NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575817 |
2me8   |
19520 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2me8
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 740
_Distance_constraint_stats_list.Viol_count 2830
_Distance_constraint_stats_list.Viol_total 7112.220
_Distance_constraint_stats_list.Viol_max 1.300
_Distance_constraint_stats_list.Viol_rms 0.0693
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0240
_Distance_constraint_stats_list.Viol_average_violations_only 0.1257
_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 4 MET 0.685 0.203 18 0 "[ . 1 . 2]"
1 5 SER 0.480 0.203 18 0 "[ . 1 . 2]"
1 6 GLN 0.368 0.152 13 0 "[ . 1 . 2]"
1 7 SER 2.064 1.016 18 1 "[ . 1 . + 2]"
1 8 ASN 1.127 0.530 18 1 "[ . 1 . + 2]"
1 9 ARG 1.522 1.016 18 1 "[ . 1 . + 2]"
1 10 GLU 4.010 0.320 10 0 "[ . 1 . 2]"
1 11 LEU 7.727 0.339 5 0 "[ . 1 . 2]"
1 12 VAL 12.094 0.320 10 0 "[ . 1 . 2]"
1 13 VAL 14.042 0.339 5 0 "[ . 1 . 2]"
1 14 ASP 1.635 0.225 19 0 "[ . 1 . 2]"
1 15 PHE 2.272 0.279 16 0 "[ . 1 . 2]"
1 16 LEU 7.213 0.258 10 0 "[ . 1 . 2]"
1 17 SER 1.119 0.165 19 0 "[ . 1 . 2]"
1 18 TYR 1.837 0.343 19 0 "[ . 1 . 2]"
1 19 LYS 3.280 0.558 10 1 "[ . + . 2]"
1 20 LEU 12.690 0.575 16 2 "[ . - .+ 2]"
1 21 SER 2.285 0.222 14 0 "[ . 1 . 2]"
1 22 GLN 9.976 0.515 10 1 "[ . + . 2]"
1 23 LYS 5.130 0.415 8 0 "[ . 1 . 2]"
1 24 GLY 4.872 0.420 8 0 "[ . 1 . 2]"
1 25 TYR 9.524 0.515 10 1 "[ . + . 2]"
1 26 SER 2.775 0.554 5 1 "[ + 1 . 2]"
1 27 TRP 2.601 0.575 16 2 "[ - 1 .+ 2]"
1 28 SER 0.940 0.278 18 0 "[ . 1 . 2]"
1 29 GLN 0.331 0.115 14 0 "[ . 1 . 2]"
1 30 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 SER 0.007 0.007 8 0 "[ . 1 . 2]"
1 32 ASP 1.885 0.379 13 0 "[ . 1 . 2]"
1 33 VAL 5.136 0.379 13 0 "[ . 1 . 2]"
1 34 GLU 1.922 0.261 13 0 "[ . 1 . 2]"
1 35 GLU 0.710 0.209 7 0 "[ . 1 . 2]"
1 36 ASN 0.833 0.198 12 0 "[ . 1 . 2]"
1 37 ARG 0.444 0.198 12 0 "[ . 1 . 2]"
1 38 THR 0.665 0.189 15 0 "[ . 1 . 2]"
1 39 GLU 0.665 0.189 15 0 "[ . 1 . 2]"
1 43 GLY 0.086 0.046 18 0 "[ . 1 . 2]"
1 44 THR 0.086 0.046 18 0 "[ . 1 . 2]"
1 45 GLU 0.185 0.115 11 0 "[ . 1 . 2]"
1 46 SER 0.185 0.115 11 0 "[ . 1 . 2]"
1 47 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 MET 0.104 0.104 9 0 "[ . 1 . 2]"
1 49 GLU 1.862 0.309 9 0 "[ . 1 . 2]"
1 50 THR 0.428 0.309 9 0 "[ . 1 . 2]"
1 52 SER 0.403 0.134 17 0 "[ . 1 . 2]"
1 53 ALA 0.461 0.134 17 0 "[ . 1 . 2]"
1 54 ILE 1.698 0.255 18 0 "[ . 1 . 2]"
1 55 ASN 0.102 0.071 9 0 "[ . 1 . 2]"
1 56 GLY 0.009 0.005 14 0 "[ . 1 . 2]"
1 57 ASN 0.009 0.005 14 0 "[ . 1 . 2]"
1 59 SER 1.084 0.296 16 0 "[ . 1 . 2]"
1 60 TRP 0.936 0.296 16 0 "[ . 1 . 2]"
1 61 HIS 2.738 0.275 18 0 "[ . 1 . 2]"
1 62 LEU 0.459 0.146 18 0 "[ . 1 . 2]"
1 63 ALA 0.852 0.155 9 0 "[ . 1 . 2]"
1 64 ASP 0.571 0.150 6 0 "[ . 1 . 2]"
1 65 SER 2.554 0.214 15 0 "[ . 1 . 2]"
1 67 ALA 2.204 0.214 15 0 "[ . 1 . 2]"
1 68 VAL 0.649 0.194 18 0 "[ . 1 . 2]"
1 69 ASN 0.604 0.184 14 0 "[ . 1 . 2]"
1 70 GLY 0.392 0.092 20 0 "[ . 1 . 2]"
1 71 ALA 0.216 0.092 20 0 "[ . 1 . 2]"
1 73 GLY 0.078 0.041 1 0 "[ . 1 . 2]"
1 74 HIS 0.078 0.041 1 0 "[ . 1 . 2]"
1 75 SER 1.490 0.147 20 0 "[ . 1 . 2]"
1 76 SER 1.475 0.147 20 0 "[ . 1 . 2]"
1 77 SER 0.525 0.120 8 0 "[ . 1 . 2]"
1 78 LEU 0.896 0.182 17 0 "[ . 1 . 2]"
1 79 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 ARG 0.826 0.182 17 0 "[ . 1 . 2]"
1 82 GLU 0.910 0.343 14 0 "[ . 1 . 2]"
1 83 VAL 1.380 0.343 14 0 "[ . 1 . 2]"
1 84 ILE 0.811 0.461 2 0 "[ . 1 . 2]"
1 86 MET 0.808 0.202 14 0 "[ . 1 . 2]"
1 87 ALA 1.095 0.202 14 0 "[ . 1 . 2]"
1 88 ALA 0.805 0.387 19 0 "[ . 1 . 2]"
1 89 VAL 2.911 0.387 19 0 "[ . 1 . 2]"
1 90 LYS 1.562 0.258 16 0 "[ . 1 . 2]"
1 91 GLN 0.109 0.109 19 0 "[ . 1 . 2]"
1 92 ALA 4.928 0.295 19 0 "[ . 1 . 2]"
1 93 LEU 5.472 0.276 10 0 "[ . 1 . 2]"
1 94 ARG 5.993 0.303 6 0 "[ . 1 . 2]"
1 95 GLU 3.955 0.276 10 0 "[ . 1 . 2]"
1 96 ALA 5.999 0.303 6 0 "[ . 1 . 2]"
1 97 GLY 1.734 0.137 3 0 "[ . 1 . 2]"
1 98 ASP 3.451 0.229 13 0 "[ . 1 . 2]"
1 99 GLU 5.853 0.295 15 0 "[ . 1 . 2]"
1 100 PHE 2.355 0.173 5 0 "[ . 1 . 2]"
1 101 GLU 5.737 0.295 15 0 "[ . 1 . 2]"
1 102 LEU 3.371 0.301 7 0 "[ . 1 . 2]"
1 103 ARG 2.770 0.275 13 0 "[ . 1 . 2]"
1 104 TYR 4.887 0.301 7 0 "[ . 1 . 2]"
1 105 ARG 0.649 0.275 13 0 "[ . 1 . 2]"
1 106 ARG 2.010 0.269 13 0 "[ . 1 . 2]"
1 107 ALA 2.224 0.292 12 0 "[ . 1 . 2]"
1 108 PHE 3.595 0.269 13 0 "[ . 1 . 2]"
1 109 SER 2.813 0.348 12 0 "[ . 1 . 2]"
1 110 ASP 4.789 0.347 10 0 "[ . 1 . 2]"
1 111 LEU 18.532 0.389 9 0 "[ . 1 . 2]"
1 112 THR 6.412 0.347 10 0 "[ . 1 . 2]"
1 113 SER 3.614 0.324 18 0 "[ . 1 . 2]"
1 114 GLN 1.925 0.261 9 0 "[ . 1 . 2]"
1 115 LEU 13.173 0.389 9 0 "[ . 1 . 2]"
1 116 HIS 1.465 0.236 14 0 "[ . 1 . 2]"
1 117 ILE 6.226 0.306 7 0 "[ . 1 . 2]"
1 118 THR 1.465 0.236 14 0 "[ . 1 . 2]"
1 122 ALA 2.480 0.194 15 0 "[ . 1 . 2]"
1 123 TYR 4.360 0.280 14 0 "[ . 1 . 2]"
1 124 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 SER 3.057 0.280 14 0 "[ . 1 . 2]"
1 126 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 GLU 2.366 0.216 5 0 "[ . 1 . 2]"
1 128 GLN 2.263 0.222 14 0 "[ . 1 . 2]"
1 129 VAL 1.663 0.236 17 0 "[ . 1 . 2]"
1 130 VAL 7.339 0.222 14 0 "[ . 1 . 2]"
1 131 ASN 0.633 0.241 3 0 "[ . 1 . 2]"
1 132 GLU 3.866 0.280 15 0 "[ . 1 . 2]"
1 133 LEU 4.077 0.241 3 0 "[ . 1 . 2]"
1 134 PHE 4.817 0.312 8 0 "[ . 1 . 2]"
1 135 ARG 1.325 0.156 9 0 "[ . 1 . 2]"
1 136 ASP 7.060 0.420 17 0 "[ . 1 . 2]"
1 137 GLY 1.279 0.156 9 0 "[ . 1 . 2]"
1 138 VAL 8.673 0.420 17 0 "[ . 1 . 2]"
1 139 ASN 8.957 0.327 19 0 "[ . 1 . 2]"
1 140 TRP 7.946 0.375 19 0 "[ . 1 . 2]"
1 141 GLY 10.161 0.327 19 0 "[ . 1 . 2]"
1 142 ARG 2.333 0.308 19 0 "[ . 1 . 2]"
1 143 ILE 10.499 0.282 15 0 "[ . 1 . 2]"
1 144 VAL 4.658 0.253 12 0 "[ . 1 . 2]"
1 145 ALA 3.661 0.278 8 0 "[ . 1 . 2]"
1 146 PHE 3.969 0.253 12 0 "[ . 1 . 2]"
1 147 PHE 3.460 0.278 8 0 "[ . 1 . 2]"
1 148 SER 4.671 0.281 11 0 "[ . 1 . 2]"
1 149 PHE 1.670 0.205 11 0 "[ . 1 . 2]"
1 150 GLY 5.226 0.275 3 0 "[ . 1 . 2]"
1 151 GLY 1.751 0.220 2 0 "[ . 1 . 2]"
1 152 ALA 5.698 0.375 12 0 "[ . 1 . 2]"
1 153 LEU 15.406 0.380 10 0 "[ . 1 . 2]"
1 154 CYS 23.498 1.300 9 20 [********+**********-]
1 155 VAL 8.990 0.421 8 0 "[ . 1 . 2]"
1 156 GLU 20.512 1.300 9 20 [*-******+***********]
1 157 SER 6.419 0.656 5 3 "[ + *1 . -]"
1 158 VAL 5.627 0.284 14 0 "[ . 1 . 2]"
1 159 ASP 0.389 0.132 12 0 "[ . 1 . 2]"
1 160 LYS 0.292 0.131 20 0 "[ . 1 . 2]"
1 161 GLU 2.408 0.200 14 0 "[ . 1 . 2]"
1 162 MET 0.469 0.131 20 0 "[ . 1 . 2]"
1 163 GLN 8.050 0.501 9 1 "[ . +1 . 2]"
1 164 VAL 10.024 0.501 9 1 "[ . +1 . 2]"
1 165 LEU 17.210 0.375 10 0 "[ . 1 . 2]"
1 166 VAL 10.611 0.422 9 0 "[ . 1 . 2]"
1 167 SER 2.782 0.235 4 0 "[ . 1 . 2]"
1 168 ARG 2.595 0.229 19 0 "[ . 1 . 2]"
1 169 ILE 8.995 0.235 4 0 "[ . 1 . 2]"
1 170 ALA 4.696 0.292 7 0 "[ . 1 . 2]"
1 171 ALA 5.067 0.238 11 0 "[ . 1 . 2]"
1 172 TRP 6.196 0.292 7 0 "[ . 1 . 2]"
1 173 MET 3.629 0.302 6 0 "[ . 1 . 2]"
1 174 ALA 0.051 0.051 15 0 "[ . 1 . 2]"
1 175 THR 2.676 0.279 6 0 "[ . 1 . 2]"
1 176 TYR 0.241 0.083 17 0 "[ . 1 . 2]"
1 177 LEU 12.380 0.302 6 0 "[ . 1 . 2]"
1 178 ASN 2.986 0.153 5 0 "[ . 1 . 2]"
1 179 ASP 1.188 0.352 15 0 "[ . 1 . 2]"
1 180 HIS 6.766 0.351 11 0 "[ . 1 . 2]"
1 181 LEU 5.199 0.352 15 0 "[ . 1 . 2]"
1 182 GLU 4.744 0.351 11 0 "[ . 1 . 2]"
1 184 TRP 1.697 0.125 3 0 "[ . 1 . 2]"
1 185 ILE 4.272 0.230 17 0 "[ . 1 . 2]"
1 186 GLN 2.308 0.366 19 0 "[ . 1 . 2]"
1 187 GLU 4.054 0.469 19 0 "[ . 1 . 2]"
1 188 ASN 1.973 0.366 19 0 "[ . 1 . 2]"
1 189 GLY 1.169 0.175 2 0 "[ . 1 . 2]"
1 190 GLY 6.312 0.469 19 0 "[ . 1 . 2]"
1 191 TRP 8.124 0.257 17 0 "[ . 1 . 2]"
1 192 ASP 4.555 0.220 20 0 "[ . 1 . 2]"
1 193 THR 5.500 0.279 10 0 "[ . 1 . 2]"
1 194 PHE 6.347 0.213 1 0 "[ . 1 . 2]"
1 195 VAL 5.244 0.282 19 0 "[ . 1 . 2]"
1 196 GLU 8.924 0.416 14 0 "[ . 1 . 2]"
1 197 LEU 11.039 0.416 19 0 "[ . 1 . 2]"
1 198 TYR 2.990 0.344 19 0 "[ . 1 . 2]"
1 199 GLY 3.492 0.416 19 0 "[ . 1 . 2]"
1 200 ASN 1.912 0.375 16 0 "[ . 1 . 2]"
1 201 ASN 1.857 0.173 18 0 "[ . 1 . 2]"
1 202 ALA 1.144 0.196 9 0 "[ . 1 . 2]"
1 203 ALA 2.516 0.196 9 0 "[ . 1 . 2]"
1 204 ALA 0.976 0.161 8 0 "[ . 1 . 2]"
1 205 GLU 0.520 0.129 13 0 "[ . 1 . 2]"
1 206 SER 0.741 0.129 13 0 "[ . 1 . 2]"
1 207 ARG 1.804 0.300 7 0 "[ . 1 . 2]"
1 208 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 209 GLY 1.701 0.300 7 0 "[ . 1 . 2]"
1 210 GLN 1.592 0.390 6 0 "[ . 1 . 2]"
1 211 GLU 1.267 0.390 6 0 "[ . 1 . 2]"
1 212 ARG 0.612 0.185 4 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 1 166 VAL H 1 169 ILE H . . 4.600 4.658 4.517 4.795 0.195 19 0 "[ . 1 . 2]" 1
2 1 168 ARG H 1 169 ILE H . . 2.960 2.620 2.522 2.790 . 0 0 "[ . 1 . 2]" 1
3 1 185 ILE H 1 187 GLU H . . 4.350 4.001 3.862 4.171 . 0 0 "[ . 1 . 2]" 1
4 1 184 TRP H 1 185 ILE H . . 2.700 2.750 2.623 2.825 0.125 3 0 "[ . 1 . 2]" 1
5 1 185 ILE H 1 186 GLN H . . 2.700 2.637 2.491 2.818 0.118 12 0 "[ . 1 . 2]" 1
6 1 17 SER H 1 20 LEU H . . 5.200 5.186 4.794 5.365 0.165 19 0 "[ . 1 . 2]" 1
7 1 17 SER H 1 18 TYR H . . 2.930 2.739 2.571 2.853 . 0 0 "[ . 1 . 2]" 1
8 1 207 ARG H 1 208 LYS H . . 3.460 2.574 1.975 3.099 . 0 0 "[ . 1 . 2]" 1
9 1 83 VAL H 1 84 ILE H . . 6.000 3.824 1.956 4.684 . 0 0 "[ . 1 . 2]" 1
10 1 12 VAL H 1 14 ASP H . . 4.320 4.092 4.030 4.158 . 0 0 "[ . 1 . 2]" 1
11 1 12 VAL H 1 13 VAL H . . 3.100 2.781 2.604 2.849 . 0 0 "[ . 1 . 2]" 1
12 1 28 SER H 1 29 GLN H . . 4.190 2.614 2.346 2.893 . 0 0 "[ . 1 . 2]" 1
13 1 74 HIS H 1 75 SER H . . 3.460 2.660 2.506 2.830 . 0 0 "[ . 1 . 2]" 1
14 1 75 SER H 1 76 SER H . . 2.700 2.758 2.608 2.847 0.147 20 0 "[ . 1 . 2]" 1
15 1 95 GLU H 1 97 GLY H . . 4.090 3.924 3.702 4.227 0.137 3 0 "[ . 1 . 2]" 1
16 1 93 LEU H 1 95 GLU H . . 4.090 4.275 4.186 4.366 0.276 10 0 "[ . 1 . 2]" 1
17 1 35 GLU H 1 36 ASN H . . 3.620 2.919 2.160 3.675 0.055 16 0 "[ . 1 . 2]" 1
18 1 45 GLU H 1 46 SER H . . 3.720 3.200 2.365 3.835 0.115 11 0 "[ . 1 . 2]" 1
19 1 178 ASN H 1 180 HIS H . . 4.900 4.902 3.966 5.048 0.148 12 0 "[ . 1 . 2]" 1
20 1 178 ASN H 1 181 LEU H . . 4.650 4.714 4.488 4.803 0.153 5 0 "[ . 1 . 2]" 1
21 1 178 ASN H 1 179 ASP H . . 2.960 2.450 2.369 2.627 . 0 0 "[ . 1 . 2]" 1
22 1 106 ARG H 1 107 ALA H . . 3.000 2.680 2.404 2.853 . 0 0 "[ . 1 . 2]" 1
23 1 27 TRP H 1 28 SER H . . 4.650 2.895 2.098 4.216 . 0 0 "[ . 1 . 2]" 1
24 1 101 GLU H 1 104 TYR H . . 4.500 4.580 4.490 4.730 0.230 7 0 "[ . 1 . 2]" 1
25 1 131 ASN H 1 132 GLU H . . 3.530 2.817 2.723 2.902 . 0 0 "[ . 1 . 2]" 1
26 1 30 PHE H 1 31 SER H . . 4.350 2.551 1.915 3.327 . 0 0 "[ . 1 . 2]" 1
27 1 91 GLN H 1 92 ALA H . . 3.200 2.617 2.274 2.884 . 0 0 "[ . 1 . 2]" 1
28 1 92 ALA H 1 93 LEU H . . 3.360 2.671 2.523 2.921 . 0 0 "[ . 1 . 2]" 1
29 1 90 LYS H 1 92 ALA H . . 3.920 3.773 2.742 4.178 0.258 16 0 "[ . 1 . 2]" 1
30 1 146 PHE H 1 148 SER H . . 4.480 4.192 3.905 4.463 . 0 0 "[ . 1 . 2]" 1
31 1 146 PHE H 1 149 PHE H . . 4.850 4.684 4.505 4.962 0.112 6 0 "[ . 1 . 2]" 1
32 1 144 VAL H 1 146 PHE H . . 3.920 4.107 4.052 4.173 0.253 12 0 "[ . 1 . 2]" 1
33 1 146 PHE H 1 147 PHE H . . 3.790 2.686 2.540 2.797 . 0 0 "[ . 1 . 2]" 1
34 1 190 GLY H 1 191 TRP H . . 4.250 3.983 2.882 4.425 0.175 18 0 "[ . 1 . 2]" 1
35 1 191 TRP H 1 194 PHE H . . 4.610 4.728 4.587 4.823 0.213 1 0 "[ . 1 . 2]" 1
36 1 191 TRP H 1 193 THR H . . 4.400 4.496 4.188 4.657 0.257 17 0 "[ . 1 . 2]" 1
37 1 206 SER H 1 207 ARG H . . 2.700 2.643 2.234 2.781 0.081 14 0 "[ . 1 . 2]" 1
38 1 207 ARG H 1 209 GLY H . . 4.420 4.369 3.337 4.720 0.300 7 0 "[ . 1 . 2]" 1
39 1 77 SER H 1 78 LEU H . . 2.770 2.685 2.256 2.890 0.120 8 0 "[ . 1 . 2]" 1
40 1 148 SER H 1 151 GLY H . . 5.740 4.575 4.328 4.868 . 0 0 "[ . 1 . 2]" 1
41 1 5 SER H 1 6 GLN H . . 2.800 2.541 1.939 2.858 0.058 7 0 "[ . 1 . 2]" 1
42 1 4 MET H 1 5 SER H . . 2.700 2.320 1.947 2.903 0.203 18 0 "[ . 1 . 2]" 1
43 1 95 GLU H 1 96 ALA H . . 3.060 2.730 2.648 2.828 . 0 0 "[ . 1 . 2]" 1
44 1 94 ARG H 1 96 ALA H . . 4.200 4.340 4.102 4.503 0.303 6 0 "[ . 1 . 2]" 1
45 1 93 LEU H 1 96 ALA H . . 5.310 5.018 4.767 5.135 . 0 0 "[ . 1 . 2]" 1
46 1 96 ALA H 1 98 ASP H . . 4.090 4.240 4.004 4.319 0.229 13 0 "[ . 1 . 2]" 1
47 1 201 ASN H 1 202 ALA H . . 2.770 2.473 1.874 2.885 0.115 5 0 "[ . 1 . 2]" 1
48 1 164 VAL H 1 166 VAL H . . 3.920 4.088 3.781 4.342 0.422 9 0 "[ . 1 . 2]" 1
49 1 163 GLN H 1 166 VAL H . . 5.180 5.082 4.519 5.357 0.177 13 0 "[ . 1 . 2]" 1
50 1 166 VAL H 1 167 SER H . . 3.560 2.794 2.524 2.968 . 0 0 "[ . 1 . 2]" 1
51 1 155 VAL H 1 156 GLU H . . 2.700 2.605 2.509 2.763 0.063 12 0 "[ . 1 . 2]" 1
52 1 177 LEU H 1 180 HIS H . . 5.640 5.584 4.860 5.768 0.128 17 0 "[ . 1 . 2]" 1
53 1 180 HIS H 1 182 GLU H . . 3.660 3.859 2.919 4.011 0.351 11 0 "[ . 1 . 2]" 1
54 1 70 GLY H 1 71 ALA H . . 3.790 3.341 2.249 3.882 0.092 20 0 "[ . 1 . 2]" 1
55 1 163 GLN H 1 164 VAL H . . 3.260 2.327 1.868 2.937 . 0 0 "[ . 1 . 2]" 1
56 1 164 VAL H 1 167 SER H . . 5.600 4.970 4.564 5.421 . 0 0 "[ . 1 . 2]" 1
57 1 129 VAL H 1 131 ASN H . . 4.280 4.138 3.962 4.387 0.107 3 0 "[ . 1 . 2]" 1
58 1 126 PHE H 1 129 VAL H . . 5.570 4.942 4.802 5.128 . 0 0 "[ . 1 . 2]" 1
59 1 128 GLN H 1 129 VAL H . . 3.290 2.591 2.520 2.673 . 0 0 "[ . 1 . 2]" 1
60 1 129 VAL H 1 130 VAL H . . 3.200 2.761 2.654 2.871 . 0 0 "[ . 1 . 2]" 1
61 1 129 VAL H 1 132 GLU H . . 5.870 4.919 4.675 5.084 . 0 0 "[ . 1 . 2]" 1
62 1 69 ASN H 1 70 GLY H . . 4.400 4.100 2.290 4.449 0.049 8 0 "[ . 1 . 2]" 1
63 1 68 VAL H 1 69 ASN H . . 3.530 3.003 1.977 3.714 0.184 14 0 "[ . 1 . 2]" 1
64 1 169 ILE H 1 172 TRP H . . 5.010 4.577 4.491 4.669 . 0 0 "[ . 1 . 2]" 1
65 1 171 ALA H 1 172 TRP H . . 3.060 2.604 2.541 2.659 . 0 0 "[ . 1 . 2]" 1
66 1 205 GLU H 1 206 SER H . . 2.930 2.748 2.075 3.059 0.129 13 0 "[ . 1 . 2]" 1
67 1 48 MET H 1 49 GLU H . . 3.430 2.878 2.315 3.408 . 0 0 "[ . 1 . 2]" 1
68 1 49 GLU H 1 50 THR H . . 3.560 2.929 1.944 3.869 0.309 9 0 "[ . 1 . 2]" 1
69 1 209 GLY H 1 210 GLN H . . 3.560 3.265 2.801 3.656 0.096 13 0 "[ . 1 . 2]" 1
70 1 204 ALA H 1 205 GLU H . . 2.900 2.743 1.998 2.933 0.033 8 0 "[ . 1 . 2]" 1
71 1 136 ASP H 1 138 VAL H . . 4.800 4.904 4.683 5.220 0.420 17 0 "[ . 1 . 2]" 1
72 1 111 LEU H 1 112 THR H . . 2.700 2.751 2.581 2.961 0.261 1 0 "[ . 1 . 2]" 1
73 1 122 ALA H 1 123 TYR H . . 4.250 4.053 2.963 4.444 0.194 15 0 "[ . 1 . 2]" 1
74 1 202 ALA H 1 203 ALA H . . 2.700 2.486 1.921 2.896 0.196 9 0 "[ . 1 . 2]" 1
75 1 196 GLU H 1 198 TYR H . . 3.920 4.055 3.911 4.264 0.344 19 0 "[ . 1 . 2]" 1
76 1 198 TYR H 1 200 ASN H . . 4.280 4.123 3.885 4.339 0.059 20 0 "[ . 1 . 2]" 1
77 1 197 LEU H 1 198 TYR H . . 2.800 2.611 2.405 2.831 0.031 7 0 "[ . 1 . 2]" 1
78 1 6 GLN H 1 7 SER H . . 3.330 2.634 2.041 3.246 . 0 0 "[ . 1 . 2]" 1
79 1 7 SER H 1 9 ARG H . . 4.350 4.232 3.777 5.366 1.016 18 1 "[ . 1 . + 2]" 1
80 1 148 SER H 1 149 PHE H . . 3.260 2.440 2.276 2.752 . 0 0 "[ . 1 . 2]" 1
81 1 149 PHE H 1 150 GLY H . . 3.130 2.640 2.439 2.762 . 0 0 "[ . 1 . 2]" 1
82 1 149 PHE H 1 152 ALA H . . 4.850 4.610 4.371 4.866 0.016 17 0 "[ . 1 . 2]" 1
83 1 149 PHE H 1 151 GLY H . . 4.450 4.043 3.738 4.428 . 0 0 "[ . 1 . 2]" 1
84 1 176 TYR H 1 177 LEU H . . 2.700 2.679 2.575 2.783 0.083 17 0 "[ . 1 . 2]" 1
85 1 177 LEU H 1 178 ASN H . . 3.100 2.836 2.739 2.912 . 0 0 "[ . 1 . 2]" 1
86 1 175 THR H 1 177 LEU H . . 4.220 4.086 3.887 4.319 0.099 19 0 "[ . 1 . 2]" 1
87 1 187 GLU H 1 188 ASN H . . 2.960 2.562 2.318 2.785 . 0 0 "[ . 1 . 2]" 1
88 1 184 TRP H 1 187 GLU H . . 5.050 4.603 4.524 4.732 . 0 0 "[ . 1 . 2]" 1
89 1 187 GLU H 1 189 GLY H . . 4.050 3.897 3.554 4.225 0.175 2 0 "[ . 1 . 2]" 1
90 1 144 VAL H 1 145 ALA H . . 3.100 2.668 2.599 2.784 . 0 0 "[ . 1 . 2]" 1
91 1 148 SER H 1 150 GLY H . . 3.890 4.014 3.885 4.165 0.275 3 0 "[ . 1 . 2]" 1
92 1 150 GLY H 1 151 GLY H . . 3.260 2.331 1.981 2.767 . 0 0 "[ . 1 . 2]" 1
93 1 134 PHE H 1 136 ASP H . . 4.300 4.537 4.377 4.612 0.312 8 0 "[ . 1 . 2]" 1
94 1 145 ALA H 1 146 PHE H . . 3.030 2.653 2.498 2.853 . 0 0 "[ . 1 . 2]" 1
95 1 145 ALA H 1 148 SER H . . 5.410 5.133 4.759 5.512 0.102 16 0 "[ . 1 . 2]" 1
96 1 150 GLY H 1 152 ALA H . . 3.820 3.906 3.596 4.077 0.257 7 0 "[ . 1 . 2]" 1
97 1 191 TRP H 1 192 ASP H . . 2.730 2.803 2.609 2.950 0.220 20 0 "[ . 1 . 2]" 1
98 1 190 GLY H 1 192 ASP H . . 5.500 5.003 3.666 5.668 0.168 9 0 "[ . 1 . 2]" 1
99 1 87 ALA H 1 88 ALA H . . 2.960 2.661 1.918 3.076 0.116 20 0 "[ . 1 . 2]" 1
100 1 88 ALA H 1 89 VAL H . . 2.960 2.661 2.045 3.347 0.387 19 0 "[ . 1 . 2]" 1
101 1 159 ASP H 1 160 LYS H . . 3.290 2.378 2.264 2.594 . 0 0 "[ . 1 . 2]" 1
102 1 188 ASN H 1 189 GLY H . . 3.360 2.725 2.482 2.862 . 0 0 "[ . 1 . 2]" 1
103 1 186 GLN H 1 188 ASN H . . 4.380 4.382 4.136 4.746 0.366 19 0 "[ . 1 . 2]" 1
104 1 4 MET H 1 6 GLN H . . 4.480 3.704 2.593 4.632 0.152 13 0 "[ . 1 . 2]" 1
105 1 194 PHE H 1 196 GLU H . . 4.090 4.134 4.019 4.242 0.152 19 0 "[ . 1 . 2]" 1
106 1 196 GLU H 1 197 LEU H . . 3.230 2.698 2.474 2.859 . 0 0 "[ . 1 . 2]" 1
107 1 195 VAL H 1 196 GLU H . . 3.100 2.509 2.450 2.556 . 0 0 "[ . 1 . 2]" 1
108 1 19 LYS H 1 20 LEU H . . 3.130 2.755 2.592 2.883 . 0 0 "[ . 1 . 2]" 1
109 1 53 ALA H 1 54 ILE H . . 3.130 2.532 1.991 3.183 0.053 11 0 "[ . 1 . 2]" 1
110 1 54 ILE H 1 55 ASN H . . 3.820 3.214 2.405 3.891 0.071 9 0 "[ . 1 . 2]" 1
111 1 159 ASP H 1 161 GLU H . . 4.050 3.987 3.795 4.182 0.132 12 0 "[ . 1 . 2]" 1
112 1 187 GLU H 1 190 GLY H . . 4.600 4.777 4.363 5.069 0.469 19 0 "[ . 1 . 2]" 1
113 1 188 ASN H 1 190 GLY H . . 4.300 3.969 3.278 4.430 0.130 1 0 "[ . 1 . 2]" 1
114 1 189 GLY H 1 190 GLY H . . 3.000 2.426 1.950 3.018 0.018 1 0 "[ . 1 . 2]" 1
115 1 86 MET H 1 87 ALA H . . 4.150 3.486 2.022 4.352 0.202 14 0 "[ . 1 . 2]" 1
116 1 46 SER H 1 47 GLU H . . 5.110 2.716 2.238 2.932 . 0 0 "[ . 1 . 2]" 1
117 1 47 GLU H 1 48 MET H . . 3.860 2.901 2.256 3.435 . 0 0 "[ . 1 . 2]" 1
118 1 182 GLU H 1 184 TRP H . . 5.340 3.864 3.753 4.062 . 0 0 "[ . 1 . 2]" 1
119 1 101 GLU H 1 103 ARG H . . 4.030 3.904 3.669 4.116 0.086 12 0 "[ . 1 . 2]" 1
120 1 102 LEU H 1 103 ARG H . . 3.790 2.575 2.408 2.760 . 0 0 "[ . 1 . 2]" 1
121 1 103 ARG H 1 105 ARG H . . 4.420 4.070 3.677 4.695 0.275 13 0 "[ . 1 . 2]" 1
122 1 103 ARG H 1 104 TYR H . . 3.260 2.466 2.381 2.531 . 0 0 "[ . 1 . 2]" 1
123 1 62 LEU H 1 63 ALA H . . 4.420 2.577 1.981 3.889 . 0 0 "[ . 1 . 2]" 1
124 1 61 HIS H 1 62 LEU H . . 2.700 2.447 1.951 2.846 0.146 18 0 "[ . 1 . 2]" 1
125 1 55 ASN H 1 56 GLY H . . 4.610 4.084 2.050 4.587 . 0 0 "[ . 1 . 2]" 1
126 1 155 VAL H 1 157 SER H . . 4.250 4.187 3.964 4.366 0.116 9 0 "[ . 1 . 2]" 1
127 1 138 VAL H 1 140 TRP H . . 6.000 6.066 5.920 6.181 0.181 8 0 "[ . 1 . 2]" 1
128 1 140 TRP H 1 142 ARG H . . 4.480 4.382 4.261 4.488 0.008 2 0 "[ . 1 . 2]" 1
129 1 198 TYR H 1 199 GLY H . . 2.700 2.542 2.185 2.717 0.017 6 0 "[ . 1 . 2]" 1
130 1 197 LEU H 1 199 GLY H . . 3.900 3.905 3.701 4.101 0.201 14 0 "[ . 1 . 2]" 1
131 1 192 ASP H 1 194 PHE H . . 4.020 4.087 3.955 4.211 0.191 9 0 "[ . 1 . 2]" 1
132 1 194 PHE H 1 195 VAL H . . 3.030 2.825 2.705 2.901 . 0 0 "[ . 1 . 2]" 1
133 1 193 THR H 1 194 PHE H . . 2.930 2.566 2.427 2.747 . 0 0 "[ . 1 . 2]" 1
134 1 126 PHE H 1 128 GLN H . . 4.980 4.348 3.985 4.675 . 0 0 "[ . 1 . 2]" 1
135 1 128 GLN H 1 130 VAL H . . 4.000 4.097 3.894 4.222 0.222 14 0 "[ . 1 . 2]" 1
136 1 112 THR H 1 113 SER H . . 3.160 2.692 2.407 2.904 . 0 0 "[ . 1 . 2]" 1
137 1 111 LEU H 1 113 SER H . . 4.300 4.391 4.054 4.624 0.324 18 0 "[ . 1 . 2]" 1
138 1 113 SER H 1 114 GLN H . . 2.700 2.429 2.250 2.684 . 0 0 "[ . 1 . 2]" 1
139 1 166 VAL H 1 168 ARG H . . 4.190 3.997 3.676 4.300 0.110 10 0 "[ . 1 . 2]" 1
140 1 165 LEU H 1 168 ARG H . . 4.500 4.585 4.345 4.729 0.229 19 0 "[ . 1 . 2]" 1
141 1 168 ARG H 1 170 ALA H . . 4.180 4.143 3.912 4.320 0.140 10 0 "[ . 1 . 2]" 1
142 1 167 SER H 1 168 ARG H . . 3.460 2.614 2.479 2.837 . 0 0 "[ . 1 . 2]" 1
143 1 162 MET H 1 163 GLN H . . 3.100 2.303 2.070 2.601 . 0 0 "[ . 1 . 2]" 1
144 1 161 GLU H 1 163 GLN H . . 4.800 4.714 3.678 5.000 0.200 14 0 "[ . 1 . 2]" 1
145 1 99 GLU H 1 101 GLU H . . 3.720 3.920 3.811 4.015 0.295 15 0 "[ . 1 . 2]" 1
146 1 152 ALA H 1 153 LEU H . . 2.700 2.600 2.483 2.820 0.120 19 0 "[ . 1 . 2]" 1
147 1 153 LEU H 1 155 VAL H . . 3.920 4.177 4.073 4.300 0.380 10 0 "[ . 1 . 2]" 1
148 1 153 LEU H 1 154 CYS H . . 2.700 2.602 2.546 2.710 0.010 19 0 "[ . 1 . 2]" 1
149 1 151 GLY H 1 153 LEU H . . 4.050 3.841 3.238 4.270 0.220 2 0 "[ . 1 . 2]" 1
150 1 130 VAL H 1 131 ASN H . . 3.360 2.566 2.449 2.711 . 0 0 "[ . 1 . 2]" 1
151 1 130 VAL H 1 132 GLU H . . 4.020 4.146 3.874 4.236 0.216 12 0 "[ . 1 . 2]" 1
152 1 96 ALA H 1 97 GLY H . . 3.430 2.667 2.584 2.767 . 0 0 "[ . 1 . 2]" 1
153 1 97 GLY H 1 99 GLU H . . 4.190 4.230 3.990 4.323 0.133 11 0 "[ . 1 . 2]" 1
154 1 89 VAL H 1 90 LYS H . . 3.920 2.748 2.606 3.193 . 0 0 "[ . 1 . 2]" 1
155 1 165 LEU H 1 166 VAL H . . 3.130 2.400 2.158 2.779 . 0 0 "[ . 1 . 2]" 1
156 1 164 VAL H 1 165 LEU H . . 3.000 2.467 2.333 2.788 . 0 0 "[ . 1 . 2]" 1
157 1 163 GLN H 1 165 LEU H . . 4.190 4.197 3.798 4.476 0.286 12 0 "[ . 1 . 2]" 1
158 1 165 LEU H 1 167 SER H . . 4.250 4.123 3.647 4.423 0.173 7 0 "[ . 1 . 2]" 1
159 1 20 LEU H 1 23 LYS H . . 5.500 5.568 5.087 5.794 0.294 20 0 "[ . 1 . 2]" 1
160 1 20 LEU H 1 21 SER H . . 2.700 2.598 2.472 2.783 0.083 3 0 "[ . 1 . 2]" 1
161 1 32 ASP H 1 33 VAL H . . 2.770 2.492 1.987 2.870 0.100 6 0 "[ . 1 . 2]" 1
162 1 117 ILE H 1 118 THR H . . 4.610 3.148 2.593 3.683 . 0 0 "[ . 1 . 2]" 1
163 1 16 LEU H 1 17 SER H . . 2.830 2.816 2.744 2.875 0.045 19 0 "[ . 1 . 2]" 1
164 1 14 ASP H 1 16 LEU H . . 4.050 4.111 3.967 4.212 0.162 1 0 "[ . 1 . 2]" 1
165 1 16 LEU H 1 19 LYS H . . 4.600 4.624 4.511 4.751 0.151 9 0 "[ . 1 . 2]" 1
166 1 15 PHE H 1 16 LEU H . . 3.060 2.689 2.582 2.850 . 0 0 "[ . 1 . 2]" 1
167 1 16 LEU H 1 18 TYR H . . 3.890 3.895 3.719 4.053 0.163 17 0 "[ . 1 . 2]" 1
168 1 134 PHE H 1 135 ARG H . . 2.870 2.221 1.702 2.449 . 0 0 "[ . 1 . 2]" 1
169 1 14 ASP H 1 15 PHE H . . 2.960 2.761 2.587 2.908 . 0 0 "[ . 1 . 2]" 1
170 1 199 GLY H 1 200 ASN H . . 3.390 2.377 1.901 2.667 . 0 0 "[ . 1 . 2]" 1
171 1 169 ILE H 1 171 ALA H . . 4.020 4.149 4.011 4.227 0.207 5 0 "[ . 1 . 2]" 1
172 1 168 ARG H 1 171 ALA H . . 4.810 4.644 4.513 4.799 . 0 0 "[ . 1 . 2]" 1
173 1 171 ALA H 1 173 MET H . . 4.220 4.317 4.044 4.458 0.238 11 0 "[ . 1 . 2]" 1
174 1 186 GLN H 1 189 GLY H . . 5.240 5.206 4.759 5.397 0.157 9 0 "[ . 1 . 2]" 1
175 1 109 SER H 1 111 LEU H . . 4.190 4.181 3.793 4.538 0.348 12 0 "[ . 1 . 2]" 1
176 1 110 ASP H 1 111 LEU H . . 2.700 2.730 2.509 2.872 0.172 17 0 "[ . 1 . 2]" 1
177 1 131 ASN H 1 133 LEU H . . 4.420 4.282 4.054 4.661 0.241 3 0 "[ . 1 . 2]" 1
178 1 133 LEU H 1 134 PHE H . . 3.060 2.523 2.414 2.833 . 0 0 "[ . 1 . 2]" 1
179 1 194 PHE H 1 197 LEU H . . 5.410 5.006 4.768 5.302 . 0 0 "[ . 1 . 2]" 1
180 1 197 LEU H 1 200 ASN H . . 5.240 4.988 4.423 5.601 0.361 14 0 "[ . 1 . 2]" 1
181 1 101 GLU H 1 102 LEU H . . 2.870 2.683 2.588 2.791 . 0 0 "[ . 1 . 2]" 1
182 1 203 ALA H 1 204 ALA H . . 2.700 2.630 2.079 2.861 0.161 8 0 "[ . 1 . 2]" 1
183 1 109 SER H 1 110 ASP H . . 4.530 4.520 4.386 4.618 0.088 17 0 "[ . 1 . 2]" 1
184 1 26 SER H 1 29 GLN H . . 5.160 4.523 3.273 5.275 0.115 14 0 "[ . 1 . 2]" 1
185 1 26 SER H 1 28 SER H . . 5.140 4.247 2.587 5.418 0.278 18 0 "[ . 1 . 2]" 1
186 1 13 VAL H 1 14 ASP H . . 3.030 2.568 2.525 2.647 . 0 0 "[ . 1 . 2]" 1
187 1 11 LEU H 1 13 VAL H . . 3.920 4.190 4.129 4.259 0.339 5 0 "[ . 1 . 2]" 1
188 1 25 TYR H 1 26 SER H . . 4.550 4.452 4.176 4.651 0.101 13 0 "[ . 1 . 2]" 1
189 1 94 ARG H 1 95 GLU H . . 3.160 2.595 2.526 2.680 . 0 0 "[ . 1 . 2]" 1
190 1 92 ALA H 1 94 ARG H . . 3.820 3.974 3.817 4.115 0.295 19 0 "[ . 1 . 2]" 1
191 1 100 PHE H 1 103 ARG H . . 4.700 4.799 4.695 4.873 0.173 5 0 "[ . 1 . 2]" 1
192 1 99 GLU H 1 100 PHE H . . 2.800 2.761 2.627 2.930 0.130 14 0 "[ . 1 . 2]" 1
193 1 100 PHE H 1 102 LEU H . . 5.270 4.425 4.175 4.618 . 0 0 "[ . 1 . 2]" 1
194 1 98 ASP H 1 100 PHE H . . 4.560 4.338 4.165 4.665 0.105 12 0 "[ . 1 . 2]" 1
195 1 26 SER H 1 27 TRP H . . 3.760 2.768 1.910 4.314 0.554 5 1 "[ + 1 . 2]" 1
196 1 24 GLY H 1 25 TYR H . . 3.230 2.516 1.839 3.197 . 0 0 "[ . 1 . 2]" 1
197 1 21 SER H 1 24 GLY H . . 5.110 5.016 4.701 5.332 0.222 14 0 "[ . 1 . 2]" 1
198 1 22 GLN H 1 24 GLY H . . 3.950 4.123 3.852 4.370 0.420 8 0 "[ . 1 . 2]" 1
199 1 123 TYR H 1 124 GLN H . . 3.290 2.817 2.454 2.921 . 0 0 "[ . 1 . 2]" 1
200 1 64 ASP H 1 65 SER H . . 2.700 2.591 2.226 2.850 0.150 6 0 "[ . 1 . 2]" 1
201 1 10 GLU H 1 12 VAL H . . 3.930 4.100 3.896 4.250 0.320 10 0 "[ . 1 . 2]" 1
202 1 9 ARG H 1 10 GLU H . . 2.700 2.636 2.514 2.722 0.022 13 0 "[ . 1 . 2]" 1
203 1 10 GLU H 1 11 LEU H . . 2.870 2.233 2.088 2.366 . 0 0 "[ . 1 . 2]" 1
204 1 154 CYS H 1 155 VAL H . . 3.900 2.656 2.537 2.804 . 0 0 "[ . 1 . 2]" 1
205 1 138 VAL H 1 139 ASN H . . 3.590 3.148 2.157 3.913 0.323 17 0 "[ . 1 . 2]" 1
206 1 139 ASN H 1 140 TRP H . . 4.650 4.552 4.262 4.682 0.032 9 0 "[ . 1 . 2]" 1
207 1 139 ASN H 1 142 ARG H . . 4.200 4.272 4.095 4.508 0.308 19 0 "[ . 1 . 2]" 1
208 1 139 ASN H 1 143 ILE H . . 3.820 3.866 3.655 4.094 0.274 19 0 "[ . 1 . 2]" 1
209 1 139 ASN H 1 141 GLY H . . 5.000 5.252 5.168 5.327 0.327 19 0 "[ . 1 . 2]" 1
210 1 135 ARG H 1 136 ASP H . . 3.060 2.861 2.777 3.170 0.110 17 0 "[ . 1 . 2]" 1
211 1 56 GLY H 1 57 ASN H . . 2.700 2.497 1.958 2.705 0.005 14 0 "[ . 1 . 2]" 1
212 1 33 VAL H 1 35 GLU H . . 4.800 4.608 3.868 5.009 0.209 7 0 "[ . 1 . 2]" 1
213 1 29 GLN H 1 31 SER H . . 4.580 4.205 3.519 4.587 0.007 8 0 "[ . 1 . 2]" 1
214 1 31 SER H 1 32 ASP H . . 3.660 2.953 2.161 3.604 . 0 0 "[ . 1 . 2]" 1
215 1 151 GLY H 1 152 ALA H . . 3.160 2.375 1.962 2.842 . 0 0 "[ . 1 . 2]" 1
216 1 151 GLY H 1 154 CYS H . . 5.040 4.873 4.144 5.187 0.147 15 0 "[ . 1 . 2]" 1
217 1 156 GLU H 1 157 SER H . . 3.820 2.453 2.336 2.655 . 0 0 "[ . 1 . 2]" 1
218 1 157 SER H 1 159 ASP H . . 4.750 4.225 4.033 4.707 . 0 0 "[ . 1 . 2]" 1
219 1 210 GLN H 1 211 GLU H . . 3.950 2.786 1.914 4.340 0.390 6 0 "[ . 1 . 2]" 1
220 1 18 TYR H 1 19 LYS H . . 2.700 2.627 2.531 2.698 . 0 0 "[ . 1 . 2]" 1
221 1 192 ASP H 1 195 VAL H . . 4.980 4.905 4.768 5.033 0.053 18 0 "[ . 1 . 2]" 1
222 1 193 THR H 1 195 VAL H . . 4.000 4.158 4.050 4.279 0.279 10 0 "[ . 1 . 2]" 1
223 1 33 VAL H 1 34 GLU H . . 2.700 2.399 1.944 2.961 0.261 13 0 "[ . 1 . 2]" 1
224 1 34 GLU H 1 35 GLU H . . 3.460 2.966 1.949 3.591 0.131 7 0 "[ . 1 . 2]" 1
225 1 82 GLU H 1 83 VAL H . . 4.220 3.226 2.043 4.493 0.273 14 0 "[ . 1 . 2]" 1
226 1 147 PHE H 1 148 SER H . . 4.580 2.765 2.618 2.863 . 0 0 "[ . 1 . 2]" 1
227 1 145 ALA H 1 147 PHE H . . 4.010 4.183 4.023 4.288 0.278 8 0 "[ . 1 . 2]" 1
228 1 162 MET H 1 164 VAL H . . 4.940 3.419 2.517 4.848 . 0 0 "[ . 1 . 2]" 1
229 1 160 LYS H 1 162 MET H . . 5.000 4.649 3.845 5.131 0.131 20 0 "[ . 1 . 2]" 1
230 1 160 LYS H 1 161 GLU H . . 3.130 2.385 2.091 2.696 . 0 0 "[ . 1 . 2]" 1
231 1 161 GLU H 1 162 MET H . . 3.100 2.796 2.560 3.163 0.063 9 0 "[ . 1 . 2]" 1
232 1 73 GLY H 1 74 HIS H . . 4.120 3.089 2.012 4.161 0.041 1 0 "[ . 1 . 2]" 1
233 1 7 SER H 1 8 ASN H . . 3.290 2.822 2.451 3.820 0.530 18 1 "[ . 1 . + 2]" 1
234 1 8 ASN H 1 10 GLU H . . 4.120 3.997 3.710 4.359 0.239 18 0 "[ . 1 . 2]" 1
235 1 76 SER H 1 77 SER H . . 2.700 2.618 2.400 2.735 0.035 15 0 "[ . 1 . 2]" 1
236 1 23 LYS H 1 25 TYR H . . 3.530 3.565 3.054 3.945 0.415 8 0 "[ . 1 . 2]" 1
237 1 23 LYS H 1 24 GLY H . . 3.100 2.058 1.880 2.413 . 0 0 "[ . 1 . 2]" 1
238 1 105 ARG H 1 106 ARG H . . 4.050 2.852 2.763 2.901 . 0 0 "[ . 1 . 2]" 1
239 1 105 ARG H 1 107 ALA H . . 4.940 4.490 4.282 4.810 . 0 0 "[ . 1 . 2]" 1
240 1 201 ASN H 1 203 ALA H . . 4.100 4.009 3.215 4.260 0.160 11 0 "[ . 1 . 2]" 1
241 1 200 ASN H 1 201 ASN H . . 2.700 2.666 2.189 2.873 0.173 18 0 "[ . 1 . 2]" 1
242 1 89 VAL H 1 91 GLN H . . 4.730 4.262 3.831 4.839 0.109 19 0 "[ . 1 . 2]" 1
243 1 137 GLY H 1 138 VAL H . . 3.950 3.848 3.658 4.005 0.055 14 0 "[ . 1 . 2]" 1
244 1 135 ARG H 1 137 GLY H . . 3.900 3.916 3.333 4.056 0.156 9 0 "[ . 1 . 2]" 1
245 1 137 GLY H 1 139 ASN H . . 6.000 5.237 4.589 5.787 . 0 0 "[ . 1 . 2]" 1
246 1 136 ASP H 1 137 GLY H . . 2.700 2.285 1.999 2.413 . 0 0 "[ . 1 . 2]" 1
247 1 125 SER H 1 126 PHE H . . 5.540 2.530 2.384 2.786 . 0 0 "[ . 1 . 2]" 1
248 1 125 SER H 1 128 GLN H . . 5.180 5.005 4.755 5.259 0.079 5 0 "[ . 1 . 2]" 1
249 1 123 TYR H 1 125 SER H . . 4.520 4.540 3.973 4.800 0.280 14 0 "[ . 1 . 2]" 1
250 1 125 SER H 1 127 GLU H . . 4.020 3.954 3.654 4.236 0.216 5 0 "[ . 1 . 2]" 1
251 1 124 GLN H 1 125 SER H . . 3.790 2.887 2.774 3.017 . 0 0 "[ . 1 . 2]" 1
252 1 180 HIS H 1 181 LEU H . . 3.330 1.977 1.895 2.742 . 0 0 "[ . 1 . 2]" 1
253 1 113 SER H 1 115 LEU H . . 4.190 4.239 3.987 4.429 0.239 12 0 "[ . 1 . 2]" 1
254 1 182 GLU H 1 185 ILE H . . 5.000 4.834 4.689 5.021 0.021 7 0 "[ . 1 . 2]" 1
255 1 181 LEU H 1 182 GLU H . . 3.330 2.283 2.197 2.633 . 0 0 "[ . 1 . 2]" 1
256 1 59 SER H 1 60 TRP H . . 4.020 2.511 2.048 4.316 0.296 16 0 "[ . 1 . 2]" 1
257 1 59 SER H 1 61 HIS H . . 4.510 4.384 3.686 4.785 0.275 18 0 "[ . 1 . 2]" 1
258 1 38 THR H 1 39 GLU H . . 2.730 2.479 2.007 2.919 0.189 15 0 "[ . 1 . 2]" 1
259 1 169 ILE H 1 170 ALA H . . 3.160 2.755 2.644 2.854 . 0 0 "[ . 1 . 2]" 1
260 1 170 ALA H 1 172 TRP H . . 3.970 4.166 4.088 4.262 0.292 7 0 "[ . 1 . 2]" 1
261 1 170 ALA H 1 171 ALA H . . 3.360 2.775 2.657 2.881 . 0 0 "[ . 1 . 2]" 1
262 1 93 LEU H 1 94 ARG H . . 3.460 2.594 2.481 2.706 . 0 0 "[ . 1 . 2]" 1
263 1 91 GLN H 1 93 LEU H . . 4.550 3.947 3.629 4.212 . 0 0 "[ . 1 . 2]" 1
264 1 167 SER H 1 169 ILE H . . 4.280 4.331 3.971 4.515 0.235 4 0 "[ . 1 . 2]" 1
265 1 208 LYS H 1 209 GLY H . . 2.900 2.519 1.921 2.882 . 0 0 "[ . 1 . 2]" 1
266 1 172 TRP H 1 174 ALA H . . 4.610 4.243 3.792 4.661 0.051 15 0 "[ . 1 . 2]" 1
267 1 171 ALA H 1 174 ALA H . . 5.390 4.857 4.575 5.077 . 0 0 "[ . 1 . 2]" 1
268 1 173 MET H 1 174 ALA H . . 3.620 2.830 2.567 3.010 . 0 0 "[ . 1 . 2]" 1
269 1 174 ALA H 1 175 THR H . . 3.560 2.791 2.651 2.860 . 0 0 "[ . 1 . 2]" 1
270 1 60 TRP H 1 61 HIS H . . 3.030 2.469 1.962 3.020 . 0 0 "[ . 1 . 2]" 1
271 1 192 ASP H 1 193 THR H . . 3.130 2.751 2.461 2.888 . 0 0 "[ . 1 . 2]" 1
272 1 98 ASP H 1 99 GLU H . . 2.700 2.682 2.593 2.765 0.065 5 0 "[ . 1 . 2]" 1
273 1 97 GLY H 1 98 ASP H . . 3.660 2.650 2.483 2.875 . 0 0 "[ . 1 . 2]" 1
274 1 65 SER H 1 67 ALA H . . 4.090 4.189 4.104 4.304 0.214 15 0 "[ . 1 . 2]" 1
275 1 141 GLY H 1 142 ARG H . . 3.030 2.372 2.323 2.456 . 0 0 "[ . 1 . 2]" 1
276 1 102 LEU H 1 104 TYR H . . 4.020 4.079 3.878 4.321 0.301 7 0 "[ . 1 . 2]" 1
277 1 104 TYR H 1 105 ARG H . . 3.200 2.636 2.420 2.874 . 0 0 "[ . 1 . 2]" 1
278 1 186 GLN H 1 187 GLU H . . 3.230 2.654 2.603 2.732 . 0 0 "[ . 1 . 2]" 1
279 1 61 HIS H 1 63 ALA H . . 4.320 4.090 2.557 4.475 0.155 9 0 "[ . 1 . 2]" 1
280 1 127 GLU H 1 129 VAL H . . 4.350 4.332 4.124 4.486 0.136 8 0 "[ . 1 . 2]" 1
281 1 126 PHE H 1 127 GLU H . . 4.380 2.771 2.430 2.874 . 0 0 "[ . 1 . 2]" 1
282 1 127 GLU H 1 128 GLN H . . 3.330 2.740 2.474 2.911 . 0 0 "[ . 1 . 2]" 1
283 1 127 GLU H 1 130 VAL H . . 5.130 4.842 4.670 5.008 . 0 0 "[ . 1 . 2]" 1
284 1 132 GLU H 1 134 PHE H . . 4.500 3.927 3.764 4.572 0.072 17 0 "[ . 1 . 2]" 1
285 1 132 GLU H 1 133 LEU H . . 3.100 2.615 2.511 2.850 . 0 0 "[ . 1 . 2]" 1
286 1 156 GLU H 1 158 VAL H . . 4.060 4.034 3.755 4.214 0.154 13 0 "[ . 1 . 2]" 1
287 1 158 VAL H 1 159 ASP H . . 3.390 2.763 2.646 2.910 . 0 0 "[ . 1 . 2]" 1
288 1 155 VAL H 1 158 VAL H . . 5.310 4.841 4.647 5.056 . 0 0 "[ . 1 . 2]" 1
289 1 157 SER H 1 158 VAL H . . 3.330 2.830 2.603 3.049 . 0 0 "[ . 1 . 2]" 1
290 1 143 ILE H 1 144 VAL H . . 3.160 2.839 2.756 2.965 . 0 0 "[ . 1 . 2]" 1
291 1 140 TRP H 1 143 ILE H . . 4.800 4.890 4.830 4.927 0.127 11 0 "[ . 1 . 2]" 1
292 1 142 ARG H 1 143 ILE H . . 3.160 2.496 2.335 2.646 . 0 0 "[ . 1 . 2]" 1
293 1 88 ALA H 1 90 LYS H . . 5.010 3.966 2.298 5.128 0.118 16 0 "[ . 1 . 2]" 1
294 1 90 LYS H 1 91 GLN H . . 5.010 2.105 1.930 2.850 . 0 0 "[ . 1 . 2]" 1
295 1 172 TRP H 1 173 MET H . . 2.700 2.657 2.560 2.796 0.096 7 0 "[ . 1 . 2]" 1
296 1 173 MET H 1 175 THR H . . 4.140 4.062 3.806 4.325 0.185 19 0 "[ . 1 . 2]" 1
297 1 210 GLN H 1 212 ARG H . . 3.950 3.576 2.828 4.074 0.124 11 0 "[ . 1 . 2]" 1
298 1 211 GLU H 1 212 ARG H . . 3.100 2.652 2.017 3.285 0.185 4 0 "[ . 1 . 2]" 1
299 1 52 SER H 1 53 ALA H . . 2.700 2.496 1.919 2.834 0.134 17 0 "[ . 1 . 2]" 1
300 1 175 THR H 1 176 TYR H . . 3.360 2.710 2.571 2.857 . 0 0 "[ . 1 . 2]" 1
301 1 116 HIS H 1 118 THR H . . 5.500 5.333 4.681 5.736 0.236 14 0 "[ . 1 . 2]" 1
302 1 115 LEU H 1 116 HIS H . . 3.360 2.199 1.804 2.494 . 0 0 "[ . 1 . 2]" 1
303 1 67 ALA H 1 68 VAL H . . 3.200 2.992 2.481 3.394 0.194 18 0 "[ . 1 . 2]" 1
304 1 115 LEU H 1 117 ILE H . . 4.850 4.577 4.046 5.000 0.150 8 0 "[ . 1 . 2]" 1
305 1 116 HIS H 1 117 ILE H . . 3.620 2.953 2.695 3.438 . 0 0 "[ . 1 . 2]" 1
306 1 140 TRP H 1 141 GLY H . . 3.100 2.913 2.806 3.018 . 0 0 "[ . 1 . 2]" 1
307 1 141 GLY H 1 143 ILE H . . 3.900 3.997 3.883 4.106 0.206 11 0 "[ . 1 . 2]" 1
308 1 44 THR H 1 45 GLU H . . 3.160 2.577 1.979 3.111 . 0 0 "[ . 1 . 2]" 1
309 1 43 GLY H 1 44 THR H . . 3.590 3.261 2.154 3.636 0.046 18 0 "[ . 1 . 2]" 1
310 1 8 ASN H 1 9 ARG H . . 3.290 2.662 2.501 2.774 . 0 0 "[ . 1 . 2]" 1
311 1 122 ALA H 1 124 GLN H . . 4.940 4.181 3.632 4.878 . 0 0 "[ . 1 . 2]" 1
312 1 21 SER H 1 23 LYS H . . 4.610 4.546 4.182 4.818 0.207 1 0 "[ . 1 . 2]" 1
313 1 21 SER H 1 22 GLN H . . 3.390 2.812 2.683 2.903 . 0 0 "[ . 1 . 2]" 1
314 1 36 ASN H 1 37 ARG H . . 3.000 2.713 2.197 3.198 0.198 12 0 "[ . 1 . 2]" 1
315 1 179 ASP H 1 180 HIS H . . 3.160 3.081 2.445 3.197 0.037 16 0 "[ . 1 . 2]" 1
316 1 177 LEU H 1 179 ASP H . . 4.020 4.008 3.907 4.247 0.227 6 0 "[ . 1 . 2]" 1
317 1 179 ASP H 1 181 LEU H . . 3.790 3.810 3.604 4.142 0.352 15 0 "[ . 1 . 2]" 1
318 1 108 PHE H 1 109 SER H . . 3.100 2.375 2.059 2.862 . 0 0 "[ . 1 . 2]" 1
319 1 107 ALA H 1 108 PHE H . . 2.800 2.764 2.241 2.960 0.160 14 0 "[ . 1 . 2]" 1
320 1 20 LEU H 1 22 GLN H . . 3.990 4.060 3.774 4.339 0.349 6 0 "[ . 1 . 2]" 1
321 1 22 GLN H 1 25 TYR H . . 4.800 5.028 4.735 5.315 0.515 10 1 "[ . + . 2]" 1
322 1 22 GLN H 1 23 LYS H . . 3.100 2.803 2.592 2.912 . 0 0 "[ . 1 . 2]" 1
323 1 11 LEU H 1 12 VAL H . . 2.870 2.696 2.542 2.825 . 0 0 "[ . 1 . 2]" 1
324 1 112 THR H 1 114 GLN H . . 3.820 3.893 3.747 4.081 0.261 9 0 "[ . 1 . 2]" 1
325 1 114 GLN H 1 115 LEU H . . 3.100 2.443 2.194 2.765 . 0 0 "[ . 1 . 2]" 1
326 1 114 GLN H 1 116 HIS H . . 5.180 3.686 3.190 4.197 . 0 0 "[ . 1 . 2]" 1
327 1 154 CYS HG 1 156 GLU H . . 4.750 5.626 5.303 6.050 1.300 9 20 [*-******+***********] 1
328 1 122 ALA H 1 172 TRP HE1 . . 5.500 5.357 4.808 5.657 0.157 5 0 "[ . 1 . 2]" 1
329 1 152 ALA H 1 154 CYS HG . . 5.500 4.824 4.550 5.045 . 0 0 "[ . 1 . 2]" 1
330 1 140 TRP HE1 1 188 ASN H . . 7.000 6.459 5.216 7.156 0.156 1 0 "[ . 1 . 2]" 1
331 1 60 TRP HE1 1 61 HIS H . . 6.000 5.701 3.937 6.170 0.170 9 0 "[ . 1 . 2]" 1
332 1 154 CYS HG 1 155 VAL H . . 5.180 3.072 2.699 3.597 . 0 0 "[ . 1 . 2]" 1
333 1 153 LEU H 1 154 CYS HG . . 5.000 4.824 4.520 5.017 0.017 1 0 "[ . 1 . 2]" 1
334 1 123 TYR H 1 172 TRP HE1 . . 4.200 3.634 2.725 4.385 0.185 7 0 "[ . 1 . 2]" 1
335 1 138 VAL H 1 140 TRP HE1 . . 7.300 7.372 6.429 7.675 0.375 19 0 "[ . 1 . 2]" 1
336 1 154 CYS HG 1 157 SER H . . 6.500 6.673 6.219 7.156 0.656 5 3 "[ + *1 . -]" 1
337 1 18 TYR H 1 154 CYS HG . . 7.500 7.420 7.043 7.843 0.343 19 0 "[ . 1 . 2]" 1
338 1 172 TRP H 1 172 TRP HE1 . . 6.500 5.728 5.174 6.587 0.087 15 0 "[ . 1 . 2]" 1
339 1 20 LEU H 1 27 TRP HE1 . . 6.000 5.990 5.407 6.575 0.575 16 1 "[ . 1 .+ 2]" 1
340 1 165 LEU MD1 1 169 ILE H . . 7.020 4.190 3.219 6.235 . 0 0 "[ . 1 . 2]" 1
341 1 169 ILE H 1 169 ILE MD . . 4.580 3.422 2.115 3.755 . 0 0 "[ . 1 . 2]" 1
342 1 165 LEU MD2 1 169 ILE H . . 7.020 4.920 3.434 5.701 . 0 0 "[ . 1 . 2]" 1
343 1 185 ILE H 1 185 ILE MD . . 5.830 3.369 2.391 3.550 . 0 0 "[ . 1 . 2]" 1
344 1 16 LEU MD2 1 17 SER H . . 7.020 4.297 3.930 4.533 . 0 0 "[ . 1 . 2]" 1
345 1 16 LEU MD1 1 17 SER H . . 7.020 4.379 4.125 4.655 . 0 0 "[ . 1 . 2]" 1
346 1 84 ILE H 1 84 ILE MD . . 4.380 3.574 2.013 4.841 0.461 2 0 "[ . 1 . 2]" 1
347 1 33 VAL MG2 1 36 ASN H . . 6.520 4.730 2.126 6.650 0.130 12 0 "[ . 1 . 2]" 1
348 1 33 VAL MG1 1 36 ASN H . . 6.520 5.272 2.481 6.633 0.113 5 0 "[ . 1 . 2]" 1
349 1 130 VAL MG2 1 131 ASN H . . 5.730 3.887 2.238 4.142 . 0 0 "[ . 1 . 2]" 1
350 1 130 VAL MG1 1 131 ASN H . . 5.730 3.248 2.148 4.110 . 0 0 "[ . 1 . 2]" 1
351 1 92 ALA H 1 195 VAL MG1 . . 5.270 4.751 2.778 5.552 0.282 19 0 "[ . 1 . 2]" 1
352 1 92 ALA H 1 195 VAL MG2 . . 5.500 4.967 3.950 5.540 0.040 18 0 "[ . 1 . 2]" 1
353 1 185 ILE MD 1 191 TRP H . . 6.490 5.490 3.870 6.562 0.072 2 0 "[ . 1 . 2]" 1
354 1 96 ALA H 1 144 VAL MG2 . . 6.890 5.774 4.922 6.605 . 0 0 "[ . 1 . 2]" 1
355 1 96 ALA H 1 144 VAL MG1 . . 6.890 4.473 2.830 5.730 . 0 0 "[ . 1 . 2]" 1
356 1 20 LEU MD2 1 156 GLU H . . 6.330 6.020 4.759 6.516 0.186 15 0 "[ . 1 . 2]" 1
357 1 153 LEU MD1 1 156 GLU H . . 7.020 4.489 4.004 6.279 . 0 0 "[ . 1 . 2]" 1
358 1 153 LEU MD2 1 156 GLU H . . 7.020 6.205 4.585 6.576 . 0 0 "[ . 1 . 2]" 1
359 1 20 LEU MD1 1 156 GLU H . . 6.330 6.220 4.952 6.488 0.158 11 0 "[ . 1 . 2]" 1
360 1 156 GLU H 1 169 ILE MD . . 6.860 6.171 5.821 6.769 . 0 0 "[ . 1 . 2]" 1
361 1 180 HIS H 1 181 LEU MD2 . . 7.020 4.405 3.234 5.846 . 0 0 "[ . 1 . 2]" 1
362 1 180 HIS H 1 181 LEU MD1 . . 7.020 5.429 4.261 6.595 . 0 0 "[ . 1 . 2]" 1
363 1 164 VAL H 1 164 VAL MG2 . . 4.250 3.806 3.736 3.837 . 0 0 "[ . 1 . 2]" 1
364 1 164 VAL H 1 164 VAL MG1 . . 4.250 2.085 1.917 2.325 . 0 0 "[ . 1 . 2]" 1
365 1 16 LEU MD2 1 172 TRP H . . 7.020 6.555 5.617 7.084 0.064 8 0 "[ . 1 . 2]" 1
366 1 16 LEU MD1 1 172 TRP H . . 7.020 6.218 5.319 7.176 0.156 10 0 "[ . 1 . 2]" 1
367 1 49 GLU H 1 54 ILE MD . . 4.310 4.218 3.508 4.565 0.255 18 0 "[ . 1 . 2]" 1
368 1 197 LEU MD2 1 198 TYR H . . 5.110 3.922 3.673 4.351 . 0 0 "[ . 1 . 2]" 1
369 1 197 LEU MD1 1 198 TYR H . . 5.110 3.331 2.343 4.655 . 0 0 "[ . 1 . 2]" 1
370 1 143 ILE MD 1 144 VAL H . . 5.960 4.758 4.481 4.991 . 0 0 "[ . 1 . 2]" 1
371 1 16 LEU MD2 1 150 GLY H . . 7.020 6.062 4.970 7.099 0.079 20 0 "[ . 1 . 2]" 1
372 1 16 LEU MD1 1 150 GLY H . . 7.020 6.222 5.400 7.162 0.142 14 0 "[ . 1 . 2]" 1
373 1 133 LEU MD2 1 134 PHE H . . 6.000 4.147 2.936 4.980 . 0 0 "[ . 1 . 2]" 1
374 1 133 LEU MD1 1 134 PHE H . . 6.000 4.729 3.313 5.314 . 0 0 "[ . 1 . 2]" 1
375 1 144 VAL MG2 1 145 ALA H . . 5.370 3.822 2.231 4.079 . 0 0 "[ . 1 . 2]" 1
376 1 144 VAL MG1 1 145 ALA H . . 5.370 3.481 3.082 3.984 . 0 0 "[ . 1 . 2]" 1
377 1 152 ALA H 1 153 LEU MD1 . . 6.100 6.185 5.491 6.475 0.375 12 0 "[ . 1 . 2]" 1
378 1 152 ALA H 1 153 LEU MD2 . . 5.800 5.088 4.726 5.726 . 0 0 "[ . 1 . 2]" 1
379 1 192 ASP H 1 195 VAL MG1 . . 7.020 6.305 4.932 6.927 . 0 0 "[ . 1 . 2]" 1
380 1 192 ASP H 1 195 VAL MG2 . . 7.020 4.606 4.191 4.971 . 0 0 "[ . 1 . 2]" 1
381 1 158 VAL MG1 1 160 LYS H . . 7.020 4.689 4.147 5.305 . 0 0 "[ . 1 . 2]" 1
382 1 158 VAL MG2 1 160 LYS H . . 7.020 4.941 4.043 5.400 . 0 0 "[ . 1 . 2]" 1
383 1 196 GLU H 1 197 LEU MD2 . . 4.580 4.186 3.710 4.707 0.127 19 0 "[ . 1 . 2]" 1
384 1 196 GLU H 1 197 LEU MD1 . . 5.300 5.111 3.845 5.493 0.193 15 0 "[ . 1 . 2]" 1
385 1 19 LYS H 1 20 LEU MD2 . . 5.900 5.233 3.396 6.458 0.558 10 1 "[ . + . 2]" 1
386 1 19 LYS H 1 20 LEU MD1 . . 5.900 4.747 3.428 6.024 0.124 10 0 "[ . 1 . 2]" 1
387 1 54 ILE H 1 54 ILE MD . . 4.580 3.938 3.194 4.483 . 0 0 "[ . 1 . 2]" 1
388 1 184 TRP H 1 185 ILE MD . . 5.270 5.165 4.417 5.377 0.107 15 0 "[ . 1 . 2]" 1
389 1 102 LEU MD2 1 103 ARG H . . 7.020 4.206 3.036 4.913 . 0 0 "[ . 1 . 2]" 1
390 1 102 LEU MD1 1 103 ARG H . . 7.020 4.247 3.142 4.960 . 0 0 "[ . 1 . 2]" 1
391 1 20 LEU MD2 1 155 VAL H . . 7.020 4.675 3.615 5.349 . 0 0 "[ . 1 . 2]" 1
392 1 153 LEU MD1 1 155 VAL H . . 7.020 4.780 4.393 6.478 . 0 0 "[ . 1 . 2]" 1
393 1 153 LEU MD2 1 155 VAL H . . 7.020 5.880 5.347 6.041 . 0 0 "[ . 1 . 2]" 1
394 1 20 LEU MD1 1 155 VAL H . . 7.020 4.693 3.596 5.442 . 0 0 "[ . 1 . 2]" 1
395 1 155 VAL H 1 169 ILE MD . . 6.130 5.222 4.671 5.858 . 0 0 "[ . 1 . 2]" 1
396 1 197 LEU MD2 1 199 GLY H . . 5.600 5.627 5.207 6.016 0.416 19 0 "[ . 1 . 2]" 1
397 1 197 LEU MD1 1 199 GLY H . . 5.200 4.849 3.985 5.319 0.119 10 0 "[ . 1 . 2]" 1
398 1 194 PHE H 1 195 VAL MG1 . . 6.000 5.681 4.296 6.166 0.166 12 0 "[ . 1 . 2]" 1
399 1 194 PHE H 1 195 VAL MG2 . . 5.170 4.236 3.867 4.432 . 0 0 "[ . 1 . 2]" 1
400 1 115 LEU MD2 1 128 GLN H . . 7.020 5.717 4.064 6.886 . 0 0 "[ . 1 . 2]" 1
401 1 128 GLN H 1 129 VAL MG2 . . 6.490 4.295 3.621 5.972 . 0 0 "[ . 1 . 2]" 1
402 1 115 LEU MD1 1 128 GLN H . . 7.020 5.775 4.879 6.987 . 0 0 "[ . 1 . 2]" 1
403 1 128 GLN H 1 129 VAL MG1 . . 6.490 5.296 3.754 5.944 . 0 0 "[ . 1 . 2]" 1
404 1 166 VAL MG2 1 168 ARG H . . 7.020 5.112 4.932 5.295 . 0 0 "[ . 1 . 2]" 1
405 1 166 VAL MG1 1 168 ARG H . . 7.020 4.712 4.072 5.146 . 0 0 "[ . 1 . 2]" 1
406 1 168 ARG H 1 169 ILE MD . . 7.020 5.100 3.718 5.474 . 0 0 "[ . 1 . 2]" 1
407 1 163 GLN H 1 164 VAL MG2 . . 5.700 5.497 4.998 6.201 0.501 9 1 "[ . +1 . 2]" 1
408 1 163 GLN H 1 164 VAL MG1 . . 5.700 3.771 3.326 4.252 . 0 0 "[ . 1 . 2]" 1
409 1 129 VAL MG2 1 130 VAL H . . 6.090 3.593 2.082 3.940 . 0 0 "[ . 1 . 2]" 1
410 1 129 VAL MG1 1 130 VAL H . . 6.090 3.333 2.133 4.008 . 0 0 "[ . 1 . 2]" 1
411 1 97 GLY H 1 144 VAL MG2 . . 6.760 6.380 5.555 6.838 0.078 19 0 "[ . 1 . 2]" 1
412 1 97 GLY H 1 144 VAL MG1 . . 6.760 4.692 3.242 6.722 . 0 0 "[ . 1 . 2]" 1
413 1 164 VAL MG2 1 165 LEU H . . 5.370 3.885 3.595 4.020 . 0 0 "[ . 1 . 2]" 1
414 1 164 VAL MG1 1 165 LEU H . . 5.370 2.360 2.034 2.627 . 0 0 "[ . 1 . 2]" 1
415 1 20 LEU H 1 20 LEU MD2 . . 5.010 3.323 1.695 4.337 . 0 0 "[ . 1 . 2]" 1
416 1 20 LEU H 1 155 VAL MG2 . . 7.020 3.560 2.685 5.256 . 0 0 "[ . 1 . 2]" 1
417 1 20 LEU H 1 155 VAL MG1 . . 7.020 5.041 2.728 6.700 . 0 0 "[ . 1 . 2]" 1
418 1 20 LEU H 1 20 LEU MD1 . . 5.010 2.969 1.845 4.049 . 0 0 "[ . 1 . 2]" 1
419 1 32 ASP H 1 33 VAL MG2 . . 5.140 4.470 3.720 5.519 0.379 13 0 "[ . 1 . 2]" 1
420 1 32 ASP H 1 33 VAL MG1 . . 5.140 4.382 3.277 5.302 0.162 12 0 "[ . 1 . 2]" 1
421 1 15 PHE H 1 93 LEU MD1 . . 6.490 5.165 2.895 6.297 . 0 0 "[ . 1 . 2]" 1
422 1 15 PHE H 1 16 LEU MD2 . . 7.020 5.619 4.087 6.689 . 0 0 "[ . 1 . 2]" 1
423 1 15 PHE H 1 16 LEU MD1 . . 7.020 5.643 4.763 6.450 . 0 0 "[ . 1 . 2]" 1
424 1 15 PHE H 1 93 LEU MD2 . . 6.490 4.927 2.953 6.557 0.067 15 0 "[ . 1 . 2]" 1
425 1 197 LEU MD1 1 200 ASN H . . 5.470 5.268 4.720 5.845 0.375 16 0 "[ . 1 . 2]" 1
426 1 16 LEU MD2 1 171 ALA H . . 7.020 5.903 4.656 6.733 . 0 0 "[ . 1 . 2]" 1
427 1 16 LEU MD1 1 171 ALA H . . 7.020 5.578 4.864 6.401 . 0 0 "[ . 1 . 2]" 1
428 1 111 LEU H 1 111 LEU MD2 . . 5.340 4.033 3.307 4.306 . 0 0 "[ . 1 . 2]" 1
429 1 111 LEU H 1 111 LEU MD1 . . 5.340 4.175 3.499 4.386 . 0 0 "[ . 1 . 2]" 1
430 1 197 LEU H 1 197 LEU MD2 . . 5.010 2.652 1.966 3.214 . 0 0 "[ . 1 . 2]" 1
431 1 197 LEU H 1 197 LEU MD1 . . 5.010 3.353 2.170 3.760 . 0 0 "[ . 1 . 2]" 1
432 1 25 TYR H 1 155 VAL MG2 . . 5.770 5.819 5.170 6.191 0.421 8 0 "[ . 1 . 2]" 1
433 1 25 TYR H 1 155 VAL MG1 . . 5.770 5.209 4.544 5.762 . 0 0 "[ . 1 . 2]" 1
434 1 93 LEU MD1 1 94 ARG H . . 7.020 4.544 3.909 5.082 . 0 0 "[ . 1 . 2]" 1
435 1 93 LEU MD2 1 94 ARG H . . 7.020 4.643 3.855 5.134 . 0 0 "[ . 1 . 2]" 1
436 1 140 TRP HE1 1 143 ILE MD . . 6.330 6.322 6.086 6.477 0.147 3 0 "[ . 1 . 2]" 1
437 1 10 GLU H 1 13 VAL MG1 . . 7.020 5.124 4.908 5.290 . 0 0 "[ . 1 . 2]" 1
438 1 10 GLU H 1 13 VAL MG2 . . 7.020 3.962 3.861 4.096 . 0 0 "[ . 1 . 2]" 1
439 1 154 CYS H 1 169 ILE MD . . 6.620 3.329 2.783 3.910 . 0 0 "[ . 1 . 2]" 1
440 1 138 VAL MG2 1 139 ASN H . . 5.040 4.049 3.282 4.473 . 0 0 "[ . 1 . 2]" 1
441 1 138 VAL MG1 1 139 ASN H . . 5.040 4.065 3.476 4.364 . 0 0 "[ . 1 . 2]" 1
442 1 33 VAL H 1 33 VAL MG2 . . 3.790 2.746 2.038 3.954 0.164 13 0 "[ . 1 . 2]" 1
443 1 33 VAL H 1 33 VAL MG1 . . 3.790 2.861 1.941 3.885 0.095 12 0 "[ . 1 . 2]" 1
444 1 153 LEU MD1 1 157 SER H . . 7.020 3.508 2.961 5.822 . 0 0 "[ . 1 . 2]" 1
445 1 153 LEU MD2 1 157 SER H . . 7.020 5.833 4.658 6.341 . 0 0 "[ . 1 . 2]" 1
446 1 157 SER H 1 169 ILE MD . . 5.700 5.584 5.224 5.832 0.132 19 0 "[ . 1 . 2]" 1
447 1 185 ILE MD 1 191 TRP HE1 . . 4.600 3.921 2.134 4.689 0.089 10 0 "[ . 1 . 2]" 1
448 1 16 LEU MD2 1 18 TYR H . . 6.690 5.681 5.316 6.168 . 0 0 "[ . 1 . 2]" 1
449 1 16 LEU MD1 1 18 TYR H . . 6.690 5.914 5.409 6.398 . 0 0 "[ . 1 . 2]" 1
450 1 195 VAL H 1 195 VAL MG1 . . 4.110 3.428 2.162 3.836 . 0 0 "[ . 1 . 2]" 1
451 1 195 VAL H 1 195 VAL MG2 . . 4.110 2.225 1.874 2.392 . 0 0 "[ . 1 . 2]" 1
452 1 33 VAL MG2 1 34 GLU H . . 4.150 3.083 2.123 4.360 0.210 16 0 "[ . 1 . 2]" 1
453 1 33 VAL MG1 1 34 GLU H . . 4.150 3.699 2.052 4.387 0.237 1 0 "[ . 1 . 2]" 1
454 1 48 MET H 1 54 ILE MD . . 5.870 5.450 3.659 5.974 0.104 9 0 "[ . 1 . 2]" 1
455 1 82 GLU H 1 83 VAL MG2 . . 6.060 3.800 2.742 5.654 . 0 0 "[ . 1 . 2]" 1
456 1 82 GLU H 1 83 VAL MG1 . . 6.060 4.097 2.712 6.403 0.343 14 0 "[ . 1 . 2]" 1
457 1 181 LEU H 1 185 ILE MD . . 6.130 5.313 4.627 5.846 . 0 0 "[ . 1 . 2]" 1
458 1 111 LEU MD2 1 115 LEU H . . 6.660 3.871 2.966 5.648 . 0 0 "[ . 1 . 2]" 1
459 1 111 LEU MD1 1 115 LEU H . . 6.660 4.667 3.717 5.632 . 0 0 "[ . 1 . 2]" 1
460 1 115 LEU H 1 117 ILE MD . . 6.490 4.822 3.498 5.912 . 0 0 "[ . 1 . 2]" 1
461 1 182 GLU H 1 185 ILE MD . . 6.130 4.740 4.382 5.176 . 0 0 "[ . 1 . 2]" 1
462 1 181 LEU MD2 1 182 GLU H . . 7.020 4.754 4.478 5.647 . 0 0 "[ . 1 . 2]" 1
463 1 181 LEU MD1 1 182 GLU H . . 7.020 4.639 4.349 5.276 . 0 0 "[ . 1 . 2]" 1
464 1 169 ILE MD 1 170 ALA H . . 5.470 4.495 4.144 4.744 . 0 0 "[ . 1 . 2]" 1
465 1 166 VAL MG2 1 167 SER H . . 6.330 3.637 3.418 3.810 . 0 0 "[ . 1 . 2]" 1
466 1 166 VAL MG1 1 167 SER H . . 6.330 2.951 1.945 3.665 . 0 0 "[ . 1 . 2]" 1
467 1 12 VAL MG2 1 174 ALA H . . 5.600 3.935 3.063 5.089 . 0 0 "[ . 1 . 2]" 1
468 1 12 VAL MG1 1 174 ALA H . . 5.600 3.973 3.416 5.152 . 0 0 "[ . 1 . 2]" 1
469 1 193 THR H 1 195 VAL MG1 . . 7.020 6.371 5.239 6.856 . 0 0 "[ . 1 . 2]" 1
470 1 193 THR H 1 195 VAL MG2 . . 7.020 4.933 4.112 5.359 . 0 0 "[ . 1 . 2]" 1
471 1 142 ARG H 1 144 VAL MG2 . . 7.020 5.049 3.718 5.488 . 0 0 "[ . 1 . 2]" 1
472 1 142 ARG H 1 144 VAL MG1 . . 7.020 6.446 4.926 6.711 . 0 0 "[ . 1 . 2]" 1
473 1 185 ILE MD 1 186 GLN H . . 5.500 4.517 4.365 4.658 . 0 0 "[ . 1 . 2]" 1
474 1 129 VAL MG2 1 132 GLU H . . 7.020 5.356 4.813 5.691 . 0 0 "[ . 1 . 2]" 1
475 1 132 GLU H 1 133 LEU MD2 . . 6.520 5.968 4.571 6.395 . 0 0 "[ . 1 . 2]" 1
476 1 132 GLU H 1 133 LEU MD1 . . 6.520 6.155 4.480 6.498 . 0 0 "[ . 1 . 2]" 1
477 1 129 VAL MG1 1 132 GLU H . . 7.020 5.071 4.561 5.345 . 0 0 "[ . 1 . 2]" 1
478 1 143 ILE H 1 143 ILE MD . . 5.270 4.186 3.440 4.432 . 0 0 "[ . 1 . 2]" 1
479 1 117 ILE H 1 153 LEU MD1 . . 5.670 5.326 4.763 5.752 0.082 8 0 "[ . 1 . 2]" 1
480 1 117 ILE H 1 153 LEU MD2 . . 5.670 4.931 4.577 5.404 . 0 0 "[ . 1 . 2]" 1
481 1 117 ILE H 1 117 ILE MD . . 4.740 2.594 1.787 3.543 . 0 0 "[ . 1 . 2]" 1
482 1 141 GLY H 1 143 ILE MD . . 6.430 6.460 4.867 6.712 0.282 15 0 "[ . 1 . 2]" 1
483 1 81 ARG H 1 83 VAL MG2 . . 5.770 4.882 2.834 5.858 0.088 14 0 "[ . 1 . 2]" 1
484 1 81 ARG H 1 83 VAL MG1 . . 5.770 4.938 3.204 5.951 0.181 14 0 "[ . 1 . 2]" 1
485 1 177 LEU MD1 1 179 ASP H . . 7.020 6.016 5.647 6.572 . 0 0 "[ . 1 . 2]" 1
486 1 177 LEU MD2 1 179 ASP H . . 7.020 5.854 5.027 6.518 . 0 0 "[ . 1 . 2]" 1
487 1 111 LEU MD2 1 114 GLN H . . 6.390 4.652 3.752 6.162 . 0 0 "[ . 1 . 2]" 1
488 1 114 GLN H 1 115 LEU MD2 . . 6.490 4.944 3.696 6.528 0.038 5 0 "[ . 1 . 2]" 1
489 1 111 LEU MD1 1 114 GLN H . . 6.390 5.441 4.437 6.268 . 0 0 "[ . 1 . 2]" 1
490 1 114 GLN H 1 115 LEU MD1 . . 6.490 5.500 3.619 6.641 0.151 18 0 "[ . 1 . 2]" 1
491 1 9 ARG H 1 11 LEU QD . . 6.140 5.561 4.642 6.011 . 0 0 "[ . 1 . 2]" 1
492 1 10 GLU H 1 13 VAL QG . . 5.510 3.835 3.746 3.929 . 0 0 "[ . 1 . 2]" 1
493 1 11 LEU H 1 12 VAL QG . . 5.150 3.643 3.561 3.799 . 0 0 "[ . 1 . 2]" 1
494 1 11 LEU QD 1 13 VAL H . . 5.730 4.453 4.224 4.912 . 0 0 "[ . 1 . 2]" 1
495 1 11 LEU QD 1 14 ASP H . . 6.710 4.367 3.842 4.960 . 0 0 "[ . 1 . 2]" 1
496 1 11 LEU QD 1 191 TRP HE1 . . 4.640 2.754 1.831 4.599 . 0 0 "[ . 1 . 2]" 1
497 1 12 VAL H 1 12 VAL QG . . 3.990 2.041 1.938 2.146 . 0 0 "[ . 1 . 2]" 1
498 1 12 VAL H 1 13 VAL QG . . 5.190 3.598 3.480 3.663 . 0 0 "[ . 1 . 2]" 1
499 1 12 VAL QG 1 13 VAL H . . 4.900 1.994 1.778 2.075 . 0 0 "[ . 1 . 2]" 1
500 1 12 VAL QG 1 14 ASP H . . 5.630 3.972 3.872 4.089 . 0 0 "[ . 1 . 2]" 1
501 1 12 VAL QG 1 16 LEU H . . 6.270 4.202 3.817 4.347 . 0 0 "[ . 1 . 2]" 1
502 1 12 VAL QG 1 170 ALA H . . 6.900 6.050 5.647 6.606 . 0 0 "[ . 1 . 2]" 1
503 1 12 VAL QG 1 173 MET H . . 5.790 4.576 4.182 5.241 . 0 0 "[ . 1 . 2]" 1
504 1 12 VAL QG 1 174 ALA H . . 4.860 3.504 2.978 4.456 . 0 0 "[ . 1 . 2]" 1
505 1 13 VAL H 1 13 VAL QG . . 3.700 1.824 1.778 1.863 . 0 0 "[ . 1 . 2]" 1
506 1 13 VAL H 1 89 VAL QG . . 6.000 6.099 5.961 6.204 0.204 19 0 "[ . 1 . 2]" 1
507 1 13 VAL QG 1 14 ASP H . . 4.930 2.261 2.113 2.378 . 0 0 "[ . 1 . 2]" 1
508 1 13 VAL QG 1 15 PHE H . . 4.250 4.357 4.209 4.529 0.279 16 0 "[ . 1 . 2]" 1
509 1 14 ASP H 1 89 VAL QG . . 5.730 5.067 4.487 5.955 0.225 19 0 "[ . 1 . 2]" 1
510 1 14 ASP H 1 93 LEU QD . . 6.900 5.791 4.357 6.734 . 0 0 "[ . 1 . 2]" 1
511 1 16 LEU H 1 16 LEU QD . . 4.430 2.996 2.382 3.719 . 0 0 "[ . 1 . 2]" 1
512 1 16 LEU H 1 166 VAL QG . . 6.580 6.495 5.971 6.787 0.207 17 0 "[ . 1 . 2]" 1
513 1 16 LEU QD 1 17 SER H . . 5.830 3.853 3.672 3.965 . 0 0 "[ . 1 . 2]" 1
514 1 16 LEU QD 1 18 TYR H . . 5.420 5.142 4.830 5.423 0.003 20 0 "[ . 1 . 2]" 1
515 1 16 LEU QD 1 150 GLY H . . 5.850 5.399 4.647 5.943 0.093 5 0 "[ . 1 . 2]" 1
516 1 16 LEU QD 1 151 GLY H . . 4.700 4.139 3.416 4.673 . 0 0 "[ . 1 . 2]" 1
517 1 16 LEU QD 1 170 ALA H . . 4.660 3.311 2.913 3.596 . 0 0 "[ . 1 . 2]" 1
518 1 16 LEU QD 1 171 ALA H . . 5.740 5.025 4.533 5.456 . 0 0 "[ . 1 . 2]" 1
519 1 16 LEU QD 1 172 TRP H . . 5.910 5.627 5.076 6.055 0.145 8 0 "[ . 1 . 2]" 1
520 1 17 SER H 1 166 VAL QG . . 6.020 5.360 4.639 6.070 0.050 12 0 "[ . 1 . 2]" 1
521 1 18 TYR H 1 20 LEU QD . . 6.390 4.627 4.006 6.011 . 0 0 "[ . 1 . 2]" 1
522 1 20 LEU H 1 155 VAL QG . . 5.520 3.383 2.635 4.472 . 0 0 "[ . 1 . 2]" 1
523 1 20 LEU QD 1 21 SER H . . 6.460 3.611 2.803 4.130 . 0 0 "[ . 1 . 2]" 1
524 1 20 LEU QD 1 25 TYR H . . 6.900 4.169 2.582 5.553 . 0 0 "[ . 1 . 2]" 1
525 1 20 LEU QD 1 26 SER H . . 6.000 3.949 2.390 5.024 . 0 0 "[ . 1 . 2]" 1
526 1 20 LEU QD 1 27 TRP HE1 . . 4.770 2.705 2.060 3.356 . 0 0 "[ . 1 . 2]" 1
527 1 20 LEU QD 1 154 CYS H . . 6.900 5.010 4.381 5.474 . 0 0 "[ . 1 . 2]" 1
528 1 20 LEU QD 1 157 SER H . . 6.900 5.837 4.957 6.447 . 0 0 "[ . 1 . 2]" 1
529 1 20 LEU QD 1 158 VAL H . . 6.710 4.430 3.675 5.073 . 0 0 "[ . 1 . 2]" 1
530 1 23 LYS H 1 155 VAL QG . . 5.980 3.912 2.793 4.877 . 0 0 "[ . 1 . 2]" 1
531 1 25 TYR H 1 155 VAL QG . . 5.050 4.843 4.302 5.181 0.131 12 0 "[ . 1 . 2]" 1
532 1 25 TYR H 1 158 VAL QG . . 5.980 4.883 3.616 5.955 . 0 0 "[ . 1 . 2]" 1
533 1 62 LEU QD 1 64 ASP H . . 6.900 5.348 3.057 6.749 . 0 0 "[ . 1 . 2]" 1
534 1 68 VAL QG 1 69 ASN H . . 6.900 3.063 2.277 3.787 . 0 0 "[ . 1 . 2]" 1
535 1 75 SER H 1 78 LEU QD . . 6.330 5.515 3.959 6.366 0.036 17 0 "[ . 1 . 2]" 1
536 1 77 SER H 1 78 LEU QD . . 6.490 4.477 3.049 5.304 . 0 0 "[ . 1 . 2]" 1
537 1 78 LEU QD 1 79 ASP H . . 5.410 2.754 2.048 3.946 . 0 0 "[ . 1 . 2]" 1
538 1 78 LEU QD 1 80 ALA H . . 5.090 3.763 2.106 4.915 . 0 0 "[ . 1 . 2]" 1
539 1 78 LEU QD 1 81 ARG H . . 5.600 5.444 4.529 5.782 0.182 17 0 "[ . 1 . 2]" 1
540 1 82 GLU H 1 83 VAL QG . . 5.180 3.372 2.573 5.300 0.120 14 0 "[ . 1 . 2]" 1
541 1 92 ALA H 1 93 LEU QD . . 6.170 4.022 3.360 5.239 . 0 0 "[ . 1 . 2]" 1
542 1 93 LEU QD 1 94 ARG H . . 5.650 4.026 3.691 4.335 . 0 0 "[ . 1 . 2]" 1
543 1 93 LEU QD 1 191 TRP HE1 . . 5.760 5.375 3.777 5.910 0.150 19 0 "[ . 1 . 2]" 1
544 1 96 ALA H 1 144 VAL QG . . 5.810 4.282 2.814 4.858 . 0 0 "[ . 1 . 2]" 1
545 1 97 GLY H 1 144 VAL QG . . 5.570 4.532 3.221 5.485 . 0 0 "[ . 1 . 2]" 1
546 1 99 GLU H 1 102 LEU QD . . 5.410 4.810 4.110 5.464 0.054 4 0 "[ . 1 . 2]" 1
547 1 101 GLU H 1 102 LEU QD . . 6.170 4.369 3.878 5.684 . 0 0 "[ . 1 . 2]" 1
548 1 102 LEU QD 1 104 TYR H . . 5.000 4.961 4.509 5.223 0.223 16 0 "[ . 1 . 2]" 1
549 1 102 LEU QD 1 105 ARG H . . 6.460 5.113 4.452 5.943 . 0 0 "[ . 1 . 2]" 1
550 1 108 PHE H 1 111 LEU QD . . 6.000 6.014 5.747 6.147 0.147 18 0 "[ . 1 . 2]" 1
551 1 111 LEU H 1 111 LEU QD . . 4.680 3.644 3.023 3.761 . 0 0 "[ . 1 . 2]" 1
552 1 111 LEU QD 1 112 THR H . . 6.170 3.198 2.453 3.684 . 0 0 "[ . 1 . 2]" 1
553 1 111 LEU QD 1 114 GLN H . . 5.630 4.349 3.562 4.908 . 0 0 "[ . 1 . 2]" 1
554 1 111 LEU QD 1 115 LEU H . . 5.700 3.602 2.882 4.725 . 0 0 "[ . 1 . 2]" 1
555 1 111 LEU QD 1 148 SER H . . 6.300 6.286 5.732 6.581 0.281 11 0 "[ . 1 . 2]" 1
556 1 111 LEU QD 1 149 PHE H . . 5.830 4.555 4.308 5.068 . 0 0 "[ . 1 . 2]" 1
557 1 111 LEU QD 1 150 GLY H . . 6.240 4.043 3.313 4.567 . 0 0 "[ . 1 . 2]" 1
558 1 111 LEU QD 1 151 GLY H . . 6.240 4.720 2.978 5.434 . 0 0 "[ . 1 . 2]" 1
559 1 111 LEU QD 1 152 ALA H . . 6.900 4.549 3.505 5.145 . 0 0 "[ . 1 . 2]" 1
560 1 111 LEU QD 1 153 LEU H . . 5.850 3.382 2.526 3.955 . 0 0 "[ . 1 . 2]" 1
561 1 114 GLN H 1 115 LEU QD . . 5.640 4.279 3.589 5.232 . 0 0 "[ . 1 . 2]" 1
562 1 115 LEU QD 1 117 ILE H . . 5.920 3.632 1.986 4.964 . 0 0 "[ . 1 . 2]" 1
563 1 115 LEU QD 1 127 GLU H . . 6.460 6.219 5.396 6.642 0.182 10 0 "[ . 1 . 2]" 1
564 1 115 LEU QD 1 128 GLN H . . 6.000 5.056 4.000 5.800 . 0 0 "[ . 1 . 2]" 1
565 1 115 LEU QD 1 129 VAL H . . 6.460 3.617 3.145 4.094 . 0 0 "[ . 1 . 2]" 1
566 1 115 LEU QD 1 130 VAL H . . 5.310 5.177 4.760 5.367 0.057 10 0 "[ . 1 . 2]" 1
567 1 115 LEU QD 1 132 GLU H . . 5.660 5.641 5.247 5.940 0.280 15 0 "[ . 1 . 2]" 1
568 1 117 ILE H 1 153 LEU QD . . 4.600 4.527 4.213 4.768 0.168 13 0 "[ . 1 . 2]" 1
569 1 118 THR H 1 153 LEU QD . . 6.900 5.965 5.022 6.820 . 0 0 "[ . 1 . 2]" 1
570 1 129 VAL H 1 130 VAL QG . . 6.100 4.263 3.619 4.526 . 0 0 "[ . 1 . 2]" 1
571 1 130 VAL QG 1 132 GLU H . . 6.680 4.500 4.138 4.720 . 0 0 "[ . 1 . 2]" 1
572 1 132 GLU H 1 133 LEU QD . . 5.730 5.344 4.341 5.654 . 0 0 "[ . 1 . 2]" 1
573 1 133 LEU QD 1 134 PHE H . . 5.110 3.786 2.913 4.371 . 0 0 "[ . 1 . 2]" 1
574 1 133 LEU QD 1 145 ALA H . . 6.240 5.344 4.772 5.808 . 0 0 "[ . 1 . 2]" 1
575 1 133 LEU QD 1 146 PHE H . . 4.280 3.870 3.386 4.387 0.107 15 0 "[ . 1 . 2]" 1
576 1 133 LEU QD 1 149 PHE H . . 6.020 6.080 5.765 6.225 0.205 11 0 "[ . 1 . 2]" 1
577 1 133 LEU QD 1 150 GLY H . . 6.170 5.790 5.254 6.162 . 0 0 "[ . 1 . 2]" 1
578 1 137 GLY H 1 138 VAL QG . . 5.980 4.945 4.183 5.239 . 0 0 "[ . 1 . 2]" 1
579 1 138 VAL H 1 138 VAL QG . . 3.810 2.771 2.438 3.082 . 0 0 "[ . 1 . 2]" 1
580 1 138 VAL H 1 181 LEU QD . . 5.660 5.367 4.507 5.699 0.039 11 0 "[ . 1 . 2]" 1
581 1 138 VAL QG 1 139 ASN H . . 3.650 3.546 3.187 3.726 0.076 15 0 "[ . 1 . 2]" 1
582 1 138 VAL QG 1 140 TRP H . . 6.900 4.230 3.470 5.185 . 0 0 "[ . 1 . 2]" 1
583 1 138 VAL QG 1 140 TRP HE1 . . 6.900 4.110 3.674 5.757 . 0 0 "[ . 1 . 2]" 1
584 1 138 VAL QG 1 141 GLY H . . 6.900 5.872 5.474 6.711 . 0 0 "[ . 1 . 2]" 1
585 1 138 VAL QG 1 142 ARG H . . 5.880 5.781 5.473 6.141 0.261 18 0 "[ . 1 . 2]" 1
586 1 138 VAL QG 1 143 ILE H . . 6.550 4.590 4.211 5.041 . 0 0 "[ . 1 . 2]" 1
587 1 139 ASN H 1 181 LEU QD . . 5.920 5.738 5.234 5.967 0.047 20 0 "[ . 1 . 2]" 1
588 1 142 ARG H 1 144 VAL QG . . 6.060 4.875 3.614 5.242 . 0 0 "[ . 1 . 2]" 1
589 1 143 ILE H 1 144 VAL QG . . 5.570 4.202 3.672 4.434 . 0 0 "[ . 1 . 2]" 1
590 1 144 VAL H 1 144 VAL QG . . 4.030 2.151 1.866 2.389 . 0 0 "[ . 1 . 2]" 1
591 1 144 VAL QG 1 145 ALA H . . 4.490 3.182 2.219 3.376 . 0 0 "[ . 1 . 2]" 1
592 1 144 VAL QG 1 146 PHE H . . 5.210 4.639 4.158 4.741 . 0 0 "[ . 1 . 2]" 1
593 1 144 VAL QG 1 147 PHE H . . 6.900 4.463 4.201 4.668 . 0 0 "[ . 1 . 2]" 1
594 1 144 VAL QG 1 148 SER H . . 6.640 4.618 3.882 5.368 . 0 0 "[ . 1 . 2]" 1
595 1 152 ALA H 1 153 LEU QD . . 5.090 4.860 4.468 5.365 0.275 12 0 "[ . 1 . 2]" 1
596 1 153 LEU H 1 153 LEU QD . . 5.230 3.322 2.840 3.675 . 0 0 "[ . 1 . 2]" 1
597 1 153 LEU QD 1 155 VAL H . . 5.970 4.548 4.270 5.108 . 0 0 "[ . 1 . 2]" 1
598 1 153 LEU QD 1 169 ILE H . . 5.400 5.336 4.719 5.499 0.099 18 0 "[ . 1 . 2]" 1
599 1 154 CYS H 1 155 VAL QG . . 6.300 3.931 3.456 4.182 . 0 0 "[ . 1 . 2]" 1
600 1 154 CYS H 1 158 VAL QG . . 6.900 5.540 5.086 5.953 . 0 0 "[ . 1 . 2]" 1
601 1 154 CYS H 1 166 VAL QG . . 6.520 4.840 4.140 5.719 . 0 0 "[ . 1 . 2]" 1
602 1 155 VAL QG 1 156 GLU H . . 4.020 3.272 2.149 3.475 . 0 0 "[ . 1 . 2]" 1
603 1 155 VAL QG 1 157 SER H . . 6.900 4.800 4.146 5.008 . 0 0 "[ . 1 . 2]" 1
604 1 157 SER H 1 158 VAL QG . . 5.880 4.007 3.631 4.375 . 0 0 "[ . 1 . 2]" 1
605 1 158 VAL H 1 158 VAL QG . . 4.180 2.156 1.821 2.517 . 0 0 "[ . 1 . 2]" 1
606 1 158 VAL QG 1 160 LYS H . . 5.650 4.202 3.897 4.647 . 0 0 "[ . 1 . 2]" 1
607 1 158 VAL QG 1 164 VAL H . . 6.520 4.516 3.736 5.463 . 0 0 "[ . 1 . 2]" 1
608 1 164 VAL H 1 166 VAL QG . . 6.050 4.233 3.820 5.058 . 0 0 "[ . 1 . 2]" 1
609 1 164 VAL QG 1 165 LEU H . . 4.250 2.340 2.023 2.593 . 0 0 "[ . 1 . 2]" 1
610 1 164 VAL QG 1 166 VAL H . . 5.510 4.203 3.921 4.469 . 0 0 "[ . 1 . 2]" 1
611 1 164 VAL QG 1 167 SER H . . 6.020 4.853 4.437 5.141 . 0 0 "[ . 1 . 2]" 1
612 1 164 VAL QG 1 168 ARG H . . 6.020 4.407 3.602 4.753 . 0 0 "[ . 1 . 2]" 1
613 1 165 LEU H 1 166 VAL QG . . 5.790 3.505 3.044 4.059 . 0 0 "[ . 1 . 2]" 1
614 1 165 LEU QD 1 169 ILE H . . 5.800 3.501 3.194 4.648 . 0 0 "[ . 1 . 2]" 1
615 1 166 VAL QG 1 167 SER H . . 5.380 2.752 1.934 3.238 . 0 0 "[ . 1 . 2]" 1
616 1 166 VAL QG 1 168 ARG H . . 6.110 4.325 3.889 4.615 . 0 0 "[ . 1 . 2]" 1
617 1 166 VAL QG 1 169 ILE H . . 5.090 4.553 4.207 4.855 . 0 0 "[ . 1 . 2]" 1
618 1 173 MET H 1 177 LEU QD . . 5.700 5.318 5.032 6.002 0.302 6 0 "[ . 1 . 2]" 1
619 1 175 THR H 1 177 LEU QD . . 5.150 5.187 4.815 5.429 0.279 6 0 "[ . 1 . 2]" 1
620 1 177 LEU H 1 177 LEU QD . . 4.120 2.720 2.182 3.705 . 0 0 "[ . 1 . 2]" 1
621 1 177 LEU H 1 181 LEU QD . . 6.050 4.839 3.950 5.374 . 0 0 "[ . 1 . 2]" 1
622 1 177 LEU QD 1 178 ASN H . . 4.700 4.002 3.252 4.185 . 0 0 "[ . 1 . 2]" 1
623 1 177 LEU QD 1 181 LEU H . . 6.070 4.834 4.241 5.222 . 0 0 "[ . 1 . 2]" 1
624 1 177 LEU QD 1 182 GLU H . . 5.400 4.972 4.475 5.334 . 0 0 "[ . 1 . 2]" 1
625 1 177 LEU QD 1 191 TRP HE1 . . 6.000 4.759 3.069 5.936 . 0 0 "[ . 1 . 2]" 1
626 1 178 ASN H 1 181 LEU QD . . 6.460 5.638 5.209 5.884 . 0 0 "[ . 1 . 2]" 1
627 1 181 LEU QD 1 182 GLU H . . 6.030 4.160 4.016 4.434 . 0 0 "[ . 1 . 2]" 1
628 1 181 LEU QD 1 184 TRP H . . 5.690 4.100 3.561 4.893 . 0 0 "[ . 1 . 2]" 1
629 1 181 LEU QD 1 184 TRP HE1 . . 4.930 4.653 3.574 4.927 . 0 0 "[ . 1 . 2]" 1
630 1 181 LEU QD 1 185 ILE H . . 6.240 3.330 2.820 4.440 . 0 0 "[ . 1 . 2]" 1
631 1 191 TRP H 1 195 VAL QG . . 6.900 5.487 5.039 5.737 . 0 0 "[ . 1 . 2]" 1
632 1 192 ASP H 1 195 VAL QG . . 5.610 4.482 4.055 4.851 . 0 0 "[ . 1 . 2]" 1
633 1 193 THR H 1 195 VAL QG . . 5.610 4.771 4.021 5.158 . 0 0 "[ . 1 . 2]" 1
634 1 194 PHE H 1 195 VAL QG . . 4.430 4.099 3.659 4.338 . 0 0 "[ . 1 . 2]" 1
635 1 195 VAL QG 1 196 GLU H . . 4.700 3.135 2.249 3.463 . 0 0 "[ . 1 . 2]" 1
636 1 195 VAL QG 1 197 LEU H . . 6.140 4.733 4.248 5.061 . 0 0 "[ . 1 . 2]" 1
637 1 195 VAL QG 1 198 TYR H . . 6.390 4.523 4.266 4.818 . 0 0 "[ . 1 . 2]" 1
638 1 196 GLU H 1 197 LEU QD . . 3.790 3.950 3.609 4.206 0.416 14 0 "[ . 1 . 2]" 1
639 1 20 LEU MD2 1 166 VAL MG2 . . 4.240 2.494 1.802 3.983 . 0 0 "[ . 1 . 2]" 1
640 1 20 LEU MD1 1 166 VAL MG2 . . 4.240 2.427 1.844 3.149 . 0 0 "[ . 1 . 2]" 1
641 1 153 LEU MD1 1 165 LEU MD1 . . 2.620 2.150 1.810 2.758 0.138 15 0 "[ . 1 . 2]" 1
642 1 117 ILE MD 1 153 LEU MD1 . . 5.000 1.998 1.844 2.345 . 0 0 "[ . 1 . 2]" 1
643 1 153 LEU MD1 1 165 LEU MD2 . . 3.500 2.937 2.430 3.367 . 0 0 "[ . 1 . 2]" 1
644 1 111 LEU MD2 1 115 LEU MD2 . . 3.600 3.103 1.918 3.949 0.349 13 0 "[ . 1 . 2]" 1
645 1 177 LEU MD1 1 185 ILE MD . . 3.400 3.113 2.510 3.630 0.230 17 0 "[ . 1 . 2]" 1
646 1 12 VAL MG2 1 13 VAL MG1 . . 3.370 3.421 3.304 3.555 0.185 13 0 "[ . 1 . 2]" 1
647 1 158 VAL MG1 1 166 VAL MG2 . . 4.200 3.208 1.780 4.308 0.108 2 0 "[ . 1 . 2]" 1
648 1 158 VAL MG1 1 166 VAL MG1 . . 4.400 3.880 1.850 4.628 0.228 15 0 "[ . 1 . 2]" 1
649 1 115 LEU MD2 1 129 VAL MG2 . . 3.960 2.379 1.830 3.928 . 0 0 "[ . 1 . 2]" 1
650 1 111 LEU MD1 1 115 LEU MD2 . . 3.430 3.316 2.490 3.624 0.194 12 0 "[ . 1 . 2]" 1
651 1 115 LEU MD2 1 129 VAL MG1 . . 3.960 3.174 1.936 3.984 0.024 8 0 "[ . 1 . 2]" 1
652 1 12 VAL MG2 1 177 LEU MD1 . . 3.000 2.673 2.002 3.136 0.136 4 0 "[ . 1 . 2]" 1
653 1 12 VAL MG2 1 177 LEU MD2 . . 3.000 2.795 2.185 3.169 0.169 7 0 "[ . 1 . 2]" 1
654 1 164 VAL MG2 1 165 LEU MD2 . . 4.400 3.825 2.851 4.322 . 0 0 "[ . 1 . 2]" 1
655 1 164 VAL MG2 1 165 LEU MD1 . . 4.800 4.861 4.686 4.941 0.141 10 0 "[ . 1 . 2]" 1
656 1 164 VAL MG1 1 165 LEU MD1 . . 4.200 3.996 2.986 4.374 0.174 16 0 "[ . 1 . 2]" 1
657 1 165 LEU MD1 1 169 ILE MD . . 3.930 2.272 1.837 3.420 . 0 0 "[ . 1 . 2]" 1
658 1 153 LEU MD2 1 165 LEU MD1 . . 3.400 2.891 2.108 3.684 0.284 19 0 "[ . 1 . 2]" 1
659 1 177 LEU MD2 1 185 ILE MD . . 4.000 3.395 2.571 4.070 0.070 3 0 "[ . 1 . 2]" 1
660 1 111 LEU MD1 1 117 ILE MD . . 3.570 3.135 1.963 3.775 0.205 16 0 "[ . 1 . 2]" 1
661 1 143 ILE MD 1 185 ILE MD . . 3.210 2.561 1.878 3.189 . 0 0 "[ . 1 . 2]" 1
662 1 20 LEU MD2 1 166 VAL MG1 . . 4.240 2.683 1.902 4.134 . 0 0 "[ . 1 . 2]" 1
663 1 158 VAL MG2 1 166 VAL MG1 . . 4.200 3.334 1.903 4.476 0.276 13 0 "[ . 1 . 2]" 1
664 1 111 LEU MD2 1 117 ILE MD . . 3.570 2.776 1.915 3.876 0.306 7 0 "[ . 1 . 2]" 1
665 1 117 ILE MD 1 165 LEU MD1 . . 3.470 2.914 2.076 3.444 . 0 0 "[ . 1 . 2]" 1
666 1 117 ILE MD 1 153 LEU MD2 . . 5.000 2.039 1.775 2.580 . 0 0 "[ . 1 . 2]" 1
667 1 117 ILE MD 1 165 LEU MD2 . . 3.470 3.299 2.116 3.698 0.228 3 0 "[ . 1 . 2]" 1
668 1 111 LEU MD2 1 115 LEU MD1 . . 2.930 2.861 2.018 3.288 0.358 7 0 "[ . 1 . 2]" 1
669 1 115 LEU MD1 1 129 VAL MG2 . . 3.960 2.425 1.795 4.196 0.236 17 0 "[ . 1 . 2]" 1
670 1 111 LEU MD1 1 115 LEU MD1 . . 3.430 3.151 2.034 3.819 0.389 9 0 "[ . 1 . 2]" 1
671 1 115 LEU MD1 1 129 VAL MG1 . . 3.960 3.047 1.907 4.105 0.145 14 0 "[ . 1 . 2]" 1
672 1 93 LEU MD1 1 144 VAL MG1 . . 4.590 3.982 2.578 4.664 0.074 15 0 "[ . 1 . 2]" 1
673 1 20 LEU MD1 1 166 VAL MG1 . . 4.240 2.615 1.856 4.168 . 0 0 "[ . 1 . 2]" 1
674 1 158 VAL MG2 1 166 VAL MG2 . . 4.200 2.653 1.805 4.483 0.283 10 0 "[ . 1 . 2]" 1
675 1 153 LEU MD1 1 169 ILE MD . . 3.590 2.463 1.843 3.026 . 0 0 "[ . 1 . 2]" 1
676 1 153 LEU MD2 1 169 ILE MD . . 3.590 2.188 1.906 3.569 . 0 0 "[ . 1 . 2]" 1
677 1 117 ILE MD 1 169 ILE MD . . 4.000 3.846 3.261 4.163 0.163 3 0 "[ . 1 . 2]" 1
678 1 165 LEU MD2 1 169 ILE MD . . 3.930 3.444 1.940 4.119 0.189 13 0 "[ . 1 . 2]" 1
679 1 12 VAL MG2 1 13 VAL MG2 . . 4.400 4.564 4.484 4.644 0.244 19 0 "[ . 1 . 2]" 1
680 1 12 VAL MG1 1 13 VAL MG2 . . 3.370 2.966 2.775 3.212 . 0 0 "[ . 1 . 2]" 1
681 1 93 LEU MD2 1 144 VAL MG2 . . 4.590 4.073 2.427 4.721 0.131 3 0 "[ . 1 . 2]" 1
682 1 93 LEU MD2 1 144 VAL MG1 . . 4.590 4.129 2.572 4.687 0.097 5 0 "[ . 1 . 2]" 1
683 1 12 VAL MG1 1 177 LEU MD1 . . 2.800 2.798 2.311 3.090 0.290 15 0 "[ . 1 . 2]" 1
684 1 12 VAL MG1 1 177 LEU MD2 . . 3.400 2.575 1.895 3.547 0.147 4 0 "[ . 1 . 2]" 1
685 1 153 LEU MD2 1 165 LEU MD2 . . 4.000 4.041 3.409 4.375 0.375 10 0 "[ . 1 . 2]" 1
686 1 164 VAL MG1 1 165 LEU MD2 . . 3.640 2.936 2.130 3.755 0.115 7 0 "[ . 1 . 2]" 1
687 1 11 LEU QD 1 89 VAL QG . . 2.630 1.856 1.708 2.095 . 0 0 "[ . 1 . 2]" 1
688 1 11 LEU QD 1 93 LEU QD . . 2.500 2.152 1.660 2.630 0.130 5 0 "[ . 1 . 2]" 1
689 1 11 LEU QD 1 177 LEU QD . . 3.110 3.176 2.555 3.321 0.211 11 0 "[ . 1 . 2]" 1
690 1 12 VAL QG 1 13 VAL QG . . 2.460 2.073 1.997 2.116 . 0 0 "[ . 1 . 2]" 1
691 1 12 VAL MG1 1 13 VAL MG1 . . 3.370 2.143 2.037 2.212 . 0 0 "[ . 1 . 2]" 1
692 1 12 VAL QG 1 16 LEU QD . . 2.520 2.481 2.046 2.692 0.172 2 0 "[ . 1 . 2]" 1
693 1 16 LEU QD 1 20 LEU QD . . 3.000 3.012 2.775 3.258 0.258 10 0 "[ . 1 . 2]" 1
694 1 20 LEU QD 1 155 VAL QG . . 2.890 2.587 1.959 3.123 0.233 15 0 "[ . 1 . 2]" 1
695 1 20 LEU QD 1 158 VAL QG . . 3.310 2.000 1.767 2.453 . 0 0 "[ . 1 . 2]" 1
696 1 20 LEU QD 1 166 VAL QG . . 3.090 1.763 1.607 2.104 . 0 0 "[ . 1 . 2]" 1
697 1 89 VAL QG 1 93 LEU QD . . 3.120 2.511 1.789 3.255 0.135 12 0 "[ . 1 . 2]" 1
698 1 89 VAL QG 1 195 VAL QG . . 6.000 4.150 3.104 5.768 . 0 0 "[ . 1 . 2]" 1
699 1 93 LEU QD 1 144 VAL QG . . 3.400 3.038 1.856 3.462 0.062 5 0 "[ . 1 . 2]" 1
700 1 93 LEU MD1 1 144 VAL MG2 . . 4.590 3.952 1.910 4.653 0.063 17 0 "[ . 1 . 2]" 1
701 1 111 LEU QD 1 115 LEU QD . . 3.500 2.213 1.841 2.752 . 0 0 "[ . 1 . 2]" 1
702 1 111 LEU QD 1 117 ILE MD . . 3.120 2.260 1.908 3.103 . 0 0 "[ . 1 . 2]" 1
703 1 111 LEU QD 1 153 LEU QD . . 2.000 1.927 1.727 2.180 0.180 6 0 "[ . 1 . 2]" 1
704 1 115 LEU QD 1 117 ILE MD . . 2.300 2.281 1.894 2.591 0.291 1 0 "[ . 1 . 2]" 1
705 1 115 LEU QD 1 129 VAL QG . . 4.000 1.866 1.614 2.925 . 0 0 "[ . 1 . 2]" 1
706 1 115 LEU QD 1 153 LEU QD . . 5.000 2.170 1.819 2.928 . 0 0 "[ . 1 . 2]" 1
707 1 117 ILE MD 1 165 LEU QD . . 2.990 2.688 1.976 3.093 0.103 10 0 "[ . 1 . 2]" 1
708 1 130 VAL QG 1 133 LEU QD . . 3.230 3.143 2.575 3.356 0.126 20 0 "[ . 1 . 2]" 1
709 1 130 VAL QG 1 177 LEU QD . . 4.000 4.035 3.918 4.130 0.130 20 0 "[ . 1 . 2]" 1
710 1 130 VAL QG 1 181 LEU QD . . 3.640 3.498 2.989 3.780 0.140 18 0 "[ . 1 . 2]" 1
711 1 133 LEU QD 1 138 VAL QG . . 3.550 3.330 1.821 3.647 0.097 8 0 "[ . 1 . 2]" 1
712 1 133 LEU QD 1 143 ILE MD . . 3.190 2.699 1.903 3.254 0.064 18 0 "[ . 1 . 2]" 1
713 1 133 LEU QD 1 177 LEU QD . . 3.170 3.135 2.793 3.311 0.141 17 0 "[ . 1 . 2]" 1
714 1 133 LEU QD 1 181 LEU QD . . 3.180 2.561 1.866 3.387 0.207 17 0 "[ . 1 . 2]" 1
715 1 133 LEU QD 1 185 ILE MD . . 4.200 4.059 3.405 4.328 0.128 15 0 "[ . 1 . 2]" 1
716 1 138 VAL QG 1 143 ILE MD . . 2.280 2.110 1.853 2.379 0.099 13 0 "[ . 1 . 2]" 1
717 1 138 VAL QG 1 181 LEU QD . . 3.000 2.456 1.617 3.039 0.039 16 0 "[ . 1 . 2]" 1
718 1 138 VAL QG 1 185 ILE MD . . 3.240 3.219 2.718 3.417 0.177 19 0 "[ . 1 . 2]" 1
719 1 143 ILE MD 1 177 LEU QD . . 4.000 3.707 2.727 4.133 0.133 18 0 "[ . 1 . 2]" 1
720 1 143 ILE MD 1 181 LEU QD . . 3.000 2.957 2.527 3.151 0.151 11 0 "[ . 1 . 2]" 1
721 1 153 LEU QD 1 165 LEU QD . . 3.000 1.966 1.769 2.248 . 0 0 "[ . 1 . 2]" 1
722 1 155 VAL QG 1 158 VAL QG . . 4.050 3.247 2.812 4.138 0.088 18 0 "[ . 1 . 2]" 1
723 1 158 VAL QG 1 165 LEU QD . . 5.000 5.101 4.493 5.284 0.284 14 0 "[ . 1 . 2]" 1
724 1 158 VAL QG 1 166 VAL QG . . 2.280 1.948 1.759 2.338 0.058 20 0 "[ . 1 . 2]" 1
725 1 164 VAL QG 1 165 LEU QD . . 3.200 2.681 2.100 3.057 . 0 0 "[ . 1 . 2]" 1
726 1 165 LEU QD 1 166 VAL QG . . 4.500 4.324 3.768 4.618 0.118 1 0 "[ . 1 . 2]" 1
727 1 165 LEU QD 1 169 ILE MD . . 3.270 2.014 1.834 2.775 . 0 0 "[ . 1 . 2]" 1
728 1 166 VAL QG 1 169 ILE MD . . 4.130 4.013 3.546 4.239 0.109 15 0 "[ . 1 . 2]" 1
729 1 177 LEU QD 1 181 LEU QD . . 3.200 2.799 1.758 3.376 0.176 10 0 "[ . 1 . 2]" 1
730 1 177 LEU QD 1 185 ILE MD . . 2.960 2.725 2.487 2.983 0.023 10 0 "[ . 1 . 2]" 1
731 1 181 LEU QD 1 185 ILE MD . . 3.320 2.024 1.832 2.530 . 0 0 "[ . 1 . 2]" 1
732 1 106 ARG H 1 108 PHE H . . 4.500 4.539 4.042 4.769 0.269 13 0 "[ . 1 . 2]" 1
733 1 107 ALA H 1 109 SER H . . 4.500 4.347 3.910 4.792 0.292 12 0 "[ . 1 . 2]" 1
734 1 110 ASP H 1 112 THR H . . 4.500 4.654 4.206 4.847 0.347 10 0 "[ . 1 . 2]" 1
735 1 20 LEU QD 1 27 TRP H . . 6.000 3.439 2.499 4.616 . 0 0 "[ . 1 . 2]" 1
736 1 27 TRP HE1 1 170 ALA H . . 6.000 5.958 5.381 6.258 0.258 16 0 "[ . 1 . 2]" 1
737 1 111 LEU QD 1 156 GLU H . . 6.500 5.945 5.534 6.320 . 0 0 "[ . 1 . 2]" 1
738 1 111 LEU QD 1 157 SER H . . 6.000 6.032 5.912 6.266 0.266 7 0 "[ . 1 . 2]" 1
739 1 140 TRP HE1 1 197 LEU QD . . 4.000 4.065 3.937 4.126 0.126 4 0 "[ . 1 . 2]" 1
740 1 195 VAL H 1 198 TYR H . . 4.800 4.717 4.609 4.860 0.060 11 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 140
_Distance_constraint_stats_list.Viol_count 340
_Distance_constraint_stats_list.Viol_total 822.819
_Distance_constraint_stats_list.Viol_max 0.583
_Distance_constraint_stats_list.Viol_rms 0.0564
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0147
_Distance_constraint_stats_list.Viol_average_violations_only 0.1210
_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 6 GLN 0.535 0.420 18 0 "[ . 1 . 2]"
1 7 SER 0.013 0.013 13 0 "[ . 1 . 2]"
1 8 ASN 0.883 0.199 19 0 "[ . 1 . 2]"
1 10 GLU 0.603 0.420 18 0 "[ . 1 . 2]"
1 11 LEU 0.013 0.013 13 0 "[ . 1 . 2]"
1 12 VAL 0.883 0.199 19 0 "[ . 1 . 2]"
1 14 ASP 0.068 0.037 13 0 "[ . 1 . 2]"
1 15 PHE 0.051 0.051 2 0 "[ . 1 . 2]"
1 16 LEU 0.447 0.086 19 0 "[ . 1 . 2]"
1 18 TYR 0.258 0.077 9 0 "[ . 1 . 2]"
1 19 LYS 0.051 0.051 2 0 "[ . 1 . 2]"
1 20 LEU 0.626 0.166 5 0 "[ . 1 . 2]"
1 22 GLN 0.258 0.077 9 0 "[ . 1 . 2]"
1 24 GLY 0.179 0.166 5 0 "[ . 1 . 2]"
1 26 SER 0.906 0.219 4 0 "[ . 1 . 2]"
1 27 TRP 1.389 0.355 4 0 "[ . 1 . 2]"
1 30 PHE 0.906 0.219 4 0 "[ . 1 . 2]"
1 31 SER 1.389 0.355 4 0 "[ . 1 . 2]"
1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 LYS 0.819 0.273 19 0 "[ . 1 . 2]"
1 91 GLN 0.096 0.061 10 0 "[ . 1 . 2]"
1 92 ALA 0.133 0.063 3 0 "[ . 1 . 2]"
1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 ARG 0.819 0.273 19 0 "[ . 1 . 2]"
1 95 GLU 0.164 0.061 10 0 "[ . 1 . 2]"
1 96 ALA 0.260 0.089 7 0 "[ . 1 . 2]"
1 97 GLY 0.050 0.050 13 0 "[ . 1 . 2]"
1 98 ASP 0.095 0.046 8 0 "[ . 1 . 2]"
1 99 GLU 0.218 0.134 14 0 "[ . 1 . 2]"
1 100 PHE 0.127 0.089 7 0 "[ . 1 . 2]"
1 101 GLU 0.050 0.050 13 0 "[ . 1 . 2]"
1 102 LEU 0.095 0.046 8 0 "[ . 1 . 2]"
1 103 ARG 0.150 0.134 14 0 "[ . 1 . 2]"
1 110 ASP 0.085 0.085 9 0 "[ . 1 . 2]"
1 111 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 112 THR 1.512 0.281 18 0 "[ . 1 . 2]"
1 114 GLN 0.085 0.085 9 0 "[ . 1 . 2]"
1 115 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 HIS 1.512 0.281 18 0 "[ . 1 . 2]"
1 120 GLY 2.896 0.437 11 0 "[ . 1 . 2]"
1 121 THR 8.160 0.583 11 4 "[ *. 1+ . - *]"
1 122 ALA 0.099 0.099 17 0 "[ . 1 . 2]"
1 123 TYR 0.333 0.137 5 0 "[ . 1 . 2]"
1 124 GLN 2.896 0.437 11 0 "[ . 1 . 2]"
1 125 SER 8.588 0.583 11 4 "[ *. 1+ . - *]"
1 126 PHE 0.099 0.099 17 0 "[ . 1 . 2]"
1 127 GLU 0.333 0.137 5 0 "[ . 1 . 2]"
1 128 GLN 0.097 0.042 8 0 "[ . 1 . 2]"
1 129 VAL 0.927 0.112 15 0 "[ . 1 . 2]"
1 130 VAL 0.411 0.221 17 0 "[ . 1 . 2]"
1 131 ASN 0.968 0.307 17 0 "[ . 1 . 2]"
1 132 GLU 0.097 0.042 8 0 "[ . 1 . 2]"
1 133 LEU 0.499 0.112 15 0 "[ . 1 . 2]"
1 134 PHE 0.411 0.221 17 0 "[ . 1 . 2]"
1 135 ARG 0.968 0.307 17 0 "[ . 1 . 2]"
1 139 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 TRP 1.480 0.179 4 0 "[ . 1 . 2]"
1 141 GLY 0.438 0.295 11 0 "[ . 1 . 2]"
1 143 ILE 0.041 0.041 15 0 "[ . 1 . 2]"
1 144 VAL 1.480 0.179 4 0 "[ . 1 . 2]"
1 145 ALA 0.438 0.295 11 0 "[ . 1 . 2]"
1 146 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 PHE 0.452 0.147 18 0 "[ . 1 . 2]"
1 149 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 150 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 GLY 0.411 0.147 18 0 "[ . 1 . 2]"
1 153 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 154 CYS 0.485 0.232 7 0 "[ . 1 . 2]"
1 156 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 SER 4.482 0.555 9 1 "[ . +1 . 2]"
1 158 VAL 0.485 0.232 7 0 "[ . 1 . 2]"
1 160 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 161 GLU 4.482 0.555 9 1 "[ . +1 . 2]"
1 164 VAL 0.048 0.035 18 0 "[ . 1 . 2]"
1 166 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 167 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 168 ARG 0.048 0.035 18 0 "[ . 1 . 2]"
1 169 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 170 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 171 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 TRP 0.162 0.091 7 0 "[ . 1 . 2]"
1 173 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 174 ALA 0.923 0.354 15 0 "[ . 1 . 2]"
1 175 THR 0.273 0.168 6 0 "[ . 1 . 2]"
1 176 TYR 2.798 0.207 19 0 "[ . 1 . 2]"
1 177 LEU 3.684 0.451 5 0 "[ . 1 . 2]"
1 178 ASN 0.923 0.354 15 0 "[ . 1 . 2]"
1 179 ASP 0.273 0.168 6 0 "[ . 1 . 2]"
1 180 HIS 2.636 0.207 19 0 "[ . 1 . 2]"
1 181 LEU 3.684 0.451 5 0 "[ . 1 . 2]"
1 182 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 183 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 184 TRP 0.237 0.121 19 0 "[ . 1 . 2]"
1 185 ILE 0.420 0.132 9 0 "[ . 1 . 2]"
1 186 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 187 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 188 ASN 0.237 0.121 19 0 "[ . 1 . 2]"
1 189 GLY 2.505 0.270 12 0 "[ . 1 . 2]"
1 190 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 191 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 192 ASP 0.330 0.118 9 0 "[ . 1 . 2]"
1 193 THR 2.205 0.270 12 0 "[ . 1 . 2]"
1 194 PHE 0.525 0.235 14 0 "[ . 1 . 2]"
1 195 VAL 0.606 0.383 14 0 "[ . 1 . 2]"
1 196 GLU 0.330 0.118 9 0 "[ . 1 . 2]"
1 197 LEU 0.121 0.061 20 0 "[ . 1 . 2]"
1 198 TYR 0.525 0.235 14 0 "[ . 1 . 2]"
1 199 GLY 0.606 0.383 14 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 6 GLN O 1 10 GLU H . . 3.000 2.569 2.018 3.420 0.420 18 0 "[ . 1 . 2]" 2
2 1 6 GLN O 1 10 GLU N . . 4.000 3.245 2.803 4.115 0.115 18 0 "[ . 1 . 2]" 2
3 1 7 SER O 1 11 LEU H . . 2.500 2.142 1.793 2.513 0.013 13 0 "[ . 1 . 2]" 2
4 1 7 SER O 1 11 LEU N . . 3.500 3.016 2.769 3.375 . 0 0 "[ . 1 . 2]" 2
5 1 8 ASN O 1 12 VAL H . . 2.300 2.198 2.036 2.419 0.119 19 0 "[ . 1 . 2]" 2
6 1 8 ASN O 1 12 VAL N . . 3.200 3.200 3.041 3.399 0.199 19 0 "[ . 1 . 2]" 2
7 1 10 GLU O 1 14 ASP H . . 2.300 2.162 1.976 2.330 0.030 13 0 "[ . 1 . 2]" 2
8 1 10 GLU O 1 14 ASP N . . 3.200 3.038 2.879 3.237 0.037 13 0 "[ . 1 . 2]" 2
9 1 11 LEU O 1 15 PHE H . . 2.500 2.133 1.778 2.406 . 0 0 "[ . 1 . 2]" 2
10 1 11 LEU O 1 15 PHE N . . 3.500 3.112 2.791 3.341 . 0 0 "[ . 1 . 2]" 2
11 1 12 VAL O 1 16 LEU H . . 2.500 2.309 1.855 2.471 . 0 0 "[ . 1 . 2]" 2
12 1 12 VAL O 1 16 LEU N . . 3.500 3.225 2.806 3.412 . 0 0 "[ . 1 . 2]" 2
13 1 15 PHE O 1 19 LYS H . . 2.300 2.064 1.833 2.351 0.051 2 0 "[ . 1 . 2]" 2
14 1 15 PHE O 1 19 LYS N . . 3.200 2.927 2.765 3.180 . 0 0 "[ . 1 . 2]" 2
15 1 16 LEU O 1 20 LEU H . . 2.500 2.435 2.055 2.586 0.086 19 0 "[ . 1 . 2]" 2
16 1 16 LEU O 1 20 LEU N . . 3.500 3.376 3.026 3.552 0.052 19 0 "[ . 1 . 2]" 2
17 1 18 TYR O 1 22 GLN H . . 2.500 2.367 1.856 2.577 0.077 9 0 "[ . 1 . 2]" 2
18 1 18 TYR O 1 22 GLN N . . 3.500 3.174 2.720 3.365 . 0 0 "[ . 1 . 2]" 2
19 1 20 LEU O 1 24 GLY H . . 2.500 2.157 1.799 2.666 0.166 5 0 "[ . 1 . 2]" 2
20 1 20 LEU O 1 24 GLY N . . 3.500 2.864 2.718 3.513 0.013 5 0 "[ . 1 . 2]" 2
21 1 26 SER O 1 30 PHE H . . 3.000 2.801 1.931 3.219 0.219 4 0 "[ . 1 . 2]" 2
22 1 26 SER O 1 30 PHE N . . 4.000 3.637 2.929 4.046 0.046 20 0 "[ . 1 . 2]" 2
23 1 27 TRP O 1 31 SER H . . 3.000 2.684 1.992 3.355 0.355 4 0 "[ . 1 . 2]" 2
24 1 27 TRP O 1 31 SER N . . 4.000 3.291 2.819 4.179 0.179 7 0 "[ . 1 . 2]" 2
25 1 88 ALA O 1 92 ALA H . . 2.500 2.260 2.025 2.439 . 0 0 "[ . 1 . 2]" 2
26 1 88 ALA O 1 92 ALA N . . 3.500 3.135 2.831 3.368 . 0 0 "[ . 1 . 2]" 2
27 1 90 LYS O 1 94 ARG H . . 2.500 2.318 1.902 2.773 0.273 19 0 "[ . 1 . 2]" 2
28 1 90 LYS O 1 94 ARG N . . 3.500 3.035 2.725 3.481 . 0 0 "[ . 1 . 2]" 2
29 1 91 GLN O 1 95 GLU H . . 2.300 2.178 1.862 2.330 0.030 10 0 "[ . 1 . 2]" 2
30 1 91 GLN O 1 95 GLU N . . 3.200 3.116 2.816 3.261 0.061 10 0 "[ . 1 . 2]" 2
31 1 92 ALA O 1 96 ALA H . . 2.300 2.173 1.897 2.291 . 0 0 "[ . 1 . 2]" 2
32 1 92 ALA O 1 96 ALA N . . 3.200 3.166 2.889 3.263 0.063 3 0 "[ . 1 . 2]" 2
33 1 93 LEU O 1 97 GLY H . . 2.300 2.050 1.923 2.250 . 0 0 "[ . 1 . 2]" 2
34 1 93 LEU O 1 97 GLY N . . 3.200 2.860 2.774 2.978 . 0 0 "[ . 1 . 2]" 2
35 1 94 ARG O 1 98 ASP H . . 2.300 2.093 1.939 2.272 . 0 0 "[ . 1 . 2]" 2
36 1 94 ARG O 1 98 ASP N . . 3.200 2.970 2.808 3.189 . 0 0 "[ . 1 . 2]" 2
37 1 95 GLU O 1 99 GLU H . . 2.500 2.370 2.255 2.541 0.041 5 0 "[ . 1 . 2]" 2
38 1 95 GLU O 1 99 GLU N . . 3.500 3.341 3.145 3.516 0.016 5 0 "[ . 1 . 2]" 2
39 1 96 ALA O 1 100 PHE H . . 2.500 2.401 2.084 2.589 0.089 7 0 "[ . 1 . 2]" 2
40 1 96 ALA O 1 100 PHE N . . 3.500 3.378 3.073 3.524 0.024 7 0 "[ . 1 . 2]" 2
41 1 97 GLY O 1 101 GLU H . . 2.300 1.994 1.782 2.350 0.050 13 0 "[ . 1 . 2]" 2
42 1 97 GLY O 1 101 GLU N . . 3.200 2.798 2.708 2.926 . 0 0 "[ . 1 . 2]" 2
43 1 98 ASP O 1 102 LEU H . . 2.300 2.093 1.897 2.249 . 0 0 "[ . 1 . 2]" 2
44 1 98 ASP O 1 102 LEU N . . 3.200 3.088 2.911 3.246 0.046 8 0 "[ . 1 . 2]" 2
45 1 99 GLU O 1 103 ARG H . . 2.500 2.336 1.877 2.634 0.134 14 0 "[ . 1 . 2]" 2
46 1 99 GLU O 1 103 ARG N . . 3.500 3.213 2.874 3.468 . 0 0 "[ . 1 . 2]" 2
47 1 110 ASP O 1 114 GLN H . . 2.500 2.167 1.798 2.585 0.085 9 0 "[ . 1 . 2]" 2
48 1 110 ASP O 1 114 GLN N . . 3.500 2.973 2.785 3.409 . 0 0 "[ . 1 . 2]" 2
49 1 111 LEU O 1 115 LEU H . . 2.500 2.013 1.803 2.447 . 0 0 "[ . 1 . 2]" 2
50 1 111 LEU O 1 115 LEU N . . 3.500 2.872 2.732 3.312 . 0 0 "[ . 1 . 2]" 2
51 1 112 THR O 1 116 HIS H . . 2.500 2.468 1.978 2.781 0.281 18 0 "[ . 1 . 2]" 2
52 1 112 THR O 1 116 HIS N . . 3.500 2.997 2.771 3.324 . 0 0 "[ . 1 . 2]" 2
53 1 120 GLY O 1 124 GLN H . . 3.500 3.597 2.995 3.937 0.437 11 0 "[ . 1 . 2]" 2
54 1 120 GLY O 1 124 GLN N . . 4.500 3.972 3.534 4.667 0.167 15 0 "[ . 1 . 2]" 2
55 1 121 THR O 1 125 SER H . . 3.500 3.432 1.744 4.083 0.583 11 4 "[ *. 1+ . - *]" 2
56 1 121 THR O 1 125 SER N . . 4.500 4.254 2.706 4.879 0.379 11 0 "[ . 1 . 2]" 2
57 1 122 ALA O 1 126 PHE H . . 3.000 2.307 1.944 3.099 0.099 17 0 "[ . 1 . 2]" 2
58 1 122 ALA O 1 126 PHE N . . 4.000 3.263 2.837 3.884 . 0 0 "[ . 1 . 2]" 2
59 1 123 TYR O 1 127 GLU H . . 2.300 1.969 1.732 2.415 0.115 5 0 "[ . 1 . 2]" 2
60 1 123 TYR O 1 127 GLU N . . 3.200 2.878 2.692 3.337 0.137 5 0 "[ . 1 . 2]" 2
61 1 125 SER O 1 129 VAL H . . 2.300 2.116 1.764 2.344 0.044 14 0 "[ . 1 . 2]" 2
62 1 125 SER O 1 129 VAL N . . 3.200 3.109 2.755 3.281 0.081 6 0 "[ . 1 . 2]" 2
63 1 127 GLU O 1 131 ASN H . . 2.300 1.960 1.800 2.169 . 0 0 "[ . 1 . 2]" 2
64 1 127 GLU O 1 131 ASN N . . 3.200 2.881 2.748 3.133 . 0 0 "[ . 1 . 2]" 2
65 1 128 GLN O 1 132 GLU H . . 2.300 2.106 1.852 2.304 0.004 8 0 "[ . 1 . 2]" 2
66 1 128 GLN O 1 132 GLU N . . 3.200 3.048 2.788 3.242 0.042 8 0 "[ . 1 . 2]" 2
67 1 129 VAL O 1 133 LEU H . . 2.500 2.485 2.358 2.612 0.112 15 0 "[ . 1 . 2]" 2
68 1 129 VAL O 1 133 LEU N . . 3.500 3.382 3.226 3.585 0.085 15 0 "[ . 1 . 2]" 2
69 1 130 VAL O 1 134 PHE H . . 2.500 2.049 1.804 2.721 0.221 17 0 "[ . 1 . 2]" 2
70 1 130 VAL O 1 134 PHE N . . 3.500 2.876 2.701 3.691 0.191 17 0 "[ . 1 . 2]" 2
71 1 131 ASN O 1 135 ARG H . . 2.300 2.300 2.082 2.607 0.307 17 0 "[ . 1 . 2]" 2
72 1 131 ASN O 1 135 ARG N . . 3.200 2.832 2.752 2.946 . 0 0 "[ . 1 . 2]" 2
73 1 139 ASN O 1 143 ILE H . . 2.500 1.800 1.762 1.876 . 0 0 "[ . 1 . 2]" 2
74 1 139 ASN O 1 143 ILE N . . 3.500 2.803 2.761 2.884 . 0 0 "[ . 1 . 2]" 2
75 1 140 TRP O 1 144 VAL H . . 3.000 3.039 2.884 3.179 0.179 4 0 "[ . 1 . 2]" 2
76 1 140 TRP O 1 144 VAL N . . 4.000 3.962 3.835 4.096 0.096 4 0 "[ . 1 . 2]" 2
77 1 141 GLY O 1 145 ALA H . . 2.500 2.330 2.019 2.795 0.295 11 0 "[ . 1 . 2]" 2
78 1 141 GLY O 1 145 ALA N . . 3.500 3.258 3.021 3.603 0.103 11 0 "[ . 1 . 2]" 2
79 1 143 ILE O 1 147 PHE H . . 2.500 2.167 1.798 2.541 0.041 15 0 "[ . 1 . 2]" 2
80 1 143 ILE O 1 147 PHE N . . 3.500 3.079 2.769 3.429 . 0 0 "[ . 1 . 2]" 2
81 1 145 ALA O 1 149 PHE H . . 2.500 2.198 1.800 2.495 . 0 0 "[ . 1 . 2]" 2
82 1 145 ALA O 1 149 PHE N . . 3.500 3.098 2.726 3.360 . 0 0 "[ . 1 . 2]" 2
83 1 146 PHE O 1 150 GLY H . . 2.500 1.999 1.771 2.286 . 0 0 "[ . 1 . 2]" 2
84 1 146 PHE O 1 150 GLY N . . 3.500 2.918 2.739 3.221 . 0 0 "[ . 1 . 2]" 2
85 1 147 PHE O 1 151 GLY H . . 2.300 2.179 1.981 2.447 0.147 18 0 "[ . 1 . 2]" 2
86 1 147 PHE O 1 151 GLY N . . 3.200 2.933 2.757 3.142 . 0 0 "[ . 1 . 2]" 2
87 1 153 LEU O 1 157 SER H . . 2.500 2.000 1.794 2.421 . 0 0 "[ . 1 . 2]" 2
88 1 153 LEU O 1 157 SER N . . 3.500 2.991 2.777 3.414 . 0 0 "[ . 1 . 2]" 2
89 1 154 CYS O 1 158 VAL H . . 2.300 2.181 1.894 2.532 0.232 7 0 "[ . 1 . 2]" 2
90 1 154 CYS O 1 158 VAL N . . 3.200 3.101 2.861 3.272 0.072 7 0 "[ . 1 . 2]" 2
91 1 156 GLU O 1 160 LYS H . . 3.000 2.409 1.924 2.822 . 0 0 "[ . 1 . 2]" 2
92 1 156 GLU O 1 160 LYS N . . 4.000 3.129 2.789 3.517 . 0 0 "[ . 1 . 2]" 2
93 1 157 SER O 1 161 GLU H . . 2.300 2.502 2.158 2.855 0.555 9 1 "[ . +1 . 2]" 2
94 1 157 SER O 1 161 GLU N . . 3.200 3.107 2.881 3.268 0.068 9 0 "[ . 1 . 2]" 2
95 1 164 VAL O 1 168 ARG H . . 3.000 2.735 1.770 3.035 0.035 18 0 "[ . 1 . 2]" 2
96 1 164 VAL O 1 168 ARG N . . 4.000 3.525 2.696 3.921 . 0 0 "[ . 1 . 2]" 2
97 1 166 VAL O 1 170 ALA H . . 2.300 1.940 1.734 2.222 . 0 0 "[ . 1 . 2]" 2
98 1 166 VAL O 1 170 ALA N . . 3.200 2.920 2.729 3.175 . 0 0 "[ . 1 . 2]" 2
99 1 167 SER O 1 171 ALA H . . 2.500 2.172 1.956 2.451 . 0 0 "[ . 1 . 2]" 2
100 1 167 SER O 1 171 ALA N . . 3.500 3.084 2.894 3.348 . 0 0 "[ . 1 . 2]" 2
101 1 168 ARG O 1 172 TRP H . . 2.300 1.895 1.801 2.131 . 0 0 "[ . 1 . 2]" 2
102 1 168 ARG O 1 172 TRP N . . 3.200 2.814 2.739 2.997 . 0 0 "[ . 1 . 2]" 2
103 1 169 ILE O 1 173 MET H . . 2.300 1.789 1.729 1.917 . 0 0 "[ . 1 . 2]" 2
104 1 169 ILE O 1 173 MET N . . 3.200 2.779 2.704 2.925 . 0 0 "[ . 1 . 2]" 2
105 1 172 TRP O 1 176 TYR H . . 2.300 2.036 1.804 2.296 . 0 0 "[ . 1 . 2]" 2
106 1 172 TRP O 1 176 TYR N . . 3.200 3.025 2.777 3.291 0.091 7 0 "[ . 1 . 2]" 2
107 1 173 MET O 1 177 LEU H . . 2.300 1.810 1.763 1.878 . 0 0 "[ . 1 . 2]" 2
108 1 173 MET O 1 177 LEU N . . 3.200 2.791 2.678 2.855 . 0 0 "[ . 1 . 2]" 2
109 1 174 ALA O 1 178 ASN H . . 2.500 2.438 2.196 2.854 0.354 15 0 "[ . 1 . 2]" 2
110 1 174 ALA O 1 178 ASN N . . 3.500 3.319 3.118 3.587 0.087 15 0 "[ . 1 . 2]" 2
111 1 175 THR O 1 179 ASP H . . 2.300 1.998 1.837 2.468 0.168 6 0 "[ . 1 . 2]" 2
112 1 175 THR O 1 179 ASP N . . 3.200 2.865 2.707 3.305 0.105 6 0 "[ . 1 . 2]" 2
113 1 176 TYR O 1 180 HIS H . . 2.500 2.545 1.762 2.707 0.207 19 0 "[ . 1 . 2]" 2
114 1 176 TYR O 1 180 HIS N . . 3.500 3.461 2.632 3.668 0.168 19 0 "[ . 1 . 2]" 2
115 1 177 LEU O 1 181 LEU H . . 2.500 2.650 2.042 2.951 0.451 5 0 "[ . 1 . 2]" 2
116 1 177 LEU O 1 181 LEU N . . 3.500 3.290 2.863 3.589 0.089 5 0 "[ . 1 . 2]" 2
117 1 180 HIS O 1 184 TRP H . . 4.000 3.114 2.748 3.873 . 0 0 "[ . 1 . 2]" 2
118 1 180 HIS O 1 184 TRP N . . 5.500 3.949 3.599 4.828 . 0 0 "[ . 1 . 2]" 2
119 1 182 GLU O 1 186 GLN H . . 4.000 2.170 1.892 2.404 . 0 0 "[ . 1 . 2]" 2
120 1 182 GLU O 1 186 GLN N . . 5.500 3.147 2.857 3.416 . 0 0 "[ . 1 . 2]" 2
121 1 183 PRO O 1 187 GLU H . . 3.000 2.084 1.840 2.446 . 0 0 "[ . 1 . 2]" 2
122 1 183 PRO O 1 187 GLU N . . 4.000 2.891 2.727 3.148 . 0 0 "[ . 1 . 2]" 2
123 1 184 TRP O 1 188 ASN H . . 2.500 2.117 1.807 2.616 0.116 19 0 "[ . 1 . 2]" 2
124 1 184 TRP O 1 188 ASN N . . 3.500 3.086 2.777 3.621 0.121 19 0 "[ . 1 . 2]" 2
125 1 185 ILE O 1 189 GLY H . . 3.000 2.802 2.311 3.132 0.132 9 0 "[ . 1 . 2]" 2
126 1 185 ILE O 1 189 GLY N . . 4.000 3.306 2.795 3.799 . 0 0 "[ . 1 . 2]" 2
127 1 189 GLY O 1 193 THR H . . 3.300 2.904 1.775 3.570 0.270 12 0 "[ . 1 . 2]" 2
128 1 189 GLY O 1 193 THR N . . 4.000 3.724 2.735 4.260 0.260 19 0 "[ . 1 . 2]" 2
129 1 190 GLY O 1 194 PHE H . . 2.300 1.898 1.759 2.196 . 0 0 "[ . 1 . 2]" 2
130 1 190 GLY O 1 194 PHE N . . 3.200 2.882 2.758 3.167 . 0 0 "[ . 1 . 2]" 2
131 1 191 TRP O 1 195 VAL H . . 2.500 2.212 1.862 2.443 . 0 0 "[ . 1 . 2]" 2
132 1 191 TRP O 1 195 VAL N . . 3.500 3.120 2.837 3.400 . 0 0 "[ . 1 . 2]" 2
133 1 192 ASP O 1 196 GLU H . . 2.500 2.424 2.227 2.618 0.118 9 0 "[ . 1 . 2]" 2
134 1 192 ASP O 1 196 GLU N . . 3.500 3.283 3.070 3.404 . 0 0 "[ . 1 . 2]" 2
135 1 193 THR O 1 197 LEU H . . 2.300 1.995 1.758 2.272 . 0 0 "[ . 1 . 2]" 2
136 1 193 THR O 1 197 LEU N . . 3.200 2.985 2.766 3.261 0.061 20 0 "[ . 1 . 2]" 2
137 1 194 PHE O 1 198 TYR H . . 2.300 2.186 1.952 2.535 0.235 14 0 "[ . 1 . 2]" 2
138 1 194 PHE O 1 198 TYR N . . 3.200 3.098 2.891 3.274 0.074 10 0 "[ . 1 . 2]" 2
139 1 195 VAL O 1 199 GLY H . . 2.300 2.151 1.875 2.683 0.383 14 0 "[ . 1 . 2]" 2
140 1 195 VAL O 1 199 GLY N . . 3.200 2.825 2.739 2.958 . 0 0 "[ . 1 . 2]" 2
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