NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
568748 |
2m32   |
18942 | cing | 4-filtered-FRED | Wattos | check | completeness | distance |
data_2m32
save_NOE_Completeness
_NOE_completeness_stats.Sf_category NOE_completeness_statistics
_NOE_completeness_stats.Model_count 10
_NOE_completeness_stats.Residue_count 262
_NOE_completeness_stats.Total_atom_count 3837
_NOE_completeness_stats.Observable_atom_definition ob_standard
_NOE_completeness_stats.Observable_atom_count 1247
_NOE_completeness_stats.Use_intra_residue_restraints no
_NOE_completeness_stats.Redundancy_threshold_pct 5.0
_NOE_completeness_stats.Distance_averaging_power 1.00
_NOE_completeness_stats.Completeness_cutoff 4.00
_NOE_completeness_stats.Completeness_cumulative_pct 28.1
_NOE_completeness_stats.Constraint_unexpanded_count 1928
_NOE_completeness_stats.Constraint_count 1928
_NOE_completeness_stats.Constraint_exp_unfiltered_count 2852
_NOE_completeness_stats.Constraint_exceptional_count 0
_NOE_completeness_stats.Constraint_nonobservable_count 130
_NOE_completeness_stats.Constraint_intraresidue_count 368
_NOE_completeness_stats.Constraint_surplus_count 0
_NOE_completeness_stats.Constraint_observed_count 1430
_NOE_completeness_stats.Constraint_expected_count 2852
_NOE_completeness_stats.Constraint_matched_count 800
_NOE_completeness_stats.Constraint_unmatched_count 630
_NOE_completeness_stats.Constraint_exp_nonobs_count 2052
_NOE_completeness_stats.Details
;
A detailed methodology description is available at:
http://nmr.cmbi.ru.nl/~jd/wattos/doc/Wattos/Soup/Constraint/dc_completeness.html
Please note that the contributions in ambiguous restraints are considered
separate 'restraints' for the sets defined below.
The cut off for all statistics except those in the by-shell table is
given below by the above tag: _NOE_completeness_stats.Completeness_cutoff
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * Number of models
* 5 * Number of residues
* 6 * Number of atoms
* 7 * Standard set name of observable atom definitions
see: Doreleijers et al., J.Biomol.NMR 14, 123-132 (1999).
* 8 * Observable atom(group)s
* 9 * Include intra residue restraints
* 10 * Surplus threshold for determining redundant restraints
* 11 * Power for averaging the distance over models
* 12 * Up to what distance are NOEs expected
* 13 * Cumulative completeness percentage
* 14 * Number of unexpanded restraints in restraint list.
* 15 * Number of restraints in restraint list. Set U
* 16 * Expected restraints based on criteria in list. Set V
Set V differs from set B only if intra residue restraints are analyzed.
* 17 * Exceptional restraints, i.e. with an unknown atom.Set E
* 18 * Not observable NOEs with e.g. hydroxyl Ser HG. Set O
Even though restraints with these atom types might have been observed they are
excluded from the analysis.
* 19 * Intra-residue restraints if not to be analyzed. Set I
* 20 * Surplus like double restraints. Set S
* 21 * Observed restraints. Set A = U - (E u O u I u S)
* 22 * Expected restraints based on criteria as in A. Set B = V - (I u S)
* 23 * Observed restraints matched to the expected. Set M = A n B
* 24 * Observed restraints that were not expected. Set C = A - M
* 25 * Expected restraints that were not observed. Set D = B - M
* 26 * This tag
Description of the tags in the class table:
* 1 * Class of restraint. Note that 'medium-range' involves (2<=i<=4) contacts.
Possible values are: intraresidue,sequential,medium-range,long-range, and intermolecular.
* 2 * Observed restraints. Set A = U - (E u O u I u S)
* 3 * Expected restraints based on criteria as in A. Set B = V - (I u S)
* 4 * Observed restraints matched to the expected. Set M = A n B
* 5 * Completeness percentage
* 6 * Standard deviation from the average over the classes.
* 7 * Extra information
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the shell table.
The first row shows the lower limit of the shells requested and
The last row shows the total number of restraints over the shells.
* 1 * Description of the content of the row: edges, shell, or sums.
The value determines the meaning of the values to the nine 'Matched_shell_x' tags among others.
* 2 * Lower limit of shell of expected restraints.
* 3 * Upper limit of shell of expected restraints.
* 4 * Expected restraints based on criteria as in A. Set B = V - (I u S)
* 5 * Observed restraints matched to the expected. Set M = A n B
* 6 * Matched restraints with experimental distance in shell 1
* 7 * Matched restraints with experimental distance in shell 2
* 8 * Matched restraints with experimental distance in shell 3
* 9 * Matched restraints with experimental distance in shell 4
* 10 * Matched restraints with experimental distance in shell 5
* 11 * Matched restraints with experimental distance in shell 6
* 12 * Matched restraints with experimental distance in shell 7
* 13 * Matched restraints with experimental distance in shell 8
* 14 * Matched restraints with experimental distance in shell 9
* 15 * Matched restraints overflowing the last shell
* 16 * Completeness percentage for this shell
* 17 * Completeness percentage up to upper limit of this shell
* 18 * Administrative tag
* 19 * Administrative tag
Description of the tags in the residue table:
* 1 * Chain identifier
* 2 * Residue number
* 3 * Residue name
* 4 * Observable atom(group)s for this residue.
* 5 * Observed restraints. Set A = U - (E u O u I u S)
* 6 * Expected restraints based on criteria as in A. Set B = V - (I u S)
* 7 * Observed restraints matched to the expected. Set M = A n B
* 8 * Completeness percentage
* 9 * Standard deviation from the average over the residues.
* 10 * Extra information
* 11 * Administrative tag
* 12 * Administrative tag
;
loop_
_NOE_completeness_class.Type
_NOE_completeness_class.Constraint_observed_count
_NOE_completeness_class.Constraint_expected_count
_NOE_completeness_class.Constraint_matched_count
_NOE_completeness_class.Completeness_cumulative_pct
_NOE_completeness_class.Std_dev
_NOE_completeness_class.Details
intraresidue 0 0 0 . . "no intras"
sequential 598 885 348 39.3 0.9 .
medium-range 365 633 196 31.0 0.4 .
long-range 467 1134 256 22.6 -0.0 .
intermolecular 0 200 0 0.0 -1.3 >sigma
stop_
loop_
_NOE_completeness_shell.Type
_NOE_completeness_shell.Shell_start
_NOE_completeness_shell.Shell_end
_NOE_completeness_shell.Constraint_expected_count
_NOE_completeness_shell.Constraint_matched_count
_NOE_completeness_shell.Matched_shell_1
_NOE_completeness_shell.Matched_shell_2
_NOE_completeness_shell.Matched_shell_3
_NOE_completeness_shell.Matched_shell_4
_NOE_completeness_shell.Matched_shell_5
_NOE_completeness_shell.Matched_shell_6
_NOE_completeness_shell.Matched_shell_7
_NOE_completeness_shell.Matched_shell_8
_NOE_completeness_shell.Matched_shell_9
_NOE_completeness_shell.Matched_shell_overflow
_NOE_completeness_shell.Completeness_shell_pct
_NOE_completeness_shell.Completeness_cumulative_pct
edges . . . . 2.00 2.50 3.00 3.50 4.00 4.50 5.00 5.50 . . . .
shell 0.00 2.00 10 2 0 0 0 1 1 0 0 0 . 0 20.0 20.0
shell 2.00 2.50 312 137 0 8 66 38 16 2 7 0 . 0 43.9 43.2
shell 2.50 3.00 512 203 0 6 36 93 40 19 8 1 . 0 39.6 41.0
shell 3.00 3.50 723 198 0 2 17 39 69 44 19 8 . 0 27.4 34.7
shell 3.50 4.00 1295 260 0 0 7 29 81 75 50 18 . 0 20.1 28.1
shell 4.00 4.50 2122 304 0 0 2 7 60 119 96 20 . 0 14.3 22.2
shell 4.50 5.00 2824 192 0 0 0 5 31 56 77 23 . 0 6.8 16.6
shell 5.00 5.50 3485 90 0 0 0 3 4 13 41 29 . 0 2.6 12.3
shell 5.50 6.00 4053 30 0 0 0 1 1 9 7 12 . 0 0.7 9.2
shell 6.00 6.50 4527 10 0 0 0 0 1 3 3 3 . 0 0.2 7.2
shell 6.50 7.00 5189 4 0 0 0 0 0 1 1 2 . 0 0.1 5.7
shell 7.00 7.50 5590 0 0 0 0 0 0 0 0 0 . 0 0.0 4.7
shell 7.50 8.00 6246 0 0 0 0 0 0 0 0 0 . 0 0.0 3.9
shell 8.00 8.50 6828 0 0 0 0 0 0 0 0 0 . 0 0.0 3.3
shell 8.50 9.00 7304 0 0 0 0 0 0 0 0 0 . 0 0.0 2.8
sums . . 51020 1430 0 16 128 216 304 341 309 116 . 0 . .
stop_
loop_
_NOE_completeness_comp.Entity_assembly_ID
_NOE_completeness_comp.Comp_index_ID
_NOE_completeness_comp.Comp_ID
_NOE_completeness_comp.Obs_atom_count
_NOE_completeness_comp.Constraint_observed_count
_NOE_completeness_comp.Constraint_expected_count
_NOE_completeness_comp.Constraint_matched_count
_NOE_completeness_comp.Completeness_cumulative_pct
_NOE_completeness_comp.Std_dev
_NOE_completeness_comp.Details
1 1 SER 4 0 4 0 0.0 -1.4 >sigma
1 2 THR 4 5 15 3 20.0 -0.3 .
1 3 GLN 7 13 18 7 38.9 0.8 .
1 4 LEU 7 16 51 7 13.7 -0.7 .
1 5 ASP 4 16 28 6 21.4 -0.2 .
1 6 ILE 6 26 59 17 28.8 0.2 .
1 7 VAL 5 38 50 22 44.0 1.1 >sigma
1 8 ILE 6 24 61 13 21.3 -0.2 .
1 9 VAL 5 19 50 12 24.0 -0.1 .
1 10 LEU 7 21 55 13 23.6 -0.1 .
1 11 ASP 4 11 20 5 25.0 -0.0 .
1 12 GLY 3 8 21 5 23.8 -0.1 .
1 13 SER 4 5 16 2 12.5 -0.7 .
1 14 ASN 6 2 19 2 10.5 -0.8 .
1 15 SER 4 2 15 2 13.3 -0.7 .
1 16 ILE 6 11 29 6 20.7 -0.3 .
1 17 TYR 6 4 23 3 13.0 -0.7 .
1 18 PRO 5 4 17 4 23.5 -0.1 .
1 19 TRP 10 29 47 18 38.3 0.7 .
1 20 ASP 4 10 14 8 57.1 1.8 >sigma
1 21 SER 4 11 15 7 46.7 1.2 >sigma
1 22 VAL 5 30 40 16 40.0 0.8 .
1 23 THR 4 22 28 14 50.0 1.4 >sigma
1 24 ALA 3 14 15 5 33.3 0.5 .
1 25 PHE 7 29 45 19 42.2 1.0 .
1 26 LEU 7 35 55 17 30.9 0.3 .
1 27 ASN 6 12 25 7 28.0 0.1 .
1 28 ASP 4 15 22 7 31.8 0.4 .
1 29 LEU 7 20 57 15 26.3 0.1 .
1 30 LEU 7 9 72 8 11.1 -0.8 .
1 31 GLU 5 8 19 4 21.1 -0.2 .
1 32 ARG 7 13 35 7 20.0 -0.3 .
1 33 MET 6 20 45 9 20.0 -0.3 .
1 34 ASP 4 11 8 3 37.5 0.7 .
1 35 ILE 6 37 48 19 39.6 0.8 .
1 36 GLY 3 7 10 5 50.0 1.4 >sigma
1 37 PRO 5 5 12 3 25.0 -0.0 .
1 38 LYS 7 5 10 5 50.0 1.4 >sigma
1 39 GLN 7 18 36 12 33.3 0.5 .
1 40 THR 4 20 37 11 29.7 0.2 .
1 41 GLN 7 7 27 4 14.8 -0.6 .
1 42 VAL 5 15 45 9 20.0 -0.3 .
1 43 GLY 3 11 21 8 38.1 0.7 .
1 44 ILE 6 26 52 13 25.0 -0.0 .
1 45 VAL 5 27 47 18 38.3 0.7 .
1 46 GLN 7 14 29 9 31.0 0.3 .
1 47 TYR 6 12 52 9 17.3 -0.5 .
1 48 GLY 3 11 16 6 37.5 0.7 .
1 49 GLU 5 10 14 7 50.0 1.4 >sigma
1 50 ASN 6 12 11 6 54.5 1.7 >sigma
1 51 VAL 5 27 37 12 32.4 0.4 .
1 52 THR 4 17 16 9 56.3 1.8 >sigma
1 53 HIS 6 10 16 9 56.3 1.8 >sigma
1 54 GLU 5 12 22 6 27.3 0.1 .
1 55 PHE 7 11 41 7 17.1 -0.5 .
1 56 ASN 6 15 24 7 29.2 0.2 .
1 57 LEU 7 18 45 11 24.4 -0.1 .
1 58 ASN 6 12 19 6 31.6 0.4 .
1 59 LYS 7 12 27 8 29.6 0.2 .
1 60 TYR 6 11 20 5 25.0 -0.0 .
1 61 SER 4 7 14 6 42.9 1.0 .
1 62 SER 4 16 18 8 44.4 1.1 >sigma
1 63 THR 4 24 32 11 34.4 0.5 .
1 64 GLU 5 14 16 8 50.0 1.4 >sigma
1 65 GLU 5 10 25 7 28.0 0.1 .
1 66 VAL 5 25 49 13 26.5 0.1 .
1 67 LEU 7 16 48 8 16.7 -0.5 .
1 68 VAL 5 21 31 13 41.9 0.9 .
1 69 ALA 3 16 31 13 41.9 0.9 .
1 70 ALA 3 25 31 14 45.2 1.1 >sigma
1 71 LYS 7 13 28 8 28.6 0.2 .
1 72 LYS 7 5 30 3 10.0 -0.9 .
1 73 ILE 6 32 46 15 32.6 0.4 .
1 74 VAL 5 23 19 11 57.9 1.8 >sigma
1 75 GLN 7 13 33 5 15.2 -0.6 .
1 76 ARG 7 4 9 1 11.1 -0.8 .
1 77 GLY 3 5 11 4 36.4 0.6 .
1 78 GLY 3 6 15 4 26.7 0.1 .
1 79 ARG 7 6 11 3 27.3 0.1 .
1 80 GLN 7 7 14 4 28.6 0.2 .
1 81 THR 4 15 25 8 32.0 0.4 .
1 82 MET 6 9 33 5 15.2 -0.6 .
1 83 THR 4 18 28 9 32.1 0.4 .
1 84 ALA 3 30 36 19 52.8 1.6 >sigma
1 85 LEU 7 12 29 5 17.2 -0.5 .
1 86 GLY 3 9 24 3 12.5 -0.7 .
1 87 ILE 6 23 52 16 30.8 0.3 .
1 88 ASP 4 16 27 10 37.0 0.7 .
1 89 THR 4 13 24 7 29.2 0.2 .
1 90 ALA 3 27 29 16 55.2 1.7 >sigma
1 91 ARG 7 16 49 10 20.4 -0.3 .
1 92 LYS 7 10 23 5 21.7 -0.2 .
1 93 GLU 5 13 17 8 47.1 1.2 >sigma
1 94 ALA 3 18 23 9 39.1 0.8 .
1 95 PHE 7 29 48 12 25.0 -0.0 .
1 96 THR 4 15 23 6 26.1 0.0 .
1 97 GLU 5 0 13 0 0.0 -1.4 >sigma
1 98 ALA 3 3 15 1 6.7 -1.1 >sigma
1 99 ARG 7 7 30 5 16.7 -0.5 .
1 100 GLY 3 12 18 7 38.9 0.8 .
1 101 ALA 3 18 25 9 36.0 0.6 .
1 102 ARG 7 7 21 4 19.0 -0.4 .
1 103 ARG 7 2 8 1 12.5 -0.7 .
1 104 GLY 3 0 7 0 0.0 -1.4 >sigma
1 105 VAL 5 13 28 5 17.9 -0.4 .
1 106 LYS 7 8 30 5 16.7 -0.5 .
1 107 LYS 7 7 36 5 13.9 -0.7 .
1 108 VAL 5 30 50 18 36.0 0.6 .
1 109 MET 6 46 51 26 51.0 1.5 >sigma
1 110 VAL 5 35 52 22 42.3 1.0 .
1 111 ILE 6 40 55 18 32.7 0.4 .
1 112 VAL 5 30 43 16 37.2 0.7 .
1 113 THR 4 18 27 10 37.0 0.7 .
1 114 ASP 4 10 15 6 40.0 0.8 .
1 115 GLY 3 4 19 3 15.8 -0.5 .
1 116 GLU 5 10 16 7 43.8 1.0 >sigma
1 117 SER 4 4 7 4 57.1 1.8 >sigma
1 118 HIS 6 2 7 2 28.6 0.2 .
1 119 ASP 4 1 13 1 7.7 -1.0 >sigma
1 120 ASN 6 5 12 3 25.0 -0.0 .
1 121 HIS 6 2 12 1 8.3 -1.0 .
1 122 ARG 7 13 22 5 22.7 -0.2 .
1 123 LEU 7 19 46 15 32.6 0.4 .
1 124 LYS 7 12 19 7 36.8 0.7 .
1 125 LYS 7 16 20 7 35.0 0.5 .
1 126 VAL 5 13 47 6 12.8 -0.7 .
1 127 ILE 6 13 40 8 20.0 -0.3 .
1 128 GLN 7 12 24 10 41.7 0.9 .
1 129 ASP 4 13 26 6 23.1 -0.1 .
1 130 CYS 4 12 27 7 25.9 0.0 .
1 131 GLU 5 10 23 9 39.1 0.8 .
1 132 ASP 4 11 14 8 57.1 1.8 >sigma
1 133 GLU 5 13 25 7 28.0 0.1 .
1 134 ASN 6 13 14 6 42.9 1.0 .
1 135 ILE 6 22 57 12 21.1 -0.2 .
1 136 GLN 7 10 26 4 15.4 -0.6 .
1 137 ARG 7 7 36 3 8.3 -1.0 .
1 138 PHE 7 34 56 22 39.3 0.8 .
1 139 SER 4 20 18 8 44.4 1.1 >sigma
1 140 ILE 6 41 49 19 38.8 0.8 .
1 141 ALA 3 20 24 10 41.7 0.9 .
1 142 ILE 6 30 43 20 46.5 1.2 >sigma
1 143 LEU 7 12 18 7 38.9 0.8 .
1 144 GLY 3 3 12 2 16.7 -0.5 .
1 145 SER 4 1 6 1 16.7 -0.5 .
1 146 TYR 6 2 11 1 9.1 -0.9 .
1 147 ASN 6 4 9 2 22.2 -0.2 .
1 148 ARG 7 4 7 2 28.6 0.2 .
1 149 GLY 3 3 8 2 25.0 -0.0 .
1 150 ASN 6 2 5 1 20.0 -0.3 .
1 151 LEU 7 7 15 4 26.7 0.1 .
1 152 SER 4 10 14 7 50.0 1.4 >sigma
1 153 THR 4 18 19 8 42.1 0.9 .
1 154 GLU 5 15 13 8 61.5 2.1 >sigma
1 155 LYS 7 12 20 8 40.0 0.8 .
1 156 PHE 7 17 31 9 29.0 0.2 .
1 157 VAL 5 21 37 11 29.7 0.2 .
1 158 GLU 5 12 33 11 33.3 0.5 .
1 159 GLU 5 12 18 4 22.2 -0.2 .
1 160 ILE 6 28 47 14 29.8 0.2 .
1 161 LYS 7 23 40 15 37.5 0.7 .
1 162 SER 4 7 13 4 30.8 0.3 .
1 163 ILE 6 10 37 7 18.9 -0.4 .
1 164 ALA 3 28 20 12 60.0 2.0 >sigma
1 165 SER 4 8 8 2 25.0 -0.0 .
1 166 GLU 5 8 14 1 7.1 -1.0 >sigma
1 167 PRO 5 8 19 2 10.5 -0.8 .
1 168 THR 4 18 28 8 28.6 0.2 .
1 169 GLU 5 7 13 4 30.8 0.3 .
1 170 LYS 7 11 27 6 22.2 -0.2 .
1 171 HIS 6 16 21 8 38.1 0.7 .
1 172 PHE 7 14 41 8 19.5 -0.3 .
1 173 PHE 7 31 27 13 48.1 1.3 >sigma
1 174 ASN 6 20 23 10 43.5 1.0 >sigma
1 175 VAL 5 32 44 20 45.5 1.1 >sigma
1 176 SER 4 9 11 6 54.5 1.7 >sigma
1 177 ASP 4 15 17 8 47.1 1.2 >sigma
1 178 GLU 5 12 18 6 33.3 0.5 .
1 179 LEU 7 15 17 9 52.9 1.6 >sigma
1 180 ALA 3 27 23 12 52.2 1.5 >sigma
1 181 LEU 7 27 56 17 30.4 0.3 .
1 182 VAL 5 13 28 7 25.0 -0.0 .
1 183 THR 4 17 20 8 40.0 0.8 .
1 184 ILE 6 46 46 24 52.2 1.5 >sigma
1 185 VAL 5 23 31 14 45.2 1.1 >sigma
1 186 LYS 7 11 21 7 33.3 0.5 .
1 187 THR 4 22 30 15 50.0 1.4 >sigma
1 188 LEU 7 20 47 15 31.9 0.4 .
1 189 GLY 3 6 11 4 36.4 0.6 .
1 190 GLU 5 17 15 11 73.3 2.7 >sigma
1 191 ARG 7 15 13 7 53.8 1.6 >sigma
1 192 ILE 6 17 12 6 50.0 1.4 >sigma
2 2 GLY 3 0 7 0 0.0 -1.4 >sigma
2 3 PRO 5 0 4 0 0.0 -1.4 >sigma
2 5 GLY 3 0 16 0 0.0 -1.4 >sigma
2 6 PRO 5 0 4 0 0.0 -1.4 >sigma
2 8 GLY 3 0 16 0 0.0 -1.4 >sigma
2 9 LEU 7 0 10 0 0.0 -1.4 >sigma
2 11 GLY 3 0 12 0 0.0 -1.4 >sigma
2 12 GLU 5 0 8 0 0.0 -1.4 >sigma
2 13 ASN 6 0 15 0 0.0 -1.4 >sigma
2 14 GLY 3 0 19 0 0.0 -1.4 >sigma
2 15 PRO 5 0 15 0 0.0 -1.4 >sigma
2 17 GLY 3 0 14 0 0.0 -1.4 >sigma
2 18 PRO 5 0 7 0 0.0 -1.4 >sigma
2 20 GLY 3 0 13 0 0.0 -1.4 >sigma
2 21 PRO 5 0 4 0 0.0 -1.4 >sigma
3 2 GLY 3 0 12 0 0.0 -1.4 >sigma
3 3 PRO 5 0 6 0 0.0 -1.4 >sigma
3 5 GLY 3 0 14 0 0.0 -1.4 >sigma
3 6 PRO 5 0 6 0 0.0 -1.4 >sigma
3 8 GLY 3 0 14 0 0.0 -1.4 >sigma
3 9 LEU 7 0 7 0 0.0 -1.4 >sigma
3 11 GLY 3 0 17 0 0.0 -1.4 >sigma
3 12 GLU 5 0 20 0 0.0 -1.4 >sigma
3 13 ASN 6 0 16 0 0.0 -1.4 >sigma
3 14 GLY 3 0 16 0 0.0 -1.4 >sigma
3 15 PRO 5 0 8 0 0.0 -1.4 >sigma
3 17 GLY 3 0 13 0 0.0 -1.4 >sigma
3 18 PRO 5 0 4 0 0.0 -1.4 >sigma
3 20 GLY 3 0 14 0 0.0 -1.4 >sigma
3 21 PRO 5 0 2 0 0.0 -1.4 >sigma
4 2 GLY 3 0 13 0 0.0 -1.4 >sigma
4 3 PRO 5 0 7 0 0.0 -1.4 >sigma
4 5 GLY 3 0 14 0 0.0 -1.4 >sigma
4 6 PRO 5 0 4 0 0.0 -1.4 >sigma
4 8 GLY 3 0 14 0 0.0 -1.4 >sigma
4 9 LEU 7 0 3 0 0.0 -1.4 >sigma
4 11 GLY 3 0 17 0 0.0 -1.4 >sigma
4 12 GLU 5 0 16 0 0.0 -1.4 >sigma
4 13 ASN 6 0 22 0 0.0 -1.4 >sigma
4 14 GLY 3 0 18 0 0.0 -1.4 >sigma
4 15 PRO 5 0 4 0 0.0 -1.4 >sigma
4 17 GLY 3 0 14 0 0.0 -1.4 >sigma
4 18 PRO 5 0 5 0 0.0 -1.4 >sigma
4 20 GLY 3 0 9 0 0.0 -1.4 >sigma
4 21 PRO 5 0 3 0 0.0 -1.4 >sigma
stop_
save_
Contact the webmaster for help, if required. Friday, May 3, 2024 12:26:23 PM GMT (wattos1)