NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
388555 |
1n4c   |
4716 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1n4c
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 144
_TA_constraint_stats_list.Viol_count 959
_TA_constraint_stats_list.Viol_total 27605.43
_TA_constraint_stats_list.Viol_max 5.14
_TA_constraint_stats_list.Viol_rms 0.93
_TA_constraint_stats_list.Viol_average_all_restraints 0.48
_TA_constraint_stats_list.Viol_average_violations_only 1.44
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * ID of the restraint list.
* 3 * Number of restraints in list.
* 4 * Number of violated restraints (each model violation is used).
* 5 * Sum of violations in degrees.
* 6 * Maximum violation of a restraint without averaging in any way.
* 7 * Rms of violations over all restraints.
* 8 * Average violation over all restraints.
* 9 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
Threshold for reporting violations (degrees) in the last columns of the next table.
* 10 * This tag.
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
* 2 * Torsion angle name where available.
* 3 * First atom's:
* 4 * Chain identifier (can be absent if none defined)
* 5 * Residue number
* 6 * Residue name
* 7 * Name of (pseudo-)atom
* 8 * Second thru fourth atom's identifiers occupy columns 7 thru 18.
* 19 * Lower bound (degrees)
* 20 * Upper bound (degrees)
* 21 * Average angle in ensemble of models
* 22 * Minimum angle in ensemble of models (counter clockwise from range)
* 23 * Maximum angle in ensemble of models (clockwise from range)
* 24 * Maximum violation (without any averaging)
* 25 * Model number with the maximum violation
* 26 * Number of models with a violation above cutoff
* 27 * List of models with a violation above cutoff. See description above.
* 28 * Administrative tag
* 29 * Administrative tag
;
loop_
_TA_constraint_stats.Restraint_ID
_TA_constraint_stats.Torsion_angle_name
_TA_constraint_stats.Entity_assembly_ID_1
_TA_constraint_stats.Comp_index_ID_1
_TA_constraint_stats.Comp_ID_1
_TA_constraint_stats.Atom_ID_1
_TA_constraint_stats.Entity_assembly_ID_2
_TA_constraint_stats.Comp_index_ID_2
_TA_constraint_stats.Comp_ID_2
_TA_constraint_stats.Atom_ID_2
_TA_constraint_stats.Entity_assembly_ID_3
_TA_constraint_stats.Comp_index_ID_3
_TA_constraint_stats.Comp_ID_3
_TA_constraint_stats.Atom_ID_3
_TA_constraint_stats.Entity_assembly_ID_4
_TA_constraint_stats.Comp_index_ID_4
_TA_constraint_stats.Comp_ID_4
_TA_constraint_stats.Atom_ID_4
_TA_constraint_stats.Angle_lower_bound_val
_TA_constraint_stats.Angle_upper_bound_val
_TA_constraint_stats.Angle_average
_TA_constraint_stats.Angle_minimum
_TA_constraint_stats.Angle_maximum
_TA_constraint_stats.Max_violation
_TA_constraint_stats.Max_violation_model_number
_TA_constraint_stats.Over_cutoff_violation_count
_TA_constraint_stats.Over_cutoff_violation_per_model
1 . 1 180 PRO C 1 181 LEU N 1 181 LEU CA 1 181 LEU C -107.86 -53.10 -103.76 -110.94 -111.45 3.81 6 0 "[ . 1 . 2]"
2 . 1 175 ASN C 1 176 GLN N 1 176 GLN CA 1 176 GLN C -124.62 -62.90 -72.28 -66.06 -84.22 1.82 3 0 "[ . 1 . 2]"
3 . 1 174 GLU C 1 175 ASN N 1 175 ASN CA 1 175 ASN C -89.00 -53.60 -80.95 -78.91 -81.20 0.81 10 0 "[ . 1 . 2]"
4 . 1 173 PHE C 1 174 GLU N 1 174 GLU CA 1 174 GLU C -74.08 -53.36 -71.54 -76.64 -62.68 2.56 3 0 "[ . 1 . 2]"
5 . 1 172 GLU C 1 173 PHE N 1 173 PHE CA 1 173 PHE C -75.54 -55.54 -56.31 -54.78 -54.96 1.50 12 0 "[ . 1 . 2]"
6 . 1 171 SER C 1 172 GLU N 1 172 GLU CA 1 172 GLU C -78.64 -51.64 -80.40 -81.78 -78.93 3.14 20 0 "[ . 1 . 2]"
7 . 1 170 TRP C 1 171 SER N 1 171 SER CA 1 171 SER C -77.65 -48.29 -61.85 -65.59 -58.35 . . 0 "[ . 1 . 2]"
8 . 1 169 ALA C 1 170 TRP N 1 170 TRP CA 1 170 TRP C -76.62 -54.78 -54.16 -54.29 -54.98 2.43 2 0 "[ . 1 . 2]"
9 . 1 168 ASP C 1 169 ALA N 1 169 ALA CA 1 169 ALA C -79.51 -58.63 -63.56 -66.85 -58.13 0.50 10 0 "[ . 1 . 2]"
10 . 1 167 ASN C 1 168 ASP N 1 168 ASP CA 1 168 ASP C -80.48 -55.64 -77.92 -79.86 -80.58 0.10 1 0 "[ . 1 . 2]"
11 . 1 166 LEU C 1 167 ASN N 1 167 ASN CA 1 167 ASN C -85.59 -44.55 -84.73 -86.40 -80.42 0.81 2 0 "[ . 1 . 2]"
12 . 1 165 GLU C 1 166 LEU N 1 166 LEU CA 1 166 LEU C -80.45 -54.09 -64.02 -78.30 -52.32 1.77 5 0 "[ . 1 . 2]"
13 . 1 164 MET C 1 165 GLU N 1 165 GLU CA 1 165 GLU C -78.42 -55.70 -58.05 -79.65 -54.17 1.53 11 0 "[ . 1 . 2]"
14 . 1 163 PHE C 1 164 MET N 1 164 MET CA 1 164 MET C -79.72 -53.36 -74.43 -80.16 -62.02 0.44 3 0 "[ . 1 . 2]"
15 . 1 162 ILE C 1 163 PHE N 1 163 PHE CA 1 163 PHE C -75.52 -53.16 -61.61 -61.78 -62.67 . . 0 "[ . 1 . 2]"
16 . 1 161 MET C 1 162 ILE N 1 162 ILE CA 1 162 ILE C -78.46 -60.62 -78.58 -79.68 -79.77 3.75 17 0 "[ . 1 . 2]"
17 . 1 160 LYS C 1 161 MET N 1 161 MET CA 1 161 MET C -72.85 -56.77 -73.34 -71.38 -72.70 2.07 17 0 "[ . 1 . 2]"
18 . 1 159 ALA C 1 160 LYS N 1 160 LYS CA 1 160 LYS C -71.64 -59.40 -55.93 -57.80 -54.70 4.70 1 0 "[ . 1 . 2]"
19 . 1 158 TYR C 1 159 ALA N 1 159 ALA CA 1 159 ALA C -71.88 -51.68 -55.18 -75.26 -49.55 3.38 14 0 "[ . 1 . 2]"
20 . 1 157 GLN C 1 158 TYR N 1 158 TYR CA 1 158 TYR C -95.52 -34.48 -50.83 -51.81 -61.12 . . 0 "[ . 1 . 2]"
21 . 1 156 GLU C 1 157 GLN N 1 157 GLN CA 1 157 GLN C -76.06 -50.62 -61.38 -55.98 -61.24 0.85 7 0 "[ . 1 . 2]"
22 . 1 155 TYR C 1 156 GLU N 1 156 GLU CA 1 156 GLU C -84.64 -40.00 -63.38 -69.62 -56.85 . . 0 "[ . 1 . 2]"
23 . 1 153 GLN C 1 154 PRO N 1 154 PRO CA 1 154 PRO C -104.58 -25.94 -35.76 -35.28 -35.52 . . 0 "[ . 1 . 2]"
24 . 1 149 LYS C 1 150 ALA N 1 150 ALA CA 1 150 ALA C -122.77 -68.01 -125.19 -125.32 -125.55 3.28 15 0 "[ . 1 . 2]"
25 . 1 147 PRO C 1 148 ASP N 1 148 ASP CA 1 148 ASP C -101.02 -35.58 -42.68 -43.85 -41.38 . . 0 "[ . 1 . 2]"
26 . 1 143 LEU C 1 144 VAL N 1 144 VAL CA 1 144 VAL C -96.80 -49.52 -62.38 -64.75 -57.67 . . 0 "[ . 1 . 2]"
27 . 1 142 VAL C 1 143 LEU N 1 143 LEU CA 1 143 LEU C -75.90 -52.06 -67.80 -70.69 -58.10 . . 0 "[ . 1 . 2]"
28 . 1 141 ALA C 1 142 VAL N 1 142 VAL CA 1 142 VAL C -81.60 -48.66 -71.59 -72.13 -72.51 . . 0 "[ . 1 . 2]"
29 . 1 140 LYS C 1 141 ALA N 1 141 ALA CA 1 141 ALA C -80.00 -51.92 -51.28 -51.34 -51.43 1.80 8 0 "[ . 1 . 2]"
30 . 1 139 ARG C 1 140 LYS N 1 140 LYS CA 1 140 LYS C -79.39 -51.39 -65.96 -62.32 -65.54 0.47 8 0 "[ . 1 . 2]"
31 . 1 138 TYR C 1 139 ARG N 1 139 ARG CA 1 139 ARG C -85.71 -50.03 -69.70 -73.54 -66.51 . . 0 "[ . 1 . 2]"
32 . 1 137 VAL C 1 138 TYR N 1 138 TYR CA 1 138 TYR C -83.11 -52.55 -50.65 -50.95 -51.02 2.92 10 0 "[ . 1 . 2]"
33 . 1 136 LYS C 1 137 VAL N 1 137 VAL CA 1 137 VAL C -80.39 -52.33 -81.16 -81.40 -81.46 1.28 14 0 "[ . 1 . 2]"
34 . 1 135 LYS C 1 136 LYS N 1 136 LYS CA 1 136 LYS C -77.75 -54.19 -63.43 -60.64 -63.85 0.15 17 0 "[ . 1 . 2]"
35 . 1 134 VAL C 1 135 LYS N 1 135 LYS CA 1 135 LYS C -72.53 -52.85 -56.68 -52.70 -53.53 0.70 2 0 "[ . 1 . 2]"
36 . 1 133 GLN C 1 134 VAL N 1 134 VAL CA 1 134 VAL C -77.63 -55.99 -77.87 -79.53 -68.65 1.90 10 0 "[ . 1 . 2]"
37 . 1 132 GLU C 1 133 GLN N 1 133 GLN CA 1 133 GLN C -73.90 -57.58 -69.70 -60.84 -63.93 1.51 1 0 "[ . 1 . 2]"
38 . 1 131 PRO C 1 132 GLU N 1 132 GLU CA 1 132 GLU C -76.76 -57.96 -59.59 -67.26 -56.36 1.60 14 0 "[ . 1 . 2]"
39 . 1 130 THR C 1 131 PRO N 1 131 PRO CA 1 131 PRO C -65.67 -49.47 -56.69 -47.11 -58.34 3.69 15 0 "[ . 1 . 2]"
40 . 1 125 MET C 1 126 ALA N 1 126 ALA CA 1 126 ALA C -95.69 -42.53 -82.38 -80.18 -81.10 . . 0 "[ . 1 . 2]"
41 . 1 122 PRO C 1 123 VAL N 1 123 VAL CA 1 123 VAL C -143.68 -70.52 -89.63 -88.20 -88.90 . . 0 "[ . 1 . 2]"
42 . 1 120 TRP C 1 121 LYS N 1 121 LYS CA 1 121 LYS C -152.66 -47.06 -111.26 -121.42 -107.95 . . 0 "[ . 1 . 2]"
43 . 1 119 LYS C 1 120 TRP N 1 120 TRP CA 1 120 TRP C -114.17 -62.53 -60.94 -61.72 -59.79 2.74 18 0 "[ . 1 . 2]"
44 . 1 118 THR C 1 119 LYS N 1 119 LYS CA 1 119 LYS C -108.83 -55.55 -95.39 -104.32 -74.76 . . 0 "[ . 1 . 2]"
45 . 1 110 HIS C 1 111 THR N 1 111 THR CA 1 111 THR C -98.35 -40.99 -76.36 -78.40 -73.28 . . 0 "[ . 1 . 2]"
46 . 1 109 MET C 1 110 HIS N 1 110 HIS CA 1 110 HIS C -73.92 -52.12 -58.81 -56.95 -58.82 0.56 9 0 "[ . 1 . 2]"
47 . 1 108 THR C 1 109 MET N 1 109 MET CA 1 109 MET C -72.56 -49.28 -70.57 -75.76 -62.54 3.20 4 0 "[ . 1 . 2]"
48 . 1 106 LEU C 1 107 SER N 1 107 SER CA 1 107 SER C -121.88 -37.72 -96.58 -94.79 -95.30 . . 0 "[ . 1 . 2]"
49 . 1 105 LEU C 1 106 LEU N 1 106 LEU CA 1 106 LEU C -77.41 -49.05 -74.60 -75.67 -76.23 . . 0 "[ . 1 . 2]"
50 . 1 104 ALA C 1 105 LEU N 1 105 LEU CA 1 105 LEU C -77.78 -55.54 -52.98 -52.88 -53.07 3.39 17 0 "[ . 1 . 2]"
51 . 1 103 ARG C 1 104 ALA N 1 104 ALA CA 1 104 ALA C -79.18 -53.02 -81.22 -80.77 -81.00 2.93 8 0 "[ . 1 . 2]"
52 . 1 102 ILE C 1 103 ARG N 1 103 ARG CA 1 103 ARG C -77.33 -52.37 -56.68 -61.40 -51.91 0.46 11 0 "[ . 1 . 2]"
53 . 1 95 ILE C 1 96 GLU N 1 96 GLU CA 1 96 GLU C -88.64 -50.56 -66.09 -65.34 -65.78 . . 0 "[ . 1 . 2]"
54 . 1 94 TRP C 1 95 ILE N 1 95 ILE CA 1 95 ILE C -76.40 -52.28 -72.12 -76.44 -67.98 0.04 3 0 "[ . 1 . 2]"
55 . 1 93 GLU C 1 94 TRP N 1 94 TRP CA 1 94 TRP C -78.30 -57.70 -73.10 -72.42 -72.64 . . 0 "[ . 1 . 2]"
56 . 1 92 LEU C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -81.30 -50.62 -79.68 -82.59 -74.91 1.29 19 0 "[ . 1 . 2]"
57 . 1 91 ILE C 1 92 LEU N 1 92 LEU CA 1 92 LEU C -79.60 -50.20 -49.90 -49.92 -49.95 1.31 14 0 "[ . 1 . 2]"
58 . 1 90 LYS C 1 91 ILE N 1 91 ILE CA 1 91 ILE C -84.12 -59.80 -65.86 -76.08 -59.03 0.77 14 0 "[ . 1 . 2]"
59 . 1 89 LEU C 1 90 LYS N 1 90 LYS CA 1 90 LYS C -84.97 -46.21 -59.81 -74.98 -48.26 . . 0 "[ . 1 . 2]"
60 . 1 88 LYS C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -75.93 -56.45 -54.50 -62.18 -51.31 5.14 7 1 "[ . + 1 . 2]"
61 . 1 87 GLU C 1 88 LYS N 1 88 LYS CA 1 88 LYS C -74.72 -60.08 -76.53 -75.84 -76.08 3.91 3 0 "[ . 1 . 2]"
62 . 1 86 PRO C 1 87 GLU N 1 87 GLU CA 1 87 GLU C -92.81 -40.57 -92.49 -83.78 -88.28 3.20 1 0 "[ . 1 . 2]"
63 . 1 84 MET C 1 85 ASP N 1 85 ASP CA 1 85 ASP C -140.43 -46.43 -49.22 -60.43 -44.78 1.65 5 0 "[ . 1 . 2]"
64 . 1 80 MET C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -92.84 -46.96 -85.13 -93.17 -68.23 0.33 20 0 "[ . 1 . 2]"
65 . 1 79 GLU C 1 80 MET N 1 80 MET CA 1 80 MET C -95.32 -41.80 -63.24 -76.11 -47.49 . . 0 "[ . 1 . 2]"
66 . 1 78 GLU C 1 79 GLU N 1 79 GLU CA 1 79 GLU C -92.47 -41.75 -55.38 -84.28 -46.50 . . 0 "[ . 1 . 2]"
67 . 1 77 LYS C 1 78 GLU N 1 78 GLU CA 1 78 GLU C -81.41 -51.65 -78.44 -69.60 -75.20 1.44 16 0 "[ . 1 . 2]"
68 . 1 76 ARG C 1 77 LYS N 1 77 LYS CA 1 77 LYS C -85.10 -47.62 -53.61 -50.83 -50.92 . . 0 "[ . 1 . 2]"
69 . 1 75 MET C 1 76 ARG N 1 76 ARG CA 1 76 ARG C -91.34 -41.86 -55.97 -68.07 -46.53 . . 0 "[ . 1 . 2]"
70 . 1 74 GLU C 1 75 MET N 1 75 MET CA 1 75 MET C -85.25 -52.85 -69.23 -60.76 -66.79 2.02 9 0 "[ . 1 . 2]"
71 . 1 73 ALA C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -81.25 -53.49 -78.06 -82.04 -62.95 0.79 6 0 "[ . 1 . 2]"
72 . 1 72 ILE C 1 73 ALA N 1 73 ALA CA 1 73 ALA C -95.81 -44.09 -83.34 -90.91 -77.84 . . 0 "[ . 1 . 2]"
73 . 1 70 ARG C 1 71 THR N 1 71 THR CA 1 71 THR C -133.27 -60.63 -100.97 -133.89 -60.48 0.62 9 0 "[ . 1 . 2]"
74 . 1 176 GLN N 1 176 GLN CA 1 176 GLN C 1 177 GLY N -26.80 30.68 -24.80 -27.57 -2.46 0.77 4 0 "[ . 1 . 2]"
75 . 1 175 ASN N 1 175 ASN CA 1 175 ASN C 1 176 GLN N -59.47 3.09 -41.10 -40.33 -40.63 . . 0 "[ . 1 . 2]"
76 . 1 174 GLU N 1 174 GLU CA 1 174 GLU C 1 175 ASN N -63.44 -14.48 -44.22 -56.42 -35.81 . . 0 "[ . 1 . 2]"
77 . 1 173 PHE N 1 173 PHE CA 1 173 PHE C 1 174 GLU N -56.43 -30.11 -35.04 -29.68 -30.94 2.02 4 0 "[ . 1 . 2]"
78 . 1 172 GLU N 1 172 GLU CA 1 172 GLU C 1 173 PHE N -50.15 -28.11 -35.40 -31.68 -32.60 0.61 11 0 "[ . 1 . 2]"
79 . 1 171 SER N 1 171 SER CA 1 171 SER C 1 172 GLU N -56.26 -27.74 -34.77 -37.15 -37.34 . . 0 "[ . 1 . 2]"
80 . 1 170 TRP N 1 170 TRP CA 1 170 TRP C 1 171 SER N -54.86 -30.30 -40.67 -43.61 -32.03 . . 0 "[ . 1 . 2]"
81 . 1 169 ALA N 1 169 ALA CA 1 169 ALA C 1 170 TRP N -49.74 -29.86 -28.24 -27.08 -27.71 3.79 14 0 "[ . 1 . 2]"
82 . 1 168 ASP N 1 168 ASP CA 1 168 ASP C 1 169 ALA N -60.78 -19.90 -59.14 -61.81 -56.84 1.03 4 0 "[ . 1 . 2]"
83 . 1 167 ASN N 1 167 ASN CA 1 167 ASN C 1 168 ASP N -52.69 -11.21 -11.29 -9.89 -10.49 2.02 2 0 "[ . 1 . 2]"
84 . 1 166 LEU N 1 166 LEU CA 1 166 LEU C 1 167 ASN N -49.37 -21.09 -44.34 -48.45 -37.13 . . 0 "[ . 1 . 2]"
85 . 1 165 GLU N 1 165 GLU CA 1 165 GLU C 1 166 LEU N -50.15 -31.19 -40.06 -42.26 -47.30 1.94 17 0 "[ . 1 . 2]"
86 . 1 164 MET N 1 164 MET CA 1 164 MET C 1 165 GLU N -50.77 -18.57 -41.40 -46.76 -18.40 0.17 17 0 "[ . 1 . 2]"
87 . 1 163 PHE N 1 163 PHE CA 1 163 PHE C 1 164 MET N -57.89 -29.29 -46.33 -42.21 -46.24 . . 0 "[ . 1 . 2]"
88 . 1 162 ILE N 1 162 ILE CA 1 162 ILE C 1 163 PHE N -50.88 -27.88 -27.06 -26.99 -27.15 1.92 13 0 "[ . 1 . 2]"
89 . 1 161 MET N 1 161 MET CA 1 161 MET C 1 162 ILE N -58.81 -25.77 -53.35 -56.92 -48.13 . . 0 "[ . 1 . 2]"
90 . 1 160 LYS N 1 160 LYS CA 1 160 LYS C 1 161 MET N -51.27 -32.67 -31.71 -31.69 -31.92 2.37 8 0 "[ . 1 . 2]"
91 . 1 159 ALA N 1 159 ALA CA 1 159 ALA C 1 160 LYS N -56.03 -24.99 -55.74 -57.37 -48.71 1.34 2 0 "[ . 1 . 2]"
92 . 1 158 TYR N 1 158 TYR CA 1 158 TYR C 1 159 ALA N -58.63 -23.95 -46.47 -47.44 -48.18 . . 0 "[ . 1 . 2]"
93 . 1 157 GLN N 1 157 GLN CA 1 157 GLN C 1 158 TYR N -49.26 -24.22 -36.91 -44.44 -25.66 . . 0 "[ . 1 . 2]"
94 . 1 156 GLU N 1 156 GLU CA 1 156 GLU C 1 157 GLN N -59.88 -17.32 -48.21 -62.91 -25.25 3.03 19 0 "[ . 1 . 2]"
95 . 1 154 PRO N 1 154 PRO CA 1 154 PRO C 1 155 TYR N -59.13 6.15 -32.34 -33.56 -33.86 . . 0 "[ . 1 . 2]"
96 . 1 151 THR N 1 151 THR CA 1 151 THR C 1 152 GLY N 118.29 148.37 114.27 113.82 113.72 4.98 17 0 "[ . 1 . 2]"
97 . 1 148 ASP N 1 148 ASP CA 1 148 ASP C 1 149 LYS N -59.40 6.04 -40.50 -44.46 -35.09 . . 0 "[ . 1 . 2]"
98 . 1 144 VAL N 1 144 VAL CA 1 144 VAL C 1 145 VAL N -45.96 -12.24 -29.52 -29.84 -30.19 . . 0 "[ . 1 . 2]"
99 . 1 143 LEU N 1 143 LEU CA 1 143 LEU C 1 144 VAL N -43.52 -30.32 -29.67 -28.95 -28.98 1.93 15 0 "[ . 1 . 2]"
100 . 1 142 VAL N 1 142 VAL CA 1 142 VAL C 1 143 LEU N -52.52 -30.12 -30.42 -29.94 -30.07 1.80 17 0 "[ . 1 . 2]"
101 . 1 141 ALA N 1 141 ALA CA 1 141 ALA C 1 142 VAL N -46.82 -35.38 -35.95 -39.61 -34.55 0.83 12 0 "[ . 1 . 2]"
102 . 1 140 LYS N 1 140 LYS CA 1 140 LYS C 1 141 ALA N -46.88 -28.44 -43.60 -46.46 -41.13 . . 0 "[ . 1 . 2]"
103 . 1 139 ARG N 1 139 ARG CA 1 139 ARG C 1 140 LYS N -58.19 -31.71 -53.69 -59.93 -42.31 1.74 4 0 "[ . 1 . 2]"
104 . 1 138 TYR N 1 138 TYR CA 1 138 TYR C 1 139 ARG N -51.05 -30.69 -28.46 -28.07 -28.50 4.18 15 0 "[ . 1 . 2]"
105 . 1 137 VAL N 1 137 VAL CA 1 137 VAL C 1 138 TYR N -43.92 -34.08 -33.33 -33.23 -33.29 2.40 9 0 "[ . 1 . 2]"
106 . 1 136 LYS N 1 136 LYS CA 1 136 LYS C 1 137 VAL N -50.19 -28.67 -40.13 -41.71 -42.32 . . 0 "[ . 1 . 2]"
107 . 1 135 LYS N 1 135 LYS CA 1 135 LYS C 1 136 LYS N -57.65 -25.57 -38.94 -49.35 -31.10 . . 0 "[ . 1 . 2]"
108 . 1 134 VAL N 1 134 VAL CA 1 134 VAL C 1 135 LYS N -59.70 -23.62 -55.00 -55.24 -57.44 0.41 14 0 "[ . 1 . 2]"
109 . 1 133 GLN N 1 133 GLN CA 1 133 GLN C 1 134 VAL N -50.31 -34.47 -36.04 -40.07 -33.52 0.95 14 0 "[ . 1 . 2]"
110 . 1 132 GLU N 1 132 GLU CA 1 132 GLU C 1 133 GLN N -48.59 -30.83 -36.84 -48.05 -30.77 0.06 1 0 "[ . 1 . 2]"
111 . 1 131 PRO N 1 131 PRO CA 1 131 PRO C 1 132 GLU N -51.86 -7.90 -35.79 -43.23 -31.46 . . 0 "[ . 1 . 2]"
112 . 1 126 ALA N 1 126 ALA CA 1 126 ALA C 1 127 ASP N -51.35 -14.47 -12.54 -12.52 -12.62 2.53 16 0 "[ . 1 . 2]"
113 . 1 123 VAL N 1 123 VAL CA 1 123 VAL C 1 124 GLY N 121.58 158.46 124.60 126.23 125.53 0.46 12 0 "[ . 1 . 2]"
114 . 1 121 LYS N 1 121 LYS CA 1 121 LYS C 1 122 PRO N 64.03 163.79 95.56 98.17 97.19 . . 0 "[ . 1 . 2]"
115 . 1 120 TRP N 1 120 TRP CA 1 120 TRP C 1 121 LYS N 108.50 144.22 129.22 130.24 129.24 . . 0 "[ . 1 . 2]"
116 . 1 111 THR N 1 111 THR CA 1 111 THR C 1 112 VAL N -55.27 3.41 5.43 4.88 6.02 2.61 15 0 "[ . 1 . 2]"
117 . 1 110 HIS N 1 110 HIS CA 1 110 HIS C 1 111 THR N -57.46 -28.90 -26.17 -26.27 -26.53 3.66 9 0 "[ . 1 . 2]"
118 . 1 109 MET N 1 109 MET CA 1 109 MET C 1 110 HIS N -57.64 -23.44 -26.06 -35.40 -22.03 1.41 11 0 "[ . 1 . 2]"
119 . 1 107 SER N 1 107 SER CA 1 107 SER C 1 108 THR N -49.38 17.26 2.00 -0.71 -1.91 . . 0 "[ . 1 . 2]"
120 . 1 106 LEU N 1 106 LEU CA 1 106 LEU C 1 107 SER N -57.04 -24.60 -21.37 -22.30 -20.54 4.06 1 0 "[ . 1 . 2]"
121 . 1 105 LEU N 1 105 LEU CA 1 105 LEU C 1 106 LEU N -51.88 -22.36 -46.86 -50.74 -42.12 . . 0 "[ . 1 . 2]"
122 . 1 104 ALA N 1 104 ALA CA 1 104 ALA C 1 105 LEU N -57.70 -18.98 -40.69 -42.95 -38.10 . . 0 "[ . 1 . 2]"
123 . 1 103 ARG N 1 103 ARG CA 1 103 ARG C 1 104 ALA N -63.10 -18.18 -40.27 -41.22 -42.23 . . 0 "[ . 1 . 2]"
124 . 1 96 GLU N 1 96 GLU CA 1 96 GLU C 1 97 GLY N -56.55 -10.23 -8.05 -9.12 -7.40 2.83 10 0 "[ . 1 . 2]"
125 . 1 95 ILE N 1 95 ILE CA 1 95 ILE C 1 96 GLU N -57.44 -27.00 -43.47 -43.96 -44.23 . . 0 "[ . 1 . 2]"
126 . 1 94 TRP N 1 94 TRP CA 1 94 TRP C 1 95 ILE N -52.34 -28.10 -42.12 -43.70 -44.31 . . 0 "[ . 1 . 2]"
127 . 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 TRP N -50.05 -28.49 -28.90 -29.03 -29.04 1.97 14 0 "[ . 1 . 2]"
128 . 1 92 LEU N 1 92 LEU CA 1 92 LEU C 1 93 GLU N -58.79 -18.15 -32.09 -30.64 -32.23 . . 0 "[ . 1 . 2]"
129 . 1 91 ILE N 1 91 ILE CA 1 91 ILE C 1 92 LEU N -49.85 -24.41 -48.22 -49.52 -49.82 2.92 18 0 "[ . 1 . 2]"
130 . 1 90 LYS N 1 90 LYS CA 1 90 LYS C 1 91 ILE N -46.02 -28.22 -35.73 -42.55 -28.05 0.17 4 0 "[ . 1 . 2]"
131 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 LYS N -51.71 -23.47 -35.90 -48.44 -23.14 0.33 6 0 "[ . 1 . 2]"
132 . 1 88 LYS N 1 88 LYS CA 1 88 LYS C 1 89 LEU N -48.59 -31.27 -28.84 -30.86 -26.41 4.86 7 0 "[ . 1 . 2]"
133 . 1 87 GLU N 1 87 GLU CA 1 87 GLU C 1 88 LYS N -47.95 -29.75 -34.09 -31.11 -31.92 3.02 12 0 "[ . 1 . 2]"
134 . 1 85 ASP N 1 85 ASP CA 1 85 ASP C 1 86 PRO N 72.57 -174.99 142.29 137.74 153.44 . . 0 "[ . 1 . 2]"
135 . 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 LYS N -55.43 2.37 -1.45 -10.96 3.69 1.32 18 0 "[ . 1 . 2]"
136 . 1 80 MET N 1 80 MET CA 1 80 MET C 1 81 ALA N -58.79 -5.55 -33.52 -35.16 -35.22 . . 0 "[ . 1 . 2]"
137 . 1 79 GLU N 1 79 GLU CA 1 79 GLU C 1 80 MET N -68.23 -10.43 -37.53 -32.32 -40.87 . . 0 "[ . 1 . 2]"
138 . 1 78 GLU N 1 78 GLU CA 1 78 GLU C 1 79 GLU N -61.56 -20.08 -45.27 -61.81 -27.69 0.25 5 0 "[ . 1 . 2]"
139 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 GLU N -57.80 -19.08 -25.34 -19.42 -20.59 0.53 12 0 "[ . 1 . 2]"
140 . 1 76 ARG N 1 76 ARG CA 1 76 ARG C 1 77 LYS N -63.65 -5.73 -18.57 -41.46 -2.81 2.92 14 0 "[ . 1 . 2]"
141 . 1 75 MET N 1 75 MET CA 1 75 MET C 1 76 ARG N -63.01 -12.73 -56.74 -57.19 -59.56 2.11 12 0 "[ . 1 . 2]"
142 . 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 MET N -59.21 -21.73 -34.30 -57.93 -20.68 1.05 1 0 "[ . 1 . 2]"
143 . 1 73 ALA N 1 73 ALA CA 1 73 ALA C 1 74 GLU N -63.31 -2.95 -19.63 -19.75 -19.89 . . 0 "[ . 1 . 2]"
144 . 1 71 THR N 1 71 THR CA 1 71 THR C 1 72 ILE N 83.13 169.17 136.91 104.25 162.16 . . 0 "[ . 1 . 2]"
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