 8 0 "[ . 1]"
1 125 LEU 1.260 0.130 8 0 "[ . 1]"
1 126 LEU 0.359 0.097 9 0 "[ . 1]"
1 127 LEU 0.782 0.370 4 0 "[ . 1]"
1 128 ALA 1.099 0.205 3 0 "[ . 1]"
1 129 THR 0.101 0.036 9 0 "[ . 1]"
1 130 ILE 6.519 0.370 4 0 "[ . 1]"
1 131 GLY 0.143 0.094 9 0 "[ . 1]"
1 132 GLU 0.000 0.000 . 0 "[ . 1]"
1 133 GLN 3.528 0.258 6 0 "[ . 1]"
1 134 PHE 3.175 0.322 6 0 "[ . 1]"
1 135 THR 0.268 0.135 2 0 "[ . 1]"
1 136 ASP 0.450 0.084 4 0 "[ . 1]"
1 137 CYS 3.349 0.364 6 0 "[ . 1]"
1 138 ALA 0.005 0.004 5 0 "[ . 1]"
1 139 ALA 0.088 0.040 2 0 "[ . 1]"
1 140 ALA 0.011 0.011 8 0 "[ . 1]"
1 141 ASP 2.270 0.313 5 0 "[ . 1]"
1 142 ASP 1.353 0.189 8 0 "[ . 1]"
1 143 GLU 0.645 0.247 2 0 "[ . 1]"
1 144 ILE 2.274 0.247 2 0 "[ . 1]"
1 145 ILE 1.458 0.181 9 0 "[ . 1]"
1 146 GLY 1.765 0.226 7 0 "[ . 1]"
1 147 VAL 1.437 0.468 1 0 "[ . 1]"
1 148 SER 0.279 0.123 3 0 "[ . 1]"
1 149 VAL 0.472 0.134 10 0 "[ . 1]"
1 150 SER 0.179 0.073 9 0 "[ . 1]"
1 151 VAL 3.302 0.370 1 0 "[ . 1]"
1 152 ARG 1.650 0.230 3 0 "[ . 1]"
1 153 ASP 0.697 0.190 2 0 "[ . 1]"
1 154 ARG 0.534 0.190 2 0 "[ . 1]"
1 155 GLU 1.837 0.230 3 0 "[ . 1]"
1 156 ASP 0.650 0.171 8 0 "[ . 1]"
1 157 VAL 1.117 0.305 6 0 "[ . 1]"
1 158 VAL 2.504 0.299 5 0 "[ . 1]"
1 159 GLN 4.185 0.468 1 0 "[ . 1]"
1 160 VAL 0.938 0.251 1 0 "[ . 1]"
1 161 TRP 1.837 0.293 5 0 "[ . 1]"
1 162 ASN 1.436 0.251 1 0 "[ . 1]"
1 163 VAL 2.835 0.226 7 0 "[ . 1]"
1 164 ASN 2.906 0.428 8 0 "[ . 1]"
1 165 ALA 1.518 0.217 4 0 "[ . 1]"
1 166 SER 5.000 0.520 10 1 "[ . +]"
1 167 LEU 1.481 0.189 8 0 "[ . 1]"
1 168 VAL 1.677 0.428 8 0 "[ . 1]"
1 169 GLY 0.243 0.086 4 0 "[ . 1]"
1 170 GLU 0.315 0.086 4 0 "[ . 1]"
1 171 ALA 1.139 0.211 6 0 "[ . 1]"
1 172 THR 1.246 0.125 8 0 "[ . 1]"
1 173 VAL 3.304 0.364 6 0 "[ . 1]"
1 174 LEU 1.316 0.191 8 0 "[ . 1]"
1 175 GLU 1.325 0.257 3 0 "[ . 1]"
1 176 LYS 2.308 0.205 3 0 "[ . 1]"
1 177 ILE 0.160 0.121 4 0 "[ . 1]"
1 178 HIS 1.373 0.295 9 0 "[ . 1]"
1 179 GLN 3.624 0.295 9 0 "[ . 1]"
1 180 LEU 2.314 0.234 9 0 "[ . 1]"
1 181 LEU 1.610 0.288 9 0 "[ . 1]"
1 182 PRO 0.248 0.117 7 0 "[ . 1]"
1 183 HIS 0.306 0.116 5 0 "[ . 1]"
1 184 ILE 1.253 0.379 7 0 "[ . 1]"
1 185 ALA 0.571 0.181 9 0 "[ . 1]"
1 186 PHE 0.553 0.092 8 0 "[ . 1]"
1 187 LYS 1.087 0.245 8 0 "[ . 1]"
1 188 ALA 0.655 0.145 9 0 "[ . 1]"
1 189 VAL 1.024 0.145 9 0 "[ . 1]"
1 190 PHE 0.000 0.000 . 0 "[ . 1]"
1 191 TYR 0.636 0.156 7 0 "[ . 1]"
1 192 LYS 0.937 0.153 7 0 "[ . 1]"
1 194 HIS 0.416 0.119 6 0 "[ . 1]"
1 195 GLU 0.057 0.057 3 0 "[ . 1]"
1 196 GLU 0.000 0.000 . 0 "[ . 1]"
1 197 HIS 0.000 0.000 . 0 "[ . 1]"
1 199 ALA 0.302 0.186 5 0 "[ . 1]"
1 200 PHE 0.313 0.186 5 0 "[ . 1]"
1 201 GLU 0.000 0.000 . 0 "[ . 1]"
1 202 GLY 0.011 0.011 4 0 "[ . 1]"
1 206 LYS 0.000 0.000 . 0 "[ . 1]"
1 207 HIS 0.000 0.000 . 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 HB3 1 2 ALA H 5.500 . 5.500 2.740 2.176 3.548 . 0 0 "[ . 1]" 1
2 1 1 MET HB3 1 2 ALA HA 5.500 . 5.500 4.921 4.644 5.608 0.108 3 0 "[ . 1]" 1
3 1 1 MET HB2 1 2 ALA H 5.500 . 5.500 3.718 2.658 4.299 . 0 0 "[ . 1]" 1
4 1 1 MET HB2 1 2 ALA HA 5.500 . 5.500 5.192 4.215 5.453 . 0 0 "[ . 1]" 1
5 1 1 MET QB 1 3 LEU H 6.220 . 6.220 3.367 2.469 5.466 . 0 0 "[ . 1]" 1
6 1 1 MET HB3 1 3 LEU HA 5.500 . 5.500 4.785 3.940 5.601 0.101 3 0 "[ . 1]" 1
7 1 1 MET HB2 1 3 LEU HA 5.500 . 5.500 4.901 4.117 5.531 0.031 10 0 "[ . 1]" 1
8 1 12 ALA HA 1 13 ASN QD 6.200 . 6.200 5.868 4.182 6.607 0.407 6 0 "[ . 1]" 1
9 1 12 ALA MB 1 13 ASN H 6.520 . 6.520 2.901 2.359 3.493 . 0 0 "[ . 1]" 1
10 1 12 ALA MB 1 13 ASN QD 7.220 . 7.220 5.297 2.046 6.371 . 0 0 "[ . 1]" 1
11 1 13 ASN HB3 1 14 GLU H 5.500 . 5.500 3.783 1.972 4.466 . 0 0 "[ . 1]" 1
12 1 13 ASN HB2 1 14 GLU H 5.500 . 5.500 3.922 2.836 4.616 . 0 0 "[ . 1]" 1
13 1 13 ASN HD21 1 14 GLU HB2 5.500 . 5.500 4.809 2.937 5.489 . 0 0 "[ . 1]" 1
14 1 13 ASN HD22 1 14 GLU HB2 5.500 . 5.500 4.954 2.856 5.593 0.093 6 0 "[ . 1]" 1
15 1 13 ASN QB 1 16 LEU QB 7.100 . 7.100 5.776 1.859 7.044 . 0 0 "[ . 1]" 1
16 1 13 ASN QB 1 16 LEU QD 8.260 . 8.260 4.672 1.991 6.804 . 0 0 "[ . 1]" 1
17 1 13 ASN QD 1 16 LEU HG 6.200 . 6.200 4.814 3.055 6.260 0.060 1 0 "[ . 1]" 1
18 1 13 ASN QD 1 16 LEU QD 7.490 . 7.490 3.791 2.232 5.413 . 0 0 "[ . 1]" 1
19 1 13 ASN HD21 1 16 LEU QB 6.380 . 6.380 5.587 4.894 6.402 0.022 6 0 "[ . 1]" 1
20 1 13 ASN HD22 1 16 LEU QB 6.380 . 6.380 5.199 4.287 6.332 . 0 0 "[ . 1]" 1
21 1 14 GLU H 1 15 PRO HD2 5.500 . 5.500 3.746 1.909 4.930 . 0 0 "[ . 1]" 1
22 1 14 GLU H 1 15 PRO HD3 5.500 . 5.500 4.231 3.018 5.134 . 0 0 "[ . 1]" 1
23 1 15 PRO QB 1 17 ASP H 6.220 . 6.220 4.431 2.702 5.668 . 0 0 "[ . 1]" 1
24 1 15 PRO QB 1 17 ASP QB 6.950 . 6.950 4.886 3.458 6.472 . 0 0 "[ . 1]" 1
25 1 16 LEU HA 1 17 ASP QB 6.220 . 6.220 4.705 4.113 5.409 . 0 0 "[ . 1]" 1
26 1 16 LEU QB 1 17 ASP H 6.380 . 6.380 3.025 1.960 3.858 . 0 0 "[ . 1]" 1
27 1 16 LEU QD 1 17 ASP H 7.540 . 7.540 3.700 3.010 4.411 . 0 0 "[ . 1]" 1
28 1 16 LEU QD 1 17 ASP QB 7.830 . 7.830 4.775 3.628 5.548 . 0 0 "[ . 1]" 1
29 1 16 LEU MD1 1 17 ASP HA 6.520 . 6.520 5.604 3.848 6.348 . 0 0 "[ . 1]" 1
30 1 16 LEU MD2 1 17 ASP HA 6.520 . 6.520 5.369 2.865 6.134 . 0 0 "[ . 1]" 1
31 1 16 LEU H 1 17 ASP QB 6.220 . 6.220 4.578 3.809 5.704 . 0 0 "[ . 1]" 1
32 1 16 LEU HA 1 74 ASN HD22 5.500 . 5.500 4.629 3.796 5.324 . 0 0 "[ . 1]" 1
33 1 16 LEU QD 1 74 ASN H 7.540 . 7.540 4.522 3.480 6.062 . 0 0 "[ . 1]" 1
34 1 16 LEU QD 1 74 ASN HB2 7.540 . 7.540 4.939 3.963 6.023 . 0 0 "[ . 1]" 1
35 1 16 LEU QD 1 74 ASN HD21 7.540 . 7.540 3.937 2.412 5.890 . 0 0 "[ . 1]" 1
36 1 16 LEU MD1 1 74 ASN HB3 6.520 . 6.520 5.397 4.417 6.533 0.013 6 0 "[ . 1]" 1
37 1 16 LEU MD2 1 74 ASN HB3 6.520 . 6.520 5.240 3.443 6.564 0.044 5 0 "[ . 1]" 1
38 1 17 ASP QB 1 18 LYS QB 6.940 . 6.940 4.007 3.235 5.311 . 0 0 "[ . 1]" 1
39 1 17 ASP QB 1 18 LYS QG 6.940 . 6.940 3.925 2.619 5.258 . 0 0 "[ . 1]" 1
40 1 17 ASP HB3 1 18 LYS HA 5.500 . 5.500 4.657 4.144 5.908 0.408 3 0 "[ . 1]" 1
41 1 17 ASP HB2 1 18 LYS HA 5.500 . 5.500 4.937 4.166 5.659 0.159 5 0 "[ . 1]" 1
42 1 17 ASP H 1 18 LYS QB 6.220 . 6.220 4.787 4.098 5.964 . 0 0 "[ . 1]" 1
43 1 17 ASP QB 1 19 ALA H 6.220 . 6.220 3.898 2.652 4.900 . 0 0 "[ . 1]" 1
44 1 17 ASP HA 1 20 LEU H 5.500 . 5.500 4.175 3.301 5.138 . 0 0 "[ . 1]" 1
45 1 17 ASP HA 1 20 LEU QB 6.220 . 6.220 4.305 2.593 6.049 . 0 0 "[ . 1]" 1
46 1 17 ASP HA 1 20 LEU QD 7.540 . 7.540 2.769 1.819 4.493 . 0 0 "[ . 1]" 1
47 1 17 ASP QB 1 20 LEU QB 6.520 . 6.520 4.927 3.944 5.602 . 0 0 "[ . 1]" 1
48 1 17 ASP QB 1 20 LEU HG 6.220 . 6.220 4.701 2.385 5.840 . 0 0 "[ . 1]" 1
49 1 17 ASP QB 1 20 LEU QD 7.830 . 7.830 3.490 2.541 4.547 . 0 0 "[ . 1]" 1
50 1 17 ASP HB3 1 20 LEU H 5.500 . 5.500 5.130 3.857 5.644 0.144 8 0 "[ . 1]" 1
51 1 17 ASP HB2 1 20 LEU H 5.500 . 5.500 5.087 3.370 5.669 0.169 2 0 "[ . 1]" 1
52 1 18 LYS HB3 1 19 ALA H 5.500 . 5.500 3.308 2.080 4.367 . 0 0 "[ . 1]" 1
53 1 18 LYS HB2 1 19 ALA H 5.500 . 5.500 3.158 2.001 4.061 . 0 0 "[ . 1]" 1
54 1 19 ALA HA 1 20 LEU HG 5.500 . 5.500 5.288 4.841 5.559 0.059 9 0 "[ . 1]" 1
55 1 19 ALA MB 1 20 LEU H 6.520 . 6.520 2.835 2.443 3.061 . 0 0 "[ . 1]" 1
56 1 19 ALA MB 1 20 LEU QD 8.560 . 8.560 4.028 2.012 4.796 . 0 0 "[ . 1]" 1
57 1 19 ALA H 1 20 LEU HG 5.500 . 5.500 4.458 3.892 5.090 . 0 0 "[ . 1]" 1
58 1 19 ALA H 1 20 LEU HA 5.500 . 5.500 5.297 4.944 5.449 . 0 0 "[ . 1]" 1
59 1 19 ALA H 1 20 LEU QD 7.540 . 7.540 4.280 3.095 4.638 . 0 0 "[ . 1]" 1
60 1 19 ALA MB 1 21 SER H 6.520 . 6.520 4.551 4.313 4.663 . 0 0 "[ . 1]" 1
61 1 19 ALA H 1 22 ALA H 5.500 . 5.500 5.210 4.571 5.593 0.093 7 0 "[ . 1]" 1
62 1 19 ALA HA 1 23 LEU HG 5.500 . 5.500 4.864 4.509 5.723 0.223 5 0 "[ . 1]" 1
63 1 20 LEU QB 1 21 SER QB 6.940 . 6.940 4.806 3.857 5.281 . 0 0 "[ . 1]" 1
64 1 20 LEU HB3 1 21 SER H 5.500 . 5.500 3.896 3.735 4.093 . 0 0 "[ . 1]" 1
65 1 20 LEU HB2 1 21 SER H 5.500 . 5.500 3.728 2.579 4.087 . 0 0 "[ . 1]" 1
66 1 20 LEU QD 1 21 SER H 7.540 . 7.540 2.835 2.374 3.940 . 0 0 "[ . 1]" 1
67 1 20 LEU HG 1 21 SER HA 5.500 . 5.500 4.272 3.416 6.080 0.580 1 1 "[+ . 1]" 1
68 1 20 LEU H 1 21 SER HA 5.500 . 5.500 5.233 4.749 5.422 . 0 0 "[ . 1]" 1
69 1 20 LEU H 1 21 SER QB 6.220 . 6.220 4.582 4.040 4.810 . 0 0 "[ . 1]" 1
70 1 20 LEU HA 1 22 ALA H 5.500 . 5.500 4.186 4.108 4.231 . 0 0 "[ . 1]" 1
71 1 20 LEU HA 1 23 LEU H 5.500 . 5.500 4.507 4.377 4.652 . 0 0 "[ . 1]" 1
72 1 20 LEU HA 1 23 LEU MD1 6.520 . 6.520 2.856 2.238 3.283 . 0 0 "[ . 1]" 1
73 1 20 LEU HA 1 23 LEU MD2 6.520 . 6.520 2.957 1.831 3.565 . 0 0 "[ . 1]" 1
74 1 20 LEU HA 1 23 LEU HB2 5.500 . 5.500 5.164 4.677 5.499 . 0 0 "[ . 1]" 1
75 1 20 LEU HA 1 23 LEU HB3 5.500 . 5.500 5.517 5.381 5.924 0.424 5 0 "[ . 1]" 1
76 1 20 LEU HA 1 23 LEU HG 5.500 . 5.500 2.894 2.418 4.285 . 0 0 "[ . 1]" 1
77 1 20 LEU H 1 23 LEU QD 7.540 . 7.540 3.999 3.403 4.317 . 0 0 "[ . 1]" 1
78 1 20 LEU QD 1 60 TYR QE 9.670 . 9.670 4.671 2.942 6.426 . 0 0 "[ . 1]" 1
79 1 20 LEU QD 1 71 VAL H 7.540 . 7.540 5.937 4.842 7.039 . 0 0 "[ . 1]" 1
80 1 20 LEU QD 1 71 VAL HA 7.540 . 7.540 4.560 3.537 5.539 . 0 0 "[ . 1]" 1
81 1 20 LEU HA 1 74 ASN HD22 5.500 . 5.500 4.747 3.143 5.566 0.066 7 0 "[ . 1]" 1
82 1 20 LEU QD 1 74 ASN HD21 7.540 . 7.540 3.753 2.913 4.705 . 0 0 "[ . 1]" 1
83 1 20 LEU QD 1 74 ASN HD22 7.540 . 7.540 2.987 1.924 4.417 . 0 0 "[ . 1]" 1
84 1 20 LEU MD1 1 74 ASN HB3 6.520 . 6.520 4.606 3.636 5.238 . 0 0 "[ . 1]" 1
85 1 20 LEU MD1 1 74 ASN HB2 6.520 . 6.520 4.960 3.860 6.041 . 0 0 "[ . 1]" 1
86 1 20 LEU MD2 1 74 ASN HB3 6.520 . 6.520 4.312 3.153 6.159 . 0 0 "[ . 1]" 1
87 1 20 LEU MD2 1 74 ASN HB2 6.520 . 6.520 4.803 3.925 5.803 . 0 0 "[ . 1]" 1
88 1 21 SER HA 1 22 ALA MB 6.520 . 6.520 4.431 4.341 4.514 . 0 0 "[ . 1]" 1
89 1 21 SER QB 1 22 ALA HA 6.220 . 6.220 4.667 4.347 4.828 . 0 0 "[ . 1]" 1
90 1 21 SER QB 1 22 ALA MB 7.240 . 7.240 3.402 3.009 3.721 . 0 0 "[ . 1]" 1
91 1 21 SER H 1 22 ALA HA 5.500 . 5.500 5.280 5.214 5.345 . 0 0 "[ . 1]" 1
92 1 21 SER HA 1 23 LEU H 5.500 . 5.500 5.456 5.384 5.558 0.058 7 0 "[ . 1]" 1
93 1 21 SER H 1 23 LEU MD2 6.520 . 6.520 5.335 3.851 6.306 . 0 0 "[ . 1]" 1
94 1 21 SER H 1 23 LEU H 5.500 . 5.500 5.429 5.390 5.489 . 0 0 "[ . 1]" 1
95 1 21 SER H 1 23 LEU MD1 6.520 . 6.520 5.271 4.127 5.872 . 0 0 "[ . 1]" 1
96 1 22 ALA HA 1 23 LEU MD1 6.520 . 6.520 4.770 3.558 5.669 . 0 0 "[ . 1]" 1
97 1 22 ALA HA 1 23 LEU MD2 6.520 . 6.520 5.368 3.442 5.965 . 0 0 "[ . 1]" 1
98 1 22 ALA HA 1 23 LEU HG 5.500 . 5.500 4.886 4.132 5.818 0.318 5 0 "[ . 1]" 1
99 1 22 ALA HA 1 23 LEU QB 6.220 . 6.220 4.358 4.161 4.500 . 0 0 "[ . 1]" 1
100 1 22 ALA MB 1 23 LEU H 6.520 . 6.520 3.692 3.648 3.719 . 0 0 "[ . 1]" 1
101 1 22 ALA H 1 23 LEU QD 7.540 . 7.540 3.905 3.017 4.462 . 0 0 "[ . 1]" 1
102 1 23 LEU QB 1 24 PRO QD 6.530 . 6.530 2.444 2.186 2.762 . 0 0 "[ . 1]" 1
103 1 23 LEU MD1 1 24 PRO HD3 6.520 . 6.520 4.933 2.756 5.471 . 0 0 "[ . 1]" 1
104 1 23 LEU MD1 1 24 PRO HD2 6.520 . 6.520 4.145 2.189 4.755 . 0 0 "[ . 1]" 1
105 1 23 LEU MD2 1 24 PRO HD3 6.520 . 6.520 3.676 2.732 4.803 . 0 0 "[ . 1]" 1
106 1 23 LEU MD2 1 24 PRO HD2 6.520 . 6.520 2.879 1.983 4.042 . 0 0 "[ . 1]" 1
107 1 23 LEU HG 1 24 PRO HD2 5.500 . 5.500 4.136 3.524 4.577 . 0 0 "[ . 1]" 1
108 1 23 LEU HG 1 24 PRO HD3 5.500 . 5.500 4.699 4.047 5.351 . 0 0 "[ . 1]" 1
109 1 23 LEU QD 1 67 ILE HA 7.540 . 7.540 2.610 1.998 3.030 . 0 0 "[ . 1]" 1
110 1 23 LEU QD 1 67 ILE HB 7.540 . 7.540 4.619 4.040 5.061 . 0 0 "[ . 1]" 1
111 1 23 LEU QD 1 70 SER HB2 7.540 . 7.540 2.655 2.339 3.598 . 0 0 "[ . 1]" 1
112 1 23 LEU QD 1 70 SER HB3 7.540 . 7.540 2.528 1.982 3.629 . 0 0 "[ . 1]" 1
113 1 23 LEU HG 1 70 SER HB2 5.500 . 5.500 5.160 4.421 5.676 0.176 4 0 "[ . 1]" 1
114 1 23 LEU QD 1 71 VAL H 7.540 . 7.540 4.459 4.064 5.561 . 0 0 "[ . 1]" 1
115 1 23 LEU QD 1 71 VAL HA 7.540 . 7.540 5.274 4.402 6.814 . 0 0 "[ . 1]" 1
116 1 24 PRO HD3 1 67 ILE MD 6.520 . 6.520 6.065 5.111 6.432 . 0 0 "[ . 1]" 1
117 1 24 PRO HD2 1 67 ILE MD 6.520 . 6.520 5.122 3.656 5.694 . 0 0 "[ . 1]" 1
118 1 26 GLU QB 1 28 GLY QA 7.100 . 7.100 5.097 4.223 5.572 . 0 0 "[ . 1]" 1
119 1 26 GLU HB3 1 29 GLY H 5.500 . 5.500 5.241 4.535 5.846 0.346 3 0 "[ . 1]" 1
120 1 26 GLU HB2 1 29 GLY H 5.500 . 5.500 5.369 5.075 5.640 0.140 4 0 "[ . 1]" 1
121 1 27 PRO HD3 1 29 GLY H 6.500 . 6.500 5.973 4.641 6.274 . 0 0 "[ . 1]" 1
122 1 27 PRO HD2 1 29 GLY H 5.500 . 5.500 5.406 3.052 5.808 0.308 5 0 "[ . 1]" 1
123 1 28 GLY H 1 29 GLY H 5.500 . 5.500 2.674 2.041 2.822 . 0 0 "[ . 1]" 1
124 1 28 GLY QA 1 66 GLN QE 7.080 . 7.080 3.430 2.535 4.301 . 0 0 "[ . 1]" 1
125 1 29 GLY H 1 30 VAL H 5.500 . 5.500 4.549 4.477 4.676 . 0 0 "[ . 1]" 1
126 1 29 GLY HA3 1 65 VAL H 5.500 . 5.500 5.395 4.252 5.578 0.078 9 0 "[ . 1]" 1
127 1 29 GLY HA2 1 65 VAL H 5.500 . 5.500 5.069 4.681 5.354 . 0 0 "[ . 1]" 1
128 1 29 GLY QA 1 66 GLN H 6.220 . 6.220 3.110 2.531 3.434 . 0 0 "[ . 1]" 1
129 1 29 GLY QA 1 66 GLN HB3 6.220 . 6.220 3.236 3.160 3.327 . 0 0 "[ . 1]" 1
130 1 29 GLY QA 1 66 GLN HG2 6.220 . 6.220 3.717 3.231 4.304 . 0 0 "[ . 1]" 1
131 1 29 GLY QA 1 66 GLN QE 6.500 . 6.500 2.835 2.154 3.464 . 0 0 "[ . 1]" 1
132 1 29 GLY H 1 66 GLN HB2 5.500 . 5.500 4.338 3.297 4.682 . 0 0 "[ . 1]" 1
133 1 29 GLY H 1 66 GLN HB3 5.500 . 5.500 5.379 4.022 5.623 0.123 5 0 "[ . 1]" 1
134 1 29 GLY H 1 66 GLN QE 6.200 . 6.200 3.725 2.027 4.924 . 0 0 "[ . 1]" 1
135 1 30 VAL H 1 31 PRO QD 6.240 . 6.240 4.182 3.714 4.347 . 0 0 "[ . 1]" 1
136 1 30 VAL HB 1 32 LEU QD 7.540 . 7.540 4.109 3.080 5.877 . 0 0 "[ . 1]" 1
137 1 30 VAL H 1 32 LEU QD 7.540 . 7.540 5.055 4.253 5.600 . 0 0 "[ . 1]" 1
138 1 30 VAL H 1 64 THR HA 5.500 . 5.500 5.285 4.931 5.532 0.032 10 0 "[ . 1]" 1
139 1 30 VAL H 1 64 THR HB 5.500 . 5.500 4.194 3.457 5.446 . 0 0 "[ . 1]" 1
140 1 30 VAL H 1 65 VAL H 5.500 . 5.500 3.441 3.217 3.799 . 0 0 "[ . 1]" 1
141 1 30 VAL H 1 66 GLN HE22 5.500 . 5.500 5.348 5.111 5.636 0.136 5 0 "[ . 1]" 1
142 1 30 VAL H 1 66 GLN HE21 5.500 . 5.500 5.181 4.170 5.627 0.127 9 0 "[ . 1]" 1
143 1 30 VAL H 1 66 GLN H 5.500 . 5.500 3.095 2.597 3.454 . 0 0 "[ . 1]" 1
144 1 30 VAL H 1 66 GLN HB2 5.500 . 5.500 3.423 2.809 4.022 . 0 0 "[ . 1]" 1
145 1 31 PRO HD3 1 32 LEU H 5.500 . 5.500 5.561 5.498 5.581 0.081 4 0 "[ . 1]" 1
146 1 31 PRO HD2 1 32 LEU H 5.500 . 5.500 5.600 5.560 5.630 0.130 5 0 "[ . 1]" 1
147 1 31 PRO HA 1 64 THR MG 6.520 . 6.520 2.102 1.979 2.158 . 0 0 "[ . 1]" 1
148 1 31 PRO HB3 1 64 THR MG 6.520 . 6.520 2.593 2.394 3.101 . 0 0 "[ . 1]" 1
149 1 31 PRO HB3 1 65 VAL H 5.500 . 5.500 5.663 5.545 5.773 0.273 4 0 "[ . 1]" 1
150 1 31 PRO HA 1 66 GLN H 5.500 . 5.500 5.141 5.017 5.380 . 0 0 "[ . 1]" 1
151 1 32 LEU HA 1 33 HIS QB 6.220 . 6.220 4.174 3.980 4.336 . 0 0 "[ . 1]" 1
152 1 32 LEU HB3 1 33 HIS H 5.500 . 5.500 3.455 3.068 3.804 . 0 0 "[ . 1]" 1
153 1 32 LEU HB2 1 33 HIS H 5.500 . 5.500 4.375 4.171 4.571 . 0 0 "[ . 1]" 1
154 1 32 LEU MD1 1 33 HIS H 6.520 . 6.520 4.218 2.743 5.291 . 0 0 "[ . 1]" 1
155 1 32 LEU MD2 1 33 HIS H 6.520 . 6.520 3.588 3.040 4.079 . 0 0 "[ . 1]" 1
156 1 32 LEU H 1 33 HIS H 5.500 . 5.500 4.431 4.399 4.510 . 0 0 "[ . 1]" 1
157 1 32 LEU HA 1 34 SER H 5.500 . 5.500 3.847 3.746 3.969 . 0 0 "[ . 1]" 1
158 1 32 LEU HB3 1 34 SER H 5.500 . 5.500 3.017 2.812 3.293 . 0 0 "[ . 1]" 1
159 1 32 LEU HB2 1 34 SER H 5.500 . 5.500 4.481 4.134 4.881 . 0 0 "[ . 1]" 1
160 1 32 LEU QD 1 34 SER QB 7.830 . 7.830 3.739 2.800 4.469 . 0 0 "[ . 1]" 1
161 1 32 LEU MD1 1 34 SER H 6.520 . 6.520 4.121 2.297 5.134 . 0 0 "[ . 1]" 1
162 1 32 LEU MD2 1 34 SER H 6.520 . 6.520 4.255 3.552 5.214 . 0 0 "[ . 1]" 1
163 1 32 LEU HG 1 34 SER H 5.500 . 5.500 5.418 4.899 5.679 0.179 9 0 "[ . 1]" 1
164 1 32 LEU H 1 34 SER H 5.500 . 5.500 5.517 5.417 5.599 0.099 1 0 "[ . 1]" 1
165 1 32 LEU H 1 63 GLN HB3 5.500 . 5.500 4.819 4.681 4.887 . 0 0 "[ . 1]" 1
166 1 32 LEU H 1 63 GLN HA 5.500 . 5.500 4.160 4.063 4.281 . 0 0 "[ . 1]" 1
167 1 32 LEU H 1 63 GLN HG3 5.500 . 5.500 3.386 3.327 3.437 . 0 0 "[ . 1]" 1
168 1 32 LEU H 1 63 GLN HG2 5.500 . 5.500 4.710 4.590 4.806 . 0 0 "[ . 1]" 1
169 1 32 LEU H 1 63 GLN HB2 5.500 . 5.500 5.698 5.660 5.721 0.221 4 0 "[ . 1]" 1
170 1 32 LEU QD 1 64 THR HA 7.540 . 7.540 2.801 2.146 3.415 . 0 0 "[ . 1]" 1
171 1 32 LEU MD1 1 64 THR H 6.520 . 6.520 4.781 3.353 6.549 0.029 3 0 "[ . 1]" 1
172 1 32 LEU MD2 1 64 THR H 6.520 . 6.520 5.529 4.356 6.458 . 0 0 "[ . 1]" 1
173 1 32 LEU H 1 64 THR H 5.500 . 5.500 4.176 4.140 4.234 . 0 0 "[ . 1]" 1
174 1 32 LEU H 1 64 THR HA 5.500 . 5.500 1.962 1.930 2.022 . 0 0 "[ . 1]" 1
175 1 32 LEU H 1 64 THR MG 6.520 . 6.520 2.735 2.557 3.588 . 0 0 "[ . 1]" 1
176 1 32 LEU HB3 1 65 VAL H 5.500 . 5.500 5.640 5.547 5.753 0.253 4 0 "[ . 1]" 1
177 1 32 LEU HB2 1 65 VAL H 5.500 . 5.500 4.324 3.801 4.710 . 0 0 "[ . 1]" 1
178 1 32 LEU QD 1 65 VAL HA 7.540 . 7.540 2.793 2.254 3.724 . 0 0 "[ . 1]" 1
179 1 32 LEU QD 1 65 VAL HB 7.540 . 7.540 3.443 2.625 4.263 . 0 0 "[ . 1]" 1
180 1 32 LEU MD1 1 65 VAL H 6.520 . 6.520 3.815 2.531 5.609 . 0 0 "[ . 1]" 1
181 1 32 LEU MD2 1 65 VAL H 6.520 . 6.520 3.524 2.063 4.567 . 0 0 "[ . 1]" 1
182 1 32 LEU HG 1 65 VAL H 5.500 . 5.500 3.585 2.724 4.890 . 0 0 "[ . 1]" 1
183 1 32 LEU H 1 65 VAL H 5.500 . 5.500 3.974 3.750 4.090 . 0 0 "[ . 1]" 1
184 1 32 LEU QD 1 66 GLN H 7.540 . 7.540 4.683 4.342 5.240 . 0 0 "[ . 1]" 1
185 1 32 LEU QD 1 68 PHE H 7.540 . 7.540 5.054 4.437 6.396 . 0 0 "[ . 1]" 1
186 1 32 LEU QD 1 68 PHE QB 8.260 . 8.260 4.340 3.647 5.526 . 0 0 "[ . 1]" 1
187 1 32 LEU QD 1 130 ILE MD 8.560 . 8.560 2.083 1.754 2.795 . 0 0 "[ . 1]" 1
188 1 32 LEU HG 1 130 ILE MD 6.520 . 6.520 3.369 2.351 4.088 . 0 0 "[ . 1]" 1
189 1 33 HIS HB3 1 34 SER H 5.500 . 5.500 3.476 2.734 4.184 . 0 0 "[ . 1]" 1
190 1 33 HIS HB2 1 34 SER H 5.500 . 5.500 3.546 2.711 4.144 . 0 0 "[ . 1]" 1
191 1 33 HIS H 1 34 SER H 5.500 . 5.500 2.604 2.454 2.716 . 0 0 "[ . 1]" 1
192 1 33 HIS H 1 36 TRP HE1 5.500 . 5.500 5.531 5.196 5.796 0.296 6 0 "[ . 1]" 1
193 1 33 HIS HA 1 63 GLN HE21 5.500 . 5.500 5.459 5.322 5.603 0.103 3 0 "[ . 1]" 1
194 1 33 HIS HA 1 63 GLN HE22 5.500 . 5.500 5.657 5.572 5.707 0.207 1 0 "[ . 1]" 1
195 1 33 HIS H 1 63 GLN HA 6.500 . 6.500 6.575 6.495 6.656 0.156 4 0 "[ . 1]" 1
196 1 33 HIS H 1 130 ILE MD 6.520 . 6.520 6.608 6.429 6.770 0.250 5 0 "[ . 1]" 1
197 1 34 SER QB 1 36 TRP HE1 6.220 . 6.220 4.167 3.694 5.166 . 0 0 "[ . 1]" 1
198 1 34 SER H 1 36 TRP HE1 5.500 . 5.500 4.422 3.926 4.717 . 0 0 "[ . 1]" 1
199 1 36 TRP HB3 1 37 THR H 5.500 . 5.500 3.279 3.086 3.609 . 0 0 "[ . 1]" 1
200 1 36 TRP HB2 1 37 THR H 5.500 . 5.500 3.684 3.006 4.163 . 0 0 "[ . 1]" 1
201 1 36 TRP H 1 37 THR H 5.500 . 5.500 4.521 4.201 4.594 . 0 0 "[ . 1]" 1
202 1 36 TRP QB 1 61 THR MG 7.240 . 7.240 5.161 4.883 5.596 . 0 0 "[ . 1]" 1
203 1 36 TRP H 1 61 THR HB 5.500 . 5.500 4.428 3.824 4.755 . 0 0 "[ . 1]" 1
204 1 36 TRP H 1 61 THR MG 6.520 . 6.520 4.780 4.488 5.109 . 0 0 "[ . 1]" 1
205 1 36 TRP H 1 62 VAL H 6.500 . 6.500 3.077 2.797 3.246 . 0 0 "[ . 1]" 1
206 1 36 TRP H 1 62 VAL HA 6.500 . 6.500 5.046 4.736 5.514 . 0 0 "[ . 1]" 1
207 1 36 TRP HE1 1 65 VAL HA 5.500 . 5.500 5.663 5.595 5.712 0.212 2 0 "[ . 1]" 1
208 1 36 TRP QB 1 68 PHE QB 6.940 . 6.940 5.605 5.189 6.461 . 0 0 "[ . 1]" 1
209 1 36 TRP QB 1 68 PHE QD 8.350 . 8.350 5.165 3.768 6.380 . 0 0 "[ . 1]" 1
210 1 36 TRP HB3 1 89 LEU MD1 6.520 . 6.520 3.842 2.992 6.014 . 0 0 "[ . 1]" 1
211 1 36 TRP HB3 1 89 LEU MD2 6.520 . 6.520 3.740 3.041 4.299 . 0 0 "[ . 1]" 1
212 1 36 TRP HB2 1 89 LEU MD2 6.520 . 6.520 4.554 3.314 5.391 . 0 0 "[ . 1]" 1
213 1 36 TRP HB2 1 89 LEU MD1 6.520 . 6.520 4.138 3.101 6.434 . 0 0 "[ . 1]" 1
214 1 36 TRP H 1 89 LEU QD 7.540 . 7.540 5.782 5.289 6.121 . 0 0 "[ . 1]" 1
215 1 36 TRP HA 1 92 GLY H 5.500 . 5.500 3.767 3.280 4.158 . 0 0 "[ . 1]" 1
216 1 36 TRP HB3 1 92 GLY H 6.500 . 6.500 5.824 5.105 6.501 0.001 2 0 "[ . 1]" 1
217 1 36 TRP HB2 1 92 GLY H 6.500 . 6.500 6.554 5.758 6.743 0.243 1 0 "[ . 1]" 1
218 1 36 TRP HE1 1 130 ILE MD 6.520 . 6.520 3.126 2.245 3.659 . 0 0 "[ . 1]" 1
219 1 36 TRP H 1 130 ILE MD 6.520 . 6.520 6.129 5.144 6.659 0.139 2 0 "[ . 1]" 1
220 1 37 THR HB 1 38 PHE HA 5.500 . 5.500 4.918 4.699 4.980 . 0 0 "[ . 1]" 1
221 1 37 THR MG 1 38 PHE H 6.520 . 6.520 2.538 2.148 2.680 . 0 0 "[ . 1]" 1
222 1 37 THR MG 1 38 PHE HB2 6.520 . 6.520 4.359 3.960 4.836 . 0 0 "[ . 1]" 1
223 1 37 THR MG 1 38 PHE HB3 6.520 . 6.520 4.865 4.410 5.121 . 0 0 "[ . 1]" 1
224 1 37 THR HA 1 39 TRP HE1 5.500 . 5.500 4.805 4.401 5.153 . 0 0 "[ . 1]" 1
225 1 37 THR HB 1 39 TRP HE1 5.500 . 5.500 2.429 2.033 2.796 . 0 0 "[ . 1]" 1
226 1 37 THR MG 1 39 TRP HH2 6.520 . 6.520 5.294 4.702 5.762 . 0 0 "[ . 1]" 1
227 1 37 THR MG 1 39 TRP HE1 6.520 . 6.520 1.951 1.883 2.008 . 0 0 "[ . 1]" 1
228 1 37 THR MG 1 39 TRP HD1 6.520 . 6.520 2.744 2.403 3.125 . 0 0 "[ . 1]" 1
229 1 37 THR MG 1 39 TRP HZ2 6.520 . 6.520 3.411 2.855 3.935 . 0 0 "[ . 1]" 1
230 1 37 THR H 1 39 TRP HE1 5.500 . 5.500 4.847 4.564 5.197 . 0 0 "[ . 1]" 1
231 1 37 THR MG 1 58 LYS QD 7.400 . 7.400 3.535 1.793 4.737 . 0 0 "[ . 1]" 1
232 1 37 THR MG 1 58 LYS HA 6.520 . 6.520 3.443 3.157 3.753 . 0 0 "[ . 1]" 1
233 1 37 THR MG 1 58 LYS QG 7.240 . 7.240 3.012 2.345 4.424 . 0 0 "[ . 1]" 1
234 1 37 THR MG 1 59 ILE H 6.520 . 6.520 4.169 3.566 4.590 . 0 0 "[ . 1]" 1
235 1 37 THR MG 1 60 TYR H 6.520 . 6.520 3.691 2.571 4.222 . 0 0 "[ . 1]" 1
236 1 37 THR HA 1 61 THR H 5.500 . 5.500 4.807 4.599 4.912 . 0 0 "[ . 1]" 1
237 1 37 THR HA 1 61 THR MG 6.520 . 6.520 2.443 2.068 2.966 . 0 0 "[ . 1]" 1
238 1 37 THR MG 1 61 THR H 6.520 . 6.520 4.754 4.157 5.195 . 0 0 "[ . 1]" 1
239 1 37 THR MG 1 61 THR HA 6.520 . 6.520 3.552 3.212 3.815 . 0 0 "[ . 1]" 1
240 1 37 THR MG 1 61 THR MG 7.540 . 7.540 2.148 1.846 2.403 . 0 0 "[ . 1]" 1
241 1 37 THR H 1 61 THR MG 6.520 . 6.520 4.390 4.161 4.743 . 0 0 "[ . 1]" 1
242 1 37 THR HA 1 62 VAL H 5.500 . 5.500 3.607 3.287 3.825 . 0 0 "[ . 1]" 1
243 1 37 THR MG 1 62 VAL H 6.520 . 6.520 5.226 4.936 5.465 . 0 0 "[ . 1]" 1
244 1 37 THR MG 1 89 LEU QD 8.560 . 8.560 5.183 4.589 5.799 . 0 0 "[ . 1]" 1
245 1 37 THR H 1 89 LEU HG 5.500 . 5.500 4.465 3.821 5.504 0.004 1 0 "[ . 1]" 1
246 1 37 THR H 1 89 LEU QD 7.540 . 7.540 4.080 3.554 4.860 . 0 0 "[ . 1]" 1
247 1 37 THR HB 1 90 MET HA 5.500 . 5.500 5.379 5.001 5.573 0.073 6 0 "[ . 1]" 1
248 1 37 THR MG 1 90 MET H 6.520 . 6.520 4.348 4.005 4.523 . 0 0 "[ . 1]" 1
249 1 37 THR H 1 90 MET H 5.500 . 5.500 3.667 3.360 4.064 . 0 0 "[ . 1]" 1
250 1 37 THR H 1 91 ARG HA 5.500 . 5.500 2.581 2.201 2.939 . 0 0 "[ . 1]" 1
251 1 37 THR H 1 92 GLY H 5.500 . 5.500 3.855 3.534 4.594 . 0 0 "[ . 1]" 1
252 1 37 THR MG 1 93 GLU QG 7.400 . 7.400 6.332 4.505 7.462 0.062 5 0 "[ . 1]" 1
253 1 38 PHE H 1 39 TRP H 5.500 . 5.500 4.497 4.456 4.550 . 0 0 "[ . 1]" 1
254 1 38 PHE HA 1 59 ILE MD 6.520 . 6.520 5.322 3.687 6.567 0.047 2 0 "[ . 1]" 1
255 1 38 PHE QB 1 59 ILE H 6.220 . 6.220 3.345 2.942 3.817 . 0 0 "[ . 1]" 1
256 1 38 PHE HB3 1 59 ILE MD 6.520 . 6.520 3.634 1.859 4.945 . 0 0 "[ . 1]" 1
257 1 38 PHE HB2 1 59 ILE MD 6.520 . 6.520 4.668 2.802 6.350 . 0 0 "[ . 1]" 1
258 1 38 PHE H 1 59 ILE MD 6.520 . 6.520 5.668 4.234 6.529 0.009 4 0 "[ . 1]" 1
259 1 38 PHE H 1 59 ILE HB 5.500 . 5.500 4.019 3.312 4.391 . 0 0 "[ . 1]" 1
260 1 38 PHE HA 1 60 TYR H 5.500 . 5.500 4.839 4.693 5.009 . 0 0 "[ . 1]" 1
261 1 38 PHE QB 1 60 TYR H 6.220 . 6.220 2.464 2.081 3.097 . 0 0 "[ . 1]" 1
262 1 38 PHE H 1 60 TYR H 5.500 . 5.500 2.824 2.684 2.959 . 0 0 "[ . 1]" 1
263 1 38 PHE H 1 61 THR HA 5.500 . 5.500 3.370 3.072 3.742 . 0 0 "[ . 1]" 1
264 1 38 PHE H 1 61 THR MG 6.520 . 6.520 3.672 3.228 4.235 . 0 0 "[ . 1]" 1
265 1 38 PHE H 1 62 VAL H 5.500 . 5.500 4.847 4.577 5.179 . 0 0 "[ . 1]" 1
266 1 38 PHE QB 1 75 ILE MD 7.240 . 7.240 4.288 4.000 4.694 . 0 0 "[ . 1]" 1
267 1 38 PHE HA 1 88 HIS H 5.500 . 5.500 5.249 5.131 5.388 . 0 0 "[ . 1]" 1
268 1 38 PHE HA 1 89 LEU QD 7.540 . 7.540 2.946 2.051 4.124 . 0 0 "[ . 1]" 1
269 1 38 PHE QB 1 89 LEU QD 8.260 . 8.260 3.820 2.965 4.810 . 0 0 "[ . 1]" 1
270 1 38 PHE H 1 89 LEU QD 7.540 . 7.540 4.616 3.911 5.477 . 0 0 "[ . 1]" 1
271 1 38 PHE QB 1 90 MET H 6.220 . 6.220 5.373 5.076 5.548 . 0 0 "[ . 1]" 1
272 1 39 TRP HD1 1 40 LEU H 5.500 . 5.500 5.609 5.494 5.746 0.246 2 0 "[ . 1]" 1
273 1 39 TRP HE3 1 40 LEU H 5.500 . 5.500 3.878 3.519 4.189 . 0 0 "[ . 1]" 1
274 1 39 TRP H 1 40 LEU H 5.500 . 5.500 4.522 4.494 4.543 . 0 0 "[ . 1]" 1
275 1 39 TRP QB 1 56 LEU QD 7.510 . 7.510 3.613 2.891 4.423 . 0 0 "[ . 1]" 1
276 1 39 TRP HD1 1 56 LEU QD 7.540 . 7.540 6.349 5.932 6.795 . 0 0 "[ . 1]" 1
277 1 39 TRP HE3 1 56 LEU MD2 6.520 . 6.520 3.381 2.652 4.111 . 0 0 "[ . 1]" 1
278 1 39 TRP HE3 1 56 LEU HB2 5.500 . 5.500 3.337 1.977 4.554 . 0 0 "[ . 1]" 1
279 1 39 TRP HE3 1 56 LEU HG 5.500 . 5.500 5.173 4.933 5.480 . 0 0 "[ . 1]" 1
280 1 39 TRP HE3 1 56 LEU MD1 6.520 . 6.520 3.659 3.148 4.248 . 0 0 "[ . 1]" 1
281 1 39 TRP HE3 1 56 LEU HA 5.500 . 5.500 3.883 3.701 4.116 . 0 0 "[ . 1]" 1
282 1 39 TRP HE3 1 56 LEU HB3 5.500 . 5.500 2.689 2.089 3.907 . 0 0 "[ . 1]" 1
283 1 39 TRP HZ3 1 56 LEU MD1 6.520 . 6.520 3.402 2.016 4.261 . 0 0 "[ . 1]" 1
284 1 39 TRP HZ3 1 56 LEU HG 5.500 . 5.500 5.399 4.864 5.603 0.103 10 0 "[ . 1]" 1
285 1 39 TRP HZ3 1 56 LEU MD2 6.520 . 6.520 4.260 3.088 5.066 . 0 0 "[ . 1]" 1
286 1 39 TRP HZ3 1 56 LEU QB 6.220 . 6.220 2.765 2.479 3.434 . 0 0 "[ . 1]" 1
287 1 39 TRP HA 1 57 LYS HB2 5.500 . 5.500 5.335 4.876 5.819 0.319 4 0 "[ . 1]" 1
288 1 39 TRP QB 1 57 LYS H 6.220 . 6.220 4.121 3.692 4.831 . 0 0 "[ . 1]" 1
289 1 39 TRP HE3 1 57 LYS H 5.500 . 5.500 3.613 2.976 3.921 . 0 0 "[ . 1]" 1
290 1 39 TRP QB 1 58 LYS QD 7.100 . 7.100 5.825 5.296 6.162 . 0 0 "[ . 1]" 1
291 1 39 TRP HE1 1 58 LYS QD 6.380 . 6.380 4.614 2.580 5.938 . 0 0 "[ . 1]" 1
292 1 39 TRP HE1 1 58 LYS HB2 5.500 . 5.500 5.460 4.805 5.710 0.210 6 0 "[ . 1]" 1
293 1 39 TRP HE1 1 58 LYS HB3 5.500 . 5.500 4.426 3.811 4.835 . 0 0 "[ . 1]" 1
294 1 39 TRP HE3 1 58 LYS QD 6.380 . 6.380 5.089 4.314 5.387 . 0 0 "[ . 1]" 1
295 1 39 TRP HE3 1 58 LYS H 5.500 . 5.500 5.096 4.232 5.576 0.076 6 0 "[ . 1]" 1
296 1 39 TRP HE3 1 58 LYS HA 5.500 . 5.500 4.458 3.743 4.730 . 0 0 "[ . 1]" 1
297 1 39 TRP HE3 1 58 LYS QE 6.220 . 6.220 5.431 4.320 6.389 0.169 10 0 "[ . 1]" 1
298 1 39 TRP HH2 1 58 LYS HE2 5.500 . 5.500 3.975 2.759 5.477 . 0 0 "[ . 1]" 1
299 1 39 TRP HH2 1 58 LYS HE3 5.500 . 5.500 3.911 2.183 5.481 . 0 0 "[ . 1]" 1
300 1 39 TRP HH2 1 58 LYS QD 6.380 . 6.380 3.862 2.751 4.343 . 0 0 "[ . 1]" 1
301 1 39 TRP HH2 1 58 LYS QB 6.220 . 6.220 5.120 3.295 5.823 . 0 0 "[ . 1]" 1
302 1 39 TRP HZ2 1 58 LYS QB 6.220 . 6.220 4.398 3.280 4.954 . 0 0 "[ . 1]" 1
303 1 39 TRP HZ2 1 58 LYS QG 6.220 . 6.220 3.662 2.696 5.646 . 0 0 "[ . 1]" 1
304 1 39 TRP HZ3 1 58 LYS QD 6.380 . 6.380 4.524 2.958 5.151 . 0 0 "[ . 1]" 1
305 1 39 TRP HA 1 59 ILE MD 6.520 . 6.520 3.742 2.177 4.494 . 0 0 "[ . 1]" 1
306 1 39 TRP HA 1 59 ILE HB 5.500 . 5.500 4.474 3.965 5.101 . 0 0 "[ . 1]" 1
307 1 39 TRP HA 1 59 ILE H 5.500 . 5.500 2.656 2.416 2.906 . 0 0 "[ . 1]" 1
308 1 39 TRP HE3 1 59 ILE MD 6.520 . 6.520 6.393 5.428 6.739 0.219 4 0 "[ . 1]" 1
309 1 39 TRP H 1 59 ILE MD 6.520 . 6.520 4.628 2.992 5.937 . 0 0 "[ . 1]" 1
310 1 39 TRP H 1 59 ILE HB 5.500 . 5.500 4.821 4.502 5.127 . 0 0 "[ . 1]" 1
311 1 39 TRP H 1 59 ILE H 5.500 . 5.500 4.407 4.271 4.717 . 0 0 "[ . 1]" 1
312 1 39 TRP HA 1 60 TYR H 5.500 . 5.500 4.985 4.827 5.209 . 0 0 "[ . 1]" 1
313 1 39 TRP H 1 60 TYR H 5.500 . 5.500 5.597 5.469 5.742 0.242 3 0 "[ . 1]" 1
314 1 39 TRP H 1 88 HIS H 5.500 . 5.500 3.406 3.284 3.564 . 0 0 "[ . 1]" 1
315 1 39 TRP H 1 89 LEU HG 5.500 . 5.500 5.237 3.731 5.591 0.091 4 0 "[ . 1]" 1
316 1 39 TRP H 1 89 LEU MD2 6.520 . 6.520 5.980 5.191 6.439 . 0 0 "[ . 1]" 1
317 1 39 TRP H 1 89 LEU MD1 6.520 . 6.520 4.291 3.522 5.750 . 0 0 "[ . 1]" 1
318 1 39 TRP QB 1 90 MET H 6.220 . 6.220 4.240 4.010 4.526 . 0 0 "[ . 1]" 1
319 1 39 TRP HD1 1 90 MET H 5.500 . 5.500 2.833 2.597 3.039 . 0 0 "[ . 1]" 1
320 1 39 TRP HD1 1 90 MET QB 6.380 . 6.380 2.959 2.313 3.436 . 0 0 "[ . 1]" 1
321 1 39 TRP HD1 1 90 MET ME 6.520 . 6.520 5.857 5.187 6.493 . 0 0 "[ . 1]" 1
322 1 39 TRP HE1 1 90 MET QB 6.380 . 6.380 2.949 2.545 3.373 . 0 0 "[ . 1]" 1
323 1 39 TRP HE1 1 90 MET H 5.500 . 5.500 4.292 3.997 4.854 . 0 0 "[ . 1]" 1
324 1 39 TRP HE1 1 90 MET ME 6.520 . 6.520 5.697 5.229 6.381 . 0 0 "[ . 1]" 1
325 1 39 TRP H 1 90 MET H 5.500 . 5.500 3.911 3.609 4.086 . 0 0 "[ . 1]" 1
326 1 39 TRP HE1 1 91 ARG H 6.500 . 6.500 6.630 6.558 6.685 0.185 4 0 "[ . 1]" 1
327 1 40 LEU HB3 1 41 ASP H 5.500 . 5.500 4.211 4.105 4.401 . 0 0 "[ . 1]" 1
328 1 40 LEU HB2 1 41 ASP H 5.500 . 5.500 4.127 3.908 4.212 . 0 0 "[ . 1]" 1
329 1 40 LEU QD 1 41 ASP HA 7.540 . 7.540 3.907 2.908 4.455 . 0 0 "[ . 1]" 1
330 1 40 LEU MD1 1 41 ASP H 6.520 . 6.520 3.428 2.611 4.321 . 0 0 "[ . 1]" 1
331 1 40 LEU MD2 1 41 ASP H 6.520 . 6.520 3.785 2.942 4.230 . 0 0 "[ . 1]" 1
332 1 40 LEU HG 1 41 ASP H 5.500 . 5.500 2.495 2.212 2.738 . 0 0 "[ . 1]" 1
333 1 40 LEU HG 1 41 ASP HA 5.500 . 5.500 4.103 3.876 4.604 . 0 0 "[ . 1]" 1
334 1 40 LEU HG 1 41 ASP QB 6.220 . 6.220 4.291 4.162 4.602 . 0 0 "[ . 1]" 1
335 1 40 LEU H 1 41 ASP QB 6.220 . 6.220 5.114 4.861 5.243 . 0 0 "[ . 1]" 1
336 1 40 LEU QD 1 42 ARG QB 8.260 . 8.260 3.604 2.845 4.082 . 0 0 "[ . 1]" 1
337 1 40 LEU MD1 1 42 ARG HA 6.520 . 6.520 5.066 4.798 5.356 . 0 0 "[ . 1]" 1
338 1 40 LEU MD1 1 42 ARG HD2 6.520 . 6.520 4.931 2.447 6.041 . 0 0 "[ . 1]" 1
339 1 40 LEU MD1 1 42 ARG HD3 6.520 . 6.520 5.135 3.510 6.502 . 0 0 "[ . 1]" 1
340 1 40 LEU MD1 1 42 ARG H 6.520 . 6.520 5.533 5.216 6.033 . 0 0 "[ . 1]" 1
341 1 40 LEU MD2 1 42 ARG H 6.520 . 6.520 3.990 2.850 4.849 . 0 0 "[ . 1]" 1
342 1 40 LEU MD2 1 42 ARG HD2 6.520 . 6.520 3.092 2.220 3.937 . 0 0 "[ . 1]" 1
343 1 40 LEU MD2 1 42 ARG HD3 6.520 . 6.520 3.363 1.978 4.318 . 0 0 "[ . 1]" 1
344 1 40 LEU MD2 1 42 ARG HA 6.520 . 6.520 4.136 3.276 4.515 . 0 0 "[ . 1]" 1
345 1 40 LEU QD 1 55 ASN HA 7.540 . 7.540 6.295 5.254 7.245 . 0 0 "[ . 1]" 1
346 1 40 LEU QD 1 56 LEU H 7.540 . 7.540 6.522 5.416 7.356 . 0 0 "[ . 1]" 1
347 1 40 LEU QD 1 56 LEU QD 9.560 . 9.560 5.024 4.202 6.369 . 0 0 "[ . 1]" 1
348 1 40 LEU HG 1 56 LEU QD 7.540 . 7.540 5.825 4.920 7.436 . 0 0 "[ . 1]" 1
349 1 40 LEU H 1 56 LEU HA 5.500 . 5.500 3.947 3.733 4.129 . 0 0 "[ . 1]" 1
350 1 40 LEU H 1 56 LEU QD 7.540 . 7.540 4.401 3.906 5.425 . 0 0 "[ . 1]" 1
351 1 40 LEU QD 1 57 LYS HB2 7.540 . 7.540 4.191 3.039 5.540 . 0 0 "[ . 1]" 1
352 1 40 LEU QD 1 57 LYS QG 8.260 . 8.260 3.969 2.543 5.437 . 0 0 "[ . 1]" 1
353 1 40 LEU QD 1 57 LYS QE 8.420 . 8.420 3.923 1.677 6.144 . 0 0 "[ . 1]" 1
354 1 40 LEU H 1 57 LYS H 5.500 . 5.500 2.645 2.444 2.989 . 0 0 "[ . 1]" 1
355 1 40 LEU H 1 57 LYS QE 6.380 . 6.380 5.871 4.888 6.633 0.253 7 0 "[ . 1]" 1
356 1 40 LEU H 1 57 LYS HB2 5.500 . 5.500 4.301 3.604 5.227 . 0 0 "[ . 1]" 1
357 1 40 LEU H 1 57 LYS HB3 5.500 . 5.500 5.248 4.958 5.469 . 0 0 "[ . 1]" 1
358 1 40 LEU H 1 57 LYS QG 6.220 . 6.220 4.473 3.070 5.540 . 0 0 "[ . 1]" 1
359 1 40 LEU H 1 58 LYS QD 6.380 . 6.380 6.448 6.098 6.624 0.244 5 0 "[ . 1]" 1
360 1 40 LEU HA 1 59 ILE MD 6.520 . 6.520 3.907 3.028 4.684 . 0 0 "[ . 1]" 1
361 1 40 LEU HB2 1 59 ILE MD 6.520 . 6.520 2.196 1.756 2.785 . 0 0 "[ . 1]" 1
362 1 40 LEU H 1 59 ILE H 5.500 . 5.500 4.080 3.910 4.337 . 0 0 "[ . 1]" 1
363 1 40 LEU H 1 59 ILE MD 6.520 . 6.520 3.548 2.606 3.911 . 0 0 "[ . 1]" 1
364 1 40 LEU HB2 1 81 LEU QD 7.540 . 7.540 5.816 4.875 6.393 . 0 0 "[ . 1]" 1
365 1 40 LEU QD 1 81 LEU HB3 7.540 . 7.540 5.748 4.776 6.594 . 0 0 "[ . 1]" 1
366 1 40 LEU QD 1 81 LEU QD 9.040 . 9.040 3.333 2.262 4.081 . 0 0 "[ . 1]" 1
367 1 40 LEU QD 1 85 CYS HA 7.540 . 7.540 3.610 3.075 4.368 . 0 0 "[ . 1]" 1
368 1 40 LEU HG 1 85 CYS HA 5.500 . 5.500 4.442 4.107 4.687 . 0 0 "[ . 1]" 1
369 1 40 LEU HB2 1 86 SER H 5.500 . 5.500 5.673 5.626 5.766 0.266 8 0 "[ . 1]" 1
370 1 40 LEU QD 1 86 SER H 7.540 . 7.540 3.040 2.444 4.071 . 0 0 "[ . 1]" 1
371 1 40 LEU HG 1 86 SER H 5.500 . 5.500 3.438 3.122 3.692 . 0 0 "[ . 1]" 1
372 1 40 LEU HA 1 87 TYR QD 7.630 . 7.630 3.786 2.719 4.241 . 0 0 "[ . 1]" 1
373 1 40 LEU HA 1 87 TYR QB 6.220 . 6.220 4.563 4.299 4.903 . 0 0 "[ . 1]" 1
374 1 40 LEU HB2 1 87 TYR QE 7.630 . 7.630 3.507 2.990 3.914 . 0 0 "[ . 1]" 1
375 1 40 LEU QD 1 87 TYR HA 7.540 . 7.540 2.975 2.182 4.229 . 0 0 "[ . 1]" 1
376 1 40 LEU MD1 1 87 TYR QD 8.650 . 8.650 2.819 2.062 3.982 . 0 0 "[ . 1]" 1
377 1 40 LEU MD1 1 87 TYR QE 8.650 . 8.650 2.394 1.828 3.090 . 0 0 "[ . 1]" 1
378 1 40 LEU MD2 1 87 TYR QD 8.650 . 8.650 4.672 4.159 5.652 . 0 0 "[ . 1]" 1
379 1 40 LEU MD2 1 87 TYR QE 8.650 . 8.650 3.979 3.025 5.346 . 0 0 "[ . 1]" 1
380 1 40 LEU HG 1 87 TYR QD 7.630 . 7.630 4.686 3.555 5.267 . 0 0 "[ . 1]" 1
381 1 40 LEU HG 1 87 TYR QE 7.630 . 7.630 4.772 3.883 5.186 . 0 0 "[ . 1]" 1
382 1 40 LEU H 1 87 TYR QE 7.630 . 7.630 6.562 6.230 6.974 . 0 0 "[ . 1]" 1
383 1 40 LEU HA 1 88 HIS H 5.500 . 5.500 2.827 2.648 2.962 . 0 0 "[ . 1]" 1
384 1 40 LEU QD 1 88 HIS H 7.540 . 7.540 4.377 3.836 5.216 . 0 0 "[ . 1]" 1
385 1 40 LEU HG 1 88 HIS H 5.500 . 5.500 5.454 4.946 5.666 0.166 3 0 "[ . 1]" 1
386 1 40 LEU H 1 88 HIS H 5.500 . 5.500 4.445 4.234 4.671 . 0 0 "[ . 1]" 1
387 1 41 ASP HB3 1 42 ARG H 5.500 . 5.500 4.232 4.022 4.289 . 0 0 "[ . 1]" 1
388 1 41 ASP HB2 1 42 ARG H 5.500 . 5.500 4.477 4.342 4.516 . 0 0 "[ . 1]" 1
389 1 41 ASP H 1 42 ARG H 5.500 . 5.500 4.376 4.239 4.553 . 0 0 "[ . 1]" 1
390 1 41 ASP HA 1 55 ASN HA 5.500 . 5.500 5.252 5.033 5.627 0.127 10 0 "[ . 1]" 1
391 1 41 ASP HA 1 56 LEU H 5.500 . 5.500 4.838 4.585 4.984 . 0 0 "[ . 1]" 1
392 1 41 ASP HA 1 56 LEU HB2 5.500 . 5.500 5.280 4.689 5.543 0.043 8 0 "[ . 1]" 1
393 1 41 ASP HA 1 56 LEU HB3 5.500 . 5.500 4.538 3.407 5.186 . 0 0 "[ . 1]" 1
394 1 41 ASP HA 1 56 LEU HG 5.500 . 5.500 4.293 3.429 5.230 . 0 0 "[ . 1]" 1
395 1 41 ASP HA 1 56 LEU HA 5.500 . 5.500 2.745 2.419 2.944 . 0 0 "[ . 1]" 1
396 1 41 ASP HA 1 56 LEU QD 7.540 . 7.540 2.948 1.933 5.021 . 0 0 "[ . 1]" 1
397 1 41 ASP QB 1 56 LEU QD 7.830 . 7.830 2.978 2.014 5.034 . 0 0 "[ . 1]" 1
398 1 41 ASP H 1 56 LEU HA 5.500 . 5.500 4.922 4.678 5.130 . 0 0 "[ . 1]" 1
399 1 41 ASP H 1 56 LEU QD 7.540 . 7.540 4.578 3.628 6.598 . 0 0 "[ . 1]" 1
400 1 41 ASP HA 1 57 LYS H 5.500 . 5.500 4.135 3.785 4.322 . 0 0 "[ . 1]" 1
401 1 41 ASP HA 1 57 LYS QG 6.220 . 6.220 5.060 4.622 5.707 . 0 0 "[ . 1]" 1
402 1 41 ASP H 1 85 CYS HA 5.500 . 5.500 4.952 4.442 5.403 . 0 0 "[ . 1]" 1
403 1 41 ASP HA 1 86 SER H 5.500 . 5.500 5.160 4.720 5.645 0.145 7 0 "[ . 1]" 1
404 1 41 ASP QB 1 86 SER H 6.220 . 6.220 3.468 2.794 3.893 . 0 0 "[ . 1]" 1
405 1 41 ASP QB 1 86 SER QB 6.520 . 6.520 2.427 1.930 3.549 . 0 0 "[ . 1]" 1
406 1 41 ASP H 1 86 SER H 5.500 . 5.500 3.080 2.630 3.440 . 0 0 "[ . 1]" 1
407 1 41 ASP H 1 86 SER QB 6.220 . 6.220 3.252 2.665 4.179 . 0 0 "[ . 1]" 1
408 1 41 ASP QB 1 87 TYR H 6.220 . 6.220 5.459 5.093 5.875 . 0 0 "[ . 1]" 1
409 1 41 ASP HB3 1 87 TYR QD 7.630 . 7.630 7.028 6.490 7.444 . 0 0 "[ . 1]" 1
410 1 41 ASP HB2 1 87 TYR QD 7.630 . 7.630 7.268 6.638 7.567 . 0 0 "[ . 1]" 1
411 1 41 ASP H 1 87 TYR HA 5.500 . 5.500 3.762 3.311 4.169 . 0 0 "[ . 1]" 1
412 1 41 ASP H 1 87 TYR QD 7.630 . 7.630 5.191 4.265 5.542 . 0 0 "[ . 1]" 1
413 1 41 ASP H 1 88 HIS H 5.500 . 5.500 4.304 3.713 4.678 . 0 0 "[ . 1]" 1
414 1 42 ARG H 1 43 SER HB2 5.500 . 5.500 5.153 4.684 5.398 . 0 0 "[ . 1]" 1
415 1 42 ARG H 1 43 SER HB3 5.500 . 5.500 5.546 5.323 5.664 0.164 10 0 "[ . 1]" 1
416 1 42 ARG H 1 43 SER HA 5.500 . 5.500 4.940 4.727 5.982 0.482 4 0 "[ . 1]" 1
417 1 42 ARG QB 1 44 LEU H 6.520 . 6.520 4.539 3.799 5.869 . 0 0 "[ . 1]" 1
418 1 42 ARG QB 1 44 LEU QD 8.260 . 8.260 3.238 1.942 5.331 . 0 0 "[ . 1]" 1
419 1 42 ARG QB 1 55 ASN H 6.220 . 6.220 5.732 4.735 6.096 . 0 0 "[ . 1]" 1
420 1 42 ARG QB 1 55 ASN HA 6.220 . 6.220 4.362 2.598 5.147 . 0 0 "[ . 1]" 1
421 1 42 ARG HB3 1 55 ASN HD22 5.500 . 5.500 5.575 5.470 5.688 0.188 7 0 "[ . 1]" 1
422 1 42 ARG HB3 1 55 ASN HD21 5.500 . 5.500 5.126 4.765 5.483 . 0 0 "[ . 1]" 1
423 1 42 ARG HB2 1 55 ASN HD21 5.500 . 5.500 4.793 4.306 5.033 . 0 0 "[ . 1]" 1
424 1 42 ARG HB2 1 55 ASN HD22 5.500 . 5.500 5.306 5.106 5.626 0.126 4 0 "[ . 1]" 1
425 1 42 ARG H 1 55 ASN HB3 5.500 . 5.500 3.014 1.989 4.566 . 0 0 "[ . 1]" 1
426 1 42 ARG H 1 55 ASN H 5.500 . 5.500 4.926 4.509 5.104 . 0 0 "[ . 1]" 1
427 1 42 ARG H 1 55 ASN HD21 5.500 . 5.500 4.483 4.164 4.656 . 0 0 "[ . 1]" 1
428 1 42 ARG H 1 55 ASN HD22 5.500 . 5.500 5.073 3.809 5.775 0.275 4 0 "[ . 1]" 1
429 1 42 ARG H 1 55 ASN HB2 5.500 . 5.500 2.924 2.277 3.303 . 0 0 "[ . 1]" 1
430 1 42 ARG H 1 56 LEU H 5.500 . 5.500 5.159 4.672 5.519 0.019 9 0 "[ . 1]" 1
431 1 42 ARG H 1 56 LEU QD 7.540 . 7.540 4.402 3.422 5.867 . 0 0 "[ . 1]" 1
432 1 42 ARG H 1 57 LYS H 5.500 . 5.500 5.153 4.546 5.597 0.097 9 0 "[ . 1]" 1
433 1 42 ARG H 1 57 LYS QG 6.220 . 6.220 5.025 4.312 5.816 . 0 0 "[ . 1]" 1
434 1 42 ARG QB 1 85 CYS HA 6.220 . 6.220 5.253 4.026 6.172 . 0 0 "[ . 1]" 1
435 1 43 SER HA 1 44 LEU HG 5.500 . 5.500 4.119 3.438 5.200 . 0 0 "[ . 1]" 1
436 1 43 SER HA 1 44 LEU QB 6.220 . 6.220 4.692 3.985 5.076 . 0 0 "[ . 1]" 1
437 1 43 SER HA 1 44 LEU QD 7.540 . 7.540 3.586 3.102 4.611 . 0 0 "[ . 1]" 1
438 1 43 SER HB3 1 44 LEU H 5.500 . 5.500 4.263 2.176 4.576 . 0 0 "[ . 1]" 1
439 1 43 SER HB3 1 44 LEU QD 7.540 . 7.540 4.858 4.079 6.021 . 0 0 "[ . 1]" 1
440 1 43 SER HB2 1 44 LEU H 5.500 . 5.500 4.303 3.597 4.591 . 0 0 "[ . 1]" 1
441 1 43 SER HB2 1 44 LEU QD 7.540 . 7.540 5.057 4.655 5.641 . 0 0 "[ . 1]" 1
442 1 43 SER HB3 1 47 ALA MB 6.520 . 6.520 4.928 2.541 6.776 0.256 10 0 "[ . 1]" 1
443 1 43 SER HB2 1 47 ALA MB 6.520 . 6.520 4.560 3.690 6.378 . 0 0 "[ . 1]" 1
444 1 43 SER HB2 1 52 CYS HA 5.500 . 5.500 2.728 2.195 5.005 . 0 0 "[ . 1]" 1
445 1 43 SER HA 1 55 ASN HD21 5.500 . 5.500 2.389 1.952 4.745 . 0 0 "[ . 1]" 1
446 1 43 SER HA 1 55 ASN HD22 5.500 . 5.500 2.957 1.964 5.273 . 0 0 "[ . 1]" 1
447 1 43 SER HA 1 55 ASN HB3 5.500 . 5.500 4.287 3.934 5.083 . 0 0 "[ . 1]" 1
448 1 43 SER HA 1 55 ASN HB2 5.500 . 5.500 4.226 3.477 5.818 0.318 4 0 "[ . 1]" 1
449 1 43 SER HB2 1 55 ASN HD21 5.500 . 5.500 3.434 2.882 4.058 . 0 0 "[ . 1]" 1
450 1 43 SER HB2 1 55 ASN HD22 5.500 . 5.500 3.666 1.967 5.095 . 0 0 "[ . 1]" 1
451 1 43 SER HB2 1 55 ASN H 5.500 . 5.500 5.592 5.503 5.740 0.240 7 0 "[ . 1]" 1
452 1 43 SER H 1 85 CYS H 5.500 . 5.500 5.562 5.471 5.702 0.202 9 0 "[ . 1]" 1
453 1 44 LEU QD 1 45 PRO QD 7.830 . 7.830 2.795 1.952 3.383 . 0 0 "[ . 1]" 1
454 1 44 LEU H 1 45 PRO QD 6.240 . 6.240 3.191 1.770 4.468 . 0 0 "[ . 1]" 1
455 1 44 LEU QD 1 47 ALA H 7.540 . 7.540 5.388 3.816 6.929 . 0 0 "[ . 1]" 1
456 1 44 LEU QD 1 47 ALA MB 8.560 . 8.560 4.172 2.303 6.624 . 0 0 "[ . 1]" 1
457 1 44 LEU H 1 47 ALA H 5.500 . 5.500 5.211 3.034 5.721 0.221 10 0 "[ . 1]" 1
458 1 44 LEU H 1 52 CYS HA 5.500 . 5.500 5.367 4.582 5.641 0.141 6 0 "[ . 1]" 1
459 1 44 LEU QD 1 55 ASN H 7.540 . 7.540 6.502 5.628 7.092 . 0 0 "[ . 1]" 1
460 1 44 LEU QD 1 55 ASN HA 7.540 . 7.540 6.136 5.678 6.976 . 0 0 "[ . 1]" 1
461 1 44 LEU QD 1 55 ASN QD 7.810 . 7.810 3.653 2.371 4.432 . 0 0 "[ . 1]" 1
462 1 44 LEU HG 1 55 ASN HD21 5.500 . 5.500 4.687 4.186 5.534 0.034 8 0 "[ . 1]" 1
463 1 44 LEU HG 1 55 ASN HD22 5.500 . 5.500 4.961 4.058 5.623 0.123 4 0 "[ . 1]" 1
464 1 44 LEU H 1 55 ASN HB3 5.500 . 5.500 5.280 4.943 5.706 0.206 4 0 "[ . 1]" 1
465 1 44 LEU H 1 55 ASN HD22 5.500 . 5.500 3.890 3.059 4.684 . 0 0 "[ . 1]" 1
466 1 44 LEU H 1 55 ASN HD21 5.500 . 5.500 3.541 3.087 4.098 . 0 0 "[ . 1]" 1
467 1 44 LEU H 1 55 ASN HB2 5.500 . 5.500 5.459 4.983 5.748 0.248 7 0 "[ . 1]" 1
468 1 46 GLY H 1 47 ALA H 5.500 . 5.500 3.103 1.983 4.119 . 0 0 "[ . 1]" 1
469 1 47 ALA MB 1 48 THR H 6.520 . 6.520 2.885 2.294 3.734 . 0 0 "[ . 1]" 1
470 1 47 ALA H 1 48 THR H 5.500 . 5.500 3.968 2.470 4.685 . 0 0 "[ . 1]" 1
471 1 47 ALA HA 1 51 GLU HB2 5.500 . 5.500 3.640 3.051 4.660 . 0 0 "[ . 1]" 1
472 1 47 ALA HA 1 51 GLU HB3 5.500 . 5.500 4.045 3.503 5.263 . 0 0 "[ . 1]" 1
473 1 47 ALA MB 1 51 GLU H 6.520 . 6.520 4.610 3.886 6.209 . 0 0 "[ . 1]" 1
474 1 47 ALA MB 1 51 GLU HB3 6.520 . 6.520 2.907 1.899 4.833 . 0 0 "[ . 1]" 1
475 1 47 ALA MB 1 51 GLU HB2 6.520 . 6.520 2.876 1.967 4.607 . 0 0 "[ . 1]" 1
476 1 47 ALA MB 1 51 GLU HA 6.520 . 6.520 4.974 4.088 6.764 0.244 3 0 "[ . 1]" 1
477 1 47 ALA MB 1 51 GLU QG 7.400 . 7.400 3.371 2.086 5.267 . 0 0 "[ . 1]" 1
478 1 47 ALA H 1 51 GLU HB3 5.500 . 5.500 4.689 2.505 5.629 0.129 7 0 "[ . 1]" 1
479 1 47 ALA H 1 51 GLU QG 6.380 . 6.380 4.854 2.959 6.409 0.029 4 0 "[ . 1]" 1
480 1 47 ALA MB 1 52 CYS H 6.520 . 6.520 4.032 2.833 5.507 . 0 0 "[ . 1]" 1
481 1 47 ALA MB 1 55 ASN HD21 6.520 . 6.520 4.474 2.977 6.559 0.039 10 0 "[ . 1]" 1
482 1 47 ALA MB 1 55 ASN HD22 6.520 . 6.520 4.405 2.216 6.738 0.218 10 0 "[ . 1]" 1
483 1 48 THR HA 1 49 ALA HA 5.500 . 5.500 4.394 4.364 4.435 . 0 0 "[ . 1]" 1
484 1 48 THR HB 1 49 ALA H 5.500 . 5.500 2.563 2.233 3.618 . 0 0 "[ . 1]" 1
485 1 48 THR H 1 49 ALA HA 5.500 . 5.500 5.625 5.392 5.755 0.255 7 0 "[ . 1]" 1
486 1 48 THR HB 1 50 ALA H 5.500 . 5.500 2.660 2.293 3.128 . 0 0 "[ . 1]" 1
487 1 48 THR HB 1 50 ALA MB 6.520 . 6.520 3.294 2.886 3.493 . 0 0 "[ . 1]" 1
488 1 48 THR HB 1 50 ALA HA 5.500 . 5.500 5.406 5.027 5.554 0.054 7 0 "[ . 1]" 1
489 1 48 THR HA 1 51 GLU H 5.500 . 5.500 4.675 4.554 4.949 . 0 0 "[ . 1]" 1
490 1 48 THR HB 1 51 GLU H 5.500 . 5.500 3.453 2.327 3.921 . 0 0 "[ . 1]" 1
491 1 48 THR HB 1 51 GLU QG 6.380 . 6.380 4.425 2.421 6.303 . 0 0 "[ . 1]" 1
492 1 48 THR MG 1 51 GLU H 6.520 . 6.520 4.336 3.200 4.590 . 0 0 "[ . 1]" 1
493 1 48 THR MG 1 51 GLU HB3 6.520 . 6.520 5.750 5.141 6.372 . 0 0 "[ . 1]" 1
494 1 48 THR MG 1 51 GLU QG 7.400 . 7.400 4.266 3.453 5.476 . 0 0 "[ . 1]" 1
495 1 48 THR MG 1 51 GLU HB2 6.520 . 6.520 4.548 4.223 4.955 . 0 0 "[ . 1]" 1
496 1 48 THR H 1 51 GLU HB3 5.500 . 5.500 3.544 2.282 3.980 . 0 0 "[ . 1]" 1
497 1 48 THR H 1 51 GLU HA 5.500 . 5.500 4.998 4.504 5.397 . 0 0 "[ . 1]" 1
498 1 48 THR H 1 51 GLU H 5.500 . 5.500 3.359 2.917 3.873 . 0 0 "[ . 1]" 1
499 1 48 THR H 1 51 GLU QG 6.380 . 6.380 2.942 2.096 3.723 . 0 0 "[ . 1]" 1
500 1 48 THR H 1 51 GLU HB2 5.500 . 5.500 2.308 1.864 2.826 . 0 0 "[ . 1]" 1
501 1 49 ALA H 1 50 ALA H 5.500 . 5.500 2.726 2.684 2.813 . 0 0 "[ . 1]" 1
502 1 49 ALA H 1 51 GLU HB2 5.500 . 5.500 5.331 5.167 5.554 0.054 8 0 "[ . 1]" 1
503 1 49 ALA HA 1 52 CYS HB3 5.500 . 5.500 4.359 3.830 4.655 . 0 0 "[ . 1]" 1
504 1 49 ALA HA 1 52 CYS HB2 5.500 . 5.500 3.134 2.536 4.729 . 0 0 "[ . 1]" 1
505 1 49 ALA MB 1 52 CYS H 6.520 . 6.520 4.795 4.632 5.053 . 0 0 "[ . 1]" 1
506 1 49 ALA MB 1 52 CYS HB3 6.520 . 6.520 5.522 5.223 5.862 . 0 0 "[ . 1]" 1
507 1 49 ALA MB 1 52 CYS HB2 6.520 . 6.520 4.464 4.088 5.950 . 0 0 "[ . 1]" 1
508 1 50 ALA MB 1 51 GLU QG 7.400 . 7.400 3.489 2.809 5.153 . 0 0 "[ . 1]" 1
509 1 50 ALA MB 1 51 GLU H 6.520 . 6.520 2.435 2.147 2.699 . 0 0 "[ . 1]" 1
510 1 50 ALA H 1 51 GLU H 5.500 . 5.500 2.567 2.464 2.673 . 0 0 "[ . 1]" 1
511 1 50 ALA H 1 51 GLU QG 6.380 . 6.380 4.684 4.055 6.115 . 0 0 "[ . 1]" 1
512 1 50 ALA MB 1 52 CYS QB 7.240 . 7.240 5.493 5.252 6.053 . 0 0 "[ . 1]" 1
513 1 51 GLU HB3 1 52 CYS H 5.500 . 5.500 3.402 2.666 3.658 . 0 0 "[ . 1]" 1
514 1 51 GLU HB2 1 52 CYS H 5.500 . 5.500 2.734 2.513 3.442 . 0 0 "[ . 1]" 1
515 1 51 GLU H 1 52 CYS H 5.500 . 5.500 2.690 2.575 2.774 . 0 0 "[ . 1]" 1
516 1 51 GLU H 1 52 CYS HA 5.500 . 5.500 5.354 5.259 5.433 . 0 0 "[ . 1]" 1
517 1 51 GLU H 1 52 CYS QB 6.220 . 6.220 4.578 4.426 4.793 . 0 0 "[ . 1]" 1
518 1 51 GLU HA 1 53 ALA H 5.500 . 5.500 4.413 4.097 4.537 . 0 0 "[ . 1]" 1
519 1 51 GLU HB2 1 53 ALA H 5.500 . 5.500 5.112 4.917 5.409 . 0 0 "[ . 1]" 1
520 1 51 GLU H 1 53 ALA H 5.500 . 5.500 4.236 4.021 4.398 . 0 0 "[ . 1]" 1
521 1 51 GLU HA 1 54 SER H 5.500 . 5.500 3.271 3.199 3.391 . 0 0 "[ . 1]" 1
522 1 51 GLU HA 1 54 SER QB 6.220 . 6.220 2.261 1.987 2.982 . 0 0 "[ . 1]" 1
523 1 51 GLU HB3 1 54 SER H 5.500 . 5.500 5.009 4.851 5.198 . 0 0 "[ . 1]" 1
524 1 51 GLU HB2 1 54 SER H 5.500 . 5.500 5.271 5.128 5.486 . 0 0 "[ . 1]" 1
525 1 51 GLU QG 1 54 SER H 6.380 . 6.380 5.302 4.741 5.566 . 0 0 "[ . 1]" 1
526 1 51 GLU QG 1 54 SER HB3 6.380 . 6.380 5.066 4.065 5.952 . 0 0 "[ . 1]" 1
527 1 51 GLU QG 1 54 SER HB2 6.380 . 6.380 4.552 3.695 5.421 . 0 0 "[ . 1]" 1
528 1 51 GLU HA 1 55 ASN HD22 5.500 . 5.500 4.659 3.759 5.550 0.050 10 0 "[ . 1]" 1
529 1 51 GLU HA 1 55 ASN HD21 5.500 . 5.500 4.793 4.126 5.546 0.046 4 0 "[ . 1]" 1
530 1 51 GLU HB3 1 55 ASN H 5.500 . 5.500 5.359 5.125 5.616 0.116 8 0 "[ . 1]" 1
531 1 51 GLU HB2 1 55 ASN HD21 5.500 . 5.500 4.995 4.458 5.552 0.052 8 0 "[ . 1]" 1
532 1 51 GLU HB2 1 55 ASN HD22 5.500 . 5.500 4.772 3.565 5.648 0.148 7 0 "[ . 1]" 1
533 1 52 CYS QB 1 53 ALA MB 7.240 . 7.240 3.611 3.414 4.476 . 0 0 "[ . 1]" 1
534 1 52 CYS HB3 1 53 ALA H 5.500 . 5.500 3.560 3.309 3.815 . 0 0 "[ . 1]" 1
535 1 52 CYS HB2 1 53 ALA H 5.500 . 5.500 2.669 2.393 3.886 . 0 0 "[ . 1]" 1
536 1 52 CYS H 1 53 ALA H 5.500 . 5.500 2.688 2.574 2.777 . 0 0 "[ . 1]" 1
537 1 52 CYS HA 1 54 SER H 5.500 . 5.500 4.027 3.849 4.202 . 0 0 "[ . 1]" 1
538 1 52 CYS H 1 54 SER QB 6.220 . 6.220 4.712 4.409 5.339 . 0 0 "[ . 1]" 1
539 1 52 CYS HA 1 55 ASN HD21 5.500 . 5.500 2.809 2.137 3.525 . 0 0 "[ . 1]" 1
540 1 52 CYS HA 1 55 ASN HD22 5.500 . 5.500 3.024 1.918 4.505 . 0 0 "[ . 1]" 1
541 1 52 CYS H 1 55 ASN HD21 5.500 . 5.500 4.674 4.403 5.057 . 0 0 "[ . 1]" 1
542 1 52 CYS H 1 55 ASN HD22 5.500 . 5.500 4.661 3.919 5.471 . 0 0 "[ . 1]" 1
543 1 52 CYS HA 1 56 LEU QD 7.540 . 7.540 5.351 4.663 6.359 . 0 0 "[ . 1]" 1
544 1 52 CYS QB 1 56 LEU QD 7.510 . 7.510 5.045 4.055 6.525 . 0 0 "[ . 1]" 1
545 1 52 CYS H 1 56 LEU QD 7.540 . 7.540 6.455 6.016 7.012 . 0 0 "[ . 1]" 1
546 1 53 ALA MB 1 54 SER H 6.520 . 6.520 3.031 2.904 3.162 . 0 0 "[ . 1]" 1
547 1 53 ALA H 1 54 SER H 5.500 . 5.500 2.472 2.369 2.649 . 0 0 "[ . 1]" 1
548 1 53 ALA H 1 54 SER QB 6.220 . 6.220 4.262 4.021 4.548 . 0 0 "[ . 1]" 1
549 1 53 ALA HA 1 55 ASN H 5.500 . 5.500 4.005 3.803 4.148 . 0 0 "[ . 1]" 1
550 1 53 ALA MB 1 55 ASN H 6.520 . 6.520 4.536 4.399 4.652 . 0 0 "[ . 1]" 1
551 1 53 ALA HA 1 56 LEU H 5.500 . 5.500 5.306 4.709 5.701 0.201 5 0 "[ . 1]" 1
552 1 53 ALA HA 1 56 LEU MD2 6.520 . 6.520 3.627 3.073 4.791 . 0 0 "[ . 1]" 1
553 1 53 ALA HA 1 56 LEU MD1 6.520 . 6.520 3.321 2.060 5.331 . 0 0 "[ . 1]" 1
554 1 53 ALA HA 1 56 LEU QB 6.220 . 6.220 4.607 3.991 5.335 . 0 0 "[ . 1]" 1
555 1 53 ALA MB 1 56 LEU H 6.520 . 6.520 5.796 5.333 6.279 . 0 0 "[ . 1]" 1
556 1 53 ALA MB 1 56 LEU HB2 6.520 . 6.520 5.773 4.837 6.676 0.156 2 0 "[ . 1]" 1
557 1 53 ALA MB 1 56 LEU HB3 6.520 . 6.520 6.096 5.523 6.637 0.117 8 0 "[ . 1]" 1
558 1 53 ALA MB 1 56 LEU QD 8.560 . 8.560 3.278 2.901 3.599 . 0 0 "[ . 1]" 1
559 1 53 ALA H 1 56 LEU QD 7.540 . 7.540 4.827 4.410 5.349 . 0 0 "[ . 1]" 1
560 1 54 SER HB3 1 55 ASN H 5.500 . 5.500 3.804 2.997 4.241 . 0 0 "[ . 1]" 1
561 1 54 SER HB2 1 55 ASN H 5.500 . 5.500 3.478 2.804 4.228 . 0 0 "[ . 1]" 1
562 1 54 SER H 1 55 ASN HD21 5.500 . 5.500 4.927 4.707 5.220 . 0 0 "[ . 1]" 1
563 1 54 SER H 1 55 ASN HD22 5.500 . 5.500 5.081 4.424 5.565 0.065 8 0 "[ . 1]" 1
564 1 54 SER H 1 55 ASN HB3 5.500 . 5.500 5.272 4.474 5.766 0.266 1 0 "[ . 1]" 1
565 1 54 SER H 1 55 ASN HB2 5.500 . 5.500 4.856 4.004 5.837 0.337 10 0 "[ . 1]" 1
566 1 54 SER HA 1 56 LEU H 5.500 . 5.500 3.689 3.399 4.436 . 0 0 "[ . 1]" 1
567 1 54 SER HB3 1 56 LEU H 5.500 . 5.500 5.117 4.765 5.721 0.221 4 0 "[ . 1]" 1
568 1 54 SER HB2 1 56 LEU H 5.500 . 5.500 5.372 5.091 5.664 0.164 3 0 "[ . 1]" 1
569 1 54 SER H 1 56 LEU H 5.500 . 5.500 4.847 4.458 5.369 . 0 0 "[ . 1]" 1
570 1 54 SER H 1 56 LEU MD1 6.520 . 6.520 4.832 4.463 5.107 . 0 0 "[ . 1]" 1
571 1 54 SER H 1 56 LEU MD2 6.520 . 6.520 5.372 4.775 6.257 . 0 0 "[ . 1]" 1
572 1 54 SER H 1 56 LEU HG 5.500 . 5.500 4.510 4.302 5.027 . 0 0 "[ . 1]" 1
573 1 54 SER H 1 56 LEU QB 6.220 . 6.220 5.735 5.209 6.148 . 0 0 "[ . 1]" 1
574 1 55 ASN HA 1 56 LEU QB 6.220 . 6.220 5.006 4.607 5.323 . 0 0 "[ . 1]" 1
575 1 55 ASN HB3 1 56 LEU H 5.500 . 5.500 4.505 4.392 4.645 . 0 0 "[ . 1]" 1
576 1 55 ASN HB2 1 56 LEU H 5.500 . 5.500 4.327 4.138 4.531 . 0 0 "[ . 1]" 1
577 1 55 ASN QD 1 56 LEU H 6.200 . 6.200 5.742 5.340 5.880 . 0 0 "[ . 1]" 1
578 1 55 ASN QD 1 56 LEU QD 8.230 . 8.230 5.359 4.640 6.166 . 0 0 "[ . 1]" 1
579 1 55 ASN H 1 56 LEU H 5.500 . 5.500 3.268 2.965 3.757 . 0 0 "[ . 1]" 1
580 1 55 ASN H 1 56 LEU QB 6.220 . 6.220 4.731 4.382 5.071 . 0 0 "[ . 1]" 1
581 1 55 ASN H 1 56 LEU QD 7.540 . 7.540 4.015 3.915 4.135 . 0 0 "[ . 1]" 1
582 1 56 LEU H 1 56 LEU HG 5.500 . 5.500 2.577 1.926 3.334 . 0 0 "[ . 1]" 1
583 1 56 LEU MD1 1 57 LYS H 6.520 . 6.520 4.931 4.159 5.422 . 0 0 "[ . 1]" 1
584 1 56 LEU MD2 1 57 LYS H 6.520 . 6.520 4.094 3.423 5.365 . 0 0 "[ . 1]" 1
585 1 56 LEU H 1 57 LYS H 5.500 . 5.500 4.368 4.018 4.482 . 0 0 "[ . 1]" 1
586 1 56 LEU QD 1 58 LYS H 7.540 . 7.540 6.126 5.287 6.533 . 0 0 "[ . 1]" 1
587 1 57 LYS HB3 1 58 LYS H 5.500 . 5.500 3.036 2.638 3.861 . 0 0 "[ . 1]" 1
588 1 57 LYS HB2 1 58 LYS H 5.500 . 5.500 3.416 2.578 3.860 . 0 0 "[ . 1]" 1
589 1 57 LYS QD 1 58 LYS H 6.220 . 6.220 4.490 3.720 5.095 . 0 0 "[ . 1]" 1
590 1 57 LYS HG3 1 58 LYS H 5.500 . 5.500 4.696 3.841 5.133 . 0 0 "[ . 1]" 1
591 1 57 LYS HG2 1 58 LYS H 5.500 . 5.500 4.528 3.964 5.056 . 0 0 "[ . 1]" 1
592 1 57 LYS H 1 58 LYS H 5.500 . 5.500 4.487 4.459 4.511 . 0 0 "[ . 1]" 1
593 1 57 LYS HB2 1 59 ILE MD 6.520 . 6.520 4.500 3.063 6.559 0.039 9 0 "[ . 1]" 1
594 1 57 LYS QE 1 59 ILE MD 7.400 . 7.400 5.395 2.340 7.418 0.018 8 0 "[ . 1]" 1
595 1 57 LYS QG 1 59 ILE MD 7.240 . 7.240 4.941 2.567 7.248 0.008 6 0 "[ . 1]" 1
596 1 57 LYS H 1 59 ILE MD 6.520 . 6.520 4.908 4.249 5.962 . 0 0 "[ . 1]" 1
597 1 58 LYS HA 1 59 ILE MD 6.520 . 6.520 4.402 3.118 5.090 . 0 0 "[ . 1]" 1
598 1 58 LYS QD 1 59 ILE H 6.380 . 6.380 5.339 5.282 5.443 . 0 0 "[ . 1]" 1
599 1 58 LYS HG3 1 59 ILE H 5.500 . 5.500 4.986 4.504 5.506 0.006 2 0 "[ . 1]" 1
600 1 58 LYS HG2 1 59 ILE H 5.500 . 5.500 4.817 4.205 5.456 . 0 0 "[ . 1]" 1
601 1 58 LYS HA 1 60 TYR H 5.500 . 5.500 4.033 3.937 4.189 . 0 0 "[ . 1]" 1
602 1 59 ILE HB 1 60 TYR H 5.500 . 5.500 2.389 2.317 2.479 . 0 0 "[ . 1]" 1
603 1 59 ILE MD 1 60 TYR H 6.520 . 6.520 4.404 3.738 4.647 . 0 0 "[ . 1]" 1
604 1 59 ILE H 1 60 TYR H 5.500 . 5.500 2.734 2.694 2.768 . 0 0 "[ . 1]" 1
605 1 59 ILE HB 1 75 ILE MD 6.520 . 6.520 4.491 3.598 4.947 . 0 0 "[ . 1]" 1
606 1 59 ILE MD 1 75 ILE MD 7.540 . 7.540 3.927 3.007 4.755 . 0 0 "[ . 1]" 1
607 1 59 ILE MD 1 87 TYR QE 8.650 . 8.650 2.992 2.004 3.899 . 0 0 "[ . 1]" 1
608 1 59 ILE MD 1 87 TYR QD 8.650 . 8.650 3.294 1.989 4.482 . 0 0 "[ . 1]" 1
609 1 60 TYR HB3 1 61 THR H 5.500 . 5.500 3.395 2.473 3.982 . 0 0 "[ . 1]" 1
610 1 60 TYR HB2 1 61 THR H 5.500 . 5.500 3.680 2.487 4.049 . 0 0 "[ . 1]" 1
611 1 60 TYR QD 1 61 THR H 7.630 . 7.630 3.024 2.364 3.583 . 0 0 "[ . 1]" 1
612 1 60 TYR QD 1 61 THR MG 8.650 . 8.650 4.817 4.175 5.219 . 0 0 "[ . 1]" 1
613 1 60 TYR QE 1 61 THR HB 7.630 . 7.630 6.304 5.432 7.503 . 0 0 "[ . 1]" 1
614 1 60 TYR H 1 61 THR H 5.500 . 5.500 4.394 4.374 4.413 . 0 0 "[ . 1]" 1
615 1 60 TYR H 1 61 THR HA 5.500 . 5.500 4.642 4.604 4.690 . 0 0 "[ . 1]" 1
616 1 60 TYR H 1 61 THR MG 6.520 . 6.520 4.347 3.896 4.484 . 0 0 "[ . 1]" 1
617 1 60 TYR QD 1 62 VAL H 7.630 . 7.630 5.064 4.473 6.539 . 0 0 "[ . 1]" 1
618 1 60 TYR QE 1 67 ILE MD 8.650 . 8.650 4.448 3.113 6.771 . 0 0 "[ . 1]" 1
619 1 60 TYR QE 1 70 SER HB2 7.630 . 7.630 6.273 5.353 7.752 0.122 8 0 "[ . 1]" 1
620 1 60 TYR QD 1 71 VAL HB 7.630 . 7.630 4.617 3.243 5.505 . 0 0 "[ . 1]" 1
621 1 60 TYR QE 1 71 VAL H 7.630 . 7.630 6.095 4.338 7.500 . 0 0 "[ . 1]" 1
622 1 60 TYR QE 1 71 VAL HA 7.630 . 7.630 5.875 4.937 7.067 . 0 0 "[ . 1]" 1
623 1 60 TYR QE 1 71 VAL HB 7.630 . 7.630 5.455 2.586 7.230 . 0 0 "[ . 1]" 1
624 1 60 TYR H 1 75 ILE MD 6.520 . 6.520 6.166 5.384 6.702 0.182 8 0 "[ . 1]" 1
625 1 61 THR HB 1 62 VAL H 5.500 . 5.500 3.243 2.815 3.402 . 0 0 "[ . 1]" 1
626 1 61 THR MG 1 62 VAL H 6.520 . 6.520 3.814 3.691 3.895 . 0 0 "[ . 1]" 1
627 1 61 THR H 1 62 VAL H 5.500 . 5.500 4.485 4.447 4.528 . 0 0 "[ . 1]" 1
628 1 61 THR HB 1 63 GLN HE21 5.500 . 5.500 5.497 5.332 5.618 0.118 4 0 "[ . 1]" 1
629 1 61 THR HB 1 63 GLN HE22 5.500 . 5.500 5.645 5.596 5.679 0.179 3 0 "[ . 1]" 1
630 1 61 THR MG 1 63 GLN HB2 6.520 . 6.520 6.290 6.097 6.591 0.071 2 0 "[ . 1]" 1
631 1 61 THR MG 1 63 GLN HE21 6.520 . 6.520 6.375 6.254 6.419 . 0 0 "[ . 1]" 1
632 1 61 THR MG 1 63 GLN HE22 6.520 . 6.520 6.285 6.173 6.390 . 0 0 "[ . 1]" 1
633 1 62 VAL HA 1 64 THR H 5.500 . 5.500 3.677 3.592 3.718 . 0 0 "[ . 1]" 1
634 1 62 VAL H 1 89 LEU QD 7.540 . 7.540 5.544 4.896 6.244 . 0 0 "[ . 1]" 1
635 1 63 GLN HB3 1 64 THR H 5.500 . 5.500 3.160 3.029 3.398 . 0 0 "[ . 1]" 1
636 1 63 GLN HB3 1 64 THR HB 5.500 . 5.500 5.278 4.628 5.453 . 0 0 "[ . 1]" 1
637 1 63 GLN HB3 1 64 THR HA 5.500 . 5.500 4.771 4.703 4.809 . 0 0 "[ . 1]" 1
638 1 63 GLN HB2 1 64 THR H 5.500 . 5.500 4.120 4.047 4.209 . 0 0 "[ . 1]" 1
639 1 63 GLN HG3 1 64 THR H 5.500 . 5.500 4.390 4.309 4.547 . 0 0 "[ . 1]" 1
640 1 63 GLN HG2 1 64 THR H 5.500 . 5.500 4.985 4.845 5.218 . 0 0 "[ . 1]" 1
641 1 63 GLN H 1 64 THR H 5.500 . 5.500 2.048 1.974 2.143 . 0 0 "[ . 1]" 1
642 1 63 GLN H 1 64 THR HA 5.500 . 5.500 4.832 4.773 4.895 . 0 0 "[ . 1]" 1
643 1 63 GLN H 1 64 THR MG 6.520 . 6.520 3.786 3.416 5.474 . 0 0 "[ . 1]" 1
644 1 63 GLN HB2 1 67 ILE MD 6.520 . 6.520 5.529 4.840 6.610 0.090 2 0 "[ . 1]" 1
645 1 63 GLN QG 1 67 ILE MD 7.240 . 7.240 5.837 5.255 6.913 . 0 0 "[ . 1]" 1
646 1 64 THR HA 1 65 VAL HB 5.500 . 5.500 4.679 4.497 4.848 . 0 0 "[ . 1]" 1
647 1 64 THR HB 1 65 VAL H 5.500 . 5.500 2.848 2.638 3.764 . 0 0 "[ . 1]" 1
648 1 64 THR HB 1 65 VAL HB 5.500 . 5.500 4.796 4.401 5.525 0.025 3 0 "[ . 1]" 1
649 1 64 THR H 1 65 VAL HA 5.500 . 5.500 5.007 4.934 5.079 . 0 0 "[ . 1]" 1
650 1 64 THR H 1 65 VAL H 5.500 . 5.500 4.438 4.424 4.463 . 0 0 "[ . 1]" 1
651 1 64 THR HA 1 66 GLN H 5.500 . 5.500 4.388 4.225 4.515 . 0 0 "[ . 1]" 1
652 1 64 THR HB 1 66 GLN H 5.500 . 5.500 3.345 3.137 3.669 . 0 0 "[ . 1]" 1
653 1 64 THR HB 1 66 GLN HB3 5.500 . 5.500 4.344 3.945 4.550 . 0 0 "[ . 1]" 1
654 1 64 THR MG 1 66 GLN H 6.520 . 6.520 4.334 2.077 4.663 . 0 0 "[ . 1]" 1
655 1 64 THR MG 1 66 GLN HB2 6.520 . 6.520 4.960 3.074 5.245 . 0 0 "[ . 1]" 1
656 1 64 THR MG 1 66 GLN HB3 6.520 . 6.520 4.550 3.076 4.873 . 0 0 "[ . 1]" 1
657 1 64 THR H 1 66 GLN H 5.500 . 5.500 5.171 4.902 5.407 . 0 0 "[ . 1]" 1
658 1 64 THR HA 1 67 ILE H 5.500 . 5.500 4.722 4.592 4.821 . 0 0 "[ . 1]" 1
659 1 64 THR HB 1 67 ILE H 5.500 . 5.500 3.866 2.501 4.309 . 0 0 "[ . 1]" 1
660 1 64 THR MG 1 67 ILE H 6.520 . 6.520 4.050 3.015 4.215 . 0 0 "[ . 1]" 1
661 1 64 THR H 1 67 ILE HA 5.500 . 5.500 5.322 5.138 5.562 0.062 2 0 "[ . 1]" 1
662 1 64 THR H 1 67 ILE H 5.500 . 5.500 3.772 3.552 4.020 . 0 0 "[ . 1]" 1
663 1 64 THR H 1 67 ILE MD 6.520 . 6.520 4.306 3.944 4.893 . 0 0 "[ . 1]" 1
664 1 64 THR H 1 67 ILE HB 5.500 . 5.500 2.476 2.285 2.704 . 0 0 "[ . 1]" 1
665 1 64 THR H 1 68 PHE H 5.500 . 5.500 4.463 4.161 4.828 . 0 0 "[ . 1]" 1
666 1 65 VAL HA 1 66 GLN HB2 5.500 . 5.500 5.598 5.532 5.706 0.206 10 0 "[ . 1]" 1
667 1 65 VAL H 1 66 GLN H 5.500 . 5.500 2.730 2.667 2.821 . 0 0 "[ . 1]" 1
668 1 65 VAL HA 1 67 ILE H 5.500 . 5.500 4.238 4.131 4.469 . 0 0 "[ . 1]" 1
669 1 65 VAL H 1 67 ILE H 5.500 . 5.500 4.227 4.094 4.364 . 0 0 "[ . 1]" 1
670 1 65 VAL HA 1 69 TRP HE1 5.500 . 5.500 5.230 4.975 5.449 . 0 0 "[ . 1]" 1
671 1 65 VAL HB 1 69 TRP HE1 5.500 . 5.500 5.367 4.758 5.596 0.096 3 0 "[ . 1]" 1
672 1 65 VAL HA 1 130 ILE MD 6.520 . 6.520 3.718 3.324 4.285 . 0 0 "[ . 1]" 1
673 1 65 VAL H 1 130 ILE MD 6.520 . 6.520 5.119 4.706 5.667 . 0 0 "[ . 1]" 1
674 1 66 GLN HB2 1 67 ILE H 5.500 . 5.500 3.638 3.505 3.768 . 0 0 "[ . 1]" 1
675 1 66 GLN HB2 1 67 ILE MD 6.520 . 6.520 5.554 5.040 5.899 . 0 0 "[ . 1]" 1
676 1 66 GLN QE 1 67 ILE H 6.200 . 6.200 5.721 5.265 6.200 . 0 0 "[ . 1]" 1
677 1 66 GLN HG3 1 67 ILE H 5.500 . 5.500 4.583 4.093 4.927 . 0 0 "[ . 1]" 1
678 1 66 GLN HG2 1 67 ILE H 5.500 . 5.500 4.733 4.418 4.990 . 0 0 "[ . 1]" 1
679 1 66 GLN HG2 1 67 ILE MD 6.520 . 6.520 5.187 4.621 5.582 . 0 0 "[ . 1]" 1
680 1 66 GLN H 1 67 ILE MD 6.520 . 6.520 5.567 5.083 5.834 . 0 0 "[ . 1]" 1
681 1 66 GLN H 1 67 ILE H 5.500 . 5.500 2.697 2.630 2.748 . 0 0 "[ . 1]" 1
682 1 66 GLN H 1 68 PHE H 5.500 . 5.500 4.297 4.008 4.457 . 0 0 "[ . 1]" 1
683 1 66 GLN HA 1 69 TRP HE1 5.500 . 5.500 4.731 4.157 5.593 0.093 7 0 "[ . 1]" 1
684 1 66 GLN HA 1 69 TRP H 5.500 . 5.500 3.508 3.411 3.643 . 0 0 "[ . 1]" 1
685 1 66 GLN HA 1 69 TRP HD1 5.500 . 5.500 2.567 1.987 3.224 . 0 0 "[ . 1]" 1
686 1 66 GLN HB2 1 69 TRP HD1 5.500 . 5.500 4.974 4.476 5.445 . 0 0 "[ . 1]" 1
687 1 66 GLN QE 1 69 TRP HE1 6.200 . 6.200 5.618 4.196 6.281 0.081 8 0 "[ . 1]" 1
688 1 66 GLN H 1 69 TRP HD1 5.500 . 5.500 4.380 3.991 4.648 . 0 0 "[ . 1]" 1
689 1 66 GLN HG3 1 70 SER H 5.500 . 5.500 4.848 4.163 5.509 0.009 3 0 "[ . 1]" 1
690 1 67 ILE MD 1 68 PHE H 6.520 . 6.520 4.738 4.613 4.879 . 0 0 "[ . 1]" 1
691 1 67 ILE H 1 68 PHE H 5.500 . 5.500 2.688 2.630 2.746 . 0 0 "[ . 1]" 1
692 1 67 ILE H 1 68 PHE HB3 5.500 . 5.500 4.792 4.686 4.990 . 0 0 "[ . 1]" 1
693 1 67 ILE H 1 68 PHE HB2 5.500 . 5.500 4.981 4.681 5.170 . 0 0 "[ . 1]" 1
694 1 67 ILE HA 1 70 SER H 5.500 . 5.500 3.419 3.295 3.538 . 0 0 "[ . 1]" 1
695 1 67 ILE HB 1 70 SER H 5.500 . 5.500 5.561 5.401 5.644 0.144 5 0 "[ . 1]" 1
696 1 67 ILE HB 1 70 SER HB2 5.500 . 5.500 5.309 5.135 5.464 . 0 0 "[ . 1]" 1
697 1 67 ILE MD 1 70 SER H 6.520 . 6.520 4.938 4.674 5.383 . 0 0 "[ . 1]" 1
698 1 67 ILE MD 1 70 SER HB2 6.520 . 6.520 3.585 3.345 4.097 . 0 0 "[ . 1]" 1
699 1 67 ILE HA 1 71 VAL H 5.500 . 5.500 4.036 3.790 4.755 . 0 0 "[ . 1]" 1
700 1 68 PHE HB3 1 69 TRP H 5.500 . 5.500 2.453 2.347 2.504 . 0 0 "[ . 1]" 1
701 1 68 PHE HB2 1 69 TRP H 5.500 . 5.500 3.809 3.642 3.888 . 0 0 "[ . 1]" 1
702 1 68 PHE QD 1 69 TRP HE1 7.630 . 7.630 4.132 3.395 4.970 . 0 0 "[ . 1]" 1
703 1 68 PHE QD 1 69 TRP H 7.630 . 7.630 3.493 3.211 3.694 . 0 0 "[ . 1]" 1
704 1 68 PHE QD 1 69 TRP HZ2 7.630 . 7.630 5.352 4.935 6.105 . 0 0 "[ . 1]" 1
705 1 68 PHE H 1 70 SER H 5.500 . 5.500 4.189 4.075 4.289 . 0 0 "[ . 1]" 1
706 1 68 PHE H 1 71 VAL H 5.500 . 5.500 4.752 4.615 5.062 . 0 0 "[ . 1]" 1
707 1 68 PHE QD 1 126 LEU MD2 8.650 . 8.650 5.123 4.361 6.171 . 0 0 "[ . 1]" 1
708 1 68 PHE QD 1 126 LEU MD1 8.650 . 8.650 3.922 3.492 4.717 . 0 0 "[ . 1]" 1
709 1 68 PHE QD 1 126 LEU QB 8.350 . 8.350 4.383 4.108 4.737 . 0 0 "[ . 1]" 1
710 1 68 PHE QE 1 126 LEU MD2 8.650 . 8.650 3.741 2.913 4.440 . 0 0 "[ . 1]" 1
711 1 68 PHE QE 1 126 LEU MD1 8.650 . 8.650 2.308 1.999 2.850 . 0 0 "[ . 1]" 1
712 1 68 PHE QD 1 127 LEU MD2 8.650 . 8.650 3.841 3.128 4.631 . 0 0 "[ . 1]" 1
713 1 68 PHE QD 1 127 LEU MD1 8.650 . 8.650 5.320 4.810 6.215 . 0 0 "[ . 1]" 1
714 1 68 PHE QE 1 127 LEU H 7.630 . 7.630 5.127 4.576 6.005 . 0 0 "[ . 1]" 1
715 1 68 PHE QB 1 130 ILE MD 7.240 . 7.240 3.982 3.687 4.326 . 0 0 "[ . 1]" 1
716 1 68 PHE QD 1 130 ILE MD 8.650 . 8.650 4.354 3.487 4.961 . 0 0 "[ . 1]" 1
717 1 68 PHE H 1 130 ILE MD 6.520 . 6.520 5.739 5.493 5.998 . 0 0 "[ . 1]" 1
718 1 69 TRP H 1 69 TRP HD1 5.500 . 5.500 2.476 1.976 2.771 . 0 0 "[ . 1]" 1
719 1 69 TRP H 1 69 TRP HE3 5.500 . 5.500 5.216 5.041 5.396 . 0 0 "[ . 1]" 1
720 1 69 TRP HD1 1 70 SER H 5.500 . 5.500 4.590 4.292 4.784 . 0 0 "[ . 1]" 1
721 1 69 TRP HA 1 72 TYR H 5.500 . 5.500 3.643 3.463 3.832 . 0 0 "[ . 1]" 1
722 1 69 TRP HE3 1 72 TYR QD 7.630 . 7.630 4.226 3.101 4.770 . 0 0 "[ . 1]" 1
723 1 69 TRP H 1 72 TYR H 5.500 . 5.500 4.813 4.658 5.018 . 0 0 "[ . 1]" 1
724 1 69 TRP H 1 72 TYR QD 7.630 . 7.630 6.623 6.371 6.972 . 0 0 "[ . 1]" 1
725 1 69 TRP HA 1 73 ASN H 5.500 . 5.500 4.314 4.013 4.751 . 0 0 "[ . 1]" 1
726 1 69 TRP QB 1 73 ASN QD 6.280 . 6.280 3.557 3.255 4.287 . 0 0 "[ . 1]" 1
727 1 69 TRP HE3 1 73 ASN QD 6.200 . 6.200 4.081 3.680 4.642 . 0 0 "[ . 1]" 1
728 1 69 TRP HZ3 1 73 ASN QD 6.200 . 6.200 5.806 5.373 6.133 . 0 0 "[ . 1]" 1
729 1 69 TRP HE1 1 123 LYS QG 6.380 . 6.380 6.189 5.610 6.437 0.057 7 0 "[ . 1]" 1
730 1 69 TRP HH2 1 123 LYS QG 6.380 . 6.380 4.379 3.706 5.644 . 0 0 "[ . 1]" 1
731 1 69 TRP HH2 1 123 LYS QD 6.220 . 6.220 3.553 2.371 4.918 . 0 0 "[ . 1]" 1
732 1 69 TRP HH2 1 123 LYS QE 6.220 . 6.220 4.020 1.934 5.489 . 0 0 "[ . 1]" 1
733 1 69 TRP HZ2 1 123 LYS QE 6.220 . 6.220 5.118 3.255 6.225 0.005 8 0 "[ . 1]" 1
734 1 69 TRP HZ3 1 123 LYS QG 6.380 . 6.380 4.920 4.105 5.751 . 0 0 "[ . 1]" 1
735 1 69 TRP HD1 1 127 LEU QD 7.540 . 7.540 5.028 4.339 5.800 . 0 0 "[ . 1]" 1
736 1 69 TRP HE1 1 127 LEU MD1 6.520 . 6.520 4.706 3.991 5.611 . 0 0 "[ . 1]" 1
737 1 69 TRP HE1 1 127 LEU MD2 6.520 . 6.520 3.544 2.789 4.274 . 0 0 "[ . 1]" 1
738 1 69 TRP HH2 1 127 LEU MD1 6.520 . 6.520 4.429 3.079 5.278 . 0 0 "[ . 1]" 1
739 1 69 TRP HH2 1 127 LEU MD2 6.520 . 6.520 5.389 4.469 5.798 . 0 0 "[ . 1]" 1
740 1 69 TRP HZ2 1 127 LEU MD1 6.520 . 6.520 3.432 2.356 4.320 . 0 0 "[ . 1]" 1
741 1 69 TRP HZ2 1 127 LEU MD2 6.520 . 6.520 3.652 2.771 4.133 . 0 0 "[ . 1]" 1
742 1 69 TRP HD1 1 130 ILE MD 6.520 . 6.520 6.507 6.136 6.685 0.165 6 0 "[ . 1]" 1
743 1 69 TRP HE1 1 130 ILE MD 6.520 . 6.520 6.190 5.853 6.474 . 0 0 "[ . 1]" 1
744 1 70 SER HB3 1 71 VAL H 5.500 . 5.500 3.537 3.457 3.627 . 0 0 "[ . 1]" 1
745 1 70 SER HB3 1 71 VAL HA 5.500 . 5.500 4.441 4.348 4.561 . 0 0 "[ . 1]" 1
746 1 70 SER HB2 1 71 VAL HB 5.500 . 5.500 4.559 3.983 4.968 . 0 0 "[ . 1]" 1
747 1 70 SER HB2 1 71 VAL HA 5.500 . 5.500 4.368 4.202 4.501 . 0 0 "[ . 1]" 1
748 1 70 SER H 1 71 VAL HB 6.500 . 6.500 4.802 4.646 5.021 . 0 0 "[ . 1]" 1
749 1 70 SER HA 1 72 TYR QD 7.630 . 7.630 6.219 6.068 6.461 . 0 0 "[ . 1]" 1
750 1 70 SER H 1 72 TYR QB 6.220 . 6.220 4.818 4.645 5.079 . 0 0 "[ . 1]" 1
751 1 70 SER HA 1 73 ASN HD22 5.500 . 5.500 3.983 3.575 4.418 . 0 0 "[ . 1]" 1
752 1 70 SER HA 1 73 ASN HD21 5.500 . 5.500 2.808 2.231 3.303 . 0 0 "[ . 1]" 1
753 1 70 SER HB3 1 73 ASN QB 6.220 . 6.220 4.643 4.363 4.838 . 0 0 "[ . 1]" 1
754 1 70 SER H 1 73 ASN H 5.500 . 5.500 4.920 4.761 5.229 . 0 0 "[ . 1]" 1
755 1 70 SER HA 1 74 ASN H 5.500 . 5.500 4.546 4.100 5.211 . 0 0 "[ . 1]" 1
756 1 70 SER HA 1 74 ASN HD21 5.500 . 5.500 4.250 3.455 5.520 0.020 9 0 "[ . 1]" 1
757 1 71 VAL HB 1 72 TYR QD 7.630 . 7.630 6.105 5.663 7.139 . 0 0 "[ . 1]" 1
758 1 71 VAL H 1 72 TYR H 5.500 . 5.500 2.698 2.616 2.806 . 0 0 "[ . 1]" 1
759 1 71 VAL H 1 72 TYR QB 6.220 . 6.220 4.338 4.257 4.455 . 0 0 "[ . 1]" 1
760 1 71 VAL HA 1 74 ASN H 5.500 . 5.500 3.437 3.256 3.592 . 0 0 "[ . 1]" 1
761 1 71 VAL HA 1 74 ASN HD22 5.500 . 5.500 4.227 3.485 4.990 . 0 0 "[ . 1]" 1
762 1 71 VAL HA 1 74 ASN HB2 5.500 . 5.500 2.736 2.522 2.964 . 0 0 "[ . 1]" 1
763 1 71 VAL HB 1 74 ASN H 5.500 . 5.500 5.590 5.531 5.679 0.179 4 0 "[ . 1]" 1
764 1 72 TYR HB3 1 73 ASN H 5.500 . 5.500 2.520 2.448 2.610 . 0 0 "[ . 1]" 1
765 1 72 TYR HB2 1 73 ASN H 5.500 . 5.500 3.853 3.827 3.907 . 0 0 "[ . 1]" 1
766 1 72 TYR QD 1 73 ASN QD 8.330 . 8.330 4.463 3.887 4.862 . 0 0 "[ . 1]" 1
767 1 72 TYR H 1 73 ASN HA 5.500 . 5.500 5.411 5.364 5.512 0.012 7 0 "[ . 1]" 1
768 1 72 TYR HA 1 74 ASN HB2 5.500 . 5.500 5.122 4.931 5.391 . 0 0 "[ . 1]" 1
769 1 72 TYR QB 1 74 ASN H 6.220 . 6.220 4.720 4.638 4.821 . 0 0 "[ . 1]" 1
770 1 72 TYR QD 1 74 ASN H 7.630 . 7.630 5.458 5.293 5.636 . 0 0 "[ . 1]" 1
771 1 72 TYR HA 1 75 ILE H 5.500 . 5.500 3.475 3.386 3.608 . 0 0 "[ . 1]" 1
772 1 72 TYR HA 1 75 ILE MD 6.520 . 6.520 2.902 2.229 5.325 . 0 0 "[ . 1]" 1
773 1 72 TYR QD 1 75 ILE MD 8.650 . 8.650 3.774 2.880 6.814 . 0 0 "[ . 1]" 1
774 1 72 TYR H 1 75 ILE MD 6.520 . 6.520 4.617 4.126 6.401 . 0 0 "[ . 1]" 1
775 1 72 TYR QD 1 122 TRP HE1 7.630 . 7.630 6.884 6.169 7.451 . 0 0 "[ . 1]" 1
776 1 72 TYR QD 1 122 TRP HZ2 7.630 . 7.630 4.960 4.051 5.539 . 0 0 "[ . 1]" 1
777 1 72 TYR QE 1 122 TRP HE1 7.630 . 7.630 7.106 6.508 7.371 . 0 0 "[ . 1]" 1
778 1 72 TYR QE 1 122 TRP HD1 7.630 . 7.630 7.384 6.965 7.691 0.061 8 0 "[ . 1]" 1
779 1 72 TYR QD 1 123 LYS H 7.630 . 7.630 6.547 5.486 7.180 . 0 0 "[ . 1]" 1
780 1 72 TYR QD 1 123 LYS QG 8.510 . 8.510 4.597 3.379 5.579 . 0 0 "[ . 1]" 1
781 1 72 TYR QD 1 123 LYS HE2 7.630 . 7.630 4.101 3.243 6.443 . 0 0 "[ . 1]" 1
782 1 72 TYR QD 1 123 LYS HE3 7.630 . 7.630 4.497 3.314 5.209 . 0 0 "[ . 1]" 1
783 1 72 TYR QD 1 123 LYS QD 8.350 . 8.350 4.808 3.436 5.823 . 0 0 "[ . 1]" 1
784 1 72 TYR QE 1 123 LYS H 7.630 . 7.630 5.416 4.495 5.992 . 0 0 "[ . 1]" 1
785 1 72 TYR QE 1 123 LYS QB 8.350 . 8.350 4.323 3.026 5.745 . 0 0 "[ . 1]" 1
786 1 72 TYR QE 1 123 LYS QD 8.360 . 8.360 4.312 2.652 5.557 . 0 0 "[ . 1]" 1
787 1 72 TYR QE 1 123 LYS QE 8.360 . 8.360 3.470 2.777 4.441 . 0 0 "[ . 1]" 1
788 1 72 TYR QB 1 126 LEU QD 8.260 . 8.260 4.982 4.684 5.585 . 0 0 "[ . 1]" 1
789 1 72 TYR QD 1 126 LEU HG 7.630 . 7.630 6.748 5.370 7.612 . 0 0 "[ . 1]" 1
790 1 72 TYR QD 1 126 LEU MD1 8.650 . 8.650 4.839 3.961 6.084 . 0 0 "[ . 1]" 1
791 1 72 TYR QD 1 126 LEU MD2 8.650 . 8.650 6.417 6.002 6.909 . 0 0 "[ . 1]" 1
792 1 72 TYR QE 1 126 LEU MD1 8.650 . 8.650 5.536 4.354 7.138 . 0 0 "[ . 1]" 1
793 1 72 TYR QE 1 126 LEU MD2 8.650 . 8.650 6.979 6.630 7.529 . 0 0 "[ . 1]" 1
794 1 73 ASN HA 1 74 ASN HD21 5.500 . 5.500 5.541 5.463 5.580 0.080 5 0 "[ . 1]" 1
795 1 73 ASN QB 1 74 ASN HD21 6.220 . 6.220 3.325 3.176 3.621 . 0 0 "[ . 1]" 1
796 1 73 ASN H 1 74 ASN H 5.500 . 5.500 2.707 2.656 2.737 . 0 0 "[ . 1]" 1
797 1 73 ASN H 1 74 ASN HA 5.500 . 5.500 5.376 5.329 5.402 . 0 0 "[ . 1]" 1
798 1 73 ASN H 1 74 ASN HB2 5.500 . 5.500 4.625 4.545 4.874 . 0 0 "[ . 1]" 1
799 1 73 ASN QB 1 75 ILE H 6.220 . 6.220 4.699 4.620 4.786 . 0 0 "[ . 1]" 1
800 1 73 ASN H 1 75 ILE H 5.500 . 5.500 4.223 4.143 4.292 . 0 0 "[ . 1]" 1
801 1 74 ASN HB3 1 75 ILE H 5.500 . 5.500 3.457 3.360 3.717 . 0 0 "[ . 1]" 1
802 1 74 ASN H 1 75 ILE MD 6.520 . 6.520 5.333 5.081 5.508 . 0 0 "[ . 1]" 1
803 1 74 ASN H 1 75 ILE H 5.500 . 5.500 2.697 2.648 2.740 . 0 0 "[ . 1]" 1
804 1 75 ILE H 1 76 PRO HD2 5.500 . 5.500 4.950 4.888 5.009 . 0 0 "[ . 1]" 1
805 1 75 ILE H 1 76 PRO HD3 5.500 . 5.500 5.039 4.914 5.105 . 0 0 "[ . 1]" 1
806 1 75 ILE MD 1 87 TYR QE 8.650 . 8.650 3.167 2.043 3.868 . 0 0 "[ . 1]" 1
807 1 75 ILE MD 1 122 TRP HZ2 6.520 . 6.520 4.340 3.613 5.317 . 0 0 "[ . 1]" 1
808 1 77 PRO HA 1 79 THR H 5.500 . 5.500 4.011 3.915 4.111 . 0 0 "[ . 1]" 1
809 1 77 PRO QB 1 79 THR MG 7.240 . 7.240 3.083 1.931 3.431 . 0 0 "[ . 1]" 1
810 1 77 PRO HB3 1 79 THR H 5.500 . 5.500 3.992 3.941 4.047 . 0 0 "[ . 1]" 1
811 1 77 PRO HB2 1 79 THR H 5.500 . 5.500 2.287 2.226 2.414 . 0 0 "[ . 1]" 1
812 1 77 PRO HB3 1 80 SER H 5.500 . 5.500 4.957 4.887 5.147 . 0 0 "[ . 1]" 1
813 1 77 PRO HB2 1 80 SER H 5.500 . 5.500 3.461 3.307 3.594 . 0 0 "[ . 1]" 1
814 1 77 PRO QB 1 81 LEU QD 8.260 . 8.260 4.790 4.269 5.694 . 0 0 "[ . 1]" 1
815 1 78 VAL HA 1 79 THR MG 6.520 . 6.520 4.751 4.640 4.909 . 0 0 "[ . 1]" 1
816 1 78 VAL HB 1 79 THR H 5.500 . 5.500 3.075 3.009 3.150 . 0 0 "[ . 1]" 1
817 1 78 VAL HB 1 79 THR MG 6.520 . 6.520 3.300 2.975 4.380 . 0 0 "[ . 1]" 1
818 1 78 VAL H 1 79 THR H 5.500 . 5.500 2.607 2.504 2.706 . 0 0 "[ . 1]" 1
819 1 78 VAL H 1 79 THR MG 6.520 . 6.520 3.755 3.624 3.870 . 0 0 "[ . 1]" 1
820 1 78 VAL HA 1 80 SER H 5.500 . 5.500 3.617 3.502 3.690 . 0 0 "[ . 1]" 1
821 1 78 VAL HB 1 80 SER H 5.500 . 5.500 4.964 4.910 5.005 . 0 0 "[ . 1]" 1
822 1 78 VAL HA 1 81 LEU H 5.500 . 5.500 3.519 3.163 3.703 . 0 0 "[ . 1]" 1
823 1 78 VAL HA 1 81 LEU MD2 6.520 . 6.520 3.010 1.828 3.945 . 0 0 "[ . 1]" 1
824 1 78 VAL HA 1 81 LEU MD1 6.520 . 6.520 2.330 1.809 4.314 . 0 0 "[ . 1]" 1
825 1 78 VAL HB 1 81 LEU H 5.500 . 5.500 5.621 5.400 5.802 0.302 2 0 "[ . 1]" 1
826 1 78 VAL HA 1 87 TYR QD 7.630 . 7.630 3.913 3.343 4.399 . 0 0 "[ . 1]" 1
827 1 78 VAL HB 1 118 THR H 5.500 . 5.500 5.533 5.375 5.697 0.197 6 0 "[ . 1]" 1
828 1 78 VAL HB 1 118 THR MG 6.520 . 6.520 2.220 2.019 2.709 . 0 0 "[ . 1]" 1
829 1 78 VAL HB 1 119 SER H 5.500 . 5.500 4.025 3.333 4.561 . 0 0 "[ . 1]" 1
830 1 79 THR HB 1 80 SER H 5.500 . 5.500 4.277 4.164 4.363 . 0 0 "[ . 1]" 1
831 1 79 THR MG 1 80 SER H 6.520 . 6.520 3.903 2.454 4.117 . 0 0 "[ . 1]" 1
832 1 79 THR MG 1 80 SER QB 7.240 . 7.240 4.971 2.935 5.442 . 0 0 "[ . 1]" 1
833 1 79 THR H 1 80 SER H 5.500 . 5.500 2.507 2.430 2.633 . 0 0 "[ . 1]" 1
834 1 79 THR H 1 80 SER QB 6.220 . 6.220 4.125 3.930 4.476 . 0 0 "[ . 1]" 1
835 1 79 THR HA 1 81 LEU H 5.500 . 5.500 3.903 3.786 4.140 . 0 0 "[ . 1]" 1
836 1 79 THR MG 1 81 LEU H 6.520 . 6.520 5.114 4.355 5.250 . 0 0 "[ . 1]" 1
837 1 79 THR H 1 81 LEU H 5.500 . 5.500 4.142 4.077 4.249 . 0 0 "[ . 1]" 1
838 1 79 THR H 1 81 LEU HB2 5.500 . 5.500 5.483 5.317 5.626 0.126 9 0 "[ . 1]" 1
839 1 79 THR H 1 81 LEU QD 7.540 . 7.540 4.235 3.645 5.041 . 0 0 "[ . 1]" 1
840 1 79 THR HA 1 118 THR MG 6.520 . 6.520 3.411 2.077 4.826 . 0 0 "[ . 1]" 1
841 1 79 THR MG 1 118 THR H 6.520 . 6.520 3.848 3.005 5.206 . 0 0 "[ . 1]" 1
842 1 79 THR H 1 118 THR MG 6.520 . 6.520 3.521 2.882 5.040 . 0 0 "[ . 1]" 1
843 1 79 THR MG 1 119 SER HB3 6.520 . 6.520 3.362 1.834 4.795 . 0 0 "[ . 1]" 1
844 1 79 THR MG 1 119 SER HB2 6.520 . 6.520 3.711 2.938 4.813 . 0 0 "[ . 1]" 1
845 1 79 THR MG 1 119 SER H 6.520 . 6.520 3.235 2.060 4.045 . 0 0 "[ . 1]" 1
846 1 80 SER HB3 1 81 LEU H 5.500 . 5.500 3.662 2.973 4.237 . 0 0 "[ . 1]" 1
847 1 80 SER HB2 1 81 LEU H 5.500 . 5.500 3.908 3.162 4.454 . 0 0 "[ . 1]" 1
848 1 80 SER H 1 81 LEU H 5.500 . 5.500 2.207 2.139 2.329 . 0 0 "[ . 1]" 1
849 1 80 SER H 1 81 LEU HA 5.500 . 5.500 4.743 4.570 4.884 . 0 0 "[ . 1]" 1
850 1 80 SER H 1 81 LEU HB2 5.500 . 5.500 4.245 4.088 4.574 . 0 0 "[ . 1]" 1
851 1 80 SER H 1 81 LEU HB3 5.500 . 5.500 5.617 5.581 5.651 0.151 3 0 "[ . 1]" 1
852 1 80 SER H 1 81 LEU MD2 6.520 . 6.520 4.295 2.773 4.880 . 0 0 "[ . 1]" 1
853 1 80 SER H 1 81 LEU MD1 6.520 . 6.520 3.875 2.399 4.914 . 0 0 "[ . 1]" 1
854 1 81 LEU HA 1 82 PRO QG 6.390 . 6.390 3.953 3.921 3.973 . 0 0 "[ . 1]" 1
855 1 81 LEU QD 1 82 PRO QG 8.420 . 8.420 4.513 3.614 5.267 . 0 0 "[ . 1]" 1
856 1 81 LEU MD1 1 82 PRO HD2 6.520 . 6.520 4.288 1.973 5.255 . 0 0 "[ . 1]" 1
857 1 81 LEU MD1 1 82 PRO HD3 6.520 . 6.520 4.782 2.978 5.874 . 0 0 "[ . 1]" 1
858 1 81 LEU MD2 1 82 PRO HD2 6.520 . 6.520 3.710 2.057 4.942 . 0 0 "[ . 1]" 1
859 1 81 LEU MD2 1 82 PRO HD3 6.520 . 6.520 4.397 2.695 5.686 . 0 0 "[ . 1]" 1
860 1 81 LEU H 1 82 PRO HD2 5.500 . 5.500 4.967 4.894 5.077 . 0 0 "[ . 1]" 1
861 1 81 LEU HB3 1 83 LEU H 5.500 . 5.500 3.706 3.102 4.071 . 0 0 "[ . 1]" 1
862 1 81 LEU HB2 1 83 LEU H 5.500 . 5.500 4.749 3.674 5.417 . 0 0 "[ . 1]" 1
863 1 81 LEU HB3 1 84 ARG H 5.500 . 5.500 4.997 3.300 5.270 . 0 0 "[ . 1]" 1
864 1 81 LEU HB2 1 85 CYS H 5.500 . 5.500 5.192 4.690 5.674 0.174 4 0 "[ . 1]" 1
865 1 81 LEU QD 1 85 CYS HA 7.540 . 7.540 3.770 3.549 4.026 . 0 0 "[ . 1]" 1
866 1 81 LEU MD1 1 85 CYS HB3 6.520 . 6.520 2.628 1.910 3.715 . 0 0 "[ . 1]" 1
867 1 81 LEU MD1 1 85 CYS H 6.520 . 6.520 4.784 3.379 5.988 . 0 0 "[ . 1]" 1
868 1 81 LEU MD1 1 85 CYS HB2 6.520 . 6.520 3.595 2.418 4.627 . 0 0 "[ . 1]" 1
869 1 81 LEU MD2 1 85 CYS H 6.520 . 6.520 4.459 3.611 5.770 . 0 0 "[ . 1]" 1
870 1 81 LEU MD2 1 85 CYS HB3 6.520 . 6.520 2.123 1.927 3.648 . 0 0 "[ . 1]" 1
871 1 81 LEU MD2 1 85 CYS HB2 6.520 . 6.520 2.985 2.261 4.435 . 0 0 "[ . 1]" 1
872 1 81 LEU H 1 85 CYS HB2 5.500 . 5.500 5.627 5.579 5.688 0.188 8 0 "[ . 1]" 1
873 1 81 LEU QD 1 86 SER HA 7.540 . 7.540 3.171 2.681 4.623 . 0 0 "[ . 1]" 1
874 1 81 LEU MD1 1 86 SER H 6.520 . 6.520 4.950 3.667 6.283 . 0 0 "[ . 1]" 1
875 1 81 LEU MD2 1 86 SER H 6.520 . 6.520 4.581 3.780 5.988 . 0 0 "[ . 1]" 1
876 1 81 LEU QD 1 87 TYR QD 9.660 . 9.660 2.477 2.037 3.495 . 0 0 "[ . 1]" 1
877 1 81 LEU MD1 1 87 TYR QE 8.650 . 8.650 2.227 1.887 3.306 . 0 0 "[ . 1]" 1
878 1 81 LEU MD1 1 87 TYR H 6.520 . 6.520 4.796 3.636 5.872 . 0 0 "[ . 1]" 1
879 1 81 LEU MD2 1 87 TYR QE 8.650 . 8.650 2.268 1.859 2.894 . 0 0 "[ . 1]" 1
880 1 81 LEU MD2 1 87 TYR H 6.520 . 6.520 4.892 3.541 6.240 . 0 0 "[ . 1]" 1
881 1 81 LEU H 1 118 THR MG 6.520 . 6.520 5.820 4.761 6.434 . 0 0 "[ . 1]" 1
882 1 81 LEU QD 1 151 VAL H 7.540 . 7.540 4.502 3.650 5.349 . 0 0 "[ . 1]" 1
883 1 81 LEU MD1 1 151 VAL HB 6.520 . 6.520 3.872 2.399 5.252 . 0 0 "[ . 1]" 1
884 1 81 LEU MD2 1 151 VAL HB 6.520 . 6.520 4.118 2.300 5.451 . 0 0 "[ . 1]" 1
885 1 81 LEU H 1 151 VAL HB 5.500 . 5.500 5.671 5.555 5.870 0.370 1 0 "[ . 1]" 1
886 1 82 PRO HA 1 83 LEU HG 5.500 . 5.500 4.353 3.288 5.466 . 0 0 "[ . 1]" 1
887 1 82 PRO HA 1 83 LEU QB 6.220 . 6.220 4.297 4.033 4.542 . 0 0 "[ . 1]" 1
888 1 82 PRO HD3 1 83 LEU H 5.500 . 5.500 4.095 3.670 4.826 . 0 0 "[ . 1]" 1
889 1 82 PRO HD2 1 83 LEU H 5.500 . 5.500 3.076 2.387 4.232 . 0 0 "[ . 1]" 1
890 1 82 PRO QG 1 83 LEU H 6.390 . 6.390 2.735 1.924 4.524 . 0 0 "[ . 1]" 1
891 1 82 PRO QG 1 84 ARG H 6.390 . 6.390 4.462 2.425 6.380 . 0 0 "[ . 1]" 1
892 1 82 PRO HD2 1 85 CYS H 5.500 . 5.500 4.830 4.371 5.492 . 0 0 "[ . 1]" 1
893 1 82 PRO QG 1 85 CYS H 6.390 . 6.390 5.242 4.668 6.367 . 0 0 "[ . 1]" 1
894 1 82 PRO QG 1 85 CYS HB2 6.390 . 6.390 4.110 3.326 4.975 . 0 0 "[ . 1]" 1
895 1 82 PRO QG 1 85 CYS HB3 6.390 . 6.390 5.345 4.473 6.143 . 0 0 "[ . 1]" 1
896 1 83 LEU H 1 83 LEU HG 5.500 . 5.500 2.972 2.488 4.582 . 0 0 "[ . 1]" 1
897 1 83 LEU QD 1 84 ARG H 7.540 . 7.540 3.180 2.211 3.914 . 0 0 "[ . 1]" 1
898 1 83 LEU QD 1 84 ARG QD 7.740 . 7.740 4.051 3.210 5.526 . 0 0 "[ . 1]" 1
899 1 83 LEU H 1 84 ARG H 5.500 . 5.500 3.142 1.815 4.292 . 0 0 "[ . 1]" 1
900 1 83 LEU H 1 84 ARG QD 6.220 . 6.220 5.748 5.075 6.394 0.174 6 0 "[ . 1]" 1
901 1 83 LEU HA 1 85 CYS H 5.500 . 5.500 3.667 3.428 4.178 . 0 0 "[ . 1]" 1
902 1 83 LEU H 1 85 CYS HB2 5.500 . 5.500 3.806 2.844 5.350 . 0 0 "[ . 1]" 1
903 1 83 LEU H 1 85 CYS HB3 5.500 . 5.500 5.137 4.537 5.642 0.142 9 0 "[ . 1]" 1
904 1 84 ARG QG 1 85 CYS H 6.220 . 6.220 4.493 4.040 4.676 . 0 0 "[ . 1]" 1
905 1 84 ARG H 1 85 CYS HB3 5.500 . 5.500 5.561 4.136 5.794 0.294 6 0 "[ . 1]" 1
906 1 84 ARG H 1 85 CYS H 5.500 . 5.500 2.892 2.172 3.501 . 0 0 "[ . 1]" 1
907 1 84 ARG H 1 85 CYS HB2 5.500 . 5.500 4.191 3.523 4.596 . 0 0 "[ . 1]" 1
908 1 85 CYS HB3 1 86 SER H 5.500 . 5.500 3.743 3.345 4.128 . 0 0 "[ . 1]" 1
909 1 85 CYS HB2 1 86 SER H 5.500 . 5.500 4.558 4.375 4.712 . 0 0 "[ . 1]" 1
910 1 85 CYS H 1 86 SER H 5.500 . 5.500 4.145 3.615 4.543 . 0 0 "[ . 1]" 1
911 1 85 CYS HB3 1 87 TYR H 5.500 . 5.500 5.744 5.657 5.792 0.292 7 0 "[ . 1]" 1
912 1 85 CYS HB3 1 151 VAL HB 5.500 . 5.500 5.149 4.901 5.433 . 0 0 "[ . 1]" 1
913 1 85 CYS H 1 151 VAL HA 6.500 . 6.500 6.580 6.530 6.720 0.220 9 0 "[ . 1]" 1
914 1 85 CYS H 1 151 VAL HB 5.500 . 5.500 4.985 4.695 5.265 . 0 0 "[ . 1]" 1
915 1 86 SER HB3 1 87 TYR H 5.500 . 5.500 3.497 2.953 4.154 . 0 0 "[ . 1]" 1
916 1 86 SER HB2 1 87 TYR H 5.500 . 5.500 3.862 2.917 4.198 . 0 0 "[ . 1]" 1
917 1 86 SER H 1 87 TYR HA 5.500 . 5.500 4.779 4.709 4.905 . 0 0 "[ . 1]" 1
918 1 86 SER H 1 87 TYR H 5.500 . 5.500 4.399 4.384 4.444 . 0 0 "[ . 1]" 1
919 1 86 SER HA 1 149 VAL H 5.500 . 5.500 5.372 4.979 5.634 0.134 10 0 "[ . 1]" 1
920 1 86 SER HA 1 150 SER HA 5.500 . 5.500 3.646 2.505 4.989 . 0 0 "[ . 1]" 1
921 1 86 SER HA 1 151 VAL H 5.500 . 5.500 3.733 3.341 4.226 . 0 0 "[ . 1]" 1
922 1 87 TYR HB3 1 88 HIS H 5.500 . 5.500 3.535 3.440 3.648 . 0 0 "[ . 1]" 1
923 1 87 TYR HB2 1 88 HIS H 5.500 . 5.500 4.386 4.258 4.480 . 0 0 "[ . 1]" 1
924 1 87 TYR QD 1 88 HIS H 7.630 . 7.630 3.952 3.649 4.178 . 0 0 "[ . 1]" 1
925 1 87 TYR QE 1 88 HIS H 7.630 . 7.630 6.012 5.906 6.196 . 0 0 "[ . 1]" 1
926 1 87 TYR H 1 88 HIS H 5.500 . 5.500 4.393 4.367 4.435 . 0 0 "[ . 1]" 1
927 1 87 TYR QD 1 122 TRP HE1 7.630 . 7.630 5.405 3.871 6.212 . 0 0 "[ . 1]" 1
928 1 87 TYR QD 1 122 TRP HD1 7.630 . 7.630 6.423 4.723 7.413 . 0 0 "[ . 1]" 1
929 1 87 TYR QB 1 149 VAL H 6.220 . 6.220 4.428 3.717 5.137 . 0 0 "[ . 1]" 1
930 1 87 TYR QD 1 149 VAL H 7.630 . 7.630 6.116 5.533 6.639 . 0 0 "[ . 1]" 1
931 1 87 TYR H 1 149 VAL H 5.500 . 5.500 3.935 3.454 4.456 . 0 0 "[ . 1]" 1
932 1 87 TYR H 1 151 VAL HB 5.500 . 5.500 5.456 4.992 5.835 0.335 5 0 "[ . 1]" 1
933 1 88 HIS QB 1 89 LEU H 6.380 . 6.380 3.200 2.869 3.692 . 0 0 "[ . 1]" 1
934 1 88 HIS H 1 89 LEU HA 5.500 . 5.500 4.982 4.904 5.040 . 0 0 "[ . 1]" 1
935 1 88 HIS QB 1 90 MET H 6.380 . 6.380 4.943 4.740 5.193 . 0 0 "[ . 1]" 1
936 1 88 HIS QB 1 90 MET ME 7.400 . 7.400 5.058 4.134 6.510 . 0 0 "[ . 1]" 1
937 1 88 HIS HA 1 148 SER H 5.500 . 5.500 5.026 4.798 5.246 . 0 0 "[ . 1]" 1
938 1 88 HIS HA 1 149 VAL H 5.500 . 5.500 3.202 2.800 3.447 . 0 0 "[ . 1]" 1
939 1 89 LEU MD1 1 90 MET H 6.520 . 6.520 3.845 3.043 4.761 . 0 0 "[ . 1]" 1
940 1 89 LEU MD2 1 90 MET H 6.520 . 6.520 4.230 2.954 4.634 . 0 0 "[ . 1]" 1
941 1 89 LEU HG 1 90 MET H 5.500 . 5.500 3.124 2.869 3.876 . 0 0 "[ . 1]" 1
942 1 89 LEU MD1 1 122 TRP HZ2 6.520 . 6.520 3.671 2.639 4.600 . 0 0 "[ . 1]" 1
943 1 89 LEU MD2 1 122 TRP HZ2 6.520 . 6.520 5.248 3.102 6.314 . 0 0 "[ . 1]" 1
944 1 89 LEU QB 1 126 LEU QD 7.830 . 7.830 2.883 2.431 3.249 . 0 0 "[ . 1]" 1
945 1 89 LEU QD 1 126 LEU HA 7.540 . 7.540 3.386 2.886 4.075 . 0 0 "[ . 1]" 1
946 1 89 LEU MD1 1 129 THR MG 7.540 . 7.540 4.629 2.890 5.399 . 0 0 "[ . 1]" 1
947 1 89 LEU MD2 1 129 THR MG 7.540 . 7.540 2.840 2.291 4.181 . 0 0 "[ . 1]" 1
948 1 89 LEU QD 1 130 ILE H 7.540 . 7.540 4.885 4.294 5.873 . 0 0 "[ . 1]" 1
949 1 89 LEU QD 1 130 ILE HA 7.540 . 7.540 5.641 4.993 6.795 . 0 0 "[ . 1]" 1
950 1 89 LEU MD1 1 130 ILE MD 7.540 . 7.540 5.490 4.602 7.147 . 0 0 "[ . 1]" 1
951 1 89 LEU MD2 1 130 ILE MD 7.540 . 7.540 5.038 4.343 5.666 . 0 0 "[ . 1]" 1
952 1 89 LEU QB 1 147 VAL H 6.220 . 6.220 2.443 2.081 3.075 . 0 0 "[ . 1]" 1
953 1 89 LEU QD 1 147 VAL H 7.540 . 7.540 3.348 2.835 4.320 . 0 0 "[ . 1]" 1
954 1 89 LEU MD1 1 147 VAL HB 6.520 . 6.520 5.523 3.553 6.396 . 0 0 "[ . 1]" 1
955 1 89 LEU MD2 1 147 VAL HB 6.520 . 6.520 4.224 2.960 5.522 . 0 0 "[ . 1]" 1
956 1 89 LEU H 1 147 VAL H 5.500 . 5.500 3.075 2.625 3.559 . 0 0 "[ . 1]" 1
957 1 89 LEU H 1 148 SER HA 5.500 . 5.500 3.063 2.575 3.420 . 0 0 "[ . 1]" 1
958 1 89 LEU H 1 149 VAL H 5.500 . 5.500 4.889 4.500 5.225 . 0 0 "[ . 1]" 1
959 1 90 MET H 1 90 MET ME 6.520 . 6.520 5.150 3.965 5.693 . 0 0 "[ . 1]" 1
960 1 90 MET ME 1 91 ARG H 6.520 . 6.520 4.424 3.021 5.032 . 0 0 "[ . 1]" 1
961 1 90 MET ME 1 94 ARG H 6.520 . 6.520 5.847 4.941 6.503 . 0 0 "[ . 1]" 1
962 1 90 MET ME 1 145 ILE MD 7.540 . 7.540 3.037 1.798 4.073 . 0 0 "[ . 1]" 1
963 1 90 MET ME 1 145 ILE HB 6.520 . 6.520 4.040 2.680 4.860 . 0 0 "[ . 1]" 1
964 1 90 MET HA 1 146 GLY H 5.500 . 5.500 5.162 4.690 5.600 0.100 9 0 "[ . 1]" 1
965 1 90 MET ME 1 146 GLY H 6.520 . 6.520 5.460 3.946 6.342 . 0 0 "[ . 1]" 1
966 1 90 MET ME 1 146 GLY QA 7.240 . 7.240 3.867 2.081 4.604 . 0 0 "[ . 1]" 1
967 1 90 MET H 1 146 GLY QA 6.220 . 6.220 4.620 4.317 4.982 . 0 0 "[ . 1]" 1
968 1 90 MET HA 1 147 VAL H 5.500 . 5.500 3.882 3.463 4.203 . 0 0 "[ . 1]" 1
969 1 90 MET ME 1 147 VAL H 6.520 . 6.520 5.289 3.331 6.197 . 0 0 "[ . 1]" 1
970 1 90 MET H 1 147 VAL H 5.500 . 5.500 4.973 4.777 5.152 . 0 0 "[ . 1]" 1
971 1 90 MET ME 1 161 TRP HD1 6.520 . 6.520 4.989 3.913 6.083 . 0 0 "[ . 1]" 1
972 1 91 ARG H 1 93 GLU H 5.500 . 5.500 3.911 3.634 5.129 . 0 0 "[ . 1]" 1
973 1 91 ARG H 1 93 GLU QG 6.380 . 6.380 4.732 3.512 5.513 . 0 0 "[ . 1]" 1
974 1 91 ARG H 1 93 GLU QB 6.220 . 6.220 3.683 3.365 4.441 . 0 0 "[ . 1]" 1
975 1 91 ARG H 1 145 ILE MD 6.520 . 6.520 5.701 5.223 6.373 . 0 0 "[ . 1]" 1
976 1 91 ARG H 1 146 GLY HA2 5.500 . 5.500 3.585 2.890 4.023 . 0 0 "[ . 1]" 1
977 1 91 ARG H 1 146 GLY H 5.500 . 5.500 5.122 4.638 5.452 . 0 0 "[ . 1]" 1
978 1 91 ARG H 1 146 GLY HA3 5.500 . 5.500 3.492 3.018 3.705 . 0 0 "[ . 1]" 1
979 1 91 ARG H 1 147 VAL H 5.500 . 5.500 5.269 4.396 5.612 0.112 8 0 "[ . 1]" 1
980 1 92 GLY H 1 93 GLU H 5.500 . 5.500 3.092 2.813 4.198 . 0 0 "[ . 1]" 1
981 1 92 GLY HA3 1 94 ARG H 5.500 . 5.500 5.062 4.673 5.678 0.178 9 0 "[ . 1]" 1
982 1 92 GLY HA2 1 94 ARG H 5.500 . 5.500 5.245 4.907 5.527 0.027 7 0 "[ . 1]" 1
983 1 93 GLU HB3 1 94 ARG H 5.500 . 5.500 4.444 4.328 4.587 . 0 0 "[ . 1]" 1
984 1 93 GLU HB2 1 94 ARG H 5.500 . 5.500 4.230 3.693 4.641 . 0 0 "[ . 1]" 1
985 1 93 GLU QG 1 94 ARG H 6.380 . 6.380 3.957 3.202 4.394 . 0 0 "[ . 1]" 1
986 1 93 GLU H 1 94 ARG H 5.500 . 5.500 4.295 4.170 4.427 . 0 0 "[ . 1]" 1
987 1 93 GLU QB 1 95 ARG QB 7.100 . 7.100 5.747 4.903 6.267 . 0 0 "[ . 1]" 1
988 1 93 GLU QG 1 95 ARG H 6.380 . 6.380 5.935 4.438 6.450 0.070 1 0 "[ . 1]" 1
989 1 93 GLU HB3 1 145 ILE MD 6.520 . 6.520 4.737 3.747 5.550 . 0 0 "[ . 1]" 1
990 1 93 GLU HB2 1 145 ILE MD 6.520 . 6.520 4.113 3.528 4.611 . 0 0 "[ . 1]" 1
991 1 93 GLU QG 1 145 ILE MD 7.400 . 7.400 4.057 2.192 5.953 . 0 0 "[ . 1]" 1
992 1 93 GLU H 1 145 ILE MD 6.520 . 6.520 6.122 5.846 6.465 . 0 0 "[ . 1]" 1
993 1 93 GLU H 1 145 ILE HB 5.500 . 5.500 5.543 5.273 5.679 0.179 6 0 "[ . 1]" 1
994 1 94 ARG HB3 1 95 ARG H 5.500 . 5.500 2.636 2.244 4.234 . 0 0 "[ . 1]" 1
995 1 94 ARG HB2 1 95 ARG H 5.500 . 5.500 3.754 3.444 4.381 . 0 0 "[ . 1]" 1
996 1 94 ARG H 1 95 ARG H 5.500 . 5.500 4.576 4.254 4.690 . 0 0 "[ . 1]" 1
997 1 94 ARG QB 1 145 ILE MD 7.240 . 7.240 6.565 6.384 6.996 . 0 0 "[ . 1]" 1
998 1 94 ARG H 1 145 ILE MD 6.520 . 6.520 5.724 5.397 6.410 . 0 0 "[ . 1]" 1
999 1 94 ARG H 1 145 ILE HB 5.500 . 5.500 5.487 5.154 5.681 0.181 9 0 "[ . 1]" 1
1000 1 95 ARG H 1 97 LEU MD1 6.520 . 6.520 5.853 5.608 6.146 . 0 0 "[ . 1]" 1
1001 1 95 ARG H 1 100 GLU QG 6.380 . 6.380 6.303 5.943 6.540 0.160 8 0 "[ . 1]" 1
1002 1 96 PRO HA 1 97 LEU MD1 6.520 . 6.520 3.523 2.564 4.151 . 0 0 "[ . 1]" 1
1003 1 96 PRO HA 1 97 LEU MD2 6.520 . 6.520 2.642 2.295 4.035 . 0 0 "[ . 1]" 1
1004 1 97 LEU HA 1 98 TRP HE1 5.500 . 5.500 5.219 4.984 5.407 . 0 0 "[ . 1]" 1
1005 1 97 LEU HB3 1 98 TRP H 5.500 . 5.500 4.250 4.039 4.425 . 0 0 "[ . 1]" 1
1006 1 97 LEU HB3 1 98 TRP HD1 5.500 . 5.500 3.510 2.470 4.257 . 0 0 "[ . 1]" 1
1007 1 97 LEU HB2 1 98 TRP H 5.500 . 5.500 4.419 4.135 4.489 . 0 0 "[ . 1]" 1
1008 1 97 LEU HB2 1 98 TRP HD1 5.500 . 5.500 4.521 3.305 5.144 . 0 0 "[ . 1]" 1
1009 1 97 LEU MD1 1 98 TRP H 6.520 . 6.520 4.056 3.905 4.723 . 0 0 "[ . 1]" 1
1010 1 97 LEU MD1 1 98 TRP HD1 6.520 . 6.520 4.513 4.114 5.694 . 0 0 "[ . 1]" 1
1011 1 97 LEU MD2 1 98 TRP H 6.520 . 6.520 4.675 4.094 4.876 . 0 0 "[ . 1]" 1
1012 1 97 LEU H 1 98 TRP HA 5.500 . 5.500 5.506 5.292 5.693 0.193 5 0 "[ . 1]" 1
1013 1 97 LEU H 1 98 TRP H 5.500 . 5.500 3.821 3.566 4.123 . 0 0 "[ . 1]" 1
1014 1 97 LEU HA 1 99 GLU H 5.500 . 5.500 4.107 4.051 4.174 . 0 0 "[ . 1]" 1
1015 1 97 LEU QB 1 99 GLU H 6.220 . 6.220 4.095 3.917 4.615 . 0 0 "[ . 1]" 1
1016 1 97 LEU MD1 1 99 GLU H 6.520 . 6.520 5.121 4.651 5.239 . 0 0 "[ . 1]" 1
1017 1 97 LEU MD2 1 99 GLU H 6.520 . 6.520 4.423 3.197 4.790 . 0 0 "[ . 1]" 1
1018 1 97 LEU MD1 1 100 GLU H 6.520 . 6.520 6.424 5.990 6.531 0.011 5 0 "[ . 1]" 1
1019 1 97 LEU MD1 1 100 GLU QG 7.400 . 7.400 6.821 6.250 7.596 0.196 2 0 "[ . 1]" 1
1020 1 97 LEU MD2 1 100 GLU QG 7.400 . 7.400 5.889 5.045 7.360 . 0 0 "[ . 1]" 1
1021 1 97 LEU MD2 1 100 GLU HB2 6.520 . 6.520 6.456 6.096 6.577 0.057 5 0 "[ . 1]" 1
1022 1 97 LEU H 1 100 GLU H 5.500 . 5.500 4.543 4.184 4.939 . 0 0 "[ . 1]" 1
1023 1 98 TRP H 1 98 TRP HD1 5.500 . 5.500 3.685 3.434 4.041 . 0 0 "[ . 1]" 1
1024 1 98 TRP HE3 1 99 GLU HA 6.500 . 6.500 6.006 4.090 6.552 0.052 3 0 "[ . 1]" 1
1025 1 98 TRP H 1 99 GLU H 5.500 . 5.500 2.861 2.796 3.030 . 0 0 "[ . 1]" 1
1026 1 98 TRP H 1 99 GLU HA 5.500 . 5.500 5.489 5.448 5.587 0.087 5 0 "[ . 1]" 1
1027 1 98 TRP QB 1 104 ALA H 6.520 . 6.520 6.566 6.130 6.782 0.262 2 0 "[ . 1]" 1
1028 1 98 TRP HB3 1 104 ALA MB 6.520 . 6.520 4.903 4.372 5.516 . 0 0 "[ . 1]" 1
1029 1 98 TRP HB2 1 104 ALA MB 6.520 . 6.520 5.677 3.951 6.560 0.040 6 0 "[ . 1]" 1
1030 1 98 TRP HE3 1 104 ALA MB 6.520 . 6.520 3.403 2.472 5.048 . 0 0 "[ . 1]" 1
1031 1 98 TRP H 1 104 ALA MB 6.520 . 6.520 5.521 4.853 6.271 . 0 0 "[ . 1]" 1
1032 1 98 TRP HZ3 1 104 ALA MB 6.520 . 6.520 3.859 2.160 6.676 0.156 5 0 "[ . 1]" 1
1033 1 99 GLU QB 1 100 GLU QG 7.100 . 7.100 3.695 2.871 5.339 . 0 0 "[ . 1]" 1
1034 1 99 GLU HB3 1 100 GLU H 5.500 . 5.500 3.294 2.808 3.787 . 0 0 "[ . 1]" 1
1035 1 99 GLU HB2 1 100 GLU H 5.500 . 5.500 3.442 2.829 4.019 . 0 0 "[ . 1]" 1
1036 1 99 GLU QG 1 100 GLU H 6.220 . 6.220 4.012 3.757 4.338 . 0 0 "[ . 1]" 1
1037 1 99 GLU H 1 100 GLU H 5.500 . 5.500 2.142 2.071 2.221 . 0 0 "[ . 1]" 1
1038 1 99 GLU H 1 100 GLU HB2 5.500 . 5.500 4.002 3.762 4.204 . 0 0 "[ . 1]" 1
1039 1 99 GLU QB 1 101 GLU H 6.220 . 6.220 5.533 5.113 5.803 . 0 0 "[ . 1]" 1
1040 1 99 GLU HA 1 104 ALA MB 6.520 . 6.520 5.930 5.333 6.371 . 0 0 "[ . 1]" 1
1041 1 99 GLU H 1 104 ALA MB 6.520 . 6.520 5.561 4.993 6.246 . 0 0 "[ . 1]" 1
1042 1 100 GLU HB2 1 101 GLU H 5.500 . 5.500 4.566 4.378 4.704 . 0 0 "[ . 1]" 1
1043 1 100 GLU H 1 101 GLU H 5.500 . 5.500 4.337 4.237 4.443 . 0 0 "[ . 1]" 1
1044 1 100 GLU HB3 1 102 SER H 5.500 . 5.500 3.302 2.810 3.652 . 0 0 "[ . 1]" 1
1045 1 100 GLU HB3 1 102 SER HA 5.500 . 5.500 5.443 5.251 5.682 0.182 2 0 "[ . 1]" 1
1046 1 100 GLU HB2 1 102 SER H 5.500 . 5.500 4.639 3.867 5.061 . 0 0 "[ . 1]" 1
1047 1 100 GLU HB3 1 103 ASN HD22 5.500 . 5.500 4.729 3.027 5.585 0.085 2 0 "[ . 1]" 1
1048 1 100 GLU HB3 1 103 ASN HD21 5.500 . 5.500 3.619 1.958 5.409 . 0 0 "[ . 1]" 1
1049 1 100 GLU HB3 1 103 ASN H 5.500 . 5.500 2.893 2.304 3.510 . 0 0 "[ . 1]" 1
1050 1 100 GLU HB2 1 103 ASN H 5.500 . 5.500 3.826 3.155 4.681 . 0 0 "[ . 1]" 1
1051 1 100 GLU HB2 1 103 ASN QD 6.200 . 6.200 3.138 1.934 4.664 . 0 0 "[ . 1]" 1
1052 1 100 GLU H 1 103 ASN H 5.500 . 5.500 5.165 4.785 5.391 . 0 0 "[ . 1]" 1
1053 1 100 GLU H 1 103 ASN QD 6.200 . 6.200 4.097 2.154 4.933 . 0 0 "[ . 1]" 1
1054 1 100 GLU HB3 1 104 ALA H 5.500 . 5.500 4.325 3.437 5.306 . 0 0 "[ . 1]" 1
1055 1 100 GLU HB2 1 104 ALA MB 6.520 . 6.520 5.254 4.633 6.184 . 0 0 "[ . 1]" 1
1056 1 100 GLU H 1 104 ALA H 5.500 . 5.500 5.081 4.625 5.520 0.020 6 0 "[ . 1]" 1
1057 1 100 GLU H 1 104 ALA MB 6.520 . 6.520 4.967 4.461 5.510 . 0 0 "[ . 1]" 1
1058 1 101 GLU HG2 1 102 SER H 5.500 . 5.500 3.440 2.478 4.162 . 0 0 "[ . 1]" 1
1059 1 101 GLU HG2 1 102 SER HA 5.500 . 5.500 3.989 3.385 4.607 . 0 0 "[ . 1]" 1
1060 1 101 GLU H 1 102 SER H 5.500 . 5.500 2.820 2.730 2.974 . 0 0 "[ . 1]" 1
1061 1 101 GLU HG2 1 103 ASN H 5.500 . 5.500 5.475 4.968 5.829 0.329 9 0 "[ . 1]" 1
1062 1 101 GLU HA 1 104 ALA MB 6.520 . 6.520 2.642 2.107 3.374 . 0 0 "[ . 1]" 1
1063 1 101 GLU HA 1 104 ALA H 5.500 . 5.500 3.626 3.431 3.856 . 0 0 "[ . 1]" 1
1064 1 101 GLU HB3 1 104 ALA MB 6.520 . 6.520 4.979 4.239 5.865 . 0 0 "[ . 1]" 1
1065 1 101 GLU HB2 1 104 ALA MB 6.520 . 6.520 4.561 3.662 5.386 . 0 0 "[ . 1]" 1
1066 1 101 GLU HG3 1 104 ALA MB 6.520 . 6.520 4.228 3.332 5.344 . 0 0 "[ . 1]" 1
1067 1 101 GLU HG2 1 104 ALA MB 6.520 . 6.520 4.831 3.647 5.891 . 0 0 "[ . 1]" 1
1068 1 101 GLU H 1 104 ALA MB 6.520 . 6.520 4.746 4.094 5.310 . 0 0 "[ . 1]" 1
1069 1 101 GLU HA 1 105 LYS H 5.500 . 5.500 4.819 4.372 5.300 . 0 0 "[ . 1]" 1
1070 1 101 GLU HG3 1 105 LYS H 5.500 . 5.500 5.564 4.989 5.799 0.299 5 0 "[ . 1]" 1
1071 1 102 SER H 1 103 ASN H 5.500 . 5.500 2.880 2.805 2.976 . 0 0 "[ . 1]" 1
1072 1 102 SER H 1 104 ALA MB 6.520 . 6.520 4.654 4.161 5.297 . 0 0 "[ . 1]" 1
1073 1 102 SER H 1 104 ALA H 5.500 . 5.500 4.198 3.826 4.497 . 0 0 "[ . 1]" 1
1074 1 102 SER HA 1 105 LYS H 5.500 . 5.500 3.774 3.478 4.328 . 0 0 "[ . 1]" 1
1075 1 102 SER HA 1 105 LYS QB 6.220 . 6.220 3.453 3.094 4.016 . 0 0 "[ . 1]" 1
1076 1 102 SER QB 1 167 LEU QD 8.260 . 8.260 4.783 3.792 6.439 . 0 0 "[ . 1]" 1
1077 1 103 ASN QB 1 104 ALA MB 7.240 . 7.240 3.975 3.672 4.733 . 0 0 "[ . 1]" 1
1078 1 103 ASN HD21 1 104 ALA H 5.500 . 5.500 4.094 3.556 4.317 . 0 0 "[ . 1]" 1
1079 1 103 ASN HD22 1 104 ALA H 5.500 . 5.500 5.054 3.551 5.732 0.232 7 0 "[ . 1]" 1
1080 1 103 ASN H 1 104 ALA H 5.500 . 5.500 2.535 1.838 2.944 . 0 0 "[ . 1]" 1
1081 1 103 ASN H 1 104 ALA HA 5.500 . 5.500 5.205 4.574 5.568 0.068 2 0 "[ . 1]" 1
1082 1 103 ASN H 1 104 ALA MB 6.520 . 6.520 4.026 3.335 4.415 . 0 0 "[ . 1]" 1
1083 1 103 ASN HA 1 105 LYS H 5.500 . 5.500 3.876 3.670 4.044 . 0 0 "[ . 1]" 1
1084 1 103 ASN QD 1 105 LYS H 6.200 . 6.200 5.676 4.915 6.083 . 0 0 "[ . 1]" 1
1085 1 103 ASN HB3 1 106 GLY H 5.500 . 5.500 5.405 5.050 5.579 0.079 2 0 "[ . 1]" 1
1086 1 103 ASN HB2 1 106 GLY H 5.500 . 5.500 5.543 5.223 5.820 0.320 2 0 "[ . 1]" 1
1087 1 103 ASN QD 1 106 GLY H 6.200 . 6.200 5.990 5.315 6.406 0.206 6 0 "[ . 1]" 1
1088 1 104 ALA MB 1 105 LYS H 6.520 . 6.520 2.781 2.529 3.053 . 0 0 "[ . 1]" 1
1089 1 104 ALA MB 1 105 LYS QE 7.400 . 7.400 3.774 3.125 5.102 . 0 0 "[ . 1]" 1
1090 1 104 ALA H 1 105 LYS H 5.500 . 5.500 2.712 2.657 2.773 . 0 0 "[ . 1]" 1
1091 1 104 ALA H 1 105 LYS QE 6.380 . 6.380 5.884 5.326 6.387 0.007 6 0 "[ . 1]" 1
1092 1 104 ALA H 1 105 LYS QD 6.220 . 6.220 4.831 3.880 5.873 . 0 0 "[ . 1]" 1
1093 1 104 ALA MB 1 106 GLY H 6.520 . 6.520 4.652 4.450 4.773 . 0 0 "[ . 1]" 1
1094 1 104 ALA H 1 106 GLY H 5.500 . 5.500 4.348 4.134 4.508 . 0 0 "[ . 1]" 1
1095 1 105 LYS HB3 1 106 GLY H 5.500 . 5.500 3.812 3.361 4.435 . 0 0 "[ . 1]" 1
1096 1 105 LYS HB2 1 106 GLY H 5.500 . 5.500 3.065 2.487 4.270 . 0 0 "[ . 1]" 1
1097 1 105 LYS HD3 1 106 GLY H 5.500 . 5.500 5.268 4.812 5.643 0.143 10 0 "[ . 1]" 1
1098 1 105 LYS HD2 1 106 GLY H 5.500 . 5.500 5.135 4.524 5.618 0.118 9 0 "[ . 1]" 1
1099 1 105 LYS H 1 106 GLY HA2 5.500 . 5.500 4.567 4.356 4.782 . 0 0 "[ . 1]" 1
1100 1 105 LYS H 1 106 GLY H 5.500 . 5.500 2.478 2.268 2.820 . 0 0 "[ . 1]" 1
1101 1 105 LYS QB 1 107 GLY H 6.220 . 6.220 5.047 4.392 6.282 0.062 10 0 "[ . 1]" 1
1102 1 105 LYS QG 1 164 ASN QB 6.940 . 6.940 4.123 3.204 5.898 . 0 0 "[ . 1]" 1
1103 1 105 LYS H 1 164 ASN QB 6.220 . 6.220 4.527 3.783 5.309 . 0 0 "[ . 1]" 1
1104 1 105 LYS HA 1 165 ALA H 5.500 . 5.500 4.138 3.787 4.505 . 0 0 "[ . 1]" 1
1105 1 105 LYS QB 1 165 ALA H 6.220 . 6.220 2.255 1.775 3.415 . 0 0 "[ . 1]" 1
1106 1 105 LYS QB 1 165 ALA MB 7.240 . 7.240 2.783 1.949 3.954 . 0 0 "[ . 1]" 1
1107 1 105 LYS QD 1 165 ALA MB 7.240 . 7.240 4.550 3.641 6.048 . 0 0 "[ . 1]" 1
1108 1 105 LYS H 1 165 ALA H 5.500 . 5.500 4.418 3.868 5.247 . 0 0 "[ . 1]" 1
1109 1 105 LYS HA 1 166 SER H 5.500 . 5.500 4.741 4.239 5.489 . 0 0 "[ . 1]" 1
1110 1 105 LYS QB 1 166 SER H 6.220 . 6.220 2.426 1.974 3.568 . 0 0 "[ . 1]" 1
1111 1 105 LYS H 1 166 SER H 6.500 . 6.500 5.459 4.985 6.308 . 0 0 "[ . 1]" 1
1112 1 105 LYS QB 1 167 LEU QD 8.260 . 8.260 5.259 4.826 5.835 . 0 0 "[ . 1]" 1
1113 1 105 LYS QB 1 194 HIS H 6.220 . 6.220 5.576 5.041 6.339 0.119 6 0 "[ . 1]" 1
1114 1 106 GLY H 1 107 GLY H 5.500 . 5.500 4.009 3.661 4.720 . 0 0 "[ . 1]" 1
1115 1 106 GLY HA3 1 165 ALA MB 6.520 . 6.520 3.930 3.583 4.366 . 0 0 "[ . 1]" 1
1116 1 106 GLY HA2 1 165 ALA H 5.500 . 5.500 3.781 2.210 4.311 . 0 0 "[ . 1]" 1
1117 1 106 GLY HA2 1 165 ALA MB 6.520 . 6.520 3.882 3.010 4.349 . 0 0 "[ . 1]" 1
1118 1 106 GLY H 1 165 ALA H 5.500 . 5.500 3.462 2.940 4.327 . 0 0 "[ . 1]" 1
1119 1 106 GLY H 1 165 ALA MB 6.520 . 6.520 3.777 3.185 4.385 . 0 0 "[ . 1]" 1
1120 1 106 GLY HA2 1 166 SER H 6.500 . 6.500 5.946 4.364 6.529 0.029 7 0 "[ . 1]" 1
1121 1 106 GLY H 1 166 SER H 5.500 . 5.500 5.294 4.842 6.020 0.520 10 1 "[ . +]" 1
1122 1 106 GLY H 1 194 HIS H 5.500 . 5.500 5.329 4.324 5.582 0.082 3 0 "[ . 1]" 1
1123 1 107 GLY H 1 108 VAL H 5.500 . 5.500 4.545 4.494 4.598 . 0 0 "[ . 1]" 1
1124 1 107 GLY H 1 108 VAL HA 5.500 . 5.500 5.191 4.959 5.331 . 0 0 "[ . 1]" 1
1125 1 107 GLY H 1 145 ILE MD 6.520 . 6.520 4.871 4.472 5.305 . 0 0 "[ . 1]" 1
1126 1 107 GLY H 1 161 TRP HA 5.500 . 5.500 5.635 5.468 5.793 0.293 5 0 "[ . 1]" 1
1127 1 107 GLY QA 1 162 ASN QD 6.500 . 6.500 3.444 1.870 5.736 . 0 0 "[ . 1]" 1
1128 1 107 GLY H 1 162 ASN H 5.500 . 5.500 3.873 3.612 4.083 . 0 0 "[ . 1]" 1
1129 1 107 GLY H 1 162 ASN QD 6.200 . 6.200 4.570 3.698 5.610 . 0 0 "[ . 1]" 1
1130 1 107 GLY H 1 163 VAL H 5.500 . 5.500 4.812 4.538 5.329 . 0 0 "[ . 1]" 1
1131 1 107 GLY H 1 164 ASN H 5.500 . 5.500 3.852 3.532 4.322 . 0 0 "[ . 1]" 1
1132 1 107 GLY QA 1 165 ALA H 6.220 . 6.220 3.589 3.215 4.134 . 0 0 "[ . 1]" 1
1133 1 107 GLY HA3 1 165 ALA MB 6.520 . 6.520 2.624 2.112 3.182 . 0 0 "[ . 1]" 1
1134 1 107 GLY HA2 1 165 ALA MB 6.520 . 6.520 1.954 1.783 2.242 . 0 0 "[ . 1]" 1
1135 1 107 GLY H 1 165 ALA H 5.500 . 5.500 3.705 3.599 3.976 . 0 0 "[ . 1]" 1
1136 1 107 GLY H 1 165 ALA HA 5.500 . 5.500 4.014 3.313 4.372 . 0 0 "[ . 1]" 1
1137 1 107 GLY H 1 165 ALA MB 6.520 . 6.520 3.453 3.182 3.768 . 0 0 "[ . 1]" 1
1138 1 107 GLY H 1 166 SER H 5.500 . 5.500 5.764 5.579 5.855 0.355 8 0 "[ . 1]" 1
1139 1 107 GLY QA 1 192 LYS H 6.220 . 6.220 5.425 5.119 5.708 . 0 0 "[ . 1]" 1
1140 1 107 GLY QA 1 194 HIS H 6.220 . 6.220 3.363 2.767 4.247 . 0 0 "[ . 1]" 1
1141 1 107 GLY H 1 194 HIS H 5.500 . 5.500 5.076 4.619 5.507 0.007 1 0 "[ . 1]" 1
1142 1 107 GLY H 1 194 HIS QB 6.220 . 6.220 4.152 3.750 4.997 . 0 0 "[ . 1]" 1
1143 1 108 VAL HB 1 109 TRP H 5.500 . 5.500 3.357 2.873 4.192 . 0 0 "[ . 1]" 1
1144 1 108 VAL H 1 109 TRP HE1 5.500 . 5.500 5.559 5.199 5.685 0.185 8 0 "[ . 1]" 1
1145 1 108 VAL H 1 109 TRP H 5.500 . 5.500 4.359 4.304 4.415 . 0 0 "[ . 1]" 1
1146 1 108 VAL HA 1 110 LYS H 5.500 . 5.500 5.776 5.722 5.818 0.318 7 0 "[ . 1]" 1
1147 1 108 VAL HB 1 110 LYS HB2 5.500 . 5.500 4.880 4.577 5.414 . 0 0 "[ . 1]" 1
1148 1 108 VAL HA 1 162 ASN H 5.500 . 5.500 2.720 2.542 2.952 . 0 0 "[ . 1]" 1
1149 1 108 VAL H 1 162 ASN H 5.500 . 5.500 4.544 4.372 4.753 . 0 0 "[ . 1]" 1
1150 1 108 VAL H 1 165 ALA MB 6.520 . 6.520 3.653 3.276 4.109 . 0 0 "[ . 1]" 1
1151 1 108 VAL H 1 168 VAL HB 5.500 . 5.500 5.490 4.960 5.805 0.305 10 0 "[ . 1]" 1
1152 1 108 VAL H 1 192 LYS HA 5.500 . 5.500 5.465 5.187 5.653 0.153 7 0 "[ . 1]" 1
1153 1 108 VAL H 1 192 LYS QE 6.380 . 6.380 5.657 4.604 6.272 . 0 0 "[ . 1]" 1
1154 1 108 VAL H 1 192 LYS QG 6.380 . 6.380 5.170 3.853 6.154 . 0 0 "[ . 1]" 1
1155 1 108 VAL H 1 192 LYS H 5.500 . 5.500 3.803 3.504 4.045 . 0 0 "[ . 1]" 1
1156 1 108 VAL H 1 192 LYS QD 6.220 . 6.220 5.805 5.393 6.082 . 0 0 "[ . 1]" 1
1157 1 108 VAL H 1 194 HIS H 5.500 . 5.500 4.668 4.302 5.257 . 0 0 "[ . 1]" 1
1158 1 109 TRP HD1 1 110 LYS H 5.500 . 5.500 4.413 4.224 4.696 . 0 0 "[ . 1]" 1
1159 1 109 TRP QB 1 111 MET ME 7.240 . 7.240 3.484 2.977 3.927 . 0 0 "[ . 1]" 1
1160 1 109 TRP HH2 1 138 ALA MB 6.520 . 6.520 3.268 2.857 3.656 . 0 0 "[ . 1]" 1
1161 1 109 TRP HH2 1 144 ILE H 6.500 . 6.500 6.603 6.485 6.683 0.183 7 0 "[ . 1]" 1
1162 1 109 TRP HH2 1 144 ILE MD 6.520 . 6.520 3.763 2.841 4.844 . 0 0 "[ . 1]" 1
1163 1 109 TRP QB 1 160 VAL H 6.220 . 6.220 2.956 2.668 3.183 . 0 0 "[ . 1]" 1
1164 1 109 TRP H 1 160 VAL HB 5.500 . 5.500 3.216 2.887 3.580 . 0 0 "[ . 1]" 1
1165 1 109 TRP H 1 160 VAL H 5.500 . 5.500 2.739 2.614 2.858 . 0 0 "[ . 1]" 1
1166 1 109 TRP H 1 161 TRP HA 5.500 . 5.500 4.161 3.945 4.292 . 0 0 "[ . 1]" 1
1167 1 109 TRP H 1 162 ASN H 5.500 . 5.500 4.561 4.239 4.803 . 0 0 "[ . 1]" 1
1168 1 109 TRP HH2 1 163 VAL H 5.500 . 5.500 5.516 5.122 5.722 0.222 1 0 "[ . 1]" 1
1169 1 109 TRP HE1 1 165 ALA MB 6.520 . 6.520 6.299 5.797 6.609 0.089 8 0 "[ . 1]" 1
1170 1 109 TRP HE1 1 168 VAL HA 5.500 . 5.500 3.650 3.028 4.124 . 0 0 "[ . 1]" 1
1171 1 109 TRP HE1 1 168 VAL HB 5.500 . 5.500 3.791 2.288 4.562 . 0 0 "[ . 1]" 1
1172 1 109 TRP HZ2 1 168 VAL H 5.500 . 5.500 4.696 4.504 4.855 . 0 0 "[ . 1]" 1
1173 1 109 TRP HZ2 1 168 VAL HB 5.500 . 5.500 3.848 2.119 4.515 . 0 0 "[ . 1]" 1
1174 1 109 TRP HZ2 1 168 VAL HA 5.500 . 5.500 2.157 2.009 2.408 . 0 0 "[ . 1]" 1
1175 1 109 TRP HE1 1 171 ALA MB 6.520 . 6.520 3.624 3.229 4.158 . 0 0 "[ . 1]" 1
1176 1 109 TRP HH2 1 171 ALA H 6.500 . 6.500 6.573 6.163 6.711 0.211 6 0 "[ . 1]" 1
1177 1 109 TRP HH2 1 171 ALA MB 6.520 . 6.520 3.123 2.954 3.299 . 0 0 "[ . 1]" 1
1178 1 109 TRP HZ2 1 171 ALA H 5.500 . 5.500 4.938 4.532 5.116 . 0 0 "[ . 1]" 1
1179 1 109 TRP HZ2 1 171 ALA MB 6.520 . 6.520 2.309 2.118 2.516 . 0 0 "[ . 1]" 1
1180 1 109 TRP HH2 1 173 VAL H 5.500 . 5.500 5.163 4.926 5.426 . 0 0 "[ . 1]" 1
1181 1 109 TRP HZ2 1 173 VAL H 5.500 . 5.500 4.953 4.646 5.063 . 0 0 "[ . 1]" 1
1182 1 109 TRP QB 1 174 LEU H 6.220 . 6.220 5.013 4.706 5.330 . 0 0 "[ . 1]" 1
1183 1 109 TRP QB 1 174 LEU MD1 7.240 . 7.240 2.707 2.079 3.255 . 0 0 "[ . 1]" 1
1184 1 109 TRP QB 1 174 LEU MD2 7.240 . 7.240 1.885 1.825 2.014 . 0 0 "[ . 1]" 1
1185 1 109 TRP HD1 1 174 LEU H 5.500 . 5.500 5.597 5.533 5.691 0.191 8 0 "[ . 1]" 1
1186 1 109 TRP HD1 1 174 LEU MD1 6.520 . 6.520 2.009 1.894 2.301 . 0 0 "[ . 1]" 1
1187 1 109 TRP HD1 1 174 LEU MD2 6.520 . 6.520 3.390 2.688 3.689 . 0 0 "[ . 1]" 1
1188 1 109 TRP HE1 1 174 LEU MD2 6.520 . 6.520 4.896 4.185 5.285 . 0 0 "[ . 1]" 1
1189 1 109 TRP HE1 1 174 LEU HG 5.500 . 5.500 4.136 3.479 4.570 . 0 0 "[ . 1]" 1
1190 1 109 TRP HE1 1 174 LEU MD1 6.520 . 6.520 3.132 2.539 3.591 . 0 0 "[ . 1]" 1
1191 1 109 TRP HZ2 1 174 LEU MD2 6.520 . 6.520 6.170 5.576 6.553 0.033 1 0 "[ . 1]" 1
1192 1 109 TRP HD1 1 191 TYR H 5.500 . 5.500 4.146 4.006 4.348 . 0 0 "[ . 1]" 1
1193 1 109 TRP HD1 1 191 TYR HB2 5.500 . 5.500 2.778 2.647 2.936 . 0 0 "[ . 1]" 1
1194 1 109 TRP HD1 1 191 TYR HB3 5.500 . 5.500 1.982 1.945 2.030 . 0 0 "[ . 1]" 1
1195 1 109 TRP HE1 1 191 TYR H 5.500 . 5.500 5.391 5.290 5.518 0.018 7 0 "[ . 1]" 1
1196 1 109 TRP HE1 1 191 TYR QB 6.220 . 6.220 2.282 2.223 2.339 . 0 0 "[ . 1]" 1
1197 1 109 TRP HE1 1 192 LYS H 5.500 . 5.500 5.549 5.464 5.594 0.094 4 0 "[ . 1]" 1
1198 1 110 LYS HB3 1 111 MET H 5.500 . 5.500 4.061 3.912 4.186 . 0 0 "[ . 1]" 1
1199 1 110 LYS QE 1 111 MET H 6.380 . 6.380 4.489 4.156 5.090 . 0 0 "[ . 1]" 1
1200 1 110 LYS H 1 111 MET ME 6.520 . 6.520 5.402 4.367 6.101 . 0 0 "[ . 1]" 1
1201 1 110 LYS QD 1 159 GLN HE22 6.380 . 6.380 5.748 5.138 6.381 0.001 9 0 "[ . 1]" 1
1202 1 110 LYS QE 1 159 GLN HE22 6.380 . 6.380 6.211 5.561 6.404 0.024 2 0 "[ . 1]" 1
1203 1 110 LYS HB2 1 160 VAL H 5.500 . 5.500 5.228 4.817 5.536 0.036 7 0 "[ . 1]" 1
1204 1 110 LYS H 1 174 LEU MD1 6.520 . 6.520 4.712 4.256 5.266 . 0 0 "[ . 1]" 1
1205 1 110 LYS HB3 1 190 PHE H 5.500 . 5.500 5.130 4.956 5.423 . 0 0 "[ . 1]" 1
1206 1 110 LYS QG 1 190 PHE H 6.380 . 6.380 5.836 5.615 6.057 . 0 0 "[ . 1]" 1
1207 1 110 LYS H 1 190 PHE H 5.500 . 5.500 4.328 4.001 4.599 . 0 0 "[ . 1]" 1
1208 1 110 LYS H 1 190 PHE QD 7.630 . 7.630 5.431 4.240 6.546 . 0 0 "[ . 1]" 1
1209 1 110 LYS H 1 191 TYR H 5.500 . 5.500 5.562 5.517 5.656 0.156 7 0 "[ . 1]" 1
1210 1 110 LYS H 1 191 TYR QB 6.220 . 6.220 4.991 4.778 5.162 . 0 0 "[ . 1]" 1
1211 1 110 LYS HB3 1 192 LYS H 5.500 . 5.500 5.008 4.753 5.362 . 0 0 "[ . 1]" 1
1212 1 110 LYS HB2 1 192 LYS H 5.500 . 5.500 5.018 4.687 5.315 . 0 0 "[ . 1]" 1
1213 1 110 LYS H 1 192 LYS H 5.500 . 5.500 3.447 3.143 3.673 . 0 0 "[ . 1]" 1
1214 1 111 MET QB 1 112 LYS HA 6.220 . 6.220 4.418 4.216 4.674 . 0 0 "[ . 1]" 1
1215 1 111 MET QB 1 112 LYS HB2 6.220 . 6.220 4.855 4.513 5.268 . 0 0 "[ . 1]" 1
1216 1 111 MET QG 1 112 LYS H 6.380 . 6.380 3.971 3.752 4.330 . 0 0 "[ . 1]" 1
1217 1 111 MET H 1 157 VAL HB 5.500 . 5.500 5.060 4.309 5.805 0.305 6 0 "[ . 1]" 1
1218 1 111 MET H 1 157 VAL HA 5.500 . 5.500 5.258 4.951 5.457 . 0 0 "[ . 1]" 1
1219 1 111 MET ME 1 158 VAL H 6.520 . 6.520 4.859 4.183 5.705 . 0 0 "[ . 1]" 1
1220 1 111 MET ME 1 158 VAL HA 6.520 . 6.520 5.498 4.267 6.586 0.066 1 0 "[ . 1]" 1
1221 1 111 MET QG 1 158 VAL H 6.380 . 6.380 4.622 2.924 5.954 . 0 0 "[ . 1]" 1
1222 1 111 MET H 1 158 VAL H 5.500 . 5.500 3.419 3.204 3.628 . 0 0 "[ . 1]" 1
1223 1 111 MET H 1 158 VAL HA 5.500 . 5.500 5.121 4.821 5.492 . 0 0 "[ . 1]" 1
1224 1 111 MET ME 1 159 GLN HA 6.520 . 6.520 3.865 2.105 4.906 . 0 0 "[ . 1]" 1
1225 1 111 MET ME 1 159 GLN H 6.520 . 6.520 5.207 3.757 6.387 . 0 0 "[ . 1]" 1
1226 1 111 MET ME 1 159 GLN QG 7.240 . 7.240 5.304 3.822 6.180 . 0 0 "[ . 1]" 1
1227 1 111 MET H 1 159 GLN H 5.500 . 5.500 4.999 4.708 5.425 . 0 0 "[ . 1]" 1
1228 1 111 MET H 1 159 GLN HA 5.500 . 5.500 3.347 3.010 3.683 . 0 0 "[ . 1]" 1
1229 1 111 MET ME 1 160 VAL H 6.520 . 6.520 4.514 2.902 5.446 . 0 0 "[ . 1]" 1
1230 1 111 MET ME 1 174 LEU HA 6.520 . 6.520 3.653 2.907 4.875 . 0 0 "[ . 1]" 1
1231 1 111 MET ME 1 177 ILE MD 7.540 . 7.540 2.162 1.695 3.276 . 0 0 "[ . 1]" 1
1232 1 111 MET QG 1 177 ILE MD 7.400 . 7.400 4.342 3.523 5.901 . 0 0 "[ . 1]" 1
1233 1 111 MET HA 1 186 PHE QD 7.630 . 7.630 5.349 4.725 5.871 . 0 0 "[ . 1]" 1
1234 1 111 MET QB 1 186 PHE HA 6.220 . 6.220 4.530 3.961 4.854 . 0 0 "[ . 1]" 1
1235 1 111 MET QB 1 186 PHE QD 8.350 . 8.350 3.048 2.638 3.443 . 0 0 "[ . 1]" 1
1236 1 111 MET ME 1 186 PHE HB3 6.520 . 6.520 5.564 4.376 6.600 0.080 2 0 "[ . 1]" 1
1237 1 111 MET ME 1 186 PHE QD 8.650 . 8.650 4.183 3.474 5.270 . 0 0 "[ . 1]" 1
1238 1 111 MET ME 1 186 PHE QE 8.650 . 8.650 3.633 2.552 4.677 . 0 0 "[ . 1]" 1
1239 1 111 MET QB 1 187 LYS H 6.220 . 6.220 5.335 5.166 5.639 . 0 0 "[ . 1]" 1
1240 1 111 MET HA 1 189 VAL H 5.500 . 5.500 5.281 4.849 5.406 . 0 0 "[ . 1]" 1
1241 1 111 MET ME 1 190 PHE H 6.520 . 6.520 5.312 4.168 6.420 . 0 0 "[ . 1]" 1
1242 1 112 LYS HA 1 113 VAL HB 5.500 . 5.500 5.367 4.212 5.661 0.161 5 0 "[ . 1]" 1
1243 1 112 LYS HB2 1 113 VAL H 5.500 . 5.500 4.256 4.164 4.360 . 0 0 "[ . 1]" 1
1244 1 112 LYS H 1 113 VAL H 5.500 . 5.500 4.542 4.467 4.639 . 0 0 "[ . 1]" 1
1245 1 112 LYS QD 1 114 PRO HA 6.380 . 6.380 5.655 4.800 6.435 0.055 6 0 "[ . 1]" 1
1246 1 112 LYS QD 1 155 GLU HA 6.380 . 6.380 6.455 6.345 6.586 0.206 5 0 "[ . 1]" 1
1247 1 112 LYS QD 1 156 ASP H 6.380 . 6.380 4.979 4.373 5.663 . 0 0 "[ . 1]" 1
1248 1 112 LYS QD 1 158 VAL H 6.380 . 6.380 5.290 4.428 6.341 . 0 0 "[ . 1]" 1
1249 1 112 LYS H 1 158 VAL H 5.500 . 5.500 5.204 4.675 5.578 0.078 7 0 "[ . 1]" 1
1250 1 112 LYS HB3 1 185 ALA MB 6.520 . 6.520 6.498 6.181 6.701 0.181 9 0 "[ . 1]" 1
1251 1 112 LYS HB3 1 186 PHE HA 5.500 . 5.500 4.743 4.209 5.271 . 0 0 "[ . 1]" 1
1252 1 112 LYS H 1 186 PHE QD 7.630 . 7.630 4.363 3.766 4.883 . 0 0 "[ . 1]" 1
1253 1 112 LYS H 1 186 PHE HB3 5.500 . 5.500 4.663 4.173 4.946 . 0 0 "[ . 1]" 1
1254 1 112 LYS H 1 186 PHE HA 5.500 . 5.500 4.449 4.201 4.699 . 0 0 "[ . 1]" 1
1255 1 112 LYS HB3 1 187 LYS H 5.500 . 5.500 3.189 2.686 3.517 . 0 0 "[ . 1]" 1
1256 1 112 LYS HB3 1 187 LYS HA 5.500 . 5.500 4.846 4.676 5.012 . 0 0 "[ . 1]" 1
1257 1 112 LYS HB3 1 188 ALA H 5.500 . 5.500 3.172 2.047 3.891 . 0 0 "[ . 1]" 1
1258 1 112 LYS HB2 1 188 ALA H 5.500 . 5.500 3.017 2.106 4.050 . 0 0 "[ . 1]" 1
1259 1 112 LYS QD 1 188 ALA H 6.380 . 6.380 5.260 4.620 5.547 . 0 0 "[ . 1]" 1
1260 1 112 LYS QE 1 188 ALA H 6.380 . 6.380 5.686 3.808 6.446 0.066 5 0 "[ . 1]" 1
1261 1 112 LYS QE 1 188 ALA MB 7.400 . 7.400 4.930 2.971 6.401 . 0 0 "[ . 1]" 1
1262 1 112 LYS H 1 188 ALA H 5.500 . 5.500 2.751 2.614 2.962 . 0 0 "[ . 1]" 1
1263 1 112 LYS H 1 188 ALA MB 6.520 . 6.520 3.572 2.216 4.074 . 0 0 "[ . 1]" 1
1264 1 112 LYS H 1 189 VAL H 5.500 . 5.500 5.514 5.164 5.594 0.094 10 0 "[ . 1]" 1
1265 1 113 VAL H 1 156 ASP H 5.500 . 5.500 4.458 3.942 4.731 . 0 0 "[ . 1]" 1
1266 1 113 VAL H 1 156 ASP QB 6.220 . 6.220 4.751 4.215 5.092 . 0 0 "[ . 1]" 1
1267 1 113 VAL H 1 157 VAL HA 5.500 . 5.500 2.863 2.597 3.201 . 0 0 "[ . 1]" 1
1268 1 113 VAL HB 1 185 ALA MB 6.520 . 6.520 5.473 4.788 6.591 0.071 10 0 "[ . 1]" 1
1269 1 113 VAL HA 1 186 PHE H 5.500 . 5.500 5.239 4.924 5.522 0.022 10 0 "[ . 1]" 1
1270 1 113 VAL HB 1 186 PHE HA 5.500 . 5.500 4.579 3.909 4.919 . 0 0 "[ . 1]" 1
1271 1 113 VAL H 1 186 PHE HA 5.500 . 5.500 5.291 5.053 5.525 0.025 3 0 "[ . 1]" 1
1272 1 113 VAL HB 1 187 LYS H 5.500 . 5.500 5.602 5.436 5.745 0.245 8 0 "[ . 1]" 1
1273 1 114 PRO HA 1 115 LYS HA 5.500 . 5.500 4.448 4.427 4.481 . 0 0 "[ . 1]" 1
1274 1 114 PRO HA 1 116 ASP H 5.500 . 5.500 3.789 3.742 3.832 . 0 0 "[ . 1]" 1
1275 1 114 PRO QB 1 116 ASP H 6.380 . 6.380 2.395 2.287 2.554 . 0 0 "[ . 1]" 1
1276 1 114 PRO HA 1 117 SER H 5.500 . 5.500 4.935 4.731 5.062 . 0 0 "[ . 1]" 1
1277 1 114 PRO QB 1 117 SER H 6.380 . 6.380 3.174 2.816 3.445 . 0 0 "[ . 1]" 1
1278 1 114 PRO QB 1 118 THR H 6.380 . 6.380 5.123 4.457 5.421 . 0 0 "[ . 1]" 1
1279 1 114 PRO HA 1 155 GLU QB 6.220 . 6.220 2.546 2.019 3.281 . 0 0 "[ . 1]" 1
1280 1 114 PRO QB 1 185 ALA MB 7.400 . 7.400 3.587 3.017 4.116 . 0 0 "[ . 1]" 1
1281 1 115 LYS HA 1 117 SER H 5.500 . 5.500 4.033 3.903 4.253 . 0 0 "[ . 1]" 1
1282 1 115 LYS HA 1 118 THR H 5.500 . 5.500 3.149 3.030 3.245 . 0 0 "[ . 1]" 1
1283 1 115 LYS HA 1 118 THR MG 6.520 . 6.520 2.752 2.296 3.250 . 0 0 "[ . 1]" 1
1284 1 115 LYS H 1 155 GLU HB3 5.500 . 5.500 2.835 2.428 3.230 . 0 0 "[ . 1]" 1
1285 1 115 LYS H 1 155 GLU HB2 5.500 . 5.500 3.899 2.003 4.812 . 0 0 "[ . 1]" 1
1286 1 115 LYS H 1 155 GLU HA 5.500 . 5.500 2.878 2.409 3.332 . 0 0 "[ . 1]" 1
1287 1 115 LYS H 1 155 GLU QG 6.380 . 6.380 3.109 2.448 4.296 . 0 0 "[ . 1]" 1
1288 1 115 LYS H 1 156 ASP H 5.500 . 5.500 2.942 2.611 3.166 . 0 0 "[ . 1]" 1
1289 1 115 LYS H 1 156 ASP HB2 5.500 . 5.500 4.232 3.736 4.667 . 0 0 "[ . 1]" 1
1290 1 115 LYS H 1 156 ASP HB3 5.500 . 5.500 5.012 4.460 5.552 0.052 2 0 "[ . 1]" 1
1291 1 116 ASP H 1 118 THR HB 5.500 . 5.500 4.811 4.748 4.953 . 0 0 "[ . 1]" 1
1292 1 116 ASP H 1 156 ASP H 5.500 . 5.500 5.364 5.101 5.621 0.121 7 0 "[ . 1]" 1
1293 1 116 ASP H 1 184 ILE MD 6.520 . 6.520 6.294 5.616 6.899 0.379 7 0 "[ . 1]" 1
1294 1 117 SER H 1 118 THR H 5.500 . 5.500 2.504 2.323 2.562 . 0 0 "[ . 1]" 1
1295 1 117 SER H 1 118 THR HB 5.500 . 5.500 4.267 4.186 4.564 . 0 0 "[ . 1]" 1
1296 1 117 SER HA 1 119 SER H 5.500 . 5.500 3.853 3.735 3.972 . 0 0 "[ . 1]" 1
1297 1 117 SER H 1 119 SER H 5.500 . 5.500 4.960 4.653 5.061 . 0 0 "[ . 1]" 1
1298 1 117 SER HA 1 120 THR H 5.500 . 5.500 3.270 3.189 3.336 . 0 0 "[ . 1]" 1
1299 1 117 SER QB 1 120 THR H 6.220 . 6.220 4.098 3.955 4.404 . 0 0 "[ . 1]" 1
1300 1 117 SER QB 1 184 ILE MD 7.240 . 7.240 1.921 1.684 2.247 . 0 0 "[ . 1]" 1
1301 1 117 SER H 1 184 ILE MD 6.520 . 6.520 4.295 3.889 4.859 . 0 0 "[ . 1]" 1
1302 1 118 THR HB 1 119 SER H 5.500 . 5.500 3.725 2.581 3.904 . 0 0 "[ . 1]" 1
1303 1 118 THR MG 1 119 SER H 6.520 . 6.520 2.026 1.865 3.372 . 0 0 "[ . 1]" 1
1304 1 118 THR H 1 119 SER H 5.500 . 5.500 2.704 2.608 2.748 . 0 0 "[ . 1]" 1
1305 1 118 THR HB 1 120 THR H 5.500 . 5.500 5.636 5.065 5.743 0.243 2 0 "[ . 1]" 1
1306 1 118 THR H 1 120 THR HB 5.500 . 5.500 5.294 5.204 5.479 . 0 0 "[ . 1]" 1
1307 1 118 THR HA 1 121 VAL H 5.500 . 5.500 3.504 3.349 3.646 . 0 0 "[ . 1]" 1
1308 1 118 THR HB 1 121 VAL HB 5.500 . 5.500 5.382 5.207 5.907 0.407 10 0 "[ . 1]" 1
1309 1 118 THR H 1 121 VAL H 5.500 . 5.500 4.847 4.687 4.926 . 0 0 "[ . 1]" 1
1310 1 118 THR H 1 121 VAL HB 5.500 . 5.500 5.345 5.215 5.509 0.009 10 0 "[ . 1]" 1
1311 1 118 THR HA 1 122 TRP H 5.500 . 5.500 3.887 3.615 4.034 . 0 0 "[ . 1]" 1
1312 1 118 THR MG 1 122 TRP H 6.520 . 6.520 4.947 3.748 5.132 . 0 0 "[ . 1]" 1
1313 1 118 THR MG 1 156 ASP HB3 6.520 . 6.520 3.782 1.972 4.480 . 0 0 "[ . 1]" 1
1314 1 118 THR MG 1 156 ASP HB2 6.520 . 6.520 3.486 2.771 3.990 . 0 0 "[ . 1]" 1
1315 1 118 THR H 1 156 ASP QB 6.220 . 6.220 4.591 4.368 5.021 . 0 0 "[ . 1]" 1
1316 1 118 THR MG 1 157 VAL H 6.520 . 6.520 5.958 3.920 6.342 . 0 0 "[ . 1]" 1
1317 1 118 THR HB 1 184 ILE MD 6.520 . 6.520 6.109 5.430 6.383 . 0 0 "[ . 1]" 1
1318 1 118 THR H 1 184 ILE MD 6.520 . 6.520 5.029 4.434 5.362 . 0 0 "[ . 1]" 1
1319 1 119 SER H 1 120 THR H 5.500 . 5.500 2.629 2.572 2.780 . 0 0 "[ . 1]" 1
1320 1 119 SER H 1 121 VAL H 5.500 . 5.500 4.309 4.229 4.357 . 0 0 "[ . 1]" 1
1321 1 119 SER H 1 184 ILE MD 6.520 . 6.520 6.041 5.481 6.224 . 0 0 "[ . 1]" 1
1322 1 120 THR HB 1 121 VAL H 5.500 . 5.500 2.373 2.321 2.435 . 0 0 "[ . 1]" 1
1323 1 120 THR MG 1 121 VAL HA 6.520 . 6.520 3.780 3.697 3.882 . 0 0 "[ . 1]" 1
1324 1 120 THR MG 1 121 VAL H 6.520 . 6.520 3.521 3.471 3.575 . 0 0 "[ . 1]" 1
1325 1 120 THR H 1 121 VAL HB 5.500 . 5.500 4.709 4.603 4.922 . 0 0 "[ . 1]" 1
1326 1 120 THR MG 1 122 TRP H 6.520 . 6.520 5.265 5.171 5.342 . 0 0 "[ . 1]" 1
1327 1 120 THR H 1 122 TRP H 5.500 . 5.500 4.194 4.127 4.252 . 0 0 "[ . 1]" 1
1328 1 120 THR HA 1 123 LYS HB2 5.500 . 5.500 3.654 2.851 4.337 . 0 0 "[ . 1]" 1
1329 1 120 THR HA 1 123 LYS HB3 5.500 . 5.500 3.203 2.923 4.427 . 0 0 "[ . 1]" 1
1330 1 120 THR HA 1 123 LYS H 5.500 . 5.500 3.734 3.590 3.826 . 0 0 "[ . 1]" 1
1331 1 120 THR H 1 123 LYS H 5.500 . 5.500 4.766 4.635 5.068 . 0 0 "[ . 1]" 1
1332 1 120 THR H 1 123 LYS QB 6.220 . 6.220 4.853 4.642 5.300 . 0 0 "[ . 1]" 1
1333 1 120 THR HA 1 124 GLU QG 6.380 . 6.380 4.701 3.093 6.379 . 0 0 "[ . 1]" 1
1334 1 120 THR HA 1 124 GLU H 5.500 . 5.500 3.836 3.565 4.241 . 0 0 "[ . 1]" 1
1335 1 120 THR MG 1 124 GLU H 6.520 . 6.520 4.040 3.895 4.201 . 0 0 "[ . 1]" 1
1336 1 120 THR MG 1 124 GLU QG 7.400 . 7.400 3.269 2.140 4.477 . 0 0 "[ . 1]" 1
1337 1 120 THR MG 1 124 GLU QB 7.240 . 7.240 3.429 2.964 4.155 . 0 0 "[ . 1]" 1
1338 1 120 THR MG 1 181 LEU HB2 6.520 . 6.520 5.364 4.873 6.060 . 0 0 "[ . 1]" 1
1339 1 120 THR MG 1 181 LEU HB3 6.520 . 6.520 4.227 3.633 4.868 . 0 0 "[ . 1]" 1
1340 1 120 THR MG 1 181 LEU QD 8.560 . 8.560 2.326 2.035 2.978 . 0 0 "[ . 1]" 1
1341 1 120 THR H 1 181 LEU QD 7.540 . 7.540 5.342 4.998 5.732 . 0 0 "[ . 1]" 1
1342 1 120 THR MG 1 183 HIS HD2 6.520 . 6.520 5.186 4.512 5.876 . 0 0 "[ . 1]" 1
1343 1 120 THR HB 1 184 ILE MD 6.520 . 6.520 3.112 2.549 3.834 . 0 0 "[ . 1]" 1
1344 1 120 THR MG 1 184 ILE MD 7.540 . 7.540 3.394 2.735 4.272 . 0 0 "[ . 1]" 1
1345 1 121 VAL H 1 122 TRP H 5.500 . 5.500 2.755 2.727 2.791 . 0 0 "[ . 1]" 1
1346 1 121 VAL HA 1 124 GLU H 5.500 . 5.500 3.651 3.497 3.819 . 0 0 "[ . 1]" 1
1347 1 121 VAL HA 1 124 GLU QB 6.220 . 6.220 2.643 2.436 2.960 . 0 0 "[ . 1]" 1
1348 1 121 VAL H 1 124 GLU QB 6.220 . 6.220 4.674 4.468 5.107 . 0 0 "[ . 1]" 1
1349 1 121 VAL HA 1 125 LEU H 5.500 . 5.500 3.634 3.134 3.983 . 0 0 "[ . 1]" 1
1350 1 121 VAL HA 1 125 LEU QD 7.540 . 7.540 2.964 2.547 4.268 . 0 0 "[ . 1]" 1
1351 1 121 VAL HB 1 125 LEU QD 7.540 . 7.540 4.077 3.741 4.506 . 0 0 "[ . 1]" 1
1352 1 121 VAL HA 1 181 LEU MD2 6.520 . 6.520 3.360 1.813 4.199 . 0 0 "[ . 1]" 1
1353 1 121 VAL HA 1 181 LEU MD1 6.520 . 6.520 2.603 1.997 3.727 . 0 0 "[ . 1]" 1
1354 1 121 VAL H 1 181 LEU MD2 6.520 . 6.520 4.718 3.394 6.075 . 0 0 "[ . 1]" 1
1355 1 121 VAL H 1 181 LEU MD1 6.520 . 6.520 4.506 3.669 5.947 . 0 0 "[ . 1]" 1
1356 1 121 VAL HA 1 184 ILE MD 6.520 . 6.520 4.154 3.633 4.813 . 0 0 "[ . 1]" 1
1357 1 121 VAL H 1 184 ILE MD 6.520 . 6.520 3.655 3.339 4.053 . 0 0 "[ . 1]" 1
1358 1 122 TRP H 1 122 TRP HD1 5.500 . 5.500 4.781 4.677 4.925 . 0 0 "[ . 1]" 1
1359 1 122 TRP HH2 1 123 LYS QE 6.220 . 6.220 6.222 6.090 6.298 0.078 7 0 "[ . 1]" 1
1360 1 122 TRP H 1 123 LYS H 5.500 . 5.500 2.813 2.723 2.925 . 0 0 "[ . 1]" 1
1361 1 122 TRP HZ3 1 123 LYS QE 6.220 . 6.220 4.535 4.012 5.393 . 0 0 "[ . 1]" 1
1362 1 122 TRP HD1 1 125 LEU MD1 6.520 . 6.520 5.695 4.313 6.420 . 0 0 "[ . 1]" 1
1363 1 122 TRP HD1 1 125 LEU MD2 6.520 . 6.520 5.381 4.157 6.475 . 0 0 "[ . 1]" 1
1364 1 122 TRP H 1 125 LEU QD 7.540 . 7.540 4.305 3.933 5.090 . 0 0 "[ . 1]" 1
1365 1 122 TRP HE1 1 126 LEU MD1 6.520 . 6.520 3.204 2.579 3.775 . 0 0 "[ . 1]" 1
1366 1 122 TRP HE1 1 126 LEU MD2 6.520 . 6.520 2.999 2.120 4.308 . 0 0 "[ . 1]" 1
1367 1 122 TRP HZ2 1 126 LEU MD1 6.520 . 6.520 2.980 2.332 3.663 . 0 0 "[ . 1]" 1
1368 1 122 TRP HZ2 1 126 LEU MD2 6.520 . 6.520 3.876 3.241 4.768 . 0 0 "[ . 1]" 1
1369 1 122 TRP H 1 181 LEU QD 7.540 . 7.540 4.947 4.397 5.870 . 0 0 "[ . 1]" 1
1370 1 123 LYS HB3 1 124 GLU H 5.500 . 5.500 2.583 2.430 3.458 . 0 0 "[ . 1]" 1
1371 1 123 LYS HB2 1 124 GLU H 5.500 . 5.500 3.567 2.565 3.830 . 0 0 "[ . 1]" 1
1372 1 123 LYS QE 1 124 GLU H 6.220 . 6.220 5.631 5.175 6.311 0.091 2 0 "[ . 1]" 1
1373 1 123 LYS QG 1 124 GLU HA 6.380 . 6.380 4.201 3.610 5.800 . 0 0 "[ . 1]" 1
1374 1 123 LYS H 1 124 GLU H 5.500 . 5.500 2.729 2.653 2.787 . 0 0 "[ . 1]" 1
1375 1 123 LYS H 1 125 LEU H 5.500 . 5.500 4.213 4.121 4.301 . 0 0 "[ . 1]" 1
1376 1 123 LYS HA 1 126 LEU H 5.500 . 5.500 3.641 3.450 3.759 . 0 0 "[ . 1]" 1
1377 1 123 LYS HA 1 126 LEU HG 5.500 . 5.500 3.615 3.251 4.104 . 0 0 "[ . 1]" 1
1378 1 123 LYS HA 1 126 LEU MD1 6.520 . 6.520 3.169 1.964 4.694 . 0 0 "[ . 1]" 1
1379 1 123 LYS HA 1 126 LEU MD2 6.520 . 6.520 4.475 4.106 4.911 . 0 0 "[ . 1]" 1
1380 1 123 LYS HA 1 126 LEU QB 6.220 . 6.220 2.631 2.434 2.743 . 0 0 "[ . 1]" 1
1381 1 123 LYS QB 1 126 LEU H 6.220 . 6.220 5.013 4.915 5.090 . 0 0 "[ . 1]" 1
1382 1 123 LYS QD 1 126 LEU QD 8.260 . 8.260 5.313 3.220 6.333 . 0 0 "[ . 1]" 1
1383 1 123 LYS H 1 126 LEU H 5.500 . 5.500 4.699 4.674 4.748 . 0 0 "[ . 1]" 1
1384 1 123 LYS H 1 126 LEU HG 5.500 . 5.500 5.037 4.847 5.255 . 0 0 "[ . 1]" 1
1385 1 123 LYS HA 1 127 LEU H 5.500 . 5.500 4.429 4.250 4.692 . 0 0 "[ . 1]" 1
1386 1 123 LYS HA 1 127 LEU HG 5.500 . 5.500 4.446 4.221 4.822 . 0 0 "[ . 1]" 1
1387 1 123 LYS HA 1 127 LEU QD 7.540 . 7.540 4.510 4.289 4.864 . 0 0 "[ . 1]" 1
1388 1 123 LYS QE 1 127 LEU QD 7.510 . 7.510 4.612 2.450 5.948 . 0 0 "[ . 1]" 1
1389 1 124 GLU HA 1 125 LEU HB2 5.500 . 5.500 5.582 5.547 5.630 0.130 8 0 "[ . 1]" 1
1390 1 124 GLU HB3 1 125 LEU H 5.500 . 5.500 3.034 2.419 3.612 . 0 0 "[ . 1]" 1
1391 1 124 GLU HB2 1 125 LEU H 5.500 . 5.500 3.095 2.499 3.852 . 0 0 "[ . 1]" 1
1392 1 124 GLU QG 1 125 LEU H 6.380 . 6.380 3.882 3.437 4.452 . 0 0 "[ . 1]" 1
1393 1 124 GLU H 1 125 LEU H 5.500 . 5.500 2.676 2.588 2.737 . 0 0 "[ . 1]" 1
1394 1 124 GLU H 1 125 LEU QD 7.540 . 7.540 4.141 3.766 5.547 . 0 0 "[ . 1]" 1
1395 1 124 GLU HA 1 126 LEU H 5.500 . 5.500 4.400 4.259 4.472 . 0 0 "[ . 1]" 1
1396 1 124 GLU H 1 126 LEU H 5.500 . 5.500 4.074 3.959 4.127 . 0 0 "[ . 1]" 1
1397 1 124 GLU H 1 126 LEU QB 6.220 . 6.220 4.722 4.606 4.843 . 0 0 "[ . 1]" 1
1398 1 124 GLU HA 1 127 LEU H 5.500 . 5.500 3.591 3.502 3.689 . 0 0 "[ . 1]" 1
1399 1 124 GLU HA 1 127 LEU MD1 6.520 . 6.520 2.602 2.379 2.922 . 0 0 "[ . 1]" 1
1400 1 124 GLU HA 1 127 LEU MD2 6.520 . 6.520 4.972 4.833 5.160 . 0 0 "[ . 1]" 1
1401 1 124 GLU QB 1 127 LEU HB2 6.220 . 6.220 4.831 4.460 5.270 . 0 0 "[ . 1]" 1
1402 1 124 GLU H 1 127 LEU HG 5.500 . 5.500 5.438 5.297 5.518 0.018 7 0 "[ . 1]" 1
1403 1 124 GLU H 1 127 LEU H 5.500 . 5.500 4.969 4.888 5.091 . 0 0 "[ . 1]" 1
1404 1 124 GLU QG 1 181 LEU MD1 7.400 . 7.400 2.359 1.891 3.535 . 0 0 "[ . 1]" 1
1405 1 124 GLU QG 1 181 LEU MD2 7.400 . 7.400 2.108 1.843 3.170 . 0 0 "[ . 1]" 1
1406 1 124 GLU H 1 181 LEU MD1 6.520 . 6.520 4.241 3.632 5.274 . 0 0 "[ . 1]" 1
1407 1 124 GLU H 1 181 LEU MD2 6.520 . 6.520 4.464 3.321 5.154 . 0 0 "[ . 1]" 1
1408 1 125 LEU HB3 1 126 LEU H 5.500 . 5.500 3.258 2.634 3.547 . 0 0 "[ . 1]" 1
1409 1 125 LEU HB3 1 126 LEU QD 7.540 . 7.540 3.827 2.821 4.704 . 0 0 "[ . 1]" 1
1410 1 125 LEU HB2 1 126 LEU H 5.500 . 5.500 2.873 2.693 3.639 . 0 0 "[ . 1]" 1
1411 1 125 LEU QD 1 126 LEU QD 9.040 . 9.040 4.222 3.605 4.797 . 0 0 "[ . 1]" 1
1412 1 125 LEU MD1 1 126 LEU H 6.520 . 6.520 4.438 4.122 4.788 . 0 0 "[ . 1]" 1
1413 1 125 LEU MD2 1 126 LEU H 6.520 . 6.520 4.426 3.621 4.921 . 0 0 "[ . 1]" 1
1414 1 125 LEU H 1 126 LEU HA 5.500 . 5.500 5.325 5.283 5.356 . 0 0 "[ . 1]" 1
1415 1 125 LEU H 1 126 LEU HG 5.500 . 5.500 5.033 4.566 5.595 0.095 1 0 "[ . 1]" 1
1416 1 125 LEU H 1 126 LEU H 5.500 . 5.500 2.661 2.625 2.691 . 0 0 "[ . 1]" 1
1417 1 125 LEU H 1 126 LEU QD 7.540 . 7.540 4.417 3.824 4.885 . 0 0 "[ . 1]" 1
1418 1 125 LEU H 1 127 LEU H 5.500 . 5.500 4.325 4.241 4.405 . 0 0 "[ . 1]" 1
1419 1 125 LEU HA 1 128 ALA MB 6.520 . 6.520 2.502 2.387 2.656 . 0 0 "[ . 1]" 1
1420 1 125 LEU HA 1 128 ALA H 5.500 . 5.500 3.450 3.364 3.498 . 0 0 "[ . 1]" 1
1421 1 125 LEU MD1 1 128 ALA H 6.520 . 6.520 5.411 4.939 6.484 . 0 0 "[ . 1]" 1
1422 1 125 LEU MD2 1 128 ALA H 6.520 . 6.520 5.555 4.567 6.529 0.009 9 0 "[ . 1]" 1
1423 1 125 LEU HA 1 129 THR H 5.500 . 5.500 3.975 3.667 4.223 . 0 0 "[ . 1]" 1
1424 1 125 LEU QD 1 129 THR HA 7.540 . 7.540 5.693 4.517 6.478 . 0 0 "[ . 1]" 1
1425 1 125 LEU QD 1 129 THR HB 7.540 . 7.540 5.565 2.876 6.379 . 0 0 "[ . 1]" 1
1426 1 125 LEU QD 1 129 THR MG 8.560 . 8.560 4.951 2.862 5.623 . 0 0 "[ . 1]" 1
1427 1 125 LEU HA 1 134 PHE QE 7.630 . 7.630 3.452 2.880 4.289 . 0 0 "[ . 1]" 1
1428 1 125 LEU QD 1 134 PHE QD 9.670 . 9.670 4.591 3.607 5.422 . 0 0 "[ . 1]" 1
1429 1 125 LEU MD1 1 134 PHE HZ 6.520 . 6.520 3.007 1.843 4.001 . 0 0 "[ . 1]" 1
1430 1 125 LEU MD1 1 134 PHE QE 8.650 . 8.650 3.616 1.992 4.624 . 0 0 "[ . 1]" 1
1431 1 125 LEU MD2 1 134 PHE HZ 6.520 . 6.520 3.092 1.926 3.866 . 0 0 "[ . 1]" 1
1432 1 125 LEU MD2 1 134 PHE QE 8.650 . 8.650 3.637 1.962 4.409 . 0 0 "[ . 1]" 1
1433 1 125 LEU HG 1 134 PHE HZ 5.500 . 5.500 3.082 1.951 4.853 . 0 0 "[ . 1]" 1
1434 1 125 LEU QD 1 147 VAL H 7.540 . 7.540 7.056 5.566 7.550 0.010 10 0 "[ . 1]" 1
1435 1 125 LEU QD 1 147 VAL HB 7.540 . 7.540 4.554 2.894 5.489 . 0 0 "[ . 1]" 1
1436 1 125 LEU QD 1 148 SER H 7.540 . 7.540 5.911 4.866 6.348 . 0 0 "[ . 1]" 1
1437 1 125 LEU QD 1 158 VAL HA 7.540 . 7.540 5.015 4.565 5.731 . 0 0 "[ . 1]" 1
1438 1 125 LEU QD 1 177 ILE MD 8.560 . 8.560 2.325 1.729 2.952 . 0 0 "[ . 1]" 1
1439 1 125 LEU MD1 1 177 ILE H 6.520 . 6.520 5.491 4.995 6.559 0.039 8 0 "[ . 1]" 1
1440 1 125 LEU MD1 1 177 ILE HA 6.520 . 6.520 3.878 3.031 5.020 . 0 0 "[ . 1]" 1
1441 1 125 LEU MD2 1 177 ILE H 6.520 . 6.520 5.836 4.771 6.641 0.121 4 0 "[ . 1]" 1
1442 1 125 LEU MD2 1 177 ILE HA 6.520 . 6.520 4.410 3.196 5.830 . 0 0 "[ . 1]" 1
1443 1 125 LEU QD 1 178 HIS H 7.540 . 7.540 5.815 5.586 6.366 . 0 0 "[ . 1]" 1
1444 1 125 LEU MD1 1 186 PHE QE 8.650 . 8.650 4.789 4.144 5.867 . 0 0 "[ . 1]" 1
1445 1 125 LEU MD2 1 186 PHE QE 8.650 . 8.650 4.981 4.366 6.969 . 0 0 "[ . 1]" 1
1446 1 126 LEU MD1 1 127 LEU MD2 7.540 . 7.540 5.155 4.967 5.325 . 0 0 "[ . 1]" 1
1447 1 126 LEU MD1 1 127 LEU MD1 7.540 . 7.540 5.796 5.229 6.294 . 0 0 "[ . 1]" 1
1448 1 126 LEU MD1 1 127 LEU H 6.520 . 6.520 4.584 4.315 4.794 . 0 0 "[ . 1]" 1
1449 1 126 LEU MD2 1 127 LEU MD2 7.540 . 7.540 5.671 5.322 6.043 . 0 0 "[ . 1]" 1
1450 1 126 LEU MD2 1 127 LEU MD1 7.540 . 7.540 6.317 6.131 6.480 . 0 0 "[ . 1]" 1
1451 1 126 LEU MD2 1 127 LEU H 6.520 . 6.520 4.474 4.186 4.679 . 0 0 "[ . 1]" 1
1452 1 126 LEU HG 1 127 LEU H 5.500 . 5.500 4.712 4.440 4.952 . 0 0 "[ . 1]" 1
1453 1 126 LEU H 1 127 LEU H 5.500 . 5.500 2.797 2.765 2.838 . 0 0 "[ . 1]" 1
1454 1 126 LEU H 1 127 LEU QD 7.540 . 7.540 4.838 4.796 4.887 . 0 0 "[ . 1]" 1
1455 1 126 LEU QD 1 128 ALA H 7.540 . 7.540 5.278 4.978 5.465 . 0 0 "[ . 1]" 1
1456 1 126 LEU H 1 128 ALA H 5.500 . 5.500 4.225 4.122 4.287 . 0 0 "[ . 1]" 1
1457 1 126 LEU HA 1 129 THR H 5.500 . 5.500 3.494 3.377 3.727 . 0 0 "[ . 1]" 1
1458 1 126 LEU HA 1 129 THR HB 5.500 . 5.500 2.967 2.657 4.259 . 0 0 "[ . 1]" 1
1459 1 126 LEU HA 1 129 THR MG 6.520 . 6.520 3.769 2.085 4.276 . 0 0 "[ . 1]" 1
1460 1 126 LEU QB 1 129 THR H 6.220 . 6.220 4.880 4.776 5.125 . 0 0 "[ . 1]" 1
1461 1 126 LEU QD 1 129 THR H 7.540 . 7.540 4.623 4.327 5.030 . 0 0 "[ . 1]" 1
1462 1 126 LEU MD1 1 129 THR MG 7.540 . 7.540 5.244 4.236 6.526 . 0 0 "[ . 1]" 1
1463 1 126 LEU MD2 1 129 THR MG 7.540 . 7.540 3.798 2.773 4.455 . 0 0 "[ . 1]" 1
1464 1 126 LEU HA 1 130 ILE H 5.500 . 5.500 4.125 3.807 4.295 . 0 0 "[ . 1]" 1
1465 1 126 LEU HA 1 130 ILE MD 6.520 . 6.520 5.409 5.050 6.050 . 0 0 "[ . 1]" 1
1466 1 126 LEU QB 1 130 ILE MD 7.240 . 7.240 4.425 4.058 5.167 . 0 0 "[ . 1]" 1
1467 1 126 LEU QD 1 130 ILE MD 8.560 . 8.560 4.471 4.085 4.863 . 0 0 "[ . 1]" 1
1468 1 126 LEU QD 1 147 VAL H 7.540 . 7.540 5.073 4.560 5.702 . 0 0 "[ . 1]" 1
1469 1 126 LEU MD1 1 147 VAL HB 6.520 . 6.520 5.940 4.763 6.617 0.097 9 0 "[ . 1]" 1
1470 1 126 LEU MD2 1 147 VAL HB 6.520 . 6.520 4.273 3.537 5.002 . 0 0 "[ . 1]" 1
1471 1 127 LEU HB3 1 128 ALA H 5.500 . 5.500 3.468 3.401 3.539 . 0 0 "[ . 1]" 1
1472 1 127 LEU HB2 1 128 ALA H 5.500 . 5.500 2.487 2.398 2.584 . 0 0 "[ . 1]" 1
1473 1 127 LEU MD1 1 128 ALA H 6.520 . 6.520 4.375 4.312 4.448 . 0 0 "[ . 1]" 1
1474 1 127 LEU MD2 1 128 ALA H 6.520 . 6.520 4.624 4.583 4.656 . 0 0 "[ . 1]" 1
1475 1 127 LEU H 1 128 ALA H 5.500 . 5.500 2.664 2.612 2.711 . 0 0 "[ . 1]" 1
1476 1 127 LEU H 1 128 ALA HA 5.500 . 5.500 5.325 5.267 5.362 . 0 0 "[ . 1]" 1
1477 1 127 LEU H 1 128 ALA MB 6.520 . 6.520 4.182 4.119 4.252 . 0 0 "[ . 1]" 1
1478 1 127 LEU H 1 129 THR MG 6.520 . 6.520 6.168 4.035 6.555 0.035 7 0 "[ . 1]" 1
1479 1 127 LEU HA 1 130 ILE MD 6.520 . 6.520 3.385 2.845 4.311 . 0 0 "[ . 1]" 1
1480 1 127 LEU HB3 1 130 ILE MD 6.520 . 6.520 5.272 4.759 6.238 . 0 0 "[ . 1]" 1
1481 1 127 LEU HB2 1 130 ILE MD 6.520 . 6.520 5.979 5.474 6.890 0.370 4 0 "[ . 1]" 1
1482 1 127 LEU QD 1 130 ILE H 7.540 . 7.540 5.082 5.011 5.149 . 0 0 "[ . 1]" 1
1483 1 127 LEU MD1 1 130 ILE MD 7.540 . 7.540 5.558 5.114 6.303 . 0 0 "[ . 1]" 1
1484 1 127 LEU MD2 1 130 ILE MD 7.540 . 7.540 3.266 2.784 4.051 . 0 0 "[ . 1]" 1
1485 1 127 LEU H 1 130 ILE MD 6.520 . 6.520 5.412 4.919 6.338 . 0 0 "[ . 1]" 1
1486 1 127 LEU HA 1 131 GLY H 5.500 . 5.500 3.973 3.812 4.056 . 0 0 "[ . 1]" 1
1487 1 128 ALA MB 1 129 THR H 6.520 . 6.520 2.642 2.447 2.843 . 0 0 "[ . 1]" 1
1488 1 128 ALA H 1 129 THR MG 6.520 . 6.520 5.661 3.711 5.937 . 0 0 "[ . 1]" 1
1489 1 128 ALA H 1 129 THR HB 5.500 . 5.500 4.989 4.849 5.367 . 0 0 "[ . 1]" 1
1490 1 128 ALA MB 1 130 ILE H 6.520 . 6.520 4.693 4.600 4.792 . 0 0 "[ . 1]" 1
1491 1 128 ALA H 1 130 ILE H 5.500 . 5.500 4.422 4.285 4.517 . 0 0 "[ . 1]" 1
1492 1 128 ALA HA 1 131 GLY H 5.500 . 5.500 3.238 3.053 3.334 . 0 0 "[ . 1]" 1
1493 1 128 ALA HA 1 131 GLY HA2 5.500 . 5.500 4.814 4.645 5.023 . 0 0 "[ . 1]" 1
1494 1 128 ALA H 1 131 GLY H 5.500 . 5.500 4.379 4.315 4.446 . 0 0 "[ . 1]" 1
1495 1 128 ALA H 1 131 GLY HA3 5.500 . 5.500 5.111 5.028 5.200 . 0 0 "[ . 1]" 1
1496 1 128 ALA HA 1 133 GLN H 5.500 . 5.500 3.397 2.939 3.696 . 0 0 "[ . 1]" 1
1497 1 128 ALA HA 1 133 GLN HE22 5.500 . 5.500 5.255 4.971 5.430 . 0 0 "[ . 1]" 1
1498 1 128 ALA HA 1 133 GLN HE21 5.500 . 5.500 3.866 3.515 4.123 . 0 0 "[ . 1]" 1
1499 1 128 ALA HA 1 133 GLN HB2 5.500 . 5.500 2.764 2.256 3.148 . 0 0 "[ . 1]" 1
1500 1 128 ALA HA 1 133 GLN HB3 5.500 . 5.500 3.839 3.531 4.126 . 0 0 "[ . 1]" 1
1501 1 128 ALA HA 1 133 GLN HG3 5.500 . 5.500 1.986 1.892 2.129 . 0 0 "[ . 1]" 1
1502 1 128 ALA HA 1 133 GLN HG2 5.500 . 5.500 2.295 2.127 2.426 . 0 0 "[ . 1]" 1
1503 1 128 ALA MB 1 133 GLN HE21 6.520 . 6.520 4.847 4.550 5.123 . 0 0 "[ . 1]" 1
1504 1 128 ALA MB 1 133 GLN HE22 6.520 . 6.520 5.811 5.621 6.042 . 0 0 "[ . 1]" 1
1505 1 128 ALA MB 1 133 GLN H 6.520 . 6.520 3.963 3.667 4.127 . 0 0 "[ . 1]" 1
1506 1 128 ALA MB 1 133 GLN HB2 6.520 . 6.520 2.348 2.031 2.539 . 0 0 "[ . 1]" 1
1507 1 128 ALA MB 1 133 GLN HB3 6.520 . 6.520 3.310 3.005 3.693 . 0 0 "[ . 1]" 1
1508 1 128 ALA MB 1 133 GLN HG3 6.520 . 6.520 2.708 2.439 3.002 . 0 0 "[ . 1]" 1
1509 1 128 ALA MB 1 133 GLN HG2 6.520 . 6.520 3.543 3.368 3.788 . 0 0 "[ . 1]" 1
1510 1 128 ALA H 1 133 GLN HG2 5.500 . 5.500 5.129 4.975 5.280 . 0 0 "[ . 1]" 1
1511 1 128 ALA H 1 133 GLN HG3 5.500 . 5.500 4.507 4.294 4.731 . 0 0 "[ . 1]" 1
1512 1 128 ALA MB 1 134 PHE HZ 6.520 . 6.520 2.862 2.572 3.212 . 0 0 "[ . 1]" 1
1513 1 128 ALA MB 1 134 PHE QD 8.650 . 8.650 3.290 2.958 3.843 . 0 0 "[ . 1]" 1
1514 1 128 ALA H 1 134 PHE HZ 5.500 . 5.500 5.053 4.434 5.573 0.073 10 0 "[ . 1]" 1
1515 1 128 ALA H 1 134 PHE QE 7.630 . 7.630 4.708 4.093 5.142 . 0 0 "[ . 1]" 1
1516 1 128 ALA MB 1 176 LYS HE2 6.520 . 6.520 2.346 1.957 2.783 . 0 0 "[ . 1]" 1
1517 1 128 ALA MB 1 176 LYS HE3 6.520 . 6.520 2.702 2.490 2.996 . 0 0 "[ . 1]" 1
1518 1 128 ALA H 1 176 LYS HE3 5.500 . 5.500 5.553 5.365 5.705 0.205 3 0 "[ . 1]" 1
1519 1 128 ALA H 1 176 LYS HE2 5.500 . 5.500 5.324 4.938 5.609 0.109 6 0 "[ . 1]" 1
1520 1 128 ALA MB 1 180 LEU QD 8.560 . 8.560 2.641 1.894 3.495 . 0 0 "[ . 1]" 1
1521 1 128 ALA H 1 180 LEU QD 7.540 . 7.540 4.272 3.429 5.262 . 0 0 "[ . 1]" 1
1522 1 129 THR MG 1 130 ILE H 6.520 . 6.520 3.329 1.880 3.545 . 0 0 "[ . 1]" 1
1523 1 129 THR MG 1 130 ILE MD 7.540 . 7.540 5.269 4.386 5.634 . 0 0 "[ . 1]" 1
1524 1 129 THR MG 1 130 ILE HA 6.520 . 6.520 3.797 3.642 3.902 . 0 0 "[ . 1]" 1
1525 1 129 THR HA 1 131 GLY H 5.500 . 5.500 4.261 4.208 4.345 . 0 0 "[ . 1]" 1
1526 1 129 THR MG 1 131 GLY H 6.520 . 6.520 4.832 3.865 4.984 . 0 0 "[ . 1]" 1
1527 1 129 THR H 1 131 GLY H 5.500 . 5.500 3.661 3.574 3.700 . 0 0 "[ . 1]" 1
1528 1 129 THR HA 1 132 GLU HA 5.500 . 5.500 5.333 5.026 5.483 . 0 0 "[ . 1]" 1
1529 1 129 THR MG 1 132 GLU H 6.520 . 6.520 5.243 5.002 5.430 . 0 0 "[ . 1]" 1
1530 1 129 THR H 1 133 GLN H 5.500 . 5.500 5.260 5.151 5.425 . 0 0 "[ . 1]" 1
1531 1 129 THR HA 1 134 PHE H 5.500 . 5.500 3.797 3.278 4.087 . 0 0 "[ . 1]" 1
1532 1 129 THR HA 1 134 PHE QE 7.630 . 7.630 3.359 2.720 4.162 . 0 0 "[ . 1]" 1
1533 1 129 THR HA 1 134 PHE QD 7.630 . 7.630 2.195 1.905 3.494 . 0 0 "[ . 1]" 1
1534 1 129 THR MG 1 134 PHE H 6.520 . 6.520 5.459 4.959 5.738 . 0 0 "[ . 1]" 1
1535 1 129 THR MG 1 134 PHE QD 8.650 . 8.650 3.073 2.558 3.860 . 0 0 "[ . 1]" 1
1536 1 129 THR MG 1 134 PHE HZ 6.520 . 6.520 5.515 4.920 6.103 . 0 0 "[ . 1]" 1
1537 1 129 THR H 1 134 PHE QD 7.630 . 7.630 4.008 3.427 4.909 . 0 0 "[ . 1]" 1
1538 1 129 THR HA 1 135 THR H 5.500 . 5.500 5.154 4.468 5.536 0.036 9 0 "[ . 1]" 1
1539 1 129 THR MG 1 146 GLY H 6.520 . 6.520 4.468 3.982 5.745 . 0 0 "[ . 1]" 1
1540 1 129 THR MG 1 146 GLY HA3 6.520 . 6.520 4.883 4.365 5.849 . 0 0 "[ . 1]" 1
1541 1 129 THR MG 1 146 GLY HA2 6.520 . 6.520 3.483 2.989 4.484 . 0 0 "[ . 1]" 1
1542 1 129 THR MG 1 147 VAL H 6.520 . 6.520 4.477 3.907 5.090 . 0 0 "[ . 1]" 1
1543 1 129 THR MG 1 147 VAL HB 6.520 . 6.520 4.421 3.205 5.248 . 0 0 "[ . 1]" 1
1544 1 129 THR H 1 180 LEU QD 7.540 . 7.540 5.722 4.778 6.876 . 0 0 "[ . 1]" 1
1545 1 130 ILE HB 1 131 GLY H 5.500 . 5.500 4.189 4.083 4.327 . 0 0 "[ . 1]" 1
1546 1 130 ILE MD 1 131 GLY H 6.520 . 6.520 4.374 3.722 4.904 . 0 0 "[ . 1]" 1
1547 1 130 ILE MD 1 131 GLY HA3 6.520 . 6.520 5.272 4.174 5.998 . 0 0 "[ . 1]" 1
1548 1 130 ILE H 1 131 GLY HA2 5.500 . 5.500 4.981 4.928 5.104 . 0 0 "[ . 1]" 1
1549 1 130 ILE H 1 131 GLY H 5.500 . 5.500 2.339 2.280 2.422 . 0 0 "[ . 1]" 1
1550 1 130 ILE HA 1 132 GLU H 5.500 . 5.500 3.364 3.314 3.443 . 0 0 "[ . 1]" 1
1551 1 130 ILE H 1 133 GLN HG2 5.500 . 5.500 5.663 5.590 5.758 0.258 6 0 "[ . 1]" 1
1552 1 130 ILE HA 1 134 PHE H 6.500 . 6.500 6.756 6.625 6.822 0.322 6 0 "[ . 1]" 1
1553 1 131 GLY H 1 132 GLU HA 5.500 . 5.500 4.975 4.879 5.071 . 0 0 "[ . 1]" 1
1554 1 131 GLY H 1 132 GLU H 5.500 . 5.500 2.751 2.660 2.839 . 0 0 "[ . 1]" 1
1555 1 131 GLY HA3 1 133 GLN HE21 5.500 . 5.500 2.994 2.544 3.884 . 0 0 "[ . 1]" 1
1556 1 131 GLY HA3 1 133 GLN HE22 5.500 . 5.500 4.429 4.142 4.631 . 0 0 "[ . 1]" 1
1557 1 131 GLY HA3 1 133 GLN HG2 5.500 . 5.500 2.523 2.410 2.692 . 0 0 "[ . 1]" 1
1558 1 131 GLY HA3 1 133 GLN H 5.500 . 5.500 3.579 3.418 3.781 . 0 0 "[ . 1]" 1
1559 1 131 GLY HA2 1 133 GLN HE21 5.500 . 5.500 4.179 3.685 5.235 . 0 0 "[ . 1]" 1
1560 1 131 GLY HA2 1 133 GLN HE22 5.500 . 5.500 5.329 5.013 5.594 0.094 9 0 "[ . 1]" 1
1561 1 131 GLY HA2 1 133 GLN H 5.500 . 5.500 4.515 4.375 4.678 . 0 0 "[ . 1]" 1
1562 1 131 GLY H 1 133 GLN HG3 5.500 . 5.500 4.652 4.486 4.807 . 0 0 "[ . 1]" 1
1563 1 131 GLY H 1 133 GLN HG2 5.500 . 5.500 3.627 3.575 3.694 . 0 0 "[ . 1]" 1
1564 1 131 GLY H 1 133 GLN H 5.500 . 5.500 3.715 3.567 3.825 . 0 0 "[ . 1]" 1
1565 1 132 GLU H 1 133 GLN HG2 5.500 . 5.500 3.786 3.628 3.879 . 0 0 "[ . 1]" 1
1566 1 132 GLU H 1 133 GLN H 5.500 . 5.500 2.706 2.574 2.847 . 0 0 "[ . 1]" 1
1567 1 133 GLN HA 1 133 GLN HE21 5.500 . 5.500 4.583 4.125 4.855 . 0 0 "[ . 1]" 1
1568 1 133 GLN HA 1 133 GLN HE22 5.500 . 5.500 4.388 4.022 4.629 . 0 0 "[ . 1]" 1
1569 1 133 GLN H 1 133 GLN QE 6.200 . 6.200 4.214 3.852 4.644 . 0 0 "[ . 1]" 1
1570 1 133 GLN QB 1 134 PHE QD 8.350 . 8.350 3.529 2.441 4.022 . 0 0 "[ . 1]" 1
1571 1 133 GLN QB 1 134 PHE QE 8.350 . 8.350 4.169 3.524 4.578 . 0 0 "[ . 1]" 1
1572 1 133 GLN HB3 1 134 PHE H 5.500 . 5.500 3.690 3.577 3.858 . 0 0 "[ . 1]" 1
1573 1 133 GLN HB2 1 134 PHE H 5.500 . 5.500 2.400 2.302 2.549 . 0 0 "[ . 1]" 1
1574 1 133 GLN HG3 1 134 PHE QD 7.630 . 7.630 5.681 4.769 6.029 . 0 0 "[ . 1]" 1
1575 1 133 GLN HG3 1 134 PHE H 5.500 . 5.500 4.598 4.519 4.652 . 0 0 "[ . 1]" 1
1576 1 133 GLN HG2 1 134 PHE QD 7.630 . 7.630 5.643 4.894 5.898 . 0 0 "[ . 1]" 1
1577 1 133 GLN HG2 1 134 PHE H 5.500 . 5.500 3.853 3.724 3.954 . 0 0 "[ . 1]" 1
1578 1 133 GLN H 1 134 PHE H 5.500 . 5.500 2.392 2.302 2.521 . 0 0 "[ . 1]" 1
1579 1 133 GLN H 1 134 PHE HB2 5.500 . 5.500 4.329 4.173 4.478 . 0 0 "[ . 1]" 1
1580 1 133 GLN HA 1 135 THR H 5.500 . 5.500 4.454 4.250 4.623 . 0 0 "[ . 1]" 1
1581 1 133 GLN QB 1 135 THR H 6.220 . 6.220 4.586 4.474 4.695 . 0 0 "[ . 1]" 1
1582 1 133 GLN H 1 135 THR H 5.500 . 5.500 3.848 3.764 3.960 . 0 0 "[ . 1]" 1
1583 1 133 GLN H 1 135 THR HB 5.500 . 5.500 5.134 4.980 5.261 . 0 0 "[ . 1]" 1
1584 1 133 GLN QB 1 176 LYS QE 6.940 . 6.940 1.859 1.788 1.965 . 0 0 "[ . 1]" 1
1585 1 133 GLN QB 1 180 LEU QD 8.260 . 8.260 3.836 3.409 4.268 . 0 0 "[ . 1]" 1
1586 1 133 GLN HE21 1 180 LEU MD1 6.520 . 6.520 5.978 4.642 6.615 0.095 5 0 "[ . 1]" 1
1587 1 133 GLN HE21 1 180 LEU MD2 6.520 . 6.520 6.041 5.090 6.612 0.092 3 0 "[ . 1]" 1
1588 1 133 GLN HE22 1 180 LEU MD1 6.520 . 6.520 6.323 5.479 6.669 0.149 10 0 "[ . 1]" 1
1589 1 133 GLN HE22 1 180 LEU MD2 6.520 . 6.520 6.490 5.483 6.717 0.197 7 0 "[ . 1]" 1
1590 1 133 GLN HG3 1 180 LEU MD1 6.520 . 6.520 4.670 3.617 5.514 . 0 0 "[ . 1]" 1
1591 1 133 GLN HG3 1 180 LEU MD2 6.520 . 6.520 4.675 3.874 6.500 . 0 0 "[ . 1]" 1
1592 1 133 GLN HG2 1 180 LEU QD 7.540 . 7.540 5.261 4.650 5.795 . 0 0 "[ . 1]" 1
1593 1 134 PHE HB3 1 135 THR H 5.500 . 5.500 3.560 3.368 3.718 . 0 0 "[ . 1]" 1
1594 1 134 PHE HB2 1 135 THR H 5.500 . 5.500 2.661 2.535 2.852 . 0 0 "[ . 1]" 1
1595 1 134 PHE QD 1 135 THR H 7.630 . 7.630 4.477 4.364 4.571 . 0 0 "[ . 1]" 1
1596 1 134 PHE H 1 135 THR H 5.500 . 5.500 2.653 2.588 2.743 . 0 0 "[ . 1]" 1
1597 1 134 PHE H 1 135 THR HB 5.500 . 5.500 4.936 4.899 4.988 . 0 0 "[ . 1]" 1
1598 1 134 PHE H 1 135 THR HA 5.500 . 5.500 5.326 5.245 5.405 . 0 0 "[ . 1]" 1
1599 1 134 PHE HB3 1 136 ASP H 5.500 . 5.500 5.535 5.403 5.584 0.084 4 0 "[ . 1]" 1
1600 1 134 PHE QD 1 136 ASP H 7.630 . 7.630 5.805 5.592 5.974 . 0 0 "[ . 1]" 1
1601 1 134 PHE H 1 136 ASP H 5.500 . 5.500 4.210 4.134 4.356 . 0 0 "[ . 1]" 1
1602 1 134 PHE HB3 1 137 CYS H 5.500 . 5.500 5.306 5.137 5.451 . 0 0 "[ . 1]" 1
1603 1 134 PHE HB3 1 137 CYS QB 6.220 . 6.220 4.734 4.446 5.019 . 0 0 "[ . 1]" 1
1604 1 134 PHE H 1 137 CYS H 5.500 . 5.500 5.057 4.850 5.272 . 0 0 "[ . 1]" 1
1605 1 134 PHE H 1 137 CYS QB 6.220 . 6.220 5.456 5.190 5.810 . 0 0 "[ . 1]" 1
1606 1 134 PHE HB3 1 138 ALA H 5.500 . 5.500 5.218 5.046 5.352 . 0 0 "[ . 1]" 1
1607 1 134 PHE HB3 1 144 ILE MD 6.520 . 6.520 2.191 1.785 2.621 . 0 0 "[ . 1]" 1
1608 1 134 PHE HB2 1 144 ILE MD 6.520 . 6.520 2.856 1.931 3.763 . 0 0 "[ . 1]" 1
1609 1 134 PHE QD 1 144 ILE MD 8.650 . 8.650 3.177 1.990 3.895 . 0 0 "[ . 1]" 1
1610 1 134 PHE QD 1 146 GLY H 7.630 . 7.630 6.668 6.052 7.387 . 0 0 "[ . 1]" 1
1611 1 134 PHE QE 1 147 VAL HB 7.630 . 7.630 5.705 5.079 6.436 . 0 0 "[ . 1]" 1
1612 1 134 PHE HB3 1 171 ALA MB 6.520 . 6.520 6.164 5.584 6.592 0.072 6 0 "[ . 1]" 1
1613 1 134 PHE QD 1 173 VAL HA 7.630 . 7.630 2.888 2.279 3.720 . 0 0 "[ . 1]" 1
1614 1 134 PHE QE 1 173 VAL HA 7.630 . 7.630 4.323 3.588 4.822 . 0 0 "[ . 1]" 1
1615 1 134 PHE QD 1 176 LYS HG2 7.630 . 7.630 4.552 2.882 5.809 . 0 0 "[ . 1]" 1
1616 1 134 PHE QD 1 176 LYS H 7.630 . 7.630 5.106 4.253 5.524 . 0 0 "[ . 1]" 1
1617 1 134 PHE QD 1 176 LYS HG3 7.630 . 7.630 4.804 2.795 6.468 . 0 0 "[ . 1]" 1
1618 1 134 PHE QD 1 176 LYS QB 8.350 . 8.350 3.124 2.165 3.903 . 0 0 "[ . 1]" 1
1619 1 134 PHE QD 1 176 LYS QE 8.350 . 8.350 3.838 2.334 5.309 . 0 0 "[ . 1]" 1
1620 1 134 PHE QE 1 176 LYS H 7.630 . 7.630 5.049 4.386 5.396 . 0 0 "[ . 1]" 1
1621 1 134 PHE QE 1 176 LYS HE2 7.630 . 7.630 4.092 3.413 5.564 . 0 0 "[ . 1]" 1
1622 1 134 PHE QE 1 176 LYS HE3 7.630 . 7.630 3.906 1.965 5.603 . 0 0 "[ . 1]" 1
1623 1 134 PHE QE 1 176 LYS HG2 7.630 . 7.630 3.783 2.561 5.272 . 0 0 "[ . 1]" 1
1624 1 134 PHE QE 1 176 LYS HG3 7.630 . 7.630 4.548 3.134 5.950 . 0 0 "[ . 1]" 1
1625 1 134 PHE QE 1 176 LYS QB 8.350 . 8.350 2.822 1.955 3.341 . 0 0 "[ . 1]" 1
1626 1 134 PHE QD 1 177 ILE H 7.630 . 7.630 5.326 4.346 6.102 . 0 0 "[ . 1]" 1
1627 1 134 PHE QE 1 177 ILE MD 8.650 . 8.650 3.344 2.236 4.146 . 0 0 "[ . 1]" 1
1628 1 134 PHE QE 1 177 ILE H 7.630 . 7.630 4.067 3.001 4.912 . 0 0 "[ . 1]" 1
1629 1 134 PHE HZ 1 177 ILE MD 6.520 . 6.520 3.472 2.182 4.352 . 0 0 "[ . 1]" 1
1630 1 134 PHE HZ 1 177 ILE HA 5.500 . 5.500 4.859 3.771 5.468 . 0 0 "[ . 1]" 1
1631 1 134 PHE QD 1 180 LEU QD 9.670 . 9.670 5.112 4.405 5.814 . 0 0 "[ . 1]" 1
1632 1 134 PHE QE 1 180 LEU MD1 8.650 . 8.650 5.088 2.981 6.753 . 0 0 "[ . 1]" 1
1633 1 134 PHE QE 1 180 LEU MD2 8.650 . 8.650 4.969 3.400 7.384 . 0 0 "[ . 1]" 1
1634 1 134 PHE QE 1 180 LEU QB 8.350 . 8.350 5.070 3.988 6.071 . 0 0 "[ . 1]" 1
1635 1 134 PHE HZ 1 180 LEU QD 7.540 . 7.540 4.473 3.276 5.941 . 0 0 "[ . 1]" 1
1636 1 135 THR HB 1 136 ASP H 5.500 . 5.500 2.540 2.477 2.689 . 0 0 "[ . 1]" 1
1637 1 135 THR MG 1 136 ASP H 6.520 . 6.520 3.679 3.640 3.759 . 0 0 "[ . 1]" 1
1638 1 135 THR H 1 136 ASP H 5.500 . 5.500 2.659 2.619 2.707 . 0 0 "[ . 1]" 1
1639 1 135 THR HA 1 137 CYS H 5.500 . 5.500 4.309 4.255 4.364 . 0 0 "[ . 1]" 1
1640 1 135 THR HB 1 137 CYS H 5.500 . 5.500 4.996 4.923 5.113 . 0 0 "[ . 1]" 1
1641 1 135 THR MG 1 137 CYS H 6.520 . 6.520 5.126 5.087 5.149 . 0 0 "[ . 1]" 1
1642 1 135 THR H 1 137 CYS QB 6.220 . 6.220 5.254 5.126 5.424 . 0 0 "[ . 1]" 1
1643 1 135 THR HA 1 138 ALA H 5.500 . 5.500 3.234 3.168 3.297 . 0 0 "[ . 1]" 1
1644 1 135 THR HA 1 138 ALA MB 6.520 . 6.520 2.443 2.243 2.687 . 0 0 "[ . 1]" 1
1645 1 135 THR HB 1 138 ALA H 5.500 . 5.500 5.193 5.148 5.250 . 0 0 "[ . 1]" 1
1646 1 135 THR H 1 144 ILE MD 6.520 . 6.520 4.051 2.958 4.989 . 0 0 "[ . 1]" 1
1647 1 135 THR H 1 144 ILE HB 5.500 . 5.500 5.458 5.267 5.635 0.135 2 0 "[ . 1]" 1
1648 1 136 ASP H 1 137 CYS H 5.500 . 5.500 2.747 2.717 2.778 . 0 0 "[ . 1]" 1
1649 1 136 ASP HA 1 138 ALA H 5.500 . 5.500 4.169 4.088 4.205 . 0 0 "[ . 1]" 1
1650 1 136 ASP H 1 138 ALA H 5.500 . 5.500 3.906 3.869 3.972 . 0 0 "[ . 1]" 1
1651 1 137 CYS HB3 1 138 ALA H 5.500 . 5.500 3.971 3.691 4.039 . 0 0 "[ . 1]" 1
1652 1 137 CYS HB2 1 138 ALA H 5.500 . 5.500 3.007 2.978 3.072 . 0 0 "[ . 1]" 1
1653 1 137 CYS H 1 138 ALA H 5.500 . 5.500 2.394 2.372 2.417 . 0 0 "[ . 1]" 1
1654 1 137 CYS H 1 138 ALA MB 6.520 . 6.520 3.905 3.856 3.934 . 0 0 "[ . 1]" 1
1655 1 137 CYS H 1 144 ILE MD 6.520 . 6.520 5.945 5.211 6.614 0.094 10 0 "[ . 1]" 1
1656 1 137 CYS QB 1 171 ALA MB 7.240 . 7.240 4.526 4.037 4.755 . 0 0 "[ . 1]" 1
1657 1 137 CYS HA 1 172 THR MG 6.520 . 6.520 4.466 4.336 4.584 . 0 0 "[ . 1]" 1
1658 1 137 CYS HA 1 172 THR H 5.500 . 5.500 3.779 3.673 3.873 . 0 0 "[ . 1]" 1
1659 1 137 CYS QB 1 172 THR H 6.220 . 6.220 2.562 2.213 2.813 . 0 0 "[ . 1]" 1
1660 1 137 CYS H 1 172 THR HB 5.500 . 5.500 5.529 5.330 5.624 0.124 3 0 "[ . 1]" 1
1661 1 137 CYS H 1 172 THR H 5.500 . 5.500 5.118 4.908 5.320 . 0 0 "[ . 1]" 1
1662 1 137 CYS HA 1 173 VAL H 5.500 . 5.500 5.500 5.433 5.608 0.108 1 0 "[ . 1]" 1
1663 1 137 CYS QB 1 173 VAL H 6.220 . 6.220 3.111 2.950 3.267 . 0 0 "[ . 1]" 1
1664 1 137 CYS H 1 173 VAL H 5.500 . 5.500 5.761 5.636 5.864 0.364 6 0 "[ . 1]" 1
1665 1 137 CYS H 1 173 VAL HA 5.500 . 5.500 4.789 4.503 5.009 . 0 0 "[ . 1]" 1
1666 1 137 CYS QB 1 176 LYS H 6.220 . 6.220 4.327 4.025 4.706 . 0 0 "[ . 1]" 1
1667 1 138 ALA MB 1 139 ALA H 6.520 . 6.520 2.691 2.617 2.743 . 0 0 "[ . 1]" 1
1668 1 138 ALA H 1 139 ALA H 5.500 . 5.500 4.594 4.556 4.634 . 0 0 "[ . 1]" 1
1669 1 138 ALA MB 1 142 ASP H 6.520 . 6.520 3.874 3.689 3.984 . 0 0 "[ . 1]" 1
1670 1 138 ALA MB 1 142 ASP HB3 6.520 . 6.520 2.088 1.910 2.297 . 0 0 "[ . 1]" 1
1671 1 138 ALA MB 1 142 ASP HB2 6.520 . 6.520 3.395 3.230 3.635 . 0 0 "[ . 1]" 1
1672 1 138 ALA H 1 142 ASP HB3 5.500 . 5.500 4.898 4.723 5.082 . 0 0 "[ . 1]" 1
1673 1 138 ALA MB 1 143 GLU H 6.520 . 6.520 4.334 4.087 4.490 . 0 0 "[ . 1]" 1
1674 1 138 ALA MB 1 143 GLU QG 7.240 . 7.240 4.507 3.888 5.184 . 0 0 "[ . 1]" 1
1675 1 138 ALA MB 1 144 ILE H 6.520 . 6.520 5.120 4.927 5.322 . 0 0 "[ . 1]" 1
1676 1 138 ALA MB 1 144 ILE MD 7.540 . 7.540 3.383 2.912 4.250 . 0 0 "[ . 1]" 1
1677 1 138 ALA MB 1 144 ILE HB 6.520 . 6.520 6.157 5.765 6.414 . 0 0 "[ . 1]" 1
1678 1 138 ALA H 1 144 ILE MD 6.520 . 6.520 5.213 4.484 5.889 . 0 0 "[ . 1]" 1
1679 1 138 ALA MB 1 167 LEU HB2 6.520 . 6.520 4.665 4.382 4.976 . 0 0 "[ . 1]" 1
1680 1 138 ALA HA 1 171 ALA MB 6.520 . 6.520 2.840 2.472 3.211 . 0 0 "[ . 1]" 1
1681 1 138 ALA MB 1 171 ALA MB 7.540 . 7.540 2.898 2.621 3.282 . 0 0 "[ . 1]" 1
1682 1 138 ALA H 1 171 ALA MB 6.520 . 6.520 4.897 4.616 5.249 . 0 0 "[ . 1]" 1
1683 1 138 ALA MB 1 172 THR H 6.520 . 6.520 4.036 3.861 4.385 . 0 0 "[ . 1]" 1
1684 1 138 ALA H 1 172 THR H 5.500 . 5.500 4.163 4.010 4.403 . 0 0 "[ . 1]" 1
1685 1 138 ALA H 1 173 VAL HA 5.500 . 5.500 5.161 4.676 5.504 0.004 5 0 "[ . 1]" 1
1686 1 139 ALA MB 1 140 ALA H 6.520 . 6.520 2.674 2.521 2.839 . 0 0 "[ . 1]" 1
1687 1 139 ALA H 1 140 ALA H 5.500 . 5.500 4.691 4.657 4.717 . 0 0 "[ . 1]" 1
1688 1 139 ALA MB 1 141 ASP H 6.520 . 6.520 2.523 2.332 2.780 . 0 0 "[ . 1]" 1
1689 1 139 ALA MB 1 141 ASP QB 7.240 . 7.240 3.268 3.070 3.444 . 0 0 "[ . 1]" 1
1690 1 139 ALA HA 1 142 ASP HB2 5.500 . 5.500 4.717 4.564 4.905 . 0 0 "[ . 1]" 1
1691 1 139 ALA HA 1 142 ASP H 5.500 . 5.500 4.331 4.176 4.497 . 0 0 "[ . 1]" 1
1692 1 139 ALA MB 1 142 ASP H 6.520 . 6.520 2.652 2.239 3.099 . 0 0 "[ . 1]" 1
1693 1 139 ALA MB 1 142 ASP HB3 6.520 . 6.520 2.670 2.399 2.997 . 0 0 "[ . 1]" 1
1694 1 139 ALA MB 1 142 ASP HB2 6.520 . 6.520 2.143 1.954 2.404 . 0 0 "[ . 1]" 1
1695 1 139 ALA H 1 142 ASP H 5.500 . 5.500 3.938 3.777 4.126 . 0 0 "[ . 1]" 1
1696 1 139 ALA H 1 142 ASP HB2 5.500 . 5.500 2.900 2.747 3.149 . 0 0 "[ . 1]" 1
1697 1 139 ALA H 1 142 ASP HB3 5.500 . 5.500 2.313 2.039 2.568 . 0 0 "[ . 1]" 1
1698 1 139 ALA MB 1 164 ASN HD22 6.520 . 6.520 3.983 3.755 4.205 . 0 0 "[ . 1]" 1
1699 1 139 ALA HA 1 167 LEU QD 7.540 . 7.540 4.295 4.179 4.419 . 0 0 "[ . 1]" 1
1700 1 139 ALA MB 1 167 LEU HB2 6.520 . 6.520 3.270 3.187 3.406 . 0 0 "[ . 1]" 1
1701 1 139 ALA MB 1 167 LEU H 6.520 . 6.520 5.116 4.979 5.281 . 0 0 "[ . 1]" 1
1702 1 139 ALA MB 1 167 LEU QD 8.560 . 8.560 1.958 1.878 2.081 . 0 0 "[ . 1]" 1
1703 1 139 ALA H 1 167 LEU QD 7.540 . 7.540 3.795 3.624 3.985 . 0 0 "[ . 1]" 1
1704 1 139 ALA MB 1 169 GLY H 6.520 . 6.520 6.197 5.904 6.446 . 0 0 "[ . 1]" 1
1705 1 139 ALA MB 1 170 GLU H 6.520 . 6.520 4.680 4.238 5.260 . 0 0 "[ . 1]" 1
1706 1 139 ALA MB 1 170 GLU QG 7.400 . 7.400 3.881 2.358 4.889 . 0 0 "[ . 1]" 1
1707 1 139 ALA MB 1 170 GLU HB2 6.520 . 6.520 4.060 3.029 5.038 . 0 0 "[ . 1]" 1
1708 1 139 ALA H 1 170 GLU QG 6.380 . 6.380 5.169 3.365 6.420 0.040 2 0 "[ . 1]" 1
1709 1 139 ALA H 1 171 ALA MB 6.520 . 6.520 3.500 2.881 3.819 . 0 0 "[ . 1]" 1
1710 1 139 ALA H 1 172 THR H 5.500 . 5.500 5.124 4.852 5.516 0.016 8 0 "[ . 1]" 1
1711 1 140 ALA MB 1 141 ASP HB2 6.520 . 6.520 3.703 3.517 3.958 . 0 0 "[ . 1]" 1
1712 1 140 ALA MB 1 141 ASP H 6.520 . 6.520 2.686 2.525 2.875 . 0 0 "[ . 1]" 1
1713 1 140 ALA MB 1 141 ASP HB3 6.520 . 6.520 4.393 4.183 4.620 . 0 0 "[ . 1]" 1
1714 1 140 ALA H 1 141 ASP HB3 5.500 . 5.500 5.058 4.946 5.168 . 0 0 "[ . 1]" 1
1715 1 140 ALA H 1 141 ASP HA 5.500 . 5.500 5.471 5.413 5.511 0.011 8 0 "[ . 1]" 1
1716 1 140 ALA H 1 141 ASP H 5.500 . 5.500 2.813 2.737 2.874 . 0 0 "[ . 1]" 1
1717 1 140 ALA H 1 141 ASP HB2 5.500 . 5.500 5.150 5.051 5.238 . 0 0 "[ . 1]" 1
1718 1 140 ALA HA 1 142 ASP H 5.500 . 5.500 4.074 3.848 4.264 . 0 0 "[ . 1]" 1
1719 1 140 ALA H 1 142 ASP H 5.500 . 5.500 4.023 3.942 4.113 . 0 0 "[ . 1]" 1
1720 1 140 ALA MB 1 167 LEU QD 8.560 . 8.560 4.475 4.286 4.649 . 0 0 "[ . 1]" 1
1721 1 140 ALA H 1 167 LEU MD1 6.520 . 6.520 4.588 4.448 4.711 . 0 0 "[ . 1]" 1
1722 1 140 ALA H 1 167 LEU MD2 6.520 . 6.520 5.577 5.191 5.817 . 0 0 "[ . 1]" 1
1723 1 141 ASP H 1 142 ASP HB2 5.500 . 5.500 4.257 4.036 4.394 . 0 0 "[ . 1]" 1
1724 1 141 ASP QB 1 164 ASN HD22 6.220 . 6.220 4.739 4.614 4.858 . 0 0 "[ . 1]" 1
1725 1 141 ASP H 1 164 ASN HD22 5.500 . 5.500 5.726 5.658 5.813 0.313 5 0 "[ . 1]" 1
1726 1 141 ASP QB 1 167 LEU HG 6.220 . 6.220 4.347 4.235 4.525 . 0 0 "[ . 1]" 1
1727 1 141 ASP QB 1 167 LEU QD 7.740 . 7.740 1.878 1.819 1.962 . 0 0 "[ . 1]" 1
1728 1 141 ASP H 1 167 LEU MD2 6.520 . 6.520 4.546 4.353 4.833 . 0 0 "[ . 1]" 1
1729 1 141 ASP H 1 167 LEU MD1 6.520 . 6.520 2.932 2.779 3.189 . 0 0 "[ . 1]" 1
1730 1 142 ASP HB3 1 143 GLU H 5.500 . 5.500 4.189 4.139 4.257 . 0 0 "[ . 1]" 1
1731 1 142 ASP H 1 143 GLU H 5.500 . 5.500 4.490 4.438 4.543 . 0 0 "[ . 1]" 1
1732 1 142 ASP HA 1 163 VAL H 5.500 . 5.500 4.831 4.607 5.084 . 0 0 "[ . 1]" 1
1733 1 142 ASP HB2 1 164 ASN HD21 5.500 . 5.500 3.679 3.495 3.897 . 0 0 "[ . 1]" 1
1734 1 142 ASP HB2 1 164 ASN HD22 5.500 . 5.500 2.284 2.126 2.497 . 0 0 "[ . 1]" 1
1735 1 142 ASP H 1 164 ASN HD22 5.500 . 5.500 4.109 3.958 4.294 . 0 0 "[ . 1]" 1
1736 1 142 ASP HA 1 167 LEU HG 5.500 . 5.500 4.513 4.250 5.148 . 0 0 "[ . 1]" 1
1737 1 142 ASP HA 1 167 LEU QD 7.540 . 7.540 2.426 2.202 3.051 . 0 0 "[ . 1]" 1
1738 1 142 ASP HB3 1 167 LEU HG 5.500 . 5.500 5.607 5.565 5.689 0.189 8 0 "[ . 1]" 1
1739 1 142 ASP HB3 1 167 LEU QD 7.540 . 7.540 3.216 3.115 3.291 . 0 0 "[ . 1]" 1
1740 1 142 ASP HB2 1 167 LEU HG 5.500 . 5.500 3.864 3.812 3.984 . 0 0 "[ . 1]" 1
1741 1 142 ASP HB2 1 167 LEU QD 7.540 . 7.540 1.937 1.886 2.099 . 0 0 "[ . 1]" 1
1742 1 142 ASP H 1 167 LEU HG 5.500 . 5.500 5.470 5.285 5.596 0.096 8 0 "[ . 1]" 1
1743 1 142 ASP H 1 167 LEU QD 7.540 . 7.540 2.621 2.478 2.748 . 0 0 "[ . 1]" 1
1744 1 143 GLU HA 1 144 ILE MD 6.520 . 6.520 3.226 2.318 4.656 . 0 0 "[ . 1]" 1
1745 1 143 GLU HB3 1 144 ILE H 5.500 . 5.500 2.803 2.446 3.802 . 0 0 "[ . 1]" 1
1746 1 143 GLU HB3 1 144 ILE MD 6.520 . 6.520 4.755 3.885 5.699 . 0 0 "[ . 1]" 1
1747 1 143 GLU HB2 1 144 ILE H 5.500 . 5.500 3.675 2.551 3.968 . 0 0 "[ . 1]" 1
1748 1 143 GLU HB2 1 144 ILE MD 6.520 . 6.520 5.151 4.493 6.669 0.149 2 0 "[ . 1]" 1
1749 1 143 GLU QG 1 144 ILE H 6.220 . 6.220 3.589 2.017 3.859 . 0 0 "[ . 1]" 1
1750 1 143 GLU HG3 1 144 ILE MD 6.520 . 6.520 5.455 3.465 6.767 0.247 2 0 "[ . 1]" 1
1751 1 143 GLU HG2 1 144 ILE MD 6.520 . 6.520 5.136 3.705 6.207 . 0 0 "[ . 1]" 1
1752 1 143 GLU H 1 144 ILE HA 5.500 . 5.500 4.753 4.676 4.875 . 0 0 "[ . 1]" 1
1753 1 143 GLU H 1 144 ILE MD 6.520 . 6.520 4.540 4.039 6.283 . 0 0 "[ . 1]" 1
1754 1 143 GLU H 1 162 ASN HA 5.500 . 5.500 4.957 4.748 5.091 . 0 0 "[ . 1]" 1
1755 1 143 GLU H 1 162 ASN QB 6.380 . 6.380 4.889 3.516 5.497 . 0 0 "[ . 1]" 1
1756 1 143 GLU HA 1 163 VAL H 5.500 . 5.500 5.009 4.909 5.104 . 0 0 "[ . 1]" 1
1757 1 143 GLU QB 1 163 VAL HB 6.220 . 6.220 3.432 2.971 4.421 . 0 0 "[ . 1]" 1
1758 1 143 GLU QG 1 163 VAL HB 6.220 . 6.220 4.924 2.349 5.950 . 0 0 "[ . 1]" 1
1759 1 143 GLU H 1 163 VAL H 5.500 . 5.500 3.251 2.993 3.433 . 0 0 "[ . 1]" 1
1760 1 143 GLU H 1 163 VAL HA 5.500 . 5.500 5.475 5.303 5.597 0.097 3 0 "[ . 1]" 1
1761 1 143 GLU H 1 163 VAL HB 5.500 . 5.500 3.913 3.542 4.443 . 0 0 "[ . 1]" 1
1762 1 143 GLU QB 1 164 ASN H 6.220 . 6.220 5.345 5.014 6.250 0.030 9 0 "[ . 1]" 1
1763 1 143 GLU H 1 164 ASN H 5.500 . 5.500 3.635 3.496 3.790 . 0 0 "[ . 1]" 1
1764 1 144 ILE MD 1 145 ILE H 6.520 . 6.520 4.405 3.647 5.249 . 0 0 "[ . 1]" 1
1765 1 144 ILE H 1 145 ILE H 5.500 . 5.500 4.425 4.396 4.448 . 0 0 "[ . 1]" 1
1766 1 144 ILE MD 1 146 GLY H 6.520 . 6.520 4.829 4.049 5.542 . 0 0 "[ . 1]" 1
1767 1 144 ILE H 1 146 GLY H 5.500 . 5.500 5.420 5.305 5.476 . 0 0 "[ . 1]" 1
1768 1 144 ILE MD 1 160 VAL HB 6.520 . 6.520 4.966 3.696 6.393 . 0 0 "[ . 1]" 1
1769 1 144 ILE MD 1 162 ASN HD22 6.520 . 6.520 4.536 2.872 6.465 . 0 0 "[ . 1]" 1
1770 1 144 ILE MD 1 162 ASN HD21 6.520 . 6.520 4.382 1.891 6.542 0.022 1 0 "[ . 1]" 1
1771 1 144 ILE MD 1 162 ASN H 6.520 . 6.520 5.558 4.333 6.696 0.176 4 0 "[ . 1]" 1
1772 1 144 ILE MD 1 162 ASN QB 7.400 . 7.400 3.867 2.303 5.095 . 0 0 "[ . 1]" 1
1773 1 144 ILE MD 1 162 ASN HA 6.520 . 6.520 3.603 2.484 4.703 . 0 0 "[ . 1]" 1
1774 1 144 ILE H 1 162 ASN QB 6.380 . 6.380 5.888 4.844 6.329 . 0 0 "[ . 1]" 1
1775 1 144 ILE MD 1 163 VAL H 6.520 . 6.520 4.577 3.745 6.014 . 0 0 "[ . 1]" 1
1776 1 144 ILE MD 1 171 ALA MB 7.540 . 7.540 5.122 4.503 5.829 . 0 0 "[ . 1]" 1
1777 1 144 ILE MD 1 173 VAL H 6.520 . 6.520 5.710 5.278 6.194 . 0 0 "[ . 1]" 1
1778 1 145 ILE HB 1 146 GLY H 5.500 . 5.500 4.146 4.058 4.260 . 0 0 "[ . 1]" 1
1779 1 145 ILE MD 1 146 GLY H 6.520 . 6.520 4.201 4.059 4.405 . 0 0 "[ . 1]" 1
1780 1 145 ILE H 1 146 GLY H 5.500 . 5.500 2.486 2.450 2.528 . 0 0 "[ . 1]" 1
1781 1 145 ILE H 1 146 GLY QA 6.220 . 6.220 4.544 4.521 4.575 . 0 0 "[ . 1]" 1
1782 1 145 ILE MD 1 161 TRP HD1 6.520 . 6.520 5.030 4.773 5.318 . 0 0 "[ . 1]" 1
1783 1 145 ILE H 1 161 TRP H 5.500 . 5.500 5.213 5.092 5.333 . 0 0 "[ . 1]" 1
1784 1 145 ILE H 1 161 TRP QB 6.220 . 6.220 3.826 3.625 3.949 . 0 0 "[ . 1]" 1
1785 1 145 ILE MD 1 162 ASN HA 6.520 . 6.520 4.536 4.266 4.822 . 0 0 "[ . 1]" 1
1786 1 145 ILE MD 1 162 ASN H 6.520 . 6.520 4.130 3.887 4.464 . 0 0 "[ . 1]" 1
1787 1 145 ILE H 1 162 ASN HA 5.500 . 5.500 2.464 2.028 2.661 . 0 0 "[ . 1]" 1
1788 1 145 ILE H 1 162 ASN H 5.500 . 5.500 4.512 4.314 4.653 . 0 0 "[ . 1]" 1
1789 1 145 ILE HB 1 163 VAL HB 5.500 . 5.500 4.878 4.714 5.630 0.130 8 0 "[ . 1]" 1
1790 1 145 ILE MD 1 163 VAL HA 6.520 . 6.520 3.224 2.843 3.499 . 0 0 "[ . 1]" 1
1791 1 145 ILE MD 1 163 VAL HB 6.520 . 6.520 4.619 4.238 4.980 . 0 0 "[ . 1]" 1
1792 1 146 GLY H 1 147 VAL H 5.500 . 5.500 4.410 4.392 4.434 . 0 0 "[ . 1]" 1
1793 1 146 GLY H 1 161 TRP HA 5.500 . 5.500 5.091 4.883 5.258 . 0 0 "[ . 1]" 1
1794 1 146 GLY H 1 161 TRP H 5.500 . 5.500 3.737 3.565 3.899 . 0 0 "[ . 1]" 1
1795 1 146 GLY H 1 161 TRP HD1 5.500 . 5.500 5.385 5.000 5.583 0.083 8 0 "[ . 1]" 1
1796 1 146 GLY H 1 161 TRP QB 6.220 . 6.220 3.017 2.779 3.137 . 0 0 "[ . 1]" 1
1797 1 146 GLY H 1 162 ASN HA 5.500 . 5.500 4.124 3.836 4.298 . 0 0 "[ . 1]" 1
1798 1 146 GLY H 1 163 VAL H 5.500 . 5.500 5.648 5.584 5.726 0.226 7 0 "[ . 1]" 1
1799 1 147 VAL HB 1 148 SER H 5.500 . 5.500 3.385 2.898 4.136 . 0 0 "[ . 1]" 1
1800 1 147 VAL HA 1 159 GLN H 5.500 . 5.500 5.178 4.898 5.453 . 0 0 "[ . 1]" 1
1801 1 147 VAL HB 1 159 GLN H 5.500 . 5.500 5.072 4.249 5.968 0.468 1 0 "[ . 1]" 1
1802 1 147 VAL HA 1 160 VAL HA 5.500 . 5.500 1.991 1.858 2.111 . 0 0 "[ . 1]" 1
1803 1 147 VAL HA 1 161 TRP H 5.500 . 5.500 2.115 1.932 2.272 . 0 0 "[ . 1]" 1
1804 1 147 VAL HA 1 161 TRP HD1 5.500 . 5.500 2.864 2.455 3.239 . 0 0 "[ . 1]" 1
1805 1 147 VAL HB 1 161 TRP HD1 5.500 . 5.500 5.189 4.665 5.512 0.012 7 0 "[ . 1]" 1
1806 1 147 VAL H 1 161 TRP HD1 5.500 . 5.500 3.976 3.514 4.417 . 0 0 "[ . 1]" 1
1807 1 147 VAL H 1 161 TRP H 5.500 . 5.500 4.144 4.069 4.232 . 0 0 "[ . 1]" 1
1808 1 148 SER H 1 149 VAL H 5.500 . 5.500 4.451 4.412 4.485 . 0 0 "[ . 1]" 1
1809 1 148 SER H 1 158 VAL HA 5.500 . 5.500 5.402 5.227 5.502 0.002 5 0 "[ . 1]" 1
1810 1 148 SER HA 1 159 GLN HE22 5.500 . 5.500 5.256 4.716 5.623 0.123 3 0 "[ . 1]" 1
1811 1 148 SER HA 1 159 GLN HE21 5.500 . 5.500 4.539 4.259 4.704 . 0 0 "[ . 1]" 1
1812 1 148 SER H 1 159 GLN HE22 5.500 . 5.500 4.147 3.350 4.935 . 0 0 "[ . 1]" 1
1813 1 148 SER H 1 159 GLN HE21 5.500 . 5.500 2.825 2.320 3.467 . 0 0 "[ . 1]" 1
1814 1 148 SER H 1 159 GLN H 5.500 . 5.500 3.486 3.291 3.587 . 0 0 "[ . 1]" 1
1815 1 148 SER H 1 159 GLN QG 6.220 . 6.220 4.169 3.677 4.552 . 0 0 "[ . 1]" 1
1816 1 148 SER H 1 160 VAL HA 5.500 . 5.500 3.066 2.810 3.181 . 0 0 "[ . 1]" 1
1817 1 148 SER HA 1 161 TRP HE1 5.500 . 5.500 4.641 4.306 5.215 . 0 0 "[ . 1]" 1
1818 1 148 SER QB 1 161 TRP HE1 6.220 . 6.220 2.047 1.858 2.541 . 0 0 "[ . 1]" 1
1819 1 148 SER H 1 161 TRP HE1 5.500 . 5.500 4.131 3.702 4.625 . 0 0 "[ . 1]" 1
1820 1 149 VAL HA 1 150 SER HB3 5.500 . 5.500 4.697 4.340 5.476 . 0 0 "[ . 1]" 1
1821 1 149 VAL HA 1 150 SER HB2 5.500 . 5.500 4.384 4.033 4.725 . 0 0 "[ . 1]" 1
1822 1 149 VAL HB 1 150 SER H 5.500 . 5.500 4.276 4.181 4.356 . 0 0 "[ . 1]" 1
1823 1 149 VAL H 1 150 SER H 5.500 . 5.500 4.335 4.293 4.379 . 0 0 "[ . 1]" 1
1824 1 149 VAL H 1 150 SER HB2 5.500 . 5.500 5.249 5.020 5.519 0.019 3 0 "[ . 1]" 1
1825 1 149 VAL HA 1 158 VAL HA 5.500 . 5.500 2.491 2.181 2.687 . 0 0 "[ . 1]" 1
1826 1 149 VAL H 1 158 VAL HA 5.500 . 5.500 5.239 4.914 5.462 . 0 0 "[ . 1]" 1
1827 1 149 VAL HA 1 159 GLN HB3 5.500 . 5.500 4.234 3.867 4.625 . 0 0 "[ . 1]" 1
1828 1 149 VAL H 1 159 GLN HB3 5.500 . 5.500 5.410 4.992 5.597 0.097 2 0 "[ . 1]" 1
1829 1 150 SER HB3 1 151 VAL H 5.500 . 5.500 3.962 2.901 4.418 . 0 0 "[ . 1]" 1
1830 1 150 SER H 1 151 VAL H 5.500 . 5.500 4.444 4.198 4.527 . 0 0 "[ . 1]" 1
1831 1 150 SER H 1 156 ASP QB 6.220 . 6.220 5.488 4.666 6.287 0.067 7 0 "[ . 1]" 1
1832 1 150 SER HB3 1 157 VAL H 5.500 . 5.500 4.045 3.660 4.496 . 0 0 "[ . 1]" 1
1833 1 150 SER HB3 1 157 VAL HB 5.500 . 5.500 3.503 1.903 5.001 . 0 0 "[ . 1]" 1
1834 1 150 SER HB2 1 157 VAL HB 5.500 . 5.500 4.626 3.344 5.573 0.073 9 0 "[ . 1]" 1
1835 1 150 SER H 1 157 VAL H 5.500 . 5.500 3.339 3.095 3.721 . 0 0 "[ . 1]" 1
1836 1 150 SER H 1 158 VAL HA 5.500 . 5.500 3.674 3.407 3.951 . 0 0 "[ . 1]" 1
1837 1 151 VAL HB 1 152 ARG H 5.500 . 5.500 4.416 4.308 4.514 . 0 0 "[ . 1]" 1
1838 1 151 VAL H 1 152 ARG H 5.500 . 5.500 4.424 4.328 4.584 . 0 0 "[ . 1]" 1
1839 1 151 VAL HA 1 156 ASP HA 5.500 . 5.500 2.437 2.093 2.739 . 0 0 "[ . 1]" 1
1840 1 151 VAL H 1 156 ASP QB 6.220 . 6.220 5.868 5.395 6.172 . 0 0 "[ . 1]" 1
1841 1 151 VAL HA 1 157 VAL H 5.500 . 5.500 3.326 3.055 3.624 . 0 0 "[ . 1]" 1
1842 1 151 VAL H 1 157 VAL H 5.500 . 5.500 4.958 4.684 5.215 . 0 0 "[ . 1]" 1
1843 1 152 ARG QB 1 153 ASP HA 6.220 . 6.220 4.590 4.493 4.776 . 0 0 "[ . 1]" 1
1844 1 152 ARG HB3 1 153 ASP H 5.500 . 5.500 2.788 2.505 3.357 . 0 0 "[ . 1]" 1
1845 1 152 ARG HB2 1 153 ASP H 5.500 . 5.500 3.952 3.738 4.205 . 0 0 "[ . 1]" 1
1846 1 152 ARG HD3 1 153 ASP H 5.500 . 5.500 4.024 2.946 4.863 . 0 0 "[ . 1]" 1
1847 1 152 ARG HD2 1 153 ASP H 5.500 . 5.500 4.452 3.011 5.602 0.102 7 0 "[ . 1]" 1
1848 1 152 ARG HG3 1 153 ASP H 5.500 . 5.500 4.414 2.238 4.924 . 0 0 "[ . 1]" 1
1849 1 152 ARG HG2 1 153 ASP H 5.500 . 5.500 4.042 2.346 4.833 . 0 0 "[ . 1]" 1
1850 1 152 ARG QB 1 155 GLU H 6.220 . 6.220 2.452 2.186 2.587 . 0 0 "[ . 1]" 1
1851 1 152 ARG QD 1 155 GLU H 6.220 . 6.220 4.570 3.607 5.269 . 0 0 "[ . 1]" 1
1852 1 152 ARG QG 1 155 GLU HA 6.220 . 6.220 6.302 6.052 6.450 0.230 3 0 "[ . 1]" 1
1853 1 152 ARG QG 1 156 ASP H 6.220 . 6.220 5.869 5.530 6.391 0.171 8 0 "[ . 1]" 1
1854 1 152 ARG H 1 156 ASP H 5.500 . 5.500 4.471 4.383 4.723 . 0 0 "[ . 1]" 1
1855 1 152 ARG H 1 156 ASP HA 5.500 . 5.500 2.045 1.947 2.203 . 0 0 "[ . 1]" 1
1856 1 152 ARG QG 1 157 VAL H 6.220 . 6.220 4.843 4.094 6.403 0.183 4 0 "[ . 1]" 1
1857 1 152 ARG H 1 157 VAL H 5.500 . 5.500 3.959 3.752 4.294 . 0 0 "[ . 1]" 1
1858 1 153 ASP HA 1 154 ARG QG 6.220 . 6.220 5.503 4.998 6.410 0.190 2 0 "[ . 1]" 1
1859 1 153 ASP QB 1 154 ARG HA 6.220 . 6.220 4.071 3.892 4.281 . 0 0 "[ . 1]" 1
1860 1 153 ASP QB 1 154 ARG QB 7.100 . 7.100 4.093 3.537 4.842 . 0 0 "[ . 1]" 1
1861 1 153 ASP QB 1 154 ARG QG 6.520 . 6.520 3.806 3.027 5.671 . 0 0 "[ . 1]" 1
1862 1 153 ASP H 1 154 ARG QB 6.380 . 6.380 4.688 4.546 4.764 . 0 0 "[ . 1]" 1
1863 1 153 ASP H 1 154 ARG H 5.500 . 5.500 2.948 2.901 2.988 . 0 0 "[ . 1]" 1
1864 1 153 ASP HA 1 155 GLU H 5.500 . 5.500 4.741 4.658 4.806 . 0 0 "[ . 1]" 1
1865 1 153 ASP H 1 155 GLU H 5.500 . 5.500 4.219 4.117 4.288 . 0 0 "[ . 1]" 1
1866 1 154 ARG QD 1 155 GLU H 6.220 . 6.220 4.817 4.459 5.169 . 0 0 "[ . 1]" 1
1867 1 154 ARG QG 1 155 GLU H 6.220 . 6.220 4.014 3.629 4.167 . 0 0 "[ . 1]" 1
1868 1 154 ARG H 1 155 GLU H 5.500 . 5.500 2.747 2.650 2.814 . 0 0 "[ . 1]" 1
1869 1 155 GLU HB3 1 156 ASP H 5.500 . 5.500 2.235 1.857 3.556 . 0 0 "[ . 1]" 1
1870 1 155 GLU HB2 1 156 ASP H 5.500 . 5.500 2.888 2.036 3.161 . 0 0 "[ . 1]" 1
1871 1 155 GLU QG 1 156 ASP H 6.380 . 6.380 3.513 2.406 4.016 . 0 0 "[ . 1]" 1
1872 1 155 GLU H 1 156 ASP H 5.500 . 5.500 4.324 4.293 4.351 . 0 0 "[ . 1]" 1
1873 1 156 ASP HB3 1 157 VAL H 5.500 . 5.500 2.986 2.244 3.609 . 0 0 "[ . 1]" 1
1874 1 156 ASP HB2 1 157 VAL H 5.500 . 5.500 3.861 3.510 4.012 . 0 0 "[ . 1]" 1
1875 1 156 ASP H 1 157 VAL H 5.500 . 5.500 4.502 4.441 4.573 . 0 0 "[ . 1]" 1
1876 1 157 VAL HB 1 158 VAL H 5.500 . 5.500 3.227 2.571 3.963 . 0 0 "[ . 1]" 1
1877 1 157 VAL H 1 158 VAL H 5.500 . 5.500 4.452 4.437 4.467 . 0 0 "[ . 1]" 1
1878 1 158 VAL HA 1 159 GLN HE21 5.500 . 5.500 5.733 5.660 5.799 0.299 5 0 "[ . 1]" 1
1879 1 159 GLN HA 1 159 GLN HE21 5.500 . 5.500 4.290 3.867 4.595 . 0 0 "[ . 1]" 1
1880 1 159 GLN HB3 1 160 VAL HA 5.500 . 5.500 4.967 4.866 5.036 . 0 0 "[ . 1]" 1
1881 1 159 GLN HG3 1 160 VAL H 5.500 . 5.500 3.460 2.965 3.951 . 0 0 "[ . 1]" 1
1882 1 159 GLN HG2 1 160 VAL H 5.500 . 5.500 2.245 2.083 2.584 . 0 0 "[ . 1]" 1
1883 1 159 GLN HE21 1 161 TRP HE1 5.500 . 5.500 3.016 2.417 3.853 . 0 0 "[ . 1]" 1
1884 1 159 GLN HE21 1 161 TRP H 5.500 . 5.500 4.888 4.158 5.615 0.115 5 0 "[ . 1]" 1
1885 1 159 GLN HE21 1 161 TRP HZ2 5.500 . 5.500 4.845 4.353 5.551 0.051 6 0 "[ . 1]" 1
1886 1 159 GLN HE22 1 161 TRP HE1 5.500 . 5.500 2.155 1.957 2.648 . 0 0 "[ . 1]" 1
1887 1 160 VAL HB 1 161 TRP H 5.500 . 5.500 4.283 4.200 4.373 . 0 0 "[ . 1]" 1
1888 1 160 VAL H 1 161 TRP H 5.500 . 5.500 4.425 4.323 4.484 . 0 0 "[ . 1]" 1
1889 1 160 VAL HB 1 162 ASN H 5.500 . 5.500 5.578 5.398 5.751 0.251 1 0 "[ . 1]" 1
1890 1 161 TRP HB3 1 162 ASN H 5.500 . 5.500 3.587 3.491 3.716 . 0 0 "[ . 1]" 1
1891 1 161 TRP HB2 1 162 ASN H 5.500 . 5.500 4.439 4.329 4.514 . 0 0 "[ . 1]" 1
1892 1 162 ASN QB 1 163 VAL H 6.380 . 6.380 3.126 2.453 3.446 . 0 0 "[ . 1]" 1
1893 1 162 ASN H 1 163 VAL H 5.500 . 5.500 4.550 4.527 4.579 . 0 0 "[ . 1]" 1
1894 1 162 ASN HA 1 164 ASN H 5.500 . 5.500 4.397 4.219 4.637 . 0 0 "[ . 1]" 1
1895 1 163 VAL HB 1 164 ASN H 5.500 . 5.500 3.934 3.807 4.089 . 0 0 "[ . 1]" 1
1896 1 163 VAL H 1 164 ASN HD22 5.500 . 5.500 5.190 5.025 5.340 . 0 0 "[ . 1]" 1
1897 1 163 VAL H 1 164 ASN H 5.500 . 5.500 2.577 2.502 2.702 . 0 0 "[ . 1]" 1
1898 1 163 VAL H 1 164 ASN HD21 5.500 . 5.500 5.280 3.622 5.586 0.086 2 0 "[ . 1]" 1
1899 1 164 ASN QB 1 165 ALA MB 7.240 . 7.240 4.451 4.307 4.562 . 0 0 "[ . 1]" 1
1900 1 164 ASN HD21 1 165 ALA MB 6.520 . 6.520 5.028 4.835 5.997 . 0 0 "[ . 1]" 1
1901 1 164 ASN H 1 165 ALA H 5.500 . 5.500 4.429 4.349 4.536 . 0 0 "[ . 1]" 1
1902 1 164 ASN HA 1 166 SER H 5.500 . 5.500 3.840 3.695 4.043 . 0 0 "[ . 1]" 1
1903 1 164 ASN HB3 1 166 SER H 5.500 . 5.500 4.557 4.507 4.701 . 0 0 "[ . 1]" 1
1904 1 164 ASN HB2 1 166 SER H 5.500 . 5.500 2.974 2.882 3.076 . 0 0 "[ . 1]" 1
1905 1 164 ASN QB 1 167 LEU HG 6.220 . 6.220 3.047 2.714 3.999 . 0 0 "[ . 1]" 1
1906 1 164 ASN QB 1 167 LEU QD 7.510 . 7.510 3.330 3.198 3.568 . 0 0 "[ . 1]" 1
1907 1 164 ASN HB3 1 167 LEU H 5.500 . 5.500 4.913 4.759 5.047 . 0 0 "[ . 1]" 1
1908 1 164 ASN HB2 1 167 LEU H 5.500 . 5.500 3.333 3.113 3.848 . 0 0 "[ . 1]" 1
1909 1 164 ASN HD21 1 167 LEU H 5.500 . 5.500 2.533 2.136 4.452 . 0 0 "[ . 1]" 1
1910 1 164 ASN HD21 1 167 LEU MD2 6.520 . 6.520 4.272 3.929 5.781 . 0 0 "[ . 1]" 1
1911 1 164 ASN HD21 1 167 LEU HG 5.500 . 5.500 2.780 2.312 4.880 . 0 0 "[ . 1]" 1
1912 1 164 ASN HD21 1 167 LEU MD1 6.520 . 6.520 3.051 2.878 3.638 . 0 0 "[ . 1]" 1
1913 1 164 ASN HD22 1 167 LEU MD1 6.520 . 6.520 2.012 1.900 2.651 . 0 0 "[ . 1]" 1
1914 1 164 ASN HD22 1 167 LEU MD2 6.520 . 6.520 4.185 4.044 4.542 . 0 0 "[ . 1]" 1
1915 1 164 ASN HD22 1 167 LEU HG 5.500 . 5.500 2.971 2.671 3.689 . 0 0 "[ . 1]" 1
1916 1 164 ASN H 1 167 LEU QD 7.540 . 7.540 4.702 4.551 5.139 . 0 0 "[ . 1]" 1
1917 1 164 ASN HD21 1 168 VAL H 5.500 . 5.500 4.212 3.951 5.404 . 0 0 "[ . 1]" 1
1918 1 164 ASN HD21 1 168 VAL HA 5.500 . 5.500 5.300 5.102 5.928 0.428 8 0 "[ . 1]" 1
1919 1 165 ALA MB 1 166 SER H 6.520 . 6.520 2.905 2.789 3.105 . 0 0 "[ . 1]" 1
1920 1 165 ALA MB 1 166 SER HA 6.520 . 6.520 3.824 3.721 3.935 . 0 0 "[ . 1]" 1
1921 1 165 ALA MB 1 166 SER QB 7.240 . 7.240 4.210 4.029 4.533 . 0 0 "[ . 1]" 1
1922 1 165 ALA H 1 166 SER H 5.500 . 5.500 2.205 2.032 2.302 . 0 0 "[ . 1]" 1
1923 1 165 ALA H 1 166 SER HB2 5.500 . 5.500 4.919 4.173 5.686 0.186 2 0 "[ . 1]" 1
1924 1 165 ALA H 1 166 SER HB3 5.500 . 5.500 4.590 4.213 5.717 0.217 4 0 "[ . 1]" 1
1925 1 165 ALA H 1 167 LEU H 5.500 . 5.500 4.135 3.893 4.272 . 0 0 "[ . 1]" 1
1926 1 165 ALA H 1 167 LEU HG 5.500 . 5.500 5.387 4.998 5.573 0.073 8 0 "[ . 1]" 1
1927 1 165 ALA H 1 167 LEU QD 7.540 . 7.540 5.465 5.191 5.572 . 0 0 "[ . 1]" 1
1928 1 165 ALA HA 1 168 VAL H 5.500 . 5.500 3.411 3.167 3.599 . 0 0 "[ . 1]" 1
1929 1 165 ALA MB 1 168 VAL H 6.520 . 6.520 4.234 4.060 4.392 . 0 0 "[ . 1]" 1
1930 1 165 ALA MB 1 194 HIS HD2 6.520 . 6.520 5.883 3.627 6.596 0.076 4 0 "[ . 1]" 1
1931 1 165 ALA MB 1 194 HIS H 6.520 . 6.520 2.881 2.528 3.555 . 0 0 "[ . 1]" 1
1932 1 165 ALA MB 1 195 GLU H 6.520 . 6.520 3.929 3.374 4.971 . 0 0 "[ . 1]" 1
1933 1 165 ALA MB 1 195 GLU HG3 6.520 . 6.520 5.361 4.202 6.493 . 0 0 "[ . 1]" 1
1934 1 165 ALA MB 1 195 GLU HG2 6.520 . 6.520 5.208 3.307 6.577 0.057 3 0 "[ . 1]" 1
1935 1 165 ALA MB 1 196 GLU H 6.520 . 6.520 4.858 3.888 6.198 . 0 0 "[ . 1]" 1
1936 1 166 SER H 1 167 LEU HB2 5.500 . 5.500 5.112 4.849 5.252 . 0 0 "[ . 1]" 1
1937 1 166 SER H 1 167 LEU HG 5.500 . 5.500 4.131 3.961 4.285 . 0 0 "[ . 1]" 1
1938 1 166 SER H 1 167 LEU H 5.500 . 5.500 2.748 2.629 2.804 . 0 0 "[ . 1]" 1
1939 1 166 SER H 1 167 LEU QD 7.540 . 7.540 4.434 4.183 4.639 . 0 0 "[ . 1]" 1
1940 1 166 SER HA 1 168 VAL H 5.500 . 5.500 3.806 3.638 4.141 . 0 0 "[ . 1]" 1
1941 1 166 SER QB 1 168 VAL H 6.220 . 6.220 4.680 4.433 4.878 . 0 0 "[ . 1]" 1
1942 1 166 SER H 1 168 VAL H 5.500 . 5.500 4.167 4.044 4.295 . 0 0 "[ . 1]" 1
1943 1 166 SER HA 1 169 GLY H 5.500 . 5.500 4.806 4.587 4.973 . 0 0 "[ . 1]" 1
1944 1 167 LEU HB2 1 168 VAL H 5.500 . 5.500 3.683 3.507 3.748 . 0 0 "[ . 1]" 1
1945 1 167 LEU QD 1 168 VAL H 7.540 . 7.540 4.237 4.164 4.375 . 0 0 "[ . 1]" 1
1946 1 167 LEU HA 1 169 GLY H 5.500 . 5.500 3.735 3.499 3.991 . 0 0 "[ . 1]" 1
1947 1 167 LEU QD 1 169 GLY H 7.540 . 7.540 4.978 4.821 5.165 . 0 0 "[ . 1]" 1
1948 1 167 LEU HA 1 170 GLU H 5.500 . 5.500 3.465 3.353 3.637 . 0 0 "[ . 1]" 1
1949 1 167 LEU QD 1 170 GLU QG 8.420 . 8.420 4.822 3.275 5.296 . 0 0 "[ . 1]" 1
1950 1 168 VAL HB 1 169 GLY H 5.500 . 5.500 3.465 2.650 3.953 . 0 0 "[ . 1]" 1
1951 1 168 VAL H 1 169 GLY H 5.500 . 5.500 2.621 2.549 2.685 . 0 0 "[ . 1]" 1
1952 1 168 VAL H 1 169 GLY QA 6.220 . 6.220 4.530 4.464 4.584 . 0 0 "[ . 1]" 1
1953 1 168 VAL HA 1 171 ALA H 5.500 . 5.500 3.908 3.080 4.214 . 0 0 "[ . 1]" 1
1954 1 168 VAL HA 1 171 ALA MB 6.520 . 6.520 2.212 2.014 2.390 . 0 0 "[ . 1]" 1
1955 1 168 VAL HB 1 171 ALA MB 6.520 . 6.520 4.267 3.393 4.685 . 0 0 "[ . 1]" 1
1956 1 168 VAL H 1 171 ALA MB 6.520 . 6.520 4.295 4.052 4.429 . 0 0 "[ . 1]" 1
1957 1 169 GLY H 1 170 GLU H 5.500 . 5.500 2.796 2.724 2.845 . 0 0 "[ . 1]" 1
1958 1 169 GLY H 1 170 GLU QG 6.380 . 6.380 5.627 4.122 6.466 0.086 4 0 "[ . 1]" 1
1959 1 169 GLY H 1 170 GLU HA 5.500 . 5.500 5.431 5.388 5.465 . 0 0 "[ . 1]" 1
1960 1 169 GLY H 1 171 ALA H 5.500 . 5.500 4.458 3.771 4.717 . 0 0 "[ . 1]" 1
1961 1 169 GLY H 1 171 ALA MB 6.520 . 6.520 4.337 4.204 4.419 . 0 0 "[ . 1]" 1
1962 1 170 GLU HB3 1 171 ALA H 5.500 . 5.500 4.325 4.116 4.636 . 0 0 "[ . 1]" 1
1963 1 170 GLU QG 1 171 ALA H 6.380 . 6.380 4.346 3.855 4.676 . 0 0 "[ . 1]" 1
1964 1 170 GLU QG 1 171 ALA MB 7.400 . 7.400 5.019 3.742 5.628 . 0 0 "[ . 1]" 1
1965 1 170 GLU H 1 171 ALA H 5.500 . 5.500 3.010 2.370 3.222 . 0 0 "[ . 1]" 1
1966 1 170 GLU H 1 171 ALA HA 5.500 . 5.500 4.951 4.854 4.983 . 0 0 "[ . 1]" 1
1967 1 170 GLU H 1 171 ALA MB 6.520 . 6.520 3.815 3.716 3.979 . 0 0 "[ . 1]" 1
1968 1 171 ALA MB 1 172 THR H 6.520 . 6.520 3.172 2.839 3.364 . 0 0 "[ . 1]" 1
1969 1 171 ALA MB 1 172 THR MG 7.540 . 7.540 4.905 4.816 5.133 . 0 0 "[ . 1]" 1
1970 1 171 ALA MB 1 172 THR HA 6.520 . 6.520 4.213 4.068 4.335 . 0 0 "[ . 1]" 1
1971 1 171 ALA MB 1 172 THR HB 6.520 . 6.520 5.710 5.489 5.841 . 0 0 "[ . 1]" 1
1972 1 171 ALA H 1 172 THR H 5.500 . 5.500 4.432 4.331 4.663 . 0 0 "[ . 1]" 1
1973 1 171 ALA H 1 172 THR MG 6.520 . 6.520 5.063 4.696 5.767 . 0 0 "[ . 1]" 1
1974 1 171 ALA MB 1 173 VAL H 6.520 . 6.520 2.757 2.473 2.973 . 0 0 "[ . 1]" 1
1975 1 171 ALA MB 1 173 VAL HB 6.520 . 6.520 3.585 3.268 4.557 . 0 0 "[ . 1]" 1
1976 1 171 ALA H 1 173 VAL H 5.500 . 5.500 5.245 5.061 5.415 . 0 0 "[ . 1]" 1
1977 1 171 ALA MB 1 174 LEU H 6.520 . 6.520 4.274 4.177 4.488 . 0 0 "[ . 1]" 1
1978 1 171 ALA MB 1 174 LEU HB2 6.520 . 6.520 5.394 5.147 5.694 . 0 0 "[ . 1]" 1
1979 1 172 THR MG 1 173 VAL H 6.520 . 6.520 4.444 4.431 4.464 . 0 0 "[ . 1]" 1
1980 1 172 THR H 1 173 VAL H 5.500 . 5.500 2.571 2.396 2.661 . 0 0 "[ . 1]" 1
1981 1 172 THR H 1 173 VAL HB 5.500 . 5.500 4.916 4.452 5.625 0.125 8 0 "[ . 1]" 1
1982 1 172 THR H 1 173 VAL HA 5.500 . 5.500 4.542 4.371 4.632 . 0 0 "[ . 1]" 1
1983 1 172 THR HA 1 174 LEU H 5.500 . 5.500 3.795 3.673 3.848 . 0 0 "[ . 1]" 1
1984 1 172 THR H 1 174 LEU H 5.500 . 5.500 5.093 4.993 5.190 . 0 0 "[ . 1]" 1
1985 1 172 THR HA 1 175 GLU H 5.500 . 5.500 3.151 3.090 3.198 . 0 0 "[ . 1]" 1
1986 1 172 THR HA 1 175 GLU QB 6.220 . 6.220 2.959 2.809 3.096 . 0 0 "[ . 1]" 1
1987 1 172 THR HB 1 175 GLU H 5.500 . 5.500 4.336 4.093 4.682 . 0 0 "[ . 1]" 1
1988 1 172 THR HB 1 175 GLU HB3 5.500 . 5.500 3.258 2.662 4.610 . 0 0 "[ . 1]" 1
1989 1 172 THR HB 1 175 GLU HB2 5.500 . 5.500 3.587 2.704 4.149 . 0 0 "[ . 1]" 1
1990 1 172 THR MG 1 175 GLU H 6.520 . 6.520 3.816 3.528 3.947 . 0 0 "[ . 1]" 1
1991 1 172 THR MG 1 175 GLU HB2 6.520 . 6.520 2.510 1.964 2.765 . 0 0 "[ . 1]" 1
1992 1 172 THR MG 1 175 GLU HB3 6.520 . 6.520 2.862 2.511 3.316 . 0 0 "[ . 1]" 1
1993 1 172 THR MG 1 175 GLU QG 7.240 . 7.240 3.231 2.068 3.756 . 0 0 "[ . 1]" 1
1994 1 172 THR H 1 175 GLU H 5.500 . 5.500 5.564 5.517 5.615 0.115 6 0 "[ . 1]" 1
1995 1 172 THR MG 1 176 LYS H 6.520 . 6.520 4.647 4.130 4.919 . 0 0 "[ . 1]" 1
1996 1 173 VAL HA 1 174 LEU HA 5.500 . 5.500 4.851 4.812 4.889 . 0 0 "[ . 1]" 1
1997 1 173 VAL HB 1 174 LEU MD2 6.520 . 6.520 4.432 3.971 5.642 . 0 0 "[ . 1]" 1
1998 1 173 VAL HB 1 174 LEU H 5.500 . 5.500 2.773 2.335 3.942 . 0 0 "[ . 1]" 1
1999 1 173 VAL H 1 174 LEU MD2 6.520 . 6.520 5.631 5.529 5.847 . 0 0 "[ . 1]" 1
2000 1 173 VAL H 1 174 LEU H 5.500 . 5.500 2.764 2.731 2.801 . 0 0 "[ . 1]" 1
2001 1 173 VAL H 1 174 LEU HG 5.500 . 5.500 4.604 4.507 4.843 . 0 0 "[ . 1]" 1
2002 1 173 VAL H 1 174 LEU MD1 6.520 . 6.520 5.307 5.190 5.547 . 0 0 "[ . 1]" 1
2003 1 173 VAL HA 1 175 GLU H 5.500 . 5.500 4.495 4.295 4.585 . 0 0 "[ . 1]" 1
2004 1 173 VAL HB 1 175 GLU H 5.500 . 5.500 5.116 4.814 5.757 0.257 3 0 "[ . 1]" 1
2005 1 173 VAL H 1 175 GLU H 5.500 . 5.500 4.150 4.103 4.194 . 0 0 "[ . 1]" 1
2006 1 173 VAL HA 1 176 LYS H 5.500 . 5.500 3.648 3.481 3.819 . 0 0 "[ . 1]" 1
2007 1 173 VAL HA 1 177 ILE H 5.500 . 5.500 4.917 4.722 5.216 . 0 0 "[ . 1]" 1
2008 1 173 VAL HA 1 177 ILE MD 6.520 . 6.520 5.017 4.547 5.542 . 0 0 "[ . 1]" 1
2009 1 174 LEU HB3 1 175 GLU H 5.500 . 5.500 3.494 3.399 3.600 . 0 0 "[ . 1]" 1
2010 1 174 LEU HB2 1 175 GLU H 5.500 . 5.500 2.560 2.495 2.622 . 0 0 "[ . 1]" 1
2011 1 174 LEU MD1 1 175 GLU H 6.520 . 6.520 4.478 4.419 4.583 . 0 0 "[ . 1]" 1
2012 1 174 LEU MD2 1 175 GLU H 6.520 . 6.520 4.620 4.590 4.646 . 0 0 "[ . 1]" 1
2013 1 174 LEU HG 1 175 GLU H 5.500 . 5.500 4.379 4.317 4.510 . 0 0 "[ . 1]" 1
2014 1 174 LEU H 1 175 GLU HA 5.500 . 5.500 5.330 5.299 5.356 . 0 0 "[ . 1]" 1
2015 1 174 LEU H 1 175 GLU QB 6.220 . 6.220 4.395 4.327 4.562 . 0 0 "[ . 1]" 1
2016 1 174 LEU H 1 175 GLU QG 6.220 . 6.220 5.739 4.063 6.283 0.063 7 0 "[ . 1]" 1
2017 1 174 LEU HA 1 176 LYS H 5.500 . 5.500 4.329 4.120 4.499 . 0 0 "[ . 1]" 1
2018 1 174 LEU HB2 1 176 LYS H 5.500 . 5.500 5.065 4.853 5.241 . 0 0 "[ . 1]" 1
2019 1 174 LEU H 1 176 LYS H 5.500 . 5.500 4.290 4.034 4.452 . 0 0 "[ . 1]" 1
2020 1 174 LEU H 1 176 LYS QB 6.220 . 6.220 5.037 4.732 5.250 . 0 0 "[ . 1]" 1
2021 1 174 LEU HA 1 177 ILE H 5.500 . 5.500 3.437 3.245 3.554 . 0 0 "[ . 1]" 1
2022 1 174 LEU HA 1 177 ILE MD 6.520 . 6.520 2.581 1.814 3.914 . 0 0 "[ . 1]" 1
2023 1 174 LEU HB3 1 178 HIS HD2 5.500 . 5.500 4.247 3.417 5.024 . 0 0 "[ . 1]" 1
2024 1 174 LEU MD1 1 178 HIS HD2 6.520 . 6.520 5.764 5.103 6.424 . 0 0 "[ . 1]" 1
2025 1 174 LEU MD2 1 178 HIS HD2 6.520 . 6.520 5.317 4.450 6.138 . 0 0 "[ . 1]" 1
2026 1 174 LEU MD2 1 178 HIS H 6.520 . 6.520 5.489 5.129 5.915 . 0 0 "[ . 1]" 1
2027 1 174 LEU MD1 1 189 VAL HB 6.520 . 6.520 4.110 2.802 5.445 . 0 0 "[ . 1]" 1
2028 1 174 LEU MD1 1 190 PHE H 6.520 . 6.520 3.495 2.987 3.987 . 0 0 "[ . 1]" 1
2029 1 174 LEU MD1 1 191 TYR H 6.520 . 6.520 4.056 3.774 4.376 . 0 0 "[ . 1]" 1
2030 1 174 LEU MD1 1 191 TYR QB 7.240 . 7.240 2.739 2.399 2.982 . 0 0 "[ . 1]" 1
2031 1 174 LEU MD2 1 191 TYR H 6.520 . 6.520 5.841 5.419 6.272 . 0 0 "[ . 1]" 1
2032 1 175 GLU HB3 1 176 LYS H 5.500 . 5.500 2.868 2.418 3.695 . 0 0 "[ . 1]" 1
2033 1 175 GLU HB2 1 176 LYS H 5.500 . 5.500 3.489 2.645 3.878 . 0 0 "[ . 1]" 1
2034 1 175 GLU HG3 1 176 LYS H 5.500 . 5.500 4.814 4.647 5.019 . 0 0 "[ . 1]" 1
2035 1 175 GLU HG2 1 176 LYS H 5.500 . 5.500 4.053 3.683 5.316 . 0 0 "[ . 1]" 1
2036 1 175 GLU H 1 176 LYS H 5.500 . 5.500 2.820 2.676 2.919 . 0 0 "[ . 1]" 1
2037 1 175 GLU HA 1 177 ILE H 5.500 . 5.500 4.191 3.928 4.335 . 0 0 "[ . 1]" 1
2038 1 175 GLU QB 1 177 ILE H 6.220 . 6.220 4.623 4.446 4.809 . 0 0 "[ . 1]" 1
2039 1 175 GLU HA 1 178 HIS H 5.500 . 5.500 3.632 3.473 3.839 . 0 0 "[ . 1]" 1
2040 1 175 GLU HA 1 178 HIS HD2 5.500 . 5.500 2.353 1.897 3.713 . 0 0 "[ . 1]" 1
2041 1 175 GLU HA 1 178 HIS QB 6.220 . 6.220 3.747 2.838 4.495 . 0 0 "[ . 1]" 1
2042 1 175 GLU H 1 178 HIS HD2 5.500 . 5.500 4.551 4.106 5.180 . 0 0 "[ . 1]" 1
2043 1 175 GLU H 1 178 HIS H 5.500 . 5.500 5.274 5.098 5.473 . 0 0 "[ . 1]" 1
2044 1 175 GLU HA 1 179 GLN H 5.500 . 5.500 4.517 4.358 4.692 . 0 0 "[ . 1]" 1
2045 1 176 LYS QB 1 177 ILE MD 7.240 . 7.240 4.148 2.987 4.712 . 0 0 "[ . 1]" 1
2046 1 176 LYS HG3 1 177 ILE H 5.500 . 5.500 4.793 3.869 5.166 . 0 0 "[ . 1]" 1
2047 1 176 LYS HG2 1 177 ILE H 5.500 . 5.500 4.199 3.694 4.999 . 0 0 "[ . 1]" 1
2048 1 176 LYS H 1 177 ILE H 5.500 . 5.500 2.671 2.602 2.729 . 0 0 "[ . 1]" 1
2049 1 176 LYS H 1 177 ILE MD 6.520 . 6.520 4.910 4.353 5.170 . 0 0 "[ . 1]" 1
2050 1 176 LYS HA 1 179 GLN H 5.500 . 5.500 3.417 3.090 3.614 . 0 0 "[ . 1]" 1
2051 1 176 LYS HA 1 179 GLN HG3 5.500 . 5.500 2.802 1.972 3.176 . 0 0 "[ . 1]" 1
2052 1 176 LYS HA 1 179 GLN HG2 5.500 . 5.500 2.627 1.924 4.331 . 0 0 "[ . 1]" 1
2053 1 176 LYS HA 1 179 GLN HB3 5.500 . 5.500 3.841 3.406 4.149 . 0 0 "[ . 1]" 1
2054 1 176 LYS HA 1 179 GLN HA 5.500 . 5.500 5.388 4.783 5.683 0.183 10 0 "[ . 1]" 1
2055 1 176 LYS HA 1 179 GLN QE 6.200 . 6.200 2.931 2.032 3.811 . 0 0 "[ . 1]" 1
2056 1 176 LYS QG 1 179 GLN HB3 6.220 . 6.220 5.147 3.999 6.120 . 0 0 "[ . 1]" 1
2057 1 176 LYS QG 1 179 GLN HG2 6.220 . 6.220 4.207 3.460 5.787 . 0 0 "[ . 1]" 1
2058 1 176 LYS QG 1 179 GLN HG3 6.220 . 6.220 3.859 2.981 5.013 . 0 0 "[ . 1]" 1
2059 1 176 LYS H 1 179 GLN HG3 5.500 . 5.500 5.183 4.527 5.565 0.065 1 0 "[ . 1]" 1
2060 1 176 LYS QB 1 180 LEU QD 8.260 . 8.260 3.969 3.448 4.292 . 0 0 "[ . 1]" 1
2061 1 176 LYS HE3 1 180 LEU MD2 6.520 . 6.520 2.779 1.820 6.119 . 0 0 "[ . 1]" 1
2062 1 176 LYS HE3 1 180 LEU MD1 6.520 . 6.520 2.746 1.798 3.619 . 0 0 "[ . 1]" 1
2063 1 176 LYS HE2 1 180 LEU MD1 6.520 . 6.520 3.773 2.900 4.730 . 0 0 "[ . 1]" 1
2064 1 176 LYS HE2 1 180 LEU MD2 6.520 . 6.520 3.767 2.863 5.346 . 0 0 "[ . 1]" 1
2065 1 176 LYS QG 1 180 LEU QD 7.830 . 7.830 2.562 1.852 3.753 . 0 0 "[ . 1]" 1
2066 1 177 ILE HB 1 178 HIS H 5.500 . 5.500 2.502 2.419 2.623 . 0 0 "[ . 1]" 1
2067 1 177 ILE HB 1 178 HIS HD2 5.500 . 5.500 4.268 3.666 4.866 . 0 0 "[ . 1]" 1
2068 1 177 ILE MD 1 178 HIS H 6.520 . 6.520 4.458 4.267 4.647 . 0 0 "[ . 1]" 1
2069 1 177 ILE H 1 178 HIS H 5.500 . 5.500 2.804 2.751 2.880 . 0 0 "[ . 1]" 1
2070 1 177 ILE H 1 178 HIS HA 5.500 . 5.500 5.434 5.404 5.482 . 0 0 "[ . 1]" 1
2071 1 177 ILE HA 1 179 GLN H 5.500 . 5.500 4.390 4.296 4.472 . 0 0 "[ . 1]" 1
2072 1 177 ILE H 1 179 GLN H 5.500 . 5.500 4.053 3.831 4.166 . 0 0 "[ . 1]" 1
2073 1 177 ILE HA 1 180 LEU H 5.500 . 5.500 3.728 3.377 4.257 . 0 0 "[ . 1]" 1
2074 1 177 ILE HA 1 181 LEU QD 7.540 . 7.540 3.520 2.645 4.514 . 0 0 "[ . 1]" 1
2075 1 177 ILE MD 1 181 LEU QD 8.560 . 8.560 4.642 3.592 5.624 . 0 0 "[ . 1]" 1
2076 1 177 ILE H 1 181 LEU QD 7.540 . 7.540 5.757 4.964 6.708 . 0 0 "[ . 1]" 1
2077 1 177 ILE HB 1 186 PHE QE 7.630 . 7.630 4.234 3.842 4.741 . 0 0 "[ . 1]" 1
2078 1 178 HIS H 1 178 HIS HD2 5.500 . 5.500 3.031 2.692 3.224 . 0 0 "[ . 1]" 1
2079 1 178 HIS QB 1 179 GLN HA 6.220 . 6.220 4.358 3.930 4.698 . 0 0 "[ . 1]" 1
2080 1 178 HIS QB 1 179 GLN HB3 6.220 . 6.220 4.949 3.832 6.403 0.183 3 0 "[ . 1]" 1
2081 1 178 HIS QB 1 179 GLN HG3 6.220 . 6.220 5.374 4.628 6.277 0.057 8 0 "[ . 1]" 1
2082 1 178 HIS HB3 1 179 GLN H 5.500 . 5.500 3.807 3.284 4.090 . 0 0 "[ . 1]" 1
2083 1 178 HIS HB2 1 179 GLN H 5.500 . 5.500 3.539 2.610 4.167 . 0 0 "[ . 1]" 1
2084 1 178 HIS HD2 1 179 GLN H 5.500 . 5.500 4.582 4.205 5.350 . 0 0 "[ . 1]" 1
2085 1 178 HIS H 1 179 GLN HG3 5.500 . 5.500 4.860 3.835 5.447 . 0 0 "[ . 1]" 1
2086 1 178 HIS H 1 179 GLN HB3 5.500 . 5.500 5.245 4.545 5.795 0.295 9 0 "[ . 1]" 1
2087 1 178 HIS H 1 180 LEU H 5.500 . 5.500 4.180 4.028 4.467 . 0 0 "[ . 1]" 1
2088 1 178 HIS HA 1 181 LEU H 5.500 . 5.500 3.611 3.123 3.865 . 0 0 "[ . 1]" 1
2089 1 178 HIS QB 1 181 LEU H 6.220 . 6.220 4.995 4.603 5.272 . 0 0 "[ . 1]" 1
2090 1 178 HIS H 1 181 LEU QD 7.540 . 7.540 5.555 4.632 6.511 . 0 0 "[ . 1]" 1
2091 1 178 HIS H 1 186 PHE QE 7.630 . 7.630 4.486 3.777 4.914 . 0 0 "[ . 1]" 1
2092 1 179 GLN HB3 1 180 LEU H 5.500 . 5.500 3.732 3.184 4.023 . 0 0 "[ . 1]" 1
2093 1 179 GLN HB2 1 180 LEU H 5.500 . 5.500 3.453 2.280 4.045 . 0 0 "[ . 1]" 1
2094 1 179 GLN HB2 1 180 LEU QD 7.540 . 7.540 4.705 2.389 5.620 . 0 0 "[ . 1]" 1
2095 1 179 GLN QE 1 180 LEU H 6.200 . 6.200 4.612 2.749 5.381 . 0 0 "[ . 1]" 1
2096 1 179 GLN QE 1 180 LEU QB 6.270 . 6.270 5.223 2.020 6.363 0.093 3 0 "[ . 1]" 1
2097 1 179 GLN QE 1 180 LEU QD 8.230 . 8.230 4.594 2.190 5.869 . 0 0 "[ . 1]" 1
2098 1 179 GLN HG3 1 180 LEU H 5.500 . 5.500 2.885 1.933 4.475 . 0 0 "[ . 1]" 1
2099 1 179 GLN HG3 1 180 LEU MD1 6.520 . 6.520 4.646 4.011 6.509 . 0 0 "[ . 1]" 1
2100 1 179 GLN HG3 1 180 LEU MD2 6.520 . 6.520 5.121 3.350 6.718 0.198 5 0 "[ . 1]" 1
2101 1 179 GLN HG2 1 180 LEU H 5.500 . 5.500 3.352 2.348 4.944 . 0 0 "[ . 1]" 1
2102 1 179 GLN HG2 1 180 LEU QD 7.540 . 7.540 4.839 4.262 5.761 . 0 0 "[ . 1]" 1
2103 1 179 GLN H 1 180 LEU H 5.500 . 5.500 2.494 2.356 2.743 . 0 0 "[ . 1]" 1
2104 1 179 GLN H 1 180 LEU QB 6.220 . 6.220 4.260 4.072 4.676 . 0 0 "[ . 1]" 1
2105 1 179 GLN H 1 180 LEU QD 7.540 . 7.540 5.010 3.882 5.315 . 0 0 "[ . 1]" 1
2106 1 179 GLN HA 1 181 LEU H 5.500 . 5.500 4.200 4.078 4.303 . 0 0 "[ . 1]" 1
2107 1 179 GLN HG3 1 181 LEU H 5.500 . 5.500 5.018 4.492 5.788 0.288 9 0 "[ . 1]" 1
2108 1 179 GLN HG3 1 181 LEU QD 7.540 . 7.540 6.181 5.046 7.469 . 0 0 "[ . 1]" 1
2109 1 179 GLN H 1 181 LEU QD 7.540 . 7.540 5.556 4.395 6.404 . 0 0 "[ . 1]" 1
2110 1 180 LEU HA 1 181 LEU QD 7.540 . 7.540 4.068 3.412 4.609 . 0 0 "[ . 1]" 1
2111 1 180 LEU HB3 1 181 LEU H 5.500 . 5.500 3.293 2.690 4.189 . 0 0 "[ . 1]" 1
2112 1 180 LEU HB2 1 181 LEU H 5.500 . 5.500 3.569 2.853 3.965 . 0 0 "[ . 1]" 1
2113 1 180 LEU MD1 1 181 LEU H 6.520 . 6.520 4.662 4.165 5.136 . 0 0 "[ . 1]" 1
2114 1 180 LEU MD2 1 181 LEU H 6.520 . 6.520 4.715 4.530 5.214 . 0 0 "[ . 1]" 1
2115 1 180 LEU H 1 181 LEU HG 5.500 . 5.500 4.846 3.801 5.734 0.234 9 0 "[ . 1]" 1
2116 1 180 LEU H 1 181 LEU H 5.500 . 5.500 2.574 2.407 2.686 . 0 0 "[ . 1]" 1
2117 1 181 LEU H 1 182 PRO HA 5.500 . 5.500 4.254 4.119 4.365 . 0 0 "[ . 1]" 1
2118 1 181 LEU H 1 182 PRO QG 6.240 . 6.240 4.785 4.395 5.092 . 0 0 "[ . 1]" 1
2119 1 181 LEU QB 1 183 HIS H 6.220 . 6.220 3.930 3.697 4.204 . 0 0 "[ . 1]" 1
2120 1 181 LEU HB3 1 183 HIS HD2 5.500 . 5.500 3.803 2.638 4.645 . 0 0 "[ . 1]" 1
2121 1 181 LEU HB2 1 183 HIS HD2 5.500 . 5.500 5.037 4.034 5.616 0.116 5 0 "[ . 1]" 1
2122 1 181 LEU MD1 1 183 HIS H 6.520 . 6.520 5.692 4.363 6.127 . 0 0 "[ . 1]" 1
2123 1 181 LEU MD1 1 183 HIS HD2 6.520 . 6.520 5.173 2.947 6.080 . 0 0 "[ . 1]" 1
2124 1 181 LEU MD2 1 183 HIS H 6.520 . 6.520 4.832 4.150 5.762 . 0 0 "[ . 1]" 1
2125 1 181 LEU MD2 1 183 HIS HD2 6.520 . 6.520 3.821 2.551 5.367 . 0 0 "[ . 1]" 1
2126 1 181 LEU HG 1 183 HIS HD2 5.500 . 5.500 5.198 4.657 5.522 0.022 2 0 "[ . 1]" 1
2127 1 181 LEU H 1 183 HIS H 5.500 . 5.500 5.136 4.864 5.255 . 0 0 "[ . 1]" 1
2128 1 181 LEU QB 1 184 ILE H 6.220 . 6.220 3.309 3.178 3.461 . 0 0 "[ . 1]" 1
2129 1 181 LEU QB 1 184 ILE MD 7.240 . 7.240 3.133 1.898 3.889 . 0 0 "[ . 1]" 1
2130 1 181 LEU QD 1 184 ILE HB 7.540 . 7.540 4.094 3.403 4.329 . 0 0 "[ . 1]" 1
2131 1 181 LEU QD 1 184 ILE MD 8.560 . 8.560 3.012 1.885 3.660 . 0 0 "[ . 1]" 1
2132 1 181 LEU MD1 1 184 ILE H 6.520 . 6.520 5.171 4.485 5.503 . 0 0 "[ . 1]" 1
2133 1 181 LEU MD2 1 184 ILE H 6.520 . 6.520 4.937 4.432 5.707 . 0 0 "[ . 1]" 1
2134 1 181 LEU H 1 184 ILE H 5.500 . 5.500 5.418 5.282 5.529 0.029 7 0 "[ . 1]" 1
2135 1 181 LEU H 1 184 ILE HB 5.500 . 5.500 5.392 4.953 5.640 0.140 8 0 "[ . 1]" 1
2136 1 181 LEU QB 1 186 PHE QE 8.350 . 8.350 3.579 2.849 3.880 . 0 0 "[ . 1]" 1
2137 1 181 LEU QB 1 186 PHE HZ 6.220 . 6.220 2.869 2.576 3.646 . 0 0 "[ . 1]" 1
2138 1 181 LEU QD 1 186 PHE QD 9.670 . 9.670 5.793 5.486 6.183 . 0 0 "[ . 1]" 1
2139 1 181 LEU MD1 1 186 PHE QE 8.650 . 8.650 4.414 4.037 5.202 . 0 0 "[ . 1]" 1
2140 1 181 LEU MD1 1 186 PHE HZ 6.520 . 6.520 3.782 3.208 5.237 . 0 0 "[ . 1]" 1
2141 1 181 LEU MD2 1 186 PHE HZ 6.520 . 6.520 5.085 4.086 6.173 . 0 0 "[ . 1]" 1
2142 1 181 LEU MD2 1 186 PHE QE 8.650 . 8.650 5.435 4.557 6.177 . 0 0 "[ . 1]" 1
2143 1 181 LEU HG 1 186 PHE HZ 5.500 . 5.500 5.244 4.168 5.592 0.092 8 0 "[ . 1]" 1
2144 1 181 LEU H 1 186 PHE QE 7.630 . 7.630 4.442 3.975 4.941 . 0 0 "[ . 1]" 1
2145 1 182 PRO HD3 1 183 HIS H 5.500 . 5.500 3.922 3.889 3.935 . 0 0 "[ . 1]" 1
2146 1 182 PRO HD2 1 183 HIS H 5.500 . 5.500 2.777 2.728 2.806 . 0 0 "[ . 1]" 1
2147 1 182 PRO HA 1 184 ILE H 5.500 . 5.500 3.679 3.593 3.807 . 0 0 "[ . 1]" 1
2148 1 182 PRO HD3 1 184 ILE H 5.500 . 5.500 5.515 5.449 5.617 0.117 7 0 "[ . 1]" 1
2149 1 182 PRO HD2 1 184 ILE H 5.500 . 5.500 4.850 4.732 4.923 . 0 0 "[ . 1]" 1
2150 1 182 PRO HA 1 186 PHE QE 7.630 . 7.630 3.379 2.501 4.689 . 0 0 "[ . 1]" 1
2151 1 183 HIS QB 1 184 ILE MD 7.240 . 7.240 4.180 3.284 5.327 . 0 0 "[ . 1]" 1
2152 1 183 HIS HB3 1 184 ILE H 5.500 . 5.500 4.215 4.017 4.345 . 0 0 "[ . 1]" 1
2153 1 183 HIS HB2 1 184 ILE H 5.500 . 5.500 3.866 2.944 4.265 . 0 0 "[ . 1]" 1
2154 1 183 HIS HD2 1 184 ILE H 5.500 . 5.500 3.982 3.018 4.567 . 0 0 "[ . 1]" 1
2155 1 183 HIS HD2 1 184 ILE MD 6.520 . 6.520 4.915 4.341 5.573 . 0 0 "[ . 1]" 1
2156 1 183 HIS H 1 184 ILE MD 6.520 . 6.520 4.916 4.547 5.869 . 0 0 "[ . 1]" 1
2157 1 183 HIS H 1 184 ILE HA 5.500 . 5.500 5.201 5.121 5.264 . 0 0 "[ . 1]" 1
2158 1 183 HIS H 1 184 ILE HB 5.500 . 5.500 4.703 4.592 4.826 . 0 0 "[ . 1]" 1
2159 1 183 HIS H 1 184 ILE H 5.500 . 5.500 2.629 2.537 2.694 . 0 0 "[ . 1]" 1
2160 1 184 ILE HA 1 185 ALA MB 6.520 . 6.520 3.854 3.777 3.943 . 0 0 "[ . 1]" 1
2161 1 184 ILE HB 1 185 ALA H 5.500 . 5.500 4.242 4.085 4.292 . 0 0 "[ . 1]" 1
2162 1 184 ILE MD 1 185 ALA MB 7.540 . 7.540 4.771 3.709 6.003 . 0 0 "[ . 1]" 1
2163 1 184 ILE MD 1 185 ALA H 6.520 . 6.520 3.616 2.322 5.104 . 0 0 "[ . 1]" 1
2164 1 184 ILE H 1 185 ALA H 5.500 . 5.500 4.582 4.546 4.649 . 0 0 "[ . 1]" 1
2165 1 184 ILE HA 1 186 PHE H 5.500 . 5.500 5.103 5.037 5.237 . 0 0 "[ . 1]" 1
2166 1 184 ILE HB 1 186 PHE H 5.500 . 5.500 4.571 4.316 5.558 0.058 8 0 "[ . 1]" 1
2167 1 184 ILE HB 1 186 PHE HZ 5.500 . 5.500 3.034 2.408 4.487 . 0 0 "[ . 1]" 1
2168 1 184 ILE HB 1 186 PHE QD 7.630 . 7.630 4.016 3.522 5.323 . 0 0 "[ . 1]" 1
2169 1 184 ILE MD 1 186 PHE H 6.520 . 6.520 5.821 5.057 6.071 . 0 0 "[ . 1]" 1
2170 1 184 ILE MD 1 186 PHE QD 8.650 . 8.650 5.386 4.767 5.680 . 0 0 "[ . 1]" 1
2171 1 184 ILE MD 1 186 PHE HZ 6.520 . 6.520 4.622 3.138 5.351 . 0 0 "[ . 1]" 1
2172 1 184 ILE H 1 186 PHE QD 7.630 . 7.630 5.070 4.653 5.651 . 0 0 "[ . 1]" 1
2173 1 184 ILE H 1 186 PHE H 5.500 . 5.500 5.488 5.343 5.561 0.061 7 0 "[ . 1]" 1
2174 1 185 ALA MB 1 186 PHE H 6.520 . 6.520 3.693 3.649 3.723 . 0 0 "[ . 1]" 1
2175 1 185 ALA H 1 186 PHE H 5.500 . 5.500 4.024 3.832 4.142 . 0 0 "[ . 1]" 1
2176 1 185 ALA MB 1 187 LYS H 6.520 . 6.520 4.375 3.919 4.622 . 0 0 "[ . 1]" 1
2177 1 185 ALA MB 1 187 LYS HA 6.520 . 6.520 4.795 4.620 4.898 . 0 0 "[ . 1]" 1
2178 1 186 PHE QD 1 187 LYS H 7.630 . 7.630 4.370 3.900 4.514 . 0 0 "[ . 1]" 1
2179 1 186 PHE H 1 187 LYS H 5.500 . 5.500 4.367 4.108 4.483 . 0 0 "[ . 1]" 1
2180 1 186 PHE HB3 1 188 ALA H 5.500 . 5.500 3.854 3.655 4.169 . 0 0 "[ . 1]" 1
2181 1 187 LYS HA 1 188 ALA MB 6.520 . 6.520 4.379 4.265 4.737 . 0 0 "[ . 1]" 1
2182 1 187 LYS QG 1 188 ALA H 6.380 . 6.380 3.931 3.498 4.170 . 0 0 "[ . 1]" 1
2183 1 187 LYS H 1 188 ALA H 5.500 . 5.500 2.761 2.708 2.804 . 0 0 "[ . 1]" 1
2184 1 187 LYS H 1 188 ALA HA 5.500 . 5.500 5.278 5.194 5.363 . 0 0 "[ . 1]" 1
2185 1 188 ALA HA 1 189 VAL HB 5.500 . 5.500 4.971 4.047 5.645 0.145 9 0 "[ . 1]" 1
2186 1 188 ALA MB 1 189 VAL H 6.520 . 6.520 2.990 2.805 3.178 . 0 0 "[ . 1]" 1
2187 1 188 ALA H 1 189 VAL H 5.500 . 5.500 4.333 4.264 4.470 . 0 0 "[ . 1]" 1
2188 1 188 ALA HA 1 190 PHE QD 7.630 . 7.630 5.025 4.003 7.295 . 0 0 "[ . 1]" 1
2189 1 188 ALA MB 1 190 PHE QD 8.650 . 8.650 3.467 2.646 5.826 . 0 0 "[ . 1]" 1
2190 1 188 ALA MB 1 190 PHE QB 7.240 . 7.240 4.469 4.137 4.682 . 0 0 "[ . 1]" 1
2191 1 189 VAL HB 1 190 PHE H 5.500 . 5.500 3.911 3.260 4.491 . 0 0 "[ . 1]" 1
2192 1 189 VAL H 1 190 PHE QD 7.630 . 7.630 3.817 2.948 5.641 . 0 0 "[ . 1]" 1
2193 1 189 VAL H 1 190 PHE H 5.500 . 5.500 4.292 3.933 4.404 . 0 0 "[ . 1]" 1
2194 1 189 VAL H 1 190 PHE HA 5.500 . 5.500 5.168 5.001 5.262 . 0 0 "[ . 1]" 1
2195 1 189 VAL H 1 190 PHE QB 6.220 . 6.220 4.411 3.945 4.963 . 0 0 "[ . 1]" 1
2196 1 190 PHE HB3 1 191 TYR H 5.500 . 5.500 3.247 2.481 3.867 . 0 0 "[ . 1]" 1
2197 1 190 PHE HB2 1 191 TYR H 5.500 . 5.500 3.284 2.381 3.976 . 0 0 "[ . 1]" 1
2198 1 190 PHE QD 1 191 TYR H 7.630 . 7.630 3.203 2.827 3.596 . 0 0 "[ . 1]" 1
2199 1 191 TYR H 1 192 LYS H 5.500 . 5.500 4.448 4.419 4.470 . 0 0 "[ . 1]" 1
2200 1 191 TYR H 1 192 LYS HA 5.500 . 5.500 4.979 4.940 5.040 . 0 0 "[ . 1]" 1
2201 1 191 TYR H 1 192 LYS QB 6.220 . 6.220 5.300 5.057 5.519 . 0 0 "[ . 1]" 1
2202 1 194 HIS HB3 1 195 GLU H 5.500 . 5.500 2.702 2.246 3.848 . 0 0 "[ . 1]" 1
2203 1 194 HIS HB2 1 195 GLU H 5.500 . 5.500 3.756 3.134 3.995 . 0 0 "[ . 1]" 1
2204 1 194 HIS HD2 1 195 GLU QG 6.220 . 6.220 4.348 1.968 6.183 . 0 0 "[ . 1]" 1
2205 1 194 HIS H 1 195 GLU QG 6.220 . 6.220 4.186 3.649 4.630 . 0 0 "[ . 1]" 1
2206 1 194 HIS H 1 196 GLU H 5.500 . 5.500 3.735 3.240 4.233 . 0 0 "[ . 1]" 1
2207 1 195 GLU H 1 196 GLU H 5.500 . 5.500 2.326 1.873 2.770 . 0 0 "[ . 1]" 1
2208 1 195 GLU H 1 196 GLU QB 6.220 . 6.220 4.096 3.408 4.677 . 0 0 "[ . 1]" 1
2209 1 196 GLU HB3 1 197 HIS H 5.500 . 5.500 3.722 3.013 4.383 . 0 0 "[ . 1]" 1
2210 1 196 GLU HB2 1 197 HIS H 5.500 . 5.500 4.187 3.525 4.444 . 0 0 "[ . 1]" 1
2211 1 196 GLU H 1 197 HIS H 5.500 . 5.500 4.521 4.345 4.625 . 0 0 "[ . 1]" 1
2212 1 199 ALA HA 1 200 PHE HB2 5.500 . 5.500 4.632 4.219 5.155 . 0 0 "[ . 1]" 1
2213 1 199 ALA HA 1 200 PHE HB3 5.500 . 5.500 4.895 4.526 5.686 0.186 5 0 "[ . 1]" 1
2214 1 200 PHE HA 1 201 GLU HA 5.500 . 5.500 4.705 4.463 5.409 . 0 0 "[ . 1]" 1
2215 1 200 PHE QB 1 201 GLU HA 6.220 . 6.220 4.719 4.093 5.398 . 0 0 "[ . 1]" 1
2216 1 200 PHE HB3 1 201 GLU H 5.500 . 5.500 3.660 2.399 4.451 . 0 0 "[ . 1]" 1
2217 1 200 PHE HB2 1 201 GLU H 5.500 . 5.500 4.096 2.624 4.595 . 0 0 "[ . 1]" 1
2218 1 200 PHE QD 1 201 GLU H 7.630 . 7.630 3.828 3.269 4.785 . 0 0 "[ . 1]" 1
2219 1 200 PHE QD 1 201 GLU QG 8.510 . 8.510 5.212 1.914 7.090 . 0 0 "[ . 1]" 1
2220 1 200 PHE QD 1 201 GLU HA 7.630 . 7.630 4.967 3.628 6.131 . 0 0 "[ . 1]" 1
2221 1 200 PHE QD 1 202 GLY HA2 7.630 . 7.630 5.941 3.575 7.641 0.011 4 0 "[ . 1]" 1
2222 1 200 PHE QD 1 202 GLY HA3 7.630 . 7.630 6.071 3.634 7.586 . 0 0 "[ . 1]" 1
2223 1 200 PHE QE 1 202 GLY QA 8.350 . 8.350 6.042 2.498 8.083 . 0 0 "[ . 1]" 1
2224 1 206 LYS HB3 1 207 HIS H 5.500 . 5.500 3.529 2.118 4.451 . 0 0 "[ . 1]" 1
2225 1 206 LYS HB2 1 207 HIS H 5.500 . 5.500 3.609 2.003 4.679 . 0 0 "[ . 1]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 121
_Distance_constraint_stats_list.Viol_count 396
_Distance_constraint_stats_list.Viol_total 1769.550
_Distance_constraint_stats_list.Viol_max 3.194
_Distance_constraint_stats_list.Viol_rms 0.3682
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1462
_Distance_constraint_stats_list.Viol_average_violations_only 0.4469
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 35 PRO 21.029 1.857 2 10 [*+*-******]
1 36 TRP 1.454 0.587 2 1 "[ + . 1]"
1 37 THR 0.968 0.323 9 0 "[ . 1]"
1 38 PHE 0.000 0.000 . 0 "[ . 1]"
1 39 TRP 0.000 0.000 . 0 "[ . 1]"
1 40 LEU 0.637 0.234 6 0 "[ . 1]"
1 41 ASP 5.731 0.822 7 2 "[- . + 1]"
1 57 LYS 0.637 0.234 6 0 "[ . 1]"
1 60 TYR 0.000 0.000 . 0 "[ . 1]"
1 62 VAL 1.454 0.587 2 1 "[ + . 1]"
1 65 VAL 4.398 0.735 3 1 "[ + . 1]"
1 66 GLN 1.278 0.466 2 0 "[ . 1]"
1 67 ILE 0.271 0.184 2 0 "[ . 1]"
1 68 PHE 0.128 0.122 4 0 "[ . 1]"
1 69 TRP 5.137 0.735 3 1 "[ + . 1]"
1 70 SER 3.004 0.559 7 1 "[ . + 1]"
1 71 VAL 0.271 0.184 2 0 "[ . 1]"
1 72 TYR 0.128 0.122 4 0 "[ . 1]"
1 73 ASN 0.739 0.332 7 0 "[ . 1]"
1 74 ASN 1.726 0.559 7 1 "[ . + 1]"
1 75 ILE 0.000 0.000 . 0 "[ . 1]"
1 85 CYS 49.769 3.194 9 10 [*****-**+*]
1 86 SER 5.731 0.822 7 2 "[- . + 1]"
1 87 TYR 16.957 1.636 7 5 "[* *. + **]"
1 88 HIS 0.000 0.000 . 0 "[ . 1]"
1 89 LEU 0.000 0.000 . 0 "[ . 1]"
1 90 MET 0.968 0.323 9 0 "[ . 1]"
1 91 ARG 1.979 0.483 9 0 "[ . 1]"
1 92 GLY 21.029 1.857 2 10 [*+*-******]
1 107 GLY 7.993 0.744 10 4 "[ - . ** +]"
1 108 VAL 5.752 0.523 4 3 "[ +.-* 1]"
1 109 TRP 0.050 0.024 1 0 "[ . 1]"
1 110 LYS 21.104 0.926 8 9 "[ -*****+**]"
1 111 MET 2.481 0.504 7 1 "[ . + 1]"
1 113 VAL 14.503 0.760 7 7 "[**-*. + **]"
1 117 SER 0.000 0.000 . 0 "[ . 1]"
1 118 THR 0.000 0.000 . 0 "[ . 1]"
1 119 SER 0.029 0.026 4 0 "[ . 1]"
1 120 THR 0.000 0.000 . 0 "[ . 1]"
1 121 VAL 0.000 0.000 . 0 "[ . 1]"
1 122 TRP 0.000 0.000 . 0 "[ . 1]"
1 123 LYS 0.917 0.242 8 0 "[ . 1]"
1 124 GLU 0.715 0.254 6 0 "[ . 1]"
1 125 LEU 0.000 0.000 . 0 "[ . 1]"
1 126 LEU 0.169 0.092 3 0 "[ . 1]"
1 127 LEU 0.888 0.242 8 0 "[ . 1]"
1 128 ALA 0.715 0.254 6 0 "[ . 1]"
1 129 THR 0.000 0.000 . 0 "[ . 1]"
1 130 ILE 0.169 0.092 3 0 "[ . 1]"
1 145 ILE 2.215 0.483 9 0 "[ . 1]"
1 146 GLY 0.596 0.164 4 0 "[ . 1]"
1 147 VAL 0.000 0.000 . 0 "[ . 1]"
1 148 SER 0.000 0.000 . 0 "[ . 1]"
1 149 VAL 16.957 1.636 7 5 "[* *. + **]"
1 150 SER 1.611 0.383 7 0 "[ . 1]"
1 151 VAL 49.769 3.194 9 10 [*****-**+*]
1 152 ARG 0.000 0.000 . 0 "[ . 1]"
1 155 GLU 0.000 0.000 . 0 "[ . 1]"
1 156 ASP 14.503 0.760 7 7 "[**-*. + **]"
1 157 VAL 1.611 0.383 7 0 "[ . 1]"
1 158 VAL 2.481 0.504 7 1 "[ . + 1]"
1 159 GLN 0.000 0.000 . 0 "[ . 1]"
1 160 VAL 0.050 0.024 1 0 "[ . 1]"
1 161 TRP 0.832 0.164 4 0 "[ . 1]"
1 162 ASN 7.993 0.744 10 4 "[ - . ** +]"
1 172 THR 0.986 0.311 10 0 "[ . 1]"
1 173 VAL 5.764 0.554 10 2 "[ - +]"
1 174 LEU 4.982 0.670 5 1 "[ + 1]"
1 175 GLU 0.481 0.221 8 0 "[ . 1]"
1 176 LYS 0.986 0.311 10 0 "[ . 1]"
1 177 ILE 7.315 0.554 10 3 "[ * -+]"
1 178 HIS 4.982 0.670 5 1 "[ + 1]"
1 179 GLN 0.481 0.221 8 0 "[ . 1]"
1 180 LEU 0.000 0.000 . 0 "[ . 1]"
1 181 LEU 1.551 0.506 9 1 "[ . +1]"
1 190 PHE 21.104 0.926 8 9 "[ -*****+**]"
1 192 LYS 5.752 0.523 4 3 "[ +.-* 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 36 TRP H 1 62 VAL O 2.000 . 2.300 2.326 1.995 2.887 0.587 2 1 "[ + . 1]" 2
2 1 36 TRP N 1 62 VAL O 3.000 2.500 3.300 3.264 2.961 3.545 0.245 2 0 "[ . 1]" 2
3 1 36 TRP O 1 62 VAL H 2.000 . 2.300 1.983 1.696 2.229 . 0 0 "[ . 1]" 2
4 1 36 TRP O 1 62 VAL N 3.000 2.500 3.300 2.891 2.609 3.129 . 0 0 "[ . 1]" 2
5 1 38 PHE H 1 60 TYR O 2.000 . 2.300 2.000 1.838 2.170 . 0 0 "[ . 1]" 2
6 1 38 PHE N 1 60 TYR O 3.000 2.500 3.300 2.941 2.777 3.105 . 0 0 "[ . 1]" 2
7 1 40 LEU H 1 57 LYS O 2.000 . 2.300 2.199 1.763 2.534 0.234 6 0 "[ . 1]" 2
8 1 40 LEU N 1 57 LYS O 3.000 2.500 3.300 3.079 2.650 3.447 0.147 6 0 "[ . 1]" 2
9 1 35 PRO O 1 92 GLY H 2.000 . 2.300 3.590 3.067 4.157 1.857 2 10 [*+******-*] 2
10 1 35 PRO O 1 92 GLY N 3.000 2.500 3.300 4.113 3.873 4.408 1.108 2 10 [*+*-******] 2
11 1 37 THR H 1 90 MET O 2.000 . 2.300 2.150 1.849 2.623 0.323 9 0 "[ . 1]" 2
12 1 37 THR N 1 90 MET O 3.000 2.500 3.300 3.017 2.693 3.476 0.176 9 0 "[ . 1]" 2
13 1 37 THR O 1 90 MET H 2.000 . 2.300 2.081 1.754 2.298 . 0 0 "[ . 1]" 2
14 1 37 THR O 1 90 MET N 3.000 2.500 3.300 3.009 2.702 3.200 . 0 0 "[ . 1]" 2
15 1 39 TRP H 1 88 HIS O 2.000 . 2.300 1.690 1.630 1.843 . 0 0 "[ . 1]" 2
16 1 39 TRP N 1 88 HIS O 3.000 2.500 3.300 2.625 2.574 2.790 . 0 0 "[ . 1]" 2
17 1 39 TRP O 1 88 HIS H 2.000 . 2.300 1.693 1.642 1.789 . 0 0 "[ . 1]" 2
18 1 39 TRP O 1 88 HIS N 3.000 2.500 3.300 2.627 2.571 2.728 . 0 0 "[ . 1]" 2
19 1 41 ASP H 1 86 SER O 2.000 . 2.300 2.070 1.750 2.460 0.160 1 0 "[ . 1]" 2
20 1 41 ASP N 1 86 SER O 3.000 2.500 3.300 3.003 2.702 3.359 0.059 1 0 "[ . 1]" 2
21 1 41 ASP O 1 86 SER H 2.000 . 2.300 2.613 2.207 3.122 0.822 7 2 "[- . + 1]" 2
22 1 41 ASP O 1 86 SER N 3.000 2.500 3.300 3.478 2.913 4.017 0.717 7 2 "[- . + 1]" 2
23 1 91 ARG H 1 145 ILE O 2.000 . 2.300 2.384 2.117 2.783 0.483 9 0 "[ . 1]" 2
24 1 91 ARG N 1 145 ILE O 3.000 2.500 3.300 3.329 3.038 3.591 0.291 4 0 "[ . 1]" 2
25 1 89 LEU O 1 147 VAL H 2.000 . 2.300 2.012 1.724 2.260 . 0 0 "[ . 1]" 2
26 1 89 LEU O 1 147 VAL N 3.000 2.500 3.300 2.915 2.677 3.119 . 0 0 "[ . 1]" 2
27 1 89 LEU H 1 147 VAL O 2.000 . 2.300 1.815 1.720 1.895 . 0 0 "[ . 1]" 2
28 1 89 LEU N 1 147 VAL O 3.000 2.500 3.300 2.748 2.635 2.863 . 0 0 "[ . 1]" 2
29 1 87 TYR H 1 149 VAL O 2.000 . 2.300 2.965 2.027 3.936 1.636 7 5 "[* *. + -*]" 2
30 1 87 TYR N 1 149 VAL O 3.000 2.500 3.300 3.661 2.796 4.499 1.199 4 4 "[- +. * *]" 2
31 1 87 TYR O 1 149 VAL H 2.000 . 2.300 2.497 1.821 3.130 0.830 7 3 "[ -. + *]" 2
32 1 87 TYR O 1 149 VAL N 3.000 2.500 3.300 3.311 2.769 3.872 0.572 7 1 "[ . + 1]" 2
33 1 85 CYS O 1 151 VAL H 2.000 . 2.300 3.650 2.814 4.680 2.380 1 10 [+****-****] 2
34 1 85 CYS O 1 151 VAL N 3.000 2.500 3.300 4.371 3.649 5.177 1.877 1 6 "[+ *- * **]" 2
35 1 85 CYS N 1 151 VAL O 3.000 2.500 3.300 5.856 5.263 6.494 3.194 9 10 [*****-**+*] 2
36 1 145 ILE H 1 161 TRP O 2.000 . 2.300 2.260 2.129 2.419 0.119 9 0 "[ . 1]" 2
37 1 145 ILE N 1 161 TRP O 3.000 2.500 3.300 2.920 2.782 3.095 . 0 0 "[ . 1]" 2
38 1 146 GLY H 1 161 TRP O 2.000 . 2.300 2.333 2.180 2.464 0.164 4 0 "[ . 1]" 2
39 1 146 GLY N 1 161 TRP O 3.000 2.500 3.300 3.195 3.059 3.313 0.013 9 0 "[ . 1]" 2
40 1 146 GLY O 1 161 TRP H 2.000 . 2.300 1.946 1.713 2.164 . 0 0 "[ . 1]" 2
41 1 146 GLY O 1 161 TRP N 3.000 2.500 3.300 2.734 2.562 2.927 . 0 0 "[ . 1]" 2
42 1 148 SER H 1 159 GLN O 2.000 . 2.300 1.882 1.753 2.043 . 0 0 "[ . 1]" 2
43 1 148 SER N 1 159 GLN O 3.000 2.500 3.300 2.787 2.597 2.916 . 0 0 "[ . 1]" 2
44 1 148 SER O 1 159 GLN H 2.000 . 2.300 2.069 1.806 2.289 . 0 0 "[ . 1]" 2
45 1 148 SER O 1 159 GLN N 3.000 2.500 3.300 2.894 2.666 3.112 . 0 0 "[ . 1]" 2
46 1 150 SER H 1 157 VAL O 2.000 . 2.300 2.333 1.950 2.683 0.383 7 0 "[ . 1]" 2
47 1 150 SER N 1 157 VAL O 3.000 2.500 3.300 3.158 2.821 3.437 0.137 7 0 "[ . 1]" 2
48 1 150 SER O 1 157 VAL H 2.000 . 2.300 2.034 1.659 2.620 0.320 7 0 "[ . 1]" 2
49 1 150 SER O 1 157 VAL N 3.000 2.500 3.300 2.886 2.583 3.362 0.062 7 0 "[ . 1]" 2
50 1 152 ARG H 1 155 GLU O 2.000 . 2.300 2.013 1.837 2.254 . 0 0 "[ . 1]" 2
51 1 152 ARG N 1 155 GLU O 3.000 2.500 3.300 2.721 2.597 2.951 . 0 0 "[ . 1]" 2
52 1 107 GLY H 1 162 ASN O 2.000 . 2.300 2.762 2.396 3.044 0.744 10 4 "[ - . ** +]" 2
53 1 107 GLY N 1 162 ASN O 3.000 2.500 3.300 3.627 3.200 3.921 0.621 7 4 "[ - . +* *]" 2
54 1 107 GLY O 1 162 ASN H 2.000 . 2.300 1.748 1.610 1.998 . 0 0 "[ . 1]" 2
55 1 107 GLY O 1 162 ASN N 3.000 2.500 3.300 2.636 2.496 2.940 0.004 5 0 "[ . 1]" 2
56 1 109 TRP H 1 160 VAL O 2.000 . 2.300 2.198 2.090 2.324 0.024 1 0 "[ . 1]" 2
57 1 109 TRP N 1 160 VAL O 3.000 2.500 3.300 3.124 3.019 3.262 . 0 0 "[ . 1]" 2
58 1 109 TRP O 1 160 VAL H 2.000 . 2.300 2.173 2.042 2.307 0.007 7 0 "[ . 1]" 2
59 1 109 TRP O 1 160 VAL N 3.000 2.500 3.300 3.078 2.960 3.199 . 0 0 "[ . 1]" 2
60 1 111 MET H 1 158 VAL O 2.000 . 2.300 2.079 1.834 2.422 0.122 7 0 "[ . 1]" 2
61 1 111 MET N 1 158 VAL O 3.000 2.500 3.300 2.996 2.703 3.363 0.063 7 0 "[ . 1]" 2
62 1 111 MET O 1 158 VAL H 2.000 . 2.300 2.273 1.683 2.804 0.504 7 1 "[ . + 1]" 2
63 1 111 MET O 1 158 VAL N 3.000 2.500 3.300 3.231 2.637 3.746 0.446 7 0 "[ . 1]" 2
64 1 113 VAL H 1 156 ASP O 2.000 . 2.300 2.619 2.047 2.923 0.623 9 4 "[ * . * +-]" 2
65 1 113 VAL N 1 156 ASP O 3.000 2.500 3.300 3.553 3.015 3.865 0.565 9 2 "[ . - +1]" 2
66 1 113 VAL O 1 156 ASP H 2.000 . 2.300 2.762 2.292 3.060 0.760 7 7 "[**-*. + **]" 2
67 1 113 VAL O 1 156 ASP N 3.000 2.500 3.300 3.568 3.089 3.948 0.648 7 1 "[ . + 1]" 2
68 1 108 VAL H 1 192 LYS O 2.000 . 2.300 2.730 2.582 2.823 0.523 4 3 "[ +.-* 1]" 2
69 1 108 VAL N 1 192 LYS O 3.000 2.500 3.300 3.436 3.287 3.548 0.248 7 0 "[ . 1]" 2
70 1 108 VAL O 1 192 LYS H 2.000 . 2.300 2.019 1.909 2.386 0.086 7 0 "[ . 1]" 2
71 1 108 VAL O 1 192 LYS N 3.000 2.500 3.300 2.892 2.739 3.284 . 0 0 "[ . 1]" 2
72 1 110 LYS H 1 190 PHE O 2.000 . 2.300 2.930 2.772 3.116 0.816 7 9 "[ -****+***]" 2
73 1 110 LYS N 1 190 PHE O 3.000 2.500 3.300 3.592 3.485 3.759 0.459 7 0 "[ . 1]" 2
74 1 110 LYS O 1 190 PHE H 2.000 . 2.300 2.938 2.777 3.226 0.926 8 8 "[ **-.**+**]" 2
75 1 110 LYS O 1 190 PHE N 3.000 2.500 3.300 3.851 3.711 4.075 0.775 8 6 "[ - .**+**]" 2
76 1 65 VAL O 1 69 TRP H 2.000 . 2.300 2.538 2.218 3.035 0.735 3 1 "[ + . 1]" 2
77 1 65 VAL O 1 69 TRP N 3.000 2.500 3.300 3.472 3.183 3.919 0.619 3 1 "[ + . 1]" 2
78 1 66 GLN O 1 70 SER H 2.000 . 2.300 2.204 1.789 2.766 0.466 2 0 "[ . 1]" 2
79 1 66 GLN O 1 70 SER N 3.000 2.500 3.300 3.146 2.732 3.674 0.374 2 0 "[ . 1]" 2
80 1 67 ILE O 1 71 VAL H 2.000 . 2.300 1.918 1.742 2.484 0.184 2 0 "[ . 1]" 2
81 1 67 ILE O 1 71 VAL N 3.000 2.500 3.300 2.869 2.701 3.387 0.087 2 0 "[ . 1]" 2
82 1 68 PHE O 1 72 TYR H 2.000 . 2.300 2.021 1.739 2.422 0.122 4 0 "[ . 1]" 2
83 1 68 PHE O 1 72 TYR N 3.000 2.500 3.300 2.963 2.700 3.279 . 0 0 "[ . 1]" 2
84 1 69 TRP O 1 73 ASN H 2.000 . 2.300 2.242 2.047 2.632 0.332 7 0 "[ . 1]" 2
85 1 69 TRP O 1 73 ASN N 3.000 2.500 3.300 3.161 2.961 3.500 0.200 7 0 "[ . 1]" 2
86 1 70 SER O 1 74 ASN H 2.000 . 2.300 2.356 2.005 2.859 0.559 7 1 "[ . + 1]" 2
87 1 70 SER O 1 74 ASN N 3.000 2.500 3.300 3.276 2.929 3.778 0.478 7 0 "[ . 1]" 2
88 1 71 VAL O 1 75 ILE H 2.000 . 2.300 2.115 1.861 2.259 . 0 0 "[ . 1]" 2
89 1 71 VAL O 1 75 ILE N 3.000 2.500 3.300 3.048 2.802 3.199 . 0 0 "[ . 1]" 2
90 1 117 SER O 1 121 VAL H 2.000 . 2.300 2.068 1.902 2.254 . 0 0 "[ . 1]" 2
91 1 117 SER O 1 121 VAL N 3.000 2.500 3.300 3.030 2.867 3.204 . 0 0 "[ . 1]" 2
92 1 118 THR O 1 122 TRP H 2.000 . 2.300 1.992 1.904 2.057 . 0 0 "[ . 1]" 2
93 1 118 THR O 1 122 TRP N 3.000 2.500 3.300 2.954 2.871 3.015 . 0 0 "[ . 1]" 2
94 1 119 SER O 1 123 LYS H 2.000 . 2.300 2.077 1.870 2.326 0.026 4 0 "[ . 1]" 2
95 1 119 SER O 1 123 LYS N 3.000 2.500 3.300 3.019 2.811 3.295 . 0 0 "[ . 1]" 2
96 1 120 THR O 1 124 GLU H 2.000 . 2.300 1.872 1.775 2.104 . 0 0 "[ . 1]" 2
97 1 120 THR O 1 124 GLU N 3.000 2.500 3.300 2.815 2.721 3.043 . 0 0 "[ . 1]" 2
98 1 121 VAL O 1 125 LEU H 2.000 . 2.300 1.774 1.654 1.916 . 0 0 "[ . 1]" 2
99 1 121 VAL O 1 125 LEU N 3.000 2.500 3.300 2.713 2.580 2.850 . 0 0 "[ . 1]" 2
100 1 122 TRP O 1 126 LEU H 2.000 . 2.300 2.006 1.909 2.244 . 0 0 "[ . 1]" 2
101 1 122 TRP O 1 126 LEU N 3.000 2.500 3.300 2.907 2.828 3.111 . 0 0 "[ . 1]" 2
102 1 123 LYS O 1 127 LEU H 2.000 . 2.300 2.353 2.223 2.542 0.242 8 0 "[ . 1]" 2
103 1 123 LYS O 1 127 LEU N 3.000 2.500 3.300 3.274 3.177 3.435 0.135 8 0 "[ . 1]" 2
104 1 124 GLU O 1 128 ALA H 2.000 . 2.300 2.235 1.905 2.554 0.254 6 0 "[ . 1]" 2
105 1 124 GLU O 1 128 ALA N 3.000 2.500 3.300 3.189 2.853 3.503 0.203 6 0 "[ . 1]" 2
106 1 125 LEU O 1 129 THR H 2.000 . 2.300 1.854 1.647 2.008 . 0 0 "[ . 1]" 2
107 1 125 LEU O 1 129 THR N 3.000 2.500 3.300 2.777 2.598 2.960 . 0 0 "[ . 1]" 2
108 1 126 LEU O 1 130 ILE H 2.000 . 2.300 2.225 2.061 2.392 0.092 3 0 "[ . 1]" 2
109 1 126 LEU O 1 130 ILE N 3.000 2.500 3.300 3.192 3.025 3.358 0.058 3 0 "[ . 1]" 2
110 1 172 THR O 1 176 LYS H 2.000 . 2.300 2.319 2.113 2.611 0.311 10 0 "[ . 1]" 2
111 1 172 THR O 1 176 LYS N 3.000 2.500 3.300 3.214 2.951 3.453 0.153 10 0 "[ . 1]" 2
112 1 173 VAL O 1 177 ILE H 2.000 . 2.300 2.665 2.538 2.854 0.554 10 2 "[ - +]" 2
113 1 173 VAL O 1 177 ILE N 3.000 2.500 3.300 3.512 3.419 3.682 0.382 10 0 "[ . 1]" 2
114 1 174 LEU O 1 178 HIS H 2.000 . 2.300 2.597 2.327 2.970 0.670 5 1 "[ + 1]" 2
115 1 174 LEU O 1 178 HIS N 3.000 2.500 3.300 3.499 3.273 3.793 0.493 5 0 "[ . 1]" 2
116 1 175 GLU O 1 179 GLN H 2.000 . 2.300 2.296 2.141 2.521 0.221 8 0 "[ . 1]" 2
117 1 175 GLU O 1 179 GLN N 3.000 2.500 3.300 3.193 3.038 3.433 0.133 8 0 "[ . 1]" 2
118 1 176 LYS O 1 180 LEU H 2.000 . 2.300 1.855 1.674 2.145 . 0 0 "[ . 1]" 2
119 1 176 LYS O 1 180 LEU N 3.000 2.500 3.300 2.768 2.583 3.102 . 0 0 "[ . 1]" 2
120 1 177 ILE O 1 181 LEU H 2.000 . 2.300 2.331 1.946 2.806 0.506 9 1 "[ . +1]" 2
121 1 177 ILE O 1 181 LEU N 3.000 2.500 3.300 3.119 2.808 3.345 0.045 9 0 "[ . 1]" 2
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