Residue Dist Surf HB Arom Phob DC Trace status
9   THR* 3.0 12.0 + - - - Conserved
11  ARG* 2.7 58.9 + - - + Neutral
14  GLY* 2.8 24.6 - - - - Conserved
15  ARG* 2.5 50.3 + - - - Neutral
16  THR* 2.5 44.0 + - - - Conserved
72  PRO* 3.1 12.1 - - - + Neutral
73  GLU* 2.9 41.1 + - + + Conserved
74  TYR* 2.7 68.4 + + + - Conserved
75  HIS* 2.9 58.6 + + + + Conserved
76  SER* 2.9 27.4 + - - - Neutral
104 VAL* 3.0 37.1 + - - + Neutral
105 ALA* 3.3 33.6 + - + + Neutral
106 GLY* 3.1 30.4 + - - - Neutral
110 GLY* 3.5 12.4 - - - - Conserved
Dist- nearest distance (A°) between atoms of the ligand and the residue
Surf- contact surface area (A°) between the ligand and the residue
HB- hydrophobic-hydrophilic contact (hydrogen bond)
Arom- aromatic-aromatic contact
Phob- hydrophobic-hydrophobic contact
DC- hydrophobic-hydrophilic contact (destabilizing contact)
+/- - indicates presence/absence of a specific contacts
* - indicates residues contacting ligand by their side chain (including CA atoms)
Table 1: Active residue shown in 1NNI showing their trace status