Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
578258 | 2m9p RC | 19305 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2m9p
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 1078
_Distance_constraint_stats_list.Viol_count 559
_Distance_constraint_stats_list.Viol_total 589.872
_Distance_constraint_stats_list.Viol_max 0.447
_Distance_constraint_stats_list.Viol_rms 0.0306
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0055
_Distance_constraint_stats_list.Viol_average_violations_only 0.1055
_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 3 ALA 0.377 0.110 9 0 "[ . 1]"
1 4 ALA 1.310 0.249 1 0 "[ . 1]"
1 5 ASP 0.673 0.229 10 0 "[ . 1]"
1 6 LEU 0.110 0.066 1 0 "[ . 1]"
1 7 GLU 2.280 0.362 10 0 "[ . 1]"
1 8 LEU 0.412 0.101 9 0 "[ . 1]"
1 9 GLU 0.408 0.283 6 0 "[ . 1]"
1 10 ARG 0.000 0.000 . 0 "[ . 1]"
1 11 ALA 0.071 0.046 1 0 "[ . 1]"
1 12 ALA 0.000 0.000 . 0 "[ . 1]"
1 13 ASP 0.000 0.000 . 0 "[ . 1]"
1 14 VAL 0.000 0.000 . 0 "[ . 1]"
1 15 LYS 0.000 0.000 . 0 "[ . 1]"
1 16 TRP 3.318 0.403 6 0 "[ . 1]"
1 17 GLU 0.771 0.230 6 0 "[ . 1]"
1 18 ASP 0.648 0.138 2 0 "[ . 1]"
1 19 GLN 1.655 0.375 10 0 "[ . 1]"
1 20 ALA 0.409 0.214 7 0 "[ . 1]"
1 21 GLU 0.101 0.081 5 0 "[ . 1]"
1 22 ILE 0.092 0.040 7 0 "[ . 1]"
1 23 SER 0.540 0.193 6 0 "[ . 1]"
1 24 GLY 0.229 0.196 9 0 "[ . 1]"
1 25 SER 0.748 0.160 3 0 "[ . 1]"
1 26 SER 0.071 0.071 4 0 "[ . 1]"
1 28 ILE 0.200 0.116 8 0 "[ . 1]"
1 29 LEU 1.591 0.334 5 0 "[ . 1]"
1 30 SER 0.322 0.106 4 0 "[ . 1]"
1 31 ILE 1.870 0.236 2 0 "[ . 1]"
1 32 THR 0.029 0.029 2 0 "[ . 1]"
1 33 ILE 2.172 0.249 10 0 "[ . 1]"
1 34 SER 0.359 0.110 9 0 "[ . 1]"
1 35 GLU 0.000 0.000 . 0 "[ . 1]"
1 36 ASP 0.132 0.102 9 0 "[ . 1]"
1 37 GLY 0.029 0.017 6 0 "[ . 1]"
1 38 SER 0.276 0.240 6 0 "[ . 1]"
1 39 MET 2.118 0.249 10 0 "[ . 1]"
1 40 SER 0.542 0.119 10 0 "[ . 1]"
1 41 ILE 2.391 0.295 9 0 "[ . 1]"
1 42 LYS 0.146 0.119 10 0 "[ . 1]"
1 46 GLU 0.000 0.000 . 0 "[ . 1]"
1 47 GLU 0.000 0.000 . 0 "[ . 1]"
1 48 GLN 0.000 0.000 . 0 "[ . 1]"
1 49 THR 0.473 0.227 10 0 "[ . 1]"
1 50 LEU 0.095 0.095 2 0 "[ . 1]"
1 51 GLY 0.378 0.227 10 0 "[ . 1]"
1 55 SER 0.000 0.000 . 0 "[ . 1]"
1 56 GLY 0.000 0.000 . 0 "[ . 1]"
1 60 GLU 0.212 0.124 6 0 "[ . 1]"
1 61 PHE 0.437 0.149 8 0 "[ . 1]"
1 62 ALA 0.000 0.000 . 0 "[ . 1]"
1 63 GLY 0.149 0.149 8 0 "[ . 1]"
1 64 VAL 0.999 0.275 9 0 "[ . 1]"
1 65 LEU 1.607 0.447 5 0 "[ . 1]"
1 66 TRP 2.540 0.359 3 0 "[ . 1]"
1 67 ASP 0.000 0.000 . 0 "[ . 1]"
1 68 VAL 1.627 0.447 5 0 "[ . 1]"
1 70 SER 0.000 0.000 . 0 "[ . 1]"
1 74 VAL 0.019 0.011 3 0 "[ . 1]"
1 75 GLY 0.019 0.011 3 0 "[ . 1]"
1 76 LYS 0.130 0.130 10 0 "[ . 1]"
1 77 ALA 0.130 0.130 10 0 "[ . 1]"
1 79 LEU 0.515 0.234 3 0 "[ . 1]"
1 81 ASP 0.134 0.134 7 0 "[ . 1]"
1 82 GLY 0.000 0.000 . 0 "[ . 1]"
1 83 ALA 0.071 0.046 1 0 "[ . 1]"
1 84 TYR 0.063 0.063 4 0 "[ . 1]"
1 85 ARG 0.000 0.000 . 0 "[ . 1]"
1 86 ILE 0.739 0.283 6 0 "[ . 1]"
1 87 LYS 0.000 0.000 . 0 "[ . 1]"
1 88 GLN 0.110 0.057 2 0 "[ . 1]"
1 89 LYS 0.164 0.077 10 0 "[ . 1]"
1 90 GLY 0.185 0.185 10 0 "[ . 1]"
1 91 ILE 2.715 0.342 8 0 "[ . 1]"
1 92 LEU 0.033 0.033 4 0 "[ . 1]"
1 93 GLY 0.033 0.033 4 0 "[ . 1]"
1 94 TYR 0.000 0.000 . 0 "[ . 1]"
1 95 SER 0.517 0.164 9 0 "[ . 1]"
1 96 GLN 0.000 0.000 . 0 "[ . 1]"
1 97 ILE 0.688 0.164 9 0 "[ . 1]"
1 98 GLY 0.000 0.000 . 0 "[ . 1]"
1 99 ALA 0.071 0.037 4 0 "[ . 1]"
1 100 GLY 0.000 0.000 . 0 "[ . 1]"
1 101 VAL 0.783 0.213 6 0 "[ . 1]"
1 102 TYR 0.000 0.000 . 0 "[ . 1]"
1 103 LYS 0.000 0.000 . 0 "[ . 1]"
1 104 GLU 0.269 0.234 3 0 "[ . 1]"
1 105 GLY 0.000 0.000 . 0 "[ . 1]"
1 106 THR 0.000 0.000 . 0 "[ . 1]"
1 107 PHE 0.042 0.042 10 0 "[ . 1]"
1 108 HIS 0.145 0.097 9 0 "[ . 1]"
1 109 THR 0.667 0.213 6 0 "[ . 1]"
1 110 MET 0.936 0.266 1 0 "[ . 1]"
1 111 TRP 0.062 0.047 2 0 "[ . 1]"
1 112 HIS 0.257 0.085 3 0 "[ . 1]"
1 113 VAL 0.645 0.333 10 0 "[ . 1]"
1 114 THR 0.522 0.110 9 0 "[ . 1]"
1 115 ARG 0.000 0.000 . 0 "[ . 1]"
1 116 GLY 0.128 0.076 9 0 "[ . 1]"
1 117 ALA 0.523 0.333 10 0 "[ . 1]"
1 118 VAL 0.023 0.023 1 0 "[ . 1]"
1 119 LEU 1.005 0.140 4 0 "[ . 1]"
1 120 MET 6.842 0.362 10 0 "[ . 1]"
1 121 HIS 0.219 0.140 4 0 "[ . 1]"
1 122 LYS 0.101 0.101 9 0 "[ . 1]"
1 123 GLY 0.116 0.116 5 0 "[ . 1]"
1 124 LYS 0.250 0.127 5 0 "[ . 1]"
1 125 ARG 0.360 0.185 3 0 "[ . 1]"
1 126 ILE 1.399 0.255 9 0 "[ . 1]"
1 127 GLU 0.000 0.000 . 0 "[ . 1]"
1 129 SER 0.015 0.012 4 0 "[ . 1]"
1 130 TRP 0.328 0.132 5 0 "[ . 1]"
1 131 ALA 0.297 0.191 7 0 "[ . 1]"
1 132 ASP 0.000 0.000 . 0 "[ . 1]"
1 133 VAL 0.000 0.000 . 0 "[ . 1]"
1 134 LYS 0.000 0.000 . 0 "[ . 1]"
1 135 LYS 0.000 0.000 . 0 "[ . 1]"
1 136 ASP 0.064 0.064 8 0 "[ . 1]"
1 137 LEU 0.135 0.094 1 0 "[ . 1]"
1 138 ILE 1.025 0.191 7 0 "[ . 1]"
1 139 SER 0.000 0.000 . 0 "[ . 1]"
1 140 TYR 0.000 0.000 . 0 "[ . 1]"
1 141 GLY 0.000 0.000 . 0 "[ . 1]"
1 142 GLY 0.072 0.072 9 0 "[ . 1]"
1 143 GLY 0.015 0.012 4 0 "[ . 1]"
1 144 TRP 2.398 0.276 5 0 "[ . 1]"
1 145 LYS 0.000 0.000 . 0 "[ . 1]"
1 146 LEU 2.330 0.342 5 0 "[ . 1]"
1 147 GLU 1.800 0.276 5 0 "[ . 1]"
1 148 GLY 0.844 0.239 5 0 "[ . 1]"
1 149 GLU 0.518 0.135 8 0 "[ . 1]"
1 150 TRP 2.776 0.341 8 0 "[ . 1]"
1 151 LYS 0.000 0.000 . 0 "[ . 1]"
1 152 GLU 0.173 0.120 7 0 "[ . 1]"
1 153 GLY 0.000 0.000 . 0 "[ . 1]"
1 154 GLU 0.211 0.120 7 0 "[ . 1]"
1 156 VAL 0.248 0.116 9 0 "[ . 1]"
1 157 GLN 1.040 0.290 7 0 "[ . 1]"
1 158 VAL 2.018 0.403 6 0 "[ . 1]"
1 159 LEU 0.714 0.181 1 0 "[ . 1]"
1 160 ALA 0.000 0.000 . 0 "[ . 1]"
1 161 LEU 1.253 0.155 5 0 "[ . 1]"
1 162 GLU 0.458 0.181 1 0 "[ . 1]"
1 164 GLY 0.543 0.135 10 0 "[ . 1]"
1 165 LYS 2.373 0.375 6 0 "[ . 1]"
1 166 ASN 1.664 0.375 6 0 "[ . 1]"
1 168 ARG 0.099 0.058 5 0 "[ . 1]"
1 169 ALA 0.421 0.203 10 0 "[ . 1]"
1 170 VAL 1.220 0.375 10 0 "[ . 1]"
1 171 GLN 0.529 0.193 6 0 "[ . 1]"
1 172 THR 0.764 0.169 7 0 "[ . 1]"
1 173 LYS 0.271 0.196 9 0 "[ . 1]"
1 175 GLY 0.000 0.000 . 0 "[ . 1]"
1 176 LEU 1.878 0.239 9 0 "[ . 1]"
1 177 PHE 0.239 0.220 7 0 "[ . 1]"
1 178 LYS 0.641 0.169 8 0 "[ . 1]"
1 179 THR 0.519 0.221 4 0 "[ . 1]"
1 181 ALA 0.384 0.171 8 0 "[ . 1]"
1 182 GLY 0.155 0.155 9 0 "[ . 1]"
1 183 THR 0.208 0.208 8 0 "[ . 1]"
1 184 ILE 1.199 0.236 2 0 "[ . 1]"
1 185 GLY 0.000 0.000 . 0 "[ . 1]"
1 186 ALA 0.938 0.273 5 0 "[ . 1]"
1 187 VAL 1.304 0.225 7 0 "[ . 1]"
1 188 SER 0.598 0.150 9 0 "[ . 1]"
1 189 LEU 1.458 0.334 7 0 "[ . 1]"
1 190 ASP 0.144 0.090 4 0 "[ . 1]"
1 191 PHE 0.346 0.140 2 0 "[ . 1]"
1 192 SER 0.144 0.062 7 0 "[ . 1]"
1 195 THR 0.000 0.000 . 0 "[ . 1]"
1 196 SER 0.000 0.000 . 0 "[ . 1]"
1 197 GLY 0.046 0.046 10 0 "[ . 1]"
1 198 SER 0.006 0.006 3 0 "[ . 1]"
1 200 ILE 0.399 0.197 5 0 "[ . 1]"
1 201 ILE 0.666 0.230 6 0 "[ . 1]"
1 202 ASP 0.194 0.064 7 0 "[ . 1]"
1 203 LYS 0.000 0.000 . 0 "[ . 1]"
1 204 LYS 0.000 0.000 . 0 "[ . 1]"
1 205 GLY 0.000 0.000 . 0 "[ . 1]"
1 206 LYS 0.325 0.103 7 0 "[ . 1]"
1 207 VAL 2.526 0.341 8 0 "[ . 1]"
1 208 VAL 1.611 0.239 5 0 "[ . 1]"
1 209 GLY 0.474 0.216 10 0 "[ . 1]"
1 210 LEU 0.822 0.266 1 0 "[ . 1]"
1 211 TYR 0.052 0.046 10 0 "[ . 1]"
1 212 GLY 0.000 0.000 . 0 "[ . 1]"
1 213 ASN 1.536 0.247 7 0 "[ . 1]"
1 214 GLY 0.760 0.161 5 0 "[ . 1]"
1 215 VAL 0.656 0.295 9 0 "[ . 1]"
1 216 VAL 0.000 0.000 . 0 "[ . 1]"
1 217 THR 1.093 0.200 4 0 "[ . 1]"
1 219 SER 0.421 0.334 5 0 "[ . 1]"
1 220 GLY 0.553 0.177 6 0 "[ . 1]"
1 221 ALA 0.805 0.166 1 0 "[ . 1]"
1 222 TYR 0.244 0.154 4 0 "[ . 1]"
1 223 VAL 1.222 0.163 8 0 "[ . 1]"
1 224 SER 3.490 0.334 7 0 "[ . 1]"
1 225 ALA 0.073 0.049 10 0 "[ . 1]"
1 226 ILE 1.839 0.273 5 0 "[ . 1]"
1 227 ALA 0.087 0.087 5 0 "[ . 1]"
1 228 GLN 0.694 0.260 10 0 "[ . 1]"
1 229 THR 0.688 0.286 5 0 "[ . 1]"
1 230 GLU 0.000 0.000 . 0 "[ . 1]"
1 231 LYS 1.323 0.286 5 0 "[ . 1]"
1 232 SER 1.217 0.342 5 0 "[ . 1]"
1 233 ILE 0.268 0.214 4 0 "[ . 1]"
1 234 GLU 0.040 0.040 3 0 "[ . 1]"
1 235 ASP 0.014 0.014 6 0 "[ . 1]"
1 236 ASN 0.214 0.214 4 0 "[ . 1]"
1 238 GLU 0.000 0.000 . 0 "[ . 1]"
1 239 ILE 0.008 0.008 4 0 "[ . 1]"
1 240 GLU 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 3 ALA H 1 4 ALA H 2.900 . 4.450 3.293 2.182 4.393 . 0 0 "[ . 1]" 1
2 1 3 ALA H 1 5 ASP H 5.000 . 6.500 4.167 2.860 5.541 . 0 0 "[ . 1]" 1
3 1 3 ALA H 1 88 GLN QE 4.800 . 6.300 4.048 2.104 6.357 0.057 2 0 "[ . 1]" 1
4 1 3 ALA H 1 114 THR HG1 4.800 . 6.300 5.838 5.165 6.410 0.110 9 0 "[ . 1]" 1
5 1 4 ALA H 1 5 ASP H 2.300 . 3.750 2.158 1.590 3.286 . 0 0 "[ . 1]" 1
6 1 4 ALA H 1 6 LEU QD 4.800 . 6.300 3.382 1.898 4.778 . 0 0 "[ . 1]" 1
7 1 4 ALA H 1 88 GLN QE 4.800 . 6.300 3.882 3.486 4.275 . 0 0 "[ . 1]" 1
8 1 4 ALA H 1 118 VAL QG 4.800 . 6.300 4.535 3.958 5.036 . 0 0 "[ . 1]" 1
9 1 4 ALA H 1 120 MET QG 4.800 . 6.300 5.982 4.580 6.549 0.249 1 0 "[ . 1]" 1
10 1 4 ALA H 1 120 MET ME 4.800 . 6.250 5.512 5.025 6.349 0.099 10 0 "[ . 1]" 1
11 1 4 ALA MB 1 5 ASP H 4.800 . 6.300 3.444 2.207 3.811 . 0 0 "[ . 1]" 1
12 1 4 ALA MB 1 6 LEU QD 4.800 . 6.300 4.341 3.289 5.006 . 0 0 "[ . 1]" 1
13 1 4 ALA MB 1 91 ILE MD 4.800 . 6.300 6.083 5.242 6.489 0.189 10 0 "[ . 1]" 1
14 1 4 ALA MB 1 118 VAL QG 4.800 . 6.300 2.658 2.133 3.747 . 0 0 "[ . 1]" 1
15 1 5 ASP H 1 6 LEU H 2.300 . 3.750 2.773 1.825 3.709 . 0 0 "[ . 1]" 1
16 1 5 ASP H 1 6 LEU QD 4.800 . 6.300 2.493 1.775 3.291 0.025 1 0 "[ . 1]" 1
17 1 5 ASP H 1 7 GLU H 5.000 . 6.500 6.206 5.539 6.558 0.058 5 0 "[ . 1]" 1
18 1 5 ASP H 1 88 GLN QE 4.800 . 6.300 3.421 2.597 4.569 . 0 0 "[ . 1]" 1
19 1 5 ASP H 1 89 LYS H 5.000 . 5.200 4.936 4.679 5.170 . 0 0 "[ . 1]" 1
20 1 5 ASP H 1 118 VAL QG 4.800 . 6.300 4.263 3.436 4.907 . 0 0 "[ . 1]" 1
21 1 5 ASP H 1 119 LEU QD 4.800 . 6.300 5.389 5.023 5.718 . 0 0 "[ . 1]" 1
22 1 5 ASP H 1 120 MET QB 5.000 . 6.500 6.086 5.452 6.664 0.164 5 0 "[ . 1]" 1
23 1 5 ASP H 1 120 MET QG 4.800 . 5.450 4.492 3.856 5.100 . 0 0 "[ . 1]" 1
24 1 5 ASP H 1 120 MET ME 4.800 . 5.050 4.477 4.001 5.279 0.229 10 0 "[ . 1]" 1
25 1 6 LEU H 1 6 LEU QD 4.800 . 6.300 2.667 2.415 3.073 . 0 0 "[ . 1]" 1
26 1 6 LEU H 1 88 GLN QE 4.800 . 6.300 4.740 3.824 5.321 . 0 0 "[ . 1]" 1
27 1 6 LEU H 1 89 LYS H 5.000 . 6.500 4.428 4.000 5.115 . 0 0 "[ . 1]" 1
28 1 6 LEU H 1 97 ILE MD 4.800 . 6.300 5.723 4.718 6.366 0.066 1 0 "[ . 1]" 1
29 1 6 LEU H 1 118 VAL QG 4.800 . 6.300 4.039 3.207 4.584 . 0 0 "[ . 1]" 1
30 1 6 LEU H 1 119 LEU QD 4.800 . 6.300 3.833 3.659 4.172 . 0 0 "[ . 1]" 1
31 1 6 LEU H 1 120 MET QB 5.000 . 6.500 4.071 2.879 5.202 . 0 0 "[ . 1]" 1
32 1 6 LEU H 1 120 MET QG 4.800 . 6.300 2.889 2.123 3.703 . 0 0 "[ . 1]" 1
33 1 6 LEU H 1 120 MET ME 4.800 . 5.050 3.835 2.715 4.773 . 0 0 "[ . 1]" 1
34 1 6 LEU QD 1 7 GLU H 4.800 . 6.300 4.252 3.755 4.601 . 0 0 "[ . 1]" 1
35 1 6 LEU QD 1 87 LYS H 4.800 . 6.300 4.898 4.334 5.519 . 0 0 "[ . 1]" 1
36 1 6 LEU QD 1 88 GLN H 4.800 . 6.300 4.176 3.510 4.494 . 0 0 "[ . 1]" 1
37 1 6 LEU QD 1 88 GLN QE 4.800 . 6.300 2.959 1.869 3.845 . 0 0 "[ . 1]" 1
38 1 6 LEU QD 1 89 LYS H 4.800 . 6.300 3.828 3.472 4.283 . 0 0 "[ . 1]" 1
39 1 6 LEU QD 1 97 ILE H 4.800 . 6.300 5.289 4.743 5.927 . 0 0 "[ . 1]" 1
40 1 6 LEU QD 1 97 ILE MD 4.800 . 6.300 1.925 1.812 2.110 . 0 0 "[ . 1]" 1
41 1 6 LEU QD 1 113 VAL QG 4.800 . 6.300 3.016 2.290 3.617 . 0 0 "[ . 1]" 1
42 1 6 LEU QD 1 114 THR H 4.800 . 6.300 4.223 3.581 4.624 . 0 0 "[ . 1]" 1
43 1 6 LEU QD 1 115 ARG H 4.800 . 6.300 3.936 3.172 4.737 . 0 0 "[ . 1]" 1
44 1 6 LEU QD 1 116 GLY H 4.800 . 6.300 4.623 4.147 5.122 . 0 0 "[ . 1]" 1
45 1 6 LEU QD 1 117 ALA H 4.800 . 6.300 3.662 2.956 4.470 . 0 0 "[ . 1]" 1
46 1 6 LEU QD 1 118 VAL H 4.800 . 6.300 3.961 3.459 4.428 . 0 0 "[ . 1]" 1
47 1 6 LEU QD 1 118 VAL QG 4.800 . 6.300 4.022 3.438 4.580 . 0 0 "[ . 1]" 1
48 1 6 LEU QD 1 119 LEU H 4.800 . 6.300 4.531 4.241 4.710 . 0 0 "[ . 1]" 1
49 1 6 LEU QD 1 119 LEU QD 4.800 . 6.300 2.240 1.784 2.498 0.016 7 0 "[ . 1]" 1
50 1 6 LEU QD 1 120 MET H 4.800 . 6.300 4.814 4.251 5.236 . 0 0 "[ . 1]" 1
51 1 6 LEU QD 1 120 MET ME 4.800 . 6.300 4.991 4.335 5.612 . 0 0 "[ . 1]" 1
52 1 7 GLU H 1 8 LEU QD 4.800 . 6.300 5.079 4.539 6.169 . 0 0 "[ . 1]" 1
53 1 7 GLU H 1 87 LYS H 3.600 . 4.250 3.601 2.734 4.128 . 0 0 "[ . 1]" 1
54 1 7 GLU H 1 119 LEU QD 4.800 . 6.300 4.267 3.008 5.061 . 0 0 "[ . 1]" 1
55 1 7 GLU H 1 120 MET QB 5.000 . 6.500 3.940 3.239 5.450 . 0 0 "[ . 1]" 1
56 1 7 GLU H 1 120 MET QG 4.800 . 6.300 4.437 3.302 5.121 . 0 0 "[ . 1]" 1
57 1 7 GLU H 1 120 MET ME 4.800 . 5.850 5.790 3.463 6.212 0.362 10 0 "[ . 1]" 1
58 1 8 LEU H 1 8 LEU QD 4.800 . 6.300 3.004 1.769 3.784 0.031 9 0 "[ . 1]" 1
59 1 8 LEU H 1 87 LYS H 5.000 . 6.500 5.173 5.100 5.241 . 0 0 "[ . 1]" 1
60 1 8 LEU H 1 119 LEU QD 4.800 . 6.300 4.007 3.095 4.977 . 0 0 "[ . 1]" 1
61 1 8 LEU H 1 120 MET QB 5.000 . 6.500 4.065 3.678 5.230 . 0 0 "[ . 1]" 1
62 1 8 LEU H 1 121 HIS H 5.000 . 6.500 5.004 4.518 5.244 . 0 0 "[ . 1]" 1
63 1 8 LEU H 1 122 LYS H 5.000 . 6.500 5.069 4.223 6.601 0.101 9 0 "[ . 1]" 1
64 1 8 LEU H 1 126 ILE MD 4.800 . 6.300 4.333 3.873 5.004 . 0 0 "[ . 1]" 1
65 1 8 LEU QD 1 9 GLU H 4.800 . 6.300 3.696 2.984 4.286 . 0 0 "[ . 1]" 1
66 1 8 LEU QD 1 79 LEU QD 4.800 . 6.300 4.316 1.816 5.989 . 0 0 "[ . 1]" 1
67 1 8 LEU QD 1 84 TYR H 4.800 . 6.300 4.943 4.265 6.363 0.063 4 0 "[ . 1]" 1
68 1 8 LEU QD 1 85 ARG H 4.800 . 6.300 4.802 3.694 6.018 . 0 0 "[ . 1]" 1
69 1 8 LEU QD 1 86 ILE H 4.800 . 6.300 4.777 4.178 6.169 . 0 0 "[ . 1]" 1
70 1 8 LEU QD 1 86 ILE MD 4.800 . 6.300 2.970 2.536 4.068 . 0 0 "[ . 1]" 1
71 1 8 LEU QD 1 87 LYS H 4.800 . 6.300 4.363 3.715 5.689 . 0 0 "[ . 1]" 1
72 1 8 LEU QD 1 100 GLY H 4.800 . 6.300 4.749 4.161 6.216 . 0 0 "[ . 1]" 1
73 1 8 LEU QD 1 101 VAL H 4.800 . 6.300 5.501 4.791 6.149 . 0 0 "[ . 1]" 1
74 1 8 LEU QD 1 119 LEU H 4.800 . 6.300 5.480 4.756 6.383 0.083 10 0 "[ . 1]" 1
75 1 8 LEU QD 1 119 LEU QD 4.800 . 6.300 2.060 1.703 2.675 0.097 8 0 "[ . 1]" 1
76 1 8 LEU QD 1 120 MET QB 4.800 . 6.300 5.069 4.199 5.815 . 0 0 "[ . 1]" 1
77 1 8 LEU QD 1 121 HIS H 4.800 . 6.300 5.128 3.863 5.615 . 0 0 "[ . 1]" 1
78 1 8 LEU QD 1 126 ILE MD 4.800 . 6.300 2.206 1.910 2.892 . 0 0 "[ . 1]" 1
79 1 9 GLU H 1 10 ARG H 5.000 . 6.500 4.383 4.183 4.550 . 0 0 "[ . 1]" 1
80 1 9 GLU H 1 85 ARG H 2.900 . 4.050 3.288 2.285 3.742 . 0 0 "[ . 1]" 1
81 1 9 GLU H 1 86 ILE H 5.000 . 6.500 5.021 4.865 5.168 . 0 0 "[ . 1]" 1
82 1 9 GLU H 1 86 ILE MD 4.800 . 6.300 6.059 5.691 6.583 0.283 6 0 "[ . 1]" 1
83 1 9 GLU H 1 87 LYS H 5.000 . 6.500 4.176 3.669 4.757 . 0 0 "[ . 1]" 1
84 1 9 GLU H 1 119 LEU QD 4.800 . 6.300 5.588 4.597 6.326 0.026 6 0 "[ . 1]" 1
85 1 10 ARG H 1 11 ALA H 5.000 . 6.500 4.548 4.432 4.684 . 0 0 "[ . 1]" 1
86 1 10 ARG H 1 85 ARG H 5.000 . 6.500 4.913 4.616 5.112 . 0 0 "[ . 1]" 1
87 1 11 ALA H 1 12 ALA H 2.300 . 3.750 2.074 1.860 2.341 . 0 0 "[ . 1]" 1
88 1 11 ALA H 1 83 ALA H . . 4.950 4.869 4.720 4.996 0.046 1 0 "[ . 1]" 1
89 1 11 ALA H 1 84 TYR H 5.000 . 6.500 4.630 4.260 4.869 . 0 0 "[ . 1]" 1
90 1 11 ALA H 1 161 LEU QD 4.800 . 6.300 3.925 3.488 4.255 . 0 0 "[ . 1]" 1
91 1 12 ALA H 1 13 ASP H 5.000 . 6.500 4.338 4.294 4.357 . 0 0 "[ . 1]" 1
92 1 12 ALA H 1 83 ALA H 3.600 . 4.250 3.619 3.347 3.809 . 0 0 "[ . 1]" 1
93 1 12 ALA H 1 84 TYR H 5.000 . 6.500 5.112 4.971 5.187 . 0 0 "[ . 1]" 1
94 1 12 ALA H 1 85 ARG H 5.000 . 6.500 5.458 4.966 5.982 . 0 0 "[ . 1]" 1
95 1 12 ALA H 1 159 LEU QD 4.800 . 6.300 5.322 5.090 5.545 . 0 0 "[ . 1]" 1
96 1 12 ALA H 1 161 LEU QD 4.800 . 6.300 3.574 3.349 3.877 . 0 0 "[ . 1]" 1
97 1 13 ASP H 1 14 VAL H 5.000 . 6.500 4.543 4.436 4.610 . 0 0 "[ . 1]" 1
98 1 13 ASP H 1 14 VAL QG 4.800 . 6.300 5.283 5.097 5.486 . 0 0 "[ . 1]" 1
99 1 13 ASP H 1 15 LYS H 5.000 . 6.500 5.287 4.980 5.546 . 0 0 "[ . 1]" 1
100 1 13 ASP H 1 83 ALA H . . 4.850 4.268 3.778 4.657 . 0 0 "[ . 1]" 1
101 1 13 ASP H 1 159 LEU QD 4.800 . 6.300 4.168 3.876 4.390 . 0 0 "[ . 1]" 1
102 1 13 ASP H 1 161 LEU QD 4.800 . 6.300 5.045 4.351 5.389 . 0 0 "[ . 1]" 1
103 1 14 VAL H 1 15 LYS H 5.000 . 6.500 4.248 4.148 4.330 . 0 0 "[ . 1]" 1
104 1 14 VAL H 1 82 GLY H 5.000 . 6.500 5.125 4.562 5.586 . 0 0 "[ . 1]" 1
105 1 14 VAL H 1 83 ALA H 4.000 . 4.850 3.682 3.290 4.266 . 0 0 "[ . 1]" 1
106 1 14 VAL H 1 159 LEU QD 4.800 . 6.300 4.866 4.196 5.342 . 0 0 "[ . 1]" 1
107 1 14 VAL H 1 201 ILE MD 4.800 . 6.300 5.375 5.056 5.798 . 0 0 "[ . 1]" 1
108 1 14 VAL QG 1 15 LYS H 4.800 . 6.300 3.215 3.082 3.278 . 0 0 "[ . 1]" 1
109 1 14 VAL QG 1 16 TRP H 4.800 . 6.300 4.810 4.333 5.230 . 0 0 "[ . 1]" 1
110 1 14 VAL QG 1 82 GLY H 4.800 . 6.300 3.826 3.296 4.567 . 0 0 "[ . 1]" 1
111 1 14 VAL QG 1 83 ALA H 4.800 . 6.300 3.275 2.709 3.771 . 0 0 "[ . 1]" 1
112 1 14 VAL QG 1 102 TYR H 4.800 . 6.300 4.759 4.243 5.203 . 0 0 "[ . 1]" 1
113 1 14 VAL QG 1 146 LEU QD 4.800 . 6.300 3.134 2.075 4.958 . 0 0 "[ . 1]" 1
114 1 14 VAL QG 1 159 LEU QD 4.800 . 6.300 3.461 2.530 4.302 . 0 0 "[ . 1]" 1
115 1 14 VAL QG 1 201 ILE MD 4.800 . 6.300 2.382 1.904 2.807 . 0 0 "[ . 1]" 1
116 1 14 VAL QG 1 207 VAL H 4.800 . 6.300 4.430 3.369 6.012 . 0 0 "[ . 1]" 1
117 1 14 VAL QG 1 207 VAL QG 4.800 . 6.300 2.906 1.990 5.703 . 0 0 "[ . 1]" 1
118 1 14 VAL QG 1 208 VAL H 4.800 . 6.300 5.328 4.797 6.219 . 0 0 "[ . 1]" 1
119 1 15 LYS H 1 16 TRP H 4.000 . 5.500 3.990 3.606 4.325 . 0 0 "[ . 1]" 1
120 1 15 LYS H 1 17 GLU H 5.000 . 6.500 5.308 4.755 5.923 . 0 0 "[ . 1]" 1
121 1 15 LYS H 1 159 LEU QD 4.800 . 6.300 2.735 1.877 3.419 . 0 0 "[ . 1]" 1
122 1 15 LYS H 1 201 ILE MD . . 4.050 2.643 2.363 3.005 . 0 0 "[ . 1]" 1
123 1 16 TRP H 1 17 GLU H 5.000 . 6.500 4.213 3.914 4.464 . 0 0 "[ . 1]" 1
124 1 16 TRP H 1 159 LEU QD 4.800 . 6.300 4.495 3.879 4.952 . 0 0 "[ . 1]" 1
125 1 16 TRP H 1 201 ILE MD . . 4.050 3.037 2.091 3.769 . 0 0 "[ . 1]" 1
126 1 16 TRP HE1 1 17 GLU H 4.800 . 6.300 5.437 4.695 6.454 0.154 1 0 "[ . 1]" 1
127 1 16 TRP HE1 1 18 ASP H 4.800 . 6.300 5.849 4.469 6.438 0.138 2 0 "[ . 1]" 1
128 1 16 TRP HE1 1 19 GLN H 4.800 . 6.300 5.380 4.571 5.971 . 0 0 "[ . 1]" 1
129 1 16 TRP HE1 1 20 ALA H 4.800 . 5.250 4.857 4.020 5.464 0.214 7 0 "[ . 1]" 1
130 1 16 TRP HE1 1 21 GLU H 4.800 . 6.300 5.371 4.453 6.381 0.081 5 0 "[ . 1]" 1
131 1 16 TRP HE1 1 158 VAL QG 4.800 . 6.300 6.085 4.659 6.703 0.403 6 0 "[ . 1]" 1
132 1 17 GLU H 1 18 ASP H 4.000 . 5.500 3.847 2.659 4.676 . 0 0 "[ . 1]" 1
133 1 17 GLU H 1 19 GLN H 5.000 . 6.500 5.088 4.746 5.426 . 0 0 "[ . 1]" 1
134 1 17 GLU H 1 159 LEU QD 4.800 . 6.300 3.108 2.077 4.844 . 0 0 "[ . 1]" 1
135 1 17 GLU H 1 201 ILE MD 4.800 . 4.850 4.451 3.785 5.080 0.230 6 0 "[ . 1]" 1
136 1 18 ASP H 1 19 GLN H 2.900 . 4.450 2.669 2.528 2.844 . 0 0 "[ . 1]" 1
137 1 18 ASP H 1 20 ALA H 5.000 . 6.500 4.653 3.302 5.474 . 0 0 "[ . 1]" 1
138 1 18 ASP H 1 159 LEU QD 4.800 . 6.300 5.178 3.479 6.407 0.107 8 0 "[ . 1]" 1
139 1 19 GLN H 1 19 GLN QE 4.800 . 6.300 4.481 2.693 6.079 . 0 0 "[ . 1]" 1
140 1 19 GLN H 1 20 ALA H 2.900 . 4.450 2.824 1.786 3.478 0.014 9 0 "[ . 1]" 1
141 1 19 GLN H 1 21 GLU H 5.000 . 6.500 5.490 4.472 6.059 . 0 0 "[ . 1]" 1
142 1 19 GLN H 1 170 VAL QG 4.800 . 6.300 6.117 5.560 6.675 0.375 10 0 "[ . 1]" 1
143 1 19 GLN QE 1 169 ALA H 4.800 . 6.300 4.840 3.102 6.503 0.203 10 0 "[ . 1]" 1
144 1 20 ALA H 1 21 GLU H 4.000 . 5.500 4.100 3.705 4.315 . 0 0 "[ . 1]" 1
145 1 20 ALA H 1 169 ALA H 5.000 . 6.500 4.992 4.412 5.644 . 0 0 "[ . 1]" 1
146 1 21 GLU H 1 22 ILE H 5.000 . 6.500 4.479 4.284 4.597 . 0 0 "[ . 1]" 1
147 1 21 GLU H 1 22 ILE MD 4.800 . 6.300 5.311 4.541 6.318 0.018 9 0 "[ . 1]" 1
148 1 21 GLU H 1 169 ALA H 5.000 . 6.500 5.142 4.261 5.727 . 0 0 "[ . 1]" 1
149 1 21 GLU H 1 170 VAL H 5.000 . 6.500 4.599 4.105 4.933 . 0 0 "[ . 1]" 1
150 1 21 GLU H 1 170 VAL QG 4.800 . 6.300 3.332 2.701 3.701 . 0 0 "[ . 1]" 1
151 1 21 GLU H 1 171 GLN H 3.600 . 4.450 3.099 2.793 3.987 . 0 0 "[ . 1]" 1
152 1 22 ILE H 1 22 ILE MD 4.800 . 6.300 2.932 1.760 4.297 0.040 7 0 "[ . 1]" 1
153 1 22 ILE H 1 23 SER H 5.000 . 6.500 4.454 4.201 4.613 . 0 0 "[ . 1]" 1
154 1 22 ILE H 1 171 GLN H . . 4.850 4.676 4.343 4.822 . 0 0 "[ . 1]" 1
155 1 22 ILE MD 1 23 SER H 4.800 . 6.300 3.913 2.057 4.918 . 0 0 "[ . 1]" 1
156 1 22 ILE MD 1 23 SER HG 4.800 . 6.300 5.460 3.964 6.082 . 0 0 "[ . 1]" 1
157 1 22 ILE MD 1 170 VAL QG 4.800 . 6.300 5.063 4.359 5.784 . 0 0 "[ . 1]" 1
158 1 22 ILE MD 1 171 GLN H 4.800 . 6.300 4.460 3.487 5.607 . 0 0 "[ . 1]" 1
159 1 23 SER H 1 23 SER HG 4.800 . 6.300 3.050 2.360 3.904 . 0 0 "[ . 1]" 1
160 1 23 SER H 1 24 GLY H 2.900 . 4.450 3.733 1.915 4.461 0.011 9 0 "[ . 1]" 1
161 1 23 SER H 1 170 VAL QG 4.800 . 6.300 3.653 2.570 4.482 . 0 0 "[ . 1]" 1
162 1 23 SER H 1 171 GLN H 4.000 . 4.250 4.199 3.752 4.443 0.193 6 0 "[ . 1]" 1
163 1 23 SER H 1 172 THR H 5.000 . 6.500 5.130 4.843 5.408 . 0 0 "[ . 1]" 1
164 1 23 SER H 1 173 LYS H 5.000 . 6.500 4.760 3.742 5.539 . 0 0 "[ . 1]" 1
165 1 23 SER H 1 189 LEU QD 4.800 . 6.300 4.648 3.831 5.221 . 0 0 "[ . 1]" 1
166 1 23 SER HG 1 24 GLY H 4.800 . 6.300 4.331 3.691 4.730 . 0 0 "[ . 1]" 1
167 1 23 SER HG 1 171 GLN H 4.800 . 6.300 4.603 2.995 5.689 . 0 0 "[ . 1]" 1
168 1 24 GLY H 1 25 SER H 5.000 . 6.500 3.609 2.315 4.574 . 0 0 "[ . 1]" 1
169 1 24 GLY H 1 170 VAL QG 4.800 . 6.300 4.474 2.994 5.628 . 0 0 "[ . 1]" 1
170 1 24 GLY H 1 173 LYS H 4.000 . 5.500 4.662 3.702 5.696 0.196 9 0 "[ . 1]" 1
171 1 24 GLY H 1 187 VAL QG 4.800 . 6.300 5.398 4.438 6.318 0.018 9 0 "[ . 1]" 1
172 1 24 GLY H 1 189 LEU QD 4.800 . 6.300 2.986 1.824 4.328 . 0 0 "[ . 1]" 1
173 1 25 SER H 1 25 SER HG 4.800 . 6.300 3.741 2.464 5.111 . 0 0 "[ . 1]" 1
174 1 25 SER H 1 26 SER H 2.300 . 3.750 2.527 1.704 3.502 . 0 0 "[ . 1]" 1
175 1 25 SER H 1 173 LYS H 5.000 . 6.500 4.963 3.273 6.571 0.071 8 0 "[ . 1]" 1
176 1 25 SER H 1 187 VAL QG 4.800 . 6.300 5.249 3.781 6.460 0.160 3 0 "[ . 1]" 1
177 1 25 SER H 1 188 SER H 5.000 . 5.250 5.129 4.722 5.400 0.150 9 0 "[ . 1]" 1
178 1 25 SER H 1 189 LEU H 5.000 . 6.500 5.445 4.497 6.368 . 0 0 "[ . 1]" 1
179 1 25 SER H 1 189 LEU QD 4.800 . 6.300 4.166 2.938 5.546 . 0 0 "[ . 1]" 1
180 1 25 SER H 1 190 ASP H 5.000 . 6.500 4.696 3.351 6.554 0.054 4 0 "[ . 1]" 1
181 1 26 SER H 1 29 LEU QD 4.800 . 6.300 5.310 3.876 6.371 0.071 4 0 "[ . 1]" 1
182 1 28 ILE H 1 28 ILE MD 4.800 . 6.300 3.198 2.890 3.559 . 0 0 "[ . 1]" 1
183 1 28 ILE H 1 29 LEU H 5.000 . 6.500 4.498 4.362 4.630 . 0 0 "[ . 1]" 1
184 1 28 ILE H 1 29 LEU QD 4.800 . 6.300 5.301 4.552 6.008 . 0 0 "[ . 1]" 1
185 1 28 ILE H 1 176 LEU H 5.000 . 6.500 5.229 4.602 5.660 . 0 0 "[ . 1]" 1
186 1 28 ILE H 1 176 LEU QD 4.800 . 6.300 5.590 4.926 6.416 0.116 8 0 "[ . 1]" 1
187 1 28 ILE MD 1 29 LEU H 4.800 . 6.300 3.837 3.664 4.005 . 0 0 "[ . 1]" 1
188 1 28 ILE MD 1 176 LEU H 4.800 . 6.300 2.620 1.716 3.614 0.084 8 0 "[ . 1]" 1
189 1 28 ILE MD 1 176 LEU QD 4.800 . 6.300 2.647 2.079 4.363 . 0 0 "[ . 1]" 1
190 1 28 ILE MD 1 177 PHE H 4.800 . 6.300 4.771 4.450 5.308 . 0 0 "[ . 1]" 1
191 1 29 LEU H 1 29 LEU QD 4.800 . 6.300 3.630 1.812 4.080 . 0 0 "[ . 1]" 1
192 1 29 LEU H 1 30 SER H 5.000 . 6.500 4.460 4.254 4.587 . 0 0 "[ . 1]" 1
193 1 29 LEU H 1 176 LEU H . . 4.450 4.375 3.734 4.689 0.239 9 0 "[ . 1]" 1
194 1 29 LEU H 1 176 LEU QD 4.800 . 6.300 5.485 4.768 5.958 . 0 0 "[ . 1]" 1
195 1 29 LEU H 1 177 PHE H 5.000 . 6.500 5.040 4.758 5.564 . 0 0 "[ . 1]" 1
196 1 29 LEU H 1 178 LYS H 3.600 . 4.250 3.662 3.152 4.264 0.014 10 0 "[ . 1]" 1
197 1 29 LEU H 1 223 VAL QG 4.800 . 6.300 4.538 3.772 5.638 . 0 0 "[ . 1]" 1
198 1 29 LEU QD 1 30 SER H 4.800 . 6.300 2.585 1.726 3.123 0.074 3 0 "[ . 1]" 1
199 1 29 LEU QD 1 31 ILE H 4.800 . 6.300 5.327 4.128 6.088 . 0 0 "[ . 1]" 1
200 1 29 LEU QD 1 31 ILE MD 4.800 . 6.300 4.586 2.961 5.604 . 0 0 "[ . 1]" 1
201 1 29 LEU QD 1 41 ILE MD 4.800 . 6.300 3.861 3.110 4.092 . 0 0 "[ . 1]" 1
202 1 29 LEU QD 1 176 LEU H 4.800 . 6.300 5.735 3.696 6.372 0.072 3 0 "[ . 1]" 1
203 1 29 LEU QD 1 178 LYS H 4.800 . 6.300 5.296 3.566 5.741 . 0 0 "[ . 1]" 1
204 1 29 LEU QD 1 217 THR H 4.800 . 6.300 4.273 3.619 5.173 . 0 0 "[ . 1]" 1
205 1 29 LEU QD 1 219 SER H 4.800 . 6.300 4.962 4.122 6.634 0.334 5 0 "[ . 1]" 1
206 1 29 LEU QD 1 221 ALA H 4.800 . 6.300 5.006 4.064 6.102 . 0 0 "[ . 1]" 1
207 1 29 LEU QD 1 223 VAL H 4.800 . 6.300 5.016 3.982 6.463 0.163 8 0 "[ . 1]" 1
208 1 29 LEU QD 1 223 VAL QG 4.800 . 6.300 2.060 1.693 3.004 0.107 5 0 "[ . 1]" 1
209 1 30 SER H 1 31 ILE H 5.000 . 6.500 4.472 4.191 4.617 . 0 0 "[ . 1]" 1
210 1 30 SER H 1 41 ILE MD 4.800 . 6.300 5.471 5.006 6.406 0.106 4 0 "[ . 1]" 1
211 1 30 SER H 1 178 LYS H . . 4.850 4.705 4.244 4.925 0.075 5 0 "[ . 1]" 1
212 1 31 ILE H 1 31 ILE MD 4.800 . 6.300 4.615 3.979 4.936 . 0 0 "[ . 1]" 1
213 1 31 ILE H 1 32 THR H 5.000 . 6.500 4.444 4.307 4.599 . 0 0 "[ . 1]" 1
214 1 31 ILE H 1 41 ILE MD 4.800 . 6.300 5.110 4.525 6.022 . 0 0 "[ . 1]" 1
215 1 31 ILE H 1 178 LYS H 4.000 . 4.650 4.246 3.575 4.726 0.076 4 0 "[ . 1]" 1
216 1 31 ILE H 1 179 THR H 5.000 . 6.500 5.508 4.937 6.142 . 0 0 "[ . 1]" 1
217 1 31 ILE H 1 184 ILE MD 4.800 . 6.300 5.952 5.227 6.374 0.074 3 0 "[ . 1]" 1
218 1 31 ILE MD 1 32 THR H 4.800 . 6.300 4.171 3.823 4.953 . 0 0 "[ . 1]" 1
219 1 31 ILE MD 1 33 ILE H 4.800 . 6.300 5.804 5.189 6.452 0.152 2 0 "[ . 1]" 1
220 1 31 ILE MD 1 33 ILE MD 4.800 . 6.300 4.648 2.940 5.585 . 0 0 "[ . 1]" 1
221 1 31 ILE MD 1 39 MET H 4.800 . 6.300 5.378 4.588 6.305 0.005 10 0 "[ . 1]" 1
222 1 31 ILE MD 1 39 MET ME . . 4.050 2.082 1.849 2.683 . 0 0 "[ . 1]" 1
223 1 31 ILE MD 1 40 SER H 4.800 . 6.300 3.881 2.969 5.167 . 0 0 "[ . 1]" 1
224 1 31 ILE MD 1 41 ILE H 4.800 . 6.300 4.713 3.760 6.002 . 0 0 "[ . 1]" 1
225 1 31 ILE MD 1 41 ILE MD 4.800 . 6.300 3.727 3.129 4.326 . 0 0 "[ . 1]" 1
226 1 31 ILE MD 1 177 PHE H 4.800 . 6.300 5.981 5.457 6.520 0.220 7 0 "[ . 1]" 1
227 1 31 ILE MD 1 178 LYS H 4.800 . 6.300 6.086 5.583 6.469 0.169 8 0 "[ . 1]" 1
228 1 31 ILE MD 1 184 ILE MD . . 4.250 4.280 4.074 4.486 0.236 2 0 "[ . 1]" 1
229 1 31 ILE MD 1 215 VAL H 4.800 . 6.300 3.696 3.017 4.289 . 0 0 "[ . 1]" 1
230 1 31 ILE MD 1 215 VAL QG 4.800 . 6.300 2.083 1.897 2.436 . 0 0 "[ . 1]" 1
231 1 31 ILE MD 1 223 VAL H 4.800 . 6.300 5.298 4.773 6.402 0.102 8 0 "[ . 1]" 1
232 1 31 ILE MD 1 223 VAL QG 4.800 . 6.300 3.242 1.775 4.099 0.025 10 0 "[ . 1]" 1
233 1 31 ILE MD 1 224 SER H 4.800 . 6.300 5.957 5.053 6.395 0.095 8 0 "[ . 1]" 1
234 1 31 ILE MD 1 225 ALA H 4.800 . 6.300 5.785 5.075 6.349 0.049 10 0 "[ . 1]" 1
235 1 32 THR H 1 33 ILE H 5.000 . 6.500 4.272 4.179 4.429 . 0 0 "[ . 1]" 1
236 1 32 THR H 1 39 MET ME 4.800 . 6.300 5.888 5.528 6.329 0.029 2 0 "[ . 1]" 1
237 1 32 THR H 1 40 SER H 3.600 . 4.050 3.678 3.369 3.864 . 0 0 "[ . 1]" 1
238 1 32 THR H 1 41 ILE MD 4.800 . 6.300 3.387 2.052 4.378 . 0 0 "[ . 1]" 1
239 1 32 THR H 1 42 LYS H 5.000 . 6.500 3.956 3.150 4.899 . 0 0 "[ . 1]" 1
240 1 32 THR H 1 215 VAL QG 4.800 . 6.300 4.339 4.004 4.789 . 0 0 "[ . 1]" 1
241 1 33 ILE H 1 33 ILE MD 4.800 . 6.300 3.870 2.593 4.599 . 0 0 "[ . 1]" 1
242 1 33 ILE H 1 34 SER H 5.000 . 6.500 4.536 4.387 4.647 . 0 0 "[ . 1]" 1
243 1 33 ILE H 1 39 MET ME 4.800 . 6.300 6.206 5.632 6.479 0.179 3 0 "[ . 1]" 1
244 1 33 ILE H 1 40 SER H 5.000 . 6.500 4.934 4.692 5.111 . 0 0 "[ . 1]" 1
245 1 33 ILE H 1 184 ILE MD 4.800 . 6.300 5.907 5.211 6.463 0.163 8 0 "[ . 1]" 1
246 1 33 ILE MD 1 34 SER H 4.800 . 6.300 3.348 2.279 4.553 . 0 0 "[ . 1]" 1
247 1 33 ILE MD 1 37 GLY H 4.800 . 6.300 5.054 2.416 6.317 0.017 6 0 "[ . 1]" 1
248 1 33 ILE MD 1 38 SER H 4.800 . 6.300 4.832 3.441 6.540 0.240 6 0 "[ . 1]" 1
249 1 33 ILE MD 1 39 MET H 4.800 . 6.300 4.870 3.669 5.656 . 0 0 "[ . 1]" 1
250 1 33 ILE MD 1 39 MET ME . . 4.050 3.627 2.426 4.299 0.249 10 0 "[ . 1]" 1
251 1 33 ILE MD 1 40 SER H 4.800 . 6.300 4.923 3.502 6.118 . 0 0 "[ . 1]" 1
252 1 33 ILE MD 1 179 THR H 4.800 . 6.300 5.908 5.220 6.521 0.221 4 0 "[ . 1]" 1
253 1 33 ILE MD 1 179 THR HG1 4.800 . 6.300 4.308 3.282 5.447 . 0 0 "[ . 1]" 1
254 1 33 ILE MD 1 181 ALA H 4.800 . 6.300 5.241 3.596 6.349 0.049 6 0 "[ . 1]" 1
255 1 33 ILE MD 1 182 GLY H 4.800 . 6.300 5.471 3.862 6.455 0.155 9 0 "[ . 1]" 1
256 1 33 ILE MD 1 184 ILE MD 4.800 . 6.300 2.772 2.352 3.515 . 0 0 "[ . 1]" 1
257 1 34 SER H 1 36 ASP H 5.000 . 6.500 4.935 3.632 6.602 0.102 9 0 "[ . 1]" 1
258 1 34 SER H 1 37 GLY H 5.000 . 6.500 4.959 3.653 6.217 . 0 0 "[ . 1]" 1
259 1 34 SER H 1 38 SER H 4.000 . 4.050 3.876 3.681 4.087 0.037 4 0 "[ . 1]" 1
260 1 34 SER H 1 39 MET ME 4.800 . 6.300 5.932 5.457 6.313 0.013 3 0 "[ . 1]" 1
261 1 34 SER H 1 40 SER H 5.000 . 6.500 4.334 3.470 5.508 . 0 0 "[ . 1]" 1
262 1 34 SER H 1 40 SER HG 4.800 . 6.300 5.397 3.688 6.410 0.110 9 0 "[ . 1]" 1
263 1 34 SER HG 1 35 GLU H 4.800 . 6.300 4.302 2.422 4.951 . 0 0 "[ . 1]" 1
264 1 35 GLU H 1 36 ASP H 3.600 . 5.100 3.229 2.616 4.648 . 0 0 "[ . 1]" 1
265 1 35 GLU H 1 37 GLY H 5.000 . 6.500 5.036 4.450 6.440 . 0 0 "[ . 1]" 1
266 1 35 GLU H 1 38 SER H 5.000 . 6.500 5.070 4.805 5.380 . 0 0 "[ . 1]" 1
267 1 36 ASP H 1 37 GLY H 2.900 . 4.450 2.855 2.418 3.655 . 0 0 "[ . 1]" 1
268 1 36 ASP H 1 38 SER H 4.000 . 5.500 4.005 2.602 4.824 . 0 0 "[ . 1]" 1
269 1 37 GLY H 1 38 SER H 2.300 . 3.750 2.255 1.653 2.556 . 0 0 "[ . 1]" 1
270 1 37 GLY H 1 133 VAL QG 4.800 . 6.300 4.806 3.928 5.678 . 0 0 "[ . 1]" 1
271 1 38 SER H 1 39 MET H 5.000 . 6.500 4.486 4.322 4.573 . 0 0 "[ . 1]" 1
272 1 38 SER H 1 133 VAL QG 4.800 . 6.300 5.056 3.979 5.991 . 0 0 "[ . 1]" 1
273 1 39 MET H 1 39 MET ME 4.800 . 6.300 4.264 2.749 5.062 . 0 0 "[ . 1]" 1
274 1 39 MET H 1 40 SER H 5.000 . 6.500 4.308 4.080 4.595 . 0 0 "[ . 1]" 1
275 1 39 MET H 1 215 VAL QG 4.800 . 6.300 5.181 3.529 6.220 . 0 0 "[ . 1]" 1
276 1 39 MET ME 1 40 SER H 4.800 . 6.300 4.628 4.123 5.296 . 0 0 "[ . 1]" 1
277 1 39 MET ME 1 40 SER HG 4.800 . 6.300 6.060 5.384 6.384 0.084 8 0 "[ . 1]" 1
278 1 39 MET ME 1 184 ILE MD . . 4.050 3.089 2.065 3.991 . 0 0 "[ . 1]" 1
279 1 39 MET ME 1 213 ASN H 4.800 . 6.300 4.774 3.571 6.185 . 0 0 "[ . 1]" 1
280 1 39 MET ME 1 214 GLY H 4.800 . 6.300 4.372 3.380 5.784 . 0 0 "[ . 1]" 1
281 1 39 MET ME 1 215 VAL H 4.800 . 6.300 4.550 3.877 5.142 . 0 0 "[ . 1]" 1
282 1 39 MET ME 1 215 VAL QG 4.800 . 6.300 3.528 2.430 4.376 . 0 0 "[ . 1]" 1
283 1 39 MET ME 1 217 THR HG1 4.800 . 6.300 6.339 6.026 6.500 0.200 4 0 "[ . 1]" 1
284 1 39 MET ME 1 223 VAL QG 4.800 . 6.300 4.492 3.757 5.004 . 0 0 "[ . 1]" 1
285 1 39 MET ME 1 225 ALA H 4.800 . 5.050 4.176 3.385 5.074 0.024 10 0 "[ . 1]" 1
286 1 40 SER H 1 41 ILE H 5.000 . 6.500 4.388 4.280 4.502 . 0 0 "[ . 1]" 1
287 1 40 SER H 1 41 ILE MD 4.800 . 6.300 5.270 4.453 6.073 . 0 0 "[ . 1]" 1
288 1 40 SER H 1 42 LYS H 5.000 . 6.500 5.619 4.751 6.619 0.119 10 0 "[ . 1]" 1
289 1 40 SER H 1 215 VAL QG 4.800 . 6.300 3.851 3.517 4.287 . 0 0 "[ . 1]" 1
290 1 41 ILE H 1 41 ILE MD 4.800 . 6.300 3.389 2.068 4.324 . 0 0 "[ . 1]" 1
291 1 41 ILE H 1 42 LYS H 5.000 . 6.500 4.376 3.984 4.623 . 0 0 "[ . 1]" 1
292 1 41 ILE H 1 215 VAL QG 4.800 . 6.300 1.977 1.667 2.832 0.133 2 0 "[ . 1]" 1
293 1 41 ILE H 1 216 VAL H 5.000 . 6.500 5.386 4.862 5.725 . 0 0 "[ . 1]" 1
294 1 41 ILE MD 1 42 LYS H 4.800 . 6.300 3.811 2.263 4.774 . 0 0 "[ . 1]" 1
295 1 41 ILE MD 1 215 VAL H 4.800 . 6.300 5.837 5.091 6.595 0.295 9 0 "[ . 1]" 1
296 1 41 ILE MD 1 215 VAL QG 4.800 . 6.300 2.613 1.883 3.385 . 0 0 "[ . 1]" 1
297 1 41 ILE MD 1 216 VAL H 4.800 . 6.300 5.358 4.333 6.127 . 0 0 "[ . 1]" 1
298 1 41 ILE MD 1 216 VAL QG 4.800 . 6.300 4.611 4.244 5.030 . 0 0 "[ . 1]" 1
299 1 41 ILE MD 1 217 THR H 4.800 . 5.050 4.388 4.151 4.818 . 0 0 "[ . 1]" 1
300 1 41 ILE MD 1 219 SER H 4.800 . 6.300 5.379 4.219 6.326 0.026 4 0 "[ . 1]" 1
301 1 41 ILE MD 1 220 GLY H 4.800 . 6.300 6.128 5.592 6.477 0.177 6 0 "[ . 1]" 1
302 1 41 ILE MD 1 221 ALA H 4.800 . 6.300 6.291 5.863 6.466 0.166 1 0 "[ . 1]" 1
303 1 41 ILE MD 1 223 VAL H 4.800 . 6.300 6.135 5.589 6.451 0.151 9 0 "[ . 1]" 1
304 1 41 ILE MD 1 223 VAL QG 4.800 . 6.300 4.510 3.824 5.313 . 0 0 "[ . 1]" 1
305 1 46 GLU H 1 47 GLU H 3.600 . 5.100 4.109 1.996 4.583 . 0 0 "[ . 1]" 1
306 1 47 GLU H 1 48 GLN H 3.600 . 5.100 4.203 3.447 4.605 . 0 0 "[ . 1]" 1
307 1 48 GLN H 1 49 THR H 5.000 . 6.500 4.265 3.068 4.664 . 0 0 "[ . 1]" 1
308 1 49 THR H 1 50 LEU H 2.900 . 4.450 3.838 2.334 4.545 0.095 2 0 "[ . 1]" 1
309 1 49 THR H 1 50 LEU QD 4.800 . 6.300 5.186 3.854 6.208 . 0 0 "[ . 1]" 1
310 1 49 THR H 1 51 GLY H 5.000 . 6.500 6.210 5.384 6.727 0.227 10 0 "[ . 1]" 1
311 1 50 LEU H 1 50 LEU QD 4.800 . 6.300 3.530 2.188 4.175 . 0 0 "[ . 1]" 1
312 1 50 LEU H 1 51 GLY H 3.600 . 5.100 3.955 2.551 4.592 . 0 0 "[ . 1]" 1
313 1 50 LEU QD 1 51 GLY H 4.800 . 6.300 3.208 2.217 4.305 . 0 0 "[ . 1]" 1
314 1 55 SER H 1 56 GLY H 3.600 . 5.100 3.609 1.809 4.644 . 0 0 "[ . 1]" 1
315 1 60 GLU H 1 61 PHE H 2.300 . 3.750 2.767 2.303 3.874 0.124 6 0 "[ . 1]" 1
316 1 61 PHE H 1 62 ALA H 3.600 . 5.100 3.648 2.303 4.592 . 0 0 "[ . 1]" 1
317 1 61 PHE H 1 63 GLY H 5.000 . 6.500 4.431 2.760 6.649 0.149 8 0 "[ . 1]" 1
318 1 61 PHE H 1 64 VAL QG 4.800 . 6.300 5.089 3.220 6.351 0.051 4 0 "[ . 1]" 1
319 1 62 ALA H 1 63 GLY H 2.900 . 4.450 2.944 1.910 3.972 . 0 0 "[ . 1]" 1
320 1 63 GLY H 1 64 VAL H 3.600 . 5.100 3.792 3.137 4.656 . 0 0 "[ . 1]" 1
321 1 63 GLY H 1 64 VAL QG 4.800 . 6.300 4.047 3.240 5.185 . 0 0 "[ . 1]" 1
322 1 64 VAL H 1 65 LEU H 2.900 . 4.450 3.140 2.252 4.313 . 0 0 "[ . 1]" 1
323 1 64 VAL H 1 65 LEU QD 4.800 . 6.300 5.064 3.644 5.883 . 0 0 "[ . 1]" 1
324 1 64 VAL H 1 66 TRP H 5.000 . 6.500 6.226 5.110 6.775 0.275 9 0 "[ . 1]" 1
325 1 64 VAL H 1 66 TRP HE1 4.800 . 6.300 5.963 5.314 6.570 0.270 5 0 "[ . 1]" 1
326 1 64 VAL QG 1 65 LEU H 4.800 . 6.300 3.323 2.480 3.807 . 0 0 "[ . 1]" 1
327 1 64 VAL QG 1 65 LEU QD 4.800 . 6.300 4.176 3.555 4.752 . 0 0 "[ . 1]" 1
328 1 64 VAL QG 1 66 TRP H 4.800 . 6.300 5.241 4.634 5.802 . 0 0 "[ . 1]" 1
329 1 64 VAL QG 1 66 TRP HE1 4.800 . 6.300 4.986 3.847 5.966 . 0 0 "[ . 1]" 1
330 1 65 LEU H 1 65 LEU QD 4.800 . 6.300 3.365 2.028 4.149 . 0 0 "[ . 1]" 1
331 1 65 LEU H 1 66 TRP H 3.600 . 5.100 3.986 3.036 4.590 . 0 0 "[ . 1]" 1
332 1 65 LEU H 1 66 TRP HE1 4.800 . 6.300 5.954 4.542 6.659 0.359 3 0 "[ . 1]" 1
333 1 65 LEU QD 1 66 TRP H 4.800 . 6.300 2.978 2.093 4.268 . 0 0 "[ . 1]" 1
334 1 65 LEU QD 1 67 ASP H 4.800 . 6.300 4.384 3.147 6.282 . 0 0 "[ . 1]" 1
335 1 65 LEU QD 1 68 VAL H 4.800 . 6.300 5.182 3.877 6.747 0.447 5 0 "[ . 1]" 1
336 1 65 LEU QD 1 68 VAL QG 4.800 . 6.300 3.938 1.900 6.503 0.203 5 0 "[ . 1]" 1
337 1 66 TRP H 1 66 TRP HE1 4.800 . 6.300 5.194 4.536 5.812 . 0 0 "[ . 1]" 1
338 1 66 TRP H 1 67 ASP H 5.000 . 6.500 4.014 2.738 4.608 . 0 0 "[ . 1]" 1
339 1 66 TRP H 1 68 VAL QG 4.800 . 6.300 4.316 3.345 6.307 0.007 5 0 "[ . 1]" 1
340 1 66 TRP HE1 1 68 VAL QG 4.800 . 6.300 6.256 5.718 6.581 0.281 7 0 "[ . 1]" 1
341 1 67 ASP H 1 68 VAL H 4.000 . 5.500 3.701 2.720 4.405 . 0 0 "[ . 1]" 1
342 1 67 ASP H 1 68 VAL QG 4.800 . 6.300 3.520 2.117 5.275 . 0 0 "[ . 1]" 1
343 1 68 VAL QG 1 70 SER H 4.800 . 6.300 3.738 2.445 5.179 . 0 0 "[ . 1]" 1
344 1 74 VAL H 1 75 GLY H 2.900 . 4.450 2.777 1.789 4.368 0.011 3 0 "[ . 1]" 1
345 1 74 VAL QG 1 75 GLY H 4.800 . 6.300 2.986 2.158 3.831 . 0 0 "[ . 1]" 1
346 1 75 GLY H 1 76 LYS H 4.000 . 5.500 3.235 2.159 4.641 . 0 0 "[ . 1]" 1
347 1 76 LYS H 1 77 ALA H 2.900 . 4.450 2.477 1.670 3.246 0.130 10 0 "[ . 1]" 1
348 1 79 LEU QD 1 81 ASP H 4.800 . 6.300 4.619 2.904 6.434 0.134 7 0 "[ . 1]" 1
349 1 79 LEU QD 1 104 GLU H 4.800 . 6.300 5.231 4.079 6.534 0.234 3 0 "[ . 1]" 1
350 1 79 LEU QD 1 106 THR H 4.800 . 6.300 4.653 3.243 5.936 . 0 0 "[ . 1]" 1
351 1 79 LEU QD 1 107 PHE H 4.800 . 6.300 5.629 3.760 6.342 0.042 10 0 "[ . 1]" 1
352 1 79 LEU QD 1 126 ILE MD 4.800 . 6.300 4.468 2.139 6.378 0.078 4 0 "[ . 1]" 1
353 1 81 ASP H 1 82 GLY H 4.000 . 5.500 4.256 2.985 4.621 . 0 0 "[ . 1]" 1
354 1 82 GLY H 1 83 ALA H 5.000 . 6.500 4.401 4.303 4.594 . 0 0 "[ . 1]" 1
355 1 82 GLY H 1 101 VAL QG 4.800 . 6.300 3.745 3.168 4.843 . 0 0 "[ . 1]" 1
356 1 82 GLY H 1 102 TYR H 3.600 . 4.250 3.282 2.917 4.112 . 0 0 "[ . 1]" 1
357 1 82 GLY H 1 103 LYS H 5.000 . 6.500 4.948 4.636 5.149 . 0 0 "[ . 1]" 1
358 1 82 GLY H 1 104 GLU H 5.000 . 6.500 5.558 4.460 6.186 . 0 0 "[ . 1]" 1
359 1 83 ALA H 1 84 TYR H 5.000 . 6.500 4.432 4.258 4.617 . 0 0 "[ . 1]" 1
360 1 83 ALA H 1 101 VAL QG 4.800 . 6.300 4.059 3.639 4.542 . 0 0 "[ . 1]" 1
361 1 83 ALA H 1 102 TYR H 5.000 . 6.500 5.172 5.091 5.311 . 0 0 "[ . 1]" 1
362 1 83 ALA H 1 159 LEU QD 4.800 . 6.300 4.728 4.139 5.324 . 0 0 "[ . 1]" 1
363 1 83 ALA H 1 161 LEU QD 4.800 . 6.300 4.516 4.175 5.665 . 0 0 "[ . 1]" 1
364 1 84 TYR H 1 85 ARG H 5.000 . 6.500 4.449 4.412 4.489 . 0 0 "[ . 1]" 1
365 1 84 TYR H 1 100 GLY H 3.600 . 4.050 3.437 3.100 3.573 . 0 0 "[ . 1]" 1
366 1 84 TYR H 1 101 VAL H 5.000 . 6.500 4.736 4.526 4.878 . 0 0 "[ . 1]" 1
367 1 84 TYR H 1 101 VAL QG 4.800 . 6.300 3.672 2.976 4.232 . 0 0 "[ . 1]" 1
368 1 84 TYR H 1 102 TYR H 5.000 . 6.500 3.768 3.241 4.226 . 0 0 "[ . 1]" 1
369 1 84 TYR H 1 161 LEU QD 4.800 . 6.300 3.736 2.631 4.932 . 0 0 "[ . 1]" 1
370 1 85 ARG H 1 100 GLY H 5.000 . 6.500 4.781 4.336 5.079 . 0 0 "[ . 1]" 1
371 1 85 ARG H 1 161 LEU QD 4.800 . 6.300 4.134 3.540 5.172 . 0 0 "[ . 1]" 1
372 1 86 ILE H 1 86 ILE MD 4.800 . 6.300 3.925 3.823 4.106 . 0 0 "[ . 1]" 1
373 1 86 ILE H 1 97 ILE H 5.000 . 6.500 4.887 4.772 5.013 . 0 0 "[ . 1]" 1
374 1 86 ILE H 1 97 ILE MD 4.800 . 6.300 5.080 4.107 5.753 . 0 0 "[ . 1]" 1
375 1 86 ILE H 1 98 GLY H 3.600 . 4.650 3.700 3.497 3.790 . 0 0 "[ . 1]" 1
376 1 86 ILE H 1 99 ALA H 4.000 . 5.500 3.816 3.576 4.169 . 0 0 "[ . 1]" 1
377 1 86 ILE H 1 113 VAL QG 4.800 . 6.300 4.312 3.844 4.891 . 0 0 "[ . 1]" 1
378 1 86 ILE H 1 119 LEU QD 4.800 . 6.300 5.458 5.048 5.881 . 0 0 "[ . 1]" 1
379 1 86 ILE MD 1 87 LYS H 4.800 . 6.300 5.127 4.849 5.347 . 0 0 "[ . 1]" 1
380 1 86 ILE MD 1 99 ALA H . . 4.050 3.802 3.476 4.073 0.023 1 0 "[ . 1]" 1
381 1 86 ILE MD 1 100 GLY H 4.800 . 6.300 3.983 3.284 4.400 . 0 0 "[ . 1]" 1
382 1 86 ILE MD 1 101 VAL H 4.800 . 6.300 5.067 4.544 5.491 . 0 0 "[ . 1]" 1
383 1 86 ILE MD 1 109 THR HG1 4.800 . 5.995 2.575 2.111 2.990 . 0 0 "[ . 1]" 1
384 1 86 ILE MD 1 110 MET H 4.800 . 6.300 3.962 3.336 4.239 . 0 0 "[ . 1]" 1
385 1 86 ILE MD 1 113 VAL H 4.800 . 6.300 5.230 4.841 5.958 . 0 0 "[ . 1]" 1
386 1 86 ILE MD 1 113 VAL QG 4.800 . 6.300 1.962 1.767 2.521 0.033 8 0 "[ . 1]" 1
387 1 86 ILE MD 1 114 THR HG1 4.800 . 6.300 5.641 3.499 6.348 0.048 1 0 "[ . 1]" 1
388 1 86 ILE MD 1 119 LEU QD 4.800 . 6.300 2.114 1.795 2.684 0.005 9 0 "[ . 1]" 1
389 1 86 ILE MD 1 126 ILE MD 4.800 . 6.300 5.803 5.139 6.509 0.209 4 0 "[ . 1]" 1
390 1 87 LYS H 1 97 ILE H 5.000 . 6.500 4.726 4.624 4.967 . 0 0 "[ . 1]" 1
391 1 87 LYS H 1 97 ILE MD 4.800 . 6.300 4.151 3.315 4.621 . 0 0 "[ . 1]" 1
392 1 87 LYS H 1 98 GLY H 5.000 . 6.500 5.197 4.970 5.276 . 0 0 "[ . 1]" 1
393 1 87 LYS H 1 119 LEU QD 4.800 . 6.300 4.501 4.103 5.075 . 0 0 "[ . 1]" 1
394 1 88 GLN H 1 95 SER H 3.600 . 4.050 3.656 3.312 4.062 0.012 6 0 "[ . 1]" 1
395 1 88 GLN H 1 96 GLN H 5.000 . 6.500 4.689 4.455 4.842 . 0 0 "[ . 1]" 1
396 1 88 GLN H 1 97 ILE H 3.600 . 5.050 3.580 3.216 3.814 . 0 0 "[ . 1]" 1
397 1 88 GLN H 1 97 ILE MD . . 4.650 3.090 2.220 3.688 . 0 0 "[ . 1]" 1
398 1 88 GLN H 1 98 GLY H 5.000 . 6.500 5.261 4.931 5.467 . 0 0 "[ . 1]" 1
399 1 88 GLN QE 1 89 LYS H 4.800 . 6.300 3.393 2.130 5.060 . 0 0 "[ . 1]" 1
400 1 88 GLN QE 1 97 ILE MD 4.800 . 6.300 4.978 3.416 5.888 . 0 0 "[ . 1]" 1
401 1 89 LYS H 1 90 GLY H 4.000 . 5.500 4.000 3.797 4.495 . 0 0 "[ . 1]" 1
402 1 89 LYS H 1 95 SER H 5.000 . 6.500 4.953 4.758 5.208 . 0 0 "[ . 1]" 1
403 1 89 LYS H 1 97 ILE MD 4.800 . 6.300 5.146 4.569 5.830 . 0 0 "[ . 1]" 1
404 1 89 LYS H 1 120 MET ME 4.800 . 6.300 5.796 3.548 6.377 0.077 10 0 "[ . 1]" 1
405 1 90 GLY H 1 91 ILE H 5.000 . 6.500 4.540 4.113 4.650 . 0 0 "[ . 1]" 1
406 1 90 GLY H 1 91 ILE MD 4.800 . 6.300 5.333 4.753 6.485 0.185 10 0 "[ . 1]" 1
407 1 90 GLY H 1 92 LEU H 5.000 . 6.500 4.669 3.449 5.095 . 0 0 "[ . 1]" 1
408 1 90 GLY H 1 93 GLY H 3.600 . 5.100 3.481 2.524 3.817 . 0 0 "[ . 1]" 1
409 1 90 GLY H 1 94 TYR H 5.000 . 6.500 4.676 3.626 5.076 . 0 0 "[ . 1]" 1
410 1 90 GLY H 1 95 SER H 5.000 . 5.050 4.536 3.863 4.969 . 0 0 "[ . 1]" 1
411 1 91 ILE H 1 91 ILE MD 4.800 . 6.300 2.805 1.835 3.408 . 0 0 "[ . 1]" 1
412 1 91 ILE H 1 92 LEU H 4.000 . 5.500 3.296 2.581 3.831 . 0 0 "[ . 1]" 1
413 1 91 ILE H 1 93 GLY H 5.000 . 6.500 4.235 3.874 4.675 . 0 0 "[ . 1]" 1
414 1 91 ILE MD 1 92 LEU H 4.800 . 6.300 4.476 4.043 4.856 . 0 0 "[ . 1]" 1
415 1 91 ILE MD 1 92 LEU QD 4.800 . 6.300 5.480 4.501 6.116 . 0 0 "[ . 1]" 1
416 1 91 ILE MD 1 93 GLY H 4.800 . 6.300 5.449 5.176 6.239 . 0 0 "[ . 1]" 1
417 1 91 ILE MD 1 120 MET HA 4.800 . 6.300 6.494 6.381 6.642 0.342 8 0 "[ . 1]" 1
418 1 91 ILE MD 1 120 MET ME 4.800 . 6.300 3.163 1.772 4.693 0.028 1 0 "[ . 1]" 1
419 1 92 LEU H 1 92 LEU QD 4.800 . 6.300 3.438 2.487 4.192 . 0 0 "[ . 1]" 1
420 1 92 LEU H 1 93 GLY H 2.900 . 4.450 2.135 1.767 2.393 0.033 4 0 "[ . 1]" 1
421 1 92 LEU QD 1 93 GLY H 4.800 . 6.300 3.387 2.370 4.281 . 0 0 "[ . 1]" 1
422 1 93 GLY H 1 94 TYR H 5.000 . 6.500 4.375 4.179 4.482 . 0 0 "[ . 1]" 1
423 1 94 TYR H 1 95 SER H 5.000 . 6.500 4.038 2.222 4.609 . 0 0 "[ . 1]" 1
424 1 95 SER H 1 96 GLN H 4.000 . 5.500 4.234 3.690 4.503 . 0 0 "[ . 1]" 1
425 1 95 SER H 1 97 ILE MD 4.800 . 6.300 6.063 4.771 6.464 0.164 9 0 "[ . 1]" 1
426 1 96 GLN H 1 97 ILE H 5.000 . 6.500 4.606 4.407 4.712 . 0 0 "[ . 1]" 1
427 1 97 ILE H 1 97 ILE MD 4.800 . 6.300 3.086 1.940 3.961 . 0 0 "[ . 1]" 1
428 1 97 ILE H 1 98 GLY H 2.300 . 3.750 1.920 1.825 2.198 . 0 0 "[ . 1]" 1
429 1 97 ILE H 1 113 VAL QG 4.800 . 6.300 4.860 4.058 5.768 . 0 0 "[ . 1]" 1
430 1 97 ILE MD 1 98 GLY H 4.800 . 6.300 3.366 2.247 4.453 . 0 0 "[ . 1]" 1
431 1 97 ILE MD 1 99 ALA H 4.800 . 6.300 5.606 4.510 6.337 0.037 4 0 "[ . 1]" 1
432 1 97 ILE MD 1 113 VAL QG 4.800 . 6.300 2.816 1.981 3.789 . 0 0 "[ . 1]" 1
433 1 97 ILE MD 1 114 THR H 4.800 . 6.300 4.608 4.026 5.347 . 0 0 "[ . 1]" 1
434 1 97 ILE MD 1 114 THR HG1 4.800 . 6.300 3.586 1.734 6.004 0.066 5 0 "[ . 1]" 1
435 1 97 ILE MD 1 119 LEU QD 4.800 . 6.300 3.966 3.639 4.331 . 0 0 "[ . 1]" 1
436 1 98 GLY H 1 99 ALA H 5.000 . 6.500 4.277 4.222 4.309 . 0 0 "[ . 1]" 1
437 1 98 GLY H 1 113 VAL QG 4.800 . 6.300 3.794 3.025 4.688 . 0 0 "[ . 1]" 1
438 1 99 ALA H 1 100 GLY H 5.000 . 6.500 4.384 4.337 4.415 . 0 0 "[ . 1]" 1
439 1 99 ALA H 1 109 THR HG1 4.800 . 6.300 4.501 3.823 5.178 . 0 0 "[ . 1]" 1
440 1 99 ALA H 1 110 MET H 5.000 . 6.500 5.024 4.666 5.611 . 0 0 "[ . 1]" 1
441 1 99 ALA H 1 113 VAL QG 4.800 . 6.300 2.489 1.997 3.164 . 0 0 "[ . 1]" 1
442 1 99 ALA H 1 197 GLY H 5.000 . 6.500 4.807 4.240 5.107 . 0 0 "[ . 1]" 1
443 1 99 ALA H 1 198 SER H 5.000 . 6.500 5.267 4.707 5.875 . 0 0 "[ . 1]" 1
444 1 99 ALA H 1 210 LEU QD 4.800 . 6.300 5.293 4.583 5.866 . 0 0 "[ . 1]" 1
445 1 100 GLY H 1 101 VAL H 5.000 . 6.500 4.286 4.083 4.366 . 0 0 "[ . 1]" 1
446 1 100 GLY H 1 101 VAL QG 4.800 . 6.300 4.516 4.085 5.306 . 0 0 "[ . 1]" 1
447 1 100 GLY H 1 109 THR HG1 4.800 . 6.300 5.048 4.151 6.120 . 0 0 "[ . 1]" 1
448 1 100 GLY H 1 113 VAL QG 4.800 . 6.300 4.991 4.311 5.452 . 0 0 "[ . 1]" 1
449 1 101 VAL H 1 102 TYR H 5.000 . 6.500 4.327 4.014 4.568 . 0 0 "[ . 1]" 1
450 1 101 VAL H 1 108 HIS H 4.000 . 4.650 4.105 3.352 4.689 0.039 10 0 "[ . 1]" 1
451 1 101 VAL H 1 109 THR H 5.000 . 6.500 5.042 4.664 5.488 . 0 0 "[ . 1]" 1
452 1 101 VAL H 1 210 LEU QD 4.800 . 6.300 2.931 2.400 3.391 . 0 0 "[ . 1]" 1
453 1 101 VAL QG 1 102 TYR H 4.800 . 6.300 2.972 2.568 3.571 . 0 0 "[ . 1]" 1
454 1 101 VAL QG 1 103 LYS H 4.800 . 6.300 4.086 3.882 4.452 . 0 0 "[ . 1]" 1
455 1 101 VAL QG 1 108 HIS H 4.800 . 6.300 4.026 3.037 5.033 . 0 0 "[ . 1]" 1
456 1 101 VAL QG 1 109 THR H 4.800 . 6.300 5.624 4.830 6.401 0.101 7 0 "[ . 1]" 1
457 1 101 VAL QG 1 109 THR HG1 4.800 . 6.300 5.967 4.977 6.513 0.213 6 0 "[ . 1]" 1
458 1 101 VAL QG 1 110 MET H 4.800 . 6.300 5.884 5.451 6.349 0.049 9 0 "[ . 1]" 1
459 1 101 VAL QG 1 146 LEU QD 4.800 . 6.300 2.467 1.754 4.557 0.046 8 0 "[ . 1]" 1
460 1 101 VAL QG 1 161 LEU QD 4.800 . 6.300 4.167 3.191 5.712 . 0 0 "[ . 1]" 1
461 1 101 VAL QG 1 210 LEU QD 4.800 . 6.300 2.115 1.770 2.983 0.030 6 0 "[ . 1]" 1
462 1 102 TYR H 1 103 LYS H 5.000 . 6.500 4.487 4.296 4.628 . 0 0 "[ . 1]" 1
463 1 102 TYR H 1 108 HIS H 5.000 . 5.650 4.942 4.577 5.213 . 0 0 "[ . 1]" 1
464 1 103 LYS H 1 104 GLU H 5.000 . 6.500 4.208 3.854 4.537 . 0 0 "[ . 1]" 1
465 1 103 LYS H 1 105 GLY H 5.000 . 6.500 4.590 3.858 5.207 . 0 0 "[ . 1]" 1
466 1 103 LYS H 1 106 THR H 3.600 . 5.100 3.446 2.872 3.989 . 0 0 "[ . 1]" 1
467 1 103 LYS H 1 108 HIS H 5.000 . 6.500 4.096 3.493 4.684 . 0 0 "[ . 1]" 1
468 1 103 LYS H 1 146 LEU QD 4.800 . 6.300 4.689 3.141 5.192 . 0 0 "[ . 1]" 1
469 1 104 GLU H 1 105 GLY H 4.000 . 5.500 3.723 2.477 4.294 . 0 0 "[ . 1]" 1
470 1 104 GLU H 1 106 THR H 5.000 . 6.500 4.448 4.106 4.749 . 0 0 "[ . 1]" 1
471 1 104 GLU H 1 146 LEU QD 4.800 . 6.300 5.139 3.470 6.334 0.034 3 0 "[ . 1]" 1
472 1 105 GLY H 1 106 THR H 2.900 . 4.450 2.363 1.942 2.979 . 0 0 "[ . 1]" 1
473 1 106 THR H 1 107 PHE H 5.000 . 6.500 4.284 4.107 4.437 . 0 0 "[ . 1]" 1
474 1 107 PHE H 1 108 HIS H 5.000 . 6.500 4.367 4.109 4.531 . 0 0 "[ . 1]" 1
475 1 107 PHE H 1 140 TYR H 3.600 . 4.050 3.275 2.946 3.519 . 0 0 "[ . 1]" 1
476 1 107 PHE H 1 141 GLY H 5.000 . 6.500 5.025 4.668 5.214 . 0 0 "[ . 1]" 1
477 1 107 PHE H 1 142 GLY H 5.000 . 6.500 5.179 3.965 5.895 . 0 0 "[ . 1]" 1
478 1 108 HIS H 1 109 THR H 5.000 . 6.500 4.222 3.970 4.427 . 0 0 "[ . 1]" 1
479 1 108 HIS H 1 140 TYR H 5.000 . 6.500 4.867 4.610 5.144 . 0 0 "[ . 1]" 1
480 1 108 HIS H 1 146 LEU QD 4.800 . 6.300 5.417 4.430 6.397 0.097 9 0 "[ . 1]" 1
481 1 108 HIS H 1 210 LEU QD 4.800 . 6.300 5.083 4.303 5.689 . 0 0 "[ . 1]" 1
482 1 109 THR H 1 109 THR HG1 4.800 . 6.300 4.486 4.205 4.735 . 0 0 "[ . 1]" 1
483 1 109 THR H 1 110 MET H 5.000 . 6.500 4.402 4.232 4.469 . 0 0 "[ . 1]" 1
484 1 109 THR H 1 137 LEU QD 4.800 . 6.300 4.235 3.730 4.582 . 0 0 "[ . 1]" 1
485 1 109 THR H 1 138 ILE H 3.600 . 4.450 3.406 2.915 3.755 . 0 0 "[ . 1]" 1
486 1 109 THR H 1 138 ILE MD 4.800 . 6.300 5.621 4.612 6.294 . 0 0 "[ . 1]" 1
487 1 109 THR H 1 139 SER H 5.000 . 6.500 4.896 4.622 5.161 . 0 0 "[ . 1]" 1
488 1 109 THR H 1 210 LEU QD 4.800 . 6.300 4.146 3.628 4.546 . 0 0 "[ . 1]" 1
489 1 109 THR HG1 1 110 MET H 4.800 . 6.300 2.056 1.825 2.579 . 0 0 "[ . 1]" 1
490 1 109 THR HG1 1 110 MET ME 4.800 . 6.300 5.816 4.749 6.375 0.075 10 0 "[ . 1]" 1
491 1 109 THR HG1 1 113 VAL QG 4.800 . 6.300 2.622 2.156 3.260 . 0 0 "[ . 1]" 1
492 1 109 THR HG1 1 119 LEU QD 4.800 . 6.300 4.909 4.404 5.600 . 0 0 "[ . 1]" 1
493 1 109 THR HG1 1 137 LEU QD 4.800 . 6.300 5.298 5.056 5.560 . 0 0 "[ . 1]" 1
494 1 109 THR HG1 1 210 LEU QD 4.800 . 6.300 4.054 3.167 4.637 . 0 0 "[ . 1]" 1
495 1 110 MET H 1 110 MET ME 4.800 . 6.300 4.365 3.258 4.857 . 0 0 "[ . 1]" 1
496 1 110 MET H 1 111 TRP H 5.000 . 6.500 4.616 4.484 4.690 . 0 0 "[ . 1]" 1
497 1 110 MET H 1 112 HIS H 5.000 . 6.500 5.924 5.482 6.434 . 0 0 "[ . 1]" 1
498 1 110 MET H 1 113 VAL H 5.000 . 6.500 5.136 4.259 5.560 . 0 0 "[ . 1]" 1
499 1 110 MET H 1 113 VAL QG 4.800 . 6.300 3.055 2.753 3.399 . 0 0 "[ . 1]" 1
500 1 110 MET H 1 210 LEU QD 4.800 . 6.300 3.176 2.308 4.112 . 0 0 "[ . 1]" 1
501 1 110 MET ME 1 111 TRP H 4.800 . 6.300 3.635 2.996 4.275 . 0 0 "[ . 1]" 1
502 1 110 MET ME 1 112 HIS H 4.800 . 6.300 4.663 3.700 5.737 . 0 0 "[ . 1]" 1
503 1 110 MET ME 1 113 VAL QG 4.800 . 6.300 4.615 4.092 4.916 . 0 0 "[ . 1]" 1
504 1 110 MET ME 1 136 ASP H 4.800 . 6.300 5.719 5.106 6.364 0.064 8 0 "[ . 1]" 1
505 1 110 MET ME 1 137 LEU H 4.800 . 6.300 5.092 4.705 5.934 . 0 0 "[ . 1]" 1
506 1 110 MET ME 1 137 LEU QD 4.800 . 6.300 2.383 2.034 2.923 . 0 0 "[ . 1]" 1
507 1 110 MET ME 1 138 ILE H 4.800 . 6.300 5.411 4.416 6.291 . 0 0 "[ . 1]" 1
508 1 110 MET ME 1 197 GLY H 4.800 . 6.300 4.963 3.848 5.459 . 0 0 "[ . 1]" 1
509 1 110 MET ME 1 200 ILE MD 4.800 . 6.300 5.664 4.859 6.359 0.059 3 0 "[ . 1]" 1
510 1 110 MET ME 1 210 LEU H 4.800 . 5.850 5.315 4.180 6.116 0.266 1 0 "[ . 1]" 1
511 1 110 MET ME 1 210 LEU QD 4.800 . 6.300 2.797 1.889 3.903 . 0 0 "[ . 1]" 1
512 1 110 MET ME 1 211 TYR H 4.800 . 6.300 5.045 3.848 5.965 . 0 0 "[ . 1]" 1
513 1 110 MET ME 1 212 GLY H 4.800 . 6.300 3.892 2.294 4.530 . 0 0 "[ . 1]" 1
514 1 110 MET ME 1 213 ASN H 4.800 . 6.300 3.981 2.957 5.455 . 0 0 "[ . 1]" 1
515 1 110 MET ME 1 227 ALA H 4.800 . 6.300 4.474 3.472 5.628 . 0 0 "[ . 1]" 1
516 1 111 TRP H 1 112 HIS H 2.900 . 4.450 2.552 2.374 2.726 . 0 0 "[ . 1]" 1
517 1 111 TRP H 1 113 VAL H 5.000 . 6.500 4.173 3.790 4.344 . 0 0 "[ . 1]" 1
518 1 111 TRP H 1 113 VAL QG 4.800 . 6.300 4.193 3.971 4.590 . 0 0 "[ . 1]" 1
519 1 111 TRP H 1 136 ASP H 5.000 . 6.500 5.326 5.091 5.768 . 0 0 "[ . 1]" 1
520 1 111 TRP H 1 137 LEU H 3.600 . 5.100 3.734 3.483 4.007 . 0 0 "[ . 1]" 1
521 1 111 TRP H 1 137 LEU QD 4.800 . 6.300 3.884 3.487 4.541 . 0 0 "[ . 1]" 1
522 1 111 TRP H 1 138 ILE H 3.600 . 5.100 4.006 3.521 4.711 . 0 0 "[ . 1]" 1
523 1 111 TRP H 1 138 ILE MD 4.800 . 6.300 5.380 4.230 6.127 . 0 0 "[ . 1]" 1
524 1 111 TRP H 1 210 LEU QD 4.800 . 6.300 5.465 5.014 6.178 . 0 0 "[ . 1]" 1
525 1 111 TRP HE1 1 131 ALA H 4.800 . 6.300 6.156 5.668 6.347 0.047 2 0 "[ . 1]" 1
526 1 111 TRP HE1 1 133 VAL H 4.800 . 6.300 5.029 4.311 5.453 . 0 0 "[ . 1]" 1
527 1 111 TRP HE1 1 133 VAL QG 4.800 . 6.300 3.056 2.443 4.386 . 0 0 "[ . 1]" 1
528 1 111 TRP HE1 1 138 ILE MD 4.800 . 5.450 3.687 2.836 4.504 . 0 0 "[ . 1]" 1
529 1 112 HIS H 1 113 VAL H 2.900 . 4.450 2.801 2.525 2.930 . 0 0 "[ . 1]" 1
530 1 112 HIS H 1 113 VAL QG 4.800 . 6.300 3.804 3.653 3.997 . 0 0 "[ . 1]" 1
531 1 112 HIS H 1 114 THR H 5.000 . 6.500 4.680 4.096 5.104 . 0 0 "[ . 1]" 1
532 1 112 HIS H 1 137 LEU H 5.000 . 6.500 5.675 5.438 5.968 . 0 0 "[ . 1]" 1
533 1 112 HIS H 1 138 ILE MD 4.800 . 6.300 5.867 4.999 6.385 0.085 3 0 "[ . 1]" 1
534 1 113 VAL H 1 114 THR H 2.900 . 4.450 2.684 2.334 2.929 . 0 0 "[ . 1]" 1
535 1 113 VAL H 1 138 ILE MD 4.800 . 6.300 5.402 4.305 5.962 . 0 0 "[ . 1]" 1
536 1 113 VAL QG 1 114 THR H 4.800 . 6.300 2.568 2.074 3.279 . 0 0 "[ . 1]" 1
537 1 113 VAL QG 1 115 ARG H 4.800 . 6.300 5.230 3.706 5.903 . 0 0 "[ . 1]" 1
538 1 113 VAL QG 1 116 GLY H 4.800 . 6.300 5.054 3.353 6.376 0.076 9 0 "[ . 1]" 1
539 1 113 VAL QG 1 117 ALA H 4.800 . 6.300 5.399 3.534 6.633 0.333 10 0 "[ . 1]" 1
540 1 113 VAL QG 1 119 LEU QD 4.800 . 6.300 3.299 2.662 4.039 . 0 0 "[ . 1]" 1
541 1 113 VAL QG 1 137 LEU QD 4.800 . 6.300 5.147 4.691 5.529 . 0 0 "[ . 1]" 1
542 1 113 VAL QG 1 197 GLY H 4.800 . 6.300 5.187 4.536 5.801 . 0 0 "[ . 1]" 1
543 1 113 VAL QG 1 210 LEU QD 4.800 . 6.300 4.446 4.020 5.050 . 0 0 "[ . 1]" 1
544 1 114 THR H 1 114 THR HG1 4.800 . 6.300 3.961 3.000 4.862 . 0 0 "[ . 1]" 1
545 1 114 THR H 1 115 ARG H 4.000 . 5.500 4.157 2.888 4.437 . 0 0 "[ . 1]" 1
546 1 114 THR H 1 116 GLY H 4.000 . 5.500 3.990 2.788 4.812 . 0 0 "[ . 1]" 1
547 1 114 THR H 1 117 ALA H 5.000 . 6.500 5.308 3.999 6.393 . 0 0 "[ . 1]" 1
548 1 114 THR H 1 119 LEU QD 4.800 . 6.300 5.373 4.235 6.404 0.104 10 0 "[ . 1]" 1
549 1 114 THR H 1 138 ILE MD 4.800 . 6.300 4.479 3.865 4.986 . 0 0 "[ . 1]" 1
550 1 114 THR HG1 1 115 ARG H 4.800 . 6.300 3.845 2.728 4.531 . 0 0 "[ . 1]" 1
551 1 114 THR HG1 1 116 GLY H 4.800 . 6.300 4.743 3.574 5.871 . 0 0 "[ . 1]" 1
552 1 114 THR HG1 1 117 ALA H 4.800 . 6.300 4.305 2.536 6.221 . 0 0 "[ . 1]" 1
553 1 114 THR HG1 1 119 LEU QD 4.800 . 6.300 4.217 2.458 6.095 . 0 0 "[ . 1]" 1
554 1 115 ARG H 1 116 GLY H 2.900 . 4.450 2.833 2.413 3.210 . 0 0 "[ . 1]" 1
555 1 115 ARG H 1 117 ALA H 4.000 . 5.500 3.673 2.469 4.899 . 0 0 "[ . 1]" 1
556 1 115 ARG H 1 138 ILE MD 4.800 . 6.300 5.370 4.313 6.031 . 0 0 "[ . 1]" 1
557 1 116 GLY H 1 117 ALA H 2.900 . 4.450 2.481 2.185 2.711 . 0 0 "[ . 1]" 1
558 1 116 GLY H 1 119 LEU QD 4.800 . 6.300 5.639 5.262 6.352 0.052 10 0 "[ . 1]" 1
559 1 116 GLY H 1 138 ILE MD . . 4.650 3.279 1.934 3.927 . 0 0 "[ . 1]" 1
560 1 117 ALA H 1 118 VAL H 3.600 . 5.100 4.300 2.915 4.597 . 0 0 "[ . 1]" 1
561 1 117 ALA H 1 118 VAL QG 4.800 . 6.300 5.305 4.580 5.705 . 0 0 "[ . 1]" 1
562 1 117 ALA H 1 119 LEU QD 4.800 . 6.300 4.469 3.982 5.617 . 0 0 "[ . 1]" 1
563 1 117 ALA H 1 138 ILE MD . . 4.050 3.448 2.995 3.856 . 0 0 "[ . 1]" 1
564 1 118 VAL H 1 119 LEU H 5.000 . 6.500 4.532 4.186 4.627 . 0 0 "[ . 1]" 1
565 1 118 VAL H 1 119 LEU QD 4.800 . 6.300 4.617 4.254 5.546 . 0 0 "[ . 1]" 1
566 1 118 VAL QG 1 119 LEU H 4.800 . 6.300 2.615 2.256 3.267 . 0 0 "[ . 1]" 1
567 1 118 VAL QG 1 119 LEU QD 4.800 . 6.300 3.893 3.508 4.443 . 0 0 "[ . 1]" 1
568 1 118 VAL QG 1 120 MET QG 4.800 . 6.300 3.714 2.441 4.224 . 0 0 "[ . 1]" 1
569 1 118 VAL QG 1 120 MET ME 4.800 . 6.300 3.110 2.067 5.349 . 0 0 "[ . 1]" 1
570 1 118 VAL QG 1 121 HIS H 4.800 . 6.300 5.871 5.285 6.323 0.023 1 0 "[ . 1]" 1
571 1 118 VAL QG 1 125 ARG H 4.800 . 6.300 4.911 4.552 5.601 . 0 0 "[ . 1]" 1
572 1 118 VAL QG 1 126 ILE H 4.800 . 6.300 2.999 2.174 4.010 . 0 0 "[ . 1]" 1
573 1 118 VAL QG 1 126 ILE MD 4.800 . 6.300 5.189 4.756 5.943 . 0 0 "[ . 1]" 1
574 1 118 VAL QG 1 127 GLU H 4.800 . 6.300 4.014 3.406 4.759 . 0 0 "[ . 1]" 1
575 1 119 LEU H 1 119 LEU QD 4.800 . 6.300 2.782 2.292 3.733 . 0 0 "[ . 1]" 1
576 1 119 LEU H 1 120 MET H 5.000 . 6.500 4.532 4.456 4.602 . 0 0 "[ . 1]" 1
577 1 119 LEU H 1 120 MET QG 4.800 . 6.300 5.331 4.442 5.814 . 0 0 "[ . 1]" 1
578 1 119 LEU H 1 126 ILE H 3.600 . 4.250 3.453 2.517 4.256 0.006 1 0 "[ . 1]" 1
579 1 119 LEU H 1 126 ILE MD 4.800 . 6.300 4.818 4.292 5.369 . 0 0 "[ . 1]" 1
580 1 119 LEU H 1 127 GLU H 5.000 . 6.500 5.013 4.831 5.178 . 0 0 "[ . 1]" 1
581 1 119 LEU H 1 138 ILE MD 4.800 . 6.300 6.137 5.705 6.413 0.113 9 0 "[ . 1]" 1
582 1 119 LEU QD 1 120 MET H 4.800 . 6.300 3.075 1.728 3.763 0.072 10 0 "[ . 1]" 1
583 1 119 LEU QD 1 120 MET QB 4.800 . 6.300 4.705 3.605 5.271 . 0 0 "[ . 1]" 1
584 1 119 LEU QD 1 120 MET QG 4.800 . 6.300 4.674 3.759 5.416 . 0 0 "[ . 1]" 1
585 1 119 LEU QD 1 120 MET ME 4.800 . 6.300 5.321 4.436 6.177 . 0 0 "[ . 1]" 1
586 1 119 LEU QD 1 121 HIS H 4.800 . 6.300 5.899 4.134 6.440 0.140 4 0 "[ . 1]" 1
587 1 119 LEU QD 1 126 ILE H 4.800 . 6.300 4.792 4.170 5.236 . 0 0 "[ . 1]" 1
588 1 119 LEU QD 1 126 ILE MD 4.800 . 6.300 3.420 1.768 4.268 0.032 10 0 "[ . 1]" 1
589 1 120 MET H 1 120 MET QB 2.900 . 4.450 2.702 2.486 3.380 . 0 0 "[ . 1]" 1
590 1 120 MET H 1 120 MET QG 4.800 . 6.300 3.078 2.856 3.338 . 0 0 "[ . 1]" 1
591 1 120 MET H 1 120 MET ME 4.800 . 6.300 4.609 3.354 5.248 . 0 0 "[ . 1]" 1
592 1 120 MET H 1 121 HIS H 5.000 . 6.500 4.342 4.070 4.515 . 0 0 "[ . 1]" 1
593 1 120 MET H 1 126 ILE H 5.000 . 6.500 4.544 3.960 5.026 . 0 0 "[ . 1]" 1
594 1 120 MET H 1 126 ILE MD 4.800 . 6.300 3.904 3.306 4.826 . 0 0 "[ . 1]" 1
595 1 120 MET QB 1 121 HIS H 2.900 . 4.450 2.848 2.327 3.612 . 0 0 "[ . 1]" 1
596 1 120 MET QB 1 123 GLY H 4.000 . 5.500 3.327 2.312 4.583 . 0 0 "[ . 1]" 1
597 1 120 MET QB 1 124 LYS H 5.000 . 6.500 4.510 3.850 5.348 . 0 0 "[ . 1]" 1
598 1 120 MET QB 1 126 ILE MD 4.800 . 6.300 4.943 4.597 5.360 . 0 0 "[ . 1]" 1
599 1 120 MET QG 1 121 HIS H 4.800 . 6.300 4.403 3.849 4.736 . 0 0 "[ . 1]" 1
600 1 120 MET QG 1 126 ILE H 4.800 . 6.300 4.930 3.964 5.567 . 0 0 "[ . 1]" 1
601 1 120 MET QG 1 126 ILE MD 4.800 . 6.300 5.664 5.173 6.367 0.067 5 0 "[ . 1]" 1
602 1 120 MET ME 1 121 HIS H 4.800 . 6.300 4.925 4.271 5.454 . 0 0 "[ . 1]" 1
603 1 120 MET ME 1 123 GLY H 4.800 . 6.300 5.319 3.915 6.416 0.116 5 0 "[ . 1]" 1
604 1 120 MET ME 1 124 LYS H 4.800 . 6.300 5.820 4.892 6.427 0.127 5 0 "[ . 1]" 1
605 1 120 MET ME 1 125 ARG H 4.800 . 6.300 5.082 4.457 6.485 0.185 3 0 "[ . 1]" 1
606 1 120 MET ME 1 126 ILE H 4.800 . 6.300 4.924 3.429 6.399 0.099 3 0 "[ . 1]" 1
607 1 120 MET ME 1 126 ILE MD 4.800 . 6.300 6.177 5.354 6.555 0.255 9 0 "[ . 1]" 1
608 1 121 HIS H 1 122 LYS H 4.000 . 5.500 3.802 3.429 4.154 . 0 0 "[ . 1]" 1
609 1 121 HIS H 1 124 LYS H 2.900 . 4.450 2.973 2.383 3.934 . 0 0 "[ . 1]" 1
610 1 121 HIS H 1 125 ARG H 5.000 . 6.500 4.954 4.757 5.173 . 0 0 "[ . 1]" 1
611 1 121 HIS H 1 126 ILE H 5.000 . 6.500 4.559 4.015 5.406 . 0 0 "[ . 1]" 1
612 1 121 HIS H 1 126 ILE MD 4.800 . 6.300 3.792 3.445 4.283 . 0 0 "[ . 1]" 1
613 1 122 LYS H 1 123 GLY H 2.900 . 4.450 2.718 2.480 3.164 . 0 0 "[ . 1]" 1
614 1 122 LYS H 1 124 LYS H 4.000 . 5.500 4.174 3.992 4.335 . 0 0 "[ . 1]" 1
615 1 123 GLY H 1 124 LYS H 2.900 . 4.450 2.638 2.385 3.068 . 0 0 "[ . 1]" 1
616 1 124 LYS H 1 125 ARG H 5.000 . 6.500 4.472 4.408 4.579 . 0 0 "[ . 1]" 1
617 1 124 LYS H 1 126 ILE MD 4.800 . 6.300 5.630 4.570 6.403 0.103 6 0 "[ . 1]" 1
618 1 125 ARG H 1 126 ILE H 5.000 . 6.500 4.357 4.068 4.625 . 0 0 "[ . 1]" 1
619 1 125 ARG H 1 126 ILE MD 4.800 . 6.300 5.988 4.360 6.374 0.074 7 0 "[ . 1]" 1
620 1 126 ILE H 1 126 ILE MD 4.800 . 6.300 3.715 2.530 4.233 . 0 0 "[ . 1]" 1
621 1 126 ILE H 1 127 GLU H 5.000 . 6.500 4.168 4.071 4.410 . 0 0 "[ . 1]" 1
622 1 126 ILE MD 1 127 GLU H 4.800 . 6.300 5.387 4.521 5.658 . 0 0 "[ . 1]" 1
623 1 129 SER HG 1 142 GLY H 4.800 . 6.300 3.010 2.221 5.472 . 0 0 "[ . 1]" 1
624 1 129 SER HG 1 143 GLY H 4.800 . 6.300 5.517 4.962 6.312 0.012 4 0 "[ . 1]" 1
625 1 130 TRP H 1 131 ALA H 5.000 . 6.500 4.341 4.236 4.473 . 0 0 "[ . 1]" 1
626 1 130 TRP H 1 138 ILE MD 4.800 . 6.300 5.760 5.103 6.432 0.132 5 0 "[ . 1]" 1
627 1 130 TRP H 1 139 SER H 3.600 . 4.650 3.390 3.124 3.744 . 0 0 "[ . 1]" 1
628 1 130 TRP H 1 141 GLY H 5.000 . 6.500 4.762 3.466 5.369 . 0 0 "[ . 1]" 1
629 1 130 TRP H 1 142 GLY H 5.000 . 6.500 5.081 4.381 6.572 0.072 9 0 "[ . 1]" 1
630 1 130 TRP HE1 1 131 ALA H 4.800 . 6.300 4.560 4.293 4.958 . 0 0 "[ . 1]" 1
631 1 130 TRP HE1 1 132 ASP H 4.800 . 6.300 4.114 3.422 4.654 . 0 0 "[ . 1]" 1
632 1 131 ALA H 1 138 ILE MD 4.800 . 6.300 5.880 5.435 6.491 0.191 7 0 "[ . 1]" 1
633 1 131 ALA H 1 139 SER H 5.000 . 6.500 4.723 4.529 4.990 . 0 0 "[ . 1]" 1
634 1 132 ASP H 1 133 VAL H 5.000 . 6.500 4.166 3.993 4.271 . 0 0 "[ . 1]" 1
635 1 132 ASP H 1 133 VAL QG 4.800 . 6.300 4.682 4.300 5.302 . 0 0 "[ . 1]" 1
636 1 132 ASP H 1 134 LYS H 5.000 . 6.500 5.509 5.296 5.924 . 0 0 "[ . 1]" 1
637 1 132 ASP H 1 135 LYS H 5.000 . 6.500 5.645 4.982 5.931 . 0 0 "[ . 1]" 1
638 1 132 ASP H 1 136 ASP H 5.000 . 6.500 5.406 5.150 5.708 . 0 0 "[ . 1]" 1
639 1 132 ASP H 1 137 LEU H 3.600 . 4.450 3.551 3.341 3.851 . 0 0 "[ . 1]" 1
640 1 132 ASP H 1 137 LEU QD 4.800 . 6.300 5.321 5.006 5.695 . 0 0 "[ . 1]" 1
641 1 132 ASP H 1 138 ILE MD 4.800 . 6.300 5.308 4.618 5.799 . 0 0 "[ . 1]" 1
642 1 132 ASP H 1 139 SER H 5.000 . 6.500 4.796 4.055 5.319 . 0 0 "[ . 1]" 1
643 1 133 VAL H 1 134 LYS H 2.900 . 4.450 2.507 2.447 2.613 . 0 0 "[ . 1]" 1
644 1 133 VAL H 1 135 LYS H 5.000 . 6.500 4.540 3.995 4.969 . 0 0 "[ . 1]" 1
645 1 133 VAL H 1 136 ASP H 5.000 . 6.500 4.691 4.523 4.822 . 0 0 "[ . 1]" 1
646 1 133 VAL H 1 137 LEU H 5.000 . 6.500 5.077 4.959 5.212 . 0 0 "[ . 1]" 1
647 1 133 VAL QG 1 134 LYS H 4.800 . 6.300 3.297 2.240 3.642 . 0 0 "[ . 1]" 1
648 1 133 VAL QG 1 135 LYS H 4.800 . 6.300 4.870 4.159 5.143 . 0 0 "[ . 1]" 1
649 1 133 VAL QG 1 136 ASP H 4.800 . 6.300 4.295 4.066 4.478 . 0 0 "[ . 1]" 1
650 1 133 VAL QG 1 137 LEU H 4.800 . 6.300 4.937 4.679 5.294 . 0 0 "[ . 1]" 1
651 1 134 LYS H 1 135 LYS H 2.900 . 4.450 2.646 2.470 2.936 . 0 0 "[ . 1]" 1
652 1 134 LYS H 1 136 ASP H 4.000 . 5.500 3.462 3.282 3.816 . 0 0 "[ . 1]" 1
653 1 135 LYS H 1 136 ASP H 2.300 . 3.750 2.324 2.118 2.432 . 0 0 "[ . 1]" 1
654 1 135 LYS H 1 137 LEU H 4.000 . 5.500 4.136 3.791 4.288 . 0 0 "[ . 1]" 1
655 1 135 LYS H 1 137 LEU QD 4.800 . 6.300 4.932 4.455 5.497 . 0 0 "[ . 1]" 1
656 1 136 ASP H 1 137 LEU H 2.900 . 4.450 2.779 2.558 2.954 . 0 0 "[ . 1]" 1
657 1 136 ASP H 1 137 LEU QD 4.800 . 6.300 4.588 3.595 5.041 . 0 0 "[ . 1]" 1
658 1 137 LEU H 1 137 LEU QD 4.800 . 6.300 3.648 2.952 3.875 . 0 0 "[ . 1]" 1
659 1 137 LEU QD 1 138 ILE H 4.800 . 6.300 3.390 3.023 3.705 . 0 0 "[ . 1]" 1
660 1 137 LEU QD 1 144 TRP H 4.800 . 6.300 4.764 3.593 6.394 0.094 1 0 "[ . 1]" 1
661 1 137 LEU QD 1 144 TRP HE1 4.800 . 6.300 4.135 3.116 5.658 . 0 0 "[ . 1]" 1
662 1 137 LEU QD 1 200 ILE MD 4.800 . 6.300 5.999 5.464 6.306 0.006 5 0 "[ . 1]" 1
663 1 137 LEU QD 1 210 LEU H 4.800 . 6.300 4.371 4.027 5.001 . 0 0 "[ . 1]" 1
664 1 137 LEU QD 1 210 LEU QD 4.800 . 6.300 2.250 1.776 2.655 0.024 1 0 "[ . 1]" 1
665 1 137 LEU QD 1 227 ALA H 4.800 . 6.300 4.694 4.386 5.138 . 0 0 "[ . 1]" 1
666 1 137 LEU QD 1 228 GLN H 4.800 . 6.300 4.309 3.777 5.075 . 0 0 "[ . 1]" 1
667 1 138 ILE H 1 138 ILE MD 4.800 . 6.300 4.571 4.061 4.999 . 0 0 "[ . 1]" 1
668 1 138 ILE H 1 210 LEU QD 4.800 . 6.300 4.891 4.094 5.421 . 0 0 "[ . 1]" 1
669 1 138 ILE MD 1 139 SER H 4.800 . 6.300 4.476 4.099 4.958 . 0 0 "[ . 1]" 1
670 1 139 SER H 1 140 TYR H 5.000 . 6.500 4.345 4.144 4.442 . 0 0 "[ . 1]" 1
671 1 140 TYR H 1 141 GLY H 5.000 . 6.500 4.228 3.989 4.433 . 0 0 "[ . 1]" 1
672 1 140 TYR H 1 142 GLY H 4.000 . 5.500 4.055 3.579 5.480 . 0 0 "[ . 1]" 1
673 1 141 GLY H 1 142 GLY H 2.300 . 3.750 2.656 2.116 3.712 . 0 0 "[ . 1]" 1
674 1 142 GLY H 1 143 GLY H 5.000 . 6.500 4.181 2.791 4.438 . 0 0 "[ . 1]" 1
675 1 143 GLY H 1 144 TRP H 5.000 . 6.500 4.510 4.308 4.591 . 0 0 "[ . 1]" 1
676 1 144 TRP H 1 145 LYS H 5.000 . 6.500 4.342 4.254 4.420 . 0 0 "[ . 1]" 1
677 1 144 TRP H 1 232 SER H 5.000 . 6.500 3.974 2.768 5.044 . 0 0 "[ . 1]" 1
678 1 144 TRP HE1 1 145 LYS H 4.800 . 6.300 5.835 5.106 6.236 . 0 0 "[ . 1]" 1
679 1 144 TRP HE1 1 146 LEU H 4.800 . 6.300 5.520 4.476 6.409 0.109 9 0 "[ . 1]" 1
680 1 144 TRP HE1 1 146 LEU QD 4.800 . 6.300 4.339 1.941 5.640 . 0 0 "[ . 1]" 1
681 1 144 TRP HE1 1 147 GLU H 4.800 . 6.300 5.746 4.047 6.576 0.276 5 0 "[ . 1]" 1
682 1 144 TRP HE1 1 148 GLY H 4.800 . 6.300 5.895 4.718 6.353 0.053 2 0 "[ . 1]" 1
683 1 144 TRP HE1 1 207 VAL QG 4.800 . 6.300 5.286 4.417 6.339 0.039 6 0 "[ . 1]" 1
684 1 144 TRP HE1 1 208 VAL QG 4.800 . 6.300 5.577 3.517 6.279 . 0 0 "[ . 1]" 1
685 1 144 TRP HE1 1 209 GLY H 4.800 . 6.300 5.719 4.913 6.467 0.167 7 0 "[ . 1]" 1
686 1 144 TRP HE1 1 210 LEU QD 4.800 . 6.300 5.082 4.621 5.907 . 0 0 "[ . 1]" 1
687 1 144 TRP HE1 1 228 GLN H 4.800 . 6.050 5.071 3.910 6.310 0.260 10 0 "[ . 1]" 1
688 1 144 TRP HE1 1 229 THR H 4.800 . 6.300 3.655 2.814 4.442 . 0 0 "[ . 1]" 1
689 1 144 TRP HE1 1 230 GLU H 4.800 . 6.300 4.231 3.676 5.388 . 0 0 "[ . 1]" 1
690 1 144 TRP HE1 1 231 LYS H 4.800 . 6.300 6.003 5.308 6.416 0.116 1 0 "[ . 1]" 1
691 1 145 LYS H 1 146 LEU H 5.000 . 6.500 4.102 3.727 4.365 . 0 0 "[ . 1]" 1
692 1 145 LYS H 1 146 LEU QD 4.800 . 6.300 4.329 3.037 5.069 . 0 0 "[ . 1]" 1
693 1 145 LYS H 1 232 SER H 5.000 . 6.500 4.969 4.622 5.515 . 0 0 "[ . 1]" 1
694 1 146 LEU H 1 146 LEU QD 4.800 . 6.300 3.704 2.755 4.144 . 0 0 "[ . 1]" 1
695 1 146 LEU H 1 147 GLU H 2.300 . 3.750 1.806 1.438 2.888 . 0 0 "[ . 1]" 1
696 1 146 LEU H 1 148 GLY H 5.000 . 6.500 4.092 3.252 4.959 . 0 0 "[ . 1]" 1
697 1 146 LEU H 1 231 LYS H 5.000 . 6.500 5.738 4.471 6.520 0.020 4 0 "[ . 1]" 1
698 1 146 LEU H 1 232 SER H 5.000 . 6.500 6.405 5.735 6.842 0.342 5 0 "[ . 1]" 1
699 1 146 LEU QD 1 147 GLU H 4.800 . 6.300 3.836 1.935 4.504 . 0 0 "[ . 1]" 1
700 1 146 LEU QD 1 148 GLY H 4.800 . 6.300 4.581 2.013 5.832 . 0 0 "[ . 1]" 1
701 1 146 LEU QD 1 207 VAL H 4.800 . 6.300 5.077 4.069 6.368 0.068 5 0 "[ . 1]" 1
702 1 146 LEU QD 1 207 VAL QG 4.800 . 6.300 2.690 1.683 5.748 0.117 4 0 "[ . 1]" 1
703 1 146 LEU QD 1 208 VAL H 4.800 . 6.300 5.182 4.223 6.511 0.211 10 0 "[ . 1]" 1
704 1 146 LEU QD 1 208 VAL QG 4.800 . 6.300 4.586 2.064 5.927 . 0 0 "[ . 1]" 1
705 1 146 LEU QD 1 209 GLY H 4.800 . 6.300 4.777 3.695 6.516 0.216 10 0 "[ . 1]" 1
706 1 146 LEU QD 1 210 LEU QD 4.800 . 6.300 4.149 3.116 5.784 . 0 0 "[ . 1]" 1
707 1 146 LEU QD 1 229 THR H 4.800 . 6.300 5.773 4.505 6.402 0.102 2 0 "[ . 1]" 1
708 1 147 GLU H 1 148 GLY H 2.900 . 4.450 2.808 1.875 3.423 . 0 0 "[ . 1]" 1
709 1 147 GLU H 1 207 VAL QG 4.800 . 6.300 5.024 3.761 6.491 0.191 5 0 "[ . 1]" 1
710 1 147 GLU H 1 229 THR H 5.000 . 6.500 5.602 4.884 6.613 0.113 3 0 "[ . 1]" 1
711 1 147 GLU H 1 231 LYS H 5.000 . 6.500 6.273 5.350 6.689 0.189 9 0 "[ . 1]" 1
712 1 148 GLY H 1 149 GLU H 5.000 . 6.500 4.314 3.236 4.645 . 0 0 "[ . 1]" 1
713 1 148 GLY H 1 207 VAL QG 4.800 . 6.300 4.133 3.157 5.649 . 0 0 "[ . 1]" 1
714 1 148 GLY H 1 208 VAL H 5.000 . 6.500 6.388 5.257 6.739 0.239 5 0 "[ . 1]" 1
715 1 148 GLY H 1 208 VAL QG 4.800 . 6.300 5.062 3.661 6.436 0.136 3 0 "[ . 1]" 1
716 1 148 GLY H 1 229 THR H 5.000 . 6.500 4.399 3.522 6.540 0.040 3 0 "[ . 1]" 1
717 1 149 GLU H 1 150 TRP H 4.000 . 5.500 4.044 3.731 4.396 . 0 0 "[ . 1]" 1
718 1 149 GLU H 1 207 VAL H 5.000 . 6.500 5.986 3.892 6.635 0.135 8 0 "[ . 1]" 1
719 1 149 GLU H 1 207 VAL QG 4.800 . 6.300 4.705 2.594 6.242 . 0 0 "[ . 1]" 1
720 1 149 GLU H 1 208 VAL H 5.000 . 6.500 5.819 4.798 6.521 0.021 10 0 "[ . 1]" 1
721 1 149 GLU H 1 208 VAL QG 4.800 . 6.300 3.627 2.490 5.312 . 0 0 "[ . 1]" 1
722 1 149 GLU H 1 229 THR HG1 4.800 . 6.300 5.300 4.442 6.377 0.077 9 0 "[ . 1]" 1
723 1 150 TRP H 1 151 LYS H 5.000 . 6.500 4.547 4.440 4.637 . 0 0 "[ . 1]" 1
724 1 150 TRP H 1 156 VAL QG 4.800 . 6.300 5.463 4.613 6.089 . 0 0 "[ . 1]" 1
725 1 150 TRP H 1 207 VAL QG 4.800 . 6.300 5.696 2.549 6.641 0.341 8 0 "[ . 1]" 1
726 1 150 TRP H 1 208 VAL H 5.000 . 6.500 6.167 5.404 6.629 0.129 5 0 "[ . 1]" 1
727 1 150 TRP H 1 208 VAL QG 4.800 . 6.300 3.578 1.729 6.449 0.149 5 0 "[ . 1]" 1
728 1 150 TRP HE1 1 151 LYS H 4.800 . 6.300 4.539 4.054 5.182 . 0 0 "[ . 1]" 1
729 1 150 TRP HE1 1 152 GLU H 4.800 . 6.300 5.677 3.610 6.353 0.053 5 0 "[ . 1]" 1
730 1 150 TRP HE1 1 153 GLY H 4.800 . 6.300 4.559 3.595 6.016 . 0 0 "[ . 1]" 1
731 1 150 TRP HE1 1 154 GLU H 4.800 . 6.300 4.479 3.264 6.391 0.091 4 0 "[ . 1]" 1
732 1 150 TRP HE1 1 156 VAL H 4.800 . 6.300 4.275 3.721 5.149 . 0 0 "[ . 1]" 1
733 1 150 TRP HE1 1 156 VAL QG 4.800 . 6.300 2.679 1.886 3.686 . 0 0 "[ . 1]" 1
734 1 150 TRP HE1 1 157 GLN H 4.800 . 6.300 5.992 4.562 6.590 0.290 7 0 "[ . 1]" 1
735 1 150 TRP HE1 1 226 ILE MD 4.800 . 6.300 4.158 2.019 6.195 . 0 0 "[ . 1]" 1
736 1 151 LYS H 1 152 GLU H 5.000 . 6.500 4.204 3.421 4.531 . 0 0 "[ . 1]" 1
737 1 152 GLU H 1 153 GLY H 5.000 . 6.500 4.440 4.223 4.639 . 0 0 "[ . 1]" 1
738 1 152 GLU H 1 154 GLU H 5.000 . 6.500 5.067 4.556 6.620 0.120 7 0 "[ . 1]" 1
739 1 156 VAL H 1 157 GLN H 5.000 . 6.500 4.549 4.503 4.599 . 0 0 "[ . 1]" 1
740 1 156 VAL H 1 158 VAL QG 4.800 . 6.300 5.210 5.008 5.403 . 0 0 "[ . 1]" 1
741 1 156 VAL H 1 172 THR H 3.600 . 4.050 3.522 2.643 4.071 0.021 1 0 "[ . 1]" 1
742 1 156 VAL H 1 172 THR HG1 4.800 . 6.300 4.872 3.346 6.191 . 0 0 "[ . 1]" 1
743 1 156 VAL H 1 173 LYS H 5.000 . 6.500 4.981 4.672 5.116 . 0 0 "[ . 1]" 1
744 1 156 VAL H 1 187 VAL QG 4.800 . 6.300 5.093 4.619 5.920 . 0 0 "[ . 1]" 1
745 1 156 VAL H 1 226 ILE MD 4.800 . 6.300 4.644 3.999 5.276 . 0 0 "[ . 1]" 1
746 1 156 VAL QG 1 157 GLN H 4.800 . 6.300 2.600 2.003 3.443 . 0 0 "[ . 1]" 1
747 1 156 VAL QG 1 158 VAL H 4.800 . 6.300 4.528 4.159 5.071 . 0 0 "[ . 1]" 1
748 1 156 VAL QG 1 158 VAL QG 4.800 . 6.300 2.867 2.384 3.883 . 0 0 "[ . 1]" 1
749 1 156 VAL QG 1 172 THR H 4.800 . 6.300 3.478 2.984 4.391 . 0 0 "[ . 1]" 1
750 1 156 VAL QG 1 173 LYS H 4.800 . 6.300 4.999 4.498 5.656 . 0 0 "[ . 1]" 1
751 1 156 VAL QG 1 187 VAL QG 4.800 . 6.300 3.087 2.452 4.095 . 0 0 "[ . 1]" 1
752 1 156 VAL QG 1 200 ILE H 4.800 . 6.300 5.728 5.021 6.195 . 0 0 "[ . 1]" 1
753 1 156 VAL QG 1 200 ILE MD 4.800 . 6.300 2.997 2.181 3.889 . 0 0 "[ . 1]" 1
754 1 156 VAL QG 1 201 ILE H 4.800 . 6.300 4.256 3.356 5.146 . 0 0 "[ . 1]" 1
755 1 156 VAL QG 1 202 ASP H 4.800 . 6.300 4.920 3.084 6.117 . 0 0 "[ . 1]" 1
756 1 156 VAL QG 1 203 LYS H 4.800 . 6.300 4.924 3.958 5.584 . 0 0 "[ . 1]" 1
757 1 156 VAL QG 1 208 VAL H 4.800 . 6.300 5.317 4.290 6.366 0.066 10 0 "[ . 1]" 1
758 1 156 VAL QG 1 209 GLY H 4.800 . 6.300 5.487 4.616 6.162 . 0 0 "[ . 1]" 1
759 1 156 VAL QG 1 226 ILE MD 4.800 . 6.300 2.015 1.684 2.687 0.116 9 0 "[ . 1]" 1
760 1 157 GLN H 1 158 VAL H 5.000 . 6.500 4.466 4.349 4.538 . 0 0 "[ . 1]" 1
761 1 157 GLN H 1 158 VAL QG 4.800 . 6.300 4.306 3.816 4.792 . 0 0 "[ . 1]" 1
762 1 157 GLN H 1 201 ILE H 3.600 . 4.050 3.929 3.719 4.084 0.034 4 0 "[ . 1]" 1
763 1 157 GLN H 1 202 ASP H 5.000 . 6.500 4.939 4.576 5.081 . 0 0 "[ . 1]" 1
764 1 157 GLN H 1 203 LYS H 5.000 . 6.500 4.548 4.213 4.969 . 0 0 "[ . 1]" 1
765 1 157 GLN H 1 226 ILE MD 4.800 . 6.300 5.893 5.486 6.434 0.134 6 0 "[ . 1]" 1
766 1 158 VAL H 1 159 LEU H 5.000 . 6.500 4.236 3.941 4.434 . 0 0 "[ . 1]" 1
767 1 158 VAL H 1 160 ALA H 5.000 . 6.500 5.167 4.826 5.400 . 0 0 "[ . 1]" 1
768 1 158 VAL H 1 170 VAL H 2.900 . 4.050 2.811 2.225 3.541 . 0 0 "[ . 1]" 1
769 1 158 VAL H 1 170 VAL QG 4.800 . 6.300 3.944 3.034 4.666 . 0 0 "[ . 1]" 1
770 1 158 VAL H 1 171 GLN H 5.000 . 6.500 4.854 4.590 5.163 . 0 0 "[ . 1]" 1
771 1 158 VAL H 1 172 THR H 5.000 . 6.500 4.495 3.840 5.065 . 0 0 "[ . 1]" 1
772 1 158 VAL H 1 201 ILE H 5.000 . 6.500 4.792 4.556 4.968 . 0 0 "[ . 1]" 1
773 1 158 VAL QG 1 159 LEU H 4.800 . 6.300 2.937 2.569 3.286 . 0 0 "[ . 1]" 1
774 1 158 VAL QG 1 159 LEU QD 4.800 . 6.300 4.276 3.107 4.731 . 0 0 "[ . 1]" 1
775 1 158 VAL QG 1 160 ALA H 4.800 . 6.300 3.192 2.748 3.584 . 0 0 "[ . 1]" 1
776 1 158 VAL QG 1 161 LEU H 4.800 . 6.300 4.471 4.005 4.945 . 0 0 "[ . 1]" 1
777 1 158 VAL QG 1 161 LEU QD 4.800 . 6.300 4.983 4.354 5.385 . 0 0 "[ . 1]" 1
778 1 158 VAL QG 1 168 ARG H 4.800 . 6.300 5.946 5.385 6.358 0.058 5 0 "[ . 1]" 1
779 1 158 VAL QG 1 170 VAL H 4.800 . 6.300 3.948 3.543 4.388 . 0 0 "[ . 1]" 1
780 1 158 VAL QG 1 171 GLN H 4.800 . 6.300 5.543 5.047 6.164 . 0 0 "[ . 1]" 1
781 1 158 VAL QG 1 172 THR H 4.800 . 6.300 3.912 3.434 4.831 . 0 0 "[ . 1]" 1
782 1 158 VAL QG 1 172 THR HG1 4.800 . 6.300 3.912 2.312 5.538 . 0 0 "[ . 1]" 1
783 1 158 VAL QG 1 187 VAL QG 4.800 . 6.300 2.689 2.119 3.404 . 0 0 "[ . 1]" 1
784 1 158 VAL QG 1 189 LEU QD 4.800 . 6.300 3.528 2.290 4.969 . 0 0 "[ . 1]" 1
785 1 158 VAL QG 1 198 SER H 4.800 . 6.300 5.034 4.593 5.577 . 0 0 "[ . 1]" 1
786 1 158 VAL QG 1 198 SER HG 4.800 . 6.300 3.740 2.274 5.442 . 0 0 "[ . 1]" 1
787 1 158 VAL QG 1 200 ILE H 4.800 . 6.300 4.503 4.144 5.020 . 0 0 "[ . 1]" 1
788 1 158 VAL QG 1 200 ILE MD 4.800 . 6.300 2.925 2.491 3.896 . 0 0 "[ . 1]" 1
789 1 158 VAL QG 1 201 ILE H 4.800 . 6.300 4.092 3.430 4.697 . 0 0 "[ . 1]" 1
790 1 158 VAL QG 1 201 ILE MD 4.800 . 6.300 5.507 4.828 5.994 . 0 0 "[ . 1]" 1
791 1 158 VAL QG 1 211 TYR H 4.800 . 6.300 4.361 4.062 4.896 . 0 0 "[ . 1]" 1
792 1 158 VAL QG 1 226 ILE MD 4.800 . 6.300 4.352 3.858 5.184 . 0 0 "[ . 1]" 1
793 1 159 LEU H 1 159 LEU QD 4.800 . 6.300 3.236 1.722 3.818 0.078 8 0 "[ . 1]" 1
794 1 159 LEU H 1 160 ALA H 4.000 . 5.500 3.975 3.752 4.112 . 0 0 "[ . 1]" 1
795 1 159 LEU H 1 161 LEU QD 4.800 . 6.300 5.411 4.904 6.176 . 0 0 "[ . 1]" 1
796 1 159 LEU H 1 170 VAL H 5.000 . 6.500 4.873 4.492 5.091 . 0 0 "[ . 1]" 1
797 1 159 LEU H 1 201 ILE H 5.000 . 6.500 3.698 3.011 4.340 . 0 0 "[ . 1]" 1
798 1 159 LEU H 1 201 ILE MD 4.800 . 6.300 4.181 3.729 4.845 . 0 0 "[ . 1]" 1
799 1 159 LEU QD 1 160 ALA H 4.800 . 6.300 3.641 3.029 4.499 . 0 0 "[ . 1]" 1
800 1 159 LEU QD 1 161 LEU H 4.800 . 6.300 4.838 4.108 5.697 . 0 0 "[ . 1]" 1
801 1 159 LEU QD 1 161 LEU QD 4.800 . 6.300 2.695 2.120 3.464 . 0 0 "[ . 1]" 1
802 1 159 LEU QD 1 162 GLU H 4.800 . 6.300 5.864 5.113 6.482 0.181 1 0 "[ . 1]" 1
803 1 159 LEU QD 1 168 ARG H 4.800 . 6.300 4.068 2.974 5.550 . 0 0 "[ . 1]" 1
804 1 159 LEU QD 1 169 ALA H 4.800 . 6.300 4.142 3.206 5.762 . 0 0 "[ . 1]" 1
805 1 159 LEU QD 1 170 VAL H 4.800 . 6.300 4.767 3.978 5.535 . 0 0 "[ . 1]" 1
806 1 159 LEU QD 1 201 ILE H 4.800 . 6.300 4.903 3.559 5.706 . 0 0 "[ . 1]" 1
807 1 159 LEU QD 1 201 ILE MD 4.800 . 6.300 2.476 1.925 2.935 . 0 0 "[ . 1]" 1
808 1 160 ALA H 1 161 LEU H 5.000 . 6.500 4.367 4.245 4.525 . 0 0 "[ . 1]" 1
809 1 160 ALA H 1 161 LEU QD 4.800 . 6.300 4.855 4.620 5.086 . 0 0 "[ . 1]" 1
810 1 160 ALA H 1 168 ARG H 3.600 . 4.050 3.485 3.184 3.868 . 0 0 "[ . 1]" 1
811 1 160 ALA H 1 169 ALA H 5.000 . 6.500 4.769 4.515 4.941 . 0 0 "[ . 1]" 1
812 1 160 ALA H 1 170 VAL H 4.000 . 5.500 3.596 3.169 4.111 . 0 0 "[ . 1]" 1
813 1 160 ALA H 1 170 VAL QG 4.800 . 6.300 3.436 3.050 4.103 . 0 0 "[ . 1]" 1
814 1 161 LEU H 1 161 LEU QD 4.800 . 6.300 3.090 2.982 3.403 . 0 0 "[ . 1]" 1
815 1 161 LEU H 1 162 GLU H 4.000 . 5.500 4.049 3.749 4.244 . 0 0 "[ . 1]" 1
816 1 161 LEU H 1 198 SER H 5.000 . 6.450 5.364 4.677 6.449 . 0 0 "[ . 1]" 1
817 1 161 LEU H 1 198 SER HG 4.800 . 6.300 3.450 2.681 4.709 . 0 0 "[ . 1]" 1
818 1 161 LEU QD 1 162 GLU H 4.800 . 6.300 3.961 3.773 4.170 . 0 0 "[ . 1]" 1
819 1 161 LEU QD 1 164 GLY H 4.800 . 6.300 6.310 6.010 6.435 0.135 10 0 "[ . 1]" 1
820 1 161 LEU QD 1 165 LYS H 4.800 . 6.300 6.314 5.828 6.455 0.155 5 0 "[ . 1]" 1
821 1 161 LEU QD 1 168 ARG H 4.800 . 6.300 4.316 3.631 4.855 . 0 0 "[ . 1]" 1
822 1 161 LEU QD 1 198 SER H 4.800 . 6.300 4.138 3.287 5.084 . 0 0 "[ . 1]" 1
823 1 161 LEU QD 1 198 SER HG 4.800 . 6.300 3.672 2.227 4.981 . 0 0 "[ . 1]" 1
824 1 161 LEU QD 1 201 ILE MD 4.800 . 6.300 5.482 4.907 6.036 . 0 0 "[ . 1]" 1
825 1 162 GLU H 1 165 LYS H 5.000 . 6.500 5.007 4.760 5.217 . 0 0 "[ . 1]" 1
826 1 162 GLU H 1 166 ASN QD 4.800 . 6.300 5.406 4.653 5.801 . 0 0 "[ . 1]" 1
827 1 162 GLU H 1 168 ARG H 4.000 . 5.500 3.721 3.285 4.384 . 0 0 "[ . 1]" 1
828 1 164 GLY H 1 165 LYS H 3.600 . 5.100 2.593 2.414 2.725 . 0 0 "[ . 1]" 1
829 1 165 LYS H 1 166 ASN QD 4.800 . 6.300 6.349 5.282 6.675 0.375 6 0 "[ . 1]" 1
830 1 166 ASN H 1 166 ASN QD 4.800 . 6.300 3.365 2.591 3.801 . 0 0 "[ . 1]" 1
831 1 166 ASN QD 1 168 ARG H 4.800 . 6.300 4.378 3.069 5.076 . 0 0 "[ . 1]" 1
832 1 168 ARG H 1 169 ALA H 5.000 . 6.500 4.211 3.830 4.527 . 0 0 "[ . 1]" 1
833 1 168 ARG H 1 170 VAL QG 4.800 . 6.300 4.687 4.259 5.199 . 0 0 "[ . 1]" 1
834 1 169 ALA H 1 170 VAL QG 4.800 . 6.300 4.172 3.852 4.330 . 0 0 "[ . 1]" 1
835 1 170 VAL H 1 171 GLN H 5.000 . 6.500 4.352 4.111 4.593 . 0 0 "[ . 1]" 1
836 1 170 VAL QG 1 171 GLN H 4.800 . 6.300 2.884 2.541 3.547 . 0 0 "[ . 1]" 1
837 1 170 VAL QG 1 189 LEU QD 4.800 . 6.300 2.574 1.935 3.267 . 0 0 "[ . 1]" 1
838 1 171 GLN H 1 172 THR H 5.000 . 6.500 4.392 4.177 4.564 . 0 0 "[ . 1]" 1
839 1 171 GLN H 1 189 LEU QD 4.800 . 6.300 5.743 5.279 6.020 . 0 0 "[ . 1]" 1
840 1 172 THR H 1 172 THR HG1 4.800 . 6.300 3.397 2.087 4.906 . 0 0 "[ . 1]" 1
841 1 172 THR H 1 173 LYS H 5.000 . 6.500 4.291 4.144 4.466 . 0 0 "[ . 1]" 1
842 1 172 THR H 1 187 VAL QG 4.800 . 6.300 4.727 4.491 5.325 . 0 0 "[ . 1]" 1
843 1 172 THR H 1 189 LEU QD 4.800 . 6.300 5.204 4.444 5.639 . 0 0 "[ . 1]" 1
844 1 172 THR H 1 226 ILE MD 4.800 . 6.300 6.266 5.705 6.469 0.169 7 0 "[ . 1]" 1
845 1 172 THR HG1 1 173 LYS H 4.800 . 6.300 3.904 2.640 4.979 . 0 0 "[ . 1]" 1
846 1 173 LYS H 1 187 VAL QG 4.800 . 6.300 4.733 4.000 5.984 . 0 0 "[ . 1]" 1
847 1 173 LYS H 1 189 LEU QD 4.800 . 6.300 4.970 2.959 5.973 . 0 0 "[ . 1]" 1
848 1 175 GLY H 1 176 LEU QD 4.800 . 6.300 4.093 3.709 4.445 . 0 0 "[ . 1]" 1
849 1 175 GLY H 1 186 ALA H 4.000 . 4.050 3.586 2.703 3.899 . 0 0 "[ . 1]" 1
850 1 175 GLY H 1 187 VAL H 4.000 . 5.500 3.795 2.635 4.980 . 0 0 "[ . 1]" 1
851 1 175 GLY H 1 187 VAL QG 4.800 . 6.300 3.873 2.981 5.257 . 0 0 "[ . 1]" 1
852 1 175 GLY H 1 188 SER H 2.900 . 4.450 3.268 2.559 4.189 . 0 0 "[ . 1]" 1
853 1 175 GLY H 1 226 ILE MD 4.800 . 6.300 4.090 3.632 5.126 . 0 0 "[ . 1]" 1
854 1 176 LEU H 1 176 LEU QD 4.800 . 6.300 2.739 1.990 3.732 . 0 0 "[ . 1]" 1
855 1 176 LEU H 1 177 PHE H 5.000 . 6.500 4.376 4.232 4.494 . 0 0 "[ . 1]" 1
856 1 176 LEU H 1 186 ALA H 5.000 . 6.500 4.864 3.787 5.360 . 0 0 "[ . 1]" 1
857 1 176 LEU H 1 223 VAL QG 4.800 . 6.300 5.125 4.080 6.307 0.007 10 0 "[ . 1]" 1
858 1 176 LEU QD 1 177 PHE H 4.800 . 6.300 3.814 2.416 4.353 . 0 0 "[ . 1]" 1
859 1 176 LEU QD 1 178 LYS H 4.800 . 6.300 5.890 5.503 6.323 0.023 10 0 "[ . 1]" 1
860 1 176 LEU QD 1 183 THR H 4.800 . 6.300 5.451 4.600 6.508 0.208 8 0 "[ . 1]" 1
861 1 176 LEU QD 1 184 ILE H 4.800 . 6.300 4.228 3.883 4.749 . 0 0 "[ . 1]" 1
862 1 176 LEU QD 1 186 ALA H 4.800 . 6.300 3.914 2.842 4.717 . 0 0 "[ . 1]" 1
863 1 176 LEU QD 1 187 VAL H 4.800 . 6.300 5.645 3.724 6.525 0.225 7 0 "[ . 1]" 1
864 1 177 PHE H 1 178 LYS H 5.000 . 6.500 4.401 4.246 4.548 . 0 0 "[ . 1]" 1
865 1 177 PHE H 1 184 ILE H 3.600 . 4.050 3.022 2.620 3.453 . 0 0 "[ . 1]" 1
866 1 177 PHE H 1 184 ILE MD 4.800 . 6.300 4.554 3.779 5.428 . 0 0 "[ . 1]" 1
867 1 177 PHE H 1 186 ALA H 5.000 . 6.500 4.879 4.350 5.554 . 0 0 "[ . 1]" 1
868 1 178 LYS H 1 179 THR H 5.000 . 6.500 4.256 3.956 4.428 . 0 0 "[ . 1]" 1
869 1 178 LYS H 1 179 THR HG1 4.800 . 6.300 5.125 3.625 6.302 0.002 5 0 "[ . 1]" 1
870 1 178 LYS H 1 184 ILE H 5.000 . 6.500 5.051 4.749 5.179 . 0 0 "[ . 1]" 1
871 1 178 LYS H 1 184 ILE MD 4.800 . 6.300 5.757 5.103 6.339 0.039 3 0 "[ . 1]" 1
872 1 179 THR H 1 179 THR HG1 4.800 . 6.300 2.380 2.137 2.598 . 0 0 "[ . 1]" 1
873 1 179 THR H 1 181 ALA H 5.000 . 6.500 4.772 4.339 5.154 . 0 0 "[ . 1]" 1
874 1 179 THR H 1 182 GLY H 3.600 . 5.100 3.426 3.013 3.943 . 0 0 "[ . 1]" 1
875 1 179 THR H 1 183 THR H 5.000 . 6.500 4.518 3.669 5.011 . 0 0 "[ . 1]" 1
876 1 179 THR H 1 184 ILE H 5.000 . 6.500 4.068 3.502 4.625 . 0 0 "[ . 1]" 1
877 1 179 THR H 1 184 ILE MD 4.800 . 6.300 4.302 3.517 4.823 . 0 0 "[ . 1]" 1
878 1 179 THR HG1 1 181 ALA H 4.800 . 6.300 4.747 3.425 6.471 0.171 8 0 "[ . 1]" 1
879 1 179 THR HG1 1 182 GLY H 4.800 . 6.300 3.574 2.240 4.995 . 0 0 "[ . 1]" 1
880 1 179 THR HG1 1 183 THR H 4.800 . 6.300 5.434 4.176 6.293 . 0 0 "[ . 1]" 1
881 1 179 THR HG1 1 184 ILE H 4.800 . 6.300 4.056 2.434 5.370 . 0 0 "[ . 1]" 1
882 1 179 THR HG1 1 184 ILE MD 4.800 . 6.300 2.856 2.109 4.598 . 0 0 "[ . 1]" 1
883 1 181 ALA H 1 182 GLY H 2.900 . 4.450 2.465 1.835 2.659 . 0 0 "[ . 1]" 1
884 1 181 ALA H 1 184 ILE MD 4.800 . 6.300 5.547 4.601 6.392 0.092 8 0 "[ . 1]" 1
885 1 182 GLY H 1 183 THR H 5.000 . 6.500 4.119 3.012 4.419 . 0 0 "[ . 1]" 1
886 1 182 GLY H 1 184 ILE MD 4.800 . 6.300 4.628 3.635 5.391 . 0 0 "[ . 1]" 1
887 1 183 THR H 1 184 ILE H 5.000 . 6.500 4.317 3.994 4.555 . 0 0 "[ . 1]" 1
888 1 183 THR H 1 184 ILE MD 4.800 . 6.300 5.413 3.126 6.297 . 0 0 "[ . 1]" 1
889 1 184 ILE H 1 184 ILE MD 4.800 . 6.300 3.272 1.770 3.877 0.030 5 0 "[ . 1]" 1
890 1 184 ILE H 1 185 GLY H 5.000 . 6.500 4.523 4.457 4.584 . 0 0 "[ . 1]" 1
891 1 185 GLY H 1 186 ALA H 5.000 . 6.500 4.493 4.398 4.584 . 0 0 "[ . 1]" 1
892 1 185 GLY H 1 226 ILE H 5.000 . 6.500 5.472 4.493 6.443 . 0 0 "[ . 1]" 1
893 1 186 ALA H 1 187 VAL QG 4.800 . 6.300 4.608 2.934 5.344 . 0 0 "[ . 1]" 1
894 1 186 ALA H 1 188 SER H 5.000 . 6.500 5.764 4.902 6.636 0.136 2 0 "[ . 1]" 1
895 1 186 ALA H 1 223 VAL QG 4.800 . 6.300 5.661 4.565 6.221 . 0 0 "[ . 1]" 1
896 1 186 ALA H 1 226 ILE H 4.000 . 5.500 4.563 2.757 5.583 0.083 8 0 "[ . 1]" 1
897 1 186 ALA H 1 226 ILE MD . . 4.450 4.316 3.843 4.723 0.273 5 0 "[ . 1]" 1
898 1 187 VAL H 1 189 LEU H 5.000 . 6.500 6.118 5.640 6.594 0.094 8 0 "[ . 1]" 1
899 1 187 VAL H 1 223 VAL QG 4.800 . 6.300 4.149 3.253 5.109 . 0 0 "[ . 1]" 1
900 1 187 VAL H 1 224 SER H 4.000 . 4.250 3.653 3.169 4.414 0.164 8 0 "[ . 1]" 1
901 1 187 VAL H 1 225 ALA H 5.000 . 6.500 5.141 4.643 5.938 . 0 0 "[ . 1]" 1
902 1 187 VAL H 1 226 ILE H 5.000 . 6.500 4.585 3.379 5.838 . 0 0 "[ . 1]" 1
903 1 187 VAL H 1 226 ILE MD 4.800 . 6.300 4.183 3.185 4.641 . 0 0 "[ . 1]" 1
904 1 187 VAL QG 1 188 SER H 4.800 . 6.300 2.967 2.416 3.305 . 0 0 "[ . 1]" 1
905 1 187 VAL QG 1 189 LEU H 4.800 . 6.300 3.449 2.675 4.187 . 0 0 "[ . 1]" 1
906 1 187 VAL QG 1 189 LEU QD 4.800 . 6.300 2.737 1.898 3.511 . 0 0 "[ . 1]" 1
907 1 187 VAL QG 1 200 ILE MD 4.800 . 6.300 2.876 2.064 4.074 . 0 0 "[ . 1]" 1
908 1 187 VAL QG 1 212 GLY H 4.800 . 6.300 4.444 3.367 5.946 . 0 0 "[ . 1]" 1
909 1 187 VAL QG 1 213 ASN H 4.800 . 6.300 5.901 5.002 6.491 0.191 10 0 "[ . 1]" 1
910 1 187 VAL QG 1 223 VAL H 4.800 . 6.300 5.733 4.945 6.194 . 0 0 "[ . 1]" 1
911 1 187 VAL QG 1 224 SER H 4.800 . 6.300 3.020 2.805 3.663 . 0 0 "[ . 1]" 1
912 1 187 VAL QG 1 225 ALA H 4.800 . 6.300 4.581 3.891 5.226 . 0 0 "[ . 1]" 1
913 1 187 VAL QG 1 226 ILE H 4.800 . 6.300 4.079 2.928 4.642 . 0 0 "[ . 1]" 1
914 1 187 VAL QG 1 226 ILE MD 4.800 . 6.300 2.722 2.266 3.140 . 0 0 "[ . 1]" 1
915 1 187 VAL QG 1 227 ALA H 4.800 . 6.300 5.417 4.717 6.093 . 0 0 "[ . 1]" 1
916 1 188 SER H 1 223 VAL QG 4.800 . 6.300 4.017 3.638 4.771 . 0 0 "[ . 1]" 1
917 1 188 SER H 1 224 SER H 5.000 . 6.500 5.306 4.884 5.862 . 0 0 "[ . 1]" 1
918 1 189 LEU H 1 189 LEU QD 4.800 . 6.300 3.317 2.233 4.103 . 0 0 "[ . 1]" 1
919 1 189 LEU H 1 190 ASP H 5.000 . 6.500 4.300 4.065 4.436 . 0 0 "[ . 1]" 1
920 1 189 LEU H 1 222 TYR H 5.000 . 6.500 4.924 4.195 6.654 0.154 4 0 "[ . 1]" 1
921 1 189 LEU H 1 223 VAL H 5.000 . 6.500 4.985 4.613 5.475 . 0 0 "[ . 1]" 1
922 1 189 LEU H 1 223 VAL QG 4.800 . 6.300 2.713 1.778 3.803 0.022 4 0 "[ . 1]" 1
923 1 189 LEU H 1 224 SER H . . 4.450 4.521 4.265 4.784 0.334 7 0 "[ . 1]" 1
924 1 189 LEU QD 1 190 ASP H 4.800 . 6.300 2.956 1.845 3.736 . 0 0 "[ . 1]" 1
925 1 189 LEU QD 1 191 PHE H 4.800 . 6.300 3.546 2.547 4.457 . 0 0 "[ . 1]" 1
926 1 189 LEU QD 1 192 SER H 4.800 . 6.300 4.703 4.272 5.250 . 0 0 "[ . 1]" 1
927 1 189 LEU QD 1 222 TYR H 4.800 . 6.300 4.320 3.297 5.805 . 0 0 "[ . 1]" 1
928 1 190 ASP H 1 191 PHE H 5.000 . 6.500 4.246 3.908 4.663 . 0 0 "[ . 1]" 1
929 1 190 ASP H 1 222 TYR H 5.000 . 6.500 5.141 4.578 6.590 0.090 4 0 "[ . 1]" 1
930 1 191 PHE H 1 192 SER H 5.000 . 6.500 4.388 4.317 4.513 . 0 0 "[ . 1]" 1
931 1 191 PHE H 1 192 SER HG 4.800 . 6.300 5.985 4.890 6.362 0.062 7 0 "[ . 1]" 1
932 1 191 PHE H 1 216 VAL QG 4.800 . 6.300 5.415 4.529 6.073 . 0 0 "[ . 1]" 1
933 1 191 PHE H 1 223 VAL QG 4.800 . 6.300 5.912 4.548 6.440 0.140 2 0 "[ . 1]" 1
934 1 192 SER H 1 192 SER HG 4.800 . 6.300 2.365 1.867 2.713 . 0 0 "[ . 1]" 1
935 1 195 THR H 1 195 THR HG1 4.800 . 6.300 3.083 2.008 4.533 . 0 0 "[ . 1]" 1
936 1 195 THR H 1 196 SER H 5.000 . 6.500 4.567 4.286 4.693 . 0 0 "[ . 1]" 1
937 1 195 THR HG1 1 196 SER H 4.800 . 6.300 4.268 2.499 5.207 . 0 0 "[ . 1]" 1
938 1 196 SER H 1 197 GLY H 5.000 . 6.500 4.241 4.093 4.613 . 0 0 "[ . 1]" 1
939 1 197 GLY H 1 198 SER H 2.300 . 3.750 1.897 1.663 2.414 . 0 0 "[ . 1]" 1
940 1 197 GLY H 1 198 SER HG 4.800 . 6.300 4.602 3.489 6.236 . 0 0 "[ . 1]" 1
941 1 197 GLY H 1 210 LEU QD 4.800 . 6.300 3.872 2.491 4.946 . 0 0 "[ . 1]" 1
942 1 197 GLY H 1 211 TYR H . . 4.850 4.033 3.295 4.896 0.046 10 0 "[ . 1]" 1
943 1 198 SER H 1 198 SER HG 4.800 . 6.300 2.987 2.060 4.281 . 0 0 "[ . 1]" 1
944 1 198 SER H 1 210 LEU QD 4.800 . 6.300 4.089 3.569 4.713 . 0 0 "[ . 1]" 1
945 1 198 SER H 1 211 TYR H 5.000 . 6.500 3.956 3.408 4.931 . 0 0 "[ . 1]" 1
946 1 198 SER HG 1 210 LEU QD 4.800 . 6.300 5.432 5.026 6.192 . 0 0 "[ . 1]" 1
947 1 198 SER HG 1 211 TYR H 4.800 . 6.300 5.196 3.227 6.306 0.006 3 0 "[ . 1]" 1
948 1 200 ILE H 1 200 ILE MD 4.800 . 6.300 3.951 3.744 4.170 . 0 0 "[ . 1]" 1
949 1 200 ILE H 1 201 ILE H 5.000 . 6.500 4.318 4.219 4.460 . 0 0 "[ . 1]" 1
950 1 200 ILE H 1 207 VAL QG 4.800 . 6.300 3.863 2.888 4.699 . 0 0 "[ . 1]" 1
951 1 200 ILE H 1 208 VAL H 5.000 . 6.500 4.730 4.349 5.132 . 0 0 "[ . 1]" 1
952 1 200 ILE H 1 208 VAL QG 4.800 . 6.300 4.581 3.888 5.172 . 0 0 "[ . 1]" 1
953 1 200 ILE H 1 209 GLY H 3.600 . 5.100 3.449 3.045 3.851 . 0 0 "[ . 1]" 1
954 1 200 ILE H 1 210 LEU H 5.000 . 6.500 4.067 3.598 4.528 . 0 0 "[ . 1]" 1
955 1 200 ILE H 1 210 LEU QD 4.800 . 6.300 3.883 3.099 5.213 . 0 0 "[ . 1]" 1
956 1 200 ILE H 1 211 TYR H 5.000 . 6.500 3.795 2.907 4.754 . 0 0 "[ . 1]" 1
957 1 200 ILE MD 1 201 ILE H 4.800 . 6.300 5.197 4.946 5.379 . 0 0 "[ . 1]" 1
958 1 200 ILE MD 1 207 VAL QG 4.800 . 6.300 5.504 4.706 6.324 0.024 10 0 "[ . 1]" 1
959 1 200 ILE MD 1 208 VAL H 4.800 . 6.300 6.019 4.897 6.497 0.197 5 0 "[ . 1]" 1
960 1 200 ILE MD 1 209 GLY H 4.800 . 6.300 4.911 3.691 5.352 . 0 0 "[ . 1]" 1
961 1 200 ILE MD 1 210 LEU H 4.800 . 6.300 3.783 2.848 5.008 . 0 0 "[ . 1]" 1
962 1 200 ILE MD 1 212 GLY H 4.800 . 6.300 3.751 2.862 4.496 . 0 0 "[ . 1]" 1
963 1 200 ILE MD 1 226 ILE H 4.800 . 6.300 4.625 4.316 4.850 . 0 0 "[ . 1]" 1
964 1 200 ILE MD 1 226 ILE MD 4.800 . 6.300 2.990 2.218 3.648 . 0 0 "[ . 1]" 1
965 1 200 ILE MD 1 227 ALA H 4.800 . 6.300 3.150 2.355 3.645 . 0 0 "[ . 1]" 1
966 1 200 ILE MD 1 228 GLN H 4.800 . 6.300 5.984 5.375 6.362 0.062 2 0 "[ . 1]" 1
967 1 201 ILE H 1 201 ILE MD 4.800 . 6.300 3.937 3.781 4.155 . 0 0 "[ . 1]" 1
968 1 201 ILE H 1 202 ASP H 5.000 . 6.500 4.478 4.358 4.542 . 0 0 "[ . 1]" 1
969 1 201 ILE H 1 208 VAL H 5.000 . 6.500 4.560 4.365 5.140 . 0 0 "[ . 1]" 1
970 1 201 ILE H 1 208 VAL QG 4.800 . 6.300 4.226 3.721 5.872 . 0 0 "[ . 1]" 1
971 1 201 ILE H 1 209 GLY H 5.000 . 6.500 5.129 4.941 5.233 . 0 0 "[ . 1]" 1
972 1 201 ILE MD 1 202 ASP H 4.800 . 6.300 4.945 4.626 5.312 . 0 0 "[ . 1]" 1
973 1 201 ILE MD 1 205 GLY H 4.800 . 6.300 5.835 5.244 6.068 . 0 0 "[ . 1]" 1
974 1 201 ILE MD 1 206 LYS H 4.800 . 6.300 5.844 5.097 6.403 0.103 7 0 "[ . 1]" 1
975 1 201 ILE MD 1 207 VAL H 4.800 . 6.300 5.203 4.514 6.394 0.094 5 0 "[ . 1]" 1
976 1 201 ILE MD 1 208 VAL H 4.800 . 6.300 5.334 4.489 5.645 . 0 0 "[ . 1]" 1
977 1 201 ILE MD 1 208 VAL QG 4.800 . 6.300 4.940 2.466 5.596 . 0 0 "[ . 1]" 1
978 1 202 ASP H 1 203 LYS H 5.000 . 6.500 4.570 4.474 4.635 . 0 0 "[ . 1]" 1
979 1 202 ASP H 1 204 LYS H 5.000 . 6.500 4.827 4.581 5.109 . 0 0 "[ . 1]" 1
980 1 202 ASP H 1 205 GLY H 4.000 . 5.500 4.298 3.694 4.760 . 0 0 "[ . 1]" 1
981 1 202 ASP H 1 206 LYS H 3.600 . 4.050 3.711 3.047 4.114 0.064 7 0 "[ . 1]" 1
982 1 202 ASP H 1 207 VAL H 5.000 . 6.500 4.614 4.251 4.963 . 0 0 "[ . 1]" 1
983 1 202 ASP H 1 207 VAL QG 4.800 . 6.300 4.186 2.796 4.641 . 0 0 "[ . 1]" 1
984 1 202 ASP H 1 208 VAL H 5.000 . 6.500 3.755 3.075 4.569 . 0 0 "[ . 1]" 1
985 1 202 ASP H 1 208 VAL QG 4.800 . 6.300 3.031 2.189 5.139 . 0 0 "[ . 1]" 1
986 1 203 LYS H 1 204 LYS H 2.900 . 4.450 2.704 2.415 2.938 . 0 0 "[ . 1]" 1
987 1 203 LYS H 1 205 GLY H 5.000 . 6.500 4.306 3.957 4.524 . 0 0 "[ . 1]" 1
988 1 203 LYS H 1 206 LYS H 5.000 . 6.500 5.462 5.001 5.963 . 0 0 "[ . 1]" 1
989 1 204 LYS H 1 205 GLY H 2.900 . 4.450 2.633 2.512 2.792 . 0 0 "[ . 1]" 1
990 1 204 LYS H 1 206 LYS H 3.600 . 5.100 3.690 3.437 4.006 . 0 0 "[ . 1]" 1
991 1 205 GLY H 1 206 LYS H 2.900 . 4.450 2.424 2.163 2.564 . 0 0 "[ . 1]" 1
992 1 206 LYS H 1 207 VAL H 5.000 . 6.500 4.461 4.255 4.586 . 0 0 "[ . 1]" 1
993 1 206 LYS H 1 207 VAL QG 4.800 . 6.300 5.187 4.115 5.678 . 0 0 "[ . 1]" 1
994 1 206 LYS H 1 208 VAL QG 4.800 . 6.300 5.016 4.196 5.991 . 0 0 "[ . 1]" 1
995 1 207 VAL H 1 208 VAL H 5.000 . 6.500 4.533 3.960 4.677 . 0 0 "[ . 1]" 1
996 1 207 VAL H 1 208 VAL QG 4.800 . 6.300 4.412 2.854 5.238 . 0 0 "[ . 1]" 1
997 1 207 VAL H 1 209 GLY H 5.000 . 6.500 6.151 5.502 6.503 0.003 7 0 "[ . 1]" 1
998 1 207 VAL QG 1 208 VAL H 4.800 . 6.300 2.395 1.735 3.078 0.065 1 0 "[ . 1]" 1
999 1 207 VAL QG 1 208 VAL QG 4.800 . 6.300 3.508 3.059 3.717 . 0 0 "[ . 1]" 1
1000 1 207 VAL QG 1 209 GLY H 4.800 . 6.300 2.366 1.783 2.847 0.017 5 0 "[ . 1]" 1
1001 1 207 VAL QG 1 210 LEU H 4.800 . 6.300 5.154 4.725 5.912 . 0 0 "[ . 1]" 1
1002 1 207 VAL QG 1 229 THR H 4.800 . 6.300 5.252 4.084 6.014 . 0 0 "[ . 1]" 1
1003 1 208 VAL H 1 209 GLY H 2.300 . 3.750 2.111 1.522 2.631 . 0 0 "[ . 1]" 1
1004 1 208 VAL QG 1 209 GLY H 4.800 . 6.300 2.867 2.345 3.576 . 0 0 "[ . 1]" 1
1005 1 208 VAL QG 1 210 LEU H 4.800 . 6.300 4.730 4.103 5.997 . 0 0 "[ . 1]" 1
1006 1 208 VAL QG 1 229 THR H 4.800 . 6.300 4.579 3.933 5.101 . 0 0 "[ . 1]" 1
1007 1 209 GLY H 1 210 LEU H 5.000 . 6.500 4.229 3.954 4.570 . 0 0 "[ . 1]" 1
1008 1 210 LEU H 1 210 LEU QD 4.800 . 6.300 3.690 3.064 4.030 . 0 0 "[ . 1]" 1
1009 1 210 LEU H 1 211 TYR H 5.000 . 6.500 4.407 4.216 4.658 . 0 0 "[ . 1]" 1
1010 1 210 LEU H 1 227 ALA H 3.600 . 4.050 3.443 3.092 4.137 0.087 5 0 "[ . 1]" 1
1011 1 210 LEU H 1 228 GLN H 5.000 . 6.500 4.875 4.286 5.207 . 0 0 "[ . 1]" 1
1012 1 210 LEU QD 1 211 TYR H 4.800 . 6.300 2.992 1.951 3.447 . 0 0 "[ . 1]" 1
1013 1 210 LEU QD 1 227 ALA H 4.800 . 6.300 4.921 3.779 5.448 . 0 0 "[ . 1]" 1
1014 1 211 TYR H 1 212 GLY H 5.000 . 6.500 4.382 3.955 4.682 . 0 0 "[ . 1]" 1
1015 1 211 TYR H 1 227 ALA H 5.000 . 6.500 5.124 4.786 5.286 . 0 0 "[ . 1]" 1
1016 1 212 GLY H 1 213 ASN H 5.000 . 6.500 3.678 2.688 4.365 . 0 0 "[ . 1]" 1
1017 1 212 GLY H 1 225 ALA H . . 4.850 4.057 3.140 4.671 . 0 0 "[ . 1]" 1
1018 1 212 GLY H 1 226 ILE H 5.000 . 6.500 5.278 4.514 6.292 . 0 0 "[ . 1]" 1
1019 1 213 ASN H 1 214 GLY H 3.600 . 5.100 3.919 3.311 4.432 . 0 0 "[ . 1]" 1
1020 1 213 ASN H 1 224 SER H 5.000 . 6.500 6.289 5.218 6.747 0.247 7 0 "[ . 1]" 1
1021 1 214 GLY H 1 215 VAL H 3.600 . 5.100 3.971 2.827 4.493 . 0 0 "[ . 1]" 1
1022 1 214 GLY H 1 215 VAL QG 4.800 . 6.300 4.593 4.026 4.925 . 0 0 "[ . 1]" 1
1023 1 214 GLY H 1 224 SER H 5.000 . 6.500 6.347 4.417 6.661 0.161 5 0 "[ . 1]" 1
1024 1 214 GLY H 1 224 SER HG 4.800 . 6.300 4.259 2.612 5.396 . 0 0 "[ . 1]" 1
1025 1 214 GLY H 1 225 ALA H 5.000 . 6.500 4.405 3.098 4.940 . 0 0 "[ . 1]" 1
1026 1 215 VAL H 1 216 VAL QG 4.800 . 6.300 4.996 4.539 5.429 . 0 0 "[ . 1]" 1
1027 1 215 VAL H 1 223 VAL H 4.000 . 4.050 3.379 3.088 3.865 . 0 0 "[ . 1]" 1
1028 1 215 VAL H 1 223 VAL QG 4.800 . 6.300 3.879 2.523 4.551 . 0 0 "[ . 1]" 1
1029 1 215 VAL H 1 224 SER H 5.000 . 6.500 5.036 4.761 5.266 . 0 0 "[ . 1]" 1
1030 1 215 VAL H 1 225 ALA H 5.000 . 6.500 5.736 5.300 6.110 . 0 0 "[ . 1]" 1
1031 1 215 VAL QG 1 216 VAL H 4.800 . 6.300 2.280 1.883 2.959 . 0 0 "[ . 1]" 1
1032 1 215 VAL QG 1 217 THR H 4.800 . 6.300 3.762 3.059 4.444 . 0 0 "[ . 1]" 1
1033 1 215 VAL QG 1 223 VAL H 4.800 . 6.300 4.130 3.853 4.624 . 0 0 "[ . 1]" 1
1034 1 215 VAL QG 1 223 VAL QG 4.800 . 6.300 3.751 2.489 4.630 . 0 0 "[ . 1]" 1
1035 1 216 VAL H 1 223 VAL H 5.000 . 6.500 4.838 4.581 5.147 . 0 0 "[ . 1]" 1
1036 1 216 VAL QG 1 217 THR H 4.800 . 6.300 3.413 2.608 3.741 . 0 0 "[ . 1]" 1
1037 1 216 VAL QG 1 220 GLY H 4.800 . 6.300 3.806 2.432 4.689 . 0 0 "[ . 1]" 1
1038 1 216 VAL QG 1 221 ALA H 4.800 . 6.300 3.775 2.659 4.474 . 0 0 "[ . 1]" 1
1039 1 216 VAL QG 1 222 TYR H 4.800 . 6.300 3.738 3.061 4.636 . 0 0 "[ . 1]" 1
1040 1 216 VAL QG 1 223 VAL H 4.800 . 6.300 4.193 2.858 5.090 . 0 0 "[ . 1]" 1
1041 1 217 THR H 1 217 THR HG1 4.800 . 6.300 2.896 2.186 4.826 . 0 0 "[ . 1]" 1
1042 1 217 THR H 1 220 GLY H 5.000 . 6.500 4.132 3.744 4.484 . 0 0 "[ . 1]" 1
1043 1 217 THR H 1 221 ALA H . . 4.450 3.261 2.478 4.073 . 0 0 "[ . 1]" 1
1044 1 217 THR H 1 222 TYR H 5.000 . 6.500 4.724 4.382 5.216 . 0 0 "[ . 1]" 1
1045 1 217 THR H 1 223 VAL H 2.300 . 3.750 3.458 2.698 3.881 0.131 3 0 "[ . 1]" 1
1046 1 217 THR H 1 223 VAL QG 4.800 . 6.300 3.119 1.939 4.054 . 0 0 "[ . 1]" 1
1047 1 217 THR HG1 1 221 ALA H 4.800 . 6.300 5.814 5.260 6.459 0.159 3 0 "[ . 1]" 1
1048 1 219 SER H 1 220 GLY H 2.900 . 4.450 2.345 1.739 2.960 0.061 2 0 "[ . 1]" 1
1049 1 219 SER H 1 221 ALA H 5.000 . 6.500 3.475 2.445 4.802 . 0 0 "[ . 1]" 1
1050 1 220 GLY H 1 221 ALA H 2.300 . 3.750 1.928 1.678 2.173 . 0 0 "[ . 1]" 1
1051 1 221 ALA H 1 222 TYR H 5.000 . 6.500 4.305 3.879 4.616 . 0 0 "[ . 1]" 1
1052 1 221 ALA H 1 223 VAL QG 4.800 . 6.300 4.546 3.883 5.235 . 0 0 "[ . 1]" 1
1053 1 222 TYR H 1 223 VAL QG 4.800 . 6.300 4.112 3.705 4.521 . 0 0 "[ . 1]" 1
1054 1 223 VAL QG 1 224 SER H 4.800 . 6.300 2.973 2.374 3.405 . 0 0 "[ . 1]" 1
1055 1 223 VAL QG 1 225 ALA H 4.800 . 6.300 5.122 4.589 5.499 . 0 0 "[ . 1]" 1
1056 1 224 SER H 1 225 ALA H 5.000 . 6.500 4.406 4.321 4.540 . 0 0 "[ . 1]" 1
1057 1 225 ALA H 1 226 ILE H 5.000 . 6.500 4.556 4.414 4.638 . 0 0 "[ . 1]" 1
1058 1 226 ILE H 1 226 ILE MD 4.800 . 6.300 4.021 3.702 4.339 . 0 0 "[ . 1]" 1
1059 1 226 ILE H 1 227 ALA H 5.000 . 6.500 4.183 3.985 4.406 . 0 0 "[ . 1]" 1
1060 1 226 ILE MD 1 227 ALA H 4.800 . 6.300 5.439 5.145 5.616 . 0 0 "[ . 1]" 1
1061 1 227 ALA H 1 228 GLN H 5.000 . 6.500 4.397 4.057 4.632 . 0 0 "[ . 1]" 1
1062 1 228 GLN H 1 229 THR H 5.000 . 6.500 4.526 4.358 4.622 . 0 0 "[ . 1]" 1
1063 1 229 THR H 1 229 THR HG1 4.800 . 6.300 2.461 2.106 3.103 . 0 0 "[ . 1]" 1
1064 1 229 THR H 1 230 GLU H 5.000 . 6.500 4.415 4.254 4.524 . 0 0 "[ . 1]" 1
1065 1 229 THR H 1 231 LYS H 5.000 . 6.500 6.175 5.723 6.786 0.286 5 0 "[ . 1]" 1
1066 1 230 GLU H 1 231 LYS H 2.900 . 4.450 2.445 1.828 3.708 . 0 0 "[ . 1]" 1
1067 1 231 LYS H 1 232 SER H 4.000 . 5.500 3.714 2.822 4.587 . 0 0 "[ . 1]" 1
1068 1 231 LYS H 1 232 SER HG 4.800 . 6.300 5.762 5.026 6.414 0.114 4 0 "[ . 1]" 1
1069 1 233 ILE H 1 233 ILE MD 4.800 . 6.300 4.408 3.649 5.118 . 0 0 "[ . 1]" 1
1070 1 233 ILE H 1 234 GLU H 2.300 . 3.750 2.543 1.718 3.790 0.040 3 0 "[ . 1]" 1
1071 1 233 ILE MD 1 234 GLU H 4.800 . 6.300 4.782 3.921 5.347 . 0 0 "[ . 1]" 1
1072 1 233 ILE MD 1 235 ASP H 4.800 . 6.300 4.451 3.200 6.314 0.014 6 0 "[ . 1]" 1
1073 1 233 ILE MD 1 236 ASN H 4.800 . 6.300 4.730 2.626 6.514 0.214 4 0 "[ . 1]" 1
1074 1 235 ASP H 1 236 ASN H 2.900 . 4.450 2.427 1.851 2.845 . 0 0 "[ . 1]" 1
1075 1 238 GLU H 1 239 ILE H 2.900 . 4.450 3.031 2.016 4.401 . 0 0 "[ . 1]" 1
1076 1 239 ILE H 1 239 ILE MD 4.800 . 6.300 3.779 1.792 5.030 0.008 4 0 "[ . 1]" 1
1077 1 239 ILE H 1 240 GLU H 2.900 . 4.450 2.627 1.864 3.549 . 0 0 "[ . 1]" 1
1078 1 239 ILE MD 1 240 GLU H 4.800 . 6.300 4.502 3.902 5.411 . 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 145
_Distance_constraint_stats_list.Viol_count 254
_Distance_constraint_stats_list.Viol_total 516.464
_Distance_constraint_stats_list.Viol_max 2.139
_Distance_constraint_stats_list.Viol_rms 0.1453
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0356
_Distance_constraint_stats_list.Viol_average_violations_only 0.2033
_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 4 ALA 2.659 0.265 9 0 "[ . 1]"
1 5 ASP 1.014 0.367 6 0 "[ . 1]"
1 6 LEU 2.286 0.421 10 0 "[ . 1]"
1 7 GLU 1.231 0.382 6 0 "[ . 1]"
1 8 LEU 0.000 0.000 . 0 "[ . 1]"
1 9 GLU 1.323 1.246 1 1 "[+ . 1]"
1 10 ARG 0.899 0.514 1 1 "[+ . 1]"
1 11 ALA 0.660 0.180 1 0 "[ . 1]"
1 12 ALA 0.000 0.000 . 0 "[ . 1]"
1 13 ASP 0.129 0.091 5 0 "[ . 1]"
1 14 VAL 0.233 0.168 8 0 "[ . 1]"
1 15 LYS 0.000 0.000 . 0 "[ . 1]"
1 16 TRP 0.074 0.067 7 0 "[ . 1]"
1 21 GLU 0.001 0.001 5 0 "[ . 1]"
1 23 SER 0.000 0.000 . 0 "[ . 1]"
1 24 GLY 0.244 0.106 5 0 "[ . 1]"
1 25 SER 0.053 0.053 3 0 "[ . 1]"
1 28 ILE 0.501 0.501 8 1 "[ . + 1]"
1 29 LEU 1.706 0.391 10 0 "[ . 1]"
1 31 ILE 0.000 0.000 . 0 "[ . 1]"
1 32 THR 1.282 0.212 10 0 "[ . 1]"
1 34 SER 0.872 0.248 10 0 "[ . 1]"
1 39 MET 1.361 0.248 10 0 "[ . 1]"
1 40 SER 0.000 0.000 . 0 "[ . 1]"
1 41 ILE 1.849 0.391 10 0 "[ . 1]"
1 42 LYS 1.237 0.212 10 0 "[ . 1]"
1 51 GLY 0.077 0.077 10 0 "[ . 1]"
1 64 VAL 2.917 0.406 9 0 "[ . 1]"
1 65 LEU 1.356 0.313 1 0 "[ . 1]"
1 66 TRP 5.603 0.786 9 1 "[ . +1]"
1 67 ASP 1.031 0.230 5 0 "[ . 1]"
1 68 VAL 0.269 0.239 4 0 "[ . 1]"
1 78 GLU 0.316 0.239 4 0 "[ . 1]"
1 80 GLU 0.985 0.230 5 0 "[ . 1]"
1 84 TYR 2.145 1.246 1 1 "[+ . 1]"
1 88 GLN 1.115 0.209 8 0 "[ . 1]"
1 89 LYS 7.446 2.139 10 4 "[* - *+]"
1 94 TYR 6.336 2.139 10 4 "[* - *+]"
1 97 ILE 0.221 0.087 8 0 "[ . 1]"
1 99 ALA 0.000 0.000 . 0 "[ . 1]"
1 100 GLY 0.000 0.000 . 0 "[ . 1]"
1 107 PHE 0.000 0.000 . 0 "[ . 1]"
1 108 HIS 0.390 0.170 4 0 "[ . 1]"
1 109 THR 1.159 0.179 3 0 "[ . 1]"
1 110 MET 0.236 0.236 4 0 "[ . 1]"
1 111 TRP 0.340 0.100 8 0 "[ . 1]"
1 112 HIS 4.378 1.813 10 1 "[ . +]"
1 113 VAL 0.000 0.000 . 0 "[ . 1]"
1 115 ARG 0.000 0.000 . 0 "[ . 1]"
1 118 VAL 3.070 0.421 10 0 "[ . 1]"
1 119 LEU 2.363 0.382 6 0 "[ . 1]"
1 120 MET 0.165 0.164 3 0 "[ . 1]"
1 121 HIS 1.653 0.329 9 0 "[ . 1]"
1 122 LYS 8.222 0.786 9 1 "[ . +1]"
1 125 ARG 0.633 0.241 4 0 "[ . 1]"
1 126 ILE 0.000 0.000 . 0 "[ . 1]"
1 127 GLU 7.993 1.518 1 6 "[+ *.** *-]"
1 133 VAL 0.340 0.100 8 0 "[ . 1]"
1 136 ASP 0.000 0.000 . 0 "[ . 1]"
1 137 LEU 0.927 0.179 3 0 "[ . 1]"
1 138 ILE 0.011 0.011 4 0 "[ . 1]"
1 140 TYR 7.993 1.518 1 6 "[+ *.** *-]"
1 144 TRP 0.390 0.170 4 0 "[ . 1]"
1 150 TRP 0.218 0.180 9 0 "[ . 1]"
1 156 VAL 0.034 0.034 3 0 "[ . 1]"
1 158 VAL 0.000 0.000 . 0 "[ . 1]"
1 159 LEU 1.789 0.239 5 0 "[ . 1]"
1 161 LEU 0.100 0.059 3 0 "[ . 1]"
1 167 PRO 0.059 0.059 3 0 "[ . 1]"
1 170 VAL 0.001 0.001 5 0 "[ . 1]"
1 174 PRO 0.218 0.180 9 0 "[ . 1]"
1 176 LEU 1.199 0.501 8 1 "[ . + 1]"
1 186 ALA 0.699 0.254 5 0 "[ . 1]"
1 187 VAL 0.922 0.323 9 0 "[ . 1]"
1 189 LEU 0.297 0.106 5 0 "[ . 1]"
1 196 SER 4.378 1.813 10 1 "[ . +]"
1 198 SER 0.000 0.000 . 0 "[ . 1]"
1 200 ILE 0.034 0.034 3 0 "[ . 1]"
1 201 ILE 1.206 0.239 5 0 "[ . 1]"
1 202 ASP 0.007 0.007 10 0 "[ . 1]"
1 205 GLY 0.000 0.000 . 0 "[ . 1]"
1 210 LEU 0.236 0.236 4 0 "[ . 1]"
1 215 VAL 0.687 0.201 7 0 "[ . 1]"
1 216 VAL 0.291 0.129 6 0 "[ . 1]"
1 217 THR 0.010 0.010 8 0 "[ . 1]"
1 220 GLY 0.060 0.060 10 0 "[ . 1]"
1 221 ALA 0.231 0.129 6 0 "[ . 1]"
1 223 VAL 0.006 0.006 8 0 "[ . 1]"
1 226 ILE 0.917 0.323 9 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 1 215 VAL MG1 1 216 VAL H 7.000 . 7.700 3.263 2.330 3.702 . 0 0 "[ . 1]" 2
2 1 215 VAL MG2 1 216 VAL H 7.000 . 7.700 2.692 1.893 4.169 . 0 0 "[ . 1]" 2
3 1 109 THR HG1 1 113 VAL MG1 6.090 . 6.700 3.158 2.241 4.431 . 0 0 "[ . 1]" 2
4 1 109 THR HG1 1 113 VAL MG2 6.090 . 6.700 3.056 2.385 4.680 . 0 0 "[ . 1]" 2
5 1 161 LEU MD1 1 198 SER HG 6.480 . 7.130 3.869 2.234 5.363 . 0 0 "[ . 1]" 2
6 1 161 LEU MD2 1 198 SER HG 6.480 . 7.130 4.892 4.009 6.102 . 0 0 "[ . 1]" 2
7 1 97 ILE MD 1 109 THR HG1 6.320 . 6.950 6.646 5.646 7.037 0.087 8 0 "[ . 1]" 2
8 1 109 THR HG1 1 137 LEU MD1 7.000 . 7.700 7.765 7.424 7.879 0.179 3 0 "[ . 1]" 2
9 1 109 THR HG1 1 137 LEU MD2 7.000 . 7.700 5.396 5.124 5.696 . 0 0 "[ . 1]" 2
10 1 109 THR HG1 1 138 ILE MD 5.810 . 7.368 5.758 4.014 7.379 0.011 4 0 "[ . 1]" 2
11 1 23 SER HG 1 189 LEU QD 5.760 . 7.318 3.657 2.849 4.116 . 0 0 "[ . 1]" 2
12 1 25 SER HG 1 189 LEU QD 5.760 . 7.318 6.034 5.172 7.371 0.053 3 0 "[ . 1]" 2
13 1 112 HIS NE2 1 196 SER OG 3.200 . 3.650 4.008 2.850 5.463 1.813 10 1 "[ . +]" 2
14 1 112 HIS ND1 1 136 ASP OD2 3.200 . 3.650 3.104 2.795 3.453 . 0 0 "[ . 1]" 2
15 1 4 ALA H 1 89 LYS H 6.000 . 6.450 6.459 5.916 6.715 0.265 9 0 "[ . 1]" 2
16 1 4 ALA H 1 88 GLN HE21 4.600 . 5.050 4.400 3.636 5.111 0.061 5 0 "[ . 1]" 2
17 1 4 ALA H 1 88 GLN HE22 4.600 . 5.050 4.677 3.548 5.199 0.149 8 0 "[ . 1]" 2
18 1 5 ASP H 1 88 GLN HE21 5.400 . 5.850 3.800 3.031 5.821 . 0 0 "[ . 1]" 2
19 1 4 ALA H 1 118 VAL MG1 5.200 . 5.650 5.057 4.208 5.876 0.226 7 0 "[ . 1]" 2
20 1 5 ASP H 1 118 VAL MG2 5.800 . 6.250 5.417 3.720 6.186 . 0 0 "[ . 1]" 2
21 1 5 ASP H 1 119 LEU MD2 5.400 . 5.850 5.880 5.471 6.217 0.367 6 0 "[ . 1]" 2
22 1 6 LEU H 1 119 LEU MD2 4.600 . 5.050 4.246 3.781 4.761 . 0 0 "[ . 1]" 2
23 1 6 LEU H 1 119 LEU MD1 6.000 . 6.450 4.655 3.995 5.826 . 0 0 "[ . 1]" 2
24 1 6 LEU H 1 118 VAL MG2 5.200 . 5.650 5.127 3.227 6.071 0.421 10 0 "[ . 1]" 2
25 1 6 LEU H 1 120 MET HG3 4.800 . 5.250 4.027 2.322 5.251 0.001 7 0 "[ . 1]" 2
26 1 7 GLU H 1 119 LEU MD2 5.400 . 5.850 5.344 4.628 6.013 0.163 1 0 "[ . 1]" 2
27 1 7 GLU H 1 119 LEU MD1 6.000 . 6.450 5.052 3.026 6.832 0.382 6 0 "[ . 1]" 2
28 1 7 GLU H 1 120 MET HG2 6.000 . 6.450 5.071 3.796 6.614 0.164 3 0 "[ . 1]" 2
29 1 11 ALA H 1 161 LEU MD1 4.400 . 4.850 4.299 3.608 4.891 0.041 6 0 "[ . 1]" 2
30 1 12 ALA H 1 161 LEU MD1 4.800 . 5.250 4.332 3.751 4.963 . 0 0 "[ . 1]" 2
31 1 15 LYS H 1 159 LEU MD1 3.600 . 4.050 2.832 1.879 3.627 . 0 0 "[ . 1]" 2
32 1 16 TRP H 1 159 LEU MD2 5.000 . 5.450 5.008 4.467 5.517 0.067 7 0 "[ . 1]" 2
33 1 21 GLU H 1 170 VAL MG2 4.200 . 4.650 3.807 3.091 4.651 0.001 5 0 "[ . 1]" 2
34 1 111 TRP HE1 1 133 VAL MG1 4.400 . 4.850 4.627 4.009 4.950 0.100 8 0 "[ . 1]" 2
35 1 111 TRP HE1 1 133 VAL MG2 4.400 . 4.850 3.183 2.464 4.920 0.070 6 0 "[ . 1]" 2
36 1 216 VAL MG1 1 220 GLY H 4.800 . 5.250 4.706 3.523 5.310 0.060 10 0 "[ . 1]" 2
37 1 5 ASP H 1 88 GLN HE22 5.400 . 5.850 4.376 2.654 5.867 0.017 4 0 "[ . 1]" 2
38 1 4 ALA H 1 118 VAL MG2 6.000 . 6.450 5.718 4.476 6.714 0.264 2 0 "[ . 1]" 2
39 1 6 LEU H 1 120 MET HG2 4.800 . 5.250 3.145 2.221 4.118 . 0 0 "[ . 1]" 2
40 1 7 GLU H 1 120 MET HG3 6.000 . 6.450 5.025 3.629 6.322 . 0 0 "[ . 1]" 2
41 1 11 ALA H 1 159 LEU MD1 6.500 . 6.950 6.916 6.626 7.130 0.180 1 0 "[ . 1]" 2
42 1 11 ALA H 1 161 LEU MD2 4.600 . 5.050 4.578 4.341 4.746 . 0 0 "[ . 1]" 2
43 1 12 ALA H 1 161 LEU MD2 5.000 . 5.450 3.819 3.627 4.048 . 0 0 "[ . 1]" 2
44 1 13 ASP H 1 159 LEU MD1 4.000 . 4.450 4.287 3.919 4.541 0.091 5 0 "[ . 1]" 2
45 1 13 ASP H 1 161 LEU MD2 5.600 . 6.050 5.212 4.457 5.553 . 0 0 "[ . 1]" 2
46 1 6 LEU H 1 118 VAL MG1 5.000 . 5.450 4.617 3.561 5.620 0.170 8 0 "[ . 1]" 2
47 1 21 GLU H 1 170 VAL MG1 4.000 . 4.450 3.865 2.719 4.386 . 0 0 "[ . 1]" 2
48 1 24 GLY H 1 189 LEU MD2 4.000 . 4.450 3.567 1.999 4.556 0.106 5 0 "[ . 1]" 2
49 1 32 THR H 1 215 VAL MG1 5.000 . 5.450 4.671 4.086 5.495 0.045 1 0 "[ . 1]" 2
50 1 40 SER H 1 215 VAL MG1 4.600 . 5.050 4.124 3.771 4.503 . 0 0 "[ . 1]" 2
51 1 6 LEU MD2 1 88 GLN H 4.000 . 4.450 4.283 3.539 4.604 0.154 3 0 "[ . 1]" 2
52 1 109 THR H 1 210 LEU MD1 4.600 . 5.050 4.227 3.665 4.725 . 0 0 "[ . 1]" 2
53 1 176 LEU MD2 1 186 ALA H 4.200 . 4.650 4.440 2.850 4.904 0.254 5 0 "[ . 1]" 2
54 1 29 LEU MD2 1 217 THR H 5.800 . 6.250 5.315 4.576 6.260 0.010 8 0 "[ . 1]" 2
55 1 216 VAL MG1 1 221 ALA H 4.400 . 4.850 4.452 2.918 4.979 0.129 6 0 "[ . 1]" 2
56 1 5 ASP H 1 118 VAL MG1 6.800 . 7.250 4.710 3.469 5.614 . 0 0 "[ . 1]" 2
57 1 99 ALA H 1 113 VAL MG1 3.600 . 4.050 2.795 1.999 4.024 . 0 0 "[ . 1]" 2
58 1 109 THR H 1 137 LEU MD2 4.800 . 5.250 4.324 3.757 4.712 . 0 0 "[ . 1]" 2
59 1 6 LEU MD2 1 119 LEU MD1 4.200 . 4.650 4.195 3.231 4.829 0.179 6 0 "[ . 1]" 2
60 1 8 LEU MD2 1 126 ILE MD 4.400 . 4.850 3.328 1.951 4.253 . 0 0 "[ . 1]" 2
61 1 28 ILE MD 1 176 LEU MD2 3.600 . 4.050 3.363 2.429 4.551 0.501 8 1 "[ . + 1]" 2
62 1 29 LEU MD2 1 41 ILE MD 3.600 . 4.050 4.087 3.192 4.441 0.391 10 0 "[ . 1]" 2
63 1 41 ILE MD 1 215 VAL MG1 3.600 . 4.050 2.986 1.902 4.170 0.120 1 0 "[ . 1]" 2
64 1 6 LEU MD1 1 119 LEU MD2 3.600 . 4.050 2.669 1.820 3.520 . 0 0 "[ . 1]" 2
65 1 110 MET ME 1 137 LEU MD1 4.600 . 5.050 3.685 2.563 4.480 . 0 0 "[ . 1]" 2
66 1 8 LEU MD1 1 126 ILE MD 3.600 . 4.050 2.432 2.008 4.042 . 0 0 "[ . 1]" 2
67 1 158 VAL MG2 1 187 VAL MG1 4.400 . 4.850 3.218 2.605 3.920 . 0 0 "[ . 1]" 2
68 1 187 VAL MG2 1 226 ILE MD 3.800 . 4.250 3.255 2.275 4.424 0.174 8 0 "[ . 1]" 2
69 1 6 LEU MD2 1 119 LEU MD2 4.600 . 5.050 3.478 2.523 4.635 . 0 0 "[ . 1]" 2
70 1 187 VAL MG1 1 223 VAL MG1 4.400 . 4.850 4.385 3.727 4.856 0.006 8 0 "[ . 1]" 2
71 1 110 MET ME 1 137 LEU MD2 3.600 . 4.050 2.515 2.043 3.803 . 0 0 "[ . 1]" 2
72 1 84 TYR H 1 161 LEU MD1 5.200 . 5.650 3.829 2.653 5.236 . 0 0 "[ . 1]" 2
73 1 110 MET ME 1 210 LEU MD1 3.600 . 4.050 3.455 2.305 4.286 0.236 4 0 "[ . 1]" 2
74 1 39 MET ME 1 215 VAL MG1 3.800 . 4.250 4.034 3.158 4.451 0.201 7 0 "[ . 1]" 2
75 1 31 ILE MD 1 215 VAL MG1 4.000 . 4.450 2.508 1.899 3.841 . 0 0 "[ . 1]" 2
76 1 31 ILE MD 1 215 VAL MG2 4.800 . 5.250 3.427 1.965 4.602 . 0 0 "[ . 1]" 2
77 1 187 VAL MG1 1 226 ILE MD 3.600 . 4.050 3.462 2.791 4.373 0.323 9 0 "[ . 1]" 2
78 1 6 LEU MD1 1 119 LEU MD1 5.200 . 5.650 3.655 2.430 5.121 . 0 0 "[ . 1]" 2
79 1 6 LEU MD2 1 88 GLN QE 4.600 . 5.050 3.635 1.870 5.259 0.209 8 0 "[ . 1]" 2
80 1 6 LEU CD2 1 88 GLN CB 4.440 . 4.890 4.456 3.725 5.011 0.121 10 0 "[ . 1]" 2
81 1 6 LEU CD2 1 88 GLN CG 4.450 . 4.900 4.227 3.677 4.940 0.040 1 0 "[ . 1]" 2
82 1 9 GLU CD 1 51 GLY CA 4.460 . 4.910 4.296 3.758 4.987 0.077 10 0 "[ . 1]" 2
83 1 9 GLU C 1 84 TYR CD2 4.350 . 4.800 3.873 3.372 6.046 1.246 1 1 "[+ . 1]" 2
84 1 10 ARG CA 1 84 TYR CD2 4.390 . 4.840 3.906 3.547 5.354 0.514 1 1 "[+ . 1]" 2
85 1 10 ARG CB 1 84 TYR CE2 4.490 . 4.940 4.178 3.778 5.325 0.385 1 0 "[ . 1]" 2
86 1 14 VAL CG1 1 201 ILE CD1 4.170 . 4.620 4.172 3.717 4.788 0.168 8 0 "[ . 1]" 2
87 1 16 TRP CE3 1 202 ASP C 6.000 . 6.450 5.755 4.674 6.457 0.007 10 0 "[ . 1]" 2
88 1 32 THR CG2 1 42 LYS CB 4.440 . 4.890 4.781 4.187 5.102 0.212 10 0 "[ . 1]" 2
89 1 32 THR CG2 1 42 LYS CG 4.470 . 4.920 4.337 3.601 4.847 . 0 0 "[ . 1]" 2
90 1 32 THR CG2 1 42 LYS CD 4.380 . 4.830 4.452 3.782 4.993 0.163 6 0 "[ . 1]" 2
91 1 34 SER CB 1 39 MET CA 5.000 . 5.450 5.056 4.003 5.628 0.178 9 0 "[ . 1]" 2
92 1 34 SER CB 1 39 MET CB 6.000 . 6.450 6.290 5.333 6.698 0.248 10 0 "[ . 1]" 2
93 1 64 VAL CA 1 122 LYS CD 4.410 . 4.860 4.303 3.914 4.708 . 0 0 "[ . 1]" 2
94 1 64 VAL CA 1 122 LYS CE 6.000 . 6.450 5.033 4.395 5.480 . 0 0 "[ . 1]" 2
95 1 64 VAL CB 1 122 LYS CG 4.320 . 4.770 4.399 3.568 5.176 0.406 9 0 "[ . 1]" 2
96 1 64 VAL CB 1 122 LYS CD 4.380 . 4.830 4.530 3.677 5.014 0.184 3 0 "[ . 1]" 2
97 1 64 VAL CB 1 122 LYS CE 6.000 . 6.450 5.396 4.251 6.147 . 0 0 "[ . 1]" 2
98 1 64 VAL CG2 1 122 LYS CA 4.220 . 4.670 4.445 3.823 4.941 0.271 5 0 "[ . 1]" 2
99 1 64 VAL CG2 1 122 LYS CG 4.100 . 4.550 4.198 3.387 4.924 0.374 6 0 "[ . 1]" 2
100 1 64 VAL C 1 122 LYS CG 4.380 . 4.830 4.147 3.590 4.751 . 0 0 "[ . 1]" 2
101 1 64 VAL C 1 122 LYS CD 3.780 . 4.230 3.738 3.406 4.269 0.039 1 0 "[ . 1]" 2
102 1 64 VAL C 1 122 LYS CE 3.980 . 4.430 4.333 4.010 4.581 0.151 7 0 "[ . 1]" 2
103 1 65 LEU CA 1 122 LYS CD 4.020 . 4.470 4.070 3.519 4.783 0.313 1 0 "[ . 1]" 2
104 1 65 LEU CA 1 122 LYS CE 4.320 . 4.770 4.361 3.740 4.850 0.080 8 0 "[ . 1]" 2
105 1 65 LEU C 1 122 LYS CD 4.150 . 4.600 4.225 3.529 4.779 0.179 2 0 "[ . 1]" 2
106 1 65 LEU C 1 122 LYS CE 4.240 . 4.690 4.438 3.904 4.847 0.157 2 0 "[ . 1]" 2
107 1 66 TRP CB 1 121 HIS CE1 3.980 . 4.430 4.313 3.602 4.746 0.316 4 0 "[ . 1]" 2
108 1 66 TRP CG 1 121 HIS CE1 4.250 . 4.700 4.336 3.912 4.828 0.128 10 0 "[ . 1]" 2
109 1 66 TRP CG 1 122 LYS CD 4.270 . 4.720 4.232 3.632 4.844 0.124 2 0 "[ . 1]" 2
110 1 66 TRP CG 1 122 LYS CE 4.100 . 4.550 4.350 3.803 4.927 0.377 3 0 "[ . 1]" 2
111 1 66 TRP CD1 1 121 HIS CD2 4.180 . 4.630 4.142 3.279 4.799 0.169 9 0 "[ . 1]" 2
112 1 66 TRP CD1 1 121 HIS CE1 4.100 . 4.550 3.934 3.348 4.879 0.329 9 0 "[ . 1]" 2
113 1 66 TRP CD1 1 122 LYS CG 4.100 . 4.550 3.988 3.347 4.541 . 0 0 "[ . 1]" 2
114 1 66 TRP CD1 1 122 LYS CD 3.790 . 4.240 3.658 3.186 4.086 . 0 0 "[ . 1]" 2
115 1 66 TRP CD1 1 122 LYS CE 3.780 . 4.230 3.972 3.263 4.519 0.289 3 0 "[ . 1]" 2
116 1 66 TRP CD2 1 122 LYS CE 4.340 . 4.790 4.606 3.768 5.142 0.352 2 0 "[ . 1]" 2
117 1 66 TRP CE2 1 122 LYS CE 4.070 . 4.520 4.392 3.696 5.306 0.786 9 1 "[ . +1]" 2
118 1 67 ASP CA 1 80 GLU CB 6.000 . 6.450 5.000 3.503 6.491 0.041 8 0 "[ . 1]" 2
119 1 67 ASP CA 1 80 GLU CG 6.000 . 6.450 5.159 4.147 5.907 . 0 0 "[ . 1]" 2
120 1 67 ASP CA 1 80 GLU CD 6.000 . 6.450 5.525 4.716 6.520 0.070 10 0 "[ . 1]" 2
121 1 67 ASP CB 1 80 GLU CA 6.000 . 6.450 5.035 4.057 6.680 0.230 5 0 "[ . 1]" 2
122 1 67 ASP CB 1 80 GLU CB 6.000 . 6.450 4.799 3.940 5.968 . 0 0 "[ . 1]" 2
123 1 67 ASP CB 1 80 GLU CG 6.000 . 6.450 5.091 3.756 6.152 . 0 0 "[ . 1]" 2
124 1 67 ASP CG 1 80 GLU CA 6.000 . 6.450 5.100 4.070 5.894 . 0 0 "[ . 1]" 2
125 1 67 ASP CG 1 80 GLU CB 6.000 . 6.450 4.895 4.116 5.974 . 0 0 "[ . 1]" 2
126 1 67 ASP CG 1 80 GLU CG 6.000 . 6.450 5.256 3.959 6.579 0.129 9 0 "[ . 1]" 2
127 1 67 ASP CG 1 80 GLU C 6.000 . 6.450 6.009 4.292 6.613 0.163 8 0 "[ . 1]" 2
128 1 67 ASP C 1 78 GLU CD 6.000 . 6.450 5.844 4.376 6.496 0.046 6 0 "[ . 1]" 2
129 1 67 ASP C 1 80 GLU CB 6.000 . 6.450 5.208 4.082 6.577 0.127 6 0 "[ . 1]" 2
130 1 67 ASP C 1 80 GLU CD 6.000 . 6.450 5.683 5.180 6.416 . 0 0 "[ . 1]" 2
131 1 68 VAL CA 1 78 GLU CD 6.000 . 6.450 5.348 4.436 6.481 0.031 10 0 "[ . 1]" 2
132 1 68 VAL CB 1 78 GLU CD 6.000 . 6.450 5.489 4.413 6.689 0.239 4 0 "[ . 1]" 2
133 1 89 LYS CB 1 94 TYR CE1 4.360 . 4.810 5.367 4.404 6.949 2.139 10 4 "[* - *+]" 2
134 1 100 GLY CA 1 107 PHE QE 4.420 . 4.870 3.810 3.060 4.715 . 0 0 "[ . 1]" 2
135 1 108 HIS CD2 1 144 TRP CE3 4.490 . 4.940 4.586 3.553 5.110 0.170 4 0 "[ . 1]" 2
136 1 111 TRP CH2 1 115 ARG C 4.450 . 4.900 4.363 3.730 4.726 . 0 0 "[ . 1]" 2
137 1 118 VAL CG1 1 125 ARG CG 4.120 . 4.570 4.395 3.527 4.811 0.241 4 0 "[ . 1]" 2
138 1 127 GLU C 1 140 TYR CD2 4.210 . 4.660 5.115 3.461 6.178 1.518 1 6 "[+ *.** *-]" 2
139 1 150 TRP CZ2 1 174 PRO CB 4.450 . 4.900 4.354 3.618 5.080 0.180 9 0 "[ . 1]" 2
140 1 156 VAL CG2 1 200 ILE CG2 4.460 . 4.910 4.007 3.462 4.944 0.034 3 0 "[ . 1]" 2
141 1 159 LEU CD1 1 201 ILE CD1 4.130 . 4.580 4.492 4.026 4.819 0.239 5 0 "[ . 1]" 2
142 1 161 LEU CD2 1 167 PRO CB 4.340 . 4.790 4.102 3.678 4.849 0.059 3 0 "[ . 1]" 2
143 1 200 ILE CD1 1 226 ILE CG2 4.450 . 4.900 3.832 3.523 4.059 . 0 0 "[ . 1]" 2
144 1 201 ILE CG2 1 205 GLY CA 4.180 . 4.630 4.074 3.821 4.533 . 0 0 "[ . 1]" 2
145 1 201 ILE CG2 1 205 GLY C 4.240 . 4.690 3.779 3.550 4.163 . 0 0 "[ . 1]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 128
_Distance_constraint_stats_list.Viol_count 663
_Distance_constraint_stats_list.Viol_total 481.289
_Distance_constraint_stats_list.Viol_max 0.406
_Distance_constraint_stats_list.Viol_rms 0.0531
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0376
_Distance_constraint_stats_list.Viol_average_violations_only 0.0726
_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 5 ASP 0.630 0.110 4 0 "[ . 1]"
1 6 LEU 0.125 0.057 3 0 "[ . 1]"
1 7 GLU 1.902 0.152 2 0 "[ . 1]"
1 8 LEU 1.598 0.167 7 0 "[ . 1]"
1 9 GLU 0.831 0.113 4 0 "[ . 1]"
1 11 ALA 1.018 0.169 10 0 "[ . 1]"
1 12 ALA 1.287 0.119 6 0 "[ . 1]"
1 32 THR 1.694 0.171 2 0 "[ . 1]"
1 34 SER 1.886 0.270 4 0 "[ . 1]"
1 38 SER 1.886 0.270 4 0 "[ . 1]"
1 40 SER 1.694 0.171 2 0 "[ . 1]"
1 82 GLY 1.717 0.159 1 0 "[ . 1]"
1 83 ALA 2.305 0.169 10 0 "[ . 1]"
1 84 TYR 0.870 0.133 10 0 "[ . 1]"
1 85 ARG 0.831 0.113 4 0 "[ . 1]"
1 86 ILE 3.604 0.160 8 0 "[ . 1]"
1 87 LYS 1.902 0.152 2 0 "[ . 1]"
1 88 GLN 0.966 0.143 6 0 "[ . 1]"
1 89 LYS 0.630 0.110 4 0 "[ . 1]"
1 90 GLY 2.475 0.207 10 0 "[ . 1]"
1 93 GLY 2.475 0.207 10 0 "[ . 1]"
1 95 SER 0.966 0.143 6 0 "[ . 1]"
1 97 ILE 1.844 0.160 8 0 "[ . 1]"
1 98 GLY 1.760 0.123 4 0 "[ . 1]"
1 99 ALA 0.833 0.137 4 0 "[ . 1]"
1 100 GLY 0.870 0.133 10 0 "[ . 1]"
1 102 TYR 1.717 0.159 1 0 "[ . 1]"
1 103 LYS 1.603 0.171 5 0 "[ . 1]"
1 106 THR 1.603 0.171 5 0 "[ . 1]"
1 107 PHE 1.259 0.149 10 0 "[ . 1]"
1 109 THR 1.106 0.109 7 0 "[ . 1]"
1 119 LEU 1.055 0.131 4 0 "[ . 1]"
1 120 MET 1.723 0.167 7 0 "[ . 1]"
1 121 HIS 1.698 0.149 9 0 "[ . 1]"
1 124 LYS 1.698 0.149 9 0 "[ . 1]"
1 126 ILE 1.055 0.131 4 0 "[ . 1]"
1 130 TRP 0.808 0.107 4 0 "[ . 1]"
1 132 ASP 0.476 0.104 4 0 "[ . 1]"
1 137 LEU 0.476 0.104 4 0 "[ . 1]"
1 138 ILE 1.106 0.109 7 0 "[ . 1]"
1 139 SER 0.808 0.107 4 0 "[ . 1]"
1 140 TYR 1.259 0.149 10 0 "[ . 1]"
1 156 VAL 0.739 0.135 5 0 "[ . 1]"
1 157 GLN 1.286 0.193 5 0 "[ . 1]"
1 158 VAL 0.969 0.108 10 0 "[ . 1]"
1 160 ALA 1.071 0.114 9 0 "[ . 1]"
1 168 ARG 1.071 0.114 9 0 "[ . 1]"
1 170 VAL 0.969 0.108 10 0 "[ . 1]"
1 172 THR 0.739 0.135 5 0 "[ . 1]"
1 175 GLY 3.797 0.406 3 0 "[ . 1]"
1 177 PHE 1.746 0.327 8 0 "[ . 1]"
1 179 THR 0.870 0.132 2 0 "[ . 1]"
1 182 GLY 0.870 0.132 2 0 "[ . 1]"
1 184 ILE 1.746 0.327 8 0 "[ . 1]"
1 186 ALA 3.797 0.406 3 0 "[ . 1]"
1 195 THR 1.084 0.165 7 0 "[ . 1]"
1 196 SER 0.833 0.137 4 0 "[ . 1]"
1 198 SER 1.573 0.165 7 0 "[ . 1]"
1 200 ILE 2.464 0.251 1 0 "[ . 1]"
1 201 ILE 1.286 0.193 5 0 "[ . 1]"
1 202 ASP 0.107 0.061 4 0 "[ . 1]"
1 206 LYS 0.107 0.061 4 0 "[ . 1]"
1 208 VAL 0.837 0.251 1 0 "[ . 1]"
1 209 GLY 1.627 0.169 5 0 "[ . 1]"
1 210 LEU 2.014 0.137 2 0 "[ . 1]"
1 211 TYR 0.489 0.147 5 0 "[ . 1]"
1 215 VAL 1.673 0.159 10 0 "[ . 1]"
1 217 THR 0.379 0.126 2 0 "[ . 1]"
1 221 ALA 0.379 0.126 2 0 "[ . 1]"
1 223 VAL 1.673 0.159 10 0 "[ . 1]"
1 227 ALA 2.014 0.137 2 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 6 LEU O 1 120 MET H 1.900 . 2.000 1.981 1.891 2.057 0.057 3 0 "[ . 1]" 3
2 1 6 LEU O 1 120 MET N 2.850 . 3.000 2.739 2.557 2.963 . 0 0 "[ . 1]" 3
3 1 8 LEU H 1 120 MET O 1.900 . 2.000 2.115 2.012 2.167 0.167 7 0 "[ . 1]" 3
4 1 8 LEU N 1 120 MET O 2.850 . 3.000 3.018 2.876 3.126 0.126 7 0 "[ . 1]" 3
5 1 32 THR O 1 40 SER H 1.900 . 2.000 2.049 1.995 2.096 0.096 6 0 "[ . 1]" 3
6 1 32 THR O 1 40 SER N 2.850 . 3.000 2.978 2.823 3.066 0.066 6 0 "[ . 1]" 3
7 1 32 THR H 1 40 SER O 1.900 . 2.000 2.100 2.040 2.171 0.171 2 0 "[ . 1]" 3
8 1 32 THR N 1 40 SER O 2.850 . 3.000 2.908 2.839 3.012 0.012 2 0 "[ . 1]" 3
9 1 34 SER O 1 38 SER H 1.900 . 2.000 2.134 2.013 2.270 0.270 4 0 "[ . 1]" 3
10 1 34 SER O 1 38 SER N 2.850 . 3.000 2.938 2.824 3.091 0.091 4 0 "[ . 1]" 3
11 1 34 SER H 1 38 SER O 1.900 . 2.000 2.039 1.975 2.110 0.110 2 0 "[ . 1]" 3
12 1 34 SER N 1 38 SER O 2.850 . 3.000 2.831 2.733 2.898 . 0 0 "[ . 1]" 3
13 1 160 ALA H 1 168 ARG O 1.900 . 2.000 2.036 1.980 2.098 0.098 4 0 "[ . 1]" 3
14 1 160 ALA N 1 168 ARG O 2.850 . 3.000 2.872 2.717 2.988 . 0 0 "[ . 1]" 3
15 1 160 ALA O 1 168 ARG H 1.900 . 2.000 2.054 1.995 2.114 0.114 9 0 "[ . 1]" 3
16 1 160 ALA O 1 168 ARG N 2.850 . 3.000 2.930 2.826 3.080 0.080 5 0 "[ . 1]" 3
17 1 158 VAL O 1 170 VAL H 1.900 . 2.000 2.044 1.959 2.107 0.107 3 0 "[ . 1]" 3
18 1 158 VAL O 1 170 VAL N 2.850 . 3.000 2.966 2.875 3.055 0.055 6 0 "[ . 1]" 3
19 1 158 VAL H 1 170 VAL O 1.900 . 2.000 2.011 1.907 2.108 0.108 10 0 "[ . 1]" 3
20 1 158 VAL N 1 170 VAL O 2.850 . 3.000 2.908 2.817 3.031 0.031 1 0 "[ . 1]" 3
21 1 156 VAL H 1 172 THR O 1.900 . 2.000 2.072 2.026 2.135 0.135 5 0 "[ . 1]" 3
22 1 156 VAL N 1 172 THR O 2.850 . 3.000 2.898 2.783 3.021 0.021 6 0 "[ . 1]" 3
23 1 179 THR H 1 182 GLY O 1.900 . 2.000 2.085 2.028 2.132 0.132 2 0 "[ . 1]" 3
24 1 179 THR N 1 182 GLY O 2.850 . 3.000 2.951 2.807 3.021 0.021 10 0 "[ . 1]" 3
25 1 177 PHE O 1 184 ILE H 1.900 . 2.000 2.068 2.021 2.110 0.110 5 0 "[ . 1]" 3
26 1 177 PHE O 1 184 ILE N 2.850 . 3.000 2.986 2.894 3.068 0.068 7 0 "[ . 1]" 3
27 1 177 PHE H 1 184 ILE O 1.900 . 2.000 2.072 1.919 2.327 0.327 8 0 "[ . 1]" 3
28 1 177 PHE N 1 184 ILE O 2.850 . 3.000 2.952 2.794 3.068 0.068 10 0 "[ . 1]" 3
29 1 175 GLY H 1 186 ALA O 1.900 . 2.000 2.120 1.950 2.317 0.317 9 0 "[ . 1]" 3
30 1 175 GLY N 1 186 ALA O 2.850 . 3.000 2.999 2.812 3.232 0.232 3 0 "[ . 1]" 3
31 1 175 GLY O 1 186 ALA H 1.900 . 2.000 2.171 1.933 2.406 0.406 3 0 "[ . 1]" 3
32 1 175 GLY O 1 186 ALA N 2.850 . 3.000 2.843 2.637 3.129 0.129 8 0 "[ . 1]" 3
33 1 215 VAL O 1 223 VAL H 1.900 . 2.000 2.046 1.929 2.099 0.099 8 0 "[ . 1]" 3
34 1 215 VAL O 1 223 VAL N 2.850 . 3.000 2.960 2.863 3.046 0.046 8 0 "[ . 1]" 3
35 1 215 VAL H 1 223 VAL O 1.900 . 2.000 2.072 1.950 2.159 0.159 10 0 "[ . 1]" 3
36 1 215 VAL N 1 223 VAL O 2.850 . 3.000 2.998 2.893 3.111 0.111 10 0 "[ . 1]" 3
37 1 217 THR O 1 221 ALA H 1.900 . 2.000 1.985 1.895 2.126 0.126 2 0 "[ . 1]" 3
38 1 217 THR O 1 221 ALA N 2.850 . 3.000 2.828 2.712 2.976 . 0 0 "[ . 1]" 3
39 1 217 THR H 1 221 ALA O 1.900 . 2.000 1.989 1.896 2.114 0.114 10 0 "[ . 1]" 3
40 1 217 THR N 1 221 ALA O 2.850 . 3.000 2.870 2.748 3.012 0.012 10 0 "[ . 1]" 3
41 1 132 ASP O 1 137 LEU H 1.900 . 2.000 1.996 1.937 2.086 0.086 6 0 "[ . 1]" 3
42 1 132 ASP O 1 137 LEU N 2.850 . 3.000 2.940 2.847 3.065 0.065 6 0 "[ . 1]" 3
43 1 132 ASP H 1 137 LEU O 1.900 . 2.000 1.989 1.909 2.104 0.104 4 0 "[ . 1]" 3
44 1 132 ASP N 1 137 LEU O 2.850 . 3.000 2.860 2.713 2.967 . 0 0 "[ . 1]" 3
45 1 130 TRP O 1 139 SER H 1.900 . 2.000 1.992 1.954 2.020 0.020 1 0 "[ . 1]" 3
46 1 130 TRP O 1 139 SER N 2.850 . 3.000 2.947 2.890 2.981 . 0 0 "[ . 1]" 3
47 1 130 TRP H 1 139 SER O 1.900 . 2.000 2.067 2.036 2.107 0.107 4 0 "[ . 1]" 3
48 1 130 TRP N 1 139 SER O 2.850 . 3.000 2.967 2.848 3.039 0.039 5 0 "[ . 1]" 3
49 1 119 LEU O 1 126 ILE H 1.900 . 2.000 2.039 1.894 2.131 0.131 4 0 "[ . 1]" 3
50 1 119 LEU O 1 126 ILE N 2.850 . 3.000 2.844 2.652 2.948 . 0 0 "[ . 1]" 3
51 1 119 LEU H 1 126 ILE O 1.900 . 2.000 2.033 1.958 2.106 0.106 3 0 "[ . 1]" 3
52 1 119 LEU N 1 126 ILE O 2.850 . 3.000 2.947 2.753 3.041 0.041 2 0 "[ . 1]" 3
53 1 121 HIS O 1 124 LYS H 1.900 . 2.000 2.072 2.028 2.121 0.121 3 0 "[ . 1]" 3
54 1 121 HIS O 1 124 LYS N 2.850 . 3.000 2.961 2.868 3.043 0.043 4 0 "[ . 1]" 3
55 1 121 HIS H 1 124 LYS O 1.900 . 2.000 2.075 1.973 2.149 0.149 9 0 "[ . 1]" 3
56 1 121 HIS N 1 124 LYS O 2.850 . 3.000 2.883 2.696 3.106 0.106 9 0 "[ . 1]" 3
57 1 5 ASP O 1 89 LYS H 1.900 . 2.000 2.063 2.000 2.110 0.110 4 0 "[ . 1]" 3
58 1 5 ASP O 1 89 LYS N 2.850 . 3.000 2.855 2.722 2.971 . 0 0 "[ . 1]" 3
59 1 7 GLU O 1 87 LYS H 1.900 . 2.000 2.073 1.991 2.144 0.144 8 0 "[ . 1]" 3
60 1 7 GLU O 1 87 LYS N 2.850 . 3.000 3.017 2.886 3.104 0.104 8 0 "[ . 1]" 3
61 1 7 GLU H 1 87 LYS O 1.900 . 2.000 2.078 1.986 2.152 0.152 2 0 "[ . 1]" 3
62 1 7 GLU N 1 87 LYS O 2.850 . 3.000 2.738 2.636 2.845 . 0 0 "[ . 1]" 3
63 1 9 GLU O 1 85 ARG H 1.900 . 2.000 1.969 1.912 2.018 0.018 7 0 "[ . 1]" 3
64 1 9 GLU O 1 85 ARG N 2.850 . 3.000 2.805 2.650 2.910 . 0 0 "[ . 1]" 3
65 1 9 GLU H 1 85 ARG O 1.900 . 2.000 2.058 1.949 2.113 0.113 4 0 "[ . 1]" 3
66 1 9 GLU N 1 85 ARG O 2.850 . 3.000 2.982 2.859 3.058 0.058 5 0 "[ . 1]" 3
67 1 12 ALA O 1 83 ALA H 1.900 . 2.000 2.083 2.045 2.119 0.119 6 0 "[ . 1]" 3
68 1 12 ALA O 1 83 ALA N 2.850 . 3.000 2.846 2.770 2.933 . 0 0 "[ . 1]" 3
69 1 12 ALA H 1 83 ALA O 1.900 . 2.000 2.042 2.015 2.072 0.072 1 0 "[ . 1]" 3
70 1 12 ALA N 1 83 ALA O 2.850 . 3.000 2.960 2.908 3.030 0.030 1 0 "[ . 1]" 3
71 1 11 ALA H 1 83 ALA O 1.900 . 2.000 2.090 1.998 2.169 0.169 10 0 "[ . 1]" 3
72 1 11 ALA N 1 83 ALA O 2.850 . 3.000 2.962 2.822 3.054 0.054 5 0 "[ . 1]" 3
73 1 82 GLY H 1 102 TYR O 1.900 . 2.000 2.053 1.989 2.105 0.105 8 0 "[ . 1]" 3
74 1 82 GLY N 1 102 TYR O 2.850 . 3.000 2.897 2.650 3.057 0.057 3 0 "[ . 1]" 3
75 1 82 GLY O 1 102 TYR H 1.900 . 2.000 2.098 2.038 2.159 0.159 1 0 "[ . 1]" 3
76 1 82 GLY O 1 102 TYR N 2.850 . 3.000 2.929 2.797 3.058 0.058 1 0 "[ . 1]" 3
77 1 84 TYR O 1 100 GLY H 1.900 . 2.000 2.002 1.899 2.048 0.048 1 0 "[ . 1]" 3
78 1 84 TYR O 1 100 GLY N 2.850 . 3.000 2.943 2.834 3.023 0.023 1 0 "[ . 1]" 3
79 1 84 TYR H 1 100 GLY O 1.900 . 2.000 2.060 2.011 2.133 0.133 10 0 "[ . 1]" 3
80 1 84 TYR N 1 100 GLY O 2.850 . 3.000 2.921 2.828 3.012 0.012 7 0 "[ . 1]" 3
81 1 86 ILE H 1 98 GLY O 1.900 . 2.000 2.055 1.995 2.092 0.092 1 0 "[ . 1]" 3
82 1 86 ILE N 1 98 GLY O 2.850 . 3.000 2.844 2.784 2.882 . 0 0 "[ . 1]" 3
83 1 86 ILE O 1 98 GLY H 1.900 . 2.000 2.094 2.025 2.123 0.123 4 0 "[ . 1]" 3
84 1 86 ILE O 1 98 GLY N 2.850 . 3.000 3.024 2.983 3.105 0.105 8 0 "[ . 1]" 3
85 1 86 ILE O 1 97 ILE H 1.900 . 2.000 2.110 2.021 2.160 0.160 8 0 "[ . 1]" 3
86 1 86 ILE O 1 97 ILE N 2.850 . 3.000 3.073 2.992 3.142 0.142 8 0 "[ . 1]" 3
87 1 88 GLN O 1 95 SER H 1.900 . 2.000 2.075 2.005 2.143 0.143 6 0 "[ . 1]" 3
88 1 88 GLN O 1 95 SER N 2.850 . 3.000 2.923 2.834 3.071 0.071 10 0 "[ . 1]" 3
89 1 88 GLN H 1 95 SER O 1.900 . 2.000 1.971 1.882 2.069 0.069 2 0 "[ . 1]" 3
90 1 88 GLN N 1 95 SER O 2.850 . 3.000 2.706 2.589 2.795 . 0 0 "[ . 1]" 3
91 1 90 GLY H 1 93 GLY O 1.900 . 2.000 2.112 2.037 2.164 0.164 9 0 "[ . 1]" 3
92 1 90 GLY N 1 93 GLY O 2.850 . 3.000 2.823 2.673 3.083 0.083 10 0 "[ . 1]" 3
93 1 90 GLY O 1 93 GLY H 1.900 . 2.000 2.098 2.038 2.207 0.207 10 0 "[ . 1]" 3
94 1 90 GLY O 1 93 GLY N 2.850 . 3.000 2.952 2.527 3.154 0.154 10 0 "[ . 1]" 3
95 1 157 GLN O 1 201 ILE H 1.900 . 2.000 2.002 1.936 2.119 0.119 6 0 "[ . 1]" 3
96 1 157 GLN O 1 201 ILE N 2.850 . 3.000 2.805 2.679 2.943 . 0 0 "[ . 1]" 3
97 1 157 GLN H 1 201 ILE O 1.900 . 2.000 2.104 2.031 2.193 0.193 5 0 "[ . 1]" 3
98 1 157 GLN N 1 201 ILE O 2.850 . 3.000 2.935 2.855 3.009 0.009 9 0 "[ . 1]" 3
99 1 202 ASP H 1 206 LYS O 1.900 . 2.000 1.951 1.851 2.061 0.061 4 0 "[ . 1]" 3
100 1 202 ASP N 1 206 LYS O 2.850 . 3.000 2.806 2.688 2.972 . 0 0 "[ . 1]" 3
101 1 200 ILE O 1 209 GLY H 1.900 . 2.000 2.063 1.937 2.169 0.169 5 0 "[ . 1]" 3
102 1 200 ILE O 1 209 GLY N 2.850 . 3.000 2.966 2.690 3.099 0.099 6 0 "[ . 1]" 3
103 1 200 ILE H 1 209 GLY O 1.900 . 2.000 2.050 1.962 2.117 0.117 4 0 "[ . 1]" 3
104 1 200 ILE N 1 209 GLY O 2.850 . 3.000 2.906 2.784 3.048 0.048 1 0 "[ . 1]" 3
105 1 200 ILE O 1 208 VAL H 1.900 . 2.000 2.070 1.951 2.251 0.251 1 0 "[ . 1]" 3
106 1 200 ILE O 1 208 VAL N 2.850 . 3.000 2.877 2.721 3.026 0.026 10 0 "[ . 1]" 3
107 1 103 LYS O 1 106 THR H 1.900 . 2.000 2.074 2.020 2.124 0.124 3 0 "[ . 1]" 3
108 1 103 LYS O 1 106 THR N 2.850 . 3.000 2.975 2.879 3.055 0.055 3 0 "[ . 1]" 3
109 1 103 LYS H 1 106 THR O 1.900 . 2.000 2.051 1.906 2.171 0.171 5 0 "[ . 1]" 3
110 1 103 LYS N 1 106 THR O 2.850 . 3.000 2.983 2.857 3.047 0.047 2 0 "[ . 1]" 3
111 1 109 THR H 1 138 ILE O 1.900 . 2.000 2.066 2.009 2.109 0.109 7 0 "[ . 1]" 3
112 1 109 THR N 1 138 ILE O 2.850 . 3.000 2.975 2.875 3.046 0.046 10 0 "[ . 1]" 3
113 1 109 THR O 1 138 ILE H 1.900 . 2.000 2.021 1.901 2.102 0.102 8 0 "[ . 1]" 3
114 1 109 THR O 1 138 ILE N 2.850 . 3.000 2.894 2.769 3.025 0.025 2 0 "[ . 1]" 3
115 1 107 PHE O 1 140 TYR H 1.900 . 2.000 2.003 1.893 2.097 0.097 4 0 "[ . 1]" 3
116 1 107 PHE O 1 140 TYR N 2.850 . 3.000 2.808 2.623 2.909 . 0 0 "[ . 1]" 3
117 1 107 PHE H 1 140 TYR O 1.900 . 2.000 2.099 2.011 2.149 0.149 10 0 "[ . 1]" 3
118 1 107 PHE N 1 140 TYR O 2.850 . 3.000 2.939 2.857 3.014 0.014 4 0 "[ . 1]" 3
119 1 210 LEU O 1 227 ALA H 1.900 . 2.000 2.106 2.052 2.137 0.137 2 0 "[ . 1]" 3
120 1 210 LEU O 1 227 ALA N 2.850 . 3.000 2.995 2.868 3.129 0.129 2 0 "[ . 1]" 3
121 1 210 LEU H 1 227 ALA O 1.900 . 2.000 2.070 1.997 2.133 0.133 5 0 "[ . 1]" 3
122 1 210 LEU N 1 227 ALA O 2.850 . 3.000 2.945 2.754 3.018 0.018 3 0 "[ . 1]" 3
123 1 198 SER O 1 211 TYR H 1.900 . 2.000 2.031 1.888 2.147 0.147 5 0 "[ . 1]" 3
124 1 198 SER O 1 211 TYR N 2.850 . 3.000 2.888 2.727 2.975 . 0 0 "[ . 1]" 3
125 1 99 ALA H 1 196 SER O 1.900 . 2.000 2.082 2.029 2.137 0.137 4 0 "[ . 1]" 3
126 1 99 ALA N 1 196 SER O 2.850 . 3.000 2.878 2.769 3.011 0.011 8 0 "[ . 1]" 3
127 1 195 THR O 1 198 SER H 1.900 . 2.000 2.101 2.018 2.165 0.165 7 0 "[ . 1]" 3
128 1 195 THR O 1 198 SER N 2.850 . 3.000 2.951 2.801 3.062 0.062 10 0 "[ . 1]" 3
stop_
save_