NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
621020 |
6amv   |
30331 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6amv
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 1360
_Distance_constraint_stats_list.Viol_count 1395
_Distance_constraint_stats_list.Viol_total 2507.134
_Distance_constraint_stats_list.Viol_max 0.396
_Distance_constraint_stats_list.Viol_rms 0.0251
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0046
_Distance_constraint_stats_list.Viol_average_violations_only 0.0899
_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 52 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ASP 0.009 0.009 3 0 "[ . 1 . 2]"
1 56 PHE 0.009 0.009 3 0 "[ . 1 . 2]"
1 64 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 TRP 0.088 0.056 13 0 "[ . 1 . 2]"
1 72 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LEU 0.658 0.112 7 0 "[ . 1 . 2]"
1 74 LEU 0.120 0.090 5 0 "[ . 1 . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 LEU 2.286 0.208 14 0 "[ . 1 . 2]"
1 85 PHE 0.510 0.065 15 0 "[ . 1 . 2]"
1 86 VAL 0.012 0.012 5 0 "[ . 1 . 2]"
1 87 ALA 0.280 0.111 4 0 "[ . 1 . 2]"
1 88 LEU 0.541 0.153 16 0 "[ . 1 . 2]"
1 89 TYR 0.064 0.020 14 0 "[ . 1 . 2]"
1 90 ASP 0.472 0.117 19 0 "[ . 1 . 2]"
1 91 PHE 3.380 0.210 12 0 "[ . 1 . 2]"
1 92 VAL 0.175 0.070 7 0 "[ . 1 . 2]"
1 93 ALA 0.170 0.060 4 0 "[ . 1 . 2]"
1 94 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LEU 0.540 0.097 3 0 "[ . 1 . 2]"
1 100 SER 0.013 0.013 15 0 "[ . 1 . 2]"
1 101 ILE 1.015 0.140 3 0 "[ . 1 . 2]"
1 102 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 LYS 0.737 0.117 19 0 "[ . 1 . 2]"
1 104 GLY 0.015 0.015 4 0 "[ . 1 . 2]"
1 105 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 LYS 3.021 0.235 5 0 "[ . 1 . 2]"
1 107 LEU 3.906 0.235 5 0 "[ . 1 . 2]"
1 108 ARG 1.128 0.166 16 0 "[ . 1 . 2]"
1 109 VAL 11.238 0.286 18 0 "[ . 1 . 2]"
1 110 LEU 8.974 0.286 18 0 "[ . 1 . 2]"
1 111 GLY 0.482 0.118 6 0 "[ . 1 . 2]"
1 112 TYR 11.623 0.288 8 0 "[ . 1 . 2]"
1 113 ASN 0.239 0.126 11 0 "[ . 1 . 2]"
1 115 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 GLY 3.257 0.265 16 0 "[ . 1 . 2]"
1 117 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 TRP 0.725 0.108 16 0 "[ . 1 . 2]"
1 119 ALA 3.800 0.288 8 0 "[ . 1 . 2]"
1 120 GLU 1.742 0.250 10 0 "[ . 1 . 2]"
1 121 ALA 0.453 0.115 17 0 "[ . 1 . 2]"
1 122 GLN 0.640 0.115 4 0 "[ . 1 . 2]"
1 123 THR 0.516 0.097 3 0 "[ . 1 . 2]"
1 124 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 GLY 1.186 0.217 12 0 "[ . 1 . 2]"
1 129 TRP 0.343 0.126 11 0 "[ . 1 . 2]"
1 130 VAL 3.841 0.192 5 0 "[ . 1 . 2]"
1 132 SER 0.824 0.157 7 0 "[ . 1 . 2]"
1 133 ASN 0.092 0.092 7 0 "[ . 1 . 2]"
1 134 TYR 0.893 0.153 16 0 "[ . 1 . 2]"
1 135 ILE 2.522 0.192 5 0 "[ . 1 . 2]"
1 136 THR 0.119 0.070 7 0 "[ . 1 . 2]"
1 138 VAL 1.968 0.208 14 0 "[ . 1 . 2]"
1 139 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 LEU 0.914 0.147 16 0 "[ . 1 . 2]"
1 142 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 146 TRP 0.558 0.071 8 0 "[ . 1 . 2]"
1 147 TYR 1.687 0.153 12 0 "[ . 1 . 2]"
1 148 HIS 0.747 0.105 8 0 "[ . 1 . 2]"
1 149 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 VAL 1.399 0.217 5 0 "[ . 1 . 2]"
1 152 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 153 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 154 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 155 ALA 1.655 0.207 18 0 "[ . 1 . 2]"
1 156 ALA 1.195 0.209 7 0 "[ . 1 . 2]"
1 157 GLU 0.084 0.066 12 0 "[ . 1 . 2]"
1 158 TYR 8.713 0.292 17 0 "[ . 1 . 2]"
1 159 LEU 8.020 0.292 17 0 "[ . 1 . 2]"
1 160 LEU 2.104 0.153 16 0 "[ . 1 . 2]"
1 161 SER 0.842 0.148 8 0 "[ . 1 . 2]"
1 164 ILE 1.819 0.257 2 0 "[ . 1 . 2]"
1 166 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 167 SER 0.102 0.070 2 0 "[ . 1 . 2]"
1 168 PHE 2.232 0.168 2 0 "[ . 1 . 2]"
1 169 LEU 2.041 0.153 12 0 "[ . 1 . 2]"
1 170 VAL 0.009 0.003 1 0 "[ . 1 . 2]"
1 171 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 173 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 174 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 175 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 176 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 178 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 179 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 180 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 181 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 182 ILE 4.931 0.396 11 0 "[ . 1 . 2]"
1 183 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 184 LEU 7.745 0.266 6 0 "[ . 1 . 2]"
1 185 ARG 0.471 0.110 14 0 "[ . 1 . 2]"
1 186 TYR 0.314 0.082 13 0 "[ . 1 . 2]"
1 187 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 188 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 189 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 190 VAL 5.139 0.223 7 0 "[ . 1 . 2]"
1 191 TYR 5.238 0.223 7 0 "[ . 1 . 2]"
1 192 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 193 TYR 25.200 0.396 11 0 "[ . 1 . 2]"
1 194 ARG 1.672 0.253 13 0 "[ . 1 . 2]"
1 195 ILE 3.226 0.230 19 0 "[ . 1 . 2]"
1 196 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 197 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 198 ALA 0.445 0.075 3 0 "[ . 1 . 2]"
1 200 ASP 0.521 0.133 18 0 "[ . 1 . 2]"
1 201 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 202 LYS 0.522 0.133 18 0 "[ . 1 . 2]"
1 203 LEU 4.480 0.257 13 0 "[ . 1 . 2]"
1 204 TYR 4.953 0.195 13 0 "[ . 1 . 2]"
1 205 VAL 3.709 0.358 11 0 "[ . 1 . 2]"
1 206 SER 1.554 0.195 13 0 "[ . 1 . 2]"
1 208 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 209 SER 0.952 0.108 4 0 "[ . 1 . 2]"
1 210 ARG 1.300 0.113 12 0 "[ . 1 . 2]"
1 211 PHE 12.144 0.257 13 0 "[ . 1 . 2]"
1 212 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 213 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 214 LEU 3.996 0.173 16 0 "[ . 1 . 2]"
1 215 ALA 0.049 0.030 7 0 "[ . 1 . 2]"
1 216 GLU 0.090 0.090 5 0 "[ . 1 . 2]"
1 217 LEU 0.626 0.078 12 0 "[ . 1 . 2]"
1 218 VAL 0.141 0.026 13 0 "[ . 1 . 2]"
1 219 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 220 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 221 HIS 0.064 0.060 11 0 "[ . 1 . 2]"
1 222 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 223 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 224 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 225 ALA 8.886 0.212 16 0 "[ . 1 . 2]"
1 226 ASP 3.215 0.196 6 0 "[ . 1 . 2]"
1 227 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 228 LEU 10.514 0.275 20 0 "[ . 1 . 2]"
1 229 ILE 3.410 0.339 20 0 "[ . 1 . 2]"
1 230 THR 2.894 0.166 4 0 "[ . 1 . 2]"
1 231 THR 0.297 0.055 17 0 "[ . 1 . 2]"
1 232 LEU 6.205 0.285 16 0 "[ . 1 . 2]"
1 233 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 234 TYR 5.082 0.257 2 0 "[ . 1 . 2]"
1 236 ALA 0.516 0.114 10 0 "[ . 1 . 2]"
1 238 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 239 ARG 0.739 0.242 6 0 "[ . 1 . 2]"
1 244 VAL 2.837 0.210 12 0 "[ . 1 . 2]"
1 245 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 246 GLY 0.641 0.392 13 0 "[ . 1 . 2]"
1 247 VAL 0.583 0.392 13 0 "[ . 1 . 2]"
1 251 TYR 1.830 0.276 3 0 "[ . 1 . 2]"
1 252 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 254 TRP 1.830 0.276 3 0 "[ . 1 . 2]"
1 255 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
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 1 141 LEU MD2 1 203 LEU MD2 3.820 . 5.840 4.938 4.170 5.813 . 0 0 "[ . 1 . 2]" 1
2 1 141 LEU MD2 1 214 LEU MD2 3.210 . 4.620 3.889 3.456 4.378 . 0 0 "[ . 1 . 2]" 1
3 1 195 ILE MD 1 203 LEU MD1 3.440 . 5.080 4.212 3.820 4.796 . 0 0 "[ . 1 . 2]" 1
4 1 84 LEU MD2 1 138 VAL MG1 3.040 . 4.280 3.337 2.931 3.926 . 0 0 "[ . 1 . 2]" 1
5 1 99 LEU MD2 1 109 VAL MG2 4.360 . 6.920 5.915 5.365 6.444 . 0 0 "[ . 1 . 2]" 1
6 1 109 VAL MG2 1 138 VAL MG2 4.380 . 6.960 6.198 5.862 6.620 . 0 0 "[ . 1 . 2]" 1
7 1 86 VAL MG1 1 109 VAL MG2 4.540 . 7.280 6.417 6.120 6.654 . 0 0 "[ . 1 . 2]" 1
8 1 99 LEU MD2 1 135 ILE MD 4.190 . 6.580 5.935 5.362 6.367 . 0 0 "[ . 1 . 2]" 1
9 1 88 LEU MD1 1 135 ILE MD 4.340 . 6.880 6.341 5.915 6.692 . 0 0 "[ . 1 . 2]" 1
10 1 109 VAL MG1 1 110 LEU MD1 3.690 . 5.580 5.365 5.022 5.742 0.162 16 0 "[ . 1 . 2]" 1
11 1 107 LEU MD1 1 109 VAL MG2 3.040 . 4.280 2.787 2.241 3.241 . 0 0 "[ . 1 . 2]" 1
12 1 107 LEU MD1 1 130 VAL MG2 3.590 . 5.380 3.319 3.035 3.607 . 0 0 "[ . 1 . 2]" 1
13 1 99 LEU MD2 1 107 LEU MD2 3.140 . 4.480 3.712 3.110 4.235 . 0 0 "[ . 1 . 2]" 1
14 1 99 LEU MD1 1 107 LEU MD2 3.870 . 5.940 5.538 5.059 5.859 . 0 0 "[ . 1 . 2]" 1
15 1 107 LEU MD2 1 119 ALA MB 4.190 . 6.580 5.411 4.910 5.777 . 0 0 "[ . 1 . 2]" 1
16 1 141 LEU MD1 1 217 LEU MD2 4.300 . 6.800 5.545 5.170 5.998 . 0 0 "[ . 1 . 2]" 1
17 1 86 VAL MG2 1 88 LEU MD1 4.080 . 6.360 5.495 5.259 5.962 . 0 0 "[ . 1 . 2]" 1
18 1 86 VAL MG1 1 88 LEU MD1 3.580 . 5.360 4.339 4.119 4.842 . 0 0 "[ . 1 . 2]" 1
19 1 99 LEU MD2 1 130 VAL MG2 3.430 . 5.060 3.621 3.071 4.123 . 0 0 "[ . 1 . 2]" 1
20 1 99 LEU MD2 1 101 ILE MD 3.950 . 6.100 4.857 4.441 5.607 . 0 0 "[ . 1 . 2]" 1
21 1 99 LEU MD1 1 130 VAL MG2 4.450 . 7.100 5.739 5.268 6.083 . 0 0 "[ . 1 . 2]" 1
22 1 109 VAL MG1 1 130 VAL MG2 4.070 . 6.340 4.773 4.024 5.235 . 0 0 "[ . 1 . 2]" 1
23 1 84 LEU MD2 1 138 VAL MG2 2.820 . 3.840 2.381 2.099 2.821 . 0 0 "[ . 1 . 2]" 1
24 1 86 VAL MG1 1 107 LEU MD1 3.330 . 4.860 4.350 4.201 4.482 . 0 0 "[ . 1 . 2]" 1
25 1 86 VAL MG1 1 138 VAL MG1 3.160 . 4.520 3.480 2.872 4.266 . 0 0 "[ . 1 . 2]" 1
26 1 99 LEU MD1 1 130 VAL MG1 3.540 . 5.280 4.119 3.943 4.260 . 0 0 "[ . 1 . 2]" 1
27 1 160 LEU MD1 1 184 LEU MD1 3.670 . 5.540 4.236 3.918 4.684 . 0 0 "[ . 1 . 2]" 1
28 1 84 LEU MD2 1 86 VAL MG1 4.320 . 6.840 5.512 5.016 5.843 . 0 0 "[ . 1 . 2]" 1
29 1 84 LEU MD1 1 138 VAL MG2 3.210 . 4.620 3.644 3.467 4.007 . 0 0 "[ . 1 . 2]" 1
30 1 99 LEU MD1 1 101 ILE MD 4.480 . 7.160 6.166 5.808 6.609 . 0 0 "[ . 1 . 2]" 1
31 1 88 LEU MD2 1 107 LEU MD1 4.300 . 6.800 5.916 5.575 6.359 . 0 0 "[ . 1 . 2]" 1
32 1 99 LEU MD1 1 121 ALA MB 4.050 . 6.300 5.269 4.842 5.585 . 0 0 "[ . 1 . 2]" 1
33 1 203 LEU MD2 1 214 LEU MD2 3.380 . 4.960 4.738 4.290 5.025 0.065 4 0 "[ . 1 . 2]" 1
34 1 198 ALA MB 1 203 LEU MD2 4.420 . 7.040 5.375 5.031 5.834 . 0 0 "[ . 1 . 2]" 1
35 1 160 LEU MD1 1 184 LEU MD2 4.260 . 6.720 5.739 5.578 5.892 . 0 0 "[ . 1 . 2]" 1
36 1 184 LEU MD2 1 232 LEU MD1 3.760 . 5.720 4.680 4.381 5.352 . 0 0 "[ . 1 . 2]" 1
37 1 160 LEU MD2 1 184 LEU MD2 4.330 . 6.860 6.507 6.031 6.667 . 0 0 "[ . 1 . 2]" 1
38 1 169 LEU MD2 1 190 VAL MG1 3.580 . 5.360 4.269 3.855 4.659 . 0 0 "[ . 1 . 2]" 1
39 1 151 VAL MG1 1 169 LEU MD2 3.040 . 4.280 3.648 3.409 3.991 . 0 0 "[ . 1 . 2]" 1
40 1 160 LEU MD1 1 169 LEU MD1 3.200 . 4.600 3.978 3.683 4.308 . 0 0 "[ . 1 . 2]" 1
41 1 184 LEU MD1 1 232 LEU MD1 3.610 . 5.420 4.277 4.161 4.515 . 0 0 "[ . 1 . 2]" 1
42 1 169 LEU MD1 1 170 VAL MG2 3.570 . 5.340 4.567 4.361 4.784 . 0 0 "[ . 1 . 2]" 1
43 1 141 LEU MD2 1 170 VAL MG2 4.030 . 6.260 5.603 5.202 5.998 . 0 0 "[ . 1 . 2]" 1
44 1 195 ILE MD 1 203 LEU MD2 3.770 . 5.740 5.339 5.109 5.630 . 0 0 "[ . 1 . 2]" 1
45 1 170 VAL MG1 1 217 LEU MD2 3.620 . 5.440 4.022 3.730 4.350 . 0 0 "[ . 1 . 2]" 1
46 1 214 LEU MD1 1 217 LEU MD2 3.460 . 5.120 3.620 3.290 3.875 . 0 0 "[ . 1 . 2]" 1
47 1 203 LEU MD1 1 217 LEU MD2 3.290 . 4.780 4.114 3.837 4.516 . 0 0 "[ . 1 . 2]" 1
48 1 141 LEU MD2 1 217 LEU MD2 4.540 . 7.280 6.057 5.618 6.593 . 0 0 "[ . 1 . 2]" 1
49 1 203 LEU MD2 1 214 LEU MD1 3.530 . 5.260 4.184 3.515 4.733 . 0 0 "[ . 1 . 2]" 1
50 1 214 LEU MD1 1 218 VAL MG1 4.460 . 7.120 6.099 5.905 6.380 . 0 0 "[ . 1 . 2]" 1
51 1 182 ILE MD 1 214 LEU MD1 4.340 . 6.880 5.141 4.911 5.341 . 0 0 "[ . 1 . 2]" 1
52 1 169 LEU MD1 1 218 VAL MG2 4.780 . 7.760 6.850 6.570 7.120 . 0 0 "[ . 1 . 2]" 1
53 1 203 LEU MD2 1 218 VAL MG2 5.100 . 8.400 6.468 6.066 6.864 . 0 0 "[ . 1 . 2]" 1
54 1 170 VAL MG1 1 218 VAL MG2 3.280 . 4.760 3.928 3.627 4.384 . 0 0 "[ . 1 . 2]" 1
55 1 184 LEU MD1 1 228 LEU MD2 4.270 . 6.740 5.767 4.580 5.958 . 0 0 "[ . 1 . 2]" 1
56 1 205 VAL MG1 1 228 LEU MD1 3.350 . 4.900 4.231 4.094 4.522 . 0 0 "[ . 1 . 2]" 1
57 1 205 VAL MG1 1 217 LEU MD1 3.540 . 5.280 4.017 3.909 4.196 . 0 0 "[ . 1 . 2]" 1
58 1 195 ILE MD 1 205 VAL MG1 4.510 . 7.220 5.610 5.350 5.878 . 0 0 "[ . 1 . 2]" 1
59 1 170 VAL MG2 1 205 VAL MG2 4.090 . 6.380 4.834 4.649 5.074 . 0 0 "[ . 1 . 2]" 1
60 1 205 VAL MG2 1 232 LEU MD2 4.290 . 6.780 4.915 4.643 5.207 . 0 0 "[ . 1 . 2]" 1
61 1 160 LEU MD1 1 232 LEU MD2 4.420 . 7.040 5.583 5.247 5.911 . 0 0 "[ . 1 . 2]" 1
62 1 160 LEU MD2 1 232 LEU MD2 4.180 . 6.560 6.070 5.555 6.217 . 0 0 "[ . 1 . 2]" 1
63 1 218 VAL MG2 1 232 LEU MD2 4.040 . 6.280 4.840 4.348 5.399 . 0 0 "[ . 1 . 2]" 1
64 1 184 LEU MD2 1 190 VAL MG1 4.480 . 7.160 6.083 5.812 6.405 . 0 0 "[ . 1 . 2]" 1
65 1 159 LEU MD1 1 190 VAL MG1 4.480 . 7.160 6.259 5.877 6.545 . 0 0 "[ . 1 . 2]" 1
66 1 169 LEU MD1 1 190 VAL MG1 4.790 . 7.780 5.007 4.678 5.353 . 0 0 "[ . 1 . 2]" 1
67 1 184 LEU MD1 1 190 VAL MG1 4.330 . 6.860 5.495 5.305 5.780 . 0 0 "[ . 1 . 2]" 1
68 1 224 VAL MG1 1 225 ALA MB 4.030 . 6.260 4.783 4.664 4.926 . 0 0 "[ . 1 . 2]" 1
69 1 224 VAL MG2 1 225 ALA MB 3.710 . 5.620 4.551 4.333 4.678 . 0 0 "[ . 1 . 2]" 1
70 1 151 VAL MG1 1 236 ALA MB 4.710 . 7.620 5.826 5.274 6.167 . 0 0 "[ . 1 . 2]" 1
71 1 151 VAL MG2 1 236 ALA MB 5.050 . 8.300 6.075 5.600 6.352 . 0 0 "[ . 1 . 2]" 1
72 1 155 ALA MB 1 156 ALA MB 3.200 . 4.600 3.857 3.715 3.995 . 0 0 "[ . 1 . 2]" 1
73 1 159 LEU MD1 1 169 LEU MD1 2.700 . 3.600 2.900 2.332 3.221 . 0 0 "[ . 1 . 2]" 1
74 1 159 LEU MD2 1 169 LEU MD1 3.760 . 5.720 4.985 4.356 5.384 . 0 0 "[ . 1 . 2]" 1
75 1 164 ILE MD 1 236 ALA MB 4.700 . 7.600 7.215 6.851 7.604 0.004 10 0 "[ . 1 . 2]" 1
76 1 170 VAL MG2 1 217 LEU MD1 3.960 . 6.120 5.021 4.751 5.222 . 0 0 "[ . 1 . 2]" 1
77 1 217 LEU MD1 1 218 VAL MG1 4.310 . 6.820 5.541 5.397 5.649 . 0 0 "[ . 1 . 2]" 1
78 1 159 LEU MD2 1 169 LEU MD2 3.110 . 4.420 3.646 3.166 3.859 . 0 0 "[ . 1 . 2]" 1
79 1 159 LEU MD2 1 160 LEU MD1 4.410 . 7.020 6.129 5.826 6.383 . 0 0 "[ . 1 . 2]" 1
80 1 151 VAL MG1 1 159 LEU MD2 3.330 . 4.860 4.602 4.283 4.918 0.058 5 0 "[ . 1 . 2]" 1
81 1 159 LEU MD2 1 236 ALA MB 3.550 . 5.300 3.074 2.479 3.597 . 0 0 "[ . 1 . 2]" 1
82 1 169 LEU MD2 1 190 VAL MG2 4.020 . 6.240 5.085 4.710 5.624 . 0 0 "[ . 1 . 2]" 1
83 1 151 VAL MG2 1 159 LEU MD2 3.370 . 4.940 4.657 3.879 5.157 0.217 5 0 "[ . 1 . 2]" 1
84 1 86 VAL MG2 1 107 LEU MD1 3.250 . 4.700 4.358 4.282 4.503 . 0 0 "[ . 1 . 2]" 1
85 1 86 VAL MG2 1 88 LEU MD2 3.230 . 4.660 3.326 3.025 3.949 . 0 0 "[ . 1 . 2]" 1
86 1 52 VAL MG2 1 53 ALA MB 3.810 . 5.820 3.750 2.552 5.482 . 0 0 "[ . 1 . 2]" 1
87 1 73 LEU MD1 1 75 ALA MB 4.880 . 7.960 5.900 5.333 6.648 . 0 0 "[ . 1 . 2]" 1
88 1 74 LEU MD1 1 75 ALA MB 5.100 . 8.400 6.255 5.037 6.499 . 0 0 "[ . 1 . 2]" 1
89 1 74 LEU MD2 1 75 ALA MB 4.480 . 7.160 5.678 5.270 5.845 . 0 0 "[ . 1 . 2]" 1
90 1 195 ILE MD 1 217 LEU MD1 3.220 . 4.640 4.136 4.028 4.250 . 0 0 "[ . 1 . 2]" 1
91 1 217 LEU MD1 1 218 VAL MG2 3.530 . 5.260 4.238 4.144 4.398 . 0 0 "[ . 1 . 2]" 1
92 1 160 LEU MD2 1 190 VAL MG1 3.230 . 4.660 4.249 3.997 4.445 . 0 0 "[ . 1 . 2]" 1
93 1 141 LEU MD1 1 170 VAL MG1 3.330 . 4.860 4.244 3.763 4.838 . 0 0 "[ . 1 . 2]" 1
94 1 86 VAL MG1 1 87 ALA MB 3.890 . 5.980 4.872 4.816 4.939 . 0 0 "[ . 1 . 2]" 1
95 1 215 ALA MB 1 218 VAL MG1 3.990 . 6.180 5.353 5.058 5.682 . 0 0 "[ . 1 . 2]" 1
96 1 101 ILE MD 1 135 ILE MD 3.300 . 4.800 4.278 4.024 4.496 . 0 0 "[ . 1 . 2]" 1
97 1 156 ALA MB 1 159 LEU MD2 4.230 . 6.660 5.642 5.313 5.850 . 0 0 "[ . 1 . 2]" 1
98 1 156 ALA MB 1 160 LEU MD2 4.480 . 7.160 5.126 4.695 5.516 . 0 0 "[ . 1 . 2]" 1
99 1 198 ALA H 1 204 TYR H 4.130 . 6.460 4.856 4.387 5.370 . 0 0 "[ . 1 . 2]" 1
100 1 198 ALA H 1 201 GLY H 3.550 . 5.300 4.071 3.526 4.532 . 0 0 "[ . 1 . 2]" 1
101 1 198 ALA H 1 204 TYR HD1 3.220 . 4.640 3.571 3.121 3.972 . 0 0 "[ . 1 . 2]" 1
102 1 198 ALA H 1 204 TYR HE1 3.290 . 4.780 2.888 2.295 3.397 . 0 0 "[ . 1 . 2]" 1
103 1 198 ALA H 1 204 TYR HB3 4.070 . 6.340 6.034 5.615 6.376 0.036 7 0 "[ . 1 . 2]" 1
104 1 198 ALA H 1 203 LEU MD1 3.480 . 5.160 3.997 3.560 4.398 . 0 0 "[ . 1 . 2]" 1
105 1 88 LEU H 1 89 TYR H 2.720 . 3.640 2.365 2.057 2.577 . 0 0 "[ . 1 . 2]" 1
106 1 88 LEU H 1 89 TYR HD1 3.170 . 4.540 3.858 3.200 4.366 . 0 0 "[ . 1 . 2]" 1
107 1 88 LEU H 1 89 TYR HA 3.920 . 6.040 5.116 4.861 5.288 . 0 0 "[ . 1 . 2]" 1
108 1 88 LEU H 1 89 TYR HB2 4.010 . 6.220 4.861 4.409 5.214 . 0 0 "[ . 1 . 2]" 1
109 1 87 ALA MB 1 88 LEU H 3.110 . 4.420 3.266 2.948 3.483 . 0 0 "[ . 1 . 2]" 1
110 1 86 VAL MG2 1 88 LEU H 3.710 . 5.620 4.469 4.143 4.710 . 0 0 "[ . 1 . 2]" 1
111 1 110 LEU MD2 1 121 ALA H 4.150 . 6.500 5.549 3.781 6.205 . 0 0 "[ . 1 . 2]" 1
112 1 191 TYR H 1 192 HIS H 3.570 . 5.340 4.492 4.292 4.600 . 0 0 "[ . 1 . 2]" 1
113 1 191 TYR H 1 193 TYR HE2 3.600 . 5.400 5.310 4.410 5.506 0.106 3 0 "[ . 1 . 2]" 1
114 1 191 TYR H 1 191 TYR HB2 3.140 . 4.480 2.568 2.503 2.655 . 0 0 "[ . 1 . 2]" 1
115 1 190 VAL MG2 1 191 TYR H 3.300 . 4.800 4.249 4.160 4.337 . 0 0 "[ . 1 . 2]" 1
116 1 160 LEU MD1 1 191 TYR H 3.330 . 4.860 4.616 4.248 4.809 . 0 0 "[ . 1 . 2]" 1
117 1 190 VAL MG1 1 191 TYR H 2.920 . 4.040 3.119 2.924 3.248 . 0 0 "[ . 1 . 2]" 1
118 1 187 GLU H 1 188 GLY H 2.920 . 4.040 2.723 2.641 2.791 . 0 0 "[ . 1 . 2]" 1
119 1 186 TYR HD1 1 187 GLU H 3.070 . 4.340 3.268 2.840 3.755 . 0 0 "[ . 1 . 2]" 1
120 1 186 TYR HB3 1 187 GLU H 3.360 . 4.920 4.036 3.919 4.252 . 0 0 "[ . 1 . 2]" 1
121 1 186 TYR HB2 1 187 GLU H 3.470 . 5.140 4.223 4.147 4.341 . 0 0 "[ . 1 . 2]" 1
122 1 187 GLU H 1 229 ILE MD 4.010 . 6.220 5.551 4.882 6.014 . 0 0 "[ . 1 . 2]" 1
123 1 110 LEU H 1 120 GLU H 3.280 . 4.760 4.379 3.964 4.751 . 0 0 "[ . 1 . 2]" 1
124 1 110 LEU H 1 111 GLY H 2.740 . 3.680 2.341 1.988 2.699 . 0 0 "[ . 1 . 2]" 1
125 1 110 LEU H 1 121 ALA MB 3.680 . 5.560 4.114 3.454 4.650 . 0 0 "[ . 1 . 2]" 1
126 1 110 LEU H 1 119 ALA MB 3.830 . 5.860 3.905 3.291 4.771 . 0 0 "[ . 1 . 2]" 1
127 1 110 LEU H 1 110 LEU MD2 2.930 . 4.060 2.899 1.775 3.412 0.025 17 0 "[ . 1 . 2]" 1
128 1 109 VAL MG1 1 110 LEU H 2.710 . 3.620 2.910 2.496 3.324 . 0 0 "[ . 1 . 2]" 1
129 1 183 SER H 1 184 LEU H 3.460 . 5.120 4.151 4.058 4.480 . 0 0 "[ . 1 . 2]" 1
130 1 184 LEU H 1 191 TYR HD1 3.670 . 5.540 4.658 4.291 5.047 . 0 0 "[ . 1 . 2]" 1
131 1 184 LEU H 1 193 TYR HE2 3.260 . 4.720 4.640 2.985 4.970 0.250 2 0 "[ . 1 . 2]" 1
132 1 184 LEU H 1 191 TYR HB2 3.060 . 4.320 3.586 3.205 3.851 . 0 0 "[ . 1 . 2]" 1
133 1 184 LEU H 1 184 LEU MD2 3.410 . 5.020 4.465 4.398 4.600 . 0 0 "[ . 1 . 2]" 1
134 1 160 LEU MD1 1 184 LEU H 2.930 . 4.060 3.896 3.437 4.073 0.013 10 0 "[ . 1 . 2]" 1
135 1 196 ASN H 1 197 THR H 3.680 . 5.560 4.467 4.205 4.616 . 0 0 "[ . 1 . 2]" 1
136 1 147 TYR H 1 148 HIS H 3.600 . 5.400 4.357 4.189 4.472 . 0 0 "[ . 1 . 2]" 1
137 1 147 TYR HD2 1 148 HIS H 3.570 . 5.340 4.129 3.582 4.700 . 0 0 "[ . 1 . 2]" 1
138 1 148 HIS H 1 170 VAL MG2 3.880 . 5.960 5.551 5.419 5.683 . 0 0 "[ . 1 . 2]" 1
139 1 148 HIS H 1 169 LEU MD1 3.440 . 5.080 4.112 3.901 4.264 . 0 0 "[ . 1 . 2]" 1
140 1 224 VAL H 1 225 ALA H 3.580 . 5.360 4.447 4.411 4.473 . 0 0 "[ . 1 . 2]" 1
141 1 225 ALA H 1 231 THR H 3.550 . 5.300 5.231 4.863 5.355 0.055 17 0 "[ . 1 . 2]" 1
142 1 151 VAL H 1 152 SER H 3.620 . 5.440 4.304 4.103 4.473 . 0 0 "[ . 1 . 2]" 1
143 1 86 VAL H 1 87 ALA H 3.730 . 5.660 4.254 4.133 4.342 . 0 0 "[ . 1 . 2]" 1
144 1 87 ALA H 1 88 LEU H 4.000 . 6.200 4.440 4.273 4.560 . 0 0 "[ . 1 . 2]" 1
145 1 87 ALA H 1 107 LEU MD2 3.110 . 4.420 3.461 3.213 3.967 . 0 0 "[ . 1 . 2]" 1
146 1 92 VAL H 1 93 ALA H 3.550 . 5.300 4.467 4.371 4.567 . 0 0 "[ . 1 . 2]" 1
147 1 91 PHE HD1 1 92 VAL H 3.070 . 4.340 3.864 3.397 4.373 0.033 7 0 "[ . 1 . 2]" 1
148 1 92 VAL H 1 134 TYR HE2 3.880 . 5.960 5.055 4.659 5.663 . 0 0 "[ . 1 . 2]" 1
149 1 92 VAL H 1 92 VAL MG2 2.560 . 3.320 2.497 2.142 2.802 . 0 0 "[ . 1 . 2]" 1
150 1 186 TYR H 1 188 GLY H 3.530 . 5.260 3.961 3.755 4.137 . 0 0 "[ . 1 . 2]" 1
151 1 186 TYR H 1 191 TYR HD1 3.040 . 4.280 2.980 2.803 3.301 . 0 0 "[ . 1 . 2]" 1
152 1 186 TYR H 1 186 TYR HB2 3.050 . 4.300 3.212 3.078 3.335 . 0 0 "[ . 1 . 2]" 1
153 1 182 ILE H 1 193 TYR H 2.850 . 3.900 3.093 2.850 3.317 . 0 0 "[ . 1 . 2]" 1
154 1 181 SER H 1 182 ILE H 3.830 . 5.860 4.339 4.303 4.433 . 0 0 "[ . 1 . 2]" 1
155 1 182 ILE H 1 183 SER H 4.010 . 6.220 4.483 4.198 4.539 . 0 0 "[ . 1 . 2]" 1
156 1 182 ILE H 1 194 ARG H 3.730 . 5.660 4.811 4.675 5.017 . 0 0 "[ . 1 . 2]" 1
157 1 182 ILE H 1 193 TYR HD2 3.430 . 6.060 5.642 4.400 5.855 . 0 0 "[ . 1 . 2]" 1
158 1 182 ILE H 1 193 TYR HB3 3.630 . 5.460 4.293 4.034 5.577 0.117 11 0 "[ . 1 . 2]" 1
159 1 182 ILE H 1 193 TYR HB2 3.160 . 4.520 2.857 2.496 4.755 0.235 11 0 "[ . 1 . 2]" 1
160 1 170 VAL MG2 1 182 ILE H 4.030 . 6.260 4.675 4.454 4.949 . 0 0 "[ . 1 . 2]" 1
161 1 182 ILE H 1 195 ILE MD 3.530 . 5.260 3.864 3.507 4.071 . 0 0 "[ . 1 . 2]" 1
162 1 193 TYR H 1 194 ARG H 3.550 . 5.300 4.514 4.341 4.561 . 0 0 "[ . 1 . 2]" 1
163 1 193 TYR H 1 193 TYR HD2 2.930 . 4.060 3.192 2.352 3.418 . 0 0 "[ . 1 . 2]" 1
164 1 193 TYR H 1 193 TYR HB3 3.290 . 4.780 3.633 3.402 3.721 . 0 0 "[ . 1 . 2]" 1
165 1 193 TYR H 1 193 TYR HB2 3.170 . 4.540 2.720 2.544 3.673 . 0 0 "[ . 1 . 2]" 1
166 1 193 TYR H 1 205 VAL MG2 3.800 . 5.800 5.022 4.851 5.155 . 0 0 "[ . 1 . 2]" 1
167 1 193 TYR H 1 228 LEU MD2 3.630 . 5.460 5.450 4.998 5.735 0.275 20 0 "[ . 1 . 2]" 1
168 1 85 PHE H 1 86 VAL H 3.700 . 5.600 4.442 4.408 4.478 . 0 0 "[ . 1 . 2]" 1
169 1 85 PHE H 1 85 PHE HD1 3.190 . 4.580 2.579 2.427 2.921 . 0 0 "[ . 1 . 2]" 1
170 1 85 PHE H 1 85 PHE HB2 3.250 . 4.700 2.489 2.444 2.551 . 0 0 "[ . 1 . 2]" 1
171 1 85 PHE H 1 85 PHE HB3 3.400 . 5.000 3.683 3.652 3.723 . 0 0 "[ . 1 . 2]" 1
172 1 85 PHE H 1 135 ILE MD 4.180 . 6.560 5.835 5.021 6.574 0.014 8 0 "[ . 1 . 2]" 1
173 1 168 PHE HB2 1 183 SER H 3.500 . 5.200 4.274 3.940 4.867 . 0 0 "[ . 1 . 2]" 1
174 1 214 LEU H 1 215 ALA H 3.010 . 4.220 2.574 2.509 2.641 . 0 0 "[ . 1 . 2]" 1
175 1 214 LEU H 1 216 GLU H 3.590 . 5.380 4.338 4.190 4.491 . 0 0 "[ . 1 . 2]" 1
176 1 214 LEU H 1 214 LEU MD1 3.440 . 5.080 4.167 4.115 4.244 . 0 0 "[ . 1 . 2]" 1
177 1 141 LEU MD1 1 214 LEU H 3.560 . 5.320 3.408 2.628 4.074 . 0 0 "[ . 1 . 2]" 1
178 1 170 VAL MG1 1 171 ARG H 2.710 . 3.620 2.591 2.276 2.978 . 0 0 "[ . 1 . 2]" 1
179 1 171 ARG H 1 195 ILE MD 3.480 . 5.160 4.215 3.604 4.755 . 0 0 "[ . 1 . 2]" 1
180 1 169 LEU MD1 1 171 ARG H 3.030 . 4.260 3.225 2.848 3.670 . 0 0 "[ . 1 . 2]" 1
181 1 153 ARG H 1 154 ASN H 2.930 . 4.060 2.751 2.654 2.860 . 0 0 "[ . 1 . 2]" 1
182 1 153 ARG H 1 155 ALA H 3.720 . 5.640 4.277 3.912 4.573 . 0 0 "[ . 1 . 2]" 1
183 1 153 ARG H 1 155 ALA MB 4.070 . 6.340 4.977 4.463 5.370 . 0 0 "[ . 1 . 2]" 1
184 1 193 TYR HD1 1 194 ARG H 3.800 . 5.800 5.747 4.244 6.053 0.253 13 0 "[ . 1 . 2]" 1
185 1 193 TYR HB3 1 194 ARG H 3.480 . 5.160 3.045 2.843 3.944 . 0 0 "[ . 1 . 2]" 1
186 1 193 TYR HB2 1 194 ARG H 3.390 . 4.980 3.759 3.209 4.031 . 0 0 "[ . 1 . 2]" 1
187 1 85 PHE H 1 109 VAL H 3.410 . 5.020 3.675 3.310 4.131 . 0 0 "[ . 1 . 2]" 1
188 1 109 VAL H 1 110 LEU H 3.660 . 5.520 4.396 4.229 4.536 . 0 0 "[ . 1 . 2]" 1
189 1 85 PHE HD1 1 109 VAL H 2.960 . 4.120 3.013 2.563 3.471 . 0 0 "[ . 1 . 2]" 1
190 1 109 VAL H 1 109 VAL MG1 3.140 . 4.480 3.799 3.717 3.845 . 0 0 "[ . 1 . 2]" 1
191 1 109 VAL H 1 109 VAL MG2 2.790 . 3.780 2.484 2.353 2.691 . 0 0 "[ . 1 . 2]" 1
192 1 103 LYS H 1 105 GLU H 3.660 . 5.520 4.650 4.459 4.969 . 0 0 "[ . 1 . 2]" 1
193 1 90 ASP H 1 103 LYS H 3.020 . 4.240 4.190 3.946 4.357 0.117 19 0 "[ . 1 . 2]" 1
194 1 87 ALA MB 1 103 LYS H 3.250 . 4.700 4.530 3.938 4.811 0.111 4 0 "[ . 1 . 2]" 1
195 1 158 TYR HB3 1 159 LEU H 2.850 . 3.900 3.130 2.575 4.097 0.197 13 0 "[ . 1 . 2]" 1
196 1 155 ALA MB 1 159 LEU H 3.660 . 5.520 4.645 4.443 4.844 . 0 0 "[ . 1 . 2]" 1
197 1 159 LEU H 1 159 LEU MD1 3.110 . 4.420 3.451 3.324 3.571 . 0 0 "[ . 1 . 2]" 1
198 1 159 LEU H 1 160 LEU MD1 4.030 . 6.260 5.620 5.276 5.858 . 0 0 "[ . 1 . 2]" 1
199 1 152 SER H 1 153 ARG H 3.730 . 5.660 4.599 4.530 4.669 . 0 0 "[ . 1 . 2]" 1
200 1 152 SER H 1 155 ALA H 3.370 . 4.940 3.843 3.496 4.305 . 0 0 "[ . 1 . 2]" 1
201 1 152 SER H 1 155 ALA MB 2.780 . 3.760 2.467 2.046 2.967 . 0 0 "[ . 1 . 2]" 1
202 1 151 VAL MG2 1 152 SER H 3.270 . 4.740 4.005 3.790 4.279 . 0 0 "[ . 1 . 2]" 1
203 1 164 ILE H 1 167 SER H 4.040 . 6.280 4.354 3.926 4.596 . 0 0 "[ . 1 . 2]" 1
204 1 167 SER H 1 184 LEU MD1 3.160 . 4.520 3.308 3.026 3.780 . 0 0 "[ . 1 . 2]" 1
205 1 164 ILE MD 1 167 SER H 3.550 . 5.300 5.146 4.702 5.370 0.070 2 0 "[ . 1 . 2]" 1
206 1 91 PHE H 1 92 VAL H 3.550 . 5.300 4.300 3.810 4.489 . 0 0 "[ . 1 . 2]" 1
207 1 91 PHE H 1 91 PHE HD2 3.390 . 4.980 4.621 4.524 4.765 . 0 0 "[ . 1 . 2]" 1
208 1 91 PHE H 1 91 PHE HB3 3.020 . 4.240 2.671 2.495 2.897 . 0 0 "[ . 1 . 2]" 1
209 1 91 PHE H 1 101 ILE MD 3.360 . 4.920 3.691 3.383 4.041 . 0 0 "[ . 1 . 2]" 1
210 1 99 LEU H 1 129 TRP H 3.260 . 4.720 3.706 2.907 4.744 0.024 3 0 "[ . 1 . 2]" 1
211 1 98 THR H 1 99 LEU H 3.750 . 5.700 4.616 4.535 4.672 . 0 0 "[ . 1 . 2]" 1
212 1 91 PHE HE2 1 99 LEU H 2.990 . 4.180 2.910 2.518 3.570 . 0 0 "[ . 1 . 2]" 1
213 1 99 LEU H 1 118 TRP HZ3 3.510 . 5.220 3.539 2.946 3.868 . 0 0 "[ . 1 . 2]" 1
214 1 93 ALA MB 1 99 LEU H 3.200 . 4.600 3.715 3.062 4.421 . 0 0 "[ . 1 . 2]" 1
215 1 99 LEU H 1 130 VAL MG1 2.900 . 4.000 2.960 2.596 3.275 . 0 0 "[ . 1 . 2]" 1
216 1 182 ILE H 1 195 ILE H 3.490 . 5.180 4.029 3.820 4.226 . 0 0 "[ . 1 . 2]" 1
217 1 180 ARG H 1 195 ILE H 3.490 . 5.180 4.336 4.104 4.600 . 0 0 "[ . 1 . 2]" 1
218 1 194 ARG H 1 195 ILE H 3.830 . 5.860 4.352 4.182 4.549 . 0 0 "[ . 1 . 2]" 1
219 1 195 ILE H 1 196 ASN H 4.020 . 6.240 4.171 4.116 4.342 . 0 0 "[ . 1 . 2]" 1
220 1 195 ILE H 1 195 ILE MD 3.270 . 4.740 3.798 3.615 3.886 . 0 0 "[ . 1 . 2]" 1
221 1 254 TRP H 1 255 GLU H 3.760 . 5.720 4.545 4.337 4.681 . 0 0 "[ . 1 . 2]" 1
222 1 115 ASN H 1 117 GLU H 3.440 . 5.080 3.664 3.431 3.937 . 0 0 "[ . 1 . 2]" 1
223 1 244 VAL H 1 244 VAL MG2 2.890 . 3.980 2.277 2.033 2.590 . 0 0 "[ . 1 . 2]" 1
224 1 74 LEU MD2 1 75 ALA H 3.910 . 6.020 4.511 4.079 4.716 . 0 0 "[ . 1 . 2]" 1
225 1 146 TRP H 1 147 TYR H 3.110 . 4.420 2.743 2.511 2.875 . 0 0 "[ . 1 . 2]" 1
226 1 214 LEU H 1 217 LEU H 3.920 . 6.040 4.702 4.633 4.760 . 0 0 "[ . 1 . 2]" 1
227 1 215 ALA H 1 217 LEU H 3.490 . 5.180 4.006 3.934 4.056 . 0 0 "[ . 1 . 2]" 1
228 1 216 GLU H 1 217 LEU H 2.810 . 3.820 2.598 2.509 2.693 . 0 0 "[ . 1 . 2]" 1
229 1 211 PHE HE1 1 217 LEU H 3.640 . 5.480 5.406 5.203 5.558 0.078 12 0 "[ . 1 . 2]" 1
230 1 211 PHE HB3 1 217 LEU H 3.410 . 5.020 3.641 3.239 4.040 . 0 0 "[ . 1 . 2]" 1
231 1 211 PHE HB2 1 217 LEU H 3.320 . 4.840 3.234 3.100 3.371 . 0 0 "[ . 1 . 2]" 1
232 1 215 ALA MB 1 217 LEU H 3.640 . 5.480 4.476 4.364 4.560 . 0 0 "[ . 1 . 2]" 1
233 1 217 LEU H 1 217 LEU MD2 3.530 . 5.260 4.306 4.276 4.333 . 0 0 "[ . 1 . 2]" 1
234 1 74 LEU MD2 1 217 LEU H 4.040 . 6.280 5.323 4.710 6.310 0.030 5 0 "[ . 1 . 2]" 1
235 1 203 LEU MD2 1 217 LEU H 4.270 . 6.740 5.055 4.815 5.343 . 0 0 "[ . 1 . 2]" 1
236 1 217 LEU H 1 217 LEU MD1 3.440 . 5.080 4.313 4.278 4.338 . 0 0 "[ . 1 . 2]" 1
237 1 204 TYR HD2 1 205 VAL H 3.460 . 5.120 4.404 4.043 4.628 . 0 0 "[ . 1 . 2]" 1
238 1 205 VAL H 1 217 LEU MD2 3.490 . 5.180 3.299 3.029 3.755 . 0 0 "[ . 1 . 2]" 1
239 1 211 PHE HD2 1 212 ASN H 3.940 . 6.080 4.805 4.597 5.039 . 0 0 "[ . 1 . 2]" 1
240 1 148 HIS H 1 170 VAL H 3.160 . 4.520 4.020 3.753 4.268 . 0 0 "[ . 1 . 2]" 1
241 1 146 TRP HE3 1 170 VAL H 3.350 . 4.900 2.661 2.393 3.235 . 0 0 "[ . 1 . 2]" 1
242 1 170 VAL H 1 170 VAL MG2 2.860 . 3.920 2.686 2.375 2.861 . 0 0 "[ . 1 . 2]" 1
243 1 203 LEU H 1 204 TYR H 3.680 . 5.560 4.561 4.435 4.629 . 0 0 "[ . 1 . 2]" 1
244 1 202 LYS H 1 203 LEU H 3.630 . 5.460 4.592 4.503 4.684 . 0 0 "[ . 1 . 2]" 1
245 1 203 LEU H 1 211 PHE HD1 3.110 . 4.420 4.337 4.120 4.472 0.052 18 0 "[ . 1 . 2]" 1
246 1 203 LEU H 1 204 TYR HD1 3.600 . 5.400 4.384 4.098 4.623 . 0 0 "[ . 1 . 2]" 1
247 1 203 LEU H 1 211 PHE HB2 3.290 . 4.780 3.913 3.588 4.276 . 0 0 "[ . 1 . 2]" 1
248 1 198 ALA MB 1 203 LEU H 3.960 . 6.120 4.962 4.440 5.456 . 0 0 "[ . 1 . 2]" 1
249 1 203 LEU H 1 203 LEU MD2 2.690 . 3.580 2.053 1.784 2.467 0.016 18 0 "[ . 1 . 2]" 1
250 1 102 THR H 1 105 GLU H 3.520 . 5.240 4.392 4.033 4.858 . 0 0 "[ . 1 . 2]" 1
251 1 101 ILE MD 1 102 THR H 3.570 . 5.340 4.605 4.124 4.831 . 0 0 "[ . 1 . 2]" 1
252 1 102 THR H 1 107 LEU MD2 3.610 . 5.420 4.512 4.077 4.942 . 0 0 "[ . 1 . 2]" 1
253 1 85 PHE H 1 107 LEU H 2.900 . 4.000 3.429 3.257 3.834 . 0 0 "[ . 1 . 2]" 1
254 1 86 VAL H 1 107 LEU H 3.530 . 5.260 4.589 4.176 4.837 . 0 0 "[ . 1 . 2]" 1
255 1 85 PHE HA 1 107 LEU H 3.690 . 5.580 4.895 4.772 5.094 . 0 0 "[ . 1 . 2]" 1
256 1 85 PHE HB2 1 107 LEU H 3.200 . 4.600 3.921 3.760 4.185 . 0 0 "[ . 1 . 2]" 1
257 1 85 PHE HB3 1 107 LEU H 3.450 . 5.100 4.681 4.325 4.840 . 0 0 "[ . 1 . 2]" 1
258 1 84 LEU MD1 1 107 LEU H 2.830 . 3.860 2.992 2.710 3.523 . 0 0 "[ . 1 . 2]" 1
259 1 211 PHE H 1 212 ASN H 3.590 . 5.380 4.467 4.381 4.551 . 0 0 "[ . 1 . 2]" 1
260 1 211 PHE H 1 211 PHE HD1 2.880 . 3.960 2.665 2.407 2.913 . 0 0 "[ . 1 . 2]" 1
261 1 204 TYR HD1 1 211 PHE H 3.420 . 5.040 3.939 3.496 4.300 . 0 0 "[ . 1 . 2]" 1
262 1 211 PHE H 1 211 PHE HB3 3.340 . 4.880 3.825 3.741 3.957 . 0 0 "[ . 1 . 2]" 1
263 1 204 TYR HB3 1 211 PHE H 3.500 . 5.200 2.915 2.566 3.261 . 0 0 "[ . 1 . 2]" 1
264 1 211 PHE H 1 211 PHE HB2 3.100 . 4.400 2.960 2.813 3.103 . 0 0 "[ . 1 . 2]" 1
265 1 203 LEU MD2 1 211 PHE H 3.530 . 5.260 4.975 4.633 5.295 0.035 14 0 "[ . 1 . 2]" 1
266 1 93 ALA H 1 101 ILE H 3.770 . 5.740 5.027 4.655 5.267 . 0 0 "[ . 1 . 2]" 1
267 1 92 VAL H 1 101 ILE H 4.030 . 6.260 4.971 4.794 5.158 . 0 0 "[ . 1 . 2]" 1
268 1 91 PHE HD2 1 101 ILE H 2.900 . 4.000 3.403 3.139 3.615 . 0 0 "[ . 1 . 2]" 1
269 1 101 ILE H 1 130 VAL MG1 3.440 . 5.080 4.222 3.911 4.618 . 0 0 "[ . 1 . 2]" 1
270 1 101 ILE H 1 101 ILE MD 3.280 . 4.760 3.898 3.783 3.999 . 0 0 "[ . 1 . 2]" 1
271 1 204 TYR HD2 1 206 SER H 3.350 . 4.900 3.513 3.355 3.623 . 0 0 "[ . 1 . 2]" 1
272 1 204 TYR HB3 1 206 SER H 3.890 . 5.980 4.464 4.200 4.763 . 0 0 "[ . 1 . 2]" 1
273 1 155 ALA H 1 156 ALA H 3.130 . 4.460 2.617 2.513 2.733 . 0 0 "[ . 1 . 2]" 1
274 1 106 LYS H 1 107 LEU H 3.710 . 5.620 4.535 4.384 4.616 . 0 0 "[ . 1 . 2]" 1
275 1 105 GLU H 1 106 LYS H 3.730 . 5.660 4.555 4.421 4.647 . 0 0 "[ . 1 . 2]" 1
276 1 168 PHE H 1 169 LEU H 3.500 . 5.200 4.406 4.336 4.485 . 0 0 "[ . 1 . 2]" 1
277 1 168 PHE H 1 168 PHE HB3 3.250 . 4.700 3.206 3.064 3.384 . 0 0 "[ . 1 . 2]" 1
278 1 168 PHE H 1 184 LEU MD1 3.470 . 5.140 3.760 3.484 4.097 . 0 0 "[ . 1 . 2]" 1
279 1 141 LEU MD2 1 215 ALA H 3.370 . 4.940 2.854 2.394 3.578 . 0 0 "[ . 1 . 2]" 1
280 1 124 LYS H 1 125 ASN H 3.470 . 5.140 2.524 2.424 2.664 . 0 0 "[ . 1 . 2]" 1
281 1 238 LYS H 1 239 ARG H 3.740 . 5.680 4.642 4.383 4.719 . 0 0 "[ . 1 . 2]" 1
282 1 159 LEU MD2 1 239 ARG H 3.300 . 4.800 3.369 2.509 3.923 . 0 0 "[ . 1 . 2]" 1
283 1 171 ARG H 1 172 GLU H 3.590 . 5.380 4.379 4.284 4.441 . 0 0 "[ . 1 . 2]" 1
284 1 172 GLU H 1 173 SER H 3.730 . 5.660 4.474 4.361 4.601 . 0 0 "[ . 1 . 2]" 1
285 1 149 GLY H 1 172 GLU H 3.730 . 5.660 3.881 3.389 4.316 . 0 0 "[ . 1 . 2]" 1
286 1 74 LEU H 1 74 LEU MD1 3.050 . 4.300 3.980 3.765 4.201 . 0 0 "[ . 1 . 2]" 1
287 1 119 ALA H 1 132 SER H 3.100 . 4.400 4.188 3.424 4.439 0.039 7 0 "[ . 1 . 2]" 1
288 1 132 SER H 1 134 TYR H 3.580 . 5.360 4.412 4.075 4.584 . 0 0 "[ . 1 . 2]" 1
289 1 132 SER H 1 134 TYR HB2 3.940 . 6.080 5.587 5.198 5.899 . 0 0 "[ . 1 . 2]" 1
290 1 190 VAL H 1 191 TYR H 3.630 . 5.460 4.272 4.173 4.387 . 0 0 "[ . 1 . 2]" 1
291 1 190 VAL H 1 191 TYR HD1 3.610 . 5.420 5.326 5.110 5.502 0.082 15 0 "[ . 1 . 2]" 1
292 1 190 VAL H 1 191 TYR HE1 3.670 . 5.540 5.476 5.215 5.652 0.112 12 0 "[ . 1 . 2]" 1
293 1 190 VAL H 1 190 VAL MG2 2.550 . 3.300 2.445 2.314 2.568 . 0 0 "[ . 1 . 2]" 1
294 1 178 GLY H 1 179 GLN H 2.760 . 3.720 2.868 2.610 3.138 . 0 0 "[ . 1 . 2]" 1
295 1 93 ALA H 1 100 SER H 2.990 . 4.180 3.879 3.476 4.193 0.013 15 0 "[ . 1 . 2]" 1
296 1 52 VAL H 1 52 VAL MG2 3.460 . 5.120 2.798 1.974 3.869 . 0 0 "[ . 1 . 2]" 1
297 1 107 LEU H 1 108 ARG H 3.590 . 5.380 4.378 4.298 4.512 . 0 0 "[ . 1 . 2]" 1
298 1 108 ARG H 1 121 ALA MB 3.200 . 4.600 3.625 2.934 4.161 . 0 0 "[ . 1 . 2]" 1
299 1 108 ARG H 1 109 VAL MG2 4.060 . 6.320 4.881 4.638 5.137 . 0 0 "[ . 1 . 2]" 1
300 1 100 SER H 1 101 ILE H 3.640 . 5.480 4.511 4.392 4.615 . 0 0 "[ . 1 . 2]" 1
301 1 93 ALA MB 1 100 SER H 2.780 . 3.760 2.605 2.174 2.930 . 0 0 "[ . 1 . 2]" 1
302 1 100 SER H 1 130 VAL MG1 3.740 . 5.680 4.713 4.526 5.077 . 0 0 "[ . 1 . 2]" 1
303 1 99 LEU MD1 1 100 SER H 2.520 . 3.240 2.349 2.092 2.744 . 0 0 "[ . 1 . 2]" 1
304 1 215 ALA H 1 218 VAL H 3.930 . 6.060 4.877 4.814 4.968 . 0 0 "[ . 1 . 2]" 1
305 1 218 VAL H 1 219 HIS H 2.900 . 4.000 2.708 2.654 2.770 . 0 0 "[ . 1 . 2]" 1
306 1 126 GLY H 1 127 GLN H 3.660 . 5.520 4.446 4.211 4.539 . 0 0 "[ . 1 . 2]" 1
307 1 217 LEU H 1 218 VAL H 2.920 . 4.040 2.954 2.888 3.048 . 0 0 "[ . 1 . 2]" 1
308 1 73 LEU MD2 1 218 VAL H 3.730 . 5.660 4.553 4.059 5.030 . 0 0 "[ . 1 . 2]" 1
309 1 218 VAL H 1 218 VAL MG2 2.810 . 3.820 2.202 2.116 2.286 . 0 0 "[ . 1 . 2]" 1
310 1 168 PHE H 1 234 TYR H 3.410 . 5.020 4.100 3.741 4.543 . 0 0 "[ . 1 . 2]" 1
311 1 219 HIS H 1 221 HIS H 3.630 . 5.460 4.051 3.902 4.197 . 0 0 "[ . 1 . 2]" 1
312 1 216 GLU H 1 219 HIS H 4.020 . 6.240 4.695 4.531 4.822 . 0 0 "[ . 1 . 2]" 1
313 1 219 HIS H 1 222 SER H 4.220 . 6.640 4.692 4.626 4.799 . 0 0 "[ . 1 . 2]" 1
314 1 217 LEU H 1 219 HIS H 3.460 . 5.120 4.174 4.009 4.334 . 0 0 "[ . 1 . 2]" 1
315 1 73 LEU MD2 1 219 HIS H 3.270 . 4.740 2.801 2.391 3.180 . 0 0 "[ . 1 . 2]" 1
316 1 218 VAL H 1 220 HIS H 3.430 . 5.060 4.564 4.414 4.736 . 0 0 "[ . 1 . 2]" 1
317 1 217 LEU MD1 1 220 HIS H 3.890 . 5.980 5.126 4.933 5.328 . 0 0 "[ . 1 . 2]" 1
318 1 220 HIS H 1 232 LEU MD1 4.170 . 6.540 5.822 5.395 6.106 . 0 0 "[ . 1 . 2]" 1
319 1 210 ARG H 1 211 PHE H 3.720 . 5.640 4.480 4.344 4.607 . 0 0 "[ . 1 . 2]" 1
320 1 209 SER H 1 210 ARG H 2.890 . 3.980 3.885 3.570 4.006 0.026 16 0 "[ . 1 . 2]" 1
321 1 210 ARG H 1 211 PHE HE2 3.880 . 5.960 5.605 5.252 6.000 0.040 15 0 "[ . 1 . 2]" 1
322 1 204 TYR HD1 1 210 ARG H 3.860 . 5.920 5.975 5.837 6.033 0.113 12 0 "[ . 1 . 2]" 1
323 1 56 PHE H 1 56 PHE HD1 3.870 . 5.940 4.451 1.981 5.302 . 0 0 "[ . 1 . 2]" 1
324 1 56 PHE H 1 56 PHE HD2 4.160 . 6.520 3.494 2.205 5.061 . 0 0 "[ . 1 . 2]" 1
325 1 204 TYR HD2 1 209 SER H 3.240 . 4.680 4.702 4.438 4.788 0.108 4 0 "[ . 1 . 2]" 1
326 1 204 TYR HB2 1 209 SER H 3.510 . 5.220 4.117 3.983 4.357 . 0 0 "[ . 1 . 2]" 1
327 1 246 GLY H 1 247 VAL H 3.430 . 5.060 3.115 2.724 3.524 . 0 0 "[ . 1 . 2]" 1
328 1 247 VAL H 1 247 VAL MG1 2.650 . 3.500 2.664 2.019 3.689 0.189 13 0 "[ . 1 . 2]" 1
329 1 174 GLU H 1 176 SER H 3.470 . 5.140 3.981 3.759 4.251 . 0 0 "[ . 1 . 2]" 1
330 1 175 SER H 1 176 SER H 3.120 . 4.440 2.537 2.391 2.699 . 0 0 "[ . 1 . 2]" 1
331 1 198 ALA H 1 200 ASP H 3.800 . 5.800 5.134 4.892 5.457 . 0 0 "[ . 1 . 2]" 1
332 1 198 ALA MB 1 200 ASP H 2.960 . 4.120 2.795 2.455 2.985 . 0 0 "[ . 1 . 2]" 1
333 1 232 LEU H 1 233 HIS H 3.670 . 5.540 4.528 4.181 4.736 . 0 0 "[ . 1 . 2]" 1
334 1 225 ALA MB 1 232 LEU H 4.140 . 6.480 5.995 5.486 6.408 . 0 0 "[ . 1 . 2]" 1
335 1 184 LEU MD1 1 232 LEU H 3.520 . 5.240 4.430 4.114 4.764 . 0 0 "[ . 1 . 2]" 1
336 1 228 LEU MD1 1 232 LEU H 3.100 . 4.400 3.098 2.958 3.417 . 0 0 "[ . 1 . 2]" 1
337 1 232 LEU H 1 232 LEU MD2 2.740 . 3.680 3.212 3.048 3.393 . 0 0 "[ . 1 . 2]" 1
338 1 83 ASN H 1 84 LEU H 2.620 . 3.440 2.553 2.310 2.748 . 0 0 "[ . 1 . 2]" 1
339 1 84 LEU H 1 138 VAL H 3.750 . 5.700 4.824 4.460 4.987 . 0 0 "[ . 1 . 2]" 1
340 1 84 LEU H 1 85 PHE HD1 3.650 . 5.500 4.237 3.854 4.946 . 0 0 "[ . 1 . 2]" 1
341 1 84 LEU H 1 138 VAL MG2 3.120 . 4.440 4.530 4.345 4.648 0.208 14 0 "[ . 1 . 2]" 1
342 1 227 GLY H 1 228 LEU H 2.680 . 3.560 2.098 1.984 2.186 . 0 0 "[ . 1 . 2]" 1
343 1 193 TYR HE1 1 228 LEU H 4.150 . 6.500 6.352 5.395 6.536 0.036 12 0 "[ . 1 . 2]" 1
344 1 228 LEU H 1 230 THR H 4.410 . 7.020 5.048 4.913 5.176 . 0 0 "[ . 1 . 2]" 1
345 1 225 ALA MB 1 228 LEU H 2.850 . 3.900 4.036 3.906 4.112 0.212 16 0 "[ . 1 . 2]" 1
346 1 205 VAL MG1 1 228 LEU H 3.390 . 4.980 4.939 4.766 5.123 0.143 7 0 "[ . 1 . 2]" 1
347 1 228 LEU H 1 228 LEU MD1 3.070 . 4.340 3.896 3.802 4.099 . 0 0 "[ . 1 . 2]" 1
348 1 228 LEU H 1 228 LEU MD2 2.900 . 4.000 2.860 2.727 3.238 . 0 0 "[ . 1 . 2]" 1
349 1 142 GLU H 1 144 HIS H 3.430 . 5.060 4.334 4.272 4.459 . 0 0 "[ . 1 . 2]" 1
350 1 143 LYS H 1 144 HIS H 2.980 . 4.160 2.703 2.594 2.798 . 0 0 "[ . 1 . 2]" 1
351 1 144 HIS H 1 147 TYR HD2 3.860 . 5.920 5.410 4.934 5.833 . 0 0 "[ . 1 . 2]" 1
352 1 141 LEU MD2 1 144 HIS H 3.920 . 6.040 5.458 5.127 6.001 . 0 0 "[ . 1 . 2]" 1
353 1 198 ALA H 1 202 LYS H 2.860 . 3.920 3.559 3.053 3.920 0.000 8 0 "[ . 1 . 2]" 1
354 1 201 GLY H 1 202 LYS H 2.550 . 3.300 2.237 2.128 2.518 . 0 0 "[ . 1 . 2]" 1
355 1 200 ASP H 1 202 LYS H 2.760 . 3.720 3.674 3.519 3.853 0.133 18 0 "[ . 1 . 2]" 1
356 1 198 ALA MB 1 202 LYS H 2.710 . 3.620 2.250 1.971 2.728 . 0 0 "[ . 1 . 2]" 1
357 1 202 LYS H 1 203 LEU MD1 3.740 . 5.680 5.044 4.786 5.312 . 0 0 "[ . 1 . 2]" 1
358 1 193 TYR HE1 1 229 ILE H 3.030 . 5.260 5.152 3.651 5.599 0.339 20 0 "[ . 1 . 2]" 1
359 1 191 TYR HB2 1 229 ILE H 3.370 . 4.940 4.960 4.765 5.134 0.194 11 0 "[ . 1 . 2]" 1
360 1 184 LEU MD2 1 229 ILE H 2.930 . 4.060 3.766 2.662 4.083 0.023 2 0 "[ . 1 . 2]" 1
361 1 228 LEU MD2 1 229 ILE H 3.450 . 5.100 3.972 3.815 4.071 . 0 0 "[ . 1 . 2]" 1
362 1 85 PHE HB2 1 86 VAL H 3.410 . 5.020 3.545 3.475 3.736 . 0 0 "[ . 1 . 2]" 1
363 1 85 PHE HB3 1 86 VAL H 3.360 . 4.920 2.258 2.198 2.439 . 0 0 "[ . 1 . 2]" 1
364 1 121 ALA H 1 130 VAL H 3.530 . 5.260 3.483 3.131 3.893 . 0 0 "[ . 1 . 2]" 1
365 1 130 VAL H 1 130 VAL MG1 3.110 . 4.420 2.886 2.604 3.128 . 0 0 "[ . 1 . 2]" 1
366 1 119 ALA MB 1 130 VAL H 3.480 . 5.160 3.636 3.290 4.216 . 0 0 "[ . 1 . 2]" 1
367 1 130 VAL H 1 130 VAL MG2 2.920 . 4.040 2.391 2.236 2.615 . 0 0 "[ . 1 . 2]" 1
368 1 108 ARG H 1 123 THR H 3.790 . 5.780 4.966 4.610 5.199 . 0 0 "[ . 1 . 2]" 1
369 1 121 ALA MB 1 123 THR H 3.680 . 5.560 4.401 4.115 4.872 . 0 0 "[ . 1 . 2]" 1
370 1 99 LEU MD2 1 123 THR H 2.680 . 3.560 2.502 1.816 3.010 . 0 0 "[ . 1 . 2]" 1
371 1 172 GLU H 1 181 SER H 3.870 . 5.940 5.089 4.912 5.281 . 0 0 "[ . 1 . 2]" 1
372 1 181 SER H 1 195 ILE MD 3.220 . 4.640 3.536 3.141 4.060 . 0 0 "[ . 1 . 2]" 1
373 1 88 LEU H 1 104 GLY H 3.630 . 5.460 4.933 4.660 5.074 . 0 0 "[ . 1 . 2]" 1
374 1 104 GLY H 1 105 GLU H 2.610 . 3.420 2.478 2.264 2.904 . 0 0 "[ . 1 . 2]" 1
375 1 89 TYR H 1 104 GLY H 3.690 . 5.580 4.971 4.510 5.502 . 0 0 "[ . 1 . 2]" 1
376 1 87 ALA MB 1 104 GLY H 2.780 . 3.760 2.933 2.477 3.488 . 0 0 "[ . 1 . 2]" 1
377 1 86 VAL MG2 1 104 GLY H 2.850 . 3.900 3.389 2.935 3.845 . 0 0 "[ . 1 . 2]" 1
378 1 168 PHE HD2 1 169 LEU H 3.170 . 4.540 3.245 2.806 3.633 . 0 0 "[ . 1 . 2]" 1
379 1 168 PHE HB2 1 169 LEU H 3.080 . 4.360 2.461 2.173 2.693 . 0 0 "[ . 1 . 2]" 1
380 1 169 LEU H 1 236 ALA MB 3.680 . 5.560 4.636 4.377 5.185 . 0 0 "[ . 1 . 2]" 1
381 1 160 LEU MD1 1 169 LEU H 3.220 . 4.640 3.516 3.190 4.070 . 0 0 "[ . 1 . 2]" 1
382 1 169 LEU H 1 169 LEU MD2 3.630 . 5.460 3.896 3.654 3.990 . 0 0 "[ . 1 . 2]" 1
383 1 122 GLN H 1 123 THR H 3.470 . 5.140 4.176 4.062 4.347 . 0 0 "[ . 1 . 2]" 1
384 1 108 ARG H 1 122 GLN H 2.620 . 3.440 2.758 2.434 3.219 . 0 0 "[ . 1 . 2]" 1
385 1 121 ALA MB 1 122 GLN H 2.790 . 3.780 2.760 2.342 3.041 . 0 0 "[ . 1 . 2]" 1
386 1 110 LEU MD2 1 122 GLN H 3.410 . 5.020 3.626 2.935 4.387 . 0 0 "[ . 1 . 2]" 1
387 1 109 VAL MG2 1 122 GLN H 3.730 . 5.660 4.789 4.425 5.171 . 0 0 "[ . 1 . 2]" 1
388 1 86 VAL H 1 136 THR H 2.860 . 3.920 2.630 2.436 2.870 . 0 0 "[ . 1 . 2]" 1
389 1 85 PHE HD2 1 136 THR H 2.960 . 4.120 3.426 3.066 3.732 . 0 0 "[ . 1 . 2]" 1
390 1 85 PHE HB2 1 136 THR H 3.660 . 5.520 4.845 4.456 5.170 . 0 0 "[ . 1 . 2]" 1
391 1 85 PHE HB3 1 136 THR H 3.220 . 4.640 3.131 2.754 3.437 . 0 0 "[ . 1 . 2]" 1
392 1 86 VAL MG1 1 136 THR H 2.800 . 3.800 3.285 3.089 3.433 . 0 0 "[ . 1 . 2]" 1
393 1 107 LEU MD1 1 136 THR H 3.020 . 4.240 3.844 3.644 4.116 . 0 0 "[ . 1 . 2]" 1
394 1 109 VAL MG2 1 136 THR H 3.800 . 5.800 5.336 4.863 5.870 0.070 7 0 "[ . 1 . 2]" 1
395 1 154 ASN H 1 155 ALA H 3.160 . 4.520 2.755 2.634 2.855 . 0 0 "[ . 1 . 2]" 1
396 1 154 ASN H 1 155 ALA MB 3.690 . 5.580 4.424 4.307 4.545 . 0 0 "[ . 1 . 2]" 1
397 1 97 ASN H 1 98 THR H 3.350 . 4.900 2.415 2.184 2.640 . 0 0 "[ . 1 . 2]" 1
398 1 204 TYR H 1 205 VAL H 3.530 . 5.260 4.137 3.937 4.274 . 0 0 "[ . 1 . 2]" 1
399 1 204 TYR H 1 211 PHE HE1 3.400 . 5.000 5.043 4.899 5.146 0.146 12 0 "[ . 1 . 2]" 1
400 1 204 TYR H 1 217 LEU MD2 3.070 . 4.340 3.499 3.114 3.776 . 0 0 "[ . 1 . 2]" 1
401 1 203 LEU MD1 1 204 TYR H 2.990 . 4.180 3.757 3.499 3.883 . 0 0 "[ . 1 . 2]" 1
402 1 89 TYR HB2 1 90 ASP H 3.000 . 4.200 3.822 3.413 4.045 . 0 0 "[ . 1 . 2]" 1
403 1 208 GLU H 1 209 SER H 2.750 . 3.700 2.475 2.297 2.626 . 0 0 "[ . 1 . 2]" 1
404 1 204 TYR HD2 1 208 GLU H 3.540 . 5.280 4.892 4.611 5.099 . 0 0 "[ . 1 . 2]" 1
405 1 224 VAL H 1 226 ASP H 3.950 . 6.100 4.341 4.177 4.638 . 0 0 "[ . 1 . 2]" 1
406 1 225 ALA MB 1 226 ASP H 2.630 . 3.460 3.621 3.579 3.656 0.196 6 0 "[ . 1 . 2]" 1
407 1 133 ASN H 1 134 TYR H 2.920 . 4.040 2.618 2.412 2.730 . 0 0 "[ . 1 . 2]" 1
408 1 133 ASN H 1 134 TYR HB2 3.750 . 5.700 4.626 4.419 4.775 . 0 0 "[ . 1 . 2]" 1
409 1 164 ILE H 1 234 TYR HD2 4.270 . 6.740 5.832 4.491 6.285 . 0 0 "[ . 1 . 2]" 1
410 1 164 ILE H 1 164 ILE MD 3.140 . 4.480 3.724 3.598 4.008 . 0 0 "[ . 1 . 2]" 1
411 1 197 THR H 1 198 ALA H 3.470 . 5.140 4.311 4.156 4.472 . 0 0 "[ . 1 . 2]" 1
412 1 197 THR H 1 203 LEU MD1 3.580 . 5.360 4.405 3.745 4.980 . 0 0 "[ . 1 . 2]" 1
413 1 123 THR H 1 125 ASN H 3.370 . 4.940 4.407 4.131 4.662 . 0 0 "[ . 1 . 2]" 1
414 1 99 LEU MD2 1 125 ASN H 3.740 . 5.680 4.584 4.156 5.134 . 0 0 "[ . 1 . 2]" 1
415 1 215 ALA H 1 216 GLU H 2.990 . 4.180 2.756 2.691 2.836 . 0 0 "[ . 1 . 2]" 1
416 1 216 GLU H 1 218 VAL H 3.600 . 5.400 4.428 4.280 4.580 . 0 0 "[ . 1 . 2]" 1
417 1 215 ALA MB 1 216 GLU H 3.010 . 4.220 2.458 2.350 2.625 . 0 0 "[ . 1 . 2]" 1
418 1 74 LEU MD2 1 216 GLU H 3.310 . 4.820 3.788 3.179 4.910 0.090 5 0 "[ . 1 . 2]" 1
419 1 161 SER H 1 190 VAL MG2 3.360 . 4.920 4.857 4.005 5.068 0.148 8 0 "[ . 1 . 2]" 1
420 1 159 LEU H 1 160 LEU H 2.760 . 3.720 2.680 2.540 2.858 . 0 0 "[ . 1 . 2]" 1
421 1 157 GLU H 1 160 LEU H 3.940 . 6.080 4.693 4.533 4.928 . 0 0 "[ . 1 . 2]" 1
422 1 158 TYR HD1 1 160 LEU H 4.190 . 6.580 5.326 4.779 5.718 . 0 0 "[ . 1 . 2]" 1
423 1 156 ALA MB 1 160 LEU H 3.890 . 5.980 4.792 4.622 4.882 . 0 0 "[ . 1 . 2]" 1
424 1 160 LEU H 1 190 VAL MG2 3.210 . 4.620 4.361 4.058 4.773 0.153 16 0 "[ . 1 . 2]" 1
425 1 160 LEU H 1 160 LEU MD1 3.070 . 4.340 3.848 3.569 4.016 . 0 0 "[ . 1 . 2]" 1
426 1 160 LEU H 1 169 LEU MD2 3.300 . 4.800 3.555 3.370 3.725 . 0 0 "[ . 1 . 2]" 1
427 1 220 HIS H 1 222 SER H 3.280 . 4.760 4.015 3.911 4.099 . 0 0 "[ . 1 . 2]" 1
428 1 222 SER H 1 223 THR H 3.030 . 4.260 2.253 2.185 2.324 . 0 0 "[ . 1 . 2]" 1
429 1 222 SER H 1 232 LEU MD1 3.560 . 5.320 3.710 3.449 3.846 . 0 0 "[ . 1 . 2]" 1
430 1 156 ALA H 1 157 GLU H 2.750 . 3.700 2.687 2.565 2.790 . 0 0 "[ . 1 . 2]" 1
431 1 155 ALA H 1 157 GLU H 3.500 . 5.200 4.225 3.982 4.520 . 0 0 "[ . 1 . 2]" 1
432 1 157 GLU H 1 158 TYR H 2.890 . 3.980 2.549 2.407 2.761 . 0 0 "[ . 1 . 2]" 1
433 1 91 PHE HZ 1 94 SER H 3.190 . 4.580 3.425 2.694 4.293 . 0 0 "[ . 1 . 2]" 1
434 1 157 GLU H 1 158 TYR HA 4.240 . 6.680 5.201 5.100 5.407 . 0 0 "[ . 1 . 2]" 1
435 1 156 ALA MB 1 157 GLU H 2.770 . 3.740 2.530 2.356 2.746 . 0 0 "[ . 1 . 2]" 1
436 1 93 ALA MB 1 94 SER H 3.400 . 5.000 3.190 2.912 3.383 . 0 0 "[ . 1 . 2]" 1
437 1 157 GLU H 1 160 LEU MD1 3.790 . 5.780 5.240 4.537 5.782 0.002 2 0 "[ . 1 . 2]" 1
438 1 157 GLU H 1 190 VAL MG1 3.370 . 4.940 4.522 4.171 4.896 . 0 0 "[ . 1 . 2]" 1
439 1 220 HIS H 1 223 THR H 4.140 . 6.480 4.824 4.755 4.909 . 0 0 "[ . 1 . 2]" 1
440 1 221 HIS H 1 223 THR H 3.400 . 5.000 3.969 3.788 4.331 . 0 0 "[ . 1 . 2]" 1
441 1 223 THR H 1 224 VAL H 2.710 . 3.620 2.547 2.381 2.687 . 0 0 "[ . 1 . 2]" 1
442 1 166 GLY H 1 186 TYR H 3.890 . 5.980 4.478 4.249 4.685 . 0 0 "[ . 1 . 2]" 1
443 1 166 GLY H 1 167 SER H 2.720 . 3.640 2.351 2.131 2.523 . 0 0 "[ . 1 . 2]" 1
444 1 166 GLY H 1 186 TYR HB3 4.080 . 6.360 4.533 4.180 4.844 . 0 0 "[ . 1 . 2]" 1
445 1 121 ALA H 1 128 GLY H 2.860 . 3.920 3.282 2.911 3.609 . 0 0 "[ . 1 . 2]" 1
446 1 127 GLN H 1 128 GLY H 3.690 . 5.580 4.489 4.291 4.598 . 0 0 "[ . 1 . 2]" 1
447 1 99 LEU MD2 1 128 GLY H 2.570 . 3.340 2.321 2.074 2.758 . 0 0 "[ . 1 . 2]" 1
448 1 88 LEU H 1 135 ILE H 3.620 . 5.440 4.517 4.233 4.785 . 0 0 "[ . 1 . 2]" 1
449 1 133 ASN H 1 135 ILE H 3.490 . 5.180 4.053 3.803 4.186 . 0 0 "[ . 1 . 2]" 1
450 1 134 TYR H 1 135 ILE H 2.810 . 3.820 2.178 1.982 2.353 . 0 0 "[ . 1 . 2]" 1
451 1 134 TYR HB3 1 135 ILE H 3.110 . 4.420 3.981 3.815 4.180 . 0 0 "[ . 1 . 2]" 1
452 1 101 ILE MD 1 135 ILE H 3.460 . 5.120 4.775 4.423 5.191 0.071 7 0 "[ . 1 . 2]" 1
453 1 148 HIS H 1 149 GLY H 2.810 . 3.820 2.248 2.062 2.550 . 0 0 "[ . 1 . 2]" 1
454 1 147 TYR HD2 1 149 GLY H 3.110 . 4.420 3.046 2.343 3.751 . 0 0 "[ . 1 . 2]" 1
455 1 147 TYR HE2 1 149 GLY H 3.080 . 4.360 3.528 3.030 4.084 . 0 0 "[ . 1 . 2]" 1
456 1 89 TYR H 1 90 ASP H 3.650 . 5.500 4.415 4.344 4.474 . 0 0 "[ . 1 . 2]" 1
457 1 89 TYR H 1 89 TYR HD1 2.980 . 4.160 2.805 2.428 3.293 . 0 0 "[ . 1 . 2]" 1
458 1 89 TYR H 1 89 TYR HB2 3.350 . 4.900 2.769 2.682 2.896 . 0 0 "[ . 1 . 2]" 1
459 1 87 ALA MB 1 89 TYR H 3.230 . 4.660 3.219 3.009 3.442 . 0 0 "[ . 1 . 2]" 1
460 1 226 ASP H 1 227 GLY H 2.940 . 4.080 3.757 3.710 3.797 . 0 0 "[ . 1 . 2]" 1
461 1 225 ALA MB 1 227 GLY H 2.850 . 3.900 3.758 3.632 3.867 . 0 0 "[ . 1 . 2]" 1
462 1 227 GLY H 1 228 LEU MD2 4.000 . 6.200 4.488 4.258 4.915 . 0 0 "[ . 1 . 2]" 1
463 1 116 GLY H 1 117 GLU H 2.840 . 3.880 2.698 2.457 2.862 . 0 0 "[ . 1 . 2]" 1
464 1 115 ASN H 1 116 GLY H 3.010 . 4.220 2.230 2.030 2.385 . 0 0 "[ . 1 . 2]" 1
465 1 123 THR H 1 126 GLY H 2.710 . 3.620 3.266 2.891 3.618 . 0 0 "[ . 1 . 2]" 1
466 1 124 LYS H 1 126 GLY H 3.440 . 5.080 4.058 3.866 4.174 . 0 0 "[ . 1 . 2]" 1
467 1 125 ASN H 1 126 GLY H 2.630 . 3.460 2.483 2.317 2.589 . 0 0 "[ . 1 . 2]" 1
468 1 99 LEU MD1 1 126 GLY H 2.970 . 4.140 3.537 2.923 4.121 . 0 0 "[ . 1 . 2]" 1
469 1 231 THR H 1 232 LEU H 3.770 . 5.740 4.619 4.579 4.668 . 0 0 "[ . 1 . 2]" 1
470 1 230 THR H 1 231 THR H 3.560 . 5.320 4.360 4.327 4.396 . 0 0 "[ . 1 . 2]" 1
471 1 225 ALA MB 1 231 THR H 3.180 . 4.560 3.363 2.915 3.724 . 0 0 "[ . 1 . 2]" 1
472 1 184 LEU MD2 1 231 THR H 3.490 . 5.180 4.506 4.150 4.764 . 0 0 "[ . 1 . 2]" 1
473 1 212 ASN H 1 213 THR H 3.130 . 4.460 2.572 2.379 2.711 . 0 0 "[ . 1 . 2]" 1
474 1 203 LEU H 1 213 THR H 3.760 . 5.720 4.729 4.385 5.102 . 0 0 "[ . 1 . 2]" 1
475 1 213 THR H 1 216 GLU H 3.480 . 5.160 3.774 3.589 3.893 . 0 0 "[ . 1 . 2]" 1
476 1 211 PHE HA 1 213 THR H 3.540 . 5.280 4.164 3.895 4.329 . 0 0 "[ . 1 . 2]" 1
477 1 211 PHE HB3 1 213 THR H 3.150 . 4.500 3.286 2.963 3.526 . 0 0 "[ . 1 . 2]" 1
478 1 211 PHE HB2 1 213 THR H 3.230 . 4.660 3.254 2.975 3.525 . 0 0 "[ . 1 . 2]" 1
479 1 203 LEU MD2 1 213 THR H 3.250 . 4.700 3.961 3.758 4.134 . 0 0 "[ . 1 . 2]" 1
480 1 111 GLY H 1 112 TYR H 3.590 . 5.380 4.238 4.116 4.349 . 0 0 "[ . 1 . 2]" 1
481 1 111 GLY H 1 119 ALA MB 3.340 . 4.880 3.493 2.969 4.288 . 0 0 "[ . 1 . 2]" 1
482 1 109 VAL MG1 1 111 GLY H 2.680 . 3.560 2.619 2.083 3.136 . 0 0 "[ . 1 . 2]" 1
483 1 109 VAL MG2 1 111 GLY H 3.610 . 5.420 4.681 4.337 5.046 . 0 0 "[ . 1 . 2]" 1
484 1 186 TYR HA 1 188 GLY H 3.260 . 4.720 3.391 3.245 3.533 . 0 0 "[ . 1 . 2]" 1
485 1 55 ASP H 1 56 PHE H 3.520 . 5.240 2.877 1.791 4.368 0.009 3 0 "[ . 1 . 2]" 1
486 1 167 SER H 1 185 ARG H 3.250 . 4.700 3.961 3.291 4.123 . 0 0 "[ . 1 . 2]" 1
487 1 168 PHE HB3 1 185 ARG H 3.240 . 4.680 4.586 4.002 4.790 0.110 14 0 "[ . 1 . 2]" 1
488 1 160 LEU MD2 1 185 ARG H 2.800 . 3.800 3.191 2.402 3.837 0.037 3 0 "[ . 1 . 2]" 1
489 1 120 GLU H 1 129 TRP HE3 3.190 . 4.580 3.841 3.202 4.588 0.008 11 0 "[ . 1 . 2]" 1
490 1 111 GLY H 1 120 GLU H 2.860 . 3.920 3.288 2.964 3.726 . 0 0 "[ . 1 . 2]" 1
491 1 179 GLN H 1 180 ARG H 3.500 . 5.200 4.446 4.391 4.573 . 0 0 "[ . 1 . 2]" 1
492 1 87 ALA MB 1 105 GLU H 2.800 . 3.800 2.606 2.062 3.078 . 0 0 "[ . 1 . 2]" 1
493 1 86 VAL MG2 1 105 GLU H 3.190 . 4.580 3.673 3.424 4.029 . 0 0 "[ . 1 . 2]" 1
494 1 113 ASN H 1 119 ALA H 3.850 . 5.900 5.133 4.960 5.266 . 0 0 "[ . 1 . 2]" 1
495 1 113 ASN H 1 118 TRP H 3.110 . 4.420 3.267 2.956 3.677 . 0 0 "[ . 1 . 2]" 1
496 1 113 ASN H 1 116 GLY H 3.460 . 5.120 3.526 3.320 3.737 . 0 0 "[ . 1 . 2]" 1
497 1 113 ASN H 1 129 TRP HE3 3.520 . 5.240 4.743 3.986 5.366 0.126 11 0 "[ . 1 . 2]" 1
498 1 112 TYR HD1 1 113 ASN H 3.330 . 5.860 5.576 5.419 5.754 . 0 0 "[ . 1 . 2]" 1
499 1 113 ASN H 1 129 TRP HZ3 3.110 . 4.420 3.020 2.172 4.304 . 0 0 "[ . 1 . 2]" 1
500 1 112 TYR HB3 1 113 ASN H 3.130 . 4.460 2.326 2.104 2.716 . 0 0 "[ . 1 . 2]" 1
501 1 112 TYR HB2 1 113 ASN H 3.330 . 4.860 3.680 3.469 4.001 . 0 0 "[ . 1 . 2]" 1
502 1 86 VAL H 1 138 VAL H 3.470 . 5.140 4.400 4.210 4.798 . 0 0 "[ . 1 . 2]" 1
503 1 138 VAL H 1 138 VAL MG2 2.500 . 3.200 2.053 1.946 2.279 . 0 0 "[ . 1 . 2]" 1
504 1 218 VAL H 1 232 LEU MD1 3.810 . 5.820 4.713 4.349 5.146 . 0 0 "[ . 1 . 2]" 1
505 1 186 TYR H 1 189 ARG H 2.810 . 3.820 3.281 3.022 3.456 . 0 0 "[ . 1 . 2]" 1
506 1 158 TYR H 1 159 LEU H 2.910 . 4.020 2.630 2.373 2.801 . 0 0 "[ . 1 . 2]" 1
507 1 188 GLY H 1 189 ARG H 2.720 . 3.640 2.692 2.566 2.806 . 0 0 "[ . 1 . 2]" 1
508 1 189 ARG H 1 190 VAL H 3.600 . 5.400 4.508 4.411 4.593 . 0 0 "[ . 1 . 2]" 1
509 1 186 TYR HA 1 189 ARG H 3.430 . 5.060 4.581 4.371 4.858 . 0 0 "[ . 1 . 2]" 1
510 1 155 ALA MB 1 158 TYR H 3.840 . 5.880 4.575 4.451 4.698 . 0 0 "[ . 1 . 2]" 1
511 1 158 TYR H 1 190 VAL MG1 3.920 . 6.040 5.988 5.676 6.214 0.174 2 0 "[ . 1 . 2]" 1
512 1 112 TYR H 1 113 ASN H 3.600 . 5.400 4.544 4.505 4.600 . 0 0 "[ . 1 . 2]" 1
513 1 112 TYR H 1 120 GLU H 3.740 . 5.680 5.173 5.000 5.311 . 0 0 "[ . 1 . 2]" 1
514 1 112 TYR H 1 112 TYR HD2 2.930 . 5.060 4.857 4.687 5.117 0.057 16 0 "[ . 1 . 2]" 1
515 1 112 TYR H 1 112 TYR HB3 3.170 . 4.540 3.602 3.552 3.657 . 0 0 "[ . 1 . 2]" 1
516 1 112 TYR H 1 112 TYR HB2 3.050 . 4.300 2.350 2.282 2.434 . 0 0 "[ . 1 . 2]" 1
517 1 155 ALA H 1 158 TYR H 3.980 . 6.160 4.668 4.522 4.879 . 0 0 "[ . 1 . 2]" 1
518 1 158 TYR H 1 160 LEU H 3.270 . 4.740 4.047 3.850 4.440 . 0 0 "[ . 1 . 2]" 1
519 1 158 TYR H 1 158 TYR HB3 2.810 . 3.820 2.351 2.132 2.680 . 0 0 "[ . 1 . 2]" 1
520 1 229 ILE H 1 230 THR H 2.740 . 3.680 2.721 2.580 2.788 . 0 0 "[ . 1 . 2]" 1
521 1 225 ALA MB 1 230 THR H 2.990 . 4.180 4.227 3.763 4.311 0.131 20 0 "[ . 1 . 2]" 1
522 1 184 LEU MD2 1 230 THR H 2.620 . 3.440 2.817 2.234 3.049 . 0 0 "[ . 1 . 2]" 1
523 1 228 LEU MD1 1 230 THR H 3.400 . 5.000 4.027 3.812 4.138 . 0 0 "[ . 1 . 2]" 1
524 1 230 THR H 1 232 LEU MD2 3.710 . 5.620 4.939 4.726 5.175 . 0 0 "[ . 1 . 2]" 1
525 1 119 ALA H 1 120 GLU H 3.490 . 5.180 4.326 4.072 4.418 . 0 0 "[ . 1 . 2]" 1
526 1 119 ALA H 1 130 VAL MG2 3.410 . 5.020 3.821 3.478 4.101 . 0 0 "[ . 1 . 2]" 1
527 1 192 HIS H 1 193 TYR H 3.710 . 5.620 4.291 4.135 4.408 . 0 0 "[ . 1 . 2]" 1
528 1 192 HIS H 1 193 TYR HA 4.000 . 6.200 5.048 4.787 5.307 . 0 0 "[ . 1 . 2]" 1
529 1 191 TYR HB3 1 192 HIS H 2.890 . 3.980 3.200 2.722 3.694 . 0 0 "[ . 1 . 2]" 1
530 1 190 VAL MG1 1 192 HIS H 3.570 . 5.340 4.568 3.853 4.894 . 0 0 "[ . 1 . 2]" 1
531 1 167 SER H 1 233 HIS H 3.860 . 5.920 5.230 5.011 5.376 . 0 0 "[ . 1 . 2]" 1
532 1 168 PHE H 1 233 HIS H 4.180 . 6.560 4.751 4.148 5.327 . 0 0 "[ . 1 . 2]" 1
533 1 233 HIS H 1 234 TYR H 2.890 . 3.980 2.585 2.066 2.926 . 0 0 "[ . 1 . 2]" 1
534 1 168 PHE HE1 1 233 HIS H 3.520 . 5.240 3.731 2.987 4.475 . 0 0 "[ . 1 . 2]" 1
535 1 168 PHE HB3 1 233 HIS H 3.710 . 5.620 3.846 3.349 4.261 . 0 0 "[ . 1 . 2]" 1
536 1 184 LEU MD1 1 233 HIS H 3.220 . 4.640 3.048 2.648 3.425 . 0 0 "[ . 1 . 2]" 1
537 1 116 GLY H 1 118 TRP H 3.420 . 5.040 4.228 3.833 4.702 . 0 0 "[ . 1 . 2]" 1
538 1 118 TRP H 1 129 TRP HE3 4.060 . 6.320 4.879 4.023 5.876 . 0 0 "[ . 1 . 2]" 1
539 1 118 TRP H 1 118 TRP HD1 3.200 . 4.600 3.136 2.479 3.883 . 0 0 "[ . 1 . 2]" 1
540 1 218 VAL H 1 221 HIS H 3.920 . 6.040 4.829 4.759 4.920 . 0 0 "[ . 1 . 2]" 1
541 1 220 HIS H 1 221 HIS H 2.700 . 3.600 2.632 2.535 2.712 . 0 0 "[ . 1 . 2]" 1
542 1 221 HIS H 1 222 SER H 2.760 . 3.720 2.464 2.377 2.571 . 0 0 "[ . 1 . 2]" 1
543 1 211 PHE HE2 1 221 HIS H 3.830 . 5.860 5.486 4.975 5.862 0.002 5 0 "[ . 1 . 2]" 1
544 1 217 LEU MD1 1 221 HIS H 3.320 . 4.840 4.084 3.996 4.190 . 0 0 "[ . 1 . 2]" 1
545 1 221 HIS H 1 224 VAL MG2 3.700 . 5.600 4.801 4.666 4.894 . 0 0 "[ . 1 . 2]" 1
546 1 221 HIS H 1 228 LEU MD1 3.740 . 5.680 4.801 4.754 4.874 . 0 0 "[ . 1 . 2]" 1
547 1 221 HIS H 1 232 LEU MD1 3.240 . 4.680 4.094 3.809 4.264 . 0 0 "[ . 1 . 2]" 1
548 1 218 VAL MG2 1 221 HIS H 4.180 . 6.560 5.382 5.273 5.527 . 0 0 "[ . 1 . 2]" 1
549 1 200 ASP H 1 201 GLY H 2.620 . 3.440 2.348 2.211 2.495 . 0 0 "[ . 1 . 2]" 1
550 1 198 ALA MB 1 201 GLY H 2.960 . 4.120 2.886 2.496 3.280 . 0 0 "[ . 1 . 2]" 1
551 1 173 SER H 1 174 GLU H 3.580 . 5.360 4.469 4.379 4.561 . 0 0 "[ . 1 . 2]" 1
552 1 142 GLU H 1 143 LYS H 3.160 . 4.520 2.648 2.553 2.687 . 0 0 "[ . 1 . 2]" 1
553 1 134 TYR H 1 134 TYR HB2 3.410 . 5.020 2.392 2.319 2.476 . 0 0 "[ . 1 . 2]" 1
554 1 134 TYR H 1 134 TYR HB3 3.170 . 4.540 3.621 3.528 3.680 . 0 0 "[ . 1 . 2]" 1
555 1 101 ILE MD 1 134 TYR H 3.790 . 5.780 4.948 4.588 5.422 . 0 0 "[ . 1 . 2]" 1
556 1 130 VAL MG2 1 134 TYR H 4.120 . 6.440 5.202 4.920 5.544 . 0 0 "[ . 1 . 2]" 1
557 1 204 TYR H 1 205 VAL MG2 3.580 . 5.360 4.793 4.708 4.965 . 0 0 "[ . 1 . 2]" 1
558 1 133 ASN H 1 244 VAL MG2 4.100 . 6.400 5.264 4.583 6.492 0.092 7 0 "[ . 1 . 2]" 1
559 1 224 VAL MG2 1 225 ALA H 3.280 . 4.760 3.430 3.169 3.637 . 0 0 "[ . 1 . 2]" 1
560 1 170 VAL H 1 170 VAL MG1 3.170 . 4.540 3.860 3.803 3.906 . 0 0 "[ . 1 . 2]" 1
561 1 186 TYR H 1 191 TYR H 3.430 . 5.060 3.995 3.715 4.325 . 0 0 "[ . 1 . 2]" 1
562 1 186 TYR H 1 191 TYR HE1 2.960 . 4.120 2.705 2.225 3.271 . 0 0 "[ . 1 . 2]" 1
563 1 184 LEU MD2 1 186 TYR H 3.850 . 5.900 4.874 4.165 5.776 . 0 0 "[ . 1 . 2]" 1
564 1 186 TYR H 1 190 VAL MG2 4.140 . 6.480 4.545 4.253 4.860 . 0 0 "[ . 1 . 2]" 1
565 1 169 LEU MD2 1 183 SER H 3.740 . 5.680 4.513 4.182 5.048 . 0 0 "[ . 1 . 2]" 1
566 1 169 LEU MD1 1 183 SER H 2.900 . 4.000 3.243 2.987 3.648 . 0 0 "[ . 1 . 2]" 1
567 1 153 ARG H 1 156 ALA H 3.890 . 5.980 4.776 4.678 4.900 . 0 0 "[ . 1 . 2]" 1
568 1 156 ALA H 1 159 LEU MD1 3.370 . 4.940 4.132 3.742 4.559 . 0 0 "[ . 1 . 2]" 1
569 1 72 ASN H 1 73 LEU H 3.010 . 4.220 2.495 2.416 2.591 . 0 0 "[ . 1 . 2]" 1
570 1 219 HIS H 1 220 HIS H 2.720 . 3.640 2.858 2.750 2.944 . 0 0 "[ . 1 . 2]" 1
571 1 187 GLU H 1 189 ARG H 3.440 . 5.080 4.328 4.159 4.519 . 0 0 "[ . 1 . 2]" 1
572 1 134 TYR H 1 134 TYR HD1 3.050 . 4.300 2.836 2.496 3.177 . 0 0 "[ . 1 . 2]" 1
573 1 168 PHE HD1 1 234 TYR H 3.290 . 4.780 3.015 2.322 3.584 . 0 0 "[ . 1 . 2]" 1
574 1 225 ALA H 1 226 ASP H 2.630 . 3.460 3.080 2.900 3.250 . 0 0 "[ . 1 . 2]" 1
575 1 157 GLU H 1 159 LEU H 3.550 . 5.300 4.116 3.855 4.349 . 0 0 "[ . 1 . 2]" 1
576 1 141 LEU H 1 143 LYS H 3.530 . 5.260 4.321 4.113 4.431 . 0 0 "[ . 1 . 2]" 1
577 1 146 TRP H 1 146 TRP HD1 3.360 . 4.920 2.670 2.495 2.874 . 0 0 "[ . 1 . 2]" 1
578 1 134 TYR H 1 244 VAL MG2 4.000 . 6.200 5.544 4.860 6.215 0.015 7 0 "[ . 1 . 2]" 1
579 1 171 ARG H 1 181 SER H 2.610 . 3.420 3.155 2.820 3.415 . 0 0 "[ . 1 . 2]" 1
580 1 203 LEU MD2 1 215 ALA H 3.980 . 6.160 4.646 4.355 5.113 . 0 0 "[ . 1 . 2]" 1
581 1 87 ALA H 1 104 GLY H 3.310 . 4.820 4.081 3.778 4.835 0.015 4 0 "[ . 1 . 2]" 1
582 1 88 LEU H 1 107 LEU MD2 4.290 . 6.780 5.225 4.849 5.628 . 0 0 "[ . 1 . 2]" 1
583 1 88 LEU H 1 107 LEU MD1 4.520 . 7.240 5.196 4.902 5.444 . 0 0 "[ . 1 . 2]" 1
584 1 184 LEU H 1 184 LEU MD1 3.680 . 5.560 4.427 4.361 4.479 . 0 0 "[ . 1 . 2]" 1
585 1 184 LEU H 1 190 VAL MG1 3.040 . 4.280 3.459 2.751 3.734 . 0 0 "[ . 1 . 2]" 1
586 1 196 ASN H 1 217 LEU MD2 3.580 . 5.360 4.800 4.477 5.050 . 0 0 "[ . 1 . 2]" 1
587 1 196 ASN H 1 217 LEU MD1 3.940 . 6.080 5.636 5.325 5.891 . 0 0 "[ . 1 . 2]" 1
588 1 196 ASN H 1 203 LEU MD1 3.920 . 6.040 5.313 4.838 5.657 . 0 0 "[ . 1 . 2]" 1
589 1 196 ASN H 1 205 VAL MG2 3.340 . 4.880 4.225 3.973 4.567 . 0 0 "[ . 1 . 2]" 1
590 1 148 HIS H 1 169 LEU MD2 3.770 . 5.740 5.758 5.550 5.845 0.105 8 0 "[ . 1 . 2]" 1
591 1 224 VAL MG1 1 225 ALA H 3.410 . 5.020 3.553 3.420 3.686 . 0 0 "[ . 1 . 2]" 1
592 1 214 LEU H 1 214 LEU MD2 3.480 . 5.160 4.344 4.298 4.398 . 0 0 "[ . 1 . 2]" 1
593 1 214 LEU H 1 215 ALA MB 3.470 . 5.140 4.214 4.163 4.308 . 0 0 "[ . 1 . 2]" 1
594 1 84 LEU MD1 1 109 VAL H 3.350 . 4.900 4.624 4.286 4.989 0.089 6 0 "[ . 1 . 2]" 1
595 1 109 VAL H 1 121 ALA MB 3.600 . 5.400 4.206 3.788 4.821 . 0 0 "[ . 1 . 2]" 1
596 1 109 VAL H 1 135 ILE MD 3.950 . 6.100 4.962 4.719 5.298 . 0 0 "[ . 1 . 2]" 1
597 1 151 VAL MG1 1 152 SER H 2.690 . 3.580 2.707 2.323 3.104 . 0 0 "[ . 1 . 2]" 1
598 1 99 LEU H 1 99 LEU MD1 3.720 . 5.640 4.471 4.358 4.526 . 0 0 "[ . 1 . 2]" 1
599 1 244 VAL MG1 1 245 TYR H 3.010 . 4.220 2.889 2.274 3.186 . 0 0 "[ . 1 . 2]" 1
600 1 244 VAL MG2 1 245 TYR H 3.570 . 5.340 4.285 4.099 4.522 . 0 0 "[ . 1 . 2]" 1
601 1 195 ILE H 1 205 VAL MG2 3.670 . 5.540 4.041 3.832 4.359 . 0 0 "[ . 1 . 2]" 1
602 1 244 VAL H 1 244 VAL MG1 3.220 . 4.640 3.832 3.745 3.876 . 0 0 "[ . 1 . 2]" 1
603 1 214 LEU MD2 1 217 LEU H 3.520 . 5.240 4.107 3.983 4.250 . 0 0 "[ . 1 . 2]" 1
604 1 203 LEU H 1 203 LEU MD1 3.090 . 4.380 3.374 3.034 3.690 . 0 0 "[ . 1 . 2]" 1
605 1 92 VAL MG2 1 101 ILE H 4.020 . 6.240 5.029 4.742 5.402 . 0 0 "[ . 1 . 2]" 1
606 1 205 VAL MG1 1 206 SER H 3.400 . 5.000 3.516 3.165 3.781 . 0 0 "[ . 1 . 2]" 1
607 1 106 LYS H 1 107 LEU MD1 3.640 . 5.480 5.631 5.570 5.715 0.235 5 0 "[ . 1 . 2]" 1
608 1 86 VAL MG2 1 106 LYS H 3.540 . 5.280 4.079 3.398 4.456 . 0 0 "[ . 1 . 2]" 1
609 1 168 PHE H 1 232 LEU MD2 3.800 . 5.800 5.073 4.799 5.325 . 0 0 "[ . 1 . 2]" 1
610 1 74 LEU H 1 74 LEU MD2 3.350 . 4.900 3.542 3.328 3.664 . 0 0 "[ . 1 . 2]" 1
611 1 151 VAL MG2 1 172 GLU H 3.290 . 4.780 3.928 3.056 4.548 . 0 0 "[ . 1 . 2]" 1
612 1 130 VAL MG2 1 132 SER H 3.470 . 5.140 5.035 4.459 5.297 0.157 7 0 "[ . 1 . 2]" 1
613 1 190 VAL H 1 190 VAL MG1 3.200 . 4.600 3.864 3.840 3.889 . 0 0 "[ . 1 . 2]" 1
614 1 84 LEU MD1 1 108 ARG H 3.200 . 4.600 3.912 3.361 4.266 . 0 0 "[ . 1 . 2]" 1
615 1 99 LEU MD2 1 127 GLN H 3.460 . 5.120 4.161 3.241 4.914 . 0 0 "[ . 1 . 2]" 1
616 1 99 LEU MD1 1 127 GLN H 3.320 . 4.840 3.531 2.656 4.281 . 0 0 "[ . 1 . 2]" 1
617 1 218 VAL H 1 218 VAL MG1 3.270 . 4.740 3.786 3.751 3.810 . 0 0 "[ . 1 . 2]" 1
618 1 73 LEU MD2 1 220 HIS H 3.460 . 5.120 4.734 4.562 4.921 . 0 0 "[ . 1 . 2]" 1
619 1 170 VAL MG1 1 181 SER H 2.990 . 4.180 3.475 3.076 3.900 . 0 0 "[ . 1 . 2]" 1
620 1 169 LEU H 1 169 LEU MD1 3.390 . 4.980 3.793 3.661 3.996 . 0 0 "[ . 1 . 2]" 1
621 1 107 LEU MD1 1 122 GLN H 4.090 . 6.380 5.146 4.901 5.460 . 0 0 "[ . 1 . 2]" 1
622 1 88 LEU MD1 1 136 THR H 3.470 . 5.140 4.275 4.041 4.711 . 0 0 "[ . 1 . 2]" 1
623 1 88 LEU MD2 1 136 THR H 3.560 . 5.320 4.168 3.871 4.477 . 0 0 "[ . 1 . 2]" 1
624 1 86 VAL MG2 1 136 THR H 3.740 . 5.680 4.918 4.810 5.033 . 0 0 "[ . 1 . 2]" 1
625 1 204 TYR H 1 217 LEU MD1 3.370 . 4.940 4.490 4.233 4.686 . 0 0 "[ . 1 . 2]" 1
626 1 160 LEU H 1 160 LEU MD2 3.490 . 5.180 3.490 3.232 3.690 . 0 0 "[ . 1 . 2]" 1
627 1 223 THR H 1 224 VAL MG1 3.470 . 5.140 4.802 4.622 4.941 . 0 0 "[ . 1 . 2]" 1
628 1 223 THR H 1 224 VAL MG2 3.160 . 4.520 4.188 3.936 4.362 . 0 0 "[ . 1 . 2]" 1
629 1 121 ALA MB 1 128 GLY H 3.500 . 5.200 4.258 4.070 4.540 . 0 0 "[ . 1 . 2]" 1
630 1 99 LEU MD1 1 128 GLY H 3.390 . 4.980 3.869 3.492 4.269 . 0 0 "[ . 1 . 2]" 1
631 1 88 LEU MD1 1 135 ILE H 3.230 . 4.660 4.361 3.487 4.728 0.068 7 0 "[ . 1 . 2]" 1
632 1 149 GLY H 1 151 VAL MG2 3.320 . 4.840 3.904 3.531 4.210 . 0 0 "[ . 1 . 2]" 1
633 1 110 LEU MD1 1 111 GLY H 3.710 . 5.620 4.506 3.997 4.868 . 0 0 "[ . 1 . 2]" 1
634 1 110 LEU MD2 1 111 GLY H 3.710 . 5.620 4.340 2.459 4.655 . 0 0 "[ . 1 . 2]" 1
635 1 184 LEU MD2 1 185 ARG H 3.620 . 5.440 4.933 4.180 5.122 . 0 0 "[ . 1 . 2]" 1
636 1 160 LEU MD1 1 185 ARG H 3.070 . 4.340 2.108 1.837 3.208 . 0 0 "[ . 1 . 2]" 1
637 1 109 VAL MG1 1 120 GLU H 2.990 . 4.180 3.870 3.417 4.213 0.033 19 0 "[ . 1 . 2]" 1
638 1 214 LEU MD2 1 218 VAL H 3.110 . 4.420 3.150 2.986 3.461 . 0 0 "[ . 1 . 2]" 1
639 1 158 TYR H 1 159 LEU MD1 3.600 . 5.400 5.025 4.656 5.238 . 0 0 "[ . 1 . 2]" 1
640 1 109 VAL MG1 1 112 TYR H 3.720 . 5.640 3.847 3.469 4.208 . 0 0 "[ . 1 . 2]" 1
641 1 158 TYR H 1 190 VAL MG2 3.980 . 6.160 5.733 5.414 6.140 . 0 0 "[ . 1 . 2]" 1
642 1 189 ARG H 1 190 VAL MG2 4.260 . 6.720 4.854 4.648 5.006 . 0 0 "[ . 1 . 2]" 1
643 1 184 LEU MD1 1 230 THR H 3.650 . 5.500 5.151 4.279 5.496 . 0 0 "[ . 1 . 2]" 1
644 1 228 LEU MD2 1 230 THR H 4.040 . 6.280 4.911 4.678 5.064 . 0 0 "[ . 1 . 2]" 1
645 1 232 LEU MD2 1 233 HIS H 3.280 . 4.760 4.024 3.857 4.293 . 0 0 "[ . 1 . 2]" 1
646 1 75 ALA MB 1 76 GLY H 3.350 . 4.900 2.751 2.315 3.020 . 0 0 "[ . 1 . 2]" 1
647 1 73 LEU H 1 73 LEU MD1 3.460 . 5.120 4.127 4.001 4.188 . 0 0 "[ . 1 . 2]" 1
648 1 99 LEU MD2 1 126 GLY H 3.310 . 4.820 3.859 3.142 4.352 . 0 0 "[ . 1 . 2]" 1
649 1 107 LEU MD1 1 108 ARG H 3.470 . 5.140 4.138 3.703 4.385 . 0 0 "[ . 1 . 2]" 1
650 1 99 LEU MD2 1 100 SER H 3.700 . 5.600 4.559 4.223 4.780 . 0 0 "[ . 1 . 2]" 1
651 1 138 VAL H 1 138 VAL MG1 3.210 . 4.620 3.842 3.784 3.887 . 0 0 "[ . 1 . 2]" 1
652 1 85 PHE H 1 109 VAL MG2 3.310 . 4.820 4.227 3.597 4.778 . 0 0 "[ . 1 . 2]" 1
653 1 86 VAL H 1 109 VAL MG2 3.890 . 5.980 5.236 4.848 5.534 . 0 0 "[ . 1 . 2]" 1
654 1 109 VAL MG2 1 110 LEU H 3.340 . 4.880 3.931 3.701 4.149 . 0 0 "[ . 1 . 2]" 1
655 1 109 VAL MG2 1 120 GLU H 3.740 . 5.680 5.147 4.779 5.592 . 0 0 "[ . 1 . 2]" 1
656 1 85 PHE HE1 1 109 VAL MG2 3.310 . 4.820 4.128 3.756 4.613 . 0 0 "[ . 1 . 2]" 1
657 1 85 PHE HZ 1 109 VAL MG2 3.670 . 5.540 4.058 3.567 4.702 . 0 0 "[ . 1 . 2]" 1
658 1 85 PHE HE2 1 109 VAL MG2 3.490 . 5.180 3.478 3.115 3.933 . 0 0 "[ . 1 . 2]" 1
659 1 85 PHE HB2 1 109 VAL MG2 3.300 . 4.800 2.546 2.183 2.882 . 0 0 "[ . 1 . 2]" 1
660 1 85 PHE HB3 1 109 VAL MG2 3.400 . 5.000 3.364 3.051 3.574 . 0 0 "[ . 1 . 2]" 1
661 1 109 VAL MG2 1 121 ALA MB 3.160 . 4.520 2.399 1.935 2.911 . 0 0 "[ . 1 . 2]" 1
662 1 109 VAL MG2 1 119 ALA MB 2.940 . 4.080 2.390 2.052 2.823 . 0 0 "[ . 1 . 2]" 1
663 1 119 ALA H 1 135 ILE MD 3.480 . 5.160 4.153 3.678 4.656 . 0 0 "[ . 1 . 2]" 1
664 1 107 LEU H 1 135 ILE MD 4.350 . 6.900 6.285 5.636 6.897 . 0 0 "[ . 1 . 2]" 1
665 1 135 ILE MD 1 136 THR H 3.350 . 4.900 4.332 4.114 4.666 . 0 0 "[ . 1 . 2]" 1
666 1 132 SER H 1 135 ILE MD 4.310 . 6.820 3.828 3.532 4.245 . 0 0 "[ . 1 . 2]" 1
667 1 120 GLU H 1 135 ILE MD 4.030 . 6.260 6.001 5.524 6.287 0.027 13 0 "[ . 1 . 2]" 1
668 1 85 PHE HE2 1 135 ILE MD 3.070 . 4.340 3.868 3.467 4.391 0.051 5 0 "[ . 1 . 2]" 1
669 1 85 PHE HD2 1 135 ILE MD 2.960 . 4.120 2.876 2.325 3.607 . 0 0 "[ . 1 . 2]" 1
670 1 112 TYR HE1 1 135 ILE MD 4.030 . 6.260 4.698 4.334 5.986 . 0 0 "[ . 1 . 2]" 1
671 1 112 TYR HE2 1 135 ILE MD 4.290 . 6.780 2.974 2.263 4.279 . 0 0 "[ . 1 . 2]" 1
672 1 85 PHE HB2 1 135 ILE MD 3.410 . 5.020 3.672 2.860 4.386 . 0 0 "[ . 1 . 2]" 1
673 1 85 PHE HB3 1 135 ILE MD 3.410 . 5.020 3.447 3.034 4.029 . 0 0 "[ . 1 . 2]" 1
674 1 121 ALA MB 1 135 ILE MD 3.120 . 4.440 3.248 2.718 3.501 . 0 0 "[ . 1 . 2]" 1
675 1 119 ALA MB 1 135 ILE MD 2.880 . 3.960 2.478 2.098 2.868 . 0 0 "[ . 1 . 2]" 1
676 1 130 VAL MG2 1 135 ILE MD 2.600 . 3.400 1.888 1.737 2.050 0.063 7 0 "[ . 1 . 2]" 1
677 1 109 VAL MG2 1 135 ILE MD 2.710 . 3.620 1.964 1.771 2.097 0.029 8 0 "[ . 1 . 2]" 1
678 1 109 VAL MG1 1 119 ALA H 4.400 . 7.000 5.061 4.922 5.196 . 0 0 "[ . 1 . 2]" 1
679 1 85 PHE HE1 1 109 VAL MG1 3.370 . 4.940 4.118 3.634 4.352 . 0 0 "[ . 1 . 2]" 1
680 1 85 PHE HZ 1 109 VAL MG1 3.530 . 5.260 3.702 3.364 3.956 . 0 0 "[ . 1 . 2]" 1
681 1 109 VAL MG1 1 110 LEU MD2 3.690 . 5.580 4.646 3.806 4.903 . 0 0 "[ . 1 . 2]" 1
682 1 85 PHE H 1 107 LEU MD1 2.980 . 4.160 3.260 3.041 3.572 . 0 0 "[ . 1 . 2]" 1
683 1 86 VAL H 1 107 LEU MD1 2.950 . 4.100 3.081 2.922 3.259 . 0 0 "[ . 1 . 2]" 1
684 1 107 LEU H 1 107 LEU MD1 2.870 . 3.940 2.229 1.997 2.462 . 0 0 "[ . 1 . 2]" 1
685 1 85 PHE HB2 1 107 LEU MD1 2.970 . 4.140 2.132 2.033 2.243 . 0 0 "[ . 1 . 2]" 1
686 1 85 PHE HB3 1 107 LEU MD1 2.960 . 4.120 2.515 2.275 2.680 . 0 0 "[ . 1 . 2]" 1
687 1 107 LEU MD1 1 121 ALA MB 2.800 . 3.800 2.994 2.631 3.503 . 0 0 "[ . 1 . 2]" 1
688 1 101 ILE MD 1 107 LEU MD1 3.090 . 4.380 4.056 3.756 4.376 . 0 0 "[ . 1 . 2]" 1
689 1 107 LEU MD1 1 135 ILE MD 2.860 . 3.920 2.950 2.435 3.388 . 0 0 "[ . 1 . 2]" 1
690 1 107 LEU MD2 1 122 GLN H 3.600 . 5.400 5.221 4.620 5.515 0.115 4 0 "[ . 1 . 2]" 1
691 1 107 LEU MD2 1 136 THR H 3.770 . 5.740 5.420 5.265 5.789 0.049 7 0 "[ . 1 . 2]" 1
692 1 91 PHE HB3 1 107 LEU MD2 4.440 . 7.080 5.694 5.277 5.948 . 0 0 "[ . 1 . 2]" 1
693 1 107 LEU MD2 1 134 TYR HB3 4.670 . 7.540 5.238 4.948 5.515 . 0 0 "[ . 1 . 2]" 1
694 1 85 PHE HB2 1 107 LEU MD2 3.410 . 5.020 4.626 4.431 4.791 . 0 0 "[ . 1 . 2]" 1
695 1 85 PHE HB3 1 107 LEU MD2 3.340 . 4.880 4.786 4.550 4.920 0.040 7 0 "[ . 1 . 2]" 1
696 1 87 ALA MB 1 107 LEU MD2 2.720 . 3.640 2.068 1.821 2.565 . 0 0 "[ . 1 . 2]" 1
697 1 101 ILE MD 1 107 LEU MD2 2.520 . 3.240 2.541 2.236 2.818 . 0 0 "[ . 1 . 2]" 1
698 1 107 LEU MD2 1 135 ILE MD 2.860 . 3.920 3.625 3.230 3.942 0.022 1 0 "[ . 1 . 2]" 1
699 1 110 LEU H 1 110 LEU MD1 2.930 . 4.060 3.574 3.025 4.047 . 0 0 "[ . 1 . 2]" 1
700 1 110 LEU MD1 1 121 ALA H 4.150 . 6.500 4.885 3.986 6.615 0.115 17 0 "[ . 1 . 2]" 1
701 1 110 LEU MD1 1 122 GLN H 3.410 . 5.020 4.118 3.408 4.732 . 0 0 "[ . 1 . 2]" 1
702 1 109 VAL H 1 110 LEU MD1 3.650 . 6.500 6.224 4.648 6.653 0.153 3 0 "[ . 1 . 2]" 1
703 1 109 VAL MG2 1 110 LEU MD1 4.100 . 6.400 5.937 5.521 6.377 . 0 0 "[ . 1 . 2]" 1
704 1 160 LEU MD2 1 168 PHE H 3.070 . 4.340 3.348 2.962 3.714 . 0 0 "[ . 1 . 2]" 1
705 1 160 LEU MD2 1 236 ALA H 3.150 . 4.500 3.673 3.067 4.044 . 0 0 "[ . 1 . 2]" 1
706 1 160 LEU MD2 1 234 TYR HD1 3.780 . 5.760 4.046 3.553 5.749 . 0 0 "[ . 1 . 2]" 1
707 1 160 LEU MD2 1 168 PHE HB2 3.640 . 5.480 5.034 4.497 5.311 . 0 0 "[ . 1 . 2]" 1
708 1 160 LEU MD2 1 168 PHE HB3 3.830 . 5.860 4.936 4.447 5.244 . 0 0 "[ . 1 . 2]" 1
709 1 160 LEU MD2 1 236 ALA MB 2.620 . 3.440 2.036 1.829 2.176 . 0 0 "[ . 1 . 2]" 1
710 1 160 LEU MD2 1 169 LEU MD2 2.830 . 3.860 2.414 2.118 2.742 . 0 0 "[ . 1 . 2]" 1
711 1 88 LEU H 1 88 LEU MD1 3.160 . 4.520 3.765 3.668 3.952 . 0 0 "[ . 1 . 2]" 1
712 1 141 LEU MD1 1 215 ALA H 3.960 . 6.120 4.143 3.444 4.691 . 0 0 "[ . 1 . 2]" 1
713 1 141 LEU H 1 141 LEU MD1 3.640 . 5.480 3.645 3.444 3.847 . 0 0 "[ . 1 . 2]" 1
714 1 88 LEU MD1 1 134 TYR H 3.680 . 5.560 5.429 4.552 5.713 0.153 16 0 "[ . 1 . 2]" 1
715 1 141 LEU MD1 1 146 TRP HZ3 3.480 . 5.160 3.901 3.140 4.680 . 0 0 "[ . 1 . 2]" 1
716 1 141 LEU MD1 1 147 TYR HE1 3.100 . 4.400 3.122 2.847 3.801 . 0 0 "[ . 1 . 2]" 1
717 1 141 LEU MD1 1 146 TRP HH2 3.650 . 5.500 3.634 2.969 4.113 . 0 0 "[ . 1 . 2]" 1
718 1 87 ALA MB 1 88 LEU MD1 4.460 . 7.120 5.854 5.638 5.999 . 0 0 "[ . 1 . 2]" 1
719 1 141 LEU MD1 1 214 LEU MD1 2.650 . 3.500 2.098 1.825 2.514 . 0 0 "[ . 1 . 2]" 1
720 1 141 LEU MD1 1 218 VAL MG2 4.370 . 6.940 5.211 4.673 5.791 . 0 0 "[ . 1 . 2]" 1
721 1 109 VAL H 1 110 LEU MD2 3.650 . 5.500 4.658 4.426 5.024 . 0 0 "[ . 1 . 2]" 1
722 1 108 ARG H 1 110 LEU MD2 3.890 . 5.980 4.903 4.624 5.231 . 0 0 "[ . 1 . 2]" 1
723 1 109 VAL MG2 1 110 LEU MD2 4.100 . 6.400 5.164 4.492 5.447 . 0 0 "[ . 1 . 2]" 1
724 1 99 LEU MD2 1 130 VAL H 4.430 . 7.060 4.704 4.273 5.122 . 0 0 "[ . 1 . 2]" 1
725 1 99 LEU MD2 1 121 ALA H 3.070 . 4.340 3.658 3.371 3.970 . 0 0 "[ . 1 . 2]" 1
726 1 99 LEU MD2 1 108 ARG H 3.970 . 6.140 5.744 5.127 6.041 . 0 0 "[ . 1 . 2]" 1
727 1 99 LEU H 1 99 LEU MD2 3.750 . 5.700 4.537 4.296 4.687 . 0 0 "[ . 1 . 2]" 1
728 1 99 LEU MD2 1 121 ALA MB 2.660 . 3.520 2.890 2.469 3.226 . 0 0 "[ . 1 . 2]" 1
729 1 121 ALA H 1 130 VAL MG2 3.280 . 4.760 3.565 3.058 4.207 . 0 0 "[ . 1 . 2]" 1
730 1 99 LEU H 1 130 VAL MG2 3.910 . 6.020 5.397 4.830 5.690 . 0 0 "[ . 1 . 2]" 1
731 1 130 VAL MG2 1 134 TYR HB2 3.680 . 5.560 4.326 3.975 4.557 . 0 0 "[ . 1 . 2]" 1
732 1 130 VAL MG2 1 134 TYR HB3 3.460 . 5.120 4.774 4.171 5.183 0.063 14 0 "[ . 1 . 2]" 1
733 1 85 PHE HB2 1 130 VAL MG2 4.410 . 7.020 5.440 4.862 5.884 . 0 0 "[ . 1 . 2]" 1
734 1 109 VAL MG2 1 130 VAL MG2 3.370 . 4.940 3.387 2.964 3.772 . 0 0 "[ . 1 . 2]" 1
735 1 85 PHE H 1 138 VAL MG2 3.380 . 4.960 3.627 3.378 3.920 . 0 0 "[ . 1 . 2]" 1
736 1 86 VAL H 1 138 VAL MG2 3.280 . 4.760 3.472 3.319 3.697 . 0 0 "[ . 1 . 2]" 1
737 1 107 LEU H 1 138 VAL MG2 3.530 . 5.260 4.409 4.140 5.055 . 0 0 "[ . 1 . 2]" 1
738 1 83 ASN H 1 138 VAL MG2 4.460 . 7.120 6.603 6.098 6.971 . 0 0 "[ . 1 . 2]" 1
739 1 92 VAL MG2 1 93 ALA H 3.480 . 5.160 4.099 4.014 4.231 . 0 0 "[ . 1 . 2]" 1
740 1 85 PHE HB2 1 138 VAL MG2 3.890 . 5.980 4.773 4.629 5.069 . 0 0 "[ . 1 . 2]" 1
741 1 107 LEU MD1 1 138 VAL MG2 3.490 . 5.180 4.544 4.386 4.900 . 0 0 "[ . 1 . 2]" 1
742 1 86 VAL H 1 86 VAL MG1 2.740 . 3.680 2.340 2.271 2.421 . 0 0 "[ . 1 . 2]" 1
743 1 86 VAL MG1 1 107 LEU H 4.010 . 6.220 5.405 5.064 5.628 . 0 0 "[ . 1 . 2]" 1
744 1 86 VAL MG1 1 87 ALA H 3.380 . 4.960 3.980 3.848 4.106 . 0 0 "[ . 1 . 2]" 1
745 1 86 VAL MG1 1 138 VAL H 3.410 . 5.020 3.895 3.644 4.098 . 0 0 "[ . 1 . 2]" 1
746 1 85 PHE HD2 1 86 VAL MG1 3.750 . 5.700 5.372 5.143 5.645 . 0 0 "[ . 1 . 2]" 1
747 1 85 PHE HB3 1 86 VAL MG1 3.410 . 5.020 4.248 4.153 4.430 . 0 0 "[ . 1 . 2]" 1
748 1 86 VAL MG1 1 135 ILE MD 4.340 . 6.880 6.118 5.952 6.381 . 0 0 "[ . 1 . 2]" 1
749 1 121 ALA H 1 130 VAL MG1 3.160 . 4.520 3.981 3.225 4.572 0.052 17 0 "[ . 1 . 2]" 1
750 1 151 VAL H 1 151 VAL MG1 3.230 . 4.660 3.902 3.849 3.967 . 0 0 "[ . 1 . 2]" 1
751 1 91 PHE HD2 1 130 VAL MG1 3.020 . 4.240 3.186 2.635 3.673 . 0 0 "[ . 1 . 2]" 1
752 1 118 TRP HZ3 1 130 VAL MG1 3.650 . 5.500 4.119 3.472 4.723 . 0 0 "[ . 1 . 2]" 1
753 1 91 PHE HB3 1 130 VAL MG1 3.450 . 5.100 3.865 3.355 4.499 . 0 0 "[ . 1 . 2]" 1
754 1 151 VAL MG1 1 155 ALA MB 2.610 . 3.420 1.874 1.748 1.984 0.052 13 0 "[ . 1 . 2]" 1
755 1 130 VAL MG1 1 135 ILE MD 3.510 . 5.220 4.411 4.168 4.640 . 0 0 "[ . 1 . 2]" 1
756 1 109 VAL MG2 1 130 VAL MG1 4.160 . 6.520 5.328 4.592 5.902 . 0 0 "[ . 1 . 2]" 1
757 1 84 LEU MD2 1 85 PHE H 3.230 . 4.660 4.470 4.169 4.725 0.065 15 0 "[ . 1 . 2]" 1
758 1 184 LEU MD1 1 186 TYR H 3.650 . 5.500 4.973 4.727 5.251 . 0 0 "[ . 1 . 2]" 1
759 1 166 GLY H 1 184 LEU MD1 2.990 . 4.180 3.450 3.093 3.865 . 0 0 "[ . 1 . 2]" 1
760 1 184 LEU MD1 1 185 ARG H 2.680 . 3.560 3.048 2.055 3.517 . 0 0 "[ . 1 . 2]" 1
761 1 84 LEU MD2 1 138 VAL H 3.980 . 6.160 4.969 4.584 5.320 . 0 0 "[ . 1 . 2]" 1
762 1 84 LEU H 1 84 LEU MD2 3.590 . 5.380 4.410 4.287 4.507 . 0 0 "[ . 1 . 2]" 1
763 1 203 LEU MD1 1 211 PHE HD1 3.830 . 5.860 5.841 5.586 5.959 0.099 13 0 "[ . 1 . 2]" 1
764 1 184 LEU MD1 1 186 TYR HB2 3.100 . 4.400 3.566 3.278 4.087 . 0 0 "[ . 1 . 2]" 1
765 1 184 LEU MD1 1 191 TYR HB2 3.990 . 6.180 5.594 5.413 5.826 . 0 0 "[ . 1 . 2]" 1
766 1 184 LEU MD1 1 228 LEU MD1 3.320 . 4.840 4.153 3.485 4.330 . 0 0 "[ . 1 . 2]" 1
767 1 184 LEU MD1 1 232 LEU MD2 2.510 . 3.220 2.009 1.814 2.225 . 0 0 "[ . 1 . 2]" 1
768 1 84 LEU MD1 1 85 PHE H 2.940 . 4.080 2.497 2.260 2.804 . 0 0 "[ . 1 . 2]" 1
769 1 84 LEU H 1 84 LEU MD1 3.450 . 5.100 4.249 4.151 4.370 . 0 0 "[ . 1 . 2]" 1
770 1 84 LEU MD1 1 85 PHE HD1 3.620 . 5.440 4.478 4.080 4.732 . 0 0 "[ . 1 . 2]" 1
771 1 84 LEU MD1 1 85 PHE HB2 3.560 . 5.320 4.468 4.249 4.748 . 0 0 "[ . 1 . 2]" 1
772 1 84 LEU MD1 1 85 PHE HB3 4.170 . 6.540 5.548 5.360 5.800 . 0 0 "[ . 1 . 2]" 1
773 1 84 LEU MD1 1 107 LEU MD1 3.280 . 4.760 4.075 3.859 4.269 . 0 0 "[ . 1 . 2]" 1
774 1 84 LEU MD1 1 109 VAL MG2 3.800 . 5.800 5.434 5.051 5.708 . 0 0 "[ . 1 . 2]" 1
775 1 88 LEU H 1 101 ILE MD 3.360 . 4.920 4.210 3.781 4.674 . 0 0 "[ . 1 . 2]" 1
776 1 87 ALA H 1 101 ILE MD 3.550 . 5.300 4.589 4.367 4.833 . 0 0 "[ . 1 . 2]" 1
777 1 91 PHE HD2 1 101 ILE MD 3.540 . 5.280 4.116 3.616 4.487 . 0 0 "[ . 1 . 2]" 1
778 1 89 TYR H 1 101 ILE MD 3.040 . 4.280 3.860 3.519 4.226 . 0 0 "[ . 1 . 2]" 1
779 1 101 ILE MD 1 134 TYR HB3 3.150 . 4.500 2.169 1.792 2.623 0.008 19 0 "[ . 1 . 2]" 1
780 1 87 ALA MB 1 101 ILE MD 2.840 . 3.880 1.988 1.917 2.116 . 0 0 "[ . 1 . 2]" 1
781 1 101 ILE MD 1 130 VAL MG1 2.720 . 3.640 2.540 2.025 3.277 . 0 0 "[ . 1 . 2]" 1
782 1 88 LEU H 1 88 LEU MD2 3.090 . 4.380 3.303 3.123 3.565 . 0 0 "[ . 1 . 2]" 1
783 1 88 LEU MD2 1 104 GLY H 3.680 . 5.560 4.859 4.216 5.507 . 0 0 "[ . 1 . 2]" 1
784 1 88 LEU MD2 1 89 TYR HE1 3.590 . 5.380 5.157 4.886 5.400 0.020 14 0 "[ . 1 . 2]" 1
785 1 87 ALA MB 1 88 LEU MD2 4.060 . 6.320 4.904 4.600 5.188 . 0 0 "[ . 1 . 2]" 1
786 1 86 VAL MG1 1 88 LEU MD2 2.710 . 3.620 2.639 2.407 3.259 . 0 0 "[ . 1 . 2]" 1
787 1 121 ALA MB 1 130 VAL H 3.730 . 5.660 3.507 3.081 3.835 . 0 0 "[ . 1 . 2]" 1
788 1 121 ALA H 1 121 ALA MB 3.050 . 4.300 2.463 2.336 2.625 . 0 0 "[ . 1 . 2]" 1
789 1 120 GLU H 1 121 ALA MB 4.040 . 6.280 4.931 4.656 5.213 . 0 0 "[ . 1 . 2]" 1
790 1 85 PHE HD2 1 121 ALA MB 3.970 . 6.140 5.989 5.668 6.186 0.046 1 0 "[ . 1 . 2]" 1
791 1 87 ALA MB 1 121 ALA MB 4.070 . 6.340 5.520 5.015 6.006 . 0 0 "[ . 1 . 2]" 1
792 1 119 ALA MB 1 121 ALA MB 3.230 . 4.660 3.177 2.771 3.663 . 0 0 "[ . 1 . 2]" 1
793 1 121 ALA MB 1 130 VAL MG2 2.610 . 3.420 2.052 1.921 2.234 . 0 0 "[ . 1 . 2]" 1
794 1 109 VAL MG1 1 121 ALA MB 3.450 . 5.100 3.846 3.039 4.525 . 0 0 "[ . 1 . 2]" 1
795 1 87 ALA H 1 87 ALA MB 2.960 . 4.120 2.242 2.212 2.262 . 0 0 "[ . 1 . 2]" 1
796 1 87 ALA MB 1 89 TYR HD1 4.200 . 6.600 5.402 4.957 5.703 . 0 0 "[ . 1 . 2]" 1
797 1 87 ALA MB 1 130 VAL MG1 4.520 . 7.240 4.737 4.397 5.186 . 0 0 "[ . 1 . 2]" 1
798 1 119 ALA H 1 119 ALA MB 3.170 . 4.540 2.536 2.459 2.660 . 0 0 "[ . 1 . 2]" 1
799 1 112 TYR H 1 119 ALA MB 3.710 . 5.620 4.297 3.928 4.743 . 0 0 "[ . 1 . 2]" 1
800 1 119 ALA MB 1 120 GLU H 3.170 . 4.540 2.992 2.763 3.230 . 0 0 "[ . 1 . 2]" 1
801 1 138 VAL MG1 1 139 ASN H 3.440 . 5.080 4.122 3.797 4.299 . 0 0 "[ . 1 . 2]" 1
802 1 119 ALA MB 1 130 VAL MG2 2.900 . 4.000 3.079 2.556 3.620 . 0 0 "[ . 1 . 2]" 1
803 1 109 VAL MG1 1 119 ALA MB 2.880 . 3.960 1.748 1.698 1.806 0.102 8 0 "[ . 1 . 2]" 1
804 1 93 ALA MB 1 129 TRP H 4.140 . 6.480 5.973 5.491 6.540 0.060 4 0 "[ . 1 . 2]" 1
805 1 93 ALA H 1 93 ALA MB 2.800 . 3.800 2.228 2.194 2.270 . 0 0 "[ . 1 . 2]" 1
806 1 92 VAL H 1 93 ALA MB 4.400 . 7.000 5.677 5.505 5.824 . 0 0 "[ . 1 . 2]" 1
807 1 91 PHE HE2 1 93 ALA MB 3.310 . 4.820 3.823 3.460 4.273 . 0 0 "[ . 1 . 2]" 1
808 1 93 ALA MB 1 130 VAL MG1 3.710 . 5.620 5.114 4.763 5.585 . 0 0 "[ . 1 . 2]" 1
809 1 92 VAL MG1 1 93 ALA MB 2.930 . 4.060 3.522 3.354 3.810 . 0 0 "[ . 1 . 2]" 1
810 1 93 ALA MB 1 99 LEU MD1 3.400 . 5.000 4.007 3.746 4.453 . 0 0 "[ . 1 . 2]" 1
811 1 92 VAL MG1 1 93 ALA H 2.810 . 3.820 2.588 2.433 2.806 . 0 0 "[ . 1 . 2]" 1
812 1 92 VAL MG1 1 100 SER H 4.170 . 6.540 5.652 5.219 6.152 . 0 0 "[ . 1 . 2]" 1
813 1 92 VAL H 1 92 VAL MG1 3.260 . 4.720 3.862 3.824 3.922 . 0 0 "[ . 1 . 2]" 1
814 1 134 TYR HB3 1 244 VAL MG2 4.060 . 6.320 6.188 5.972 6.419 0.099 7 0 "[ . 1 . 2]" 1
815 1 91 PHE H 1 92 VAL MG2 3.580 . 5.360 4.545 4.192 4.808 . 0 0 "[ . 1 . 2]" 1
816 1 203 LEU MD2 1 214 LEU H 2.730 . 3.660 2.519 2.163 3.064 . 0 0 "[ . 1 . 2]" 1
817 1 203 LEU MD2 1 216 GLU H 4.330 . 6.860 5.404 5.218 5.758 . 0 0 "[ . 1 . 2]" 1
818 1 203 LEU MD2 1 211 PHE HD1 3.380 . 4.960 4.962 4.845 5.086 0.126 17 0 "[ . 1 . 2]" 1
819 1 203 LEU MD2 1 204 TYR HD1 4.360 . 6.920 5.562 5.309 5.737 . 0 0 "[ . 1 . 2]" 1
820 1 203 LEU MD2 1 211 PHE HB3 4.020 . 6.240 5.465 5.030 5.979 . 0 0 "[ . 1 . 2]" 1
821 1 141 LEU MD1 1 203 LEU MD2 3.590 . 5.380 4.140 3.467 5.114 . 0 0 "[ . 1 . 2]" 1
822 1 184 LEU MD2 1 233 HIS H 3.970 . 6.140 4.701 4.311 5.382 . 0 0 "[ . 1 . 2]" 1
823 1 184 LEU MD2 1 232 LEU H 3.650 . 5.500 4.331 3.843 4.761 . 0 0 "[ . 1 . 2]" 1
824 1 184 LEU MD2 1 228 LEU H 4.020 . 6.240 6.123 5.027 6.406 0.166 12 0 "[ . 1 . 2]" 1
825 1 168 PHE HB3 1 184 LEU MD2 3.280 . 4.760 4.101 3.906 4.471 . 0 0 "[ . 1 . 2]" 1
826 1 184 LEU MD2 1 186 TYR HB3 3.410 . 5.020 3.723 3.043 4.859 . 0 0 "[ . 1 . 2]" 1
827 1 184 LEU MD2 1 191 TYR HB2 3.290 . 4.780 3.914 3.545 4.250 . 0 0 "[ . 1 . 2]" 1
828 1 184 LEU MD2 1 229 ILE MD 3.510 . 5.220 4.230 3.848 4.676 . 0 0 "[ . 1 . 2]" 1
829 1 184 LEU MD2 1 232 LEU MD2 2.620 . 3.440 2.231 1.870 3.010 . 0 0 "[ . 1 . 2]" 1
830 1 184 LEU MD2 1 228 LEU MD2 3.210 . 4.620 4.396 2.829 4.651 0.031 13 0 "[ . 1 . 2]" 1
831 1 169 LEU MD2 1 170 VAL H 3.860 . 5.920 5.117 4.938 5.302 . 0 0 "[ . 1 . 2]" 1
832 1 156 ALA H 1 169 LEU MD2 3.890 . 5.980 4.731 4.545 5.073 . 0 0 "[ . 1 . 2]" 1
833 1 158 TYR HD1 1 169 LEU MD2 4.490 . 7.180 5.764 5.458 6.041 . 0 0 "[ . 1 . 2]" 1
834 1 168 PHE HB2 1 169 LEU MD2 4.510 . 7.220 5.748 5.486 6.055 . 0 0 "[ . 1 . 2]" 1
835 1 156 ALA MB 1 169 LEU MD2 2.900 . 4.000 2.523 2.275 2.934 . 0 0 "[ . 1 . 2]" 1
836 1 159 LEU MD1 1 169 LEU MD2 2.490 . 3.180 2.004 1.854 2.197 . 0 0 "[ . 1 . 2]" 1
837 1 160 LEU MD1 1 183 SER H 3.600 . 5.400 4.097 3.907 4.329 . 0 0 "[ . 1 . 2]" 1
838 1 160 LEU MD1 1 190 VAL H 4.370 . 6.940 5.585 5.374 5.882 . 0 0 "[ . 1 . 2]" 1
839 1 160 LEU MD1 1 168 PHE HB2 3.630 . 5.460 4.652 4.035 5.231 . 0 0 "[ . 1 . 2]" 1
840 1 156 ALA MB 1 160 LEU MD1 3.130 . 4.460 3.661 3.133 4.104 . 0 0 "[ . 1 . 2]" 1
841 1 159 LEU MD1 1 160 LEU MD1 3.420 . 5.040 5.052 4.908 5.124 0.084 20 0 "[ . 1 . 2]" 1
842 1 160 LEU MD1 1 190 VAL MG1 2.600 . 3.400 1.967 1.876 2.090 . 0 0 "[ . 1 . 2]" 1
843 1 226 ASP H 1 228 LEU MD1 4.150 . 6.500 4.473 4.100 4.851 . 0 0 "[ . 1 . 2]" 1
844 1 228 LEU MD1 1 229 ILE H 3.790 . 5.780 4.500 4.304 4.591 . 0 0 "[ . 1 . 2]" 1
845 1 193 TYR HD2 1 228 LEU MD1 3.290 . 5.780 5.439 4.749 5.701 . 0 0 "[ . 1 . 2]" 1
846 1 193 TYR HE2 1 228 LEU MD1 3.220 . 4.640 4.750 4.407 4.853 0.213 6 0 "[ . 1 . 2]" 1
847 1 168 PHE HB2 1 228 LEU MD1 4.100 . 6.400 5.385 4.912 5.578 . 0 0 "[ . 1 . 2]" 1
848 1 168 PHE HB3 1 228 LEU MD1 4.340 . 6.880 5.404 4.881 5.616 . 0 0 "[ . 1 . 2]" 1
849 1 193 TYR HB3 1 228 LEU MD1 4.070 . 6.340 5.274 4.971 6.271 . 0 0 "[ . 1 . 2]" 1
850 1 225 ALA MB 1 228 LEU MD1 3.380 . 4.960 4.783 4.496 5.002 0.042 7 0 "[ . 1 . 2]" 1
851 1 184 LEU MD2 1 228 LEU MD1 2.660 . 3.520 3.044 2.118 3.332 . 0 0 "[ . 1 . 2]" 1
852 1 228 LEU MD1 1 232 LEU MD2 2.670 . 3.540 2.082 1.953 2.172 . 0 0 "[ . 1 . 2]" 1
853 1 169 LEU H 1 232 LEU MD1 3.630 . 5.460 5.219 4.911 5.489 0.029 1 0 "[ . 1 . 2]" 1
854 1 168 PHE H 1 232 LEU MD1 4.350 . 6.900 6.257 5.879 6.647 . 0 0 "[ . 1 . 2]" 1
855 1 232 LEU MD1 1 233 HIS H 4.180 . 6.560 5.325 5.006 5.686 . 0 0 "[ . 1 . 2]" 1
856 1 219 HIS H 1 232 LEU MD1 3.870 . 5.940 5.179 4.734 5.636 . 0 0 "[ . 1 . 2]" 1
857 1 232 LEU H 1 232 LEU MD1 3.230 . 4.660 3.681 3.600 3.768 . 0 0 "[ . 1 . 2]" 1
858 1 168 PHE HE2 1 232 LEU MD1 3.420 . 5.040 3.054 2.872 3.266 . 0 0 "[ . 1 . 2]" 1
859 1 168 PHE HD2 1 232 LEU MD1 3.350 . 4.900 2.729 2.586 2.936 . 0 0 "[ . 1 . 2]" 1
860 1 168 PHE HB2 1 232 LEU MD1 3.750 . 5.700 3.654 3.371 3.949 . 0 0 "[ . 1 . 2]" 1
861 1 168 PHE HB3 1 232 LEU MD1 4.090 . 6.380 4.180 3.862 4.539 . 0 0 "[ . 1 . 2]" 1
862 1 170 VAL MG2 1 232 LEU MD1 3.230 . 4.660 3.681 3.271 3.950 . 0 0 "[ . 1 . 2]" 1
863 1 73 LEU MD2 1 232 LEU MD1 3.680 . 5.560 5.279 4.539 5.642 0.082 14 0 "[ . 1 . 2]" 1
864 1 228 LEU MD1 1 232 LEU MD1 3.010 . 4.220 2.647 2.458 2.866 . 0 0 "[ . 1 . 2]" 1
865 1 228 LEU MD2 1 232 LEU MD1 3.640 . 5.480 3.998 3.778 4.234 . 0 0 "[ . 1 . 2]" 1
866 1 169 LEU H 1 170 VAL MG2 3.680 . 5.560 4.426 4.270 4.575 . 0 0 "[ . 1 . 2]" 1
867 1 170 VAL MG2 1 183 SER H 3.910 . 6.020 4.471 4.140 4.759 . 0 0 "[ . 1 . 2]" 1
868 1 146 TRP HE3 1 170 VAL MG2 2.990 . 4.180 2.474 2.294 2.642 . 0 0 "[ . 1 . 2]" 1
869 1 146 TRP HZ3 1 170 VAL MG2 3.020 . 4.240 2.781 2.416 3.251 . 0 0 "[ . 1 . 2]" 1
870 1 146 TRP HH2 1 170 VAL MG2 3.450 . 5.100 4.297 3.975 4.777 . 0 0 "[ . 1 . 2]" 1
871 1 168 PHE HB2 1 170 VAL MG2 3.960 . 6.120 4.747 4.543 4.962 . 0 0 "[ . 1 . 2]" 1
872 1 170 VAL MG2 1 195 ILE MD 2.900 . 4.000 2.558 2.114 2.864 . 0 0 "[ . 1 . 2]" 1
873 1 170 VAL MG2 1 182 ILE MD 3.100 . 4.400 2.842 2.631 2.975 . 0 0 "[ . 1 . 2]" 1
874 1 146 TRP HE3 1 195 ILE MD 4.100 . 6.400 5.517 5.077 5.923 . 0 0 "[ . 1 . 2]" 1
875 1 146 TRP HZ3 1 195 ILE MD 3.950 . 6.100 4.753 4.455 5.059 . 0 0 "[ . 1 . 2]" 1
876 1 147 TYR HD1 1 195 ILE MD 4.180 . 6.560 5.005 4.549 5.424 . 0 0 "[ . 1 . 2]" 1
877 1 147 TYR HE1 1 195 ILE MD 3.640 . 5.480 4.630 4.150 5.258 . 0 0 "[ . 1 . 2]" 1
878 1 146 TRP HH2 1 195 ILE MD 4.550 . 7.300 5.947 5.587 6.399 . 0 0 "[ . 1 . 2]" 1
879 1 182 ILE MD 1 195 ILE MD 2.920 . 4.040 2.800 2.493 3.145 . 0 0 "[ . 1 . 2]" 1
880 1 195 ILE MD 1 218 VAL MG2 3.290 . 4.780 4.046 3.638 4.283 . 0 0 "[ . 1 . 2]" 1
881 1 182 ILE H 1 182 ILE MD 3.660 . 5.520 3.858 3.790 4.054 . 0 0 "[ . 1 . 2]" 1
882 1 182 ILE MD 1 193 TYR HB2 3.690 . 5.580 3.006 2.632 4.852 . 0 0 "[ . 1 . 2]" 1
883 1 182 ILE MD 1 217 LEU MD2 2.980 . 4.160 2.452 2.115 2.921 . 0 0 "[ . 1 . 2]" 1
884 1 182 ILE MD 1 205 VAL MG1 3.170 . 4.540 3.649 3.562 3.853 . 0 0 "[ . 1 . 2]" 1
885 1 182 ILE MD 1 228 LEU MD1 2.930 . 4.060 3.416 3.089 3.597 . 0 0 "[ . 1 . 2]" 1
886 1 182 ILE MD 1 232 LEU MD1 2.790 . 3.780 2.318 2.109 2.563 . 0 0 "[ . 1 . 2]" 1
887 1 182 ILE MD 1 218 VAL MG2 3.150 . 4.500 3.283 3.011 3.542 . 0 0 "[ . 1 . 2]" 1
888 1 186 TYR HD2 1 229 ILE MD 2.840 . 3.880 2.159 1.827 2.840 . 0 0 "[ . 1 . 2]" 1
889 1 186 TYR HE2 1 229 ILE MD 2.980 . 4.160 3.489 2.826 4.242 0.082 13 0 "[ . 1 . 2]" 1
890 1 186 TYR HB3 1 229 ILE MD 3.300 . 4.800 2.831 2.194 3.411 . 0 0 "[ . 1 . 2]" 1
891 1 186 TYR HB2 1 229 ILE MD 3.320 . 4.840 4.146 3.591 4.770 . 0 0 "[ . 1 . 2]" 1
892 1 148 HIS H 1 170 VAL MG1 3.510 . 5.220 4.546 4.311 4.711 . 0 0 "[ . 1 . 2]" 1
893 1 170 VAL MG1 1 172 GLU H 3.760 . 5.720 4.527 4.070 4.847 . 0 0 "[ . 1 . 2]" 1
894 1 147 TYR H 1 170 VAL MG1 4.190 . 6.580 5.662 5.422 5.951 . 0 0 "[ . 1 . 2]" 1
895 1 146 TRP HE3 1 170 VAL MG1 3.190 . 4.580 3.596 3.212 3.942 . 0 0 "[ . 1 . 2]" 1
896 1 147 TYR HD1 1 170 VAL MG1 2.910 . 4.020 2.625 2.261 3.108 . 0 0 "[ . 1 . 2]" 1
897 1 146 TRP HH2 1 170 VAL MG1 4.000 . 6.200 4.702 4.318 4.937 . 0 0 "[ . 1 . 2]" 1
898 1 149 GLY H 1 170 VAL MG1 3.580 . 5.360 4.781 4.373 5.133 . 0 0 "[ . 1 . 2]" 1
899 1 170 VAL MG1 1 195 ILE MD 2.750 . 3.700 2.064 1.958 2.238 . 0 0 "[ . 1 . 2]" 1
900 1 146 TRP HE3 1 214 LEU MD2 3.360 . 4.920 4.056 3.606 4.444 . 0 0 "[ . 1 . 2]" 1
901 1 147 TYR HD1 1 214 LEU MD2 2.990 . 4.180 3.716 3.471 4.058 . 0 0 "[ . 1 . 2]" 1
902 1 147 TYR HE1 1 214 LEU MD2 3.360 . 4.920 4.358 3.924 4.787 . 0 0 "[ . 1 . 2]" 1
903 1 146 TRP HH2 1 214 LEU MD2 3.300 . 4.800 2.832 2.556 3.158 . 0 0 "[ . 1 . 2]" 1
904 1 214 LEU MD2 1 215 ALA MB 3.830 . 5.860 4.954 4.838 5.096 . 0 0 "[ . 1 . 2]" 1
905 1 195 ILE MD 1 214 LEU MD2 2.480 . 3.160 2.132 1.820 2.339 . 0 0 "[ . 1 . 2]" 1
906 1 214 LEU MD2 1 232 LEU MD1 4.010 . 6.220 4.783 4.522 5.081 . 0 0 "[ . 1 . 2]" 1
907 1 214 LEU MD2 1 218 VAL MG2 2.910 . 4.020 2.083 1.967 2.386 . 0 0 "[ . 1 . 2]" 1
908 1 217 LEU MD2 1 218 VAL H 3.780 . 5.760 4.153 4.061 4.234 . 0 0 "[ . 1 . 2]" 1
909 1 211 PHE HE1 1 217 LEU MD2 2.980 . 4.160 3.714 3.577 3.840 . 0 0 "[ . 1 . 2]" 1
910 1 211 PHE HZ 1 217 LEU MD2 3.700 . 5.600 5.590 5.503 5.657 0.057 19 0 "[ . 1 . 2]" 1
911 1 204 TYR HB3 1 217 LEU MD2 3.940 . 6.080 4.999 4.671 5.337 . 0 0 "[ . 1 . 2]" 1
912 1 195 ILE MD 1 217 LEU MD2 2.590 . 3.380 2.109 2.044 2.175 . 0 0 "[ . 1 . 2]" 1
913 1 217 LEU MD2 1 232 LEU MD1 4.070 . 6.340 4.864 4.607 5.183 . 0 0 "[ . 1 . 2]" 1
914 1 217 LEU MD2 1 218 VAL MG2 3.460 . 5.120 3.605 3.499 3.717 . 0 0 "[ . 1 . 2]" 1
915 1 217 LEU MD2 1 228 LEU MD2 4.270 . 6.740 5.199 4.774 5.468 . 0 0 "[ . 1 . 2]" 1
916 1 214 LEU MD1 1 215 ALA H 3.620 . 5.440 4.965 4.791 5.083 . 0 0 "[ . 1 . 2]" 1
917 1 147 TYR H 1 214 LEU MD1 4.170 . 6.540 6.445 5.968 6.642 0.102 9 0 "[ . 1 . 2]" 1
918 1 146 TRP HE3 1 214 LEU MD1 3.320 . 4.840 4.637 3.978 4.906 0.066 9 0 "[ . 1 . 2]" 1
919 1 147 TYR HD1 1 214 LEU MD1 2.810 . 3.820 2.610 2.236 3.019 . 0 0 "[ . 1 . 2]" 1
920 1 146 TRP HH2 1 214 LEU MD1 3.070 . 4.340 3.532 2.973 4.087 . 0 0 "[ . 1 . 2]" 1
921 1 214 LEU MD1 1 215 ALA MB 4.100 . 6.400 5.644 5.370 5.806 . 0 0 "[ . 1 . 2]" 1
922 1 214 LEU MD1 1 218 VAL MG2 3.250 . 4.700 4.050 3.874 4.363 . 0 0 "[ . 1 . 2]" 1
923 1 170 VAL H 1 218 VAL MG2 3.630 . 5.460 4.934 4.681 5.240 . 0 0 "[ . 1 . 2]" 1
924 1 218 VAL MG2 1 219 HIS H 3.310 . 4.820 4.000 3.926 4.097 . 0 0 "[ . 1 . 2]" 1
925 1 216 GLU H 1 218 VAL MG2 4.240 . 6.680 5.556 5.342 5.840 . 0 0 "[ . 1 . 2]" 1
926 1 146 TRP HE3 1 218 VAL MG2 3.320 . 4.840 3.413 3.170 3.733 . 0 0 "[ . 1 . 2]" 1
927 1 217 LEU H 1 218 VAL MG2 3.670 . 5.540 4.521 4.425 4.671 . 0 0 "[ . 1 . 2]" 1
928 1 67 TRP HZ2 1 218 VAL MG2 3.690 . 5.580 4.803 4.518 5.606 0.026 13 0 "[ . 1 . 2]" 1
929 1 146 TRP HZ3 1 218 VAL MG2 3.310 . 4.820 3.193 2.877 3.480 . 0 0 "[ . 1 . 2]" 1
930 1 168 PHE HE2 1 218 VAL MG2 3.110 . 4.420 2.955 2.713 3.122 . 0 0 "[ . 1 . 2]" 1
931 1 146 TRP HH2 1 218 VAL MG2 3.380 . 4.960 3.149 2.928 3.546 . 0 0 "[ . 1 . 2]" 1
932 1 215 ALA MB 1 218 VAL MG2 3.740 . 5.680 4.910 4.694 5.253 . 0 0 "[ . 1 . 2]" 1
933 1 170 VAL MG2 1 218 VAL MG2 2.810 . 3.820 2.329 2.115 2.701 . 0 0 "[ . 1 . 2]" 1
934 1 73 LEU MD2 1 218 VAL MG2 3.350 . 4.900 4.244 3.863 4.774 . 0 0 "[ . 1 . 2]" 1
935 1 218 VAL MG2 1 232 LEU MD1 2.940 . 4.080 2.896 2.475 3.380 . 0 0 "[ . 1 . 2]" 1
936 1 218 VAL MG1 1 219 HIS H 3.290 . 4.780 3.440 3.266 3.593 . 0 0 "[ . 1 . 2]" 1
937 1 218 VAL MG1 1 222 SER H 3.390 . 4.980 4.259 4.129 4.344 . 0 0 "[ . 1 . 2]" 1
938 1 146 TRP HD1 1 218 VAL MG1 3.180 . 4.560 3.602 3.170 3.983 . 0 0 "[ . 1 . 2]" 1
939 1 67 TRP HZ2 1 218 VAL MG1 3.190 . 4.580 2.618 1.971 4.255 . 0 0 "[ . 1 . 2]" 1
940 1 146 TRP HZ3 1 218 VAL MG1 3.880 . 5.960 5.064 4.657 5.495 . 0 0 "[ . 1 . 2]" 1
941 1 67 TRP HH2 1 218 VAL MG1 3.320 . 4.840 2.352 1.808 3.911 . 0 0 "[ . 1 . 2]" 1
942 1 168 PHE HE2 1 218 VAL MG1 3.410 . 5.020 2.184 2.061 2.323 . 0 0 "[ . 1 . 2]" 1
943 1 146 TRP HH2 1 218 VAL MG1 3.910 . 6.020 4.693 4.221 5.229 . 0 0 "[ . 1 . 2]" 1
944 1 73 LEU MD2 1 218 VAL MG1 3.140 . 4.480 2.486 2.074 3.060 . 0 0 "[ . 1 . 2]" 1
945 1 182 ILE MD 1 218 VAL MG1 3.530 . 5.260 4.601 4.241 4.807 . 0 0 "[ . 1 . 2]" 1
946 1 218 VAL MG1 1 228 LEU MD1 4.270 . 6.740 5.489 5.177 5.796 . 0 0 "[ . 1 . 2]" 1
947 1 218 VAL MG1 1 232 LEU MD1 2.890 . 3.980 2.557 2.081 3.069 . 0 0 "[ . 1 . 2]" 1
948 1 182 ILE H 1 228 LEU MD2 4.080 . 6.360 6.149 5.358 6.416 0.056 16 0 "[ . 1 . 2]" 1
949 1 194 ARG H 1 228 LEU MD2 4.350 . 6.900 5.667 5.246 6.834 . 0 0 "[ . 1 . 2]" 1
950 1 193 TYR HD1 1 228 LEU MD2 3.250 . 4.700 2.931 2.571 3.389 . 0 0 "[ . 1 . 2]" 1
951 1 193 TYR HD2 1 228 LEU MD2 3.320 . 4.840 3.859 3.041 4.827 . 0 0 "[ . 1 . 2]" 1
952 1 193 TYR HE1 1 228 LEU MD2 3.220 . 4.640 2.934 2.118 3.745 . 0 0 "[ . 1 . 2]" 1
953 1 193 TYR HE2 1 228 LEU MD2 3.350 . 4.900 3.876 3.377 4.658 . 0 0 "[ . 1 . 2]" 1
954 1 193 TYR HB3 1 228 LEU MD2 3.220 . 4.640 3.470 3.107 4.549 . 0 0 "[ . 1 . 2]" 1
955 1 193 TYR HB2 1 228 LEU MD2 3.280 . 4.760 4.026 3.273 4.282 . 0 0 "[ . 1 . 2]" 1
956 1 225 ALA MB 1 228 LEU MD2 3.660 . 5.520 5.569 5.373 5.722 0.202 1 0 "[ . 1 . 2]" 1
957 1 205 VAL MG1 1 228 LEU MD2 2.510 . 3.220 2.207 2.099 2.428 . 0 0 "[ . 1 . 2]" 1
958 1 205 VAL MG2 1 228 LEU MD2 2.740 . 3.680 2.733 2.449 2.905 . 0 0 "[ . 1 . 2]" 1
959 1 182 ILE MD 1 228 LEU MD2 2.890 . 3.980 3.239 2.830 3.494 . 0 0 "[ . 1 . 2]" 1
960 1 228 LEU MD2 1 232 LEU MD2 3.100 . 4.400 3.671 3.198 3.900 . 0 0 "[ . 1 . 2]" 1
961 1 205 VAL H 1 205 VAL MG1 3.600 . 5.400 3.821 3.778 3.867 . 0 0 "[ . 1 . 2]" 1
962 1 193 TYR H 1 205 VAL MG1 3.930 . 6.060 5.028 4.889 5.143 . 0 0 "[ . 1 . 2]" 1
963 1 182 ILE H 1 205 VAL MG1 4.060 . 6.320 5.279 5.041 5.445 . 0 0 "[ . 1 . 2]" 1
964 1 194 ARG H 1 205 VAL MG1 3.300 . 4.800 3.000 2.524 4.227 . 0 0 "[ . 1 . 2]" 1
965 1 193 TYR HB3 1 205 VAL MG1 3.050 . 4.300 2.140 1.953 3.333 . 0 0 "[ . 1 . 2]" 1
966 1 193 TYR HB2 1 205 VAL MG1 3.100 . 4.400 3.257 2.170 3.461 . 0 0 "[ . 1 . 2]" 1
967 1 224 VAL MG2 1 226 ASP H 2.790 . 3.780 2.438 2.248 2.659 . 0 0 "[ . 1 . 2]" 1
968 1 224 VAL H 1 224 VAL MG2 2.710 . 3.620 2.358 2.270 2.454 . 0 0 "[ . 1 . 2]" 1
969 1 205 VAL H 1 205 VAL MG2 3.500 . 5.200 2.397 2.262 2.496 . 0 0 "[ . 1 . 2]" 1
970 1 205 VAL MG2 1 206 SER H 3.320 . 4.840 3.875 3.735 3.969 . 0 0 "[ . 1 . 2]" 1
971 1 205 VAL MG2 1 211 PHE HE1 3.920 . 6.040 4.258 3.992 4.534 . 0 0 "[ . 1 . 2]" 1
972 1 193 TYR HB3 1 205 VAL MG2 3.440 . 5.080 2.664 2.237 4.645 . 0 0 "[ . 1 . 2]" 1
973 1 193 TYR HB2 1 205 VAL MG2 3.440 . 5.080 2.905 2.614 3.306 . 0 0 "[ . 1 . 2]" 1
974 1 205 VAL MG2 1 228 LEU MD1 2.930 . 4.060 3.997 3.629 4.143 0.083 9 0 "[ . 1 . 2]" 1
975 1 205 VAL MG2 1 232 LEU MD1 3.650 . 5.500 4.378 4.032 4.723 . 0 0 "[ . 1 . 2]" 1
976 1 205 VAL MG2 1 218 VAL MG2 4.150 . 6.500 5.236 4.818 5.472 . 0 0 "[ . 1 . 2]" 1
977 1 185 ARG H 1 232 LEU MD2 3.860 . 5.920 5.554 4.947 5.901 . 0 0 "[ . 1 . 2]" 1
978 1 169 LEU H 1 232 LEU MD2 3.650 . 5.500 4.383 4.166 4.718 . 0 0 "[ . 1 . 2]" 1
979 1 232 LEU MD2 1 234 TYR H 4.180 . 6.560 5.803 5.316 6.264 . 0 0 "[ . 1 . 2]" 1
980 1 193 TYR HD2 1 232 LEU MD2 3.740 . 5.680 5.859 4.740 5.965 0.285 16 0 "[ . 1 . 2]" 1
981 1 182 ILE MD 1 232 LEU MD2 3.130 . 4.460 3.213 2.866 3.524 . 0 0 "[ . 1 . 2]" 1
982 1 218 VAL MG1 1 232 LEU MD2 3.660 . 5.520 4.593 4.076 5.134 . 0 0 "[ . 1 . 2]" 1
983 1 160 LEU H 1 190 VAL MG1 3.690 . 5.580 4.864 4.523 5.215 . 0 0 "[ . 1 . 2]" 1
984 1 190 VAL MG1 1 191 TYR HE1 4.360 . 6.920 6.344 6.186 6.483 . 0 0 "[ . 1 . 2]" 1
985 1 190 VAL MG1 1 191 TYR HB2 3.730 . 5.660 4.907 4.775 5.054 . 0 0 "[ . 1 . 2]" 1
986 1 156 ALA MB 1 190 VAL MG1 3.410 . 5.020 3.636 3.197 3.949 . 0 0 "[ . 1 . 2]" 1
987 1 225 ALA H 1 225 ALA MB 2.700 . 3.600 2.275 2.245 2.301 . 0 0 "[ . 1 . 2]" 1
988 1 185 ARG H 1 236 ALA MB 4.080 . 6.360 5.878 5.409 6.415 0.055 3 0 "[ . 1 . 2]" 1
989 1 236 ALA H 1 236 ALA MB 2.820 . 3.840 2.252 2.217 2.274 . 0 0 "[ . 1 . 2]" 1
990 1 156 ALA MB 1 236 ALA MB 4.100 . 6.400 5.505 5.142 5.803 . 0 0 "[ . 1 . 2]" 1
991 1 215 ALA H 1 215 ALA MB 2.980 . 4.160 2.228 2.203 2.251 . 0 0 "[ . 1 . 2]" 1
992 1 215 ALA MB 1 218 VAL H 3.770 . 5.740 4.923 4.787 5.063 . 0 0 "[ . 1 . 2]" 1
993 1 146 TRP HZ2 1 215 ALA MB 3.080 . 4.360 3.949 3.132 4.390 0.030 7 0 "[ . 1 . 2]" 1
994 1 146 TRP HH2 1 215 ALA MB 3.300 . 4.800 4.192 3.539 4.624 . 0 0 "[ . 1 . 2]" 1
995 1 155 ALA MB 1 156 ALA H 3.250 . 4.700 2.683 2.441 2.915 . 0 0 "[ . 1 . 2]" 1
996 1 155 ALA H 1 155 ALA MB 3.160 . 4.520 2.248 2.200 2.280 . 0 0 "[ . 1 . 2]" 1
997 1 153 ARG H 1 156 ALA MB 3.800 . 5.800 4.648 4.397 4.951 . 0 0 "[ . 1 . 2]" 1
998 1 156 ALA H 1 156 ALA MB 2.990 . 4.180 2.253 2.229 2.273 . 0 0 "[ . 1 . 2]" 1
999 1 156 ALA MB 1 158 TYR H 3.700 . 5.600 4.444 4.269 4.719 . 0 0 "[ . 1 . 2]" 1
1000 1 156 ALA MB 1 158 TYR HD1 4.420 . 7.040 6.282 5.747 6.569 . 0 0 "[ . 1 . 2]" 1
1001 1 155 ALA MB 1 158 TYR HB3 3.760 . 5.720 4.157 3.490 5.510 . 0 0 "[ . 1 . 2]" 1
1002 1 151 VAL MG1 1 156 ALA MB 2.780 . 3.760 2.427 2.191 2.665 . 0 0 "[ . 1 . 2]" 1
1003 1 151 VAL MG2 1 156 ALA MB 3.600 . 5.400 4.504 3.997 4.882 . 0 0 "[ . 1 . 2]" 1
1004 1 157 GLU H 1 159 LEU MD1 3.560 . 5.320 5.092 4.699 5.386 0.066 12 0 "[ . 1 . 2]" 1
1005 1 159 LEU MD1 1 160 LEU H 3.460 . 5.120 4.489 4.296 4.673 . 0 0 "[ . 1 . 2]" 1
1006 1 158 TYR HD1 1 159 LEU MD1 3.380 . 4.960 3.996 3.769 4.270 . 0 0 "[ . 1 . 2]" 1
1007 1 158 TYR HE1 1 159 LEU MD1 3.500 . 5.200 4.488 3.211 5.362 0.162 6 0 "[ . 1 . 2]" 1
1008 1 158 TYR HB3 1 159 LEU MD1 3.890 . 5.980 5.276 4.642 6.272 0.292 17 0 "[ . 1 . 2]" 1
1009 1 156 ALA MB 1 159 LEU MD1 2.960 . 4.120 3.510 3.138 3.800 . 0 0 "[ . 1 . 2]" 1
1010 1 169 LEU MD1 1 170 VAL H 2.950 . 4.100 3.538 3.332 3.754 . 0 0 "[ . 1 . 2]" 1
1011 1 147 TYR H 1 169 LEU MD1 4.130 . 6.460 6.511 6.441 6.613 0.153 12 0 "[ . 1 . 2]" 1
1012 1 168 PHE HB2 1 169 LEU MD1 4.310 . 6.820 5.817 5.628 5.994 . 0 0 "[ . 1 . 2]" 1
1013 1 156 ALA MB 1 169 LEU MD1 2.750 . 3.700 2.235 1.991 2.600 . 0 0 "[ . 1 . 2]" 1
1014 1 151 VAL MG1 1 169 LEU MD1 2.870 . 3.940 2.875 2.560 3.465 . 0 0 "[ . 1 . 2]" 1
1015 1 151 VAL MG2 1 169 LEU MD1 2.840 . 3.880 3.506 2.910 3.916 0.036 2 0 "[ . 1 . 2]" 1
1016 1 164 ILE MD 1 168 PHE H 4.560 . 7.320 6.717 6.373 7.375 0.055 2 0 "[ . 1 . 2]" 1
1017 1 206 SER H 1 217 LEU MD1 3.510 . 5.220 3.755 3.550 4.124 . 0 0 "[ . 1 . 2]" 1
1018 1 217 LEU MD1 1 218 VAL H 3.470 . 5.140 4.093 4.023 4.189 . 0 0 "[ . 1 . 2]" 1
1019 1 211 PHE HE1 1 217 LEU MD1 3.080 . 4.360 1.814 1.759 1.887 0.041 5 0 "[ . 1 . 2]" 1
1020 1 211 PHE HB2 1 217 LEU MD1 4.030 . 6.260 4.748 4.575 4.910 . 0 0 "[ . 1 . 2]" 1
1021 1 217 LEU MD1 1 228 LEU MD1 3.680 . 5.560 4.222 3.815 4.496 . 0 0 "[ . 1 . 2]" 1
1022 1 217 LEU MD1 1 232 LEU MD1 3.500 . 5.200 4.072 3.793 4.347 . 0 0 "[ . 1 . 2]" 1
1023 1 217 LEU MD1 1 228 LEU MD2 3.590 . 5.380 3.749 3.278 4.027 . 0 0 "[ . 1 . 2]" 1
1024 1 159 LEU H 1 159 LEU MD2 3.140 . 4.480 3.677 3.480 3.957 . 0 0 "[ . 1 . 2]" 1
1025 1 159 LEU MD2 1 238 LYS H 4.030 . 6.260 5.073 4.294 5.679 . 0 0 "[ . 1 . 2]" 1
1026 1 158 TYR H 1 159 LEU MD2 4.130 . 6.460 5.744 5.366 6.216 . 0 0 "[ . 1 . 2]" 1
1027 1 158 TYR HB3 1 159 LEU MD2 3.830 . 5.860 5.310 4.592 6.092 0.232 20 0 "[ . 1 . 2]" 1
1028 1 155 ALA MB 1 159 LEU MD2 3.190 . 4.580 4.582 4.236 4.787 0.207 18 0 "[ . 1 . 2]" 1
1029 1 205 VAL MG2 1 221 HIS H 4.360 . 6.920 6.610 6.360 6.980 0.060 11 0 "[ . 1 . 2]" 1
1030 1 224 VAL H 1 224 VAL MG1 2.820 . 3.840 3.127 2.988 3.265 . 0 0 "[ . 1 . 2]" 1
1031 1 190 VAL MG2 1 191 TYR HD1 3.760 . 5.720 5.437 5.322 5.547 . 0 0 "[ . 1 . 2]" 1
1032 1 190 VAL MG2 1 191 TYR HE1 4.080 . 6.360 5.999 5.833 6.154 . 0 0 "[ . 1 . 2]" 1
1033 1 141 LEU MD2 1 215 ALA MB 3.250 . 4.700 2.764 2.166 3.319 . 0 0 "[ . 1 . 2]" 1
1034 1 151 VAL MG1 1 156 ALA H 3.040 . 4.280 2.729 2.565 2.976 . 0 0 "[ . 1 . 2]" 1
1035 1 148 HIS H 1 151 VAL MG2 3.500 . 5.200 3.980 3.407 4.383 . 0 0 "[ . 1 . 2]" 1
1036 1 151 VAL H 1 151 VAL MG2 2.660 . 3.520 2.994 2.567 3.181 . 0 0 "[ . 1 . 2]" 1
1037 1 151 VAL MG2 1 169 LEU MD2 3.250 . 4.700 4.539 4.316 4.751 0.051 2 0 "[ . 1 . 2]" 1
1038 1 118 TRP HE1 1 244 VAL MG1 3.680 . 5.560 2.099 1.801 3.150 . 0 0 "[ . 1 . 2]" 1
1039 1 86 VAL H 1 86 VAL MG2 3.340 . 4.880 3.976 3.947 4.015 . 0 0 "[ . 1 . 2]" 1
1040 1 86 VAL MG2 1 87 ALA H 2.650 . 3.500 2.528 2.290 2.751 . 0 0 "[ . 1 . 2]" 1
1041 1 118 TRP HD1 1 244 VAL MG1 3.470 . 5.140 4.074 3.591 5.210 0.070 7 0 "[ . 1 . 2]" 1
1042 1 141 LEU MD2 1 146 TRP HZ2 3.510 . 5.220 3.765 3.084 4.475 . 0 0 "[ . 1 . 2]" 1
1043 1 141 LEU MD2 1 146 TRP HH2 3.120 . 4.440 2.418 1.802 3.249 . 0 0 "[ . 1 . 2]" 1
1044 1 141 LEU MD2 1 170 VAL MG1 3.830 . 5.860 5.320 4.896 5.761 . 0 0 "[ . 1 . 2]" 1
1045 1 141 LEU MD2 1 214 LEU MD1 2.660 . 3.520 3.514 3.227 3.667 0.147 16 0 "[ . 1 . 2]" 1
1046 1 141 LEU MD2 1 218 VAL MG2 3.870 . 5.940 4.676 4.074 5.250 . 0 0 "[ . 1 . 2]" 1
1047 1 52 VAL H 1 52 VAL MG1 3.460 . 5.120 2.373 1.938 3.864 . 0 0 "[ . 1 . 2]" 1
1048 1 52 VAL MG1 1 53 ALA MB 3.810 . 5.820 4.742 3.844 5.169 . 0 0 "[ . 1 . 2]" 1
1049 1 91 PHE HE1 1 244 VAL MG2 3.340 . 4.880 3.165 2.446 3.814 . 0 0 "[ . 1 . 2]" 1
1050 1 134 TYR HD1 1 244 VAL MG2 3.240 . 4.680 3.574 3.040 4.279 . 0 0 "[ . 1 . 2]" 1
1051 1 118 TRP HZ3 1 244 VAL MG2 4.300 . 6.800 5.399 4.737 5.945 . 0 0 "[ . 1 . 2]" 1
1052 1 246 GLY H 1 247 VAL MG1 3.640 . 5.480 4.671 3.984 5.872 0.392 13 0 "[ . 1 . 2]" 1
1053 1 198 ALA H 1 198 ALA MB 2.930 . 4.060 2.236 2.192 2.275 . 0 0 "[ . 1 . 2]" 1
1054 1 198 ALA MB 1 211 PHE H 3.760 . 5.720 5.578 5.123 5.775 0.055 3 0 "[ . 1 . 2]" 1
1055 1 198 ALA MB 1 204 TYR HE1 3.030 . 4.260 1.930 1.725 2.342 0.075 3 0 "[ . 1 . 2]" 1
1056 1 64 ALA H 1 64 ALA MB 3.280 . 4.760 2.326 2.215 2.981 . 0 0 "[ . 1 . 2]" 1
1057 1 65 ALA H 1 65 ALA MB 3.300 . 4.800 2.426 2.194 2.999 . 0 0 "[ . 1 . 2]" 1
1058 1 65 ALA MB 1 66 ARG H 3.380 . 4.960 2.650 1.855 3.539 . 0 0 "[ . 1 . 2]" 1
1059 1 74 LEU H 1 75 ALA MB 3.710 . 5.620 4.140 3.908 4.668 . 0 0 "[ . 1 . 2]" 1
1060 1 75 ALA H 1 75 ALA MB 3.040 . 4.280 2.276 2.233 2.333 . 0 0 "[ . 1 . 2]" 1
1061 1 73 LEU MD2 1 222 SER H 3.620 . 5.440 5.053 4.654 5.438 . 0 0 "[ . 1 . 2]" 1
1062 1 67 TRP HZ2 1 73 LEU MD2 3.220 . 4.640 2.384 1.893 3.592 . 0 0 "[ . 1 . 2]" 1
1063 1 67 TRP HH2 1 73 LEU MD2 3.200 . 4.600 2.755 1.744 3.491 0.056 13 0 "[ . 1 . 2]" 1
1064 1 73 LEU MD2 1 215 ALA MB 3.640 . 5.480 4.205 3.852 4.625 . 0 0 "[ . 1 . 2]" 1
1065 1 73 LEU MD1 1 146 TRP HE1 3.590 . 5.380 2.132 1.729 2.779 0.071 8 0 "[ . 1 . 2]" 1
1066 1 72 ASN H 1 73 LEU MD1 4.060 . 6.320 5.897 5.625 6.157 . 0 0 "[ . 1 . 2]" 1
1067 1 73 LEU MD1 1 146 TRP HD1 3.420 . 5.040 4.310 3.822 4.918 . 0 0 "[ . 1 . 2]" 1
1068 1 67 TRP HZ2 1 73 LEU MD1 3.100 . 4.400 2.740 1.902 3.402 . 0 0 "[ . 1 . 2]" 1
1069 1 73 LEU MD1 1 146 TRP HZ2 3.220 . 4.640 2.005 1.878 2.105 . 0 0 "[ . 1 . 2]" 1
1070 1 73 LEU MD1 1 146 TRP HH2 3.770 . 5.740 3.697 3.323 3.960 . 0 0 "[ . 1 . 2]" 1
1071 1 73 LEU MD1 1 215 ALA MB 3.340 . 4.880 2.745 2.420 3.376 . 0 0 "[ . 1 . 2]" 1
1072 1 73 LEU MD1 1 170 VAL MG2 4.200 . 6.600 5.414 5.252 5.579 . 0 0 "[ . 1 . 2]" 1
1073 1 73 LEU MD1 1 218 VAL MG1 3.190 . 4.580 2.701 2.298 2.990 . 0 0 "[ . 1 . 2]" 1
1074 1 73 LEU H 1 74 LEU MD1 4.210 . 6.620 5.921 5.451 6.294 . 0 0 "[ . 1 . 2]" 1
1075 1 99 LEU MD2 1 130 VAL MG1 2.650 . 3.500 2.481 2.201 2.768 . 0 0 "[ . 1 . 2]" 1
1076 1 203 LEU MD2 1 217 LEU MD2 3.280 . 4.760 4.435 4.129 4.622 . 0 0 "[ . 1 . 2]" 1
1077 1 205 VAL MG2 1 217 LEU MD2 2.680 . 3.560 2.334 2.139 2.560 . 0 0 "[ . 1 . 2]" 1
1078 1 169 LEU MD2 1 236 ALA MB 2.790 . 3.780 2.411 2.102 2.880 . 0 0 "[ . 1 . 2]" 1
1079 1 151 VAL MG1 1 155 ALA H 3.350 . 4.900 3.772 3.550 4.031 . 0 0 "[ . 1 . 2]" 1
1080 1 151 VAL MG1 1 157 GLU H 3.740 . 5.680 4.789 4.664 4.996 . 0 0 "[ . 1 . 2]" 1
1081 1 110 LEU H 1 135 ILE MD 4.250 . 6.700 6.011 5.712 6.361 . 0 0 "[ . 1 . 2]" 1
1082 1 211 PHE HE1 1 214 LEU MD2 3.930 . 6.060 6.187 6.145 6.233 0.173 16 0 "[ . 1 . 2]" 1
1083 1 146 TRP HZ2 1 214 LEU MD2 3.670 . 5.540 4.530 4.199 4.944 . 0 0 "[ . 1 . 2]" 1
1084 1 87 ALA H 1 107 LEU MD1 2.960 . 4.120 3.208 2.871 3.440 . 0 0 "[ . 1 . 2]" 1
1085 1 168 PHE HB3 1 184 LEU MD1 2.780 . 3.760 1.880 1.779 2.102 0.021 11 0 "[ . 1 . 2]" 1
1086 1 86 VAL MG1 1 138 VAL MG2 2.900 . 4.000 2.587 2.310 2.820 . 0 0 "[ . 1 . 2]" 1
1087 1 182 ILE MD 1 214 LEU MD2 3.220 . 4.640 3.495 3.246 3.682 . 0 0 "[ . 1 . 2]" 1
1088 1 170 VAL MG1 1 214 LEU MD1 2.620 . 3.440 1.909 1.797 2.114 0.003 1 0 "[ . 1 . 2]" 1
1089 1 169 LEU MD1 1 170 VAL MG1 3.460 . 5.120 4.544 4.376 4.745 . 0 0 "[ . 1 . 2]" 1
1090 1 205 VAL MG2 1 217 LEU MD1 2.420 . 3.040 1.893 1.794 2.095 0.006 4 0 "[ . 1 . 2]" 1
1091 1 195 ILE MD 1 214 LEU MD1 2.990 . 4.180 2.497 2.097 2.789 . 0 0 "[ . 1 . 2]" 1
1092 1 168 PHE HZ 1 218 VAL MG1 3.080 . 4.360 2.676 2.205 2.812 . 0 0 "[ . 1 . 2]" 1
1093 1 168 PHE HD1 1 232 LEU MD2 3.230 . 4.660 3.907 3.597 4.202 . 0 0 "[ . 1 . 2]" 1
1094 1 168 PHE HD2 1 232 LEU MD2 3.460 . 5.120 3.152 2.771 3.471 . 0 0 "[ . 1 . 2]" 1
1095 1 107 LEU H 1 109 VAL MG2 4.060 . 6.320 5.422 4.804 5.984 . 0 0 "[ . 1 . 2]" 1
1096 1 168 PHE HZ 1 232 LEU MD1 3.280 . 4.760 4.170 3.897 4.419 . 0 0 "[ . 1 . 2]" 1
1097 1 146 TRP HD1 1 232 LEU MD1 4.550 . 7.300 6.280 5.838 6.725 . 0 0 "[ . 1 . 2]" 1
1098 1 146 TRP HE3 1 232 LEU MD1 4.840 . 7.880 5.904 5.623 6.208 . 0 0 "[ . 1 . 2]" 1
1099 1 160 LEU MD1 1 168 PHE H 3.950 . 6.100 4.572 4.278 5.165 . 0 0 "[ . 1 . 2]" 1
1100 1 170 VAL MG2 1 214 LEU MD1 2.740 . 3.680 3.351 2.945 3.612 . 0 0 "[ . 1 . 2]" 1
1101 1 146 TRP HZ3 1 214 LEU MD1 2.850 . 3.900 2.713 2.071 3.104 . 0 0 "[ . 1 . 2]" 1
1102 1 198 ALA MB 1 203 LEU MD1 3.920 . 6.040 5.016 4.635 5.438 . 0 0 "[ . 1 . 2]" 1
1103 1 74 LEU MD2 1 215 ALA MB 3.160 . 4.520 2.463 1.994 3.785 . 0 0 "[ . 1 . 2]" 1
1104 1 74 LEU H 1 215 ALA MB 4.000 . 6.200 4.608 4.165 4.898 . 0 0 "[ . 1 . 2]" 1
1105 1 215 ALA MB 1 219 HIS H 4.250 . 6.700 4.772 4.706 4.838 . 0 0 "[ . 1 . 2]" 1
1106 1 168 PHE H 1 236 ALA MB 3.210 . 4.620 3.895 3.448 4.418 . 0 0 "[ . 1 . 2]" 1
1107 1 101 ILE MD 1 130 VAL MG2 2.650 . 3.500 2.782 2.166 3.305 . 0 0 "[ . 1 . 2]" 1
1108 1 195 ILE MD 1 211 PHE HE1 4.100 . 6.400 6.561 6.463 6.630 0.230 19 0 "[ . 1 . 2]" 1
1109 1 180 ARG H 1 195 ILE MD 3.750 . 5.700 4.751 4.395 5.216 . 0 0 "[ . 1 . 2]" 1
1110 1 170 VAL MG1 1 182 ILE MD 3.710 . 5.620 4.163 4.010 4.488 . 0 0 "[ . 1 . 2]" 1
1111 1 182 ILE MD 1 217 LEU MD1 2.690 . 3.580 2.742 2.502 3.147 . 0 0 "[ . 1 . 2]" 1
1112 1 229 ILE H 1 229 ILE MD 3.550 . 5.300 4.531 4.471 4.563 . 0 0 "[ . 1 . 2]" 1
1113 1 229 ILE MD 1 230 THR H 3.190 . 4.580 4.643 4.470 4.746 0.166 4 0 "[ . 1 . 2]" 1
1114 1 109 VAL MG1 1 135 ILE MD 3.010 . 4.220 3.442 2.813 3.720 . 0 0 "[ . 1 . 2]" 1
1115 1 135 ILE H 1 135 ILE MD 3.370 . 4.940 3.843 3.721 4.034 . 0 0 "[ . 1 . 2]" 1
1116 1 134 TYR H 1 135 ILE MD 4.190 . 6.580 4.677 4.460 5.184 . 0 0 "[ . 1 . 2]" 1
1117 1 86 VAL H 1 135 ILE MD 3.650 . 5.500 5.096 4.777 5.512 0.012 5 0 "[ . 1 . 2]" 1
1118 1 107 LEU MD2 1 130 VAL MG2 2.690 . 3.580 2.220 1.783 2.674 0.017 15 0 "[ . 1 . 2]" 1
1119 1 130 VAL MG2 1 135 ILE H 3.290 . 4.780 4.880 4.810 4.972 0.192 5 0 "[ . 1 . 2]" 1
1120 1 118 TRP HE3 1 130 VAL MG2 3.400 . 5.000 4.921 4.714 5.095 0.095 3 0 "[ . 1 . 2]" 1
1121 1 151 VAL MG2 1 159 LEU MD1 2.620 . 3.440 2.999 2.365 3.453 0.013 3 0 "[ . 1 . 2]" 1
1122 1 151 VAL MG2 1 155 ALA MB 3.150 . 4.500 3.434 3.031 3.906 . 0 0 "[ . 1 . 2]" 1
1123 1 108 ARG H 1 110 LEU MD1 3.890 . 5.980 5.957 5.379 6.146 0.166 16 0 "[ . 1 . 2]" 1
1124 1 86 VAL MG2 1 87 ALA MB 3.080 . 4.360 3.587 3.507 3.677 . 0 0 "[ . 1 . 2]" 1
1125 1 87 ALA MB 1 107 LEU MD1 2.960 . 4.120 3.320 3.171 3.466 . 0 0 "[ . 1 . 2]" 1
1126 1 195 ILE MD 1 205 VAL MG2 3.220 . 4.640 3.621 3.360 3.940 . 0 0 "[ . 1 . 2]" 1
1127 1 118 TRP HZ2 1 244 VAL MG1 3.230 . 4.660 1.961 1.692 2.363 0.108 16 0 "[ . 1 . 2]" 1
1128 1 91 PHE HZ 1 244 VAL MG1 3.720 . 5.640 4.886 3.907 5.579 . 0 0 "[ . 1 . 2]" 1
1129 1 118 TRP HH2 1 244 VAL MG1 3.070 . 4.340 3.884 3.036 4.275 . 0 0 "[ . 1 . 2]" 1
1130 1 244 VAL MG1 1 246 GLY H 3.320 . 4.840 4.335 3.629 4.981 0.141 12 0 "[ . 1 . 2]" 1
1131 1 244 VAL MG1 1 247 VAL H 3.940 . 6.080 3.446 2.827 4.251 . 0 0 "[ . 1 . 2]" 1
1132 1 247 VAL H 1 247 VAL MG2 2.850 . 3.900 2.275 1.924 3.902 0.002 15 0 "[ . 1 . 2]" 1
1133 1 86 VAL MG2 1 107 LEU H 3.930 . 6.060 4.732 4.402 4.918 . 0 0 "[ . 1 . 2]" 1
1134 1 73 LEU MD2 1 168 PHE HZ 3.700 . 5.600 4.796 4.264 5.150 . 0 0 "[ . 1 . 2]" 1
1135 1 73 LEU MD2 1 146 TRP HD1 3.650 . 5.500 5.096 4.471 5.535 0.035 3 0 "[ . 1 . 2]" 1
1136 1 73 LEU H 1 73 LEU MD2 3.640 . 5.480 4.262 4.176 4.366 . 0 0 "[ . 1 . 2]" 1
1137 1 73 LEU MD2 1 74 LEU H 3.890 . 5.980 4.242 4.020 4.854 . 0 0 "[ . 1 . 2]" 1
1138 1 170 VAL MG1 1 182 ILE H 4.140 . 6.480 4.715 4.293 5.118 . 0 0 "[ . 1 . 2]" 1
1139 1 93 ALA MB 1 98 THR H 4.000 . 6.200 4.039 3.647 4.365 . 0 0 "[ . 1 . 2]" 1
1140 1 87 ALA MB 1 102 THR H 3.120 . 4.440 3.673 3.106 4.029 . 0 0 "[ . 1 . 2]" 1
1141 1 87 ALA MB 1 106 LYS H 3.930 . 6.060 5.318 5.079 5.540 . 0 0 "[ . 1 . 2]" 1
1142 1 160 LEU MD1 1 236 ALA MB 2.870 . 3.940 3.905 3.727 4.054 0.114 10 0 "[ . 1 . 2]" 1
1143 1 224 VAL H 1 225 ALA MB 4.360 . 6.920 5.644 5.513 5.729 . 0 0 "[ . 1 . 2]" 1
1144 1 225 ALA MB 1 229 ILE H 3.920 . 6.040 5.486 5.102 5.656 . 0 0 "[ . 1 . 2]" 1
1145 1 170 VAL MG1 1 214 LEU MD2 2.660 . 3.520 2.286 1.900 2.710 . 0 0 "[ . 1 . 2]" 1
1146 1 170 VAL MG2 1 218 VAL MG1 3.220 . 4.640 3.840 3.599 4.217 . 0 0 "[ . 1 . 2]" 1
1147 1 168 PHE HE2 1 170 VAL MG2 3.080 . 4.360 3.424 2.906 3.915 . 0 0 "[ . 1 . 2]" 1
1148 1 168 PHE HD2 1 170 VAL MG2 3.270 . 4.740 3.146 2.806 3.416 . 0 0 "[ . 1 . 2]" 1
1149 1 107 LEU MD2 1 130 VAL MG1 2.870 . 3.940 3.069 2.382 3.466 . 0 0 "[ . 1 . 2]" 1
1150 1 121 ALA MB 1 130 VAL MG1 2.780 . 3.760 2.942 2.379 3.555 . 0 0 "[ . 1 . 2]" 1
1151 1 91 PHE HE2 1 130 VAL MG1 3.120 . 4.440 3.952 3.339 4.372 . 0 0 "[ . 1 . 2]" 1
1152 1 118 TRP HE3 1 130 VAL MG1 3.460 . 5.120 4.682 4.137 5.156 0.036 11 0 "[ . 1 . 2]" 1
1153 1 129 TRP H 1 130 VAL MG1 3.410 . 5.020 4.316 3.936 4.610 . 0 0 "[ . 1 . 2]" 1
1154 1 151 VAL MG1 1 154 ASN H 4.260 . 6.720 5.301 4.984 5.639 . 0 0 "[ . 1 . 2]" 1
1155 1 119 ALA MB 1 129 TRP HE3 3.380 . 4.960 4.457 4.203 4.748 . 0 0 "[ . 1 . 2]" 1
1156 1 182 ILE MD 1 205 VAL MG2 2.410 . 3.020 1.990 1.928 2.078 . 0 0 "[ . 1 . 2]" 1
1157 1 205 VAL MG2 1 228 LEU H 4.060 . 6.320 6.353 6.068 6.540 0.220 8 0 "[ . 1 . 2]" 1
1158 1 185 ARG H 1 190 VAL MG1 3.790 . 5.780 3.651 3.337 4.643 . 0 0 "[ . 1 . 2]" 1
1159 1 183 SER H 1 190 VAL MG1 4.300 . 6.800 5.024 4.807 5.370 . 0 0 "[ . 1 . 2]" 1
1160 1 186 TYR H 1 190 VAL MG1 4.010 . 6.220 5.209 4.996 5.580 . 0 0 "[ . 1 . 2]" 1
1161 1 168 PHE HB3 1 232 LEU MD2 3.130 . 4.460 2.360 2.117 2.631 . 0 0 "[ . 1 . 2]" 1
1162 1 168 PHE HZ 1 218 VAL MG2 3.220 . 4.640 4.542 4.020 4.663 0.023 10 0 "[ . 1 . 2]" 1
1163 1 215 ALA H 1 218 VAL MG2 3.770 . 5.740 4.994 4.788 5.249 . 0 0 "[ . 1 . 2]" 1
1164 1 107 LEU MD2 1 109 VAL MG2 3.320 . 4.840 4.165 3.528 4.667 . 0 0 "[ . 1 . 2]" 1
1165 1 85 PHE HD1 1 109 VAL MG2 2.990 . 4.180 3.509 3.172 3.778 . 0 0 "[ . 1 . 2]" 1
1166 1 85 PHE HD2 1 109 VAL MG2 3.130 . 4.460 3.055 2.887 3.289 . 0 0 "[ . 1 . 2]" 1
1167 1 109 VAL MG2 1 121 ALA H 3.980 . 6.160 4.831 4.370 5.467 . 0 0 "[ . 1 . 2]" 1
1168 1 109 VAL MG2 1 119 ALA H 4.340 . 6.880 5.080 4.519 5.561 . 0 0 "[ . 1 . 2]" 1
1169 1 109 VAL MG1 1 122 GLN H 4.440 . 7.080 5.875 5.657 6.065 . 0 0 "[ . 1 . 2]" 1
1170 1 88 LEU MD2 1 89 TYR H 3.760 . 5.720 4.623 4.525 4.761 . 0 0 "[ . 1 . 2]" 1
1171 1 87 ALA H 1 88 LEU MD2 4.260 . 6.720 5.103 4.753 5.542 . 0 0 "[ . 1 . 2]" 1
1172 1 107 LEU MD2 1 121 ALA MB 2.570 . 3.340 2.727 2.274 3.386 0.046 20 0 "[ . 1 . 2]" 1
1173 1 160 LEU MD1 1 169 LEU MD2 2.440 . 3.080 2.619 2.391 2.773 . 0 0 "[ . 1 . 2]" 1
1174 1 169 LEU MD2 1 236 ALA H 3.260 . 4.720 4.335 3.975 4.621 . 0 0 "[ . 1 . 2]" 1
1175 1 169 LEU MD1 1 236 ALA MB 3.360 . 4.920 4.170 3.819 4.639 . 0 0 "[ . 1 . 2]" 1
1176 1 159 LEU H 1 169 LEU MD1 4.640 . 7.480 5.767 5.509 6.005 . 0 0 "[ . 1 . 2]" 1
1177 1 88 LEU MD1 1 89 TYR H 3.790 . 5.780 4.734 4.548 4.978 . 0 0 "[ . 1 . 2]" 1
1178 1 141 LEU MD1 1 147 TYR HD1 3.010 . 4.220 3.558 3.073 4.065 . 0 0 "[ . 1 . 2]" 1
1179 1 141 LEU MD1 1 142 GLU H 4.010 . 6.220 4.891 4.710 5.062 . 0 0 "[ . 1 . 2]" 1
1180 1 205 VAL H 1 217 LEU MD1 3.880 . 5.960 2.231 2.050 2.531 . 0 0 "[ . 1 . 2]" 1
1181 1 73 LEU MD1 1 74 LEU H 3.620 . 5.440 4.449 4.290 4.582 . 0 0 "[ . 1 . 2]" 1
1182 1 73 LEU MD1 1 219 HIS H 3.260 . 4.720 3.554 3.012 3.925 . 0 0 "[ . 1 . 2]" 1
1183 1 73 LEU MD1 1 218 VAL H 3.820 . 5.840 4.080 3.762 4.383 . 0 0 "[ . 1 . 2]" 1
1184 1 73 LEU MD1 1 146 TRP HZ3 4.310 . 6.820 5.262 4.927 5.465 . 0 0 "[ . 1 . 2]" 1
1185 1 73 LEU MD1 1 168 PHE HZ 3.650 . 5.500 5.068 4.323 5.612 0.112 7 0 "[ . 1 . 2]" 1
1186 1 67 TRP HH2 1 73 LEU MD1 3.460 . 5.120 4.104 2.233 5.127 0.007 10 0 "[ . 1 . 2]" 1
1187 1 73 LEU MD1 1 215 ALA H 3.970 . 6.140 4.607 4.374 5.264 . 0 0 "[ . 1 . 2]" 1
1188 1 170 VAL MG2 1 214 LEU MD2 2.680 . 3.560 2.157 1.930 2.376 . 0 0 "[ . 1 . 2]" 1
1189 1 214 LEU MD2 1 217 LEU MD2 2.780 . 3.760 1.996 1.811 2.124 . 0 0 "[ . 1 . 2]" 1
1190 1 214 LEU MD2 1 218 VAL MG1 3.600 . 5.400 4.348 4.218 4.622 . 0 0 "[ . 1 . 2]" 1
1191 1 151 VAL MG1 1 159 LEU MD1 2.340 . 2.880 2.518 2.099 2.855 . 0 0 "[ . 1 . 2]" 1
1192 1 159 LEU MD1 1 236 ALA MB 3.340 . 4.880 3.282 2.829 3.777 . 0 0 "[ . 1 . 2]" 1
1193 1 155 ALA MB 1 159 LEU MD1 3.050 . 4.300 3.424 2.970 3.783 . 0 0 "[ . 1 . 2]" 1
1194 1 159 LEU MD1 1 239 ARG H 4.220 . 6.640 4.352 3.485 5.147 . 0 0 "[ . 1 . 2]" 1
1195 1 203 LEU MD2 1 211 PHE HE1 4.220 . 6.640 6.807 6.714 6.897 0.257 13 0 "[ . 1 . 2]" 1
1196 1 202 LYS H 1 203 LEU MD2 4.000 . 6.200 4.731 4.519 4.974 . 0 0 "[ . 1 . 2]" 1
1197 1 203 LEU MD2 1 204 TYR H 3.840 . 5.880 4.988 4.892 5.054 . 0 0 "[ . 1 . 2]" 1
1198 1 160 LEU MD1 1 190 VAL MG2 2.670 . 3.540 2.690 2.394 3.187 . 0 0 "[ . 1 . 2]" 1
1199 1 156 ALA MB 1 190 VAL MG2 3.880 . 5.960 4.985 4.508 5.361 . 0 0 "[ . 1 . 2]" 1
1200 1 157 GLU H 1 190 VAL MG2 3.730 . 5.660 5.073 4.513 5.483 . 0 0 "[ . 1 . 2]" 1
1201 1 141 LEU MD2 1 142 GLU H 4.070 . 6.340 4.821 4.702 4.960 . 0 0 "[ . 1 . 2]" 1
1202 1 185 ARG H 1 190 VAL MG2 3.730 . 5.660 3.978 3.636 4.784 . 0 0 "[ . 1 . 2]" 1
1203 1 168 PHE HD1 1 184 LEU MD1 3.160 . 4.520 3.386 3.067 3.613 . 0 0 "[ . 1 . 2]" 1
1204 1 203 LEU MD1 1 204 TYR HD1 3.870 . 5.940 5.041 4.837 5.304 . 0 0 "[ . 1 . 2]" 1
1205 1 84 LEU MD2 1 107 LEU H 3.320 . 4.840 4.603 4.044 4.885 0.045 10 0 "[ . 1 . 2]" 1
1206 1 160 LEU MD2 1 190 VAL MG2 3.130 . 4.460 4.136 3.962 4.393 . 0 0 "[ . 1 . 2]" 1
1207 1 160 LEU MD2 1 184 LEU MD1 3.210 . 4.620 4.482 4.113 4.753 0.133 12 0 "[ . 1 . 2]" 1
1208 1 99 LEU MD1 1 125 ASN H 3.490 . 5.180 4.379 3.912 4.959 . 0 0 "[ . 1 . 2]" 1
1209 1 99 LEU MD1 1 123 THR H 2.970 . 4.140 3.977 3.154 4.237 0.097 3 0 "[ . 1 . 2]" 1
1210 1 160 LEU MD2 1 184 LEU H 3.870 . 5.940 5.877 5.099 6.035 0.095 7 0 "[ . 1 . 2]" 1
1211 1 89 TYR HD1 1 134 TYR H 3.820 . 5.840 4.624 4.458 4.810 . 0 0 "[ . 1 . 2]" 1
1212 1 89 TYR HD1 1 135 ILE H 3.920 . 6.040 4.665 4.275 4.928 . 0 0 "[ . 1 . 2]" 1
1213 1 89 TYR HD1 1 101 ILE MD 3.730 . 5.660 4.990 4.449 5.675 0.015 14 0 "[ . 1 . 2]" 1
1214 1 88 LEU MD1 1 89 TYR HD1 3.210 . 4.620 3.896 3.592 4.235 . 0 0 "[ . 1 . 2]" 1
1215 1 204 TYR H 1 204 TYR HD1 3.250 . 4.700 3.175 3.012 3.347 . 0 0 "[ . 1 . 2]" 1
1216 1 198 ALA MB 1 204 TYR HD1 3.340 . 4.880 3.231 2.840 3.569 . 0 0 "[ . 1 . 2]" 1
1217 1 204 TYR HD2 1 205 VAL MG1 3.940 . 6.080 5.399 5.211 5.549 . 0 0 "[ . 1 . 2]" 1
1218 1 204 TYR HD2 1 205 VAL MG2 4.070 . 6.340 5.706 5.446 5.895 . 0 0 "[ . 1 . 2]" 1
1219 1 91 PHE H 1 134 TYR HE2 3.850 . 5.900 5.008 4.265 5.527 . 0 0 "[ . 1 . 2]" 1
1220 1 91 PHE HD1 1 134 TYR HE2 3.020 . 4.240 2.929 2.558 3.545 . 0 0 "[ . 1 . 2]" 1
1221 1 204 TYR HE2 1 206 SER H 3.790 . 5.780 5.851 5.695 5.975 0.195 13 0 "[ . 1 . 2]" 1
1222 1 211 PHE H 1 211 PHE HE1 3.740 . 5.680 4.378 4.084 4.650 . 0 0 "[ . 1 . 2]" 1
1223 1 85 PHE HD1 1 138 VAL MG2 3.580 . 5.360 4.760 4.569 5.047 . 0 0 "[ . 1 . 2]" 1
1224 1 85 PHE HD2 1 107 LEU MD1 3.460 . 5.120 4.018 3.703 4.174 . 0 0 "[ . 1 . 2]" 1
1225 1 91 PHE HD2 1 93 ALA H 3.490 . 5.180 4.460 4.124 4.903 . 0 0 "[ . 1 . 2]" 1
1226 1 91 PHE HD2 1 118 TRP HZ3 4.030 . 6.260 5.040 4.483 5.867 . 0 0 "[ . 1 . 2]" 1
1227 1 91 PHE HD2 1 93 ALA MB 3.730 . 5.660 4.370 3.912 4.837 . 0 0 "[ . 1 . 2]" 1
1228 1 91 PHE HD1 1 244 VAL MG2 3.020 . 4.240 4.220 3.872 4.393 0.153 9 0 "[ . 1 . 2]" 1
1229 1 91 PHE HD2 1 130 VAL MG2 3.880 . 5.960 5.608 5.241 5.988 0.028 15 0 "[ . 1 . 2]" 1
1230 1 91 PHE H 1 134 TYR HD2 3.500 . 5.200 4.337 3.816 4.902 . 0 0 "[ . 1 . 2]" 1
1231 1 133 ASN H 1 134 TYR HD1 3.580 . 5.360 3.960 3.502 4.427 . 0 0 "[ . 1 . 2]" 1
1232 1 90 ASP H 1 134 TYR HD2 3.960 . 6.120 4.708 4.324 5.255 . 0 0 "[ . 1 . 2]" 1
1233 1 91 PHE HD1 1 134 TYR HD2 3.180 . 4.560 3.857 3.479 4.259 . 0 0 "[ . 1 . 2]" 1
1234 1 89 TYR HD1 1 134 TYR HD1 3.610 . 5.420 4.971 4.454 5.421 0.001 17 0 "[ . 1 . 2]" 1
1235 1 89 TYR HD1 1 134 TYR HD2 3.740 . 5.680 3.894 2.917 4.845 . 0 0 "[ . 1 . 2]" 1
1236 1 101 ILE MD 1 134 TYR HD2 3.180 . 4.560 3.018 2.438 3.744 . 0 0 "[ . 1 . 2]" 1
1237 1 147 TYR HE2 1 148 HIS H 4.340 . 6.880 5.423 4.928 5.930 . 0 0 "[ . 1 . 2]" 1
1238 1 147 TYR HE1 1 170 VAL MG1 2.960 . 4.120 2.799 2.485 3.280 . 0 0 "[ . 1 . 2]" 1
1239 1 147 TYR HE1 1 214 LEU MD1 3.000 . 4.200 2.313 1.930 2.830 . 0 0 "[ . 1 . 2]" 1
1240 1 85 PHE HE1 1 109 VAL H 3.640 . 5.480 4.102 3.596 4.603 . 0 0 "[ . 1 . 2]" 1
1241 1 85 PHE HE2 1 119 ALA MB 3.630 . 5.460 5.136 4.809 5.489 0.029 5 0 "[ . 1 . 2]" 1
1242 1 211 PHE HD1 1 217 LEU MD2 3.010 . 4.220 3.525 3.338 3.716 . 0 0 "[ . 1 . 2]" 1
1243 1 211 PHE HD1 1 217 LEU MD1 3.340 . 4.880 2.996 2.856 3.137 . 0 0 "[ . 1 . 2]" 1
1244 1 91 PHE HE1 1 92 VAL H 3.740 . 5.680 5.019 4.529 5.750 0.070 7 0 "[ . 1 . 2]" 1
1245 1 91 PHE HE1 1 244 VAL MG1 3.250 . 4.700 4.650 4.205 4.910 0.210 12 0 "[ . 1 . 2]" 1
1246 1 91 PHE HE2 1 99 LEU MD1 4.490 . 7.180 6.300 6.054 6.744 . 0 0 "[ . 1 . 2]" 1
1247 1 91 PHE HE2 1 130 VAL MG2 4.690 . 7.580 6.334 5.901 6.625 . 0 0 "[ . 1 . 2]" 1
1248 1 91 PHE HZ 1 93 ALA MB 3.650 . 5.500 5.282 4.924 5.533 0.033 17 0 "[ . 1 . 2]" 1
1249 1 191 TYR H 1 191 TYR HD1 2.940 . 4.080 2.279 2.138 2.527 . 0 0 "[ . 1 . 2]" 1
1250 1 191 TYR HD2 1 192 HIS H 3.840 . 5.880 4.579 4.218 4.910 . 0 0 "[ . 1 . 2]" 1
1251 1 184 LEU MD2 1 191 TYR HD1 3.380 . 4.960 3.912 3.132 4.626 . 0 0 "[ . 1 . 2]" 1
1252 1 190 VAL MG1 1 191 TYR HD1 3.290 . 4.780 4.922 4.821 5.003 0.223 7 0 "[ . 1 . 2]" 1
1253 1 109 VAL MG1 1 112 TYR HD2 3.080 . 4.360 4.522 4.381 4.630 0.270 12 0 "[ . 1 . 2]" 1
1254 1 88 LEU H 1 89 TYR HE1 3.740 . 5.680 5.245 4.774 5.687 0.007 14 0 "[ . 1 . 2]" 1
1255 1 88 LEU MD1 1 89 TYR HE1 2.920 . 4.040 2.971 2.614 3.367 . 0 0 "[ . 1 . 2]" 1
1256 1 112 TYR HE1 1 119 ALA MB 3.040 . 4.280 4.124 3.876 4.409 0.129 8 0 "[ . 1 . 2]" 1
1257 1 112 TYR HE2 1 119 ALA MB 3.250 . 4.700 2.594 2.494 2.939 . 0 0 "[ . 1 . 2]" 1
1258 1 109 VAL MG1 1 112 TYR HE2 2.960 . 4.120 4.230 3.961 4.351 0.231 3 0 "[ . 1 . 2]" 1
1259 1 109 VAL MG2 1 112 TYR HE2 3.290 . 4.780 4.417 4.043 4.847 0.067 17 0 "[ . 1 . 2]" 1
1260 1 186 TYR H 1 186 TYR HD1 4.130 . 6.460 5.016 4.889 5.218 . 0 0 "[ . 1 . 2]" 1
1261 1 186 TYR H 1 186 TYR HD2 4.340 . 6.880 4.978 4.761 5.179 . 0 0 "[ . 1 . 2]" 1
1262 1 166 GLY H 1 186 TYR HD1 3.400 . 5.000 2.501 1.951 2.965 . 0 0 "[ . 1 . 2]" 1
1263 1 186 TYR HD2 1 189 ARG H 4.270 . 6.740 6.154 5.637 6.554 . 0 0 "[ . 1 . 2]" 1
1264 1 184 LEU MD1 1 186 TYR HD1 3.420 . 5.040 4.602 3.860 5.053 0.013 6 0 "[ . 1 . 2]" 1
1265 1 147 TYR HD1 1 170 VAL H 3.700 . 5.600 4.973 4.695 5.503 . 0 0 "[ . 1 . 2]" 1
1266 1 147 TYR H 1 147 TYR HD2 4.540 . 7.280 4.951 4.806 5.042 . 0 0 "[ . 1 . 2]" 1
1267 1 146 TRP HE3 1 147 TYR HD1 3.290 . 4.780 3.359 3.083 3.749 . 0 0 "[ . 1 . 2]" 1
1268 1 146 TRP HH2 1 147 TYR HD1 3.430 . 5.060 3.904 3.303 4.547 . 0 0 "[ . 1 . 2]" 1
1269 1 141 LEU MD2 1 147 TYR HD1 3.210 . 4.620 4.517 4.290 4.636 0.016 17 0 "[ . 1 . 2]" 1
1270 1 146 TRP HD1 1 168 PHE HE1 3.920 . 6.040 4.944 4.502 5.667 . 0 0 "[ . 1 . 2]" 1
1271 1 146 TRP HD1 1 168 PHE HE2 4.060 . 6.320 3.894 3.254 4.451 . 0 0 "[ . 1 . 2]" 1
1272 1 191 TYR H 1 191 TYR HE1 3.590 . 5.380 4.308 4.151 4.502 . 0 0 "[ . 1 . 2]" 1
1273 1 189 ARG H 1 191 TYR HE1 3.580 . 5.360 3.651 3.499 3.910 . 0 0 "[ . 1 . 2]" 1
1274 1 191 TYR HE2 1 229 ILE MD 3.180 . 4.560 3.238 2.883 3.542 . 0 0 "[ . 1 . 2]" 1
1275 1 168 PHE H 1 234 TYR HD1 3.800 . 5.800 3.425 3.280 4.544 . 0 0 "[ . 1 . 2]" 1
1276 1 234 TYR H 1 234 TYR HD1 3.030 . 4.260 4.355 4.239 4.513 0.253 2 0 "[ . 1 . 2]" 1
1277 1 168 PHE H 1 234 TYR HE1 3.480 . 5.160 5.228 5.090 5.328 0.168 2 0 "[ . 1 . 2]" 1
1278 1 158 TYR HE1 1 239 ARG H 3.670 . 5.540 5.382 4.944 5.782 0.242 6 0 "[ . 1 . 2]" 1
1279 1 164 ILE H 1 234 TYR HE2 3.970 . 6.140 6.004 4.440 6.313 0.173 6 0 "[ . 1 . 2]" 1
1280 1 158 TYR HE1 1 159 LEU MD2 2.810 . 3.820 3.020 2.499 3.781 . 0 0 "[ . 1 . 2]" 1
1281 1 164 ILE MD 1 234 TYR HE2 3.190 . 4.580 4.037 1.743 4.664 0.084 13 0 "[ . 1 . 2]" 1
1282 1 192 HIS H 1 193 TYR HD2 3.950 . 6.100 4.468 3.888 4.950 . 0 0 "[ . 1 . 2]" 1
1283 1 193 TYR HD1 1 205 VAL MG1 2.770 . 3.740 3.548 2.005 3.887 0.147 5 0 "[ . 1 . 2]" 1
1284 1 193 TYR HD2 1 205 VAL MG2 3.420 . 5.040 5.001 4.745 5.398 0.358 11 0 "[ . 1 . 2]" 1
1285 1 251 TYR H 1 251 TYR HD1 3.900 . 6.000 4.696 2.188 5.256 . 0 0 "[ . 1 . 2]" 1
1286 1 251 TYR H 1 251 TYR HD2 4.340 . 6.880 3.916 2.411 5.048 . 0 0 "[ . 1 . 2]" 1
1287 1 251 TYR HD1 1 254 TRP HE3 3.770 . 5.740 5.537 3.491 6.016 0.276 3 0 "[ . 1 . 2]" 1
1288 1 186 TYR HE1 1 187 GLU H 3.460 . 5.120 4.436 4.045 4.876 . 0 0 "[ . 1 . 2]" 1
1289 1 158 TYR HD1 1 159 LEU H 3.010 . 4.220 2.824 2.469 3.077 . 0 0 "[ . 1 . 2]" 1
1290 1 158 TYR H 1 158 TYR HD1 3.050 . 4.300 4.128 3.738 4.405 0.105 14 0 "[ . 1 . 2]" 1
1291 1 155 ALA MB 1 158 TYR HD1 3.400 . 5.000 3.942 3.049 4.725 . 0 0 "[ . 1 . 2]" 1
1292 1 158 TYR HD1 1 159 LEU MD2 2.790 . 3.780 3.168 2.781 3.724 . 0 0 "[ . 1 . 2]" 1
1293 1 193 TYR H 1 193 TYR HE2 3.800 . 5.800 4.835 3.964 5.063 . 0 0 "[ . 1 . 2]" 1
1294 1 184 LEU MD2 1 193 TYR HE2 2.860 . 3.920 3.890 2.413 4.186 0.266 6 0 "[ . 1 . 2]" 1
1295 1 141 LEU MD2 1 147 TYR HE1 3.530 . 5.260 5.121 4.878 5.342 0.082 12 0 "[ . 1 . 2]" 1
1296 1 85 PHE HD2 1 86 VAL H 3.250 . 4.700 4.014 3.754 4.186 . 0 0 "[ . 1 . 2]" 1
1297 1 186 TYR HB2 1 191 TYR HE1 2.980 . 4.160 4.009 3.589 4.213 0.053 16 0 "[ . 1 . 2]" 1
1298 1 186 TYR HB3 1 191 TYR HE1 3.280 . 4.760 2.444 2.071 2.800 . 0 0 "[ . 1 . 2]" 1
1299 1 112 TYR HB3 1 112 TYR HE1 3.740 . 5.680 5.386 5.315 5.467 . 0 0 "[ . 1 . 2]" 1
1300 1 134 TYR HE1 1 244 VAL MG2 2.950 . 4.100 2.430 1.916 3.174 . 0 0 "[ . 1 . 2]" 1
1301 1 147 TYR H 1 147 TYR HD1 4.120 . 6.440 4.705 4.539 4.864 . 0 0 "[ . 1 . 2]" 1
1302 1 184 LEU H 1 193 TYR HD2 3.650 . 5.500 5.188 3.370 5.520 0.020 5 0 "[ . 1 . 2]" 1
1303 1 182 ILE MD 1 193 TYR HD2 3.480 . 5.160 5.345 4.603 5.556 0.396 11 0 "[ . 1 . 2]" 1
1304 1 156 ALA H 1 158 TYR HD1 3.910 . 6.020 5.851 5.006 6.229 0.209 7 0 "[ . 1 . 2]" 1
1305 1 251 TYR HD1 1 252 ASP H 4.380 . 6.960 4.466 2.742 6.032 . 0 0 "[ . 1 . 2]" 1
1306 1 251 TYR HD2 1 252 ASP H 4.610 . 7.420 5.389 1.965 6.434 . 0 0 "[ . 1 . 2]" 1
1307 1 109 VAL MG2 1 112 TYR HD2 4.090 . 6.380 5.520 5.167 5.939 . 0 0 "[ . 1 . 2]" 1
1308 1 164 ILE MD 1 234 TYR HD2 2.890 . 3.980 3.006 2.575 3.349 . 0 0 "[ . 1 . 2]" 1
1309 1 112 TYR HD2 1 120 GLU H 3.970 . 6.140 5.582 5.306 6.143 0.003 16 0 "[ . 1 . 2]" 1
1310 1 112 TYR HD1 1 116 GLY H 4.210 . 6.620 6.783 6.690 6.885 0.265 16 0 "[ . 1 . 2]" 1
1311 1 158 TYR HA 1 158 TYR HD2 3.240 . 4.680 3.605 2.843 4.768 0.088 5 0 "[ . 1 . 2]" 1
1312 1 158 TYR HB2 1 158 TYR HD2 2.800 . 3.800 2.698 2.418 3.137 . 0 0 "[ . 1 . 2]" 1
1313 1 158 TYR HB3 1 158 TYR HD1 2.900 . 4.000 2.821 2.368 3.788 . 0 0 "[ . 1 . 2]" 1
1314 1 112 TYR HD1 1 119 ALA MB 2.930 . 4.060 4.169 3.968 4.348 0.288 8 0 "[ . 1 . 2]" 1
1315 1 112 TYR HD2 1 119 ALA MB 3.120 . 4.440 2.647 2.374 2.975 . 0 0 "[ . 1 . 2]" 1
1316 1 193 TYR HE2 1 232 LEU MD2 3.490 . 5.180 5.151 4.297 5.382 0.202 12 0 "[ . 1 . 2]" 1
1317 1 193 TYR HB2 1 193 TYR HE2 3.760 . 5.720 5.419 4.708 5.497 . 0 0 "[ . 1 . 2]" 1
1318 1 193 TYR HB3 1 193 TYR HE1 3.760 . 5.720 5.072 4.741 5.318 . 0 0 "[ . 1 . 2]" 1
1319 1 191 TYR HB2 1 193 TYR HE2 3.290 . 4.780 2.950 2.508 3.367 . 0 0 "[ . 1 . 2]" 1
1320 1 193 TYR HE2 1 229 ILE H 3.550 . 5.300 3.227 2.765 4.717 . 0 0 "[ . 1 . 2]" 1
1321 1 192 HIS H 1 193 TYR HE2 3.880 . 5.960 5.049 4.527 5.498 . 0 0 "[ . 1 . 2]" 1
1322 1 158 TYR HE1 1 159 LEU H 3.390 . 4.980 4.862 4.380 5.133 0.153 14 0 "[ . 1 . 2]" 1
1323 1 155 ALA MB 1 158 TYR HE1 3.620 . 5.440 4.635 3.676 5.581 0.141 6 0 "[ . 1 . 2]" 1
1324 1 146 TRP HD1 1 168 PHE HZ 3.700 . 5.600 3.195 2.954 3.756 . 0 0 "[ . 1 . 2]" 1
1325 1 168 PHE HD1 1 232 LEU H 4.360 . 6.920 6.013 5.770 6.118 . 0 0 "[ . 1 . 2]" 1
1326 1 168 PHE HD1 1 233 HIS H 3.800 . 5.800 2.691 2.075 3.286 . 0 0 "[ . 1 . 2]" 1
1327 1 168 PHE H 1 168 PHE HD1 3.910 . 6.020 2.578 2.297 2.929 . 0 0 "[ . 1 . 2]" 1
1328 1 168 PHE HE2 1 182 ILE MD 4.580 . 7.360 5.061 4.572 5.576 . 0 0 "[ . 1 . 2]" 1
1329 1 168 PHE HD2 1 182 ILE MD 4.380 . 6.960 4.189 3.908 4.582 . 0 0 "[ . 1 . 2]" 1
1330 1 89 TYR HB2 1 89 TYR HD1 2.940 . 4.080 2.475 2.369 2.566 . 0 0 "[ . 1 . 2]" 1
1331 1 89 TYR HD1 1 134 TYR HB3 3.290 . 4.780 3.750 3.419 4.192 . 0 0 "[ . 1 . 2]" 1
1332 1 89 TYR HD1 1 134 TYR HB2 3.640 . 5.480 4.619 4.348 4.940 . 0 0 "[ . 1 . 2]" 1
1333 1 89 TYR HB3 1 89 TYR HD2 3.000 . 4.200 2.468 2.402 2.611 . 0 0 "[ . 1 . 2]" 1
1334 1 89 TYR HE1 1 134 TYR H 3.900 . 6.000 5.342 4.819 5.967 . 0 0 "[ . 1 . 2]" 1
1335 1 89 TYR HE1 1 135 ILE H 4.090 . 6.380 5.359 4.775 6.039 . 0 0 "[ . 1 . 2]" 1
1336 1 186 TYR HB3 1 186 TYR HE2 3.730 . 5.660 4.663 4.640 4.694 . 0 0 "[ . 1 . 2]" 1
1337 1 91 PHE HZ 1 130 VAL MG1 3.860 . 5.920 5.589 4.745 6.022 0.102 6 0 "[ . 1 . 2]" 1
1338 1 85 PHE HD1 1 138 VAL H 3.820 . 5.840 4.773 4.414 5.141 . 0 0 "[ . 1 . 2]" 1
1339 1 85 PHE HD1 1 109 VAL MG1 3.640 . 5.480 4.854 4.454 5.171 . 0 0 "[ . 1 . 2]" 1
1340 1 91 PHE HE2 1 101 ILE H 3.750 . 5.700 5.713 5.378 5.840 0.140 3 0 "[ . 1 . 2]" 1
1341 1 91 PHE HE1 1 134 TYR HE2 4.370 . 6.940 5.126 4.691 5.663 . 0 0 "[ . 1 . 2]" 1
1342 1 112 TYR HB3 1 112 TYR HD1 2.960 . 4.120 3.593 3.491 3.714 . 0 0 "[ . 1 . 2]" 1
1343 1 112 TYR HB2 1 112 TYR HD2 2.830 . 3.860 3.716 3.638 3.742 . 0 0 "[ . 1 . 2]" 1
1344 1 91 PHE HB2 1 134 TYR HD2 3.230 . 4.660 2.401 2.056 2.751 . 0 0 "[ . 1 . 2]" 1
1345 1 186 TYR HB2 1 186 TYR HD1 3.130 . 4.460 2.740 2.565 2.860 . 0 0 "[ . 1 . 2]" 1
1346 1 211 PHE HD1 1 212 ASN H 4.310 . 6.820 5.663 5.502 5.893 . 0 0 "[ . 1 . 2]" 1
1347 1 210 ARG H 1 211 PHE HD2 3.880 . 5.960 5.609 5.267 5.906 . 0 0 "[ . 1 . 2]" 1
1348 1 211 PHE HD1 1 213 THR H 4.000 . 6.200 5.571 5.295 5.854 . 0 0 "[ . 1 . 2]" 1
1349 1 52 VAL H 1 52 VAL QG 2.740 . 3.680 2.035 1.877 2.415 . 0 0 "[ . 1 . 2]" 1
1350 1 52 VAL QG 1 53 ALA MB 3.170 . 4.540 3.566 2.540 4.459 . 0 0 "[ . 1 . 2]" 1
1351 1 56 PHE H 1 56 PHE QB 2.780 . 3.760 2.637 2.387 2.870 . 0 0 "[ . 1 . 2]" 1
1352 1 109 VAL H 1 110 LEU QD 3.310 . 4.820 4.507 4.092 4.858 0.038 16 0 "[ . 1 . 2]" 1
1353 1 109 VAL MG1 1 110 LEU QD 3.040 . 4.280 4.371 3.755 4.566 0.286 18 0 "[ . 1 . 2]" 1
1354 1 109 VAL MG2 1 110 LEU QD 3.370 . 4.940 4.853 4.321 5.093 0.153 4 0 "[ . 1 . 2]" 1
1355 1 110 LEU QD 1 111 GLY H 2.930 . 4.060 3.874 2.452 4.178 0.118 6 0 "[ . 1 . 2]" 1
1356 1 110 LEU QD 1 120 GLU H 3.290 . 4.780 4.804 4.084 5.030 0.250 10 0 "[ . 1 . 2]" 1
1357 1 110 LEU QD 1 121 ALA H 3.430 . 5.060 4.283 3.753 4.762 . 0 0 "[ . 1 . 2]" 1
1358 1 110 LEU QD 1 122 GLN H 2.980 . 4.160 3.361 2.772 3.862 . 0 0 "[ . 1 . 2]" 1
1359 1 110 LEU QD 1 128 GLY H 3.190 . 4.580 4.598 4.258 4.797 0.217 12 0 "[ . 1 . 2]" 1
1360 1 164 ILE MD 1 234 TYR QB 3.290 . 4.780 2.530 2.059 5.037 0.257 2 0 "[ . 1 . 2]" 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 124
_Distance_constraint_stats_list.Viol_count 665
_Distance_constraint_stats_list.Viol_total 659.065
_Distance_constraint_stats_list.Viol_max 0.204
_Distance_constraint_stats_list.Viol_rms 0.0303
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0133
_Distance_constraint_stats_list.Viol_average_violations_only 0.0496
_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 84 LEU 0.393 0.085 13 0 "[ . 1 . 2]"
1 85 PHE 0.258 0.061 2 0 "[ . 1 . 2]"
1 86 VAL 0.515 0.085 15 0 "[ . 1 . 2]"
1 87 ALA 0.012 0.006 1 0 "[ . 1 . 2]"
1 88 LEU 0.056 0.040 15 0 "[ . 1 . 2]"
1 91 PHE 1.093 0.100 19 0 "[ . 1 . 2]"
1 101 ILE 1.093 0.100 19 0 "[ . 1 . 2]"
1 104 GLY 0.011 0.006 1 0 "[ . 1 . 2]"
1 105 GLU 0.001 0.001 18 0 "[ . 1 . 2]"
1 107 LEU 0.258 0.061 2 0 "[ . 1 . 2]"
1 108 ARG 1.090 0.086 12 0 "[ . 1 . 2]"
1 110 LEU 0.100 0.086 16 0 "[ . 1 . 2]"
1 111 GLY 0.547 0.116 15 0 "[ . 1 . 2]"
1 113 ASN 0.319 0.102 2 0 "[ . 1 . 2]"
1 118 TRP 0.319 0.102 2 0 "[ . 1 . 2]"
1 119 ALA 0.051 0.030 17 0 "[ . 1 . 2]"
1 120 GLU 0.647 0.116 15 0 "[ . 1 . 2]"
1 121 ALA 0.711 0.128 12 0 "[ . 1 . 2]"
1 122 GLN 1.090 0.086 12 0 "[ . 1 . 2]"
1 123 THR 1.884 0.116 13 0 "[ . 1 . 2]"
1 126 GLY 1.884 0.116 13 0 "[ . 1 . 2]"
1 128 GLY 0.711 0.128 12 0 "[ . 1 . 2]"
1 130 VAL 0.051 0.030 17 0 "[ . 1 . 2]"
1 131 PRO 0.217 0.049 20 0 "[ . 1 . 2]"
1 134 TYR 0.272 0.049 20 0 "[ . 1 . 2]"
1 136 THR 0.515 0.085 15 0 "[ . 1 . 2]"
1 138 VAL 0.393 0.085 13 0 "[ . 1 . 2]"
1 146 TRP 0.530 0.063 19 0 "[ . 1 . 2]"
1 148 HIS 1.214 0.141 11 0 "[ . 1 . 2]"
1 149 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 VAL 0.408 0.097 1 0 "[ . 1 . 2]"
1 152 SER 0.710 0.091 13 0 "[ . 1 . 2]"
1 153 ARG 0.264 0.090 16 0 "[ . 1 . 2]"
1 154 ASN 0.770 0.105 13 0 "[ . 1 . 2]"
1 155 ALA 0.741 0.102 7 0 "[ . 1 . 2]"
1 156 ALA 2.143 0.108 3 0 "[ . 1 . 2]"
1 157 GLU 0.264 0.090 16 0 "[ . 1 . 2]"
1 158 TYR 0.770 0.105 13 0 "[ . 1 . 2]"
1 159 LEU 0.741 0.102 7 0 "[ . 1 . 2]"
1 160 LEU 1.433 0.108 3 0 "[ . 1 . 2]"
1 164 ILE 2.709 0.183 3 0 "[ . 1 . 2]"
1 166 GLY 1.526 0.155 4 0 "[ . 1 . 2]"
1 167 SER 6.971 0.204 19 0 "[ . 1 . 2]"
1 168 PHE 0.114 0.059 15 0 "[ . 1 . 2]"
1 170 VAL 1.743 0.141 11 0 "[ . 1 . 2]"
1 171 ARG 0.428 0.105 4 0 "[ . 1 . 2]"
1 172 GLU 0.408 0.097 1 0 "[ . 1 . 2]"
1 173 SER 0.110 0.041 11 0 "[ . 1 . 2]"
1 179 GLN 0.110 0.041 11 0 "[ . 1 . 2]"
1 180 ARG 0.773 0.087 7 0 "[ . 1 . 2]"
1 181 SER 0.428 0.105 4 0 "[ . 1 . 2]"
1 182 ILE 0.179 0.039 14 0 "[ . 1 . 2]"
1 184 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 185 ARG 4.380 0.204 19 0 "[ . 1 . 2]"
1 186 TYR 0.451 0.061 11 0 "[ . 1 . 2]"
1 189 ARG 0.451 0.061 11 0 "[ . 1 . 2]"
1 191 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 193 TYR 0.179 0.039 14 0 "[ . 1 . 2]"
1 195 ILE 0.773 0.087 7 0 "[ . 1 . 2]"
1 196 ASN 1.677 0.109 14 0 "[ . 1 . 2]"
1 198 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 202 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 203 LEU 0.847 0.106 12 0 "[ . 1 . 2]"
1 204 TYR 1.677 0.109 14 0 "[ . 1 . 2]"
1 211 PHE 0.847 0.106 12 0 "[ . 1 . 2]"
1 213 THR 2.560 0.141 12 0 "[ . 1 . 2]"
1 214 LEU 0.020 0.020 8 0 "[ . 1 . 2]"
1 215 ALA 0.459 0.049 10 0 "[ . 1 . 2]"
1 216 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 217 LEU 3.578 0.141 12 0 "[ . 1 . 2]"
1 218 VAL 0.783 0.057 2 0 "[ . 1 . 2]"
1 219 HIS 1.279 0.093 13 0 "[ . 1 . 2]"
1 220 HIS 0.724 0.074 12 0 "[ . 1 . 2]"
1 221 HIS 1.218 0.095 9 0 "[ . 1 . 2]"
1 222 SER 0.763 0.057 2 0 "[ . 1 . 2]"
1 223 THR 0.820 0.093 13 0 "[ . 1 . 2]"
1 224 VAL 0.724 0.074 12 0 "[ . 1 . 2]"
1 232 LEU 0.200 0.064 5 0 "[ . 1 . 2]"
1 233 HIS 1.330 0.155 4 0 "[ . 1 . 2]"
1 234 TYR 0.192 0.059 15 0 "[ . 1 . 2]"
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 1 152 SER O 1 156 ALA H 1.950 . 2.100 2.135 2.090 2.191 0.091 13 0 "[ . 1 . 2]" 2
2 1 152 SER O 1 156 ALA N 2.930 2.780 3.150 3.017 2.934 3.147 . 0 0 "[ . 1 . 2]" 2
3 1 153 ARG O 1 157 GLU H 1.950 . 2.100 2.050 1.913 2.190 0.090 16 0 "[ . 1 . 2]" 2
4 1 153 ARG O 1 157 GLU N 2.930 2.780 3.150 2.976 2.837 3.153 0.003 16 0 "[ . 1 . 2]" 2
5 1 154 ASN O 1 158 TYR H 1.950 . 2.100 2.139 2.103 2.205 0.105 13 0 "[ . 1 . 2]" 2
6 1 154 ASN O 1 158 TYR N 2.930 2.780 3.150 2.976 2.863 3.130 . 0 0 "[ . 1 . 2]" 2
7 1 155 ALA O 1 159 LEU H 1.950 . 2.100 2.114 1.924 2.202 0.102 7 0 "[ . 1 . 2]" 2
8 1 155 ALA O 1 159 LEU N 2.930 2.780 3.150 3.017 2.847 3.124 . 0 0 "[ . 1 . 2]" 2
9 1 156 ALA O 1 160 LEU H 1.950 . 2.100 2.172 2.130 2.208 0.108 3 0 "[ . 1 . 2]" 2
10 1 156 ALA O 1 160 LEU N 2.930 2.780 3.150 3.073 3.029 3.110 . 0 0 "[ . 1 . 2]" 2
11 1 85 PHE O 1 107 LEU H 1.950 . 2.100 2.055 1.960 2.134 0.034 20 0 "[ . 1 . 2]" 2
12 1 85 PHE O 1 107 LEU N 2.930 2.780 3.150 3.011 2.912 3.118 . 0 0 "[ . 1 . 2]" 2
13 1 85 PHE H 1 107 LEU O 1.950 . 2.100 2.037 1.967 2.161 0.061 2 0 "[ . 1 . 2]" 2
14 1 85 PHE N 1 107 LEU O 2.930 2.780 3.150 2.928 2.833 3.054 . 0 0 "[ . 1 . 2]" 2
15 1 87 ALA H 1 105 GLU O 1.950 . 2.100 1.979 1.916 2.101 0.001 18 0 "[ . 1 . 2]" 2
16 1 87 ALA N 1 105 GLU O 2.930 2.780 3.150 2.934 2.826 3.059 . 0 0 "[ . 1 . 2]" 2
17 1 113 ASN H 1 118 TRP O 1.950 . 2.100 2.060 1.930 2.202 0.102 2 0 "[ . 1 . 2]" 2
18 1 113 ASN N 1 118 TRP O 2.930 2.780 3.150 2.860 2.728 3.093 0.052 12 0 "[ . 1 . 2]" 2
19 1 111 GLY O 1 120 GLU H 1.950 . 2.100 2.108 1.991 2.216 0.116 15 0 "[ . 1 . 2]" 2
20 1 111 GLY O 1 120 GLU N 2.930 2.780 3.150 3.002 2.820 3.113 . 0 0 "[ . 1 . 2]" 2
21 1 110 LEU H 1 120 GLU O 1.950 . 2.100 1.993 1.925 2.186 0.086 16 0 "[ . 1 . 2]" 2
22 1 110 LEU N 1 120 GLU O 2.930 2.780 3.150 2.913 2.799 3.139 . 0 0 "[ . 1 . 2]" 2
23 1 108 ARG O 1 122 GLN H 1.950 . 2.100 2.054 1.962 2.160 0.060 1 0 "[ . 1 . 2]" 2
24 1 108 ARG O 1 122 GLN N 2.930 2.780 3.150 2.966 2.881 3.066 . 0 0 "[ . 1 . 2]" 2
25 1 108 ARG H 1 122 GLN O 1.950 . 2.100 2.144 2.068 2.186 0.086 12 0 "[ . 1 . 2]" 2
26 1 108 ARG N 1 122 GLN O 2.930 2.780 3.150 3.089 2.980 3.145 . 0 0 "[ . 1 . 2]" 2
27 1 119 ALA O 1 130 VAL H 1.950 . 2.100 1.952 1.879 2.071 . 0 0 "[ . 1 . 2]" 2
28 1 119 ALA O 1 130 VAL N 2.930 2.780 3.150 2.869 2.778 3.000 0.002 5 0 "[ . 1 . 2]" 2
29 1 119 ALA H 1 130 VAL O 1.950 . 2.100 1.996 1.900 2.130 0.030 17 0 "[ . 1 . 2]" 2
30 1 119 ALA N 1 130 VAL O 2.930 2.780 3.150 2.870 2.766 2.958 0.014 2 0 "[ . 1 . 2]" 2
31 1 121 ALA O 1 128 GLY H 1.950 . 2.100 2.131 2.082 2.228 0.128 12 0 "[ . 1 . 2]" 2
32 1 121 ALA O 1 128 GLY N 2.930 2.780 3.150 3.067 2.964 3.176 0.026 12 0 "[ . 1 . 2]" 2
33 1 121 ALA H 1 128 GLY O 1.950 . 2.100 1.977 1.921 2.071 . 0 0 "[ . 1 . 2]" 2
34 1 121 ALA N 1 128 GLY O 2.930 2.780 3.150 2.861 2.756 2.974 0.024 18 0 "[ . 1 . 2]" 2
35 1 123 THR O 1 126 GLY H 1.950 . 2.100 2.188 2.161 2.216 0.116 13 0 "[ . 1 . 2]" 2
36 1 123 THR O 1 126 GLY N 2.930 2.780 3.150 3.039 2.956 3.135 . 0 0 "[ . 1 . 2]" 2
37 1 123 THR H 1 126 GLY O 1.950 . 2.100 2.020 1.923 2.117 0.017 15 0 "[ . 1 . 2]" 2
38 1 123 THR N 1 126 GLY O 2.930 2.780 3.150 2.857 2.731 2.943 0.049 16 0 "[ . 1 . 2]" 2
39 1 131 PRO O 1 134 TYR H 1.950 . 2.100 2.097 2.025 2.149 0.049 20 0 "[ . 1 . 2]" 2
40 1 131 PRO O 1 134 TYR N 2.930 2.780 3.150 3.000 2.893 3.092 . 0 0 "[ . 1 . 2]" 2
41 1 91 PHE H 1 101 ILE O 1.950 . 2.100 2.144 2.081 2.200 0.100 19 0 "[ . 1 . 2]" 2
42 1 91 PHE N 1 101 ILE O 2.930 2.780 3.150 3.041 2.911 3.136 . 0 0 "[ . 1 . 2]" 2
43 1 91 PHE O 1 101 ILE H 1.950 . 2.100 2.063 1.940 2.151 0.051 20 0 "[ . 1 . 2]" 2
44 1 91 PHE O 1 101 ILE N 2.930 2.780 3.150 2.914 2.846 3.034 . 0 0 "[ . 1 . 2]" 2
45 1 88 LEU H 1 134 TYR O 1.950 . 2.100 2.024 1.924 2.112 0.012 20 0 "[ . 1 . 2]" 2
46 1 88 LEU N 1 134 TYR O 2.930 2.780 3.150 2.848 2.740 2.939 0.040 15 0 "[ . 1 . 2]" 2
47 1 86 VAL O 1 136 THR H 1.950 . 2.100 2.123 2.080 2.185 0.085 15 0 "[ . 1 . 2]" 2
48 1 86 VAL O 1 136 THR N 2.930 2.780 3.150 2.989 2.876 3.083 . 0 0 "[ . 1 . 2]" 2
49 1 86 VAL H 1 136 THR O 1.950 . 2.100 1.918 1.886 1.968 . 0 0 "[ . 1 . 2]" 2
50 1 86 VAL N 1 136 THR O 2.930 2.780 3.150 2.824 2.765 2.876 0.015 12 0 "[ . 1 . 2]" 2
51 1 87 ALA O 1 104 GLY H 1.950 . 2.100 2.004 1.940 2.106 0.006 1 0 "[ . 1 . 2]" 2
52 1 87 ALA O 1 104 GLY N 2.930 2.780 3.150 2.898 2.802 2.976 . 0 0 "[ . 1 . 2]" 2
53 1 84 LEU O 1 138 VAL H 1.950 . 2.100 2.088 1.944 2.185 0.085 13 0 "[ . 1 . 2]" 2
54 1 84 LEU O 1 138 VAL N 2.930 2.780 3.150 3.058 2.914 3.168 0.018 13 0 "[ . 1 . 2]" 2
55 1 146 TRP O 1 170 VAL H 1.950 . 2.100 2.122 2.061 2.163 0.063 19 0 "[ . 1 . 2]" 2
56 1 146 TRP O 1 170 VAL N 2.930 2.780 3.150 2.936 2.810 3.019 . 0 0 "[ . 1 . 2]" 2
57 1 148 HIS H 1 170 VAL O 1.950 . 2.100 2.152 2.067 2.241 0.141 11 0 "[ . 1 . 2]" 2
58 1 148 HIS N 1 170 VAL O 2.930 2.780 3.150 3.110 3.013 3.211 0.061 11 0 "[ . 1 . 2]" 2
59 1 149 GLY O 1 172 GLU H 1.950 . 2.100 1.986 1.938 2.070 . 0 0 "[ . 1 . 2]" 2
60 1 149 GLY O 1 172 GLU N 2.930 2.780 3.150 2.919 2.859 3.033 . 0 0 "[ . 1 . 2]" 2
61 1 151 VAL H 1 172 GLU O 1.950 . 2.100 2.073 1.920 2.197 0.097 1 0 "[ . 1 . 2]" 2
62 1 151 VAL N 1 172 GLU O 2.930 2.780 3.150 3.002 2.867 3.158 0.008 1 0 "[ . 1 . 2]" 2
63 1 168 PHE H 1 234 TYR O 1.950 . 2.100 1.936 1.859 2.106 0.006 2 0 "[ . 1 . 2]" 2
64 1 168 PHE N 1 234 TYR O 2.930 2.780 3.150 2.809 2.721 2.959 0.059 15 0 "[ . 1 . 2]" 2
65 1 166 GLY O 1 234 TYR H 1.950 . 2.100 2.054 1.974 2.132 0.032 6 0 "[ . 1 . 2]" 2
66 1 166 GLY O 1 234 TYR N 2.930 2.780 3.150 2.912 2.786 3.065 . 0 0 "[ . 1 . 2]" 2
67 1 166 GLY O 1 233 HIS H 1.950 . 2.100 2.164 2.063 2.255 0.155 4 0 "[ . 1 . 2]" 2
68 1 166 GLY O 1 233 HIS N 2.930 2.780 3.150 2.988 2.854 3.163 0.013 4 0 "[ . 1 . 2]" 2
69 1 164 ILE O 1 167 SER H 1.950 . 2.100 2.235 2.191 2.283 0.183 3 0 "[ . 1 . 2]" 2
70 1 164 ILE O 1 167 SER N 2.930 2.780 3.150 3.067 2.966 3.127 . 0 0 "[ . 1 . 2]" 2
71 1 166 GLY H 1 185 ARG O 1.950 . 2.100 2.046 1.919 2.145 0.045 15 0 "[ . 1 . 2]" 2
72 1 166 GLY N 1 185 ARG O 2.930 2.780 3.150 2.836 2.750 3.004 0.030 5 0 "[ . 1 . 2]" 2
73 1 167 SER H 1 185 ARG O 1.950 . 2.100 2.263 2.221 2.304 0.204 19 0 "[ . 1 . 2]" 2
74 1 167 SER N 1 185 ARG O 2.930 2.780 3.150 3.028 2.894 3.149 . 0 0 "[ . 1 . 2]" 2
75 1 167 SER O 1 185 ARG H 1.950 . 2.100 1.949 1.848 2.028 0.002 6 0 "[ . 1 . 2]" 2
76 1 167 SER O 1 185 ARG N 2.930 2.780 3.150 2.730 2.682 2.769 0.098 8 0 "[ . 1 . 2]" 2
77 1 171 ARG H 1 181 SER O 1.950 . 2.100 2.003 1.929 2.118 0.018 9 0 "[ . 1 . 2]" 2
78 1 171 ARG N 1 181 SER O 2.930 2.780 3.150 2.955 2.885 3.056 . 0 0 "[ . 1 . 2]" 2
79 1 171 ARG O 1 181 SER H 1.950 . 2.100 2.095 1.992 2.205 0.105 4 0 "[ . 1 . 2]" 2
80 1 171 ARG O 1 181 SER N 2.930 2.780 3.150 3.047 2.963 3.171 0.021 4 0 "[ . 1 . 2]" 2
81 1 173 SER H 1 179 GLN O 1.950 . 2.100 2.017 1.901 2.141 0.041 11 0 "[ . 1 . 2]" 2
82 1 173 SER N 1 179 GLN O 2.930 2.780 3.150 2.935 2.831 3.057 . 0 0 "[ . 1 . 2]" 2
83 1 180 ARG O 1 195 ILE H 1.950 . 2.100 2.131 2.018 2.187 0.087 7 0 "[ . 1 . 2]" 2
84 1 180 ARG O 1 195 ILE N 2.930 2.780 3.150 3.006 2.895 3.069 . 0 0 "[ . 1 . 2]" 2
85 1 182 ILE H 1 193 TYR O 1.950 . 2.100 2.076 1.958 2.139 0.039 14 0 "[ . 1 . 2]" 2
86 1 182 ILE N 1 193 TYR O 2.930 2.780 3.150 2.956 2.812 3.025 . 0 0 "[ . 1 . 2]" 2
87 1 182 ILE O 1 193 TYR H 1.950 . 2.100 1.967 1.922 2.121 0.021 11 0 "[ . 1 . 2]" 2
88 1 182 ILE O 1 193 TYR N 2.930 2.780 3.150 2.854 2.769 3.072 0.011 10 0 "[ . 1 . 2]" 2
89 1 184 LEU H 1 191 TYR O 1.950 . 2.100 1.999 1.916 2.078 . 0 0 "[ . 1 . 2]" 2
90 1 184 LEU N 1 191 TYR O 2.930 2.780 3.150 2.911 2.829 3.052 . 0 0 "[ . 1 . 2]" 2
91 1 184 LEU O 1 191 TYR H 1.950 . 2.100 1.946 1.901 2.002 . 0 0 "[ . 1 . 2]" 2
92 1 184 LEU O 1 191 TYR N 2.930 2.780 3.150 2.886 2.811 2.945 . 0 0 "[ . 1 . 2]" 2
93 1 186 TYR H 1 189 ARG O 1.950 . 2.100 2.008 1.931 2.108 0.008 1 0 "[ . 1 . 2]" 2
94 1 186 TYR N 1 189 ARG O 2.930 2.780 3.150 2.933 2.886 3.015 . 0 0 "[ . 1 . 2]" 2
95 1 186 TYR O 1 189 ARG H 1.950 . 2.100 2.116 2.060 2.161 0.061 11 0 "[ . 1 . 2]" 2
96 1 186 TYR O 1 189 ARG N 2.930 2.780 3.150 3.022 2.933 3.081 . 0 0 "[ . 1 . 2]" 2
97 1 196 ASN O 1 204 TYR H 1.950 . 2.100 2.178 2.120 2.209 0.109 14 0 "[ . 1 . 2]" 2
98 1 196 ASN O 1 204 TYR N 2.930 2.780 3.150 3.008 2.948 3.053 . 0 0 "[ . 1 . 2]" 2
99 1 196 ASN H 1 204 TYR O 1.950 . 2.100 1.990 1.929 2.070 . 0 0 "[ . 1 . 2]" 2
100 1 196 ASN N 1 204 TYR O 2.930 2.780 3.150 2.813 2.729 2.897 0.051 8 0 "[ . 1 . 2]" 2
101 1 198 ALA H 1 202 LYS O 1.950 . 2.100 1.981 1.929 2.024 . 0 0 "[ . 1 . 2]" 2
102 1 198 ALA N 1 202 LYS O 2.930 2.780 3.150 2.887 2.804 2.982 . 0 0 "[ . 1 . 2]" 2
103 1 203 LEU O 1 211 PHE H 1.950 . 2.100 2.075 1.939 2.145 0.045 13 0 "[ . 1 . 2]" 2
104 1 203 LEU O 1 211 PHE N 2.930 2.780 3.150 3.012 2.912 3.101 . 0 0 "[ . 1 . 2]" 2
105 1 203 LEU H 1 211 PHE O 1.950 . 2.100 2.127 2.051 2.206 0.106 12 0 "[ . 1 . 2]" 2
106 1 203 LEU N 1 211 PHE O 2.930 2.780 3.150 2.911 2.807 3.063 . 0 0 "[ . 1 . 2]" 2
107 1 213 THR O 1 217 LEU H 1.950 . 2.100 2.219 2.188 2.241 0.141 12 0 "[ . 1 . 2]" 2
108 1 213 THR O 1 217 LEU N 2.930 2.780 3.150 3.150 3.094 3.176 0.026 12 0 "[ . 1 . 2]" 2
109 1 214 LEU O 1 218 VAL H 1.950 . 2.100 2.021 1.985 2.120 0.020 8 0 "[ . 1 . 2]" 2
110 1 214 LEU O 1 218 VAL N 2.930 2.780 3.150 2.989 2.952 3.083 . 0 0 "[ . 1 . 2]" 2
111 1 215 ALA O 1 219 HIS H 1.950 . 2.100 2.122 2.091 2.149 0.049 10 0 "[ . 1 . 2]" 2
112 1 215 ALA O 1 219 HIS N 2.930 2.780 3.150 3.022 2.954 3.076 . 0 0 "[ . 1 . 2]" 2
113 1 216 GLU O 1 220 HIS H 1.950 . 2.100 2.012 1.930 2.059 . 0 0 "[ . 1 . 2]" 2
114 1 216 GLU O 1 220 HIS N 2.930 2.780 3.150 2.973 2.883 3.013 . 0 0 "[ . 1 . 2]" 2
115 1 217 LEU O 1 221 HIS H 1.950 . 2.100 2.151 2.109 2.195 0.095 9 0 "[ . 1 . 2]" 2
116 1 217 LEU O 1 221 HIS N 2.930 2.780 3.150 3.020 2.963 3.099 . 0 0 "[ . 1 . 2]" 2
117 1 218 VAL O 1 222 SER H 1.950 . 2.100 2.123 2.069 2.157 0.057 2 0 "[ . 1 . 2]" 2
118 1 218 VAL O 1 222 SER N 2.930 2.780 3.150 2.773 2.734 2.836 0.046 9 0 "[ . 1 . 2]" 2
119 1 219 HIS O 1 223 THR H 1.950 . 2.100 2.141 2.113 2.193 0.093 13 0 "[ . 1 . 2]" 2
120 1 219 HIS O 1 223 THR N 2.930 2.780 3.150 3.005 2.882 3.107 . 0 0 "[ . 1 . 2]" 2
121 1 220 HIS O 1 224 VAL H 1.950 . 2.100 2.130 2.028 2.174 0.074 12 0 "[ . 1 . 2]" 2
122 1 220 HIS O 1 224 VAL N 2.930 2.780 3.150 3.055 2.923 3.109 . 0 0 "[ . 1 . 2]" 2
123 1 221 HIS O 1 232 LEU H 1.950 . 2.100 2.083 2.009 2.164 0.064 5 0 "[ . 1 . 2]" 2
124 1 221 HIS O 1 232 LEU N 2.930 2.780 3.150 3.047 2.966 3.138 . 0 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Saturday, April 27, 2024 8:28:53 PM GMT (wattos1)