G4LUZ0_SCHMA Loading...

Eukaryotic translation initiation factor 3 subunit K

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession G4LUZ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 242 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56.6	Low	85.2	Confident	221 Å²	221	83.4 Å²	83.4	100%	1.089	43%	0.426	S	S	*	.				0	133.4	0	-77.1	-179.9	176.9	0	0	107.4	R3	M1-R3 PolarHBondContact O-N 2.63Å
2	D	85	Confident	85.4	Confident	102 Å²	102	87.3 Å²	87.3	55%	0.545	44%	0.441	S	S	.	.			trans	-64	114.1	177	177.1	8.3	0	0	0	109.7	K4 A5 V6	D2-K4 PolarHBondContact O-N 3.35Å; D2-K4 PolarHBondContact OD1-N 3.4Å; D2-K4 VanDerWaalsContact OD1-N 3.09Å; D2-A5 HydrophobicContact CB-CB 3.98Å; D2-A5 WeakPolarHBondContact O-CB 3.3Å; D2-A5 PolarHBondContact O-N 3.43Å; D2-A5 VanDerWaalsContact O-N 3.16Å; D2-V6 PolarHBondContact O-N 2.84Å
3	R	85.6	Confident	85.5	Confident	108 Å²	108	85.3 Å²	85.3	41%	0.408	46%	0.456	S	S	.	.	H	α-helix	trans	-61.2	-34.6	-177.8	-78.8	-168.2	177.8	-161.1	-6.8	111.4	M1 A5 V6 I7 W31	M1-R3 PolarHBondContact O-N 2.63Å; R3-A5 VanDerWaalsContact C-N 3.33Å; R3-A5 PolarHBondContact O-N 3.36Å; R3-V6 PolarHBondContact O-N 2.86Å; R3-I7 WeakPolarHBondContact O-CG1 3.5Å; R3-I7 PolarHBondContact O-N 2.73Å; R3-W31 VanDerWaalsContact CZ-CD1 3.41Å; R3-W31 VanDerWaalsContact NH1-CB 3.32Å
4	K	88.8	Confident	85.5	Confident	56 Å²	56	90 Å²	90	24%	0.243	48%	0.479	C	S	.	.	H	α-helix	trans	-63.2	-41.8	176.6	-62.8	-165.3	-173.8	179.4	0	111.3	D2 V6 I7 K8 D37 Y38 D39	D2-K4 PolarHBondContact O-N 3.35Å; D2-K4 PolarHBondContact OD1-N 3.4Å; D2-K4 VanDerWaalsContact OD1-N 3.09Å; K4-V6 VanDerWaalsContact C-N 3.3Å; K4-V6 PolarHBondContact O-N 3.26Å; K4-I7 PolarHBondContact O-N 3.23Å; K4-K8 VanDerWaalsContact O-CB 3.27Å; K4-K8 WeakPolarHBondContact O-CB 3.48Å; K4-K8 PolarHBondContact O-N 3.48Å; K4-D37 VanDerWaalsContact CE-CG 3.42Å; K4-D37 WeakPolarHBondContact CE-OD1 3.36Å; K4-D37 WeakPolarHBondContact CE-OD2 3.37Å; K4-D37 VanDerWaalsContact NZ-CG 3.28Å; K4-D37 IonicContact NZ-OD1 3.79Å; K4-D37 PolarHBondContact NZ-OD1 2.86Å; K4-D37 IonicContact NZ-OD2 2.86Å; K4-D37 PolarHBondContact NZ-OD2 3.1Å; K4-D37 VanDerWaalsContact NZ-OD2 3.16Å; K4-Y38 PolarHBondContact NZ-O 3.22Å; K4-D39 HydrophobicContact CD-CB 4.27Å; K4-D39 WeakPolarHBondContact CG-OD2 3.34Å
5	A	89	Confident	85.7	Confident	51 Å²	51	90.2 Å²	90.2	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-62.3	-36.7	176	0	0	0	0	0	112.6	D2 R3 S9	D2-A5 HydrophobicContact CB-CB 3.98Å; D2-A5 WeakPolarHBondContact O-CB 3.3Å; D2-A5 PolarHBondContact O-N 3.43Å; D2-A5 VanDerWaalsContact O-N 3.16Å; R3-A5 VanDerWaalsContact C-N 3.33Å; R3-A5 PolarHBondContact O-N 3.36Å; A5-S9 PolarHBondContact O-N 2.98Å; A5-S9 PolarHBondContact O-OG 2.84Å
6	V	89.5	Confident	85.9	Confident	62 Å²	62	86.1 Å²	86.1	38%	0.376	46%	0.457	S	S	.	.	H	α-helix	trans	-67.7	-41.2	175.9	177.7	0	0	0	0	111.7	D2 R3 K4 S9 K10	D2-V6 PolarHBondContact O-N 2.84Å; R3-V6 PolarHBondContact O-N 2.86Å; K4-V6 VanDerWaalsContact C-N 3.3Å; K4-V6 PolarHBondContact O-N 3.26Å; V6-S9 PolarHBondContact O-OG 2.99Å; V6-K10 WeakPolarHBondContact O-CG 3.49Å; V6-K10 PolarHBondContact O-N 2.98Å
7	I	90.6	Very high	86.1	Confident	14 Å²	14	87.3 Å²	87.3	7%	0.072	46%	0.455	C	S	.	.	H	α-helix	trans	-68.4	-43.4	175.7	-65.4	-62.3	0	0	0	110.6	R3 K4 S9 K10 L11 L25 H28 A42	R3-I7 WeakPolarHBondContact O-CG1 3.5Å; R3-I7 PolarHBondContact O-N 2.73Å; K4-I7 PolarHBondContact O-N 3.23Å; I7-S9 VanDerWaalsContact C-N 3.28Å; I7-S9 PolarHBondContact O-N 2.66Å; I7-K10 WeakPolarHBondContact O-CB 3.3Å; I7-K10 PolarHBondContact O-N 3Å; I7-K10 VanDerWaalsContact O-N 3.1Å; I7-L11 HydrophobicContact CG2-CD1 3.85Å; I7-L11 HydrophobicContact CG2-CG 4.36Å; I7-L11 WeakPolarHBondContact O-CG 3.43Å; I7-L11 PolarHBondContact O-N 3.14Å; I7-L11 VanDerWaalsContact O-N 3.11Å; I7-L25 HydrophobicContact CG2-CD2 3.69Å; I7-H28 HydrophobicContact CD1-CB 3.99Å; I7-H28 HydrophobicContact CG1-CB 4.01Å; I7-A42 HydrophobicContact CG2-CB 3.87Å
8	K	89.9	Confident	86.4	Confident	113 Å²	113	84.5 Å²	84.5	49%	0.491	44%	0.44	S	S	.	.	H	α-helix	trans	-62.2	-33.9	178.6	-170.9	165	-171.7	131	0	113	K4 L11 Q12 E41	K4-K8 VanDerWaalsContact O-CB 3.27Å; K4-K8 WeakPolarHBondContact O-CB 3.48Å; K4-K8 PolarHBondContact O-N 3.48Å; K8-L11 PolarHBondContact O-N 3.44Å; K8-Q12 WeakPolarHBondContact O-CG 3.45Å; K8-E41 IonicContact NZ-OE1 2.81Å; K8-E41 IonicContact NZ-OE2 3.39Å; K8-E41 PolarHBondContact NZ-OE2 3.43Å
9	S	89.2	Confident	86.8	Confident	69 Å²	69	81.8 Å²	81.8	48%	0.483	43%	0.429	S	S	.	.	H	α-helix	trans	-72	-32.2	175	67.8	0	0	0	0	112.8	A5 V6 I7 L11	A5-S9 PolarHBondContact O-N 2.98Å; A5-S9 PolarHBondContact O-OG 2.84Å; V6-S9 PolarHBondContact O-OG 2.99Å; I7-S9 VanDerWaalsContact C-N 3.28Å; I7-S9 PolarHBondContact O-N 2.66Å; S9-L11 VanDerWaalsContact C-N 3.34Å
10	K	86.2	Confident	87.1	Confident	87 Å²	87	85.6 Å²	85.6	38%	0.378	44%	0.444	S	S	.	.	H	α-helix	trans	-68.4	-31.3	173.3	-74.9	175.6	167.2	-72.9	0	113	V6 I7 Q12 E15 H21	V6-K10 WeakPolarHBondContact O-CG 3.49Å; V6-K10 PolarHBondContact O-N 2.98Å; I7-K10 WeakPolarHBondContact O-CB 3.3Å; I7-K10 PolarHBondContact O-N 3Å; I7-K10 VanDerWaalsContact O-N 3.1Å; K10-Q12 VanDerWaalsContact C-N 3.32Å; K10-Q12 PolarHBondContact O-N 3.35Å; K10-E15 VanDerWaalsContact O-CB 3.25Å; K10-E15 WeakPolarHBondContact O-CB 3.19Å; K10-H21 PolarHBondContact O-CE1 3.42Å
11	L	86.8	Confident	87.3	Confident	34 Å²	34	82.5 Å²	82.5	18%	0.178	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	25.2	-175.2	-62	177.4	0	0	0	114.1	I7 K8 S9 L25 A45	I7-L11 HydrophobicContact CG2-CD1 3.85Å; I7-L11 HydrophobicContact CG2-CG 4.36Å; I7-L11 WeakPolarHBondContact O-CG 3.43Å; I7-L11 PolarHBondContact O-N 3.14Å; I7-L11 VanDerWaalsContact O-N 3.11Å; K8-L11 PolarHBondContact O-N 3.44Å; S9-L11 VanDerWaalsContact C-N 3.34Å; L11-L25 HydrophobicContact CD1-CD2 4.15Å; L11-L25 HydrophobicContact CD2-CD1 4.36Å; L11-A45 HydrophobicContact CD1-CB 3.61Å; L11-A45 HydrophobicContact CD2-CB 4.23Å
12	Q	87.1	Confident	89.2	Confident	130 Å²	130	72.4 Å²	72.4	61%	0.607	38%	0.378	S	S	*	.	S	Bend	trans	-89	130.9	-177.4	-64.7	-169.8	-6.3	0	0	112.8	K8 K10 I14 E15	K8-Q12 WeakPolarHBondContact O-CG 3.45Å; K10-Q12 VanDerWaalsContact C-N 3.32Å; K10-Q12 PolarHBondContact O-N 3.35Å; Q12-I14 PolarHBondContact O-N 3.06Å; Q12-E15 WeakPolarHBondContact O-CB 3.37Å; Q12-E15 PolarHBondContact O-N 3.36Å
13	G	87.7	Confident	89.6	Confident	62 Å²	62	70.7 Å²	70.7	64%	0.639	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	62.8	-129	175.1	0	0	0	0	0	112.5	E15 S16	G13-E15 VanDerWaalsContact C-N 3.27Å; G13-E15 PolarHBondContact O-N 3.08Å; G13-S16 PolarHBondContact O-N 2.95Å; G13-S16 PolarHBondContact O-OG 2.99Å
14	I	85.5	Confident	90	Very high	151 Å²	151	66.8 Å²	66.8	77%	0.774	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-69.9	-26.9	-175.2	-57.5	167	0	0	0	111.3	Q12 S16 Y17	Q12-I14 PolarHBondContact O-N 3.06Å; I14-S16 PolarHBondContact O-N 3.3Å; I14-S16 VanDerWaalsContact O-N 3.09Å; I14-Y17 PolarHBondContact O-N 3Å
15	E	88.5	Confident	90.3	Very high	93 Å²	93	64.3 Å²	64.3	44%	0.435	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-63	-17.2	178.7	-70.6	-58.2	143.5	0	0	113.7	K10 Q12 G13 Y17 N18 H21	K10-E15 VanDerWaalsContact O-CB 3.25Å; K10-E15 WeakPolarHBondContact O-CB 3.19Å; Q12-E15 WeakPolarHBondContact O-CB 3.37Å; Q12-E15 PolarHBondContact O-N 3.36Å; G13-E15 VanDerWaalsContact C-N 3.27Å; G13-E15 PolarHBondContact O-N 3.08Å; E15-Y17 PolarHBondContact O-N 3.35Å; E15-N18 WeakPolarHBondContact O-CB 3.5Å; E15-N18 PolarHBondContact O-N 3.16Å; E15-N18 VanDerWaalsContact O-N 3.16Å; E15-N18 PolarHBondContact OE2-ND2 3.11Å; E15-N18 VanDerWaalsContact OE2-ND2 3.1Å; E15-H21 PolarHBondContact O-CE1 3.34Å; E15-H21 PolarHBondContact O-ND1 3.42Å; E15-H21 IonicContact OE2-CE1 2.68Å; E15-H21 PolarHBondContact OE2-CE1 3Å
16	S	87.9	Confident	90.7	Very high	25 Å²	25	64.1 Å²	64.1	18%	0.175	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-63.7	-15.8	172.7	62.6	0	0	0	0	114.1	G13 I14	G13-S16 PolarHBondContact O-N 2.95Å; G13-S16 PolarHBondContact O-OG 2.99Å; I14-S16 PolarHBondContact O-N 3.3Å; I14-S16 VanDerWaalsContact O-N 3.09Å
17	Y	90.4	Very high	90.9	Very high	106 Å²	106	66.9 Å²	66.9	42%	0.416	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-106.5	3.9	178	-58	-86.4	0	0	0	112.9	I14 E15 P19 F52 Y53	I14-Y17 PolarHBondContact O-N 3Å; E15-Y17 PolarHBondContact O-N 3.35Å; Y17-P19 WeakPolarHBondContact O-CD 3.23Å; Y17-F52 AromaticContact CD1-CD2 3.72Å; Y17-F52 HydrophobicContact CD1-CD2 3.72Å; Y17-F52 AromaticContact CD1-CE2 3.23Å; Y17-F52 HydrophobicContact CD1-CE2 3.23Å; Y17-F52 HydrophobicContact CD1-CZ 4.02Å; Y17-F52 HydrophobicContact CE1-CD2 4.2Å; Y17-F52 AromaticContact CE1-CE2 3.25Å; Y17-F52 HydrophobicContact CE1-CE2 3.25Å; Y17-F52 AromaticContact CE1-CZ 3.69Å; Y17-F52 HydrophobicContact CE1-CZ 3.69Å; Y17-Y53 WeakPolarHBondContact O-CE2 3.37Å; Y17-Y53 PolarHBondContact O-OH 3.3Å
18	N	91.7	Very high	91.1	Very high	37 Å²	37	66.6 Å²	66.6	20%	0.198	36%	0.356	C	S	.	.			trans	-75	118	-179.5	-176	-9.3	0	0	0	110.6	E15 E20 H21	E15-N18 WeakPolarHBondContact O-CB 3.5Å; E15-N18 PolarHBondContact O-N 3.16Å; E15-N18 VanDerWaalsContact O-N 3.16Å; E15-N18 PolarHBondContact OE2-ND2 3.11Å; E15-N18 VanDerWaalsContact OE2-ND2 3.1Å; N18-E20 PolarHBondContact O-N 3.41Å; N18-E20 WeakPolarHBondContact OD1-CB 3.43Å; N18-E20 WeakPolarHBondContact OD1-CG 3.38Å; N18-E20 PolarHBondContact OD1-N 2.82Å; N18-H21 WeakPolarHBondContact O-CB 3.17Å; N18-H21 PolarHBondContact O-N 3.14Å; N18-H21 VanDerWaalsContact O-N 3.14Å
19	P	92.8	Very high	91.4	Very high	34 Å²	34	61.2 Å²	61.2	22%	0.221	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.3	-178.6	26.1	-33.7	0	0	0	113.5	Y17 H21 I22 Y53	Y17-P19 WeakPolarHBondContact O-CD 3.23Å; P19-H21 PolarHBondContact O-N 2.91Å; P19-I22 HydrophobicContact CB-CD1 4.32Å; P19-I22 WeakPolarHBondContact O-CB 2.85Å; P19-I22 WeakPolarHBondContact O-CG1 3.35Å; P19-I22 PolarHBondContact O-N 3.4Å; P19-Y53 HydrophobicContact CB-CD1 4.24Å; P19-Y53 HydrophobicContact CB-CD2 3.81Å; P19-Y53 HydrophobicContact CB-CE1 4.2Å; P19-Y53 HydrophobicContact CB-CE2 3.76Å; P19-Y53 HydrophobicContact CB-CG 4.06Å; P19-Y53 HydrophobicContact CG-CE1 4.04Å; P19-Y53 HydrophobicContact CG-CE2 4.07Å
20	E	92.8	Very high	91.6	Very high	157 Å²	157	60.7 Å²	60.7	73%	0.734	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.3	175.6	-62.6	-174.6	161.7	0	0	112.5	N18 I22	N18-E20 PolarHBondContact O-N 3.41Å; N18-E20 WeakPolarHBondContact OD1-CB 3.43Å; N18-E20 WeakPolarHBondContact OD1-CG 3.38Å; N18-E20 PolarHBondContact OD1-N 2.82Å; E20-I22 VanDerWaalsContact C-N 3.29Å; E20-I22 PolarHBondContact O-N 2.81Å
21	H	92.7	Very high	92	Very high	21 Å²	21	59.1 Å²	59.1	10%	0.097	32%	0.321	C	S	.	.	H	α-helix	trans	-76.1	-13.2	177.1	-65.7	156	0	0	0	114	K10 E15 N18 P19 A23 A24 L25 L49	K10-H21 PolarHBondContact O-CE1 3.42Å; E15-H21 PolarHBondContact O-CE1 3.34Å; E15-H21 PolarHBondContact O-ND1 3.42Å; E15-H21 IonicContact OE2-CE1 2.68Å; E15-H21 PolarHBondContact OE2-CE1 3Å; N18-H21 WeakPolarHBondContact O-CB 3.17Å; N18-H21 PolarHBondContact O-N 3.14Å; N18-H21 VanDerWaalsContact O-N 3.14Å; P19-H21 PolarHBondContact O-N 2.91Å; H21-A23 PolarHBondContact O-N 3.41Å; H21-A24 PolarHBondContact O-N 2.99Å; H21-L25 HydrophobicContact CB-CD1 4.48Å; H21-L25 WeakPolarHBondContact O-CG 3.22Å; H21-L25 PolarHBondContact O-N 3.35Å; H21-L49 HydrophobicContact CB-CD1 4.34Å
22	I	94.6	Very high	92.4	Very high	8 Å²	8	57.5 Å²	57.5	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-56.3	-49.6	-179.9	-68.2	170.8	0	0	0	110.7	P19 E20 A24 L25 E26 L46 L49 Y50 R56	P19-I22 HydrophobicContact CB-CD1 4.32Å; P19-I22 WeakPolarHBondContact O-CB 2.85Å; P19-I22 WeakPolarHBondContact O-CG1 3.35Å; P19-I22 PolarHBondContact O-N 3.4Å; E20-I22 VanDerWaalsContact C-N 3.29Å; E20-I22 PolarHBondContact O-N 2.81Å; I22-A24 VanDerWaalsContact C-N 3.32Å; I22-A24 PolarHBondContact O-N 3.41Å; I22-L25 PolarHBondContact O-N 2.9Å; I22-L25 VanDerWaalsContact O-N 3.1Å; I22-E26 HydrophobicContact CG2-CG 4.25Å; I22-E26 WeakPolarHBondContact O-CG 3.4Å; I22-E26 PolarHBondContact O-N 3.48Å; I22-L46 HydrophobicContact CG2-CD1 4.19Å; I22-L49 HydrophobicContact CD1-CB 4.12Å; I22-L49 HydrophobicContact CG1-CB 3.85Å; I22-L49 HydrophobicContact CG1-CD1 3.89Å; I22-L49 HydrophobicContact CG1-CG 4.44Å; I22-Y50 HydrophobicContact CG2-CE1 3.75Å; I22-R56 HydrophobicContact CD1-CB 3.8Å; I22-R56 HydrophobicContact CD1-CG 4.35Å
23	A	94.4	Very high	92.6	Very high	67 Å²	67	52.1 Å²	52.1	55%	0.554	29%	0.287	S	S	*	.	H	α-helix	trans	-60.9	-40.2	-179.2	0	0	0	0	0	112.6	H21 L25 E26 E27	H21-A23 PolarHBondContact O-N 3.41Å; A23-L25 VanDerWaalsContact C-N 3.34Å; A23-E26 PolarHBondContact O-N 3.09Å; A23-E27 PolarHBondContact O-N 3.01Å
24	A	93.9	Very high	92.8	Very high	26 Å²	26	55.6 Å²	55.6	22%	0.215	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-35.7	177	0	0	0	0	0	112.2	H21 I22 H28	H21-A24 PolarHBondContact O-N 2.99Å; I22-A24 VanDerWaalsContact C-N 3.32Å; I22-A24 PolarHBondContact O-N 3.41Å; A24-H28 WeakPolarHBondContact O-CB 3.44Å; A24-H28 PolarHBondContact O-N 3.25Å
25	L	95.2	Very high	93	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-72.7	-37.4	176.9	-71.1	168	0	0	0	112.4	I7 L11 H21 I22 A23 H28 L29 A42 A45 L46 L49	I7-L25 HydrophobicContact CG2-CD2 3.69Å; L11-L25 HydrophobicContact CD1-CD2 4.15Å; L11-L25 HydrophobicContact CD2-CD1 4.36Å; H21-L25 HydrophobicContact CB-CD1 4.48Å; H21-L25 WeakPolarHBondContact O-CG 3.22Å; H21-L25 PolarHBondContact O-N 3.35Å; I22-L25 PolarHBondContact O-N 2.9Å; I22-L25 VanDerWaalsContact O-N 3.1Å; A23-L25 VanDerWaalsContact C-N 3.34Å; L25-H28 PolarHBondContact O-N 2.96Å; L25-L29 WeakPolarHBondContact O-CB 3.08Å; L25-L29 PolarHBondContact O-N 3.42Å; L25-A42 HydrophobicContact CD2-CB 4.09Å; L25-A45 HydrophobicContact CD1-CB 4.46Å; L25-L46 HydrophobicContact CB-CB 4.15Å; L25-L46 HydrophobicContact CB-CD1 3.92Å; L25-L46 HydrophobicContact CB-CG 4.42Å; L25-L46 HydrophobicContact CD1-CB 4.19Å; L25-L46 HydrophobicContact CD1-CD1 4.45Å; L25-L49 HydrophobicContact CD1-CD1 3.57Å
26	E	96.3	Very high	93.1	Very high	46 Å²	46	52.3 Å²	52.3	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-40.3	173.6	-69.5	-179	168.2	0	0	111.8	I22 A23 L29 S30 L46 Y50 N58 C61	I22-E26 HydrophobicContact CG2-CG 4.25Å; I22-E26 WeakPolarHBondContact O-CG 3.4Å; I22-E26 PolarHBondContact O-N 3.48Å; A23-E26 PolarHBondContact O-N 3.09Å; E26-L29 PolarHBondContact O-N 2.81Å; E26-S30 PolarHBondContact O-N 2.68Å; E26-S30 PolarHBondContact O-OG 3.18Å; E26-L46 HydrophobicContact CG-CD1 4.19Å; E26-L46 HydrophobicContact CG-CD2 4.47Å; E26-Y50 WeakPolarHBondContact CG-OH 3.44Å; E26-Y50 PolarHBondContact OE1-OH 2.94Å; E26-N58 PolarHBondContact OE1-ND2 2.94Å; E26-C61 HydrophobicContact CG-CB 4.38Å
27	E	95.2	Very high	93.2	Very high	121 Å²	121	53.3 Å²	53.3	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-64.6	-41.7	172.5	-167.6	-169.3	160.3	0	0	111.2	A23 S30 W31	A23-E27 PolarHBondContact O-N 3.01Å; E27-S30 WeakPolarHBondContact O-CB 3.43Å; E27-S30 PolarHBondContact O-N 2.66Å; E27-W31 PolarHBondContact O-N 3.02Å
28	H	95.2	Very high	93.3	Very high	7 Å²	7	50.6 Å²	50.6	3%	0.032	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-39.9	175.4	-174.1	61.7	0	0	0	112.2	I7 A24 L25 S30 W31 Q32 D39	I7-H28 HydrophobicContact CD1-CB 3.99Å; I7-H28 HydrophobicContact CG1-CB 4.01Å; A24-H28 WeakPolarHBondContact O-CB 3.44Å; A24-H28 PolarHBondContact O-N 3.25Å; L25-H28 PolarHBondContact O-N 2.96Å; H28-S30 VanDerWaalsContact C-N 3.34Å; H28-S30 PolarHBondContact O-N 2.67Å; H28-W31 AromaticContact CE1-CE3 3.92Å; H28-W31 AromaticContact ND1-CE3 3.91Å; H28-W31 WeakPolarHBondContact O-CB 3.47Å; H28-W31 PolarHBondContact O-N 3.4Å; H28-Q32 WeakPolarHBondContact O-CG 3.47Å; H28-Q32 PolarHBondContact O-N 2.85Å; H28-D39 IonicContact CD2-OD2 3.58Å; H28-D39 IonicContact CE1-OD2 2.77Å; H28-D39 IonicContact NE2-OD2 3.82Å; H28-D39 PolarHBondContact NE2-OD2 3.32Å
29	L	95.5	Very high	93.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-43	173	178.4	62.9	0	0	0	111.6	L25 E26 W31 Q32 I33 L46 C61 L64 V65	L25-L29 WeakPolarHBondContact O-CB 3.08Å; L25-L29 PolarHBondContact O-N 3.42Å; E26-L29 PolarHBondContact O-N 2.81Å; L29-W31 VanDerWaalsContact C-N 3.3Å; L29-W31 PolarHBondContact O-N 3.33Å; L29-Q32 WeakPolarHBondContact O-CB 3.38Å; L29-Q32 PolarHBondContact O-N 3.46Å; L29-I33 HydrophobicContact CG-CD1 4.36Å; L29-I33 WeakPolarHBondContact O-CD1 3.19Å; L29-I33 WeakPolarHBondContact O-CG1 3.4Å; L29-I33 PolarHBondContact O-N 3.42Å; L29-I33 VanDerWaalsContact O-N 3.09Å; L29-L46 HydrophobicContact CD2-CD2 4.13Å; L29-C61 HydrophobicContact CD2-CB 4.07Å; L29-C61 WeakPolarHBondContact CD2-O 3.42Å; L29-L64 HydrophobicContact CD2-CB 3.95Å; L29-L64 HydrophobicContact CG-CB 4.4Å; L29-V65 HydrophobicContact CD1-CG2 3.99Å; L29-V65 HydrophobicContact CD2-CG2 3.73Å
30	S	94.1	Very high	93.4	Very high	58 Å²	58	50.4 Å²	50.4	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-41.4	174.8	-58.3	0	0	0	0	111.3	E26 E27 H28 I33 I34	E26-S30 PolarHBondContact O-N 2.68Å; E26-S30 PolarHBondContact O-OG 3.18Å; E27-S30 WeakPolarHBondContact O-CB 3.43Å; E27-S30 PolarHBondContact O-N 2.66Å; H28-S30 VanDerWaalsContact C-N 3.34Å; H28-S30 PolarHBondContact O-N 2.67Å; S30-I33 PolarHBondContact O-N 3.2Å; S30-I34 WeakPolarHBondContact O-CG1 3.48Å; S30-I34 PolarHBondContact O-N 3.12Å; S30-I34 VanDerWaalsContact O-N 3.15Å
31	W	94.2	Very high	93.4	Very high	55 Å²	55	48.5 Å²	48.5	21%	0.208	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-41.2	174.1	179	84.5	0	0	0	112.9	R3 E27 H28 L29 I33 I34 N35 D37	R3-W31 VanDerWaalsContact CZ-CD1 3.41Å; R3-W31 VanDerWaalsContact NH1-CB 3.32Å; E27-W31 PolarHBondContact O-N 3.02Å; H28-W31 AromaticContact CE1-CE3 3.92Å; H28-W31 AromaticContact ND1-CE3 3.91Å; H28-W31 WeakPolarHBondContact O-CB 3.47Å; H28-W31 PolarHBondContact O-N 3.4Å; L29-W31 VanDerWaalsContact C-N 3.3Å; L29-W31 PolarHBondContact O-N 3.33Å; W31-I33 VanDerWaalsContact C-N 3.26Å; W31-I33 PolarHBondContact O-N 3.18Å; W31-I34 PolarHBondContact O-N 2.99Å; W31-N35 VanDerWaalsContact CE2-ND2 3.33Å; W31-N35 HydrophobicContact CZ2-CB 4.28Å; W31-N35 PolarHBondContact NE1-ND2 3.22Å; W31-N35 WeakPolarHBondContact O-CB 3.23Å; W31-N35 PolarHBondContact O-N 3.13Å; W31-N35 PolarHBondContact O-ND2 3.2Å; W31-D37 HydrophobicContact CH2-CB 4.34Å; W31-D37 WeakPolarHBondContact CH2-OD2 3.31Å; W31-D37 HydrophobicContact CZ3-CB 4.03Å; W31-D37 VanDerWaalsContact CZ3-OD2 3.25Å; W31-D37 WeakPolarHBondContact CZ3-OD2 3.23Å
32	Q	93.7	Very high	93.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.2	-40.9	175	-76.2	177.1	73.2	0	0	111.3	H28 L29 N36 D37 D39 N43	H28-Q32 WeakPolarHBondContact O-CG 3.47Å; H28-Q32 PolarHBondContact O-N 2.85Å; L29-Q32 WeakPolarHBondContact O-CB 3.38Å; L29-Q32 PolarHBondContact O-N 3.46Å; Q32-N36 CarbonylContact O-C 3.5Å; Q32-N36 WeakPolarHBondContact O-CA 3.35Å; Q32-N36 PolarHBondContact O-N 3.48Å; Q32-D37 WeakPolarHBondContact CB-O 3.43Å; Q32-D37 PolarHBondContact O-N 3.31Å; Q32-D39 HydrophobicContact CG-CB 4.37Å; Q32-N43 PolarHBondContact NE2-OD1 3.36Å; Q32-N43 PolarHBondContact OE1-ND2 3.35Å; Q32-N43 PolarHBondContact OE1-OD1 3.11Å
33	I	92.3	Very high	93.5	Very high	16 Å²	16	47.3 Å²	47.3	8%	0.082	25%	0.25	C	S	.	.	H	α-helix	trans	-67.3	-49	179.4	-66.1	159.4	0	0	0	111	L29 S30 W31 N35 N36 L64 A126 P128	L29-I33 HydrophobicContact CG-CD1 4.36Å; L29-I33 WeakPolarHBondContact O-CD1 3.19Å; L29-I33 WeakPolarHBondContact O-CG1 3.4Å; L29-I33 PolarHBondContact O-N 3.42Å; L29-I33 VanDerWaalsContact O-N 3.09Å; S30-I33 PolarHBondContact O-N 3.2Å; W31-I33 VanDerWaalsContact C-N 3.26Å; W31-I33 PolarHBondContact O-N 3.18Å; I33-N35 VanDerWaalsContact C-N 3.29Å; I33-N35 PolarHBondContact O-N 3.17Å; I33-N36 PolarHBondContact O-N 3.35Å; I33-L64 HydrophobicContact CD1-CB 4.06Å; I33-L64 HydrophobicContact CD1-CD1 3.64Å; I33-L64 HydrophobicContact CD1-CD2 3.71Å; I33-L64 HydrophobicContact CD1-CG 3.99Å; I33-A126 WeakPolarHBondContact CG2-O 3.2Å; I33-P128 VanDerWaalsContact O-CG 3.25Å; I33-P128 WeakPolarHBondContact O-CG 3.44Å
34	I	91.5	Very high	93.5	Very high	135 Å²	135	45.9 Å²	45.9	69%	0.692	23%	0.233	S	C	*	.	H	α-helix	trans	-61.9	-39.3	-178.4	-66.7	166.6	0	0	0	111.3	S30 W31	S30-I34 WeakPolarHBondContact O-CG1 3.48Å; S30-I34 PolarHBondContact O-N 3.12Å; S30-I34 VanDerWaalsContact O-N 3.15Å; W31-I34 PolarHBondContact O-N 2.99Å
35	N	90.7	Very high	93.5	Very high	86 Å²	86	45.3 Å²	45.3	46%	0.46	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	6	-176.6	-63.5	-86.8	0	0	0	113.3	W31 I33 D37	W31-N35 VanDerWaalsContact CE2-ND2 3.33Å; W31-N35 HydrophobicContact CZ2-CB 4.28Å; W31-N35 PolarHBondContact NE1-ND2 3.22Å; W31-N35 WeakPolarHBondContact O-CB 3.23Å; W31-N35 PolarHBondContact O-N 3.13Å; W31-N35 PolarHBondContact O-ND2 3.2Å; I33-N35 VanDerWaalsContact C-N 3.29Å; I33-N35 PolarHBondContact O-N 3.17Å; N35-D37 PolarHBondContact O-N 3.22Å
36	N	89	Confident	93.5	Very high	89 Å²	89	45.2 Å²	45.2	48%	0.476	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	39.3	-173.2	-165.6	27.5	0	0	0	113.5	Q32 I33	Q32-N36 CarbonylContact O-C 3.5Å; Q32-N36 WeakPolarHBondContact O-CA 3.35Å; Q32-N36 PolarHBondContact O-N 3.48Å; I33-N36 PolarHBondContact O-N 3.35Å
37	D	91.4	Very high	93.5	Very high	47 Å²	47	43 Å²	43	25%	0.251	22%	0.218	S	C	.	.			trans	-102	160.6	-179.5	-163.4	2.3	0	0	0	110.5	K4 W31 Q32 N35 K68	K4-D37 VanDerWaalsContact CE-CG 3.42Å; K4-D37 WeakPolarHBondContact CE-OD1 3.36Å; K4-D37 WeakPolarHBondContact CE-OD2 3.37Å; K4-D37 VanDerWaalsContact NZ-CG 3.28Å; K4-D37 IonicContact NZ-OD1 3.79Å; K4-D37 PolarHBondContact NZ-OD1 2.86Å; K4-D37 IonicContact NZ-OD2 2.86Å; K4-D37 PolarHBondContact NZ-OD2 3.1Å; K4-D37 VanDerWaalsContact NZ-OD2 3.16Å; W31-D37 HydrophobicContact CH2-CB 4.34Å; W31-D37 WeakPolarHBondContact CH2-OD2 3.31Å; W31-D37 HydrophobicContact CZ3-CB 4.03Å; W31-D37 VanDerWaalsContact CZ3-OD2 3.25Å; W31-D37 WeakPolarHBondContact CZ3-OD2 3.23Å; Q32-D37 WeakPolarHBondContact CB-O 3.43Å; Q32-D37 PolarHBondContact O-N 3.31Å; N35-D37 PolarHBondContact O-N 3.22Å; D37-K68 WeakPolarHBondContact O-CE 3.29Å; D37-K68 PolarHBondContact O-NZ 3.2Å
38	Y	91.8	Very high	93.5	Very high	49 Å²	49	42.2 Å²	42.2	19%	0.192	21%	0.21	C	C	.	.			trans	-135.1	123	179.3	-176.4	-120.5	0	0	0	110.6	K4 F40 K68 S72 D77	K4-Y38 PolarHBondContact NZ-O 3.22Å; Y38-F40 HydrophobicContact CE1-CB 3.83Å; Y38-F40 HydrophobicContact CE1-CG 4.49Å; Y38-F40 AromaticContact CZ-CD2 3.99Å; Y38-F40 WeakPolarHBondContact OH-CD2 3.38Å; Y38-K68 HydrophobicContact CD2-CB 4.14Å; Y38-K68 HydrophobicContact CE2-CB 4.16Å; Y38-S72 VanDerWaalsContact CE1-CB 3.41Å; Y38-S72 WeakPolarHBondContact CE1-OG 3.5Å; Y38-S72 PolarHBondContact OH-OG 3.47Å; Y38-D77 WeakPolarHBondContact CE1-OD2 3.45Å; Y38-D77 WeakPolarHBondContact OH-CB 2.99Å; Y38-D77 PolarHBondContact OH-OD2 3.26Å
39	D	93.3	Very high	93.5	Very high	18 Å²	18	41.9 Å²	41.9	10%	0.096	21%	0.208	C	C	.	.			trans	-125	87.1	177.8	-170.2	-14.6	0	0	0	109.3	K4 H28 Q32 E41 A42 N43	K4-D39 HydrophobicContact CD-CB 4.27Å; K4-D39 WeakPolarHBondContact CG-OD2 3.34Å; H28-D39 IonicContact CD2-OD2 3.58Å; H28-D39 IonicContact CE1-OD2 2.77Å; H28-D39 IonicContact NE2-OD2 3.82Å; H28-D39 PolarHBondContact NE2-OD2 3.32Å; Q32-D39 HydrophobicContact CG-CB 4.37Å; D39-E41 VanDerWaalsContact C-N 3.34Å; D39-E41 PolarHBondContact O-N 2.78Å; D39-A42 HydrophobicContact CB-CB 4.1Å; D39-A42 VanDerWaalsContact CG-CB 3.47Å; D39-A42 PolarHBondContact O-N 3.49Å; D39-A42 PolarHBondContact OD1-N 2.75Å; D39-N43 WeakPolarHBondContact O-CB 3.18Å; D39-N43 PolarHBondContact O-N 3Å; D39-N43 PolarHBondContact O-ND2 3.04Å; D39-N43 VanDerWaalsContact O-ND2 3.12Å
40	F	93	Very high	93.5	Very high	49 Å²	49	42.1 Å²	42.1	22%	0.215	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-40.9	-176.1	-178.9	-124.4	0	0	0	112.6	Y38 A42 N43 L44 D77 L80	Y38-F40 HydrophobicContact CE1-CB 3.83Å; Y38-F40 HydrophobicContact CE1-CG 4.49Å; Y38-F40 AromaticContact CZ-CD2 3.99Å; Y38-F40 WeakPolarHBondContact OH-CD2 3.38Å; F40-A42 PolarHBondContact O-N 3.37Å; F40-N43 PolarHBondContact O-N 3.25Å; F40-L44 HydrophobicContact CD1-CD1 4.1Å; F40-L44 HydrophobicContact CD2-CD1 4.46Å; F40-L44 HydrophobicContact CD2-CG 4.11Å; F40-L44 HydrophobicContact CE1-CD1 3.53Å; F40-L44 HydrophobicContact CE1-CG 4.2Å; F40-L44 HydrophobicContact CE2-CD1 3.95Å; F40-L44 HydrophobicContact CE2-CD2 3.73Å; F40-L44 HydrophobicContact CE2-CG 3.71Å; F40-L44 HydrophobicContact CZ-CD1 3.46Å; F40-L44 VanDerWaalsContact CZ-CD1 3.46Å; F40-L44 HydrophobicContact CZ-CD2 3.87Å; F40-L44 HydrophobicContact CZ-CG 3.77Å; F40-L44 WeakPolarHBondContact O-CG 3.43Å; F40-L44 PolarHBondContact O-N 3.23Å; F40-D77 HydrophobicContact CD2-CB 3.9Å; F40-D77 HydrophobicContact CE2-CB 3.44Å; F40-D77 VanDerWaalsContact CE2-CB 3.44Å; F40-D77 HydrophobicContact CZ-CB 3.94Å; F40-L80 HydrophobicContact CE1-CD1 4.39Å; F40-L80 HydrophobicContact CZ-CB 4.28Å; F40-L80 HydrophobicContact CZ-CD1 3.83Å
41	E	92.6	Very high	93.4	Very high	117 Å²	117	42.5 Å²	42.5	55%	0.547	20%	0.204	S	C	.	.	H	α-helix	trans	-61.7	-46.1	179.8	-68.1	-175.3	174.3	0	0	111.1	K8 D39 L44 A45	K8-E41 IonicContact NZ-OE1 2.81Å; K8-E41 IonicContact NZ-OE2 3.39Å; K8-E41 PolarHBondContact NZ-OE2 3.43Å; D39-E41 VanDerWaalsContact C-N 3.34Å; D39-E41 PolarHBondContact O-N 2.78Å; E41-L44 PolarHBondContact O-N 2.86Å; E41-A45 WeakPolarHBondContact O-CB 3.41Å; E41-A45 PolarHBondContact O-N 3.43Å
42	A	94.1	Very high	93.4	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.017	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-39	177.2	0	0	0	0	0	112.5	I7 L25 D39 F40 A45 L46	I7-A42 HydrophobicContact CG2-CB 3.87Å; L25-A42 HydrophobicContact CD2-CB 4.09Å; D39-A42 HydrophobicContact CB-CB 4.1Å; D39-A42 VanDerWaalsContact CG-CB 3.47Å; D39-A42 PolarHBondContact O-N 3.49Å; D39-A42 PolarHBondContact OD1-N 2.75Å; F40-A42 PolarHBondContact O-N 3.37Å; A42-A45 PolarHBondContact O-N 3.41Å; A42-L46 PolarHBondContact O-N 2.94Å
43	N	95.2	Very high	93.4	Very high	2 Å²	2	48 Å²	48	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-42.1	178.8	-68.2	-19.6	0	0	0	111.9	Q32 D39 F40 L46 L47 V65	Q32-N43 PolarHBondContact NE2-OD1 3.36Å; Q32-N43 PolarHBondContact OE1-ND2 3.35Å; Q32-N43 PolarHBondContact OE1-OD1 3.11Å; D39-N43 WeakPolarHBondContact O-CB 3.18Å; D39-N43 PolarHBondContact O-N 3Å; D39-N43 PolarHBondContact O-ND2 3.04Å; D39-N43 VanDerWaalsContact O-ND2 3.12Å; F40-N43 PolarHBondContact O-N 3.25Å; N43-L46 PolarHBondContact O-N 2.82Å; N43-L47 WeakPolarHBondContact O-CG 3.42Å; N43-L47 PolarHBondContact O-N 3.19Å; N43-L47 VanDerWaalsContact O-N 3.09Å; N43-V65 HydrophobicContact CB-CG1 3.87Å; N43-V65 HydrophobicContact CB-CG2 4.28Å
44	L	94.3	Very high	93.4	Very high	36 Å²	36	50.1 Å²	50.1	19%	0.188	24%	0.243	C	C	.	.	H	α-helix	trans	-64.2	-40.1	172.9	-70.7	-178.2	0	0	0	111.8	F40 E41 L46 L47 R48 L80 L84	F40-L44 HydrophobicContact CD1-CD1 4.1Å; F40-L44 HydrophobicContact CD2-CD1 4.46Å; F40-L44 HydrophobicContact CD2-CG 4.11Å; F40-L44 HydrophobicContact CE1-CD1 3.53Å; F40-L44 HydrophobicContact CE1-CG 4.2Å; F40-L44 HydrophobicContact CE2-CD1 3.95Å; F40-L44 HydrophobicContact CE2-CD2 3.73Å; F40-L44 HydrophobicContact CE2-CG 3.71Å; F40-L44 HydrophobicContact CZ-CD1 3.46Å; F40-L44 VanDerWaalsContact CZ-CD1 3.46Å; F40-L44 HydrophobicContact CZ-CD2 3.87Å; F40-L44 HydrophobicContact CZ-CG 3.77Å; F40-L44 WeakPolarHBondContact O-CG 3.43Å; F40-L44 PolarHBondContact O-N 3.23Å; E41-L44 PolarHBondContact O-N 2.86Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L46 PolarHBondContact O-N 3.42Å; L44-L47 PolarHBondContact O-N 2.99Å; L44-R48 VanDerWaalsContact O-CB 3.22Å; L44-R48 WeakPolarHBondContact O-CB 3.49Å; L44-R48 PolarHBondContact O-N 3.13Å; L44-L80 HydrophobicContact CD2-CB 4.38Å; L44-L84 HydrophobicContact CB-CD1 4.21Å; L44-L84 HydrophobicContact CD2-CD1 3.51Å; L44-L84 HydrophobicContact CG-CD1 4.43Å
45	A	94.4	Very high	93.5	Very high	15 Å²	15	50.1 Å²	50.1	12%	0.124	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-42.2	177	0	0	0	0	0	111.6	L11 L25 E41 A42 R48 L49	L11-A45 HydrophobicContact CD1-CB 3.61Å; L11-A45 HydrophobicContact CD2-CB 4.23Å; L25-A45 HydrophobicContact CD1-CB 4.46Å; E41-A45 WeakPolarHBondContact O-CB 3.41Å; E41-A45 PolarHBondContact O-N 3.43Å; A42-A45 PolarHBondContact O-N 3.41Å; A45-R48 PolarHBondContact O-N 2.66Å; A45-L49 WeakPolarHBondContact O-CG 3.15Å; A45-L49 PolarHBondContact O-N 3.18Å
46	L	96.1	Very high	93.6	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-51.1	175	178.4	58.5	0	0	0	111.8	I22 L25 E26 L29 A42 N43 L44 R48 L49 Y50 C61 V65	I22-L46 HydrophobicContact CG2-CD1 4.19Å; L25-L46 HydrophobicContact CB-CB 4.15Å; L25-L46 HydrophobicContact CB-CD1 3.92Å; L25-L46 HydrophobicContact CB-CG 4.42Å; L25-L46 HydrophobicContact CD1-CB 4.19Å; L25-L46 HydrophobicContact CD1-CD1 4.45Å; E26-L46 HydrophobicContact CG-CD1 4.19Å; E26-L46 HydrophobicContact CG-CD2 4.47Å; L29-L46 HydrophobicContact CD2-CD2 4.13Å; A42-L46 PolarHBondContact O-N 2.94Å; N43-L46 PolarHBondContact O-N 2.82Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L46 PolarHBondContact O-N 3.42Å; L46-R48 VanDerWaalsContact C-N 3.28Å; L46-R48 PolarHBondContact O-N 3.29Å; L46-L49 PolarHBondContact O-N 3.5Å; L46-Y50 HydrophobicContact CD1-CE1 3.94Å; L46-Y50 HydrophobicContact CD1-CE2 3.93Å; L46-Y50 HydrophobicContact CD2-CE2 4.33Å; L46-Y50 HydrophobicContact CG-CD2 4.4Å; L46-Y50 HydrophobicContact CG-CE2 3.85Å; L46-Y50 PolarHBondContact O-N 2.99Å; L46-C61 HydrophobicContact CD2-CB 4.46Å; L46-V65 HydrophobicContact CD2-CG2 4.24Å
47	L	96	Very high	93.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-36.2	178.4	-66.6	-177.7	0	0	0	112.2	N43 L44 Y50 Q51 A62 V65 C81 L84 I85	N43-L47 WeakPolarHBondContact O-CG 3.42Å; N43-L47 PolarHBondContact O-N 3.19Å; N43-L47 VanDerWaalsContact O-N 3.09Å; L44-L47 PolarHBondContact O-N 2.99Å; L47-Y50 HydrophobicContact CD2-CD2 4.25Å; L47-Y50 WeakPolarHBondContact O-CB 3.44Å; L47-Y50 PolarHBondContact O-N 3.33Å; L47-Q51 PolarHBondContact O-N 3.44Å; L47-A62 HydrophobicContact CD2-CB 4.22Å; L47-V65 HydrophobicContact CD1-CG1 3.66Å; L47-V65 HydrophobicContact CD2-CB 4.44Å; L47-V65 HydrophobicContact CD2-CG1 4.36Å; L47-V65 HydrophobicContact CG-CG1 4.02Å; L47-C81 HydrophobicContact CD1-CB 3.6Å; L47-C81 WeakPolarHBondContact CD1-O 3.32Å; L47-L84 HydrophobicContact CB-CB 3.83Å; L47-L84 HydrophobicContact CB-CD1 3.98Å; L47-L84 HydrophobicContact CD1-CB 4.4Å; L47-I85 HydrophobicContact CD1-CD1 4.45Å; L47-I85 HydrophobicContact CD1-CG1 4.41Å; L47-I85 HydrophobicContact CD2-CD1 4.04Å; L47-I85 HydrophobicContact CD2-CG1 3.93Å
48	R	94.7	Very high	94.1	Very high	104 Å²	104	50.7 Å²	50.7	39%	0.392	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-41.3	175.6	179.5	179	-70.6	170.1	0.2	111.9	L44 A45 L46 Y50 Q51 F52	L44-R48 VanDerWaalsContact O-CB 3.22Å; L44-R48 WeakPolarHBondContact O-CB 3.49Å; L44-R48 PolarHBondContact O-N 3.13Å; A45-R48 PolarHBondContact O-N 2.66Å; L46-R48 VanDerWaalsContact C-N 3.28Å; L46-R48 PolarHBondContact O-N 3.29Å; R48-Y50 VanDerWaalsContact C-N 3.35Å; R48-Q51 WeakPolarHBondContact O-CB 3.5Å; R48-Q51 PolarHBondContact O-N 3.04Å; R48-F52 HydrophobicContact CG-CD2 4Å; R48-F52 HydrophobicContact CG-CE2 3.32Å; R48-F52 HydrophobicContact CG-CZ 3.92Å; R48-F52 VanDerWaalsContact O-CD2 3.22Å; R48-F52 WeakPolarHBondContact O-CD2 3.34Å; R48-F52 PolarHBondContact O-N 3.43Å; R48-F52 VanDerWaalsContact O-N 3.17Å
49	L	94.9	Very high	94.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-42	174.6	-73.7	170.4	0	0	0	111.4	H21 I22 L25 A45 L46 Q51 F52 Y53	H21-L49 HydrophobicContact CB-CD1 4.34Å; I22-L49 HydrophobicContact CD1-CB 4.12Å; I22-L49 HydrophobicContact CG1-CB 3.85Å; I22-L49 HydrophobicContact CG1-CD1 3.89Å; I22-L49 HydrophobicContact CG1-CG 4.44Å; L25-L49 HydrophobicContact CD1-CD1 3.57Å; A45-L49 WeakPolarHBondContact O-CG 3.15Å; A45-L49 PolarHBondContact O-N 3.18Å; L46-L49 PolarHBondContact O-N 3.5Å; L49-Q51 VanDerWaalsContact C-N 3.26Å; L49-Q51 PolarHBondContact O-N 3.48Å; L49-F52 PolarHBondContact O-N 2.83Å; L49-Y53 HydrophobicContact CD2-CD2 4.39Å; L49-Y53 HydrophobicContact CD2-CE2 4.19Å; L49-Y53 WeakPolarHBondContact O-CD2 3.44Å; L49-Y53 PolarHBondContact O-N 3.49Å
50	Y	95.7	Very high	94.2	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-35.7	171.8	-76.4	-17.1	0	0	0	113.4	I22 E26 L46 L47 R48 F52 Y53 R56 F57 N58 C61	I22-Y50 HydrophobicContact CG2-CE1 3.75Å; E26-Y50 WeakPolarHBondContact CG-OH 3.44Å; E26-Y50 PolarHBondContact OE1-OH 2.94Å; L46-Y50 HydrophobicContact CD1-CE1 3.94Å; L46-Y50 HydrophobicContact CD1-CE2 3.93Å; L46-Y50 HydrophobicContact CD2-CE2 4.33Å; L46-Y50 HydrophobicContact CG-CD2 4.4Å; L46-Y50 HydrophobicContact CG-CE2 3.85Å; L46-Y50 PolarHBondContact O-N 2.99Å; L47-Y50 HydrophobicContact CD2-CD2 4.25Å; L47-Y50 WeakPolarHBondContact O-CB 3.44Å; L47-Y50 PolarHBondContact O-N 3.33Å; R48-Y50 VanDerWaalsContact C-N 3.35Å; Y50-F52 VanDerWaalsContact C-N 3.35Å; Y50-Y53 CarbonylContact O-C 3.58Å; Y50-R56 WeakPolarHBondContact CD1-O 3.23Å; Y50-R56 WeakPolarHBondContact CE1-O 3.46Å; Y50-F57 AromaticContact CD2-CD2 3.98Å; Y50-F57 HydrophobicContact CD2-CD2 3.98Å; Y50-F57 HydrophobicContact CD2-CE2 4.21Å; Y50-F57 AromaticContact CG-CD2 3.95Å; Y50-F57 HydrophobicContact CG-CD2 3.95Å; Y50-N58 HydrophobicContact CE1-CB 4.34Å; Y50-N58 WeakPolarHBondContact OH-CB 3.36Å; Y50-C61 HydrophobicContact CE2-CB 4.19Å; Y50-C61 WeakPolarHBondContact OH-CB 3.29Å
51	Q	93.3	Very high	94.3	Very high	67 Å²	67	51.4 Å²	51.4	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-65.2	-38.1	176	-166.4	-178	4.9	0	0	112.3	L47 R48 L49 H86	L47-Q51 PolarHBondContact O-N 3.44Å; R48-Q51 WeakPolarHBondContact O-CB 3.5Å; R48-Q51 PolarHBondContact O-N 3.04Å; L49-Q51 VanDerWaalsContact C-N 3.26Å; L49-Q51 PolarHBondContact O-N 3.48Å; Q51-H86 PolarHBondContact O-NE2 3.27Å
52	F	92.9	Very high	94.4	Very high	100 Å²	100	45.9 Å²	45.9	44%	0.439	22%	0.217	S	C	.	.	H	α-helix	trans	-81.8	-27.8	179.1	-63	-44.5	0	0	0	114.2	Y17 R48 L49 Y50 P54	Y17-F52 AromaticContact CD1-CD2 3.72Å; Y17-F52 HydrophobicContact CD1-CD2 3.72Å; Y17-F52 AromaticContact CD1-CE2 3.23Å; Y17-F52 HydrophobicContact CD1-CE2 3.23Å; Y17-F52 HydrophobicContact CD1-CZ 4.02Å; Y17-F52 HydrophobicContact CE1-CD2 4.2Å; Y17-F52 AromaticContact CE1-CE2 3.25Å; Y17-F52 HydrophobicContact CE1-CE2 3.25Å; Y17-F52 AromaticContact CE1-CZ 3.69Å; Y17-F52 HydrophobicContact CE1-CZ 3.69Å; R48-F52 HydrophobicContact CG-CD2 4Å; R48-F52 HydrophobicContact CG-CE2 3.32Å; R48-F52 HydrophobicContact CG-CZ 3.92Å; R48-F52 VanDerWaalsContact O-CD2 3.22Å; R48-F52 WeakPolarHBondContact O-CD2 3.34Å; R48-F52 PolarHBondContact O-N 3.43Å; R48-F52 VanDerWaalsContact O-N 3.17Å; L49-F52 PolarHBondContact O-N 2.83Å; Y50-F52 VanDerWaalsContact C-N 3.35Å; F52-P54 WeakPolarHBondContact O-CD 3.43Å
53	Y	94	Very high	94.4	Very high	69 Å²	69	46.6 Å²	46.6	27%	0.271	22%	0.219	S	C	.	.			trans	-125.2	72.7	-177.8	-58.7	-75.5	0	0	0	110.6	Y17 P19 L49 Y50 E55 R56	Y17-Y53 WeakPolarHBondContact O-CE2 3.37Å; Y17-Y53 PolarHBondContact O-OH 3.3Å; P19-Y53 HydrophobicContact CB-CD1 4.24Å; P19-Y53 HydrophobicContact CB-CD2 3.81Å; P19-Y53 HydrophobicContact CB-CE1 4.2Å; P19-Y53 HydrophobicContact CB-CE2 3.76Å; P19-Y53 HydrophobicContact CB-CG 4.06Å; P19-Y53 HydrophobicContact CG-CE1 4.04Å; P19-Y53 HydrophobicContact CG-CE2 4.07Å; L49-Y53 HydrophobicContact CD2-CD2 4.39Å; L49-Y53 HydrophobicContact CD2-CE2 4.19Å; L49-Y53 WeakPolarHBondContact O-CD2 3.44Å; L49-Y53 PolarHBondContact O-N 3.49Å; Y50-Y53 CarbonylContact O-C 3.58Å; Y53-E55 WeakPolarHBondContact CB-OE1 3.41Å; Y53-E55 PolarHBondContact O-N 3.43Å; Y53-E55 VanDerWaalsContact O-N 3.15Å; Y53-R56 PolarHBondContact O-N 3.46Å
54	P	92.1	Very high	94.4	Very high	61 Å²	61	47.6 Å²	47.6	40%	0.396	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-57.9	-29.3	-175.6	-24.2	34.7	0	0	0	113.8	F52 R56 F57	F52-P54 WeakPolarHBondContact O-CD 3.43Å; P54-R56 PolarHBondContact O-N 2.96Å; P54-F57 WeakPolarHBondContact O-CB 3.48Å; P54-F57 PolarHBondContact O-N 3.02Å; P54-F57 VanDerWaalsContact O-N 3.08Å
55	E	93.6	Very high	94.4	Very high	135 Å²	135	45.9 Å²	45.9	63%	0.631	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-65.2	-15.9	176.3	69.1	-74.3	170.2	0	0	114.1	Y53	Y53-E55 WeakPolarHBondContact CB-OE1 3.41Å; Y53-E55 PolarHBondContact O-N 3.43Å; Y53-E55 VanDerWaalsContact O-N 3.15Å
56	R	93.7	Very high	94.4	Very high	142 Å²	142	45.2 Å²	45.2	54%	0.536	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-104.5	8.1	175.8	-55.3	-142.4	-169.3	-76.9	1	112.8	I22 Y50 Y53 P54 N58	I22-R56 HydrophobicContact CD1-CB 3.8Å; I22-R56 HydrophobicContact CD1-CG 4.35Å; Y50-R56 WeakPolarHBondContact CD1-O 3.23Å; Y50-R56 WeakPolarHBondContact CE1-O 3.46Å; Y53-R56 PolarHBondContact O-N 3.46Å; P54-R56 PolarHBondContact O-N 2.96Å; R56-N58 PolarHBondContact O-N 3.05Å
57	F	94.9	Very high	94.2	Very high	39 Å²	39	45.1 Å²	45.1	17%	0.171	21%	0.209	C	C	.	.			trans	-60.9	126.8	179.6	-177.2	-104.7	0	0	0	111.5	Y50 P54 A59 A62 I85 H89 L95	Y50-F57 AromaticContact CD2-CD2 3.98Å; Y50-F57 HydrophobicContact CD2-CD2 3.98Å; Y50-F57 HydrophobicContact CD2-CE2 4.21Å; Y50-F57 AromaticContact CG-CD2 3.95Å; Y50-F57 HydrophobicContact CG-CD2 3.95Å; P54-F57 WeakPolarHBondContact O-CB 3.48Å; P54-F57 PolarHBondContact O-N 3.02Å; P54-F57 VanDerWaalsContact O-N 3.08Å; F57-A59 HydrophobicContact CE1-CB 3.91Å; F57-A62 HydrophobicContact CE2-CB 3.94Å; F57-A62 HydrophobicContact CZ-CB 3.85Å; F57-I85 HydrophobicContact CE2-CG2 4.18Å; F57-I85 HydrophobicContact CZ-CG2 4.19Å; F57-H89 AromaticContact CD1-CD2 3.96Å; F57-H89 AromaticContact CD1-CE1 3.82Å; F57-H89 AromaticContact CD1-CG 3.85Å; F57-H89 AromaticContact CD1-ND1 3.76Å; F57-H89 AromaticContact CD1-NE2 3.96Å; F57-H89 HydrophobicContact CE1-CB 3.71Å; F57-H89 AromaticContact CE1-CD2 3.96Å; F57-H89 AromaticContact CE1-CG 3.52Å; F57-H89 AromaticContact CE1-ND1 3.7Å; F57-H89 HydrophobicContact CE2-CB 4.39Å; F57-H89 AromaticContact CG-NE2 3.96Å; F57-H89 HydrophobicContact CZ-CB 3.63Å; F57-H89 AromaticContact CZ-CG 3.77Å; F57-L95 HydrophobicContact CE1-CD1 4.14Å; F57-L95 HydrophobicContact CZ-CD1 3.67Å
58	N	95.1	Very high	94.1	Very high	53 Å²	53	45.3 Å²	45.3	28%	0.283	21%	0.21	S	C	.	.			trans	-117	106.4	175	-174.7	-19.7	0	0	0	109.7	E26 Y50 R56 E60 C61 A62	E26-N58 PolarHBondContact OE1-ND2 2.94Å; Y50-N58 HydrophobicContact CE1-CB 4.34Å; Y50-N58 WeakPolarHBondContact OH-CB 3.36Å; R56-N58 PolarHBondContact O-N 3.05Å; N58-E60 VanDerWaalsContact C-N 3.25Å; N58-E60 PolarHBondContact O-N 2.89Å; N58-E60 WeakPolarHBondContact OD1-CB 3.37Å; N58-E60 PolarHBondContact OD1-N 3.29Å; N58-E60 VanDerWaalsContact OD1-N 3.1Å; N58-C61 HydrophobicContact CB-CB 4.09Å; N58-C61 PolarHBondContact ND2-SG 3.47Å; N58-C61 VanDerWaalsContact ND2-SG 3.36Å; N58-C61 PolarHBondContact O-N 3.21Å; N58-C61 PolarHBondContact OD1-N 2.93Å; N58-A62 PolarHBondContact O-N 3.15Å
59	A	94.2	Very high	94	Very high	30 Å²	30	40.4 Å²	40.4	25%	0.248	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-33.2	-177.9	0	0	0	0	0	112.8	F57 R63	F57-A59 HydrophobicContact CE1-CB 3.91Å; A59-R63 VanDerWaalsContact O-CB 3.28Å; A59-R63 WeakPolarHBondContact O-CB 3.41Å; A59-R63 PolarHBondContact O-N 3.44Å
60	E	93.5	Very high	93.8	Very high	90 Å²	90	41.2 Å²	41.2	42%	0.421	20%	0.196	S	C	.	.	H	α-helix	trans	-69.7	-42	177.9	-73.1	-58.7	136.4	0	0	111.9	N58 R63 L64	N58-E60 VanDerWaalsContact C-N 3.25Å; N58-E60 PolarHBondContact O-N 2.89Å; N58-E60 WeakPolarHBondContact OD1-CB 3.37Å; N58-E60 PolarHBondContact OD1-N 3.29Å; N58-E60 VanDerWaalsContact OD1-N 3.1Å; E60-R63 WeakPolarHBondContact O-CB 3.14Å; E60-R63 PolarHBondContact O-N 3.41Å; E60-R63 IonicContact OE2-CZ 3.16Å; E60-R63 VanDerWaalsContact OE2-CZ 3.24Å; E60-R63 IonicContact OE2-NE 3Å; E60-R63 PolarHBondContact OE2-NE 2.96Å; E60-R63 IonicContact OE2-NH2 2.73Å; E60-R63 PolarHBondContact OE2-NH2 3.02Å; E60-L64 VanDerWaalsContact O-CG 3.29Å; E60-L64 WeakPolarHBondContact O-CG 3.3Å; E60-L64 PolarHBondContact O-N 3.2Å
61	C	94.9	Very high	93.4	Very high	12 Å²	12	41.6 Å²	41.6	8%	0.081	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-43.5	175.2	-69.7	0	0	0	0	111.3	E26 L29 L46 Y50 N58 R63 L64 V65	E26-C61 HydrophobicContact CG-CB 4.38Å; L29-C61 HydrophobicContact CD2-CB 4.07Å; L29-C61 WeakPolarHBondContact CD2-O 3.42Å; L46-C61 HydrophobicContact CD2-CB 4.46Å; Y50-C61 HydrophobicContact CE2-CB 4.19Å; Y50-C61 WeakPolarHBondContact OH-CB 3.29Å; N58-C61 HydrophobicContact CB-CB 4.09Å; N58-C61 PolarHBondContact ND2-SG 3.47Å; N58-C61 VanDerWaalsContact ND2-SG 3.36Å; N58-C61 PolarHBondContact O-N 3.21Å; N58-C61 PolarHBondContact OD1-N 2.93Å; C61-R63 VanDerWaalsContact C-N 3.3Å; C61-R63 PolarHBondContact O-N 3.16Å; C61-L64 PolarHBondContact O-N 3.28Å; C61-V65 WeakPolarHBondContact O-CG2 3.37Å; C61-V65 PolarHBondContact O-N 3.28Å
62	A	95.5	Very high	93	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-41.2	174.5	0	0	0	0	0	112	L47 F57 N58 L64 V65 L66 I85 L95	L47-A62 HydrophobicContact CD2-CB 4.22Å; F57-A62 HydrophobicContact CE2-CB 3.94Å; F57-A62 HydrophobicContact CZ-CB 3.85Å; N58-A62 PolarHBondContact O-N 3.15Å; A62-L64 PolarHBondContact O-N 2.83Å; A62-V65 PolarHBondContact O-N 3.22Å; A62-L66 WeakPolarHBondContact O-CG 3.39Å; A62-L66 PolarHBondContact O-N 3.37Å; A62-I85 HydrophobicContact CB-CD1 4.2Å; A62-L95 HydrophobicContact CB-CD1 4.24Å; A62-L95 HydrophobicContact CB-CD2 3.89Å
63	R	94.4	Very high	92.1	Very high	17 Å²	17	38 Å²	38	6%	0.064	19%	0.187	C	C	.	.	H	α-helix	trans	-59.1	-48.2	175.1	180	-167.1	59	80	-0.9	111.1	A59 E60 C61 L66 L67 P94 L95 V98 I123	A59-R63 VanDerWaalsContact O-CB 3.28Å; A59-R63 WeakPolarHBondContact O-CB 3.41Å; A59-R63 PolarHBondContact O-N 3.44Å; E60-R63 WeakPolarHBondContact O-CB 3.14Å; E60-R63 PolarHBondContact O-N 3.41Å; E60-R63 IonicContact OE2-CZ 3.16Å; E60-R63 VanDerWaalsContact OE2-CZ 3.24Å; E60-R63 IonicContact OE2-NE 3Å; E60-R63 PolarHBondContact OE2-NE 2.96Å; E60-R63 IonicContact OE2-NH2 2.73Å; E60-R63 PolarHBondContact OE2-NH2 3.02Å; C61-R63 VanDerWaalsContact C-N 3.3Å; C61-R63 PolarHBondContact O-N 3.16Å; R63-L66 PolarHBondContact O-N 2.86Å; R63-L67 HydrophobicContact CG-CD1 4.05Å; R63-L67 VanDerWaalsContact NH1-CD1 3.31Å; R63-L67 WeakPolarHBondContact O-CB 3.25Å; R63-L67 VanDerWaalsContact O-CG 3.29Å; R63-L67 WeakPolarHBondContact O-CG 3.38Å; R63-L67 PolarHBondContact O-N 3.27Å; R63-P94 HydrophobicContact CB-CG 4.11Å; R63-P94 HydrophobicContact CG-CB 4.4Å; R63-P94 HydrophobicContact CG-CG 4.12Å; R63-L95 HydrophobicContact CB-CD2 4.05Å; R63-V98 HydrophobicContact CG-CG2 3.77Å; R63-I123 PolarHBondContact NH1-O 3.22Å
64	L	94.6	Very high	91.3	Very high	23 Å²	23	36 Å²	36	12%	0.12	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-40.2	179.6	-71.8	170.3	0	0	0	112.2	L29 I33 E60 C61 A62 L67 K68 A126 I127	L29-L64 HydrophobicContact CD2-CB 3.95Å; L29-L64 HydrophobicContact CG-CB 4.4Å; I33-L64 HydrophobicContact CD1-CB 4.06Å; I33-L64 HydrophobicContact CD1-CD1 3.64Å; I33-L64 HydrophobicContact CD1-CD2 3.71Å; I33-L64 HydrophobicContact CD1-CG 3.99Å; E60-L64 VanDerWaalsContact O-CG 3.29Å; E60-L64 WeakPolarHBondContact O-CG 3.3Å; E60-L64 PolarHBondContact O-N 3.2Å; C61-L64 PolarHBondContact O-N 3.28Å; A62-L64 PolarHBondContact O-N 2.83Å; L64-L67 PolarHBondContact O-N 3.47Å; L64-K68 WeakPolarHBondContact O-CB 3.48Å; L64-K68 WeakPolarHBondContact O-CG 3.29Å; L64-K68 PolarHBondContact O-N 3Å; L64-A126 HydrophobicContact CD2-CB 3.8Å; L64-I127 HydrophobicContact CD2-CG1 4.29Å
65	V	94.8	Very high	90.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-49.2	174.4	170.6	0	0	0	0	111.1	L29 N43 L46 L47 C61 A62 L67 K68 A69 C81	L29-V65 HydrophobicContact CD1-CG2 3.99Å; L29-V65 HydrophobicContact CD2-CG2 3.73Å; N43-V65 HydrophobicContact CB-CG1 3.87Å; N43-V65 HydrophobicContact CB-CG2 4.28Å; L46-V65 HydrophobicContact CD2-CG2 4.24Å; L47-V65 HydrophobicContact CD1-CG1 3.66Å; L47-V65 HydrophobicContact CD2-CB 4.44Å; L47-V65 HydrophobicContact CD2-CG1 4.36Å; L47-V65 HydrophobicContact CG-CG1 4.02Å; C61-V65 WeakPolarHBondContact O-CG2 3.37Å; C61-V65 PolarHBondContact O-N 3.28Å; A62-V65 PolarHBondContact O-N 3.22Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 2.98Å; V65-K68 PolarHBondContact O-N 2.97Å; V65-A69 PolarHBondContact O-N 3.18Å; V65-C81 HydrophobicContact CG1-CB 4.44Å
66	L	93.6	Very high	90	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-42.9	179	-72.6	178.2	0	0	0	111.9	A62 R63 A69 I70 F78 C81 K82 I85 L90 L95 V98 V99	A62-L66 WeakPolarHBondContact O-CG 3.39Å; A62-L66 PolarHBondContact O-N 3.37Å; R63-L66 PolarHBondContact O-N 2.86Å; L66-A69 PolarHBondContact O-N 3.21Å; L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 3.05Å; L66-F78 HydrophobicContact CB-CE2 4.22Å; L66-F78 HydrophobicContact CD2-CD2 4.22Å; L66-F78 HydrophobicContact CD2-CE2 4.03Å; L66-C81 HydrophobicContact CD2-CB 3.82Å; L66-K82 HydrophobicContact CD2-CB 4.48Å; L66-I85 HydrophobicContact CD1-CD1 3.94Å; L66-I85 HydrophobicContact CD2-CD1 4.16Å; L66-I85 HydrophobicContact CG-CD1 4.05Å; L66-L90 HydrophobicContact CD1-CD2 4.5Å; L66-L95 HydrophobicContact CD1-CD2 3.74Å; L66-V98 HydrophobicContact CB-CG1 3.63Å; L66-V98 HydrophobicContact CD1-CG1 4.31Å; L66-V99 HydrophobicContact CD1-CG2 4.44Å
67	L	92.8	Very high	89.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.3	-37.9	177.5	-70.8	171.7	0	0	0	112.5	R63 L64 V65 A69 I70 I71 V98 I123 F124 I127 F130	R63-L67 HydrophobicContact CG-CD1 4.05Å; R63-L67 VanDerWaalsContact NH1-CD1 3.31Å; R63-L67 WeakPolarHBondContact O-CB 3.25Å; R63-L67 VanDerWaalsContact O-CG 3.29Å; R63-L67 WeakPolarHBondContact O-CG 3.38Å; R63-L67 PolarHBondContact O-N 3.27Å; L64-L67 PolarHBondContact O-N 3.47Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 2.98Å; L67-A69 VanDerWaalsContact C-N 3.32Å; L67-I70 WeakPolarHBondContact O-CB 3.19Å; L67-I70 PolarHBondContact O-N 3.28Å; L67-I71 WeakPolarHBondContact O-CD1 3.36Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 3.09Å; L67-V98 HydrophobicContact CD1-CG2 4.48Å; L67-V98 HydrophobicContact CD2-CG1 3.8Å; L67-V98 HydrophobicContact CD2-CG2 3.96Å; L67-V98 HydrophobicContact CG-CG1 3.99Å; L67-V98 HydrophobicContact CG-CG2 4.05Å; L67-I123 HydrophobicContact CD1-CG2 4.48Å; L67-I123 VanDerWaalsContact CD1-O 3.29Å; L67-I123 WeakPolarHBondContact CD1-O 3.37Å; L67-F124 HydrophobicContact CD2-CD1 3.65Å; L67-F124 HydrophobicContact CD2-CE1 3.69Å; L67-I127 HydrophobicContact CB-CD1 3.27Å; L67-I127 HydrophobicContact CD1-CD1 4.12Å; L67-I127 HydrophobicContact CG-CD1 4.32Å; L67-F130 HydrophobicContact CD2-CE2 4.06Å
68	K	92.6	Very high	89.7	Confident	5 Å²	5	26.9 Å²	26.9	2%	0.022	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-39.3	173	-79.6	-66.7	-62.7	174.9	0	111.8	D37 Y38 L64 V65 I70 I71 S72 I127	D37-K68 WeakPolarHBondContact O-CE 3.29Å; D37-K68 PolarHBondContact O-NZ 3.2Å; Y38-K68 HydrophobicContact CD2-CB 4.14Å; Y38-K68 HydrophobicContact CE2-CB 4.16Å; L64-K68 WeakPolarHBondContact O-CB 3.48Å; L64-K68 WeakPolarHBondContact O-CG 3.29Å; L64-K68 PolarHBondContact O-N 3Å; V65-K68 PolarHBondContact O-N 2.97Å; K68-I70 VanDerWaalsContact C-N 3.33Å; K68-I71 PolarHBondContact O-N 3.05Å; K68-S72 PolarHBondContact O-N 3.43Å; K68-S72 PolarHBondContact O-OG 3.24Å; K68-I127 HydrophobicContact CD-CD1 4.24Å; K68-I127 HydrophobicContact CD-CG2 4.26Å; K68-I127 HydrophobicContact CG-CD1 4.12Å
69	A	92.7	Very high	89.6	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-67.3	-31.6	175.1	0	0	0	0	0	112.9	V65 L66 L67 S72 D77 F78	V65-A69 PolarHBondContact O-N 3.18Å; L66-A69 PolarHBondContact O-N 3.21Å; L67-A69 VanDerWaalsContact C-N 3.32Å; A69-S72 WeakPolarHBondContact CA-OG 3.45Å; A69-S72 PolarHBondContact O-OG 3.02Å; A69-D77 HydrophobicContact CB-CB 4.33Å; A69-F78 HydrophobicContact CB-CB 4.21Å
70	I	89.9	Confident	89.5	Confident	16 Å²	16	28.8 Å²	28.8	8%	0.082	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-45.7	170.9	-71.5	170.8	0	0	0	110.5	L66 L67 K68 S72 M73 F78 V98 L105 F130	L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 3.05Å; L67-I70 WeakPolarHBondContact O-CB 3.19Å; L67-I70 PolarHBondContact O-N 3.28Å; K68-I70 VanDerWaalsContact C-N 3.33Å; I70-S72 PolarHBondContact O-N 3.15Å; I70-M73 PolarHBondContact O-N 3.39Å; I70-F78 HydrophobicContact CD1-CD2 4.08Å; I70-F78 HydrophobicContact CD1-CE2 3.72Å; I70-F78 HydrophobicContact CD1-CZ 4.35Å; I70-F78 HydrophobicContact CG1-CD2 3.52Å; I70-F78 HydrophobicContact CG1-CE2 3.71Å; I70-F78 HydrophobicContact CG1-CG 4.17Å; I70-V98 HydrophobicContact CD1-CG1 3.89Å; I70-L105 HydrophobicContact CG2-CD1 3.4Å; I70-F130 HydrophobicContact CG2-CE2 4.42Å
71	I	87.8	Confident	89.5	Confident	12 Å²	12	24.5 Å²	24.5	6%	0.062	14%	0.137	C	C	.	.	H	α-helix	trans	-70	-29.8	-177.2	-72.3	163	0	0	0	112.8	L67 K68 M73 I127 F130 S133	L67-I71 WeakPolarHBondContact O-CD1 3.36Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 3.09Å; K68-I71 PolarHBondContact O-N 3.05Å; I71-M73 WeakPolarHBondContact O-CG 3.28Å; I71-M73 PolarHBondContact O-N 3.17Å; I71-M73 VanDerWaalsContact O-N 3.16Å; I71-I127 HydrophobicContact CD1-CB 3.82Å; I71-I127 HydrophobicContact CD1-CD1 3.72Å; I71-I127 HydrophobicContact CD1-CG1 4.39Å; I71-I127 HydrophobicContact CD1-CG2 3.27Å; I71-F130 HydrophobicContact CD1-CB 4.17Å; I71-F130 HydrophobicContact CD1-CD2 3.52Å; I71-F130 HydrophobicContact CD1-CE2 4.4Å; I71-F130 HydrophobicContact CD1-CG 4.31Å; I71-F130 HydrophobicContact CG1-CD2 3.61Å; I71-F130 HydrophobicContact CG1-CE2 4.19Å; I71-F130 HydrophobicContact CG1-CG 4.47Å; I71-S133 WeakPolarHBondContact CG2-OG 3.4Å
72	S	86.2	Confident	89.4	Confident	39 Å²	39	25.9 Å²	25.9	27%	0.273	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.3	176.2	60.8	0	0	0	0	113.3	Y38 K68 A69 I70 S74	Y38-S72 VanDerWaalsContact CE1-CB 3.41Å; Y38-S72 WeakPolarHBondContact CE1-OG 3.5Å; Y38-S72 PolarHBondContact OH-OG 3.47Å; K68-S72 PolarHBondContact O-N 3.43Å; K68-S72 PolarHBondContact O-OG 3.24Å; A69-S72 WeakPolarHBondContact CA-OG 3.45Å; A69-S72 PolarHBondContact O-OG 3.02Å; I70-S72 PolarHBondContact O-N 3.15Å; S72-S74 PolarHBondContact O-N 2.86Å; S72-S74 PolarHBondContact OG-OG 2.95Å
73	M	73.9	Confident	89.3	Confident	53 Å²	53	33.9 Å²	33.9	26%	0.261	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	14.5	175.8	-55.9	176	42.9	0	0	114.1	I70 I71 K136 F137	I70-M73 PolarHBondContact O-N 3.39Å; I71-M73 WeakPolarHBondContact O-CG 3.28Å; I71-M73 PolarHBondContact O-N 3.17Å; I71-M73 VanDerWaalsContact O-N 3.16Å; M73-K136 HydrophobicContact CE-CB 4.46Å; M73-K136 HydrophobicContact SD-CB 4.1Å; M73-F137 HydrophobicContact CB-CD2 4.19Å; M73-F137 HydrophobicContact CE-CB 3.62Å; M73-F137 HydrophobicContact CE-CD2 4.02Å; M73-F137 HydrophobicContact CE-CG 4.33Å; M73-F137 HydrophobicContact CG-CB 3.91Å; M73-F137 HydrophobicContact CG-CD2 4.32Å; M73-F137 HydrophobicContact CG-CG 4.49Å; M73-F137 HydrophobicContact SD-CB 3.9Å
74	S	76.8	Confident	89.2	Confident	28 Å²	28	34.5 Å²	34.5	20%	0.196	18%	0.178	C	C	.	.			trans	-97.4	94.6	176.8	41.6	0	0	0	0	109.4	S72 S76 D77 F78	S72-S74 PolarHBondContact O-N 2.86Å; S72-S74 PolarHBondContact OG-OG 2.95Å; S74-S76 PolarHBondContact O-N 3.01Å; S74-S76 VanDerWaalsContact O-N 3.08Å; S74-D77 VanDerWaalsContact CB-CG 3.45Å; S74-D77 WeakPolarHBondContact CB-OD2 3.19Å; S74-D77 WeakPolarHBondContact O-CB 3.45Å; S74-D77 PolarHBondContact O-N 3.17Å; S74-D77 WeakPolarHBondContact OG-CB 3.21Å; S74-D77 PolarHBondContact OG-OD2 3.06Å; S74-F78 PolarHBondContact O-N 3.01Å
75	H	72.5	Confident	89.2	Confident	87 Å²	87	34 Å²	34	40%	0.403	18%	0.175	S	C	.	.	H	α-helix	trans	-51.9	-33.6	178.3	-69.6	-63.8	0	0	0	113.6	D77 T79 F137	H75-D77 VanDerWaalsContact C-N 3.31Å; H75-D77 PolarHBondContact O-N 3.39Å; H75-T79 WeakPolarHBondContact O-CB 3.37Å; H75-T79 PolarHBondContact O-N 3.3Å; H75-T79 PolarHBondContact O-OG1 3.29Å; H75-T79 VanDerWaalsContact O-OG1 3.07Å; H75-F137 AromaticContact CE1-CE2 3.53Å; H75-F137 AromaticContact CE1-CZ 3.21Å; H75-F137 WeakPolarHBondContact CE1-CZ 3.21Å; H75-F137 AromaticContact NE2-CE2 3.19Å; H75-F137 WeakPolarHBondContact NE2-CE2 3.2Å; H75-F137 AromaticContact NE2-CZ 3.21Å; H75-F137 WeakPolarHBondContact NE2-CZ 3.38Å
76	S	86	Confident	89.1	Confident	72 Å²	72	37.2 Å²	37.2	50%	0.503	19%	0.19	S	C	.	.	H	α-helix	trans	-58	-43.1	173.7	49.6	0	0	0	0	112.2	S74 T79 L80	S74-S76 PolarHBondContact O-N 3.01Å; S74-S76 VanDerWaalsContact O-N 3.08Å; S76-T79 PolarHBondContact O-N 3.02Å; S76-L80 WeakPolarHBondContact O-CB 3.38Å; S76-L80 WeakPolarHBondContact O-CG 3.4Å; S76-L80 PolarHBondContact O-N 3.48Å
77	D	91	Very high	89	Confident	19 Å²	19	42.7 Å²	42.7	10%	0.102	22%	0.219	C	C	.	.	H	α-helix	trans	-73	-44.4	-170.5	-63.7	13.5	0	0	0	110.6	Y38 F40 A69 S74 H75 T79 L80 C81	Y38-D77 WeakPolarHBondContact CE1-OD2 3.45Å; Y38-D77 WeakPolarHBondContact OH-CB 2.99Å; Y38-D77 PolarHBondContact OH-OD2 3.26Å; F40-D77 HydrophobicContact CD2-CB 3.9Å; F40-D77 HydrophobicContact CE2-CB 3.44Å; F40-D77 VanDerWaalsContact CE2-CB 3.44Å; F40-D77 HydrophobicContact CZ-CB 3.94Å; A69-D77 HydrophobicContact CB-CB 4.33Å; S74-D77 VanDerWaalsContact CB-CG 3.45Å; S74-D77 WeakPolarHBondContact CB-OD2 3.19Å; S74-D77 WeakPolarHBondContact O-CB 3.45Å; S74-D77 PolarHBondContact O-N 3.17Å; S74-D77 WeakPolarHBondContact OG-CB 3.21Å; S74-D77 PolarHBondContact OG-OD2 3.06Å; H75-D77 VanDerWaalsContact C-N 3.31Å; H75-D77 PolarHBondContact O-N 3.39Å; D77-T79 VanDerWaalsContact C-N 3.28Å; D77-T79 PolarHBondContact O-N 3.34Å; D77-L80 PolarHBondContact O-N 3.47Å; D77-C81 WeakPolarHBondContact O-CB 3.49Å; D77-C81 PolarHBondContact O-N 3.47Å; D77-C81 PolarHBondContact O-SG 2.87Å
78	F	91.5	Very high	88.9	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-43.9	175.7	177.9	-105.7	0	0	0	111.2	L66 A69 I70 S74 K82 V98 E106	L66-F78 HydrophobicContact CB-CE2 4.22Å; L66-F78 HydrophobicContact CD2-CD2 4.22Å; L66-F78 HydrophobicContact CD2-CE2 4.03Å; A69-F78 HydrophobicContact CB-CB 4.21Å; I70-F78 HydrophobicContact CD1-CD2 4.08Å; I70-F78 HydrophobicContact CD1-CE2 3.72Å; I70-F78 HydrophobicContact CD1-CZ 4.35Å; I70-F78 HydrophobicContact CG1-CD2 3.52Å; I70-F78 HydrophobicContact CG1-CE2 3.71Å; I70-F78 HydrophobicContact CG1-CG 4.17Å; S74-F78 PolarHBondContact O-N 3.01Å; F78-K82 VanDerWaalsContact O-CB 3.28Å; F78-K82 WeakPolarHBondContact O-CB 3.36Å; F78-K82 PolarHBondContact O-N 3.39Å; F78-V98 HydrophobicContact CE2-CG1 4.49Å; F78-E106 WeakPolarHBondContact CD1-OE1 3.19Å
79	T	91.5	Very high	88.9	Confident	38 Å²	38	50.3 Å²	50.3	23%	0.233	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-45.2	177.2	-65.5	0	0	0	0	111.8	H75 S76 D77 K82 Y83	H75-T79 WeakPolarHBondContact O-CB 3.37Å; H75-T79 PolarHBondContact O-N 3.3Å; H75-T79 PolarHBondContact O-OG1 3.29Å; H75-T79 VanDerWaalsContact O-OG1 3.07Å; S76-T79 PolarHBondContact O-N 3.02Å; D77-T79 VanDerWaalsContact C-N 3.28Å; D77-T79 PolarHBondContact O-N 3.34Å; T79-K82 PolarHBondContact O-N 3.27Å; T79-Y83 HydrophobicContact CG2-CD2 3.79Å; T79-Y83 HydrophobicContact CG2-CE2 3.24Å; T79-Y83 WeakPolarHBondContact O-CD2 3.42Å; T79-Y83 PolarHBondContact O-N 2.9Å; T79-Y83 VanDerWaalsContact O-N 3.14Å
80	L	92.8	Very high	88.8	Confident	85 Å²	85	51.1 Å²	51.1	45%	0.445	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-45.6	178.3	-72.9	170.2	0	0	0	112.2	F40 L44 S76 D77 K82 Y83 L84	F40-L80 HydrophobicContact CE1-CD1 4.39Å; F40-L80 HydrophobicContact CZ-CB 4.28Å; F40-L80 HydrophobicContact CZ-CD1 3.83Å; L44-L80 HydrophobicContact CD2-CB 4.38Å; S76-L80 WeakPolarHBondContact O-CB 3.38Å; S76-L80 WeakPolarHBondContact O-CG 3.4Å; S76-L80 PolarHBondContact O-N 3.48Å; D77-L80 PolarHBondContact O-N 3.47Å; L80-K82 VanDerWaalsContact C-N 3.33Å; L80-K82 PolarHBondContact O-N 2.82Å; L80-Y83 PolarHBondContact O-N 3.11Å; L80-L84 PolarHBondContact O-N 2.78Å
81	C	93.7	Very high	88.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-44.2	176	-71.8	0	0	0	0	111.4	L47 V65 L66 D77 Y83 L84	L47-C81 HydrophobicContact CD1-CB 3.6Å; L47-C81 WeakPolarHBondContact CD1-O 3.32Å; V65-C81 HydrophobicContact CG1-CB 4.44Å; L66-C81 HydrophobicContact CD2-CB 3.82Å; D77-C81 WeakPolarHBondContact O-CB 3.49Å; D77-C81 PolarHBondContact O-N 3.47Å; D77-C81 PolarHBondContact O-SG 2.87Å; C81-Y83 VanDerWaalsContact C-N 3.31Å; C81-Y83 PolarHBondContact O-N 2.71Å; C81-L84 PolarHBondContact O-N 2.82Å
82	K	92.6	Very high	89.1	Confident	41 Å²	41	60 Å²	60	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-57	-43.2	176.5	-179	178.5	67.5	-166.4	0	111.8	L66 F78 T79 L80 L84 I85 L90 V99	L66-K82 HydrophobicContact CD2-CB 4.48Å; F78-K82 VanDerWaalsContact O-CB 3.28Å; F78-K82 WeakPolarHBondContact O-CB 3.36Å; F78-K82 PolarHBondContact O-N 3.39Å; T79-K82 PolarHBondContact O-N 3.27Å; L80-K82 VanDerWaalsContact C-N 3.33Å; L80-K82 PolarHBondContact O-N 2.82Å; K82-L84 VanDerWaalsContact C-N 3.27Å; K82-L84 PolarHBondContact O-N 2.79Å; K82-I85 PolarHBondContact O-N 3.26Å; K82-L90 HydrophobicContact CG-CD1 4.03Å; K82-L90 HydrophobicContact CG-CD2 4.45Å; K82-V99 HydrophobicContact CD-CG1 4.3Å
83	Y	92.9	Very high	89.2	Confident	168 Å²	168	63.1 Å²	63.1	66%	0.659	31%	0.313	S	S	*	.	H	α-helix	trans	-72.3	-14.3	-179.4	-69.4	-48.1	0	0	0	115.1	T79 L80 C81	T79-Y83 HydrophobicContact CG2-CD2 3.79Å; T79-Y83 HydrophobicContact CG2-CE2 3.24Å; T79-Y83 WeakPolarHBondContact O-CD2 3.42Å; T79-Y83 PolarHBondContact O-N 2.9Å; T79-Y83 VanDerWaalsContact O-N 3.14Å; L80-Y83 PolarHBondContact O-N 3.11Å; C81-Y83 VanDerWaalsContact C-N 3.31Å; C81-Y83 PolarHBondContact O-N 2.71Å
84	L	93.5	Very high	90	Very high	30 Å²	30	61.5 Å²	61.5	16%	0.157	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-11	174.4	-70.3	177.5	0	0	0	113.4	L44 L47 L80 C81 K82	L44-L84 HydrophobicContact CB-CD1 4.21Å; L44-L84 HydrophobicContact CD2-CD1 3.51Å; L44-L84 HydrophobicContact CG-CD1 4.43Å; L47-L84 HydrophobicContact CB-CB 3.83Å; L47-L84 HydrophobicContact CB-CD1 3.98Å; L47-L84 HydrophobicContact CD1-CB 4.4Å; L80-L84 PolarHBondContact O-N 2.78Å; C81-L84 PolarHBondContact O-N 2.82Å; K82-L84 VanDerWaalsContact C-N 3.27Å; K82-L84 PolarHBondContact O-N 2.79Å
85	I	93.9	Very high	90.7	Very high	13 Å²	13	60.2 Å²	60.2	7%	0.067	30%	0.298	C	S	.	.	S	Bend	trans	-98.8	130.8	179.9	-57.5	167.8	0	0	0	108.5	L47 F57 A62 L66 K82 H89 L90 L95	L47-I85 HydrophobicContact CD1-CD1 4.45Å; L47-I85 HydrophobicContact CD1-CG1 4.41Å; L47-I85 HydrophobicContact CD2-CD1 4.04Å; L47-I85 HydrophobicContact CD2-CG1 3.93Å; F57-I85 HydrophobicContact CE2-CG2 4.18Å; F57-I85 HydrophobicContact CZ-CG2 4.19Å; A62-I85 HydrophobicContact CB-CD1 4.2Å; L66-I85 HydrophobicContact CD1-CD1 3.94Å; L66-I85 HydrophobicContact CD2-CD1 4.16Å; L66-I85 HydrophobicContact CG-CD1 4.05Å; K82-I85 PolarHBondContact O-N 3.26Å; I85-H89 HydrophobicContact CG2-CB 3.86Å; I85-L90 HydrophobicContact CB-CD2 3.8Å; I85-L90 HydrophobicContact CB-CG 3.99Å; I85-L90 HydrophobicContact CD1-CD2 4.03Å; I85-L90 HydrophobicContact CG2-CD2 3.76Å; I85-L90 HydrophobicContact CG2-CG 3.8Å; I85-L95 HydrophobicContact CG2-CD1 4.48Å
86	H	92.1	Very high	91.7	Very high	69 Å²	69	56.8 Å²	56.8	32%	0.319	28%	0.283	S	S	.	.			trans	-58.1	143.8	176	-68.4	-64	0	0	0	111.4	Q51 E88 H89 L90	Q51-H86 PolarHBondContact O-NE2 3.27Å; H86-E88 PolarHBondContact O-N 3.03Å; H86-H89 PolarHBondContact O-N 3.16Å; H86-H89 VanDerWaalsContact O-N 3.12Å; H86-L90 PolarHBondContact O-N 2.82Å
87	L	91.7	Very high	92	Very high	115 Å²	115	55.4 Å²	55.4	60%	0.602	27%	0.269	S	S	*	.	H	α-helix	trans	-62.1	-32.5	-171.3	-176.7	63.1	0	0	0	112.3	L90 N91	L87-L90 PolarHBondContact O-N 2.85Å; L87-N91 PolarHBondContact O-N 2.9Å; L87-N91 PolarHBondContact O-ND2 3.49Å
88	E	91.7	Very high	92	Very high	127 Å²	127	54.5 Å²	54.5	59%	0.593	26%	0.264	S	S	*	.	H	α-helix	trans	-57.7	-49.5	176	-62.3	76.9	-168.1	0	0	110.5	H86 L90 N91	H86-E88 PolarHBondContact O-N 3.03Å; E88-L90 PolarHBondContact O-N 3.25Å; E88-N91 PolarHBondContact O-N 2.92Å
89	H	92.3	Very high	92.1	Very high	37 Å²	37	56 Å²	56	17%	0.171	27%	0.273	C	S	.	.	H	α-helix	trans	-68.7	-34.8	178.9	-62.9	-46.8	0	0	0	112.9	F57 I85 H86 N91 E92 L95	F57-H89 AromaticContact CD1-CD2 3.96Å; F57-H89 AromaticContact CD1-CE1 3.82Å; F57-H89 AromaticContact CD1-CG 3.85Å; F57-H89 AromaticContact CD1-ND1 3.76Å; F57-H89 AromaticContact CD1-NE2 3.96Å; F57-H89 HydrophobicContact CE1-CB 3.71Å; F57-H89 AromaticContact CE1-CD2 3.96Å; F57-H89 AromaticContact CE1-CG 3.52Å; F57-H89 AromaticContact CE1-ND1 3.7Å; F57-H89 HydrophobicContact CE2-CB 4.39Å; F57-H89 AromaticContact CG-NE2 3.96Å; F57-H89 HydrophobicContact CZ-CB 3.63Å; F57-H89 AromaticContact CZ-CG 3.77Å; I85-H89 HydrophobicContact CG2-CB 3.86Å; H86-H89 PolarHBondContact O-N 3.16Å; H86-H89 VanDerWaalsContact O-N 3.12Å; H89-N91 PolarHBondContact O-N 3.28Å; H89-E92 IonicContact ND1-OE2 2.72Å; H89-E92 PolarHBondContact ND1-OE2 2.92Å; H89-E92 PolarHBondContact O-N 2.94Å; H89-L95 HydrophobicContact CB-CD1 4.25Å; H89-L95 WeakPolarHBondContact O-CD1 3Å
90	L	91.7	Very high	92.1	Very high	19 Å²	19	59.2 Å²	59.2	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-27.1	177.2	-71.9	176.7	0	0	0	113.1	L66 K82 I85 H86 L87 E88 S96 V99	L66-L90 HydrophobicContact CD1-CD2 4.5Å; K82-L90 HydrophobicContact CG-CD1 4.03Å; K82-L90 HydrophobicContact CG-CD2 4.45Å; I85-L90 HydrophobicContact CB-CD2 3.8Å; I85-L90 HydrophobicContact CB-CG 3.99Å; I85-L90 HydrophobicContact CD1-CD2 4.03Å; I85-L90 HydrophobicContact CG2-CD2 3.76Å; I85-L90 HydrophobicContact CG2-CG 3.8Å; H86-L90 PolarHBondContact O-N 2.82Å; L87-L90 PolarHBondContact O-N 2.85Å; E88-L90 PolarHBondContact O-N 3.25Å; L90-S96 WeakPolarHBondContact O-CA 3.42Å; L90-S96 PolarHBondContact O-N 3.31Å; L90-V99 HydrophobicContact CD2-CG2 3.85Å
91	N	91.4	Very high	92	Very high	108 Å²	108	55.4 Å²	55.4	58%	0.578	26%	0.264	S	S	*	.	H	α-helix	trans	-84.6	-13.7	178.5	-71.3	-43.4	0	0	0	113.2	L87 E88 H89	L87-N91 PolarHBondContact O-N 2.9Å; L87-N91 PolarHBondContact O-ND2 3.49Å; E88-N91 PolarHBondContact O-N 2.92Å; H89-N91 PolarHBondContact O-N 3.28Å
92	E	92.1	Very high	91.9	Very high	107 Å²	107	55.5 Å²	55.5	50%	0.5	27%	0.266	S	S	.	.	S	Bend	trans	-82.2	150.6	177.5	-68.5	172.8	166.4	0	0	111.5	H89 L95 S96	H89-E92 IonicContact ND1-OE2 2.72Å; H89-E92 PolarHBondContact ND1-OE2 2.92Å; H89-E92 PolarHBondContact O-N 2.94Å; E92-L95 PolarHBondContact O-N 2.97Å; E92-S96 PolarHBondContact O-N 3.17Å
93	E	88.5	Confident	91.8	Very high	104 Å²	104	58 Å²	58	49%	0.486	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	138	168.7	-67.8	-65.9	175.7	0	0	109.4	Q97	E93-Q97 VanDerWaalsContact OE1-CG 3.3Å; E93-Q97 WeakPolarHBondContact OE1-CG 3.43Å; E93-Q97 PolarHBondContact OE1-NE2 3.06Å; E93-Q97 WeakPolarHBondContact OE2-CG 3.29Å; E93-Q97 PolarHBondContact OE2-NE2 3.37Å
94	P	89.7	Confident	91.7	Very high	19 Å²	19	51.4 Å²	51.4	12%	0.123	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	cis	-94.1	2.5	11.6	36.8	-37.8	0	0	0	115.4	R63 I123	R63-P94 HydrophobicContact CB-CG 4.11Å; R63-P94 HydrophobicContact CG-CB 4.4Å; R63-P94 HydrophobicContact CG-CG 4.12Å; P94-I123 HydrophobicContact CB-CD1 4.48Å
95	L	92.6	Very high	91.6	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-70.9	-39.4	-171.9	-67	169	0	0	0	112.5	F57 A62 R63 L66 I85 H89 E92 Q97 V98 V99	F57-L95 HydrophobicContact CE1-CD1 4.14Å; F57-L95 HydrophobicContact CZ-CD1 3.67Å; A62-L95 HydrophobicContact CB-CD1 4.24Å; A62-L95 HydrophobicContact CB-CD2 3.89Å; R63-L95 HydrophobicContact CB-CD2 4.05Å; L66-L95 HydrophobicContact CD1-CD2 3.74Å; I85-L95 HydrophobicContact CG2-CD1 4.48Å; H89-L95 HydrophobicContact CB-CD1 4.25Å; H89-L95 WeakPolarHBondContact O-CD1 3Å; E92-L95 PolarHBondContact O-N 2.97Å; L95-Q97 PolarHBondContact O-N 3.34Å; L95-V98 PolarHBondContact O-N 3Å; L95-V99 WeakPolarHBondContact O-CG2 3.49Å; L95-V99 PolarHBondContact O-N 3.27Å
96	S	92.9	Very high	91.3	Very high	15 Å²	15	53 Å²	53	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-53	-40.1	178.4	-172.5	0	0	0	0	112.4	L90 E92 K100	L90-S96 WeakPolarHBondContact O-CA 3.42Å; L90-S96 PolarHBondContact O-N 3.31Å; E92-S96 PolarHBondContact O-N 3.17Å; S96-K100 VanDerWaalsContact O-CG 3.29Å; S96-K100 WeakPolarHBondContact O-CG 3.46Å; S96-K100 PolarHBondContact O-N 3.15Å; S96-K100 PolarHBondContact OG-NZ 2.67Å
97	Q	91.3	Very high	91.2	Very high	43 Å²	43	52.7 Å²	52.7	20%	0.201	27%	0.265	C	S	.	.	H	α-helix	trans	-70.4	-41.8	178.6	-73.3	178.5	31.3	0	0	112.7	E93 L95 V99 K100 L101 N120 I123	E93-Q97 VanDerWaalsContact OE1-CG 3.3Å; E93-Q97 WeakPolarHBondContact OE1-CG 3.43Å; E93-Q97 PolarHBondContact OE1-NE2 3.06Å; E93-Q97 WeakPolarHBondContact OE2-CG 3.29Å; E93-Q97 PolarHBondContact OE2-NE2 3.37Å; L95-Q97 PolarHBondContact O-N 3.34Å; Q97-V99 VanDerWaalsContact C-N 3.31Å; Q97-V99 PolarHBondContact O-N 3.25Å; Q97-K100 PolarHBondContact O-N 3.09Å; Q97-L101 WeakPolarHBondContact O-CG 3.38Å; Q97-L101 PolarHBondContact O-N 3.23Å; Q97-N120 VanDerWaalsContact CD-ND2 3.33Å; Q97-N120 PolarHBondContact NE2-ND2 3.5Å; Q97-N120 PolarHBondContact OE1-ND2 3.34Å; Q97-I123 HydrophobicContact CB-CD1 4.12Å
98	V	92.5	Very high	91.1	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-40.1	176.2	-179.2	0	0	0	0	110.9	R63 L66 L67 I70 F78 L95 L101 G102 I123	R63-V98 HydrophobicContact CG-CG2 3.77Å; L66-V98 HydrophobicContact CB-CG1 3.63Å; L66-V98 HydrophobicContact CD1-CG1 4.31Å; L67-V98 HydrophobicContact CD1-CG2 4.48Å; L67-V98 HydrophobicContact CD2-CG1 3.8Å; L67-V98 HydrophobicContact CD2-CG2 3.96Å; L67-V98 HydrophobicContact CG-CG1 3.99Å; L67-V98 HydrophobicContact CG-CG2 4.05Å; I70-V98 HydrophobicContact CD1-CG1 3.89Å; F78-V98 HydrophobicContact CE2-CG1 4.49Å; L95-V98 PolarHBondContact O-N 3Å; V98-L101 PolarHBondContact O-N 2.82Å; V98-G102 PolarHBondContact O-N 3.19Å; V98-I123 HydrophobicContact CG2-CG2 3.89Å
99	V	92.6	Very high	91.1	Very high	36 Å²	36	50 Å²	50	22%	0.218	25%	0.25	C	C	.	.	H	α-helix	trans	-61.4	-47	175.9	175.3	0	0	0	0	111.5	L66 K82 L90 L95 Q97 L101 G102 L103	L66-V99 HydrophobicContact CD1-CG2 4.44Å; K82-V99 HydrophobicContact CD-CG1 4.3Å; L90-V99 HydrophobicContact CD2-CG2 3.85Å; L95-V99 WeakPolarHBondContact O-CG2 3.49Å; L95-V99 PolarHBondContact O-N 3.27Å; Q97-V99 VanDerWaalsContact C-N 3.31Å; Q97-V99 PolarHBondContact O-N 3.25Å; V99-L101 VanDerWaalsContact C-N 3.29Å; V99-L101 PolarHBondContact O-N 3.4Å; V99-G102 PolarHBondContact O-N 3.35Å; V99-L103 PolarHBondContact O-N 3.5Å
100	K	92	Very high	91.2	Very high	106 Å²	106	48.5 Å²	48.5	46%	0.461	24%	0.243	S	C	.	.	H	α-helix	trans	-59.6	-39.6	176.5	-74.5	165.9	-179.4	155.2	0	112.1	S96 Q97 L103 F104	S96-K100 VanDerWaalsContact O-CG 3.29Å; S96-K100 WeakPolarHBondContact O-CG 3.46Å; S96-K100 PolarHBondContact O-N 3.15Å; S96-K100 PolarHBondContact OG-NZ 2.67Å; Q97-K100 PolarHBondContact O-N 3.09Å; K100-L103 WeakPolarHBondContact O-CB 3.48Å; K100-L103 PolarHBondContact O-N 3.39Å; K100-F104 HydrophobicContact CB-CE2 4.42Å; K100-F104 WeakPolarHBondContact O-CD2 3.46Å; K100-F104 WeakPolarHBondContact O-CG 3.35Å; K100-F104 PolarHBondContact O-N 3.25Å
101	L	90.4	Very high	91.1	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-68.7	-41.1	177.5	-74.6	166.5	0	0	0	113	Q97 V98 V99 L103 F104 L105 F113 K116 V117 F124	Q97-L101 WeakPolarHBondContact O-CG 3.38Å; Q97-L101 PolarHBondContact O-N 3.23Å; V98-L101 PolarHBondContact O-N 2.82Å; V99-L101 VanDerWaalsContact C-N 3.29Å; V99-L101 PolarHBondContact O-N 3.4Å; L101-L103 PolarHBondContact O-N 3.36Å; L101-F104 HydrophobicContact CD2-CD2 4.25Å; L101-F104 PolarHBondContact O-N 3.01Å; L101-F104 VanDerWaalsContact O-N 3.15Å; L101-L105 PolarHBondContact O-N 2.95Å; L101-F113 HydrophobicContact CB-CD2 4.12Å; L101-F113 HydrophobicContact CB-CE2 4.02Å; L101-F113 HydrophobicContact CD2-CD2 3.49Å; L101-F113 VanDerWaalsContact CD2-CD2 3.49Å; L101-F113 HydrophobicContact CD2-CE2 3.83Å; L101-F113 HydrophobicContact CD2-CG 4.16Å; L101-F113 HydrophobicContact CG-CD2 4.4Å; L101-F113 HydrophobicContact CG-CE2 4.45Å; L101-K116 HydrophobicContact CD2-CB 3.65Å; L101-V117 HydrophobicContact CD1-CG2 4.46Å; L101-V117 HydrophobicContact CD2-CG2 4.03Å; L101-F124 HydrophobicContact CD1-CD1 4.33Å; L101-F124 HydrophobicContact CD1-CE1 3.16Å; L101-F124 HydrophobicContact CD1-CE2 3.86Å; L101-F124 HydrophobicContact CD1-CZ 2.91Å; L101-F124 HydrophobicContact CG-CZ 4.39Å
102	G	90.7	Very high	91.1	Very high	3 Å²	3	49 Å²	49	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-56.1	-42.8	170.7	0	0	0	0	0	111.5	V98 V99 F104 L105 E106	V98-G102 PolarHBondContact O-N 3.19Å; V99-G102 PolarHBondContact O-N 3.35Å; G102-F104 PolarHBondContact O-N 2.91Å; G102-L105 PolarHBondContact O-N 3.43Å; G102-E106 WeakPolarHBondContact O-CG 3.42Å; G102-E106 PolarHBondContact O-N 3.22Å
103	L	91.1	Very high	91.1	Very high	93 Å²	93	44 Å²	44	49%	0.487	22%	0.223	S	C	.	.	H	α-helix	trans	-63	-40	175.4	-177.2	67.5	0	0	0	112.7	V99 K100 L101 L105 E106 T107	V99-L103 PolarHBondContact O-N 3.5Å; K100-L103 WeakPolarHBondContact O-CB 3.48Å; K100-L103 PolarHBondContact O-N 3.39Å; L101-L103 PolarHBondContact O-N 3.36Å; L103-L105 VanDerWaalsContact C-N 3.32Å; L103-L105 PolarHBondContact O-N 2.96Å; L103-E106 PolarHBondContact O-N 3.45Å; L103-T107 HydrophobicContact CD1-CG2 3.98Å; L103-T107 HydrophobicContact CG-CG2 4.37Å; L103-T107 WeakPolarHBondContact O-CB 3.46Å; L103-T107 WeakPolarHBondContact O-CG2 3.47Å; L103-T107 PolarHBondContact O-N 3.43Å; L103-T107 PolarHBondContact O-OG1 2.85Å
104	F	92.2	Very high	91.3	Very high	30 Å²	30	39.4 Å²	39.4	13%	0.132	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-37.1	175.8	-67.5	-48.3	0	0	0	112.4	K100 L101 G102 C108 R109 E112 F113 K116	K100-F104 HydrophobicContact CB-CE2 4.42Å; K100-F104 WeakPolarHBondContact O-CD2 3.46Å; K100-F104 WeakPolarHBondContact O-CG 3.35Å; K100-F104 PolarHBondContact O-N 3.25Å; L101-F104 HydrophobicContact CD2-CD2 4.25Å; L101-F104 PolarHBondContact O-N 3.01Å; L101-F104 VanDerWaalsContact O-N 3.15Å; G102-F104 PolarHBondContact O-N 2.91Å; F104-C108 PolarHBondContact O-N 2.95Å; F104-C108 VanDerWaalsContact O-N 3.11Å; F104-R109 HydrophobicContact CB-CB 4.45Å; F104-R109 HydrophobicContact CD1-CB 4.08Å; F104-R109 PolarHBondContact O-N 3.26Å; F104-E112 HydrophobicContact CD1-CB 4.08Å; F104-E112 HydrophobicContact CE1-CB 4.08Å; F104-E112 WeakPolarHBondContact CE1-OE2 3.12Å; F104-E112 HydrophobicContact CG-CB 4.42Å; F104-E112 HydrophobicContact CZ-CB 4.42Å; F104-F113 HydrophobicContact CB-CB 3.91Å; F104-F113 HydrophobicContact CB-CD2 4.43Å; F104-K116 HydrophobicContact CD2-CG 4.49Å; F104-K116 HydrophobicContact CE2-CG 3.83Å
105	L	90.4	Very high	91.4	Very high	10 Å²	10	42.2 Å²	42.2	5%	0.052	22%	0.218	C	C	.	.	H	α-helix	trans	-69.9	-43.4	174.4	-68.6	176.3	0	0	0	112.1	I70 L101 G102 L103 T107 C108 F110 F113 V134 F137	I70-L105 HydrophobicContact CG2-CD1 3.4Å; L101-L105 PolarHBondContact O-N 2.95Å; G102-L105 PolarHBondContact O-N 3.43Å; L103-L105 VanDerWaalsContact C-N 3.32Å; L103-L105 PolarHBondContact O-N 2.96Å; L105-T107 VanDerWaalsContact C-N 3.31Å; L105-T107 PolarHBondContact O-N 3.42Å; L105-C108 PolarHBondContact O-N 2.96Å; L105-F110 HydrophobicContact CD2-CD1 4.1Å; L105-F110 HydrophobicContact CD2-CE1 4.22Å; L105-F113 HydrophobicContact CD1-CD2 4.12Å; L105-F113 HydrophobicContact CD1-CE2 3.54Å; L105-F113 HydrophobicContact CD1-CZ 4.05Å; L105-F113 HydrophobicContact CD2-CD1 4.25Å; L105-F113 HydrophobicContact CD2-CD2 3.73Å; L105-F113 HydrophobicContact CD2-CE1 4.36Å; L105-F113 HydrophobicContact CD2-CE2 3.83Å; L105-F113 HydrophobicContact CD2-CG 3.95Å; L105-F113 HydrophobicContact CD2-CZ 4.14Å; L105-F113 HydrophobicContact CG-CD2 3.58Å; L105-F113 HydrophobicContact CG-CE2 3.56Å; L105-F113 HydrophobicContact CG-CG 4.3Å; L105-F113 HydrophobicContact CG-CZ 4.28Å; L105-V134 HydrophobicContact CD2-CG1 3.97Å; L105-F137 HydrophobicContact CB-CE1 4.42Å; L105-F137 HydrophobicContact CD2-CD1 4.44Å
106	E	87.5	Confident	91.3	Very high	66 Å²	66	46.2 Å²	46.2	31%	0.308	24%	0.236	S	C	.	.	H	α-helix	trans	-60.9	-39.7	175.8	-74.6	174.4	-178.7	0	0	111.9	F78 G102 L103 C108	F78-E106 WeakPolarHBondContact CD1-OE1 3.19Å; G102-E106 WeakPolarHBondContact O-CG 3.42Å; G102-E106 PolarHBondContact O-N 3.22Å; L103-E106 PolarHBondContact O-N 3.45Å; E106-C108 VanDerWaalsContact C-N 3.29Å; E106-C108 PolarHBondContact O-N 3Å
107	T	90	Very high	91.2	Very high	62 Å²	62	46.5 Å²	46.5	38%	0.38	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	8.2	178.7	59.1	0	0	0	0	113.7	L103 L105 R109	L103-T107 HydrophobicContact CD1-CG2 3.98Å; L103-T107 HydrophobicContact CG-CG2 4.37Å; L103-T107 WeakPolarHBondContact O-CB 3.46Å; L103-T107 WeakPolarHBondContact O-CG2 3.47Å; L103-T107 PolarHBondContact O-N 3.43Å; L103-T107 PolarHBondContact O-OG1 2.85Å; L105-T107 VanDerWaalsContact C-N 3.31Å; L105-T107 PolarHBondContact O-N 3.42Å; T107-R109 PolarHBondContact O-N 2.63Å
108	C	90.2	Very high	91	Very high	58 Å²	58	50.5 Å²	50.5	39%	0.392	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	27.9	179.6	-60.4	0	0	0	0	114.8	F104 L105 E106 F110	F104-C108 PolarHBondContact O-N 2.95Å; F104-C108 VanDerWaalsContact O-N 3.11Å; L105-C108 PolarHBondContact O-N 2.96Å; E106-C108 VanDerWaalsContact C-N 3.29Å; E106-C108 PolarHBondContact O-N 3Å; C108-F110 VanDerWaalsContact C-N 3.29Å; C108-F110 HydrophobicContact CB-CE1 4.38Å; C108-F110 HydrophobicContact CB-CE2 4.07Å; C108-F110 HydrophobicContact CB-CZ 3.82Å; C108-F110 PolarHBondContact O-N 3.06Å; C108-F110 VanDerWaalsContact O-N 3.13Å
109	R	92	Very high	90.9	Very high	129 Å²	129	55.1 Å²	55.1	49%	0.487	28%	0.275	S	S	.	.			trans	-88.2	65.7	176.4	-58.8	-169.7	-158	-168	2	111	F104 T107 S111 E112 F113	F104-R109 HydrophobicContact CB-CB 4.45Å; F104-R109 HydrophobicContact CD1-CB 4.08Å; F104-R109 PolarHBondContact O-N 3.26Å; T107-R109 PolarHBondContact O-N 2.63Å; R109-S111 PolarHBondContact O-N 3.1Å; R109-E112 HydrophobicContact CB-CB 4.28Å; R109-E112 WeakPolarHBondContact CD-OE1 3.28Å; R109-E112 IonicContact NH1-OE1 3.46Å; R109-E112 IonicContact NH1-OE2 3.24Å; R109-E112 PolarHBondContact O-N 3.29Å; R109-F113 PolarHBondContact O-N 2.98Å
110	F	92.6	Very high	90.6	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.022	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-36.9	-172.1	-54.2	-49	0	0	0	113.6	L105 C108 E112 F113 W114 F137 I138 I141 F157	L105-F110 HydrophobicContact CD2-CD1 4.1Å; L105-F110 HydrophobicContact CD2-CE1 4.22Å; C108-F110 VanDerWaalsContact C-N 3.29Å; C108-F110 HydrophobicContact CB-CE1 4.38Å; C108-F110 HydrophobicContact CB-CE2 4.07Å; C108-F110 HydrophobicContact CB-CZ 3.82Å; C108-F110 PolarHBondContact O-N 3.06Å; C108-F110 VanDerWaalsContact O-N 3.13Å; F110-E112 PolarHBondContact O-N 2.9Å; F110-F113 WeakPolarHBondContact O-CB 3.48Å; F110-F113 PolarHBondContact O-N 3.36Å; F110-W114 PolarHBondContact O-N 3.03Å; F110-F137 HydrophobicContact CE1-CE1 4.21Å; F110-I138 HydrophobicContact CB-CD1 4.09Å; F110-I138 HydrophobicContact CD1-CD1 3.67Å; F110-I138 HydrophobicContact CD1-CG1 3.59Å; F110-I138 HydrophobicContact CD2-CG1 4.34Å; F110-I138 HydrophobicContact CD2-CG2 3.93Å; F110-I138 HydrophobicContact CE1-CD1 4.24Å; F110-I138 HydrophobicContact CE1-CG1 3.63Å; F110-I138 HydrophobicContact CE2-CG1 4.36Å; F110-I138 HydrophobicContact CE2-CG2 3.96Å; F110-I138 HydrophobicContact CG-CD1 3.84Å; F110-I138 HydrophobicContact CG-CG1 3.97Å; F110-I138 HydrophobicContact CG-CG2 4.29Å; F110-I138 HydrophobicContact CZ-CG1 4.01Å; F110-I138 HydrophobicContact CZ-CG2 4.36Å; F110-I141 HydrophobicContact CZ-CG2 4.4Å; F110-F157 HydrophobicContact CB-CB 4.29Å; F110-F157 HydrophobicContact CB-CD1 4.21Å; F110-F157 HydrophobicContact CD2-CB 4.02Å; F110-F157 AromaticContact CD2-CD1 3.93Å; F110-F157 HydrophobicContact CD2-CD1 3.93Å; F110-F157 HydrophobicContact CD2-CD2 4.21Å; F110-F157 HydrophobicContact CD2-CE1 4.4Å; F110-F157 AromaticContact CD2-CG 3.81Å; F110-F157 HydrophobicContact CD2-CG 3.81Å
111	S	90.6	Very high	90.2	Very high	52 Å²	52	54.9 Å²	54.9	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-64.8	-40.8	179	-43.7	0	0	0	0	112.5	R109 T115	R109-S111 PolarHBondContact O-N 3.1Å; S111-T115 PolarHBondContact O-N 2.86Å; S111-T115 PolarHBondContact O-OG1 3.29Å
112	E	91.7	Very high	89.9	Confident	86 Å²	86	63.2 Å²	63.2	40%	0.402	32%	0.318	S	S	.	.	H	α-helix	trans	-67.5	-39.9	175	-67.8	179.9	-138.4	0	0	110.9	F104 R109 F110 T115 K116	F104-E112 HydrophobicContact CD1-CB 4.08Å; F104-E112 HydrophobicContact CE1-CB 4.08Å; F104-E112 WeakPolarHBondContact CE1-OE2 3.12Å; F104-E112 HydrophobicContact CG-CB 4.42Å; F104-E112 HydrophobicContact CZ-CB 4.42Å; R109-E112 HydrophobicContact CB-CB 4.28Å; R109-E112 WeakPolarHBondContact CD-OE1 3.28Å; R109-E112 IonicContact NH1-OE1 3.46Å; R109-E112 IonicContact NH1-OE2 3.24Å; R109-E112 PolarHBondContact O-N 3.29Å; F110-E112 PolarHBondContact O-N 2.9Å; E112-T115 PolarHBondContact O-N 2.94Å; E112-K116 WeakPolarHBondContact O-CG 3.32Å; E112-K116 PolarHBondContact O-N 3.45Å
113	F	92.5	Very high	89.4	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-55.4	-52.6	174.6	173.1	-89	0	0	0	111.7	L101 F104 L105 R109 F110 T115 K116 V117 F130 V134	L101-F113 HydrophobicContact CB-CD2 4.12Å; L101-F113 HydrophobicContact CB-CE2 4.02Å; L101-F113 HydrophobicContact CD2-CD2 3.49Å; L101-F113 VanDerWaalsContact CD2-CD2 3.49Å; L101-F113 HydrophobicContact CD2-CE2 3.83Å; L101-F113 HydrophobicContact CD2-CG 4.16Å; L101-F113 HydrophobicContact CG-CD2 4.4Å; L101-F113 HydrophobicContact CG-CE2 4.45Å; F104-F113 HydrophobicContact CB-CB 3.91Å; F104-F113 HydrophobicContact CB-CD2 4.43Å; L105-F113 HydrophobicContact CD1-CD2 4.12Å; L105-F113 HydrophobicContact CD1-CE2 3.54Å; L105-F113 HydrophobicContact CD1-CZ 4.05Å; L105-F113 HydrophobicContact CD2-CD1 4.25Å; L105-F113 HydrophobicContact CD2-CD2 3.73Å; L105-F113 HydrophobicContact CD2-CE1 4.36Å; L105-F113 HydrophobicContact CD2-CE2 3.83Å; L105-F113 HydrophobicContact CD2-CG 3.95Å; L105-F113 HydrophobicContact CD2-CZ 4.14Å; L105-F113 HydrophobicContact CG-CD2 3.58Å; L105-F113 HydrophobicContact CG-CE2 3.56Å; L105-F113 HydrophobicContact CG-CG 4.3Å; L105-F113 HydrophobicContact CG-CZ 4.28Å; R109-F113 PolarHBondContact O-N 2.98Å; F110-F113 WeakPolarHBondContact O-CB 3.48Å; F110-F113 PolarHBondContact O-N 3.36Å; F113-T115 VanDerWaalsContact C-N 3.32Å; F113-T115 PolarHBondContact O-N 3.18Å; F113-K116 PolarHBondContact O-N 3.41Å; F113-V117 HydrophobicContact CD1-CG2 4.18Å; F113-V117 HydrophobicContact CE1-CG2 3.76Å; F113-V117 HydrophobicContact CE2-CG2 4.31Å; F113-V117 HydrophobicContact CZ-CG2 3.85Å; F113-V117 WeakPolarHBondContact O-CG2 3.44Å; F113-V117 PolarHBondContact O-N 2.96Å; F113-F130 HydrophobicContact CE1-CE1 4.39Å; F113-F130 HydrophobicContact CE2-CZ 4.39Å; F113-F130 AromaticContact CZ-CE1 3.84Å; F113-F130 HydrophobicContact CZ-CE1 3.84Å; F113-F130 AromaticContact CZ-CZ 3.69Å; F113-F130 HydrophobicContact CZ-CZ 3.69Å; F113-V134 HydrophobicContact CD1-CG1 4.4Å; F113-V134 HydrophobicContact CE1-CG1 3.65Å; F113-V134 HydrophobicContact CE1-CG2 4.41Å; F113-V134 HydrophobicContact CZ-CG1 3.94Å; F113-V134 HydrophobicContact CZ-CG2 4Å
114	W	92.6	Very high	89	Confident	9 Å²	9	60 Å²	60	3%	0.034	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-35.5	-179.1	-66.4	119.1	0	0	0	113	F110 K116 V117 K118 R131 V134 I138 F157 D159	F110-W114 PolarHBondContact O-N 3.03Å; W114-K116 VanDerWaalsContact C-N 3.33Å; W114-K116 PolarHBondContact O-N 2.98Å; W114-V117 PolarHBondContact O-N 3.41Å; W114-K118 WeakPolarHBondContact O-CG 3.49Å; W114-K118 PolarHBondContact O-N 3.08Å; W114-R131 HydrophobicContact CH2-CG 3.83Å; W114-R131 HydrophobicContact CZ3-CG 4.02Å; W114-V134 HydrophobicContact CH2-CB 4.14Å; W114-V134 HydrophobicContact CH2-CG1 3.87Å; W114-V134 HydrophobicContact CZ2-CG1 3.82Å; W114-I138 HydrophobicContact CZ2-CD1 3.92Å; W114-F157 PolarHBondContact NE1-O 3.49Å; W114-D159 HydrophobicContact CB-CB 3.77Å; W114-D159 VanDerWaalsContact CD1-CB 3.46Å; W114-D159 HydrophobicContact CD2-CB 3.77Å; W114-D159 HydrophobicContact CG-CB 3.38Å
115	T	91.9	Very high	88.4	Confident	77 Å²	77	63.2 Å²	63.2	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-59.6	-46	174	-56.2	0	0	0	0	110.6	S111 E112 F113 K118 E119	S111-T115 PolarHBondContact O-N 2.86Å; S111-T115 PolarHBondContact O-OG1 3.29Å; E112-T115 PolarHBondContact O-N 2.94Å; F113-T115 VanDerWaalsContact C-N 3.32Å; F113-T115 PolarHBondContact O-N 3.18Å; T115-K118 PolarHBondContact O-N 3.14Å; T115-E119 WeakPolarHBondContact O-CG 3.25Å; T115-E119 PolarHBondContact O-N 3.41Å; T115-E119 VanDerWaalsContact O-N 3.09Å
116	K	89.8	Confident	88	Confident	86 Å²	86	64.5 Å²	64.5	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-68.9	-34.7	178.8	-72.6	-77.4	164.5	-146.2	0	113.3	L101 F104 E112 F113 W114 K118 E119 N120	L101-K116 HydrophobicContact CD2-CB 3.65Å; F104-K116 HydrophobicContact CD2-CG 4.49Å; F104-K116 HydrophobicContact CE2-CG 3.83Å; E112-K116 WeakPolarHBondContact O-CG 3.32Å; E112-K116 PolarHBondContact O-N 3.45Å; F113-K116 PolarHBondContact O-N 3.41Å; W114-K116 VanDerWaalsContact C-N 3.33Å; W114-K116 PolarHBondContact O-N 2.98Å; K116-K118 VanDerWaalsContact C-N 3.34Å; K116-E119 WeakPolarHBondContact CD-OE2 3.33Å; K116-E119 VanDerWaalsContact NZ-CD 3.35Å; K116-E119 IonicContact NZ-OE1 2.82Å; K116-E119 PolarHBondContact NZ-OE1 3.07Å; K116-E119 IonicContact NZ-OE2 2.78Å; K116-E119 PolarHBondContact NZ-OE2 2.86Å; K116-E119 PolarHBondContact O-N 3.29Å; K116-N120 PolarHBondContact O-N 3.46Å
117	V	90	Very high	88	Confident	21 Å²	21	61.7 Å²	61.7	13%	0.127	33%	0.325	C	S	.	.	H	α-helix	trans	-64.2	-39.1	172.8	171.4	0	0	0	0	111.3	L101 F113 W114 N120 F124 F130	L101-V117 HydrophobicContact CD1-CG2 4.46Å; L101-V117 HydrophobicContact CD2-CG2 4.03Å; F113-V117 HydrophobicContact CD1-CG2 4.18Å; F113-V117 HydrophobicContact CE1-CG2 3.76Å; F113-V117 HydrophobicContact CE2-CG2 4.31Å; F113-V117 HydrophobicContact CZ-CG2 3.85Å; F113-V117 WeakPolarHBondContact O-CG2 3.44Å; F113-V117 PolarHBondContact O-N 2.96Å; W114-V117 PolarHBondContact O-N 3.41Å; V117-N120 CarbonylContact O-C 3.44Å; V117-F124 HydrophobicContact CB-CD2 4.26Å; V117-F124 HydrophobicContact CB-CE2 4.45Å; V117-F124 HydrophobicContact CG1-CD2 3.89Å; V117-F124 HydrophobicContact CG1-CG 4.35Å; V117-F124 HydrophobicContact CG2-CD2 4.21Å; V117-F124 HydrophobicContact CG2-CE2 4.26Å; V117-F130 HydrophobicContact CG2-CE1 4.25Å
118	K	88.4	Confident	87.8	Confident	127 Å²	127	62 Å²	62	55%	0.552	33%	0.328	S	S	*	.	H	α-helix	trans	-69.2	-32.7	176.8	-73.7	174	-176.5	169	0	113.5	W114 T115 K116 D159	W114-K118 WeakPolarHBondContact O-CG 3.49Å; W114-K118 PolarHBondContact O-N 3.08Å; T115-K118 PolarHBondContact O-N 3.14Å; K116-K118 VanDerWaalsContact C-N 3.34Å; K118-D159 WeakPolarHBondContact CE-OD2 2.82Å; K118-D159 IonicContact NZ-OD1 3.73Å; K118-D159 PolarHBondContact NZ-OD1 3.09Å; K118-D159 IonicContact NZ-OD2 3.91Å; K118-D159 PolarHBondContact NZ-OD2 3.01Å
119	E	89.3	Confident	87.6	Confident	97 Å²	97	60.4 Å²	60.4	45%	0.453	32%	0.321	S	S	.	.	H	α-helix	trans	-63.9	-41.7	176.2	-74.1	173.5	-167.7	0	0	111.6	T115 K116 P121	T115-E119 WeakPolarHBondContact O-CG 3.25Å; T115-E119 PolarHBondContact O-N 3.41Å; T115-E119 VanDerWaalsContact O-N 3.09Å; K116-E119 WeakPolarHBondContact CD-OE2 3.33Å; K116-E119 VanDerWaalsContact NZ-CD 3.35Å; K116-E119 IonicContact NZ-OE1 2.82Å; K116-E119 PolarHBondContact NZ-OE1 3.07Å; K116-E119 IonicContact NZ-OE2 2.78Å; K116-E119 PolarHBondContact NZ-OE2 2.86Å; K116-E119 PolarHBondContact O-N 3.29Å; E119-P121 WeakPolarHBondContact O-CD 3.39Å
120	N	86.3	Confident	87.4	Confident	60 Å²	60	54.9 Å²	54.9	32%	0.321	30%	0.301	S	S	.	.			trans	-128.8	65.8	-173.7	-66.8	-42.7	0	0	0	113.2	Q97 K116 V117 K122 I123 F124	Q97-N120 VanDerWaalsContact CD-ND2 3.33Å; Q97-N120 PolarHBondContact NE2-ND2 3.5Å; Q97-N120 PolarHBondContact OE1-ND2 3.34Å; K116-N120 PolarHBondContact O-N 3.46Å; V117-N120 CarbonylContact O-C 3.44Å; N120-K122 PolarHBondContact O-N 3.17Å; N120-K122 VanDerWaalsContact O-N 3.1Å; N120-I123 HydrophobicContact CB-CD1 3.94Å; N120-I123 HydrophobicContact CB-CG1 4.39Å; N120-I123 PolarHBondContact O-N 3.12Å; N120-F124 WeakPolarHBondContact O-CD2 3.41Å; N120-F124 VanDerWaalsContact O-CE2 3.23Å; N120-F124 WeakPolarHBondContact O-CE2 3.43Å
121	P	84.8	Confident	87.3	Confident	76 Å²	76	59.2 Å²	59.2	49%	0.494	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-26.1	-174.3	24.8	-34.5	0	0	0	113.4	E119 I123 F124 S125	E119-P121 WeakPolarHBondContact O-CD 3.39Å; P121-I123 PolarHBondContact O-N 3.04Å; P121-F124 PolarHBondContact O-N 3.43Å; P121-S125 WeakPolarHBondContact O-CB 3.47Å; P121-S125 PolarHBondContact O-N 3.34Å; P121-S125 PolarHBondContact O-OG 3Å
122	K	83.8	Confident	87.2	Confident	181 Å²	181	61.9 Å²	61.9	79%	0.787	32%	0.324	S	S	*	.	H	α-helix	trans	-61.3	-26.9	-179.1	-64.2	-177.4	-179.4	178.8	0	113.5	N120 S125	N120-K122 PolarHBondContact O-N 3.17Å; N120-K122 VanDerWaalsContact O-N 3.1Å; K122-S125 PolarHBondContact O-OG 3.21Å
123	I	80.7	Confident	87.1	Confident	19 Å²	19	58.7 Å²	58.7	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-75.2	-33.2	-178.3	-65.5	178.3	0	0	0	110.7	R63 L67 P94 Q97 V98 N120 P121	R63-I123 PolarHBondContact NH1-O 3.22Å; L67-I123 HydrophobicContact CD1-CG2 4.48Å; L67-I123 VanDerWaalsContact CD1-O 3.29Å; L67-I123 WeakPolarHBondContact CD1-O 3.37Å; P94-I123 HydrophobicContact CB-CD1 4.48Å; Q97-I123 HydrophobicContact CB-CD1 4.12Å; V98-I123 HydrophobicContact CG2-CG2 3.89Å; N120-I123 HydrophobicContact CB-CD1 3.94Å; N120-I123 HydrophobicContact CB-CG1 4.39Å; N120-I123 PolarHBondContact O-N 3.12Å; P121-I123 PolarHBondContact O-N 3.04Å
124	F	81.1	Confident	87	Confident	10 Å²	10	58.8 Å²	58.8	4%	0.044	31%	0.312	C	S	.	.	H	α-helix	trans	-101.2	-22.8	-172.9	-47.1	-69.3	0	0	0	112.8	L67 L101 V117 N120 P121 A126 I127 F130	L67-F124 HydrophobicContact CD2-CD1 3.65Å; L67-F124 HydrophobicContact CD2-CE1 3.69Å; L101-F124 HydrophobicContact CD1-CD1 4.33Å; L101-F124 HydrophobicContact CD1-CE1 3.16Å; L101-F124 HydrophobicContact CD1-CE2 3.86Å; L101-F124 HydrophobicContact CD1-CZ 2.91Å; L101-F124 HydrophobicContact CG-CZ 4.39Å; V117-F124 HydrophobicContact CB-CD2 4.26Å; V117-F124 HydrophobicContact CB-CE2 4.45Å; V117-F124 HydrophobicContact CG1-CD2 3.89Å; V117-F124 HydrophobicContact CG1-CG 4.35Å; V117-F124 HydrophobicContact CG2-CD2 4.21Å; V117-F124 HydrophobicContact CG2-CE2 4.26Å; N120-F124 WeakPolarHBondContact O-CD2 3.41Å; N120-F124 VanDerWaalsContact O-CE2 3.23Å; N120-F124 WeakPolarHBondContact O-CE2 3.43Å; P121-F124 PolarHBondContact O-N 3.43Å; F124-A126 PolarHBondContact O-N 3.22Å; F124-I127 PolarHBondContact O-N 2.92Å; F124-F130 HydrophobicContact CB-CD1 4.11Å; F124-F130 HydrophobicContact CB-CE1 4.16Å; F124-F130 HydrophobicContact CB-CG 4.42Å; F124-F130 HydrophobicContact CD1-CE1 4.06Å; F124-F130 HydrophobicContact CD1-CE2 4.07Å; F124-F130 AromaticContact CD1-CZ 3.7Å; F124-F130 HydrophobicContact CD1-CZ 3.7Å; F124-F130 HydrophobicContact CE1-CZ 4.46Å; F124-F130 HydrophobicContact CG-CE1 4.17Å; F124-F130 HydrophobicContact CG-CZ 4.28Å
125	S	81.2	Confident	86.9	Confident	96 Å²	96	58.6 Å²	58.6	67%	0.671	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.2	179.6	61.5	0	0	0	0	114	P121 K122 I127	P121-S125 WeakPolarHBondContact O-CB 3.47Å; P121-S125 PolarHBondContact O-N 3.34Å; P121-S125 PolarHBondContact O-OG 3Å; K122-S125 PolarHBondContact O-OG 3.21Å; S125-I127 VanDerWaalsContact C-N 3.32Å; S125-I127 PolarHBondContact O-N 2.83Å
126	A	81.8	Confident	86.8	Confident	38 Å²	38	61.5 Å²	61.5	31%	0.314	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.8	179.2	0	0	0	0	0	113.7	I33 L64 F124	I33-A126 WeakPolarHBondContact CG2-O 3.2Å; L64-A126 HydrophobicContact CD2-CB 3.8Å; F124-A126 PolarHBondContact O-N 3.22Å
127	I	86.2	Confident	86.8	Confident	7 Å²	7	58 Å²	58	4%	0.036	30%	0.303	C	S	.	.	S	Bend	trans	-110.4	116.8	-176.3	-56	174.6	0	0	0	111.1	L64 L67 K68 I71 F124 S125 F130	L64-I127 HydrophobicContact CD2-CG1 4.29Å; L67-I127 HydrophobicContact CB-CD1 3.27Å; L67-I127 HydrophobicContact CD1-CD1 4.12Å; L67-I127 HydrophobicContact CG-CD1 4.32Å; K68-I127 HydrophobicContact CD-CD1 4.24Å; K68-I127 HydrophobicContact CD-CG2 4.26Å; K68-I127 HydrophobicContact CG-CD1 4.12Å; I71-I127 HydrophobicContact CD1-CB 3.82Å; I71-I127 HydrophobicContact CD1-CD1 3.72Å; I71-I127 HydrophobicContact CD1-CG1 4.39Å; I71-I127 HydrophobicContact CD1-CG2 3.27Å; F124-I127 PolarHBondContact O-N 2.92Å; S125-I127 VanDerWaalsContact C-N 3.32Å; S125-I127 PolarHBondContact O-N 2.83Å; I127-F130 PolarHBondContact O-N 2.83Å
128	P	86.5	Confident	86.8	Confident	67 Å²	67	57 Å²	57	44%	0.435	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	136.7	174.7	28.2	-33.8	0	0	0	109.9	I33	I33-P128 VanDerWaalsContact O-CG 3.25Å; I33-P128 WeakPolarHBondContact O-CG 3.44Å
129	G	85.9	Confident	86.8	Confident	25 Å²	25	51.7 Å²	51.7	26%	0.258	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	12.1	177.5	0	0	0	0	0	115.4	E132 S133	G129-E132 VanDerWaalsContact C-OE2 3.25Å; G129-E132 WeakPolarHBondContact CA-OE2 3.34Å; G129-S133 WeakPolarHBondContact O-CB 3.42Å; G129-S133 PolarHBondContact O-N 3.5Å; G129-S133 PolarHBondContact O-OG 2.83Å
130	F	88.9	Confident	86.8	Confident	13 Å²	13	51.2 Å²	51.2	6%	0.057	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-51.3	-179.6	178.9	-95.1	0	0	0	111.6	L67 I70 I71 F113 V117 F124 I127 E132 S133 V134	L67-F130 HydrophobicContact CD2-CE2 4.06Å; I70-F130 HydrophobicContact CG2-CE2 4.42Å; I71-F130 HydrophobicContact CD1-CB 4.17Å; I71-F130 HydrophobicContact CD1-CD2 3.52Å; I71-F130 HydrophobicContact CD1-CE2 4.4Å; I71-F130 HydrophobicContact CD1-CG 4.31Å; I71-F130 HydrophobicContact CG1-CD2 3.61Å; I71-F130 HydrophobicContact CG1-CE2 4.19Å; I71-F130 HydrophobicContact CG1-CG 4.47Å; F113-F130 HydrophobicContact CE1-CE1 4.39Å; F113-F130 HydrophobicContact CE2-CZ 4.39Å; F113-F130 AromaticContact CZ-CE1 3.84Å; F113-F130 HydrophobicContact CZ-CE1 3.84Å; F113-F130 AromaticContact CZ-CZ 3.69Å; F113-F130 HydrophobicContact CZ-CZ 3.69Å; V117-F130 HydrophobicContact CG2-CE1 4.25Å; F124-F130 HydrophobicContact CB-CD1 4.11Å; F124-F130 HydrophobicContact CB-CE1 4.16Å; F124-F130 HydrophobicContact CB-CG 4.42Å; F124-F130 HydrophobicContact CD1-CE1 4.06Å; F124-F130 HydrophobicContact CD1-CE2 4.07Å; F124-F130 AromaticContact CD1-CZ 3.7Å; F124-F130 HydrophobicContact CD1-CZ 3.7Å; F124-F130 HydrophobicContact CE1-CZ 4.46Å; F124-F130 HydrophobicContact CG-CE1 4.17Å; F124-F130 HydrophobicContact CG-CZ 4.28Å; I127-F130 PolarHBondContact O-N 2.83Å; F130-E132 PolarHBondContact O-N 3.38Å; F130-S133 PolarHBondContact O-N 3.36Å; F130-V134 HydrophobicContact CD1-CG2 4.42Å; F130-V134 HydrophobicContact CE1-CG2 4.11Å; F130-V134 HydrophobicContact CE2-CG2 4.31Å; F130-V134 HydrophobicContact CZ-CG2 4.05Å; F130-V134 VanDerWaalsContact O-CG2 3.32Å; F130-V134 WeakPolarHBondContact O-CG2 3.45Å; F130-V134 PolarHBondContact O-N 3.16Å
131	R	89.4	Confident	86.8	Confident	96 Å²	96	49.8 Å²	49.8	36%	0.362	26%	0.264	S	S	.	.	H	α-helix	trans	-63.5	-45.5	-177.5	-177.2	172.7	-175.9	-88.4	-0.1	111.1	W114 S133 V134 C135 D159	W114-R131 HydrophobicContact CH2-CG 3.83Å; W114-R131 HydrophobicContact CZ3-CG 4.02Å; R131-S133 VanDerWaalsContact C-N 3.34Å; R131-S133 PolarHBondContact O-N 2.72Å; R131-V134 PolarHBondContact O-N 2.99Å; R131-C135 WeakPolarHBondContact O-CB 3.38Å; R131-C135 PolarHBondContact O-N 3Å; R131-C135 PolarHBondContact O-SG 2.58Å; R131-D159 PolarHBondContact NH2-O 3.39Å
132	E	89	Confident	87	Confident	108 Å²	108	46.2 Å²	46.2	51%	0.505	24%	0.241	S	C	.	.	H	α-helix	trans	-61.5	-42.9	-178.5	-65.7	73.8	-166.7	0	0	111.4	G129 F130 C135 K136	G129-E132 VanDerWaalsContact C-OE2 3.25Å; G129-E132 WeakPolarHBondContact CA-OE2 3.34Å; F130-E132 PolarHBondContact O-N 3.38Å; E132-C135 PolarHBondContact O-N 2.92Å; E132-K136 WeakPolarHBondContact O-CG 3.17Å; E132-K136 PolarHBondContact O-N 3.12Å
133	S	88.8	Confident	87.1	Confident	19 Å²	19	39.1 Å²	39.1	13%	0.133	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-41.7	178.5	-55.7	0	0	0	0	112	I71 G129 F130 R131 K136 F137	I71-S133 WeakPolarHBondContact CG2-OG 3.4Å; G129-S133 WeakPolarHBondContact O-CB 3.42Å; G129-S133 PolarHBondContact O-N 3.5Å; G129-S133 PolarHBondContact O-OG 2.83Å; F130-S133 PolarHBondContact O-N 3.36Å; R131-S133 VanDerWaalsContact C-N 3.34Å; R131-S133 PolarHBondContact O-N 2.72Å; S133-K136 WeakPolarHBondContact O-CB 3.45Å; S133-K136 PolarHBondContact O-N 2.85Å; S133-F137 PolarHBondContact O-N 3.24Å
134	V	90.7	Very high	87.3	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-42.3	174.1	174.6	0	0	0	0	111.1	L105 F113 W114 F130 R131 K136 F137 I138	L105-V134 HydrophobicContact CD2-CG1 3.97Å; F113-V134 HydrophobicContact CD1-CG1 4.4Å; F113-V134 HydrophobicContact CE1-CG1 3.65Å; F113-V134 HydrophobicContact CE1-CG2 4.41Å; F113-V134 HydrophobicContact CZ-CG1 3.94Å; F113-V134 HydrophobicContact CZ-CG2 4Å; W114-V134 HydrophobicContact CH2-CB 4.14Å; W114-V134 HydrophobicContact CH2-CG1 3.87Å; W114-V134 HydrophobicContact CZ2-CG1 3.82Å; F130-V134 HydrophobicContact CD1-CG2 4.42Å; F130-V134 HydrophobicContact CE1-CG2 4.11Å; F130-V134 HydrophobicContact CE2-CG2 4.31Å; F130-V134 HydrophobicContact CZ-CG2 4.05Å; F130-V134 VanDerWaalsContact O-CG2 3.32Å; F130-V134 WeakPolarHBondContact O-CG2 3.45Å; F130-V134 PolarHBondContact O-N 3.16Å; R131-V134 PolarHBondContact O-N 2.99Å; V134-K136 VanDerWaalsContact C-N 3.33Å; V134-K136 PolarHBondContact O-N 3.33Å; V134-F137 WeakPolarHBondContact O-CB 3.46Å; V134-F137 PolarHBondContact O-N 3.47Å; V134-F137 VanDerWaalsContact O-N 3.16Å; V134-I138 HydrophobicContact CG1-CD1 3.85Å; V134-I138 HydrophobicContact CG1-CG1 4.32Å; V134-I138 VanDerWaalsContact O-CG1 3.31Å; V134-I138 WeakPolarHBondContact O-CG1 3.5Å; V134-I138 PolarHBondContact O-N 3.19Å
135	C	90.6	Very high	87.5	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.034	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-42.9	174.8	-71.3	0	0	0	0	111.6	R131 E132 F137 I138 V139 L158 F168	R131-C135 WeakPolarHBondContact O-CB 3.38Å; R131-C135 PolarHBondContact O-N 3Å; R131-C135 PolarHBondContact O-SG 2.58Å; E132-C135 PolarHBondContact O-N 2.92Å; C135-F137 VanDerWaalsContact C-N 3.3Å; C135-F137 PolarHBondContact O-N 2.9Å; C135-I138 PolarHBondContact O-N 3.36Å; C135-V139 WeakPolarHBondContact O-CB 3.36Å; C135-V139 WeakPolarHBondContact O-CG2 3.45Å; C135-V139 PolarHBondContact O-N 3.49Å; C135-L158 HydrophobicContact CB-CD2 4.27Å; C135-F168 HydrophobicContact CB-CZ 4.47Å
136	K	89.2	Confident	87.7	Confident	138 Å²	138	46.5 Å²	46.5	60%	0.6	24%	0.241	S	C	*	.	H	α-helix	trans	-59.2	-41	174.2	-75.6	175.2	-178.4	179.9	0	112.2	M73 E132 S133 V134 V139 Q140	M73-K136 HydrophobicContact CE-CB 4.46Å; M73-K136 HydrophobicContact SD-CB 4.1Å; E132-K136 WeakPolarHBondContact O-CG 3.17Å; E132-K136 PolarHBondContact O-N 3.12Å; S133-K136 WeakPolarHBondContact O-CB 3.45Å; S133-K136 PolarHBondContact O-N 2.85Å; V134-K136 VanDerWaalsContact C-N 3.33Å; V134-K136 PolarHBondContact O-N 3.33Å; K136-V139 PolarHBondContact O-N 3.28Å; K136-Q140 WeakPolarHBondContact O-CB 3.47Å; K136-Q140 PolarHBondContact O-N 2.86Å
137	F	89.8	Confident	87.7	Confident	13 Å²	13	48.7 Å²	48.7	6%	0.057	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-50.5	174.3	175.9	-103.2	0	0	0	112.5	M73 H75 L105 F110 S133 V134 C135 V139 Q140 I141	M73-F137 HydrophobicContact CB-CD2 4.19Å; M73-F137 HydrophobicContact CE-CB 3.62Å; M73-F137 HydrophobicContact CE-CD2 4.02Å; M73-F137 HydrophobicContact CE-CG 4.33Å; M73-F137 HydrophobicContact CG-CB 3.91Å; M73-F137 HydrophobicContact CG-CD2 4.32Å; M73-F137 HydrophobicContact CG-CG 4.49Å; M73-F137 HydrophobicContact SD-CB 3.9Å; H75-F137 AromaticContact CE1-CE2 3.53Å; H75-F137 AromaticContact CE1-CZ 3.21Å; H75-F137 WeakPolarHBondContact CE1-CZ 3.21Å; H75-F137 AromaticContact NE2-CE2 3.19Å; H75-F137 WeakPolarHBondContact NE2-CE2 3.2Å; H75-F137 AromaticContact NE2-CZ 3.21Å; H75-F137 WeakPolarHBondContact NE2-CZ 3.38Å; L105-F137 HydrophobicContact CB-CE1 4.42Å; L105-F137 HydrophobicContact CD2-CD1 4.44Å; F110-F137 HydrophobicContact CE1-CE1 4.21Å; S133-F137 PolarHBondContact O-N 3.24Å; V134-F137 WeakPolarHBondContact O-CB 3.46Å; V134-F137 PolarHBondContact O-N 3.47Å; V134-F137 VanDerWaalsContact O-N 3.16Å; C135-F137 VanDerWaalsContact C-N 3.3Å; C135-F137 PolarHBondContact O-N 2.9Å; F137-V139 VanDerWaalsContact C-N 3.3Å; F137-V139 PolarHBondContact O-N 3.08Å; F137-Q140 WeakPolarHBondContact O-CB 3.2Å; F137-Q140 PolarHBondContact O-N 3.19Å; F137-Q140 VanDerWaalsContact O-N 3.15Å; F137-I141 HydrophobicContact CD1-CG1 4.49Å; F137-I141 HydrophobicContact CD2-CG1 4.44Å; F137-I141 HydrophobicContact CE1-CG1 3.97Å; F137-I141 HydrophobicContact CE2-CD1 3.95Å; F137-I141 HydrophobicContact CE2-CG1 3.89Å; F137-I141 HydrophobicContact CZ-CD1 3.87Å; F137-I141 HydrophobicContact CZ-CG1 3.6Å; F137-I141 WeakPolarHBondContact O-CG1 3.42Å; F137-I141 PolarHBondContact O-N 3.25Å
138	I	90.9	Very high	87.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-43.6	178.6	-65	173.4	0	0	0	110.5	F110 W114 V134 C135 Q140 I141 I142 F157 L158	F110-I138 HydrophobicContact CB-CD1 4.09Å; F110-I138 HydrophobicContact CD1-CD1 3.67Å; F110-I138 HydrophobicContact CD1-CG1 3.59Å; F110-I138 HydrophobicContact CD2-CG1 4.34Å; F110-I138 HydrophobicContact CD2-CG2 3.93Å; F110-I138 HydrophobicContact CE1-CD1 4.24Å; F110-I138 HydrophobicContact CE1-CG1 3.63Å; F110-I138 HydrophobicContact CE2-CG1 4.36Å; F110-I138 HydrophobicContact CE2-CG2 3.96Å; F110-I138 HydrophobicContact CG-CD1 3.84Å; F110-I138 HydrophobicContact CG-CG1 3.97Å; F110-I138 HydrophobicContact CG-CG2 4.29Å; F110-I138 HydrophobicContact CZ-CG1 4.01Å; F110-I138 HydrophobicContact CZ-CG2 4.36Å; W114-I138 HydrophobicContact CZ2-CD1 3.92Å; V134-I138 HydrophobicContact CG1-CD1 3.85Å; V134-I138 HydrophobicContact CG1-CG1 4.32Å; V134-I138 VanDerWaalsContact O-CG1 3.31Å; V134-I138 WeakPolarHBondContact O-CG1 3.5Å; V134-I138 PolarHBondContact O-N 3.19Å; C135-I138 PolarHBondContact O-N 3.36Å; I138-Q140 PolarHBondContact O-N 3.3Å; I138-I141 PolarHBondContact O-N 3.39Å; I138-I142 HydrophobicContact CG2-CD1 3.62Å; I138-I142 HydrophobicContact CG2-CG1 4.31Å; I138-I142 WeakPolarHBondContact O-CB 3.45Å; I138-I142 VanDerWaalsContact O-CG1 3.23Å; I138-I142 WeakPolarHBondContact O-CG1 3.15Å; I138-I142 PolarHBondContact O-N 3.46Å; I138-F157 WeakPolarHBondContact CD1-O 3.47Å; I138-F157 HydrophobicContact CG2-CB 4.13Å; I138-L158 HydrophobicContact CB-CD2 4.06Å; I138-L158 HydrophobicContact CG2-CD2 3.77Å
139	V	88.7	Confident	87.5	Confident	15 Å²	15	50.3 Å²	50.3	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-44.2	175.9	169	0	0	0	0	111.9	C135 K136 F137 I141 I142 S143 L158 F168 L172 W174	C135-V139 WeakPolarHBondContact O-CB 3.36Å; C135-V139 WeakPolarHBondContact O-CG2 3.45Å; C135-V139 PolarHBondContact O-N 3.49Å; K136-V139 PolarHBondContact O-N 3.28Å; F137-V139 VanDerWaalsContact C-N 3.3Å; F137-V139 PolarHBondContact O-N 3.08Å; V139-I141 VanDerWaalsContact C-N 3.35Å; V139-I142 PolarHBondContact O-N 3.35Å; V139-S143 WeakPolarHBondContact O-CB 3.43Å; V139-S143 PolarHBondContact O-N 2.86Å; V139-S143 PolarHBondContact O-OG 3.04Å; V139-L158 HydrophobicContact CG2-CD2 4.26Å; V139-F168 HydrophobicContact CG2-CE1 3.44Å; V139-F168 VanDerWaalsContact CG2-CE1 3.44Å; V139-F168 HydrophobicContact CG2-CZ 3.86Å; V139-L172 HydrophobicContact CB-CD1 4.48Å; V139-L172 HydrophobicContact CG1-CD1 3.72Å; V139-L172 HydrophobicContact CG1-CD2 3.78Å; V139-L172 HydrophobicContact CG1-CG 4.42Å; V139-L172 HydrophobicContact CG2-CD1 3.82Å; V139-W174 HydrophobicContact CG1-CH2 4.14Å; V139-W174 HydrophobicContact CG1-CZ2 3.87Å; V139-W174 HydrophobicContact CG2-CH2 4.48Å
140	Q	87.8	Confident	87.5	Confident	86 Å²	86	50.6 Å²	50.6	40%	0.402	24%	0.24	S	C	.	.	H	α-helix	trans	-62.5	-42	177.4	-178.2	-176.9	-41.6	0	0	111.6	K136 F137 I138 S143 Q144	K136-Q140 WeakPolarHBondContact O-CB 3.47Å; K136-Q140 PolarHBondContact O-N 2.86Å; F137-Q140 WeakPolarHBondContact O-CB 3.2Å; F137-Q140 PolarHBondContact O-N 3.19Å; F137-Q140 VanDerWaalsContact O-N 3.15Å; I138-Q140 PolarHBondContact O-N 3.3Å; Q140-S143 PolarHBondContact O-OG 3.47Å; Q140-Q144 VanDerWaalsContact O-CG 3.23Å; Q140-Q144 WeakPolarHBondContact O-CG 3.5Å; Q140-Q144 PolarHBondContact O-N 3.18Å
141	I	87.8	Confident	87.3	Confident	30 Å²	30	50.4 Å²	50.4	15%	0.154	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-45.1	175.1	-64.2	-59.4	0	0	0	110.3	F110 F137 I138 V139 S143 Q144 T145	F110-I141 HydrophobicContact CZ-CG2 4.4Å; F137-I141 HydrophobicContact CD1-CG1 4.49Å; F137-I141 HydrophobicContact CD2-CG1 4.44Å; F137-I141 HydrophobicContact CE1-CG1 3.97Å; F137-I141 HydrophobicContact CE2-CD1 3.95Å; F137-I141 HydrophobicContact CE2-CG1 3.89Å; F137-I141 HydrophobicContact CZ-CD1 3.87Å; F137-I141 HydrophobicContact CZ-CG1 3.6Å; F137-I141 WeakPolarHBondContact O-CG1 3.42Å; F137-I141 PolarHBondContact O-N 3.25Å; I138-I141 PolarHBondContact O-N 3.39Å; V139-I141 VanDerWaalsContact C-N 3.35Å; I141-S143 PolarHBondContact O-N 2.91Å; I141-Q144 PolarHBondContact O-N 2.97Å; I141-T145 HydrophobicContact CG2-CG2 4.36Å; I141-T145 WeakPolarHBondContact O-CB 3.34Å; I141-T145 WeakPolarHBondContact O-CG2 3.42Å; I141-T145 PolarHBondContact O-N 3.34Å; I141-T145 PolarHBondContact O-OG1 3.3Å
142	I	88.5	Confident	87.2	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-42.6	179.7	-69.2	169.1	0	0	0	111	I138 V139 Q144 T145 Y146 I149 L154 F157 W174 V190	I138-I142 HydrophobicContact CG2-CD1 3.62Å; I138-I142 HydrophobicContact CG2-CG1 4.31Å; I138-I142 WeakPolarHBondContact O-CB 3.45Å; I138-I142 VanDerWaalsContact O-CG1 3.23Å; I138-I142 WeakPolarHBondContact O-CG1 3.15Å; I138-I142 PolarHBondContact O-N 3.46Å; V139-I142 PolarHBondContact O-N 3.35Å; I142-Q144 VanDerWaalsContact C-N 3.25Å; I142-Q144 PolarHBondContact O-N 3.38Å; I142-T145 PolarHBondContact O-N 3.24Å; I142-Y146 HydrophobicContact CB-CD2 4.38Å; I142-Y146 HydrophobicContact CG1-CD2 4.41Å; I142-Y146 HydrophobicContact CG2-CD2 4.09Å; I142-Y146 HydrophobicContact CG2-CG 4.47Å; I142-Y146 PolarHBondContact O-N 2.91Å; I142-I149 HydrophobicContact CD1-CD1 4.23Å; I142-I149 HydrophobicContact CG1-CD1 4.45Å; I142-I149 HydrophobicContact CG2-CD1 4.05Å; I142-L154 HydrophobicContact CD1-CD1 3.61Å; I142-F157 HydrophobicContact CD1-CB 4.31Å; I142-F157 HydrophobicContact CD1-CD2 3.81Å; I142-F157 HydrophobicContact CG1-CD2 4.28Å; I142-W174 HydrophobicContact CB-CH2 4.37Å; I142-W174 HydrophobicContact CG2-CH2 3.83Å; I142-W174 HydrophobicContact CG2-CZ2 4.5Å; I142-W174 HydrophobicContact CG2-CZ3 4.44Å; I142-V190 HydrophobicContact CG2-CG1 4.03Å; I142-V190 HydrophobicContact CG2-CG2 4.05Å
143	S	85.7	Confident	87.1	Confident	33 Å²	33	47.8 Å²	47.8	23%	0.231	24%	0.24	C	C	.	.	H	α-helix	trans	-67.1	-24.9	179.5	69.5	0	0	0	0	114.5	V139 Q140 I141 V190 N191	V139-S143 WeakPolarHBondContact O-CB 3.43Å; V139-S143 PolarHBondContact O-N 2.86Å; V139-S143 PolarHBondContact O-OG 3.04Å; Q140-S143 PolarHBondContact O-OG 3.47Å; I141-S143 PolarHBondContact O-N 2.91Å; S143-V190 VanDerWaalsContact CA-CG1 3.48Å; S143-N191 PolarHBondContact O-ND2 2.92Å
144	Q	84.2	Confident	87.1	Confident	117 Å²	117	46.9 Å²	46.9	55%	0.547	23%	0.234	S	C	.	.	H	α-helix	trans	-86.2	-27.8	175.2	-69.4	175.1	-0.6	0	0	112.9	Q140 I141 I142	Q140-Q144 VanDerWaalsContact O-CG 3.23Å; Q140-Q144 WeakPolarHBondContact O-CG 3.5Å; Q140-Q144 PolarHBondContact O-N 3.18Å; I141-Q144 PolarHBondContact O-N 2.97Å; I142-Q144 VanDerWaalsContact C-N 3.25Å; I142-Q144 PolarHBondContact O-N 3.38Å
145	T	86.3	Confident	87	Confident	83 Å²	83	49.3 Å²	49.3	51%	0.509	25%	0.246	S	C	.	.	H	α-helix	trans	-106.9	-29.4	-169.8	54.1	0	0	0	0	114.1	I141 I142	I141-T145 HydrophobicContact CG2-CG2 4.36Å; I141-T145 WeakPolarHBondContact O-CB 3.34Å; I141-T145 WeakPolarHBondContact O-CG2 3.42Å; I141-T145 PolarHBondContact O-N 3.34Å; I141-T145 PolarHBondContact O-OG1 3.3Å; I142-T145 PolarHBondContact O-N 3.24Å
146	Y	84.1	Confident	86.9	Confident	79 Å²	79	51.2 Å²	51.2	31%	0.31	26%	0.259	S	S	.	.			trans	-110.1	134.8	-176.2	-68.5	-95.4	0	0	0	111.9	I142 I149 L153 F157	I142-Y146 HydrophobicContact CB-CD2 4.38Å; I142-Y146 HydrophobicContact CG1-CD2 4.41Å; I142-Y146 HydrophobicContact CG2-CD2 4.09Å; I142-Y146 HydrophobicContact CG2-CG 4.47Å; I142-Y146 PolarHBondContact O-N 2.91Å; Y146-I149 HydrophobicContact CD1-CB 4.23Å; Y146-I149 HydrophobicContact CD1-CD1 4.4Å; Y146-I149 HydrophobicContact CD1-CG1 4.22Å; Y146-I149 HydrophobicContact CD2-CD1 4.46Å; Y146-I149 HydrophobicContact CE1-CD1 4.49Å; Y146-I149 HydrophobicContact CE1-CG1 4.45Å; Y146-I149 HydrophobicContact CG-CB 4.39Å; Y146-I149 HydrophobicContact CG-CD1 4.4Å; Y146-L153 HydrophobicContact CE1-CD2 4.37Å; Y146-F157 HydrophobicContact CE2-CE2 4.36Å
147	Q	82.5	Confident	87	Confident	84 Å²	84	45.9 Å²	45.9	39%	0.393	24%	0.236	S	C	.	.	S	Bend	trans	-81.9	-48.8	164.4	-156.1	-179.6	-5.2	0	0	110	V190 N191 N192 H193	Q147-V190 PolarHBondContact O-N 3.39Å; Q147-N191 WeakPolarHBondContact CA-O 3.39Å; Q147-N191 WeakPolarHBondContact CG-O 3.32Å; Q147-N191 PolarHBondContact O-N 3.31Å; Q147-N192 PolarHBondContact NE2-OD1 2.88Å; Q147-H193 PolarHBondContact N-NE2 2.86Å
148	R	82.6	Confident	86.9	Confident	106 Å²	106	45.2 Å²	45.2	40%	0.4	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.3	176.1	-62.5	-179.5	-177.6	-173.2	-0.2	108.8	D180 I188 L189	R148-D180 IonicContact NH1-OD2 3.2Å; R148-D180 PolarHBondContact NH1-OD2 3.2Å; R148-I188 CarbonylContact C-O 3.52Å; R148-I188 VanDerWaalsContact CA-O 3.22Å; R148-I188 WeakPolarHBondContact CA-O 3.25Å; R148-L189 HydrophobicContact CG-CD1 3.84Å
149	I	85.6	Confident	86.8	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	140.2	176.3	-167.6	167.6	0	0	0	110.1	I142 Y146 L153 L154 F157 I188 V190	I142-I149 HydrophobicContact CD1-CD1 4.23Å; I142-I149 HydrophobicContact CG1-CD1 4.45Å; I142-I149 HydrophobicContact CG2-CD1 4.05Å; Y146-I149 HydrophobicContact CD1-CB 4.23Å; Y146-I149 HydrophobicContact CD1-CD1 4.4Å; Y146-I149 HydrophobicContact CD1-CG1 4.22Å; Y146-I149 HydrophobicContact CD2-CD1 4.46Å; Y146-I149 HydrophobicContact CE1-CD1 4.49Å; Y146-I149 HydrophobicContact CE1-CG1 4.45Å; Y146-I149 HydrophobicContact CG-CB 4.39Å; Y146-I149 HydrophobicContact CG-CD1 4.4Å; I149-L153 HydrophobicContact CD1-CD2 4.31Å; I149-L153 HydrophobicContact CD1-CG 4.41Å; I149-L153 HydrophobicContact CG1-CB 4.38Å; I149-L153 HydrophobicContact CG1-CD2 4.1Å; I149-L153 HydrophobicContact CG1-CG 4.43Å; I149-L154 HydrophobicContact CD1-CB 4.1Å; I149-L154 HydrophobicContact CD1-CD1 4.22Å; I149-L154 HydrophobicContact CG1-CB 4.35Å; I149-L154 HydrophobicContact CG2-CB 4.21Å; I149-L154 HydrophobicContact CG2-CD2 4.12Å; I149-F157 HydrophobicContact CD1-CD2 3.98Å; I149-F157 HydrophobicContact CD1-CE2 4.05Å; I149-I188 HydrophobicContact CG2-CB 4.06Å; I149-I188 PolarHBondContact N-O 3.03Å; I149-I188 PolarHBondContact O-N 3.19Å; I149-V190 HydrophobicContact CB-CG2 4.23Å; I149-V190 HydrophobicContact CG2-CG2 3.54Å
150	S	86.7	Confident	86.7	Confident	31 Å²	31	47.9 Å²	47.9	22%	0.217	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.6	174.3	67.4	0	0	0	0	110.3	L153 L154	S150-L153 WeakPolarHBondContact O-CB 3.22Å; S150-L153 PolarHBondContact O-N 2.95Å; S150-L153 VanDerWaalsContact O-N 3.11Å; S150-L153 WeakPolarHBondContact OG-CB 3.36Å; S150-L154 PolarHBondContact O-N 3.39Å
151	K	84.8	Confident	86.6	Confident	10 Å²	10	46.4 Å²	46.4	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-51.2	-46.9	176.9	-172.7	177.1	176.5	177.1	0	114.5	L153 L154 M155 E162 L165 Q186 I188	K151-L153 VanDerWaalsContact C-N 3.29Å; K151-L153 PolarHBondContact O-N 3.05Å; K151-L154 PolarHBondContact O-N 3.33Å; K151-M155 HydrophobicContact CG-SD 4.28Å; K151-M155 VanDerWaalsContact O-CG 3.3Å; K151-M155 WeakPolarHBondContact O-CG 3.22Å; K151-M155 PolarHBondContact O-N 3.1Å; K151-E162 VanDerWaalsContact CE-CG 3.46Å; K151-E162 IonicContact NZ-OE1 2.67Å; K151-E162 PolarHBondContact NZ-OE1 3.35Å; K151-L165 HydrophobicContact CG-CD2 3.92Å; K151-Q186 HydrophobicContact CB-CB 4.16Å; K151-Q186 WeakPolarHBondContact CB-O 3.37Å; K151-Q186 HydrophobicContact CD-CB 4.16Å; K151-Q186 PolarHBondContact N-O 3.24Å; K151-I188 HydrophobicContact CB-CD1 4.3Å; K151-I188 HydrophobicContact CG-CD1 4.48Å
152	P	86.7	Confident	86.3	Confident	92 Å²	92	48.7 Å²	48.7	60%	0.597	26%	0.256	S	S	*	.	H	α-helix	trans	-63.3	-34.7	178.3	24.1	-35	0	0	0	112.8	S156	P152-S156 PolarHBondContact O-N 2.97Å
153	L	88.1	Confident	86.1	Confident	57 Å²	57	54 Å²	54	30%	0.298	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-45.4	177	-174.6	65.3	0	0	0	110.8	Y146 I149 S150 K151 M155 S156 F157	Y146-L153 HydrophobicContact CE1-CD2 4.37Å; I149-L153 HydrophobicContact CD1-CD2 4.31Å; I149-L153 HydrophobicContact CD1-CG 4.41Å; I149-L153 HydrophobicContact CG1-CB 4.38Å; I149-L153 HydrophobicContact CG1-CD2 4.1Å; I149-L153 HydrophobicContact CG1-CG 4.43Å; S150-L153 WeakPolarHBondContact O-CB 3.22Å; S150-L153 PolarHBondContact O-N 2.95Å; S150-L153 VanDerWaalsContact O-N 3.11Å; S150-L153 WeakPolarHBondContact OG-CB 3.36Å; K151-L153 VanDerWaalsContact C-N 3.29Å; K151-L153 PolarHBondContact O-N 3.05Å; L153-M155 VanDerWaalsContact C-N 3.32Å; L153-M155 PolarHBondContact O-N 3.29Å; L153-S156 WeakPolarHBondContact O-CB 3.34Å; L153-S156 PolarHBondContact O-N 3.41Å; L153-S156 VanDerWaalsContact O-N 3.08Å; L153-S156 PolarHBondContact O-OG 3.28Å; L153-F157 HydrophobicContact CD1-CD1 4.32Å; L153-F157 HydrophobicContact CD1-CE1 3.63Å; L153-F157 HydrophobicContact CD1-CE2 4.15Å; L153-F157 HydrophobicContact CD1-CZ 3.54Å; L153-F157 HydrophobicContact CD2-CE2 4.02Å; L153-F157 HydrophobicContact CD2-CZ 4.01Å; L153-F157 HydrophobicContact CG-CD2 4.28Å; L153-F157 HydrophobicContact CG-CE1 4.13Å; L153-F157 HydrophobicContact CG-CE2 3.76Å; L153-F157 HydrophobicContact CG-CZ 3.68Å; L153-F157 WeakPolarHBondContact O-CG 3.44Å; L153-F157 PolarHBondContact O-N 3.23Å
154	L	87.6	Confident	86	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62	-40.1	177.3	-177.1	60.8	0	0	0	112.2	I142 I149 S150 K151 S156 F157 L158 L165 W174 I188	I142-L154 HydrophobicContact CD1-CD1 3.61Å; I149-L154 HydrophobicContact CD1-CB 4.1Å; I149-L154 HydrophobicContact CD1-CD1 4.22Å; I149-L154 HydrophobicContact CG1-CB 4.35Å; I149-L154 HydrophobicContact CG2-CB 4.21Å; I149-L154 HydrophobicContact CG2-CD2 4.12Å; S150-L154 PolarHBondContact O-N 3.39Å; K151-L154 PolarHBondContact O-N 3.33Å; L154-S156 VanDerWaalsContact C-N 3.29Å; L154-S156 PolarHBondContact O-N 3.48Å; L154-F157 PolarHBondContact O-N 3.04Å; L154-L158 HydrophobicContact CD1-CD1 3.7Å; L154-L158 HydrophobicContact CD1-CG 4.11Å; L154-L158 HydrophobicContact CG-CD1 4.1Å; L154-L158 PolarHBondContact O-N 3.45Å; L154-L165 HydrophobicContact CD2-CD1 3.63Å; L154-L165 HydrophobicContact CD2-CD2 4.28Å; L154-L165 HydrophobicContact CD2-CG 4.5Å; L154-L165 HydrophobicContact CG-CD1 3.89Å; L154-L165 HydrophobicContact CG-CD2 4.46Å; L154-W174 HydrophobicContact CD1-CZ3 3.99Å; L154-W174 HydrophobicContact CD2-CE3 4.19Å; L154-W174 HydrophobicContact CD2-CZ3 3.8Å; L154-I188 HydrophobicContact CD2-CD1 3.45Å; L154-I188 VanDerWaalsContact CD2-CD1 3.45Å
155	M	88.6	Confident	86	Confident	54 Å²	54	50.7 Å²	50.7	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-40.7	172.9	-71.4	177.9	65.6	0	0	111.7	K151 L153 F157 D159 E162 L165	K151-M155 HydrophobicContact CG-SD 4.28Å; K151-M155 VanDerWaalsContact O-CG 3.3Å; K151-M155 WeakPolarHBondContact O-CG 3.22Å; K151-M155 PolarHBondContact O-N 3.1Å; L153-M155 VanDerWaalsContact C-N 3.32Å; L153-M155 PolarHBondContact O-N 3.29Å; M155-F157 VanDerWaalsContact C-N 3.35Å; M155-D159 WeakPolarHBondContact O-CA 3.49Å; M155-D159 PolarHBondContact O-N 2.94Å; M155-E162 HydrophobicContact CE-CB 4.09Å; M155-E162 HydrophobicContact SD-CB 4.39Å; M155-L165 HydrophobicContact CG-CD2 3.48Å; M155-L165 VanDerWaalsContact CG-CD2 3.48Å; M155-L165 HydrophobicContact SD-CD2 4.41Å
156	S	89.4	Confident	85.8	Confident	45 Å²	45	50.6 Å²	50.6	32%	0.315	26%	0.26	S	S	.	.	H	α-helix	trans	-67.4	-35.2	177.5	81	0	0	0	0	112.6	P152 L153 L154	P152-S156 PolarHBondContact O-N 2.97Å; L153-S156 WeakPolarHBondContact O-CB 3.34Å; L153-S156 PolarHBondContact O-N 3.41Å; L153-S156 VanDerWaalsContact O-N 3.08Å; L153-S156 PolarHBondContact O-OG 3.28Å; L154-S156 VanDerWaalsContact C-N 3.29Å; L154-S156 PolarHBondContact O-N 3.48Å
157	F	90.6	Very high	85.7	Confident	25 Å²	25	52.9 Å²	52.9	11%	0.11	27%	0.273	C	S	.	.	H	α-helix	trans	-74.8	-36.6	179.6	-70.4	-11.4	0	0	0	113	F110 W114 I138 I142 Y146 I149 L153 L154 M155	F110-F157 HydrophobicContact CB-CB 4.29Å; F110-F157 HydrophobicContact CB-CD1 4.21Å; F110-F157 HydrophobicContact CD2-CB 4.02Å; F110-F157 AromaticContact CD2-CD1 3.93Å; F110-F157 HydrophobicContact CD2-CD1 3.93Å; F110-F157 HydrophobicContact CD2-CD2 4.21Å; F110-F157 HydrophobicContact CD2-CE1 4.4Å; F110-F157 AromaticContact CD2-CG 3.81Å; F110-F157 HydrophobicContact CD2-CG 3.81Å; W114-F157 PolarHBondContact NE1-O 3.49Å; I138-F157 WeakPolarHBondContact CD1-O 3.47Å; I138-F157 HydrophobicContact CG2-CB 4.13Å; I142-F157 HydrophobicContact CD1-CB 4.31Å; I142-F157 HydrophobicContact CD1-CD2 3.81Å; I142-F157 HydrophobicContact CG1-CD2 4.28Å; Y146-F157 HydrophobicContact CE2-CE2 4.36Å; I149-F157 HydrophobicContact CD1-CD2 3.98Å; I149-F157 HydrophobicContact CD1-CE2 4.05Å; L153-F157 HydrophobicContact CD1-CD1 4.32Å; L153-F157 HydrophobicContact CD1-CE1 3.63Å; L153-F157 HydrophobicContact CD1-CE2 4.15Å; L153-F157 HydrophobicContact CD1-CZ 3.54Å; L153-F157 HydrophobicContact CD2-CE2 4.02Å; L153-F157 HydrophobicContact CD2-CZ 4.01Å; L153-F157 HydrophobicContact CG-CD2 4.28Å; L153-F157 HydrophobicContact CG-CE1 4.13Å; L153-F157 HydrophobicContact CG-CE2 3.76Å; L153-F157 HydrophobicContact CG-CZ 3.68Å; L153-F157 WeakPolarHBondContact O-CG 3.44Å; L153-F157 PolarHBondContact O-N 3.23Å; L154-F157 PolarHBondContact O-N 3.04Å; M155-F157 VanDerWaalsContact C-N 3.35Å
158	L	88.3	Confident	85.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-95.5	-8.5	-178.2	-67.3	176.3	0	0	0	114.1	C135 I138 V139 L154 M160 L165 F168	C135-L158 HydrophobicContact CB-CD2 4.27Å; I138-L158 HydrophobicContact CB-CD2 4.06Å; I138-L158 HydrophobicContact CG2-CD2 3.77Å; V139-L158 HydrophobicContact CG2-CD2 4.26Å; L154-L158 HydrophobicContact CD1-CD1 3.7Å; L154-L158 HydrophobicContact CD1-CG 4.11Å; L154-L158 HydrophobicContact CG-CD1 4.1Å; L154-L158 PolarHBondContact O-N 3.45Å; L158-M160 HydrophobicContact CB-CE 3.83Å; L158-M160 HydrophobicContact CB-CG 3.8Å; L158-M160 HydrophobicContact CB-SD 3.87Å; L158-M160 HydrophobicContact CD1-CE 4.01Å; L158-M160 HydrophobicContact CD1-SD 3.79Å; L158-M160 HydrophobicContact CG-CE 4.45Å; L158-M160 PolarHBondContact O-N 3.22Å; L158-L165 HydrophobicContact CD1-CD1 4.27Å; L158-F168 HydrophobicContact CD1-CD1 3.94Å; L158-F168 HydrophobicContact CD1-CE1 3.87Å
159	D	88.3	Confident	85.6	Confident	52 Å²	52	46.2 Å²	46.2	28%	0.278	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	58	-176.4	-171.4	48.9	0	0	0	111.9	W114 K118 R131 M155	W114-D159 HydrophobicContact CB-CB 3.77Å; W114-D159 VanDerWaalsContact CD1-CB 3.46Å; W114-D159 HydrophobicContact CD2-CB 3.77Å; W114-D159 HydrophobicContact CG-CB 3.38Å; K118-D159 WeakPolarHBondContact CE-OD2 2.82Å; K118-D159 IonicContact NZ-OD1 3.73Å; K118-D159 PolarHBondContact NZ-OD1 3.09Å; K118-D159 IonicContact NZ-OD2 3.91Å; K118-D159 PolarHBondContact NZ-OD2 3.01Å; R131-D159 PolarHBondContact NH2-O 3.39Å; M155-D159 WeakPolarHBondContact O-CA 3.49Å; M155-D159 PolarHBondContact O-N 2.94Å
160	M	86	Confident	85.4	Confident	19 Å²	19	54.5 Å²	54.5	9%	0.094	28%	0.282	C	S	.	.			trans	-133.2	154.3	-178.3	60	177.8	42.6	0	0	111.7	L158 D164 L165 F168	L158-M160 HydrophobicContact CB-CE 3.83Å; L158-M160 HydrophobicContact CB-CG 3.8Å; L158-M160 HydrophobicContact CB-SD 3.87Å; L158-M160 HydrophobicContact CD1-CE 4.01Å; L158-M160 HydrophobicContact CD1-SD 3.79Å; L158-M160 HydrophobicContact CG-CE 4.45Å; L158-M160 PolarHBondContact O-N 3.22Å; M160-D164 HydrophobicContact CB-CB 4.17Å; M160-L165 HydrophobicContact CG-CB 4.2Å; M160-L165 HydrophobicContact SD-CB 3.87Å; M160-L165 HydrophobicContact SD-CD1 3.66Å; M160-L165 HydrophobicContact SD-CG 4.39Å; M160-F168 HydrophobicContact CE-CB 4.44Å; M160-F168 HydrophobicContact CE-CD1 4.2Å; M160-F168 HydrophobicContact CE-CD2 4.46Å; M160-F168 HydrophobicContact CE-CG 4.14Å; M160-F168 HydrophobicContact SD-CB 4.3Å; M160-F168 HydrophobicContact SD-CD1 4.43Å; M160-F168 HydrophobicContact SD-CG 4.48Å
161	S	85.2	Confident	85.3	Confident	54 Å²	54	59.9 Å²	59.9	38%	0.378	30%	0.304	S	S	.	.			trans	-69.5	161.3	176.1	77.2	0	0	0	0	110.9	N163 D164 L165	S161-N163 PolarHBondContact O-N 2.85Å; S161-D164 PolarHBondContact O-N 3.15Å; S161-D164 PolarHBondContact OG-N 2.89Å; S161-D164 PolarHBondContact OG-OD2 3.48Å; S161-L165 WeakPolarHBondContact O-CB 3.46Å; S161-L165 PolarHBondContact O-N 3.37Å
162	E	81.5	Confident	85	Confident	79 Å²	79	62 Å²	62	37%	0.369	32%	0.315	S	S	.	.	H	α-helix	trans	-59.1	-33.9	177.9	-169.5	-174.4	156.9	0	0	112.3	K151 M155 L165 K166	K151-E162 VanDerWaalsContact CE-CG 3.46Å; K151-E162 IonicContact NZ-OE1 2.67Å; K151-E162 PolarHBondContact NZ-OE1 3.35Å; M155-E162 HydrophobicContact CE-CB 4.09Å; M155-E162 HydrophobicContact SD-CB 4.39Å; E162-L165 PolarHBondContact O-N 3.39Å; E162-K166 WeakPolarHBondContact O-CG 3.45Å; E162-K166 PolarHBondContact O-N 2.92Å; E162-K166 VanDerWaalsContact O-N 3.14Å; E162-K166 VanDerWaalsContact OE1-CE 3.3Å; E162-K166 WeakPolarHBondContact OE1-CE 3.4Å; E162-K166 IonicContact OE1-NZ 2.86Å; E162-K166 PolarHBondContact OE1-NZ 3.17Å
163	N	84.8	Confident	84.6	Confident	112 Å²	112	66.3 Å²	66.3	60%	0.599	33%	0.328	S	S	*	.	H	α-helix	trans	-70	-42.2	-179.5	-69	-26.9	0	0	0	111.8	S161 L165 K166 Q167	S161-N163 PolarHBondContact O-N 2.85Å; N163-L165 VanDerWaalsContact C-N 3.31Å; N163-K166 PolarHBondContact O-N 3.43Å; N163-Q167 PolarHBondContact O-N 2.96Å
164	D	84.4	Confident	84.4	Confident	80 Å²	80	65 Å²	65	43%	0.428	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-39.3	176.5	-57.2	-40.6	0	0	0	110.4	M160 S161 K166 Q167 F168	M160-D164 HydrophobicContact CB-CB 4.17Å; S161-D164 PolarHBondContact O-N 3.15Å; S161-D164 PolarHBondContact OG-N 2.89Å; S161-D164 PolarHBondContact OG-OD2 3.48Å; D164-K166 VanDerWaalsContact C-N 3.34Å; D164-K166 PolarHBondContact O-N 3.18Å; D164-Q167 PolarHBondContact O-N 3.17Å; D164-Q167 VanDerWaalsContact O-N 3.16Å; D164-F168 WeakPolarHBondContact O-CB 3.44Å; D164-F168 PolarHBondContact O-N 3.1Å
165	L	83.2	Confident	83.7	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-42.9	178.2	-178	61.6	0	0	0	111.8	K151 L154 M155 L158 M160 S161 E162 N163 Q167 F168 I169	K151-L165 HydrophobicContact CG-CD2 3.92Å; L154-L165 HydrophobicContact CD2-CD1 3.63Å; L154-L165 HydrophobicContact CD2-CD2 4.28Å; L154-L165 HydrophobicContact CD2-CG 4.5Å; L154-L165 HydrophobicContact CG-CD1 3.89Å; L154-L165 HydrophobicContact CG-CD2 4.46Å; M155-L165 HydrophobicContact CG-CD2 3.48Å; M155-L165 VanDerWaalsContact CG-CD2 3.48Å; M155-L165 HydrophobicContact SD-CD2 4.41Å; L158-L165 HydrophobicContact CD1-CD1 4.27Å; M160-L165 HydrophobicContact CG-CB 4.2Å; M160-L165 HydrophobicContact SD-CB 3.87Å; M160-L165 HydrophobicContact SD-CD1 3.66Å; M160-L165 HydrophobicContact SD-CG 4.39Å; S161-L165 WeakPolarHBondContact O-CB 3.46Å; S161-L165 PolarHBondContact O-N 3.37Å; E162-L165 PolarHBondContact O-N 3.39Å; N163-L165 VanDerWaalsContact C-N 3.31Å; L165-Q167 VanDerWaalsContact C-N 3.28Å; L165-Q167 PolarHBondContact O-N 2.98Å; L165-F168 PolarHBondContact O-N 3.24Å; L165-F168 VanDerWaalsContact O-N 3.14Å; L165-I169 HydrophobicContact CD1-CD1 4.1Å; L165-I169 HydrophobicContact CD1-CG1 4.04Å; L165-I169 HydrophobicContact CD2-CD1 4.32Å; L165-I169 HydrophobicContact CG-CD1 3.75Å; L165-I169 HydrophobicContact CG-CG1 4.18Å; L165-I169 WeakPolarHBondContact O-CB 3.27Å; L165-I169 VanDerWaalsContact O-CG1 3.23Å; L165-I169 WeakPolarHBondContact O-CG1 3.32Å; L165-I169 PolarHBondContact O-N 3.46Å
166	K	81.8	Confident	82.9	Confident	80 Å²	80	69.6 Å²	69.6	35%	0.348	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-36.3	176.4	-74.6	173.5	-175.4	163.3	0	112.7	E162 N163 D164 K170	E162-K166 WeakPolarHBondContact O-CG 3.45Å; E162-K166 PolarHBondContact O-N 2.92Å; E162-K166 VanDerWaalsContact O-N 3.14Å; E162-K166 VanDerWaalsContact OE1-CE 3.3Å; E162-K166 WeakPolarHBondContact OE1-CE 3.4Å; E162-K166 IonicContact OE1-NZ 2.86Å; E162-K166 PolarHBondContact OE1-NZ 3.17Å; N163-K166 PolarHBondContact O-N 3.43Å; D164-K166 VanDerWaalsContact C-N 3.34Å; D164-K166 PolarHBondContact O-N 3.18Å; K166-K170 WeakPolarHBondContact O-CG 3.45Å; K166-K170 PolarHBondContact O-N 3.36Å
167	Q	82.8	Confident	81.6	Confident	127 Å²	127	69 Å²	69	59%	0.593	34%	0.341	S	S	*	.	H	α-helix	trans	-71.4	-39.6	175.2	-65	-176.5	6.4	0	0	111.3	N163 D164 L165 K170 Q171	N163-Q167 PolarHBondContact O-N 2.96Å; D164-Q167 PolarHBondContact O-N 3.17Å; D164-Q167 VanDerWaalsContact O-N 3.16Å; L165-Q167 VanDerWaalsContact C-N 3.28Å; L165-Q167 PolarHBondContact O-N 2.98Å; Q167-K170 WeakPolarHBondContact O-CB 3.46Å; Q167-K170 PolarHBondContact O-N 3.39Å; Q167-Q171 WeakPolarHBondContact O-CG 3.43Å; Q167-Q171 PolarHBondContact O-N 3.45Å; Q167-Q171 VanDerWaalsContact O-N 3.11Å
168	F	82	Confident	80.1	Confident	43 Å²	43	73.1 Å²	73.1	19%	0.189	37%	0.368	C	S	.	.	H	α-helix	trans	-69.5	-39.8	-178.9	-159	-110.3	0	0	0	112.6	C135 V139 L158 M160 D164 L165 K170 Q171 L172	C135-F168 HydrophobicContact CB-CZ 4.47Å; V139-F168 HydrophobicContact CG2-CE1 3.44Å; V139-F168 VanDerWaalsContact CG2-CE1 3.44Å; V139-F168 HydrophobicContact CG2-CZ 3.86Å; L158-F168 HydrophobicContact CD1-CD1 3.94Å; L158-F168 HydrophobicContact CD1-CE1 3.87Å; M160-F168 HydrophobicContact CE-CB 4.44Å; M160-F168 HydrophobicContact CE-CD1 4.2Å; M160-F168 HydrophobicContact CE-CD2 4.46Å; M160-F168 HydrophobicContact CE-CG 4.14Å; M160-F168 HydrophobicContact SD-CB 4.3Å; M160-F168 HydrophobicContact SD-CD1 4.43Å; M160-F168 HydrophobicContact SD-CG 4.48Å; D164-F168 WeakPolarHBondContact O-CB 3.44Å; D164-F168 PolarHBondContact O-N 3.1Å; L165-F168 PolarHBondContact O-N 3.24Å; L165-F168 VanDerWaalsContact O-N 3.14Å; F168-K170 VanDerWaalsContact C-N 3.31Å; F168-K170 PolarHBondContact O-N 3.34Å; F168-Q171 WeakPolarHBondContact O-CB 3.49Å; F168-Q171 PolarHBondContact O-N 3.09Å; F168-Q171 VanDerWaalsContact O-N 3.12Å; F168-L172 HydrophobicContact CD1-CD1 3.59Å; F168-L172 HydrophobicContact CD1-CG 4.39Å; F168-L172 HydrophobicContact CE1-CD1 3.44Å; F168-L172 VanDerWaalsContact CE1-CD1 3.44Å; F168-L172 HydrophobicContact CE1-CG 4.32Å; F168-L172 HydrophobicContact CG-CD1 4.47Å; F168-L172 HydrophobicContact CZ-CD1 4.18Å; F168-L172 WeakPolarHBondContact O-CG 3.41Å; F168-L172 PolarHBondContact O-N 3.22Å
169	I	81.6	Confident	78.3	Confident	8 Å²	8	79.2 Å²	79.2	4%	0.041	40%	0.4	C	S	.	.	H	α-helix	trans	-57.9	-44.1	172.2	-72.5	168.8	0	0	0	110.6	L165 Q171 L172 E173 W174 E176 I188	L165-I169 HydrophobicContact CD1-CD1 4.1Å; L165-I169 HydrophobicContact CD1-CG1 4.04Å; L165-I169 HydrophobicContact CD2-CD1 4.32Å; L165-I169 HydrophobicContact CG-CD1 3.75Å; L165-I169 HydrophobicContact CG-CG1 4.18Å; L165-I169 WeakPolarHBondContact O-CB 3.27Å; L165-I169 VanDerWaalsContact O-CG1 3.23Å; L165-I169 WeakPolarHBondContact O-CG1 3.32Å; L165-I169 PolarHBondContact O-N 3.46Å; I169-Q171 VanDerWaalsContact C-N 3.31Å; I169-Q171 PolarHBondContact O-N 3.19Å; I169-L172 PolarHBondContact O-N 3.01Å; I169-E173 PolarHBondContact O-N 2.83Å; I169-E173 VanDerWaalsContact O-N 3.13Å; I169-W174 HydrophobicContact CG2-CB 4.02Å; I169-W174 WeakPolarHBondContact CG2-O 3.29Å; I169-W174 PolarHBondContact O-N 3.16Å; I169-E176 HydrophobicContact CD1-CG 4.47Å; I169-I188 HydrophobicContact CD1-CD1 3.51Å; I169-I188 HydrophobicContact CD1-CG1 4.13Å; I169-I188 HydrophobicContact CG1-CD1 4.36Å
170	K	81.6	Confident	76.5	Confident	175 Å²	175	81.4 Å²	81.4	76%	0.761	41%	0.412	S	S	*	.	H	α-helix	trans	-63.7	-35.1	175.9	-73.1	178.5	-179.6	-174.5	0	112.9	K166 Q167 F168 L172	K166-K170 WeakPolarHBondContact O-CG 3.45Å; K166-K170 PolarHBondContact O-N 3.36Å; Q167-K170 WeakPolarHBondContact O-CB 3.46Å; Q167-K170 PolarHBondContact O-N 3.39Å; F168-K170 VanDerWaalsContact C-N 3.31Å; F168-K170 PolarHBondContact O-N 3.34Å; K170-L172 VanDerWaalsContact C-N 3.35Å
171	Q	84.4	Confident	74.9	Confident	144 Å²	144	86 Å²	86	67%	0.673	45%	0.454	S	S	*	.	H	α-helix	trans	-72	-29.8	176.4	-72.3	176	-6.2	0	0	112.7	Q167 F168 I169	Q167-Q171 WeakPolarHBondContact O-CG 3.43Å; Q167-Q171 PolarHBondContact O-N 3.45Å; Q167-Q171 VanDerWaalsContact O-N 3.11Å; F168-Q171 WeakPolarHBondContact O-CB 3.49Å; F168-Q171 PolarHBondContact O-N 3.09Å; F168-Q171 VanDerWaalsContact O-N 3.12Å; I169-Q171 VanDerWaalsContact C-N 3.31Å; I169-Q171 PolarHBondContact O-N 3.19Å
172	L	78.5	Confident	73.2	Confident	54 Å²	54	89.4 Å²	89.4	28%	0.283	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	1.4	-179.3	-68.6	175.3	0	0	0	114	V139 F168 I169 K170 W174	V139-L172 HydrophobicContact CB-CD1 4.48Å; V139-L172 HydrophobicContact CG1-CD1 3.72Å; V139-L172 HydrophobicContact CG1-CD2 3.78Å; V139-L172 HydrophobicContact CG1-CG 4.42Å; V139-L172 HydrophobicContact CG2-CD1 3.82Å; F168-L172 HydrophobicContact CD1-CD1 3.59Å; F168-L172 HydrophobicContact CD1-CG 4.39Å; F168-L172 HydrophobicContact CE1-CD1 3.44Å; F168-L172 VanDerWaalsContact CE1-CD1 3.44Å; F168-L172 HydrophobicContact CE1-CG 4.32Å; F168-L172 HydrophobicContact CG-CD1 4.47Å; F168-L172 HydrophobicContact CZ-CD1 4.18Å; F168-L172 WeakPolarHBondContact O-CG 3.41Å; F168-L172 PolarHBondContact O-N 3.22Å; I169-L172 PolarHBondContact O-N 3.01Å; K170-L172 VanDerWaalsContact C-N 3.35Å; L172-W174 HydrophobicContact CB-CD2 4.12Å; L172-W174 HydrophobicContact CB-CG 4.1Å; L172-W174 HydrophobicContact CD1-CD2 4.24Å; L172-W174 HydrophobicContact CD1-CE3 4.25Å; L172-W174 HydrophobicContact CD1-CH2 4.01Å; L172-W174 HydrophobicContact CD1-CZ2 3.97Å; L172-W174 HydrophobicContact CD1-CZ3 4.14Å; L172-W174 VanDerWaalsContact O-CD1 3.25Å; L172-W174 PolarHBondContact O-N 3.22Å; L172-W174 VanDerWaalsContact O-N 3.17Å
173	E	78.9	Confident	71.7	Confident	183 Å²	183	93 Å²	93	86%	0.855	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	23.1	-176.6	-55.2	-178.1	163.4	0	0	113.9	I169	I169-E173 PolarHBondContact O-N 2.83Å; I169-E173 VanDerWaalsContact O-N 3.13Å
174	W	82	Confident	70.2	Confident	31 Å²	31	96.2 Å²	96.2	12%	0.117	50%	0.501	C	S	.	.			trans	-77.3	142.9	175.7	-67.3	-4.9	0	0	0	110.8	V139 I142 L154 I169 L172 I188 V190	V139-W174 HydrophobicContact CG1-CH2 4.14Å; V139-W174 HydrophobicContact CG1-CZ2 3.87Å; V139-W174 HydrophobicContact CG2-CH2 4.48Å; I142-W174 HydrophobicContact CB-CH2 4.37Å; I142-W174 HydrophobicContact CG2-CH2 3.83Å; I142-W174 HydrophobicContact CG2-CZ2 4.5Å; I142-W174 HydrophobicContact CG2-CZ3 4.44Å; L154-W174 HydrophobicContact CD1-CZ3 3.99Å; L154-W174 HydrophobicContact CD2-CE3 4.19Å; L154-W174 HydrophobicContact CD2-CZ3 3.8Å; I169-W174 HydrophobicContact CG2-CB 4.02Å; I169-W174 WeakPolarHBondContact CG2-O 3.29Å; I169-W174 PolarHBondContact O-N 3.16Å; L172-W174 HydrophobicContact CB-CD2 4.12Å; L172-W174 HydrophobicContact CB-CG 4.1Å; L172-W174 HydrophobicContact CD1-CD2 4.24Å; L172-W174 HydrophobicContact CD1-CE3 4.25Å; L172-W174 HydrophobicContact CD1-CH2 4.01Å; L172-W174 HydrophobicContact CD1-CZ2 3.97Å; L172-W174 HydrophobicContact CD1-CZ3 4.14Å; L172-W174 VanDerWaalsContact O-CD1 3.25Å; L172-W174 PolarHBondContact O-N 3.22Å; L172-W174 VanDerWaalsContact O-N 3.17Å; W174-I188 HydrophobicContact CB-CG2 3.84Å; W174-I188 HydrophobicContact CD2-CG2 4.49Å; W174-I188 HydrophobicContact CE3-CG2 4.02Å; W174-I188 HydrophobicContact CG-CG2 4.47Å; W174-V190 HydrophobicContact CD2-CG1 4.44Å; W174-V190 HydrophobicContact CD2-CG2 4.21Å; W174-V190 HydrophobicContact CE3-CG2 4.13Å; W174-V190 HydrophobicContact CH2-CG1 4.21Å; W174-V190 HydrophobicContact CH2-CG2 4.33Å; W174-V190 HydrophobicContact CZ2-CG1 3.66Å; W174-V190 HydrophobicContact CZ2-CG2 4.42Å; W174-V190 HydrophobicContact CZ3-CG2 4.19Å; W174-V190 PolarHBondContact NE1-O 3.1Å
175	S	73.9	Confident	68.9	Low	57 Å²	57	99.3 Å²	99.3	40%	0.399	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.2	-179.3	55.5	0	0	0	0	111.7	T177 L189	S175-T177 PolarHBondContact O-N 3.11Å; S175-L189 PolarHBondContact N-O 3.31Å; S175-L189 PolarHBondContact O-N 2.93Å
176	E	71.7	Confident	68.1	Low	92 Å²	92	104.2 Å²	104.2	43%	0.43	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	116.3	168.8	-64.8	-175.3	-178.3	0	0	107.6	I169 I188	I169-E176 HydrophobicContact CD1-CG 4.47Å; E176-I188 HydrophobicContact CG-CG1 4.32Å
177	T	62.1	Low	67.7	Low	33 Å²	33	102.3 Å²	102.3	20%	0.202	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.8	175.3	-56	0	0	0	0	107.9	S175 D179 L187	S175-T177 PolarHBondContact O-N 3.11Å; T177-D179 VanDerWaalsContact C-N 3.29Å; T177-D179 HydrophobicContact CG2-CB 3.86Å; T177-L187 PolarHBondContact N-O 2.77Å
178	T	58.9	Low	67.4	Low	112 Å²	112	96.4 Å²	96.4	69%	0.687	50%	0.501	S	S	*	.			trans	-91.7	10.2	173.9	48.6	0	0	0	0	112.8	D180	T178-D180 PolarHBondContact O-N 3.27Å
179	D	51.7	Low	67.1	Low	127 Å²	127	96.6 Å²	96.6	68%	0.679	50%	0.504	S	S	*	.			trans	-101.9	56.2	-163.1	-66.5	-10.8	0	0	0	113.5	T177	T177-D179 VanDerWaalsContact C-N 3.29Å; T177-D179 HydrophobicContact CG2-CB 3.86Å
180	D	50.2	Low	66.8	Low	99 Å²	99	96.9 Å²	96.9	53%	0.529	51%	0.506	S	S	.	.			trans	-128	114.5	152.6	-76.6	-50.8	0	0	0	107.2	R148 T178 D182	R148-D180 IonicContact NH1-OD2 3.2Å; R148-D180 PolarHBondContact NH1-OD2 3.2Å; T178-D180 PolarHBondContact O-N 3.27Å; D180-D182 PolarHBondContact O-N 3.45Å
181	A	51	Low	66.2	Low	116 Å²	116	90.5 Å²	90.5	96%	0.959	48%	0.48	S	S	*	.	S	Bend	trans	-68.3	20.7	-175.7	0	0	0	0	0	114.1
182	D	49.7	Very low	65.3	Low	125 Å²	125	86.5 Å²	86.5	67%	0.668	46%	0.464	S	S	*	.	S	Bend	trans	-141.9	107.3	-179.3	-122.5	-1.5	0	0	0	108.5	D180	D180-D182 PolarHBondContact O-N 3.45Å
183	H	49.9	Very low	64.5	Low	154 Å²	154	86.6 Å²	86.6	71%	0.713	46%	0.463	S	S	*	.	S	Bend	trans	72.4	91.3	168.5	-55.9	-62.2	0	0	0	119.5	Q185	H183-Q185 PolarHBondContact O-N 3.2Å
184	D	53.9	Low	63.5	Low	180 Å²	180	84.8 Å²	84.8	96%	0.963	45%	0.454	S	S	*	.			trans	39.9	9.2	131	-132.4	17.9	0	0	0	121.4
185	Q	56.5	Low	62.3	Low	145 Å²	145	91.2 Å²	91.2	68%	0.678	49%	0.486	S	S	*	.			trans	-109.4	106.3	-175.4	-67.6	-172.1	-1	0	0	109.4	H183 L187	H183-Q185 PolarHBondContact O-N 3.2Å; Q185-L187 PolarHBondContact O-N 3.14Å
186	Q	67.7	Low	61.4	Low	104 Å²	104	92.8 Å²	92.8	49%	0.486	49%	0.49	S	S	.	.			trans	-66	100.6	173.3	-65.3	176.1	-0.1	0	0	109.1	K151	K151-Q186 HydrophobicContact CB-CB 4.16Å; K151-Q186 WeakPolarHBondContact CB-O 3.37Å; K151-Q186 HydrophobicContact CD-CB 4.16Å; K151-Q186 PolarHBondContact N-O 3.24Å
187	L	72.2	Confident	60.8	Low	40 Å²	40	94.3 Å²	94.3	21%	0.209	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.6	177.8	-66.7	173.7	0	0	0	110.3	T177 Q185	T177-L187 PolarHBondContact N-O 2.77Å; Q185-L187 PolarHBondContact O-N 3.14Å
188	I	76.9	Confident	60.7	Low	2 Å²	2	101.6 Å²	101.6	1%	0.01	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.3	175.6	-61.4	160.9	0	0	0	107.4	R148 I149 K151 L154 I169 W174 E176 V190	R148-I188 CarbonylContact C-O 3.52Å; R148-I188 VanDerWaalsContact CA-O 3.22Å; R148-I188 WeakPolarHBondContact CA-O 3.25Å; I149-I188 HydrophobicContact CG2-CB 4.06Å; I149-I188 PolarHBondContact N-O 3.03Å; I149-I188 PolarHBondContact O-N 3.19Å; K151-I188 HydrophobicContact CB-CD1 4.3Å; K151-I188 HydrophobicContact CG-CD1 4.48Å; L154-I188 HydrophobicContact CD2-CD1 3.45Å; L154-I188 VanDerWaalsContact CD2-CD1 3.45Å; I169-I188 HydrophobicContact CD1-CD1 3.51Å; I169-I188 HydrophobicContact CD1-CG1 4.13Å; I169-I188 HydrophobicContact CG1-CD1 4.36Å; W174-I188 HydrophobicContact CB-CG2 3.84Å; W174-I188 HydrophobicContact CD2-CG2 4.49Å; W174-I188 HydrophobicContact CE3-CG2 4.02Å; W174-I188 HydrophobicContact CG-CG2 4.47Å; E176-I188 HydrophobicContact CG-CG1 4.32Å; I188-V190 PolarHBondContact O-N 3.14Å
189	L	75.6	Confident	60.7	Low	48 Å²	48	100.5 Å²	100.5	25%	0.251	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	115.7	171.3	-174.5	75.7	0	0	0	108.2	R148 S175	R148-L189 HydrophobicContact CG-CD1 3.84Å; S175-L189 PolarHBondContact N-O 3.31Å; S175-L189 PolarHBondContact O-N 2.93Å
190	V	75.4	Confident	61.2	Low	13 Å²	13	100.1 Å²	100.1	8%	0.079	53%	0.527	C	S	.	.			trans	-95.3	-44.3	-176.1	171.9	0	0	0	0	110.3	I142 S143 Q147 I149 W174 I188	I142-V190 HydrophobicContact CG2-CG1 4.03Å; I142-V190 HydrophobicContact CG2-CG2 4.05Å; S143-V190 VanDerWaalsContact CA-CG1 3.48Å; Q147-V190 PolarHBondContact O-N 3.39Å; I149-V190 HydrophobicContact CB-CG2 4.23Å; I149-V190 HydrophobicContact CG2-CG2 3.54Å; W174-V190 HydrophobicContact CD2-CG1 4.44Å; W174-V190 HydrophobicContact CD2-CG2 4.21Å; W174-V190 HydrophobicContact CE3-CG2 4.13Å; W174-V190 HydrophobicContact CH2-CG1 4.21Å; W174-V190 HydrophobicContact CH2-CG2 4.33Å; W174-V190 HydrophobicContact CZ2-CG1 3.66Å; W174-V190 HydrophobicContact CZ2-CG2 4.42Å; W174-V190 HydrophobicContact CZ3-CG2 4.19Å; W174-V190 PolarHBondContact NE1-O 3.1Å; I188-V190 PolarHBondContact O-N 3.14Å
191	N	69.8	Low	61.5	Low	41 Å²	41	102.1 Å²	102.1	22%	0.219	53%	0.533	C	S	.	.			trans	-157.1	145.5	-176.1	-157.9	-8.2	0	0	0	109.7	S143 Q147 N196	S143-N191 PolarHBondContact O-ND2 2.92Å; Q147-N191 WeakPolarHBondContact CA-O 3.39Å; Q147-N191 WeakPolarHBondContact CG-O 3.32Å; Q147-N191 PolarHBondContact O-N 3.31Å; N191-N196 PolarHBondContact ND2-ND2 3.43Å; N191-N196 VanDerWaalsContact ND2-ND2 3.18Å
192	N	65	Low	61.9	Low	61 Å²	61	104.1 Å²	104.1	33%	0.326	53%	0.526	S	S	.	.			trans	-93.9	98.1	168.9	-169.8	7.1	0	0	0	108.8	Q147 E194 E195	Q147-N192 PolarHBondContact NE2-OD1 2.88Å; N192-E194 PolarHBondContact O-N 3.01Å; N192-E194 PolarHBondContact OD1-N 3.39Å; N192-E195 PolarHBondContact O-N 3.33Å; N192-E195 VanDerWaalsContact O-N 3.09Å
193	H	61.9	Low	62.4	Low	56 Å²	56	107.6 Å²	107.6	26%	0.259	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-57.8	-19	-177.3	-76	-52.8	0	0	0	113.9	Q147 E195 N196 I197	Q147-H193 PolarHBondContact N-NE2 2.86Å; H193-E195 PolarHBondContact O-N 2.92Å; H193-N196 PolarHBondContact O-N 3.37Å; H193-I197 WeakPolarHBondContact O-CG1 3.4Å; H193-I197 PolarHBondContact O-N 3.4Å
194	E	58.4	Low	63.1	Low	145 Å²	145	109.2 Å²	109.2	68%	0.678	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-55.4	-32.7	174.3	-68.8	-174.3	160.4	0	0	112.8	N192	N192-E194 PolarHBondContact O-N 3.01Å; N192-E194 PolarHBondContact OD1-N 3.39Å
195	E	56	Low	63.7	Low	165 Å²	165	109.5 Å²	109.5	77%	0.771	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-78.6	-21.7	177.1	-65.5	-172.3	167.5	0	0	113.3	N192 H193	N192-E195 PolarHBondContact O-N 3.33Å; N192-E195 VanDerWaalsContact O-N 3.09Å; H193-E195 PolarHBondContact O-N 2.92Å
196	N	55.9	Low	64.4	Low	91 Å²	91	106.8 Å²	106.8	49%	0.487	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	2.5	-174.6	-80.9	-49.8	0	0	0	114.3	N191 H193 K198	N191-N196 PolarHBondContact ND2-ND2 3.43Å; N191-N196 VanDerWaalsContact ND2-ND2 3.18Å; H193-N196 PolarHBondContact O-N 3.37Å; N196-K198 VanDerWaalsContact C-N 3.32Å; N196-K198 PolarHBondContact O-N 3.5Å
197	I	58.7	Low	64.9	Low	124 Å²	124	106 Å²	106	64%	0.636	52%	0.518	S	S	*	.			trans	-65.8	95.2	170.8	-63	164.8	0	0	0	108.2	H193 S199	H193-I197 WeakPolarHBondContact O-CG1 3.4Å; H193-I197 PolarHBondContact O-N 3.4Å; I197-S199 PolarHBondContact O-N 3.18Å
198	K	59.7	Low	65.1	Low	186 Å²	186	111.8 Å²	111.8	81%	0.809	54%	0.542	S	S	*	.			trans	-70.5	83.9	164.8	-67.3	-177	-176.5	177.1	0	107.6	N196 V200	N196-K198 VanDerWaalsContact C-N 3.32Å; N196-K198 PolarHBondContact O-N 3.5Å; K198-V200 VanDerWaalsContact C-N 3.3Å; K198-V200 PolarHBondContact O-N 3.16Å
199	S	58.8	Low	65.1	Low	89 Å²	89	117.8 Å²	117.8	62%	0.622	57%	0.573	S	S	*	*			trans	-65	98.9	163.8	60.2	0	0	0	0	107.4	I197 Q201	I197-S199 PolarHBondContact O-N 3.18Å; S199-Q201 PolarHBondContact O-N 3.07Å
200	V	61.9	Low	65	Low	118 Å²	118	117.8 Å²	117.8	72%	0.715	58%	0.577	S	S	*	*			trans	-72.8	91.2	166	-175.7	0	0	0	0	105.2	K198 I202	K198-V200 VanDerWaalsContact C-N 3.3Å; K198-V200 PolarHBondContact O-N 3.16Å; V200-I202 HydrophobicContact CG1-CG1 3.86Å; V200-I202 PolarHBondContact O-N 3.09Å
201	Q	56.9	Low	64.8	Low	142 Å²	142	121.2 Å²	121.2	66%	0.664	59%	0.594	S	S	*	*			trans	-66.6	93.1	168.4	-72.1	-163.2	-0.7	0	0	107.7	S199 R203	S199-Q201 PolarHBondContact O-N 3.07Å; Q201-R203 PolarHBondContact O-N 3.39Å
202	I	59.9	Low	65.1	Low	158 Å²	158	121.7 Å²	121.7	81%	0.81	60%	0.599	S	S	*	*			trans	-73.7	77.2	167	-51.9	176.2	0	0	0	106.5	V200	V200-I202 HydrophobicContact CG1-CG1 3.86Å; V200-I202 PolarHBondContact O-N 3.09Å
203	R	60.1	Low	65.5	Low	198 Å²	198	122.8 Å²	122.8	75%	0.747	61%	0.612	S	S	*	*			trans	-111.5	114.6	157.9	-96.4	-174	179.8	173.2	1.6	106.5	Q201 R205	Q201-R203 PolarHBondContact O-N 3.39Å; R203-R205 VanDerWaalsContact C-N 3.34Å; R203-R205 PolarHBondContact O-N 2.71Å
204	E	64.1	Low	65.9	Low	187 Å²	187	125.1 Å²	125.1	87%	0.874	62%	0.624	S	S	*	*			trans	-61	101.2	165.7	-157.9	172	-152.2	0	0	107.2	V206	E204-V206 PolarHBondContact O-N 2.97Å
205	R	65.9	Low	66.4	Low	187 Å²	187	121 Å²	121	71%	0.706	61%	0.611	S	S	*	*			trans	-88.7	101.9	173	-72.1	-168.3	-177.2	-173.8	2.4	106.8	R203 N207	R203-R205 VanDerWaalsContact C-N 3.34Å; R203-R205 PolarHBondContact O-N 2.71Å; R205-N207 PolarHBondContact O-N 3.41Å; R205-N207 VanDerWaalsContact O-N 3.1Å; R205-N207 PolarHBondContact O-OD1 3.16Å
206	V	71.3	Confident	67	Low	88 Å²	88	117.9 Å²	117.9	53%	0.533	60%	0.599	S	S	.	*			trans	-72.9	101.1	166.5	-165.9	0	0	0	0	106.5	E204 I211	E204-V206 PolarHBondContact O-N 2.97Å; V206-I211 HydrophobicContact CG1-CD1 3.84Å; V206-I211 HydrophobicContact CG1-CG1 3.43Å; V206-I211 VanDerWaalsContact CG1-CG1 3.43Å
207	N	78.8	Confident	67.5	Low	88 Å²	88	117.7 Å²	117.7	47%	0.471	61%	0.611	S	S	.	*			trans	-73.8	151.3	178	-64	-13.2	0	0	0	109.2	R205 D209 S210 I211	R205-N207 PolarHBondContact O-N 3.41Å; R205-N207 VanDerWaalsContact O-N 3.1Å; R205-N207 PolarHBondContact O-OD1 3.16Å; N207-D209 PolarHBondContact O-N 3.22Å; N207-D209 VanDerWaalsContact O-N 3.16Å; N207-S210 WeakPolarHBondContact O-CA 3.43Å; N207-S210 VanDerWaalsContact O-CB 3.29Å; N207-S210 WeakPolarHBondContact O-CB 3.42Å; N207-S210 PolarHBondContact O-N 3.29Å; N207-I211 PolarHBondContact O-N 2.68Å; N207-I211 VanDerWaalsContact O-N 3.14Å
208	F	76.4	Confident	67.7	Low	161 Å²	161	120.1 Å²	120.1	71%	0.706	62%	0.617	S	S	*	*	H	α-helix	trans	-55.7	-35.7	178.2	-172.4	-98.6	0	0	0	111.7	S210 I211 T212	F208-S210 VanDerWaalsContact C-N 3.34Å; F208-S210 PolarHBondContact O-N 2.82Å; F208-I211 PolarHBondContact O-N 3.19Å; F208-T212 WeakPolarHBondContact CD1-OG1 3.08Å; F208-T212 WeakPolarHBondContact CE1-OG1 3.44Å; F208-T212 WeakPolarHBondContact O-CB 3.48Å; F208-T212 PolarHBondContact O-N 3.43Å; F208-T212 PolarHBondContact O-OG1 3.37Å
209	D	77.4	Confident	67.7	Low	127 Å²	127	119.7 Å²	119.7	68%	0.679	61%	0.61	S	S	*	*	H	α-helix	trans	-63.7	-36.5	175.4	-59.1	-34.9	0	0	0	112.9	N207 I211 T212 S213	N207-D209 PolarHBondContact O-N 3.22Å; N207-D209 VanDerWaalsContact O-N 3.16Å; D209-I211 VanDerWaalsContact C-N 3.34Å; D209-T212 PolarHBondContact O-N 3.04Å; D209-S213 PolarHBondContact O-N 3.45Å
210	S	71.9	Confident	67.5	Low	48 Å²	48	120.6 Å²	120.6	34%	0.336	61%	0.614	S	S	.	*	H	α-helix	trans	-66.7	-36.3	175	-47.2	0	0	0	0	111.8	N207 F208 S213 M214	N207-S210 WeakPolarHBondContact O-CA 3.43Å; N207-S210 VanDerWaalsContact O-CB 3.29Å; N207-S210 WeakPolarHBondContact O-CB 3.42Å; N207-S210 PolarHBondContact O-N 3.29Å; F208-S210 VanDerWaalsContact C-N 3.34Å; F208-S210 PolarHBondContact O-N 2.82Å; S210-S213 PolarHBondContact O-OG 3.39Å; S210-M214 WeakPolarHBondContact O-CE 3.44Å; S210-M214 PolarHBondContact O-N 2.86Å
211	I	72.1	Confident	67	Low	85 Å²	85	119.4 Å²	119.4	44%	0.436	61%	0.611	S	S	.	*	H	α-helix	trans	-71.7	-38.5	174.2	-58.5	176.4	0	0	0	110.2	V206 N207 F208 D209 M214 S215	V206-I211 HydrophobicContact CG1-CD1 3.84Å; V206-I211 HydrophobicContact CG1-CG1 3.43Å; V206-I211 VanDerWaalsContact CG1-CG1 3.43Å; N207-I211 PolarHBondContact O-N 2.68Å; N207-I211 VanDerWaalsContact O-N 3.14Å; F208-I211 PolarHBondContact O-N 3.19Å; D209-I211 VanDerWaalsContact C-N 3.34Å; I211-M214 CarbonylContact O-C 3.54Å; I211-M214 PolarHBondContact O-N 3.16Å; I211-M214 VanDerWaalsContact O-N 3.16Å; I211-S215 PolarHBondContact O-N 3.1Å
212	T	76.4	Confident	66.7	Low	52 Å²	52	122.3 Å²	122.3	32%	0.319	62%	0.621	S	S	.	*	H	α-helix	trans	-65.8	-40.4	-179.3	-50.8	0	0	0	0	110.7	F208 D209 M214 S215 D216	F208-T212 WeakPolarHBondContact CD1-OG1 3.08Å; F208-T212 WeakPolarHBondContact CE1-OG1 3.44Å; F208-T212 WeakPolarHBondContact O-CB 3.48Å; F208-T212 PolarHBondContact O-N 3.43Å; F208-T212 PolarHBondContact O-OG1 3.37Å; D209-T212 PolarHBondContact O-N 3.04Å; T212-M214 VanDerWaalsContact C-N 3.27Å; T212-M214 PolarHBondContact O-N 3.34Å; T212-S215 WeakPolarHBondContact CA-OG 3.47Å; T212-S215 WeakPolarHBondContact O-CB 3.46Å; T212-S215 PolarHBondContact O-N 3.4Å; T212-S215 VanDerWaalsContact O-N 3.09Å; T212-S215 PolarHBondContact O-OG 3.08Å; T212-D216 PolarHBondContact O-N 3.36Å
213	S	72.3	Confident	65.9	Low	84 Å²	84	118.7 Å²	118.7	59%	0.587	61%	0.61	S	S	*	*	H	α-helix	trans	-64.6	-30.6	174.2	74.9	0	0	0	0	113.1	D209 S210	D209-S213 PolarHBondContact O-N 3.45Å; S210-S213 PolarHBondContact O-OG 3.39Å
214	M	71	Confident	65.2	Low	105 Å²	105	117 Å²	117	52%	0.517	62%	0.616	S	S	.	*	H	α-helix	trans	-77.2	-28.8	172.8	-76.1	-178.5	-94.3	0	0	112.4	S210 I211 T212 D216 A217 F218	S210-M214 WeakPolarHBondContact O-CE 3.44Å; S210-M214 PolarHBondContact O-N 2.86Å; I211-M214 CarbonylContact O-C 3.54Å; I211-M214 PolarHBondContact O-N 3.16Å; I211-M214 VanDerWaalsContact O-N 3.16Å; T212-M214 VanDerWaalsContact C-N 3.27Å; T212-M214 PolarHBondContact O-N 3.34Å; M214-D216 VanDerWaalsContact C-N 3.3Å; M214-D216 PolarHBondContact O-N 3.13Å; M214-A217 WeakPolarHBondContact O-CB 3.34Å; M214-A217 PolarHBondContact O-N 3.43Å; M214-A217 VanDerWaalsContact O-N 3.13Å; M214-F218 VanDerWaalsContact O-CD2 3.25Å; M214-F218 WeakPolarHBondContact O-CD2 3.25Å
215	S	69.5	Low	64.2	Low	57 Å²	57	116.9 Å²	116.9	40%	0.399	61%	0.613	S	S	.	*	H	α-helix	trans	-66.5	-29.3	-179.8	76.1	0	0	0	0	113.4	I211 T212 A217 F218 R219	I211-S215 PolarHBondContact O-N 3.1Å; T212-S215 WeakPolarHBondContact CA-OG 3.47Å; T212-S215 WeakPolarHBondContact O-CB 3.46Å; T212-S215 PolarHBondContact O-N 3.4Å; T212-S215 VanDerWaalsContact O-N 3.09Å; T212-S215 PolarHBondContact O-OG 3.08Å; S215-A217 PolarHBondContact O-N 2.64Å; S215-F218 PolarHBondContact O-N 3.09Å; S215-F218 VanDerWaalsContact O-N 3.08Å; S215-R219 PolarHBondContact O-N 3.33Å
216	D	67.8	Low	63.3	Low	100 Å²	100	117.5 Å²	117.5	54%	0.535	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-66.2	-25.7	173.4	-82.1	-37	0	0	0	112.8	T212 M214 F218 R219	T212-D216 PolarHBondContact O-N 3.36Å; M214-D216 VanDerWaalsContact C-N 3.3Å; M214-D216 PolarHBondContact O-N 3.13Å; D216-F218 VanDerWaalsContact C-N 3.28Å; D216-F218 PolarHBondContact O-N 3.48Å; D216-R219 VanDerWaalsContact O-CB 3.28Å; D216-R219 WeakPolarHBondContact O-CB 3.28Å; D216-R219 PolarHBondContact O-N 3.27Å
217	A	66.3	Low	62.2	Low	88 Å²	88	120.6 Å²	120.6	73%	0.727	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-72.8	-21.1	173.2	0	0	0	0	0	112.9	M214 S215	M214-A217 WeakPolarHBondContact O-CB 3.34Å; M214-A217 PolarHBondContact O-N 3.43Å; M214-A217 VanDerWaalsContact O-N 3.13Å; S215-A217 PolarHBondContact O-N 2.64Å
218	F	63.8	Low	60.2	Low	175 Å²	175	125.6 Å²	125.6	77%	0.768	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-93.4	1	173.5	-64.1	-76.6	0	0	0	112.8	M214 S215 D216 P220	M214-F218 VanDerWaalsContact O-CD2 3.25Å; M214-F218 WeakPolarHBondContact O-CD2 3.25Å; S215-F218 PolarHBondContact O-N 3.09Å; S215-F218 VanDerWaalsContact O-N 3.08Å; D216-F218 VanDerWaalsContact C-N 3.28Å; D216-F218 PolarHBondContact O-N 3.48Å; F218-P220 VanDerWaalsContact O-CD 3.29Å; F218-P220 WeakPolarHBondContact O-CD 3.29Å
219	R	59.8	Low	58.5	Low	177 Å²	177	123.7 Å²	123.7	67%	0.668	65%	0.652	S	S	*	*	S	Bend	trans	-67.8	116.8	175.5	-165.6	172.8	-172.2	153.8	2.3	108.1	S215 D216 S221	S215-R219 PolarHBondContact O-N 3.33Å; D216-R219 VanDerWaalsContact O-CB 3.28Å; D216-R219 WeakPolarHBondContact O-CB 3.28Å; D216-R219 PolarHBondContact O-N 3.27Å; R219-S221 PolarHBondContact O-N 3.34Å; R219-S221 VanDerWaalsContact O-N 3.16Å
220	P	53.2	Low	56.5	Low	107 Å²	107	123.3 Å²	123.3	70%	0.695	66%	0.655	S	S	*	*			trans	-59.5	127.9	178.7	22.5	-29.9	0	0	0	108.5	F218 K222	F218-P220 VanDerWaalsContact O-CD 3.29Å; F218-P220 WeakPolarHBondContact O-CD 3.29Å; P220-K222 PolarHBondContact O-N 3.48Å
221	S	52.3	Low	55	Low	93 Å²	93	131.8 Å²	131.8	65%	0.65	68%	0.681	S	S	*	*			trans	-40.1	128	163.1	154.2	0	0	0	0	108	R219 S223	R219-S221 PolarHBondContact O-N 3.34Å; R219-S221 VanDerWaalsContact O-N 3.16Å; S221-S223 PolarHBondContact O-N 3.08Å; S221-S223 PolarHBondContact O-OG 3.26Å; S221-S223 PolarHBondContact OG-OG 3.01Å
222	K	50.3	Low	53.5	Low	204 Å²	204	134.2 Å²	134.2	89%	0.887	70%	0.695	S	S	*	*	S	Bend	trans	-63.4	83.8	171	-75.5	-176.2	177.8	178.5	0	108.4	P220	P220-K222 PolarHBondContact O-N 3.48Å
223	S	42.8	Very low	51.5	Low	81 Å²	81	139 Å²	139	57%	0.566	72%	0.719	S	S	*	*			trans	-139	85	168.1	53.1	0	0	0	0	107.4	S221 F225	S221-S223 PolarHBondContact O-N 3.08Å; S221-S223 PolarHBondContact O-OG 3.26Å; S221-S223 PolarHBondContact OG-OG 3.01Å; S223-F225 PolarHBondContact O-N 3.16Å
224	D	45.2	Very low	50	Low	164 Å²	164	142.3 Å²	142.3	88%	0.877	72%	0.724	S	S	*	*	S	Bend	trans	32.1	46.7	145.6	-60.3	-24.2	0	0	0	121.8
225	F	44.1	Very low	48.2	Very low	183 Å²	183	143.5 Å²	143.5	80%	0.803	73%	0.733	S	S	*	*			trans	-142.6	11.5	175.2	-134.5	-94.6	0	0	0	120.4	S223	S223-F225 PolarHBondContact O-N 3.16Å
226	F	46.9	Very low	46.7	Very low	200 Å²	200	148.3 Å²	148.3	88%	0.877	75%	0.754	S	S	*	*	S	Bend	trans	-121.2	126	176.6	-74.6	-85	0	0	0	114	K228	F226-K228 PolarHBondContact O-N 3.25Å
227	I	47	Very low	45.2	Very low	154 Å²	154	150.8 Å²	150.8	79%	0.79	77%	0.767	S	S	*	*			trans	-55.9	123.6	-169.9	-62.1	170.2	0	0	0	110.9	T229	I227-T229 PolarHBondContact O-N 3.16Å
228	K	38.5	Very low	44.2	Very low	192 Å²	192	154.6 Å²	154.6	84%	0.835	77%	0.77	S	S	*	*			trans	-66.3	101.4	166	-77.7	-178.3	177.5	176.3	0	108.8	F226 T230	F226-K228 PolarHBondContact O-N 3.25Å; K228-T230 VanDerWaalsContact C-N 3.31Å; K228-T230 PolarHBondContact O-N 3.06Å; K228-T230 VanDerWaalsContact O-N 3.08Å
229	T	40.7	Very low	43	Very low	121 Å²	121	153 Å²	153	74%	0.742	77%	0.767	S	S	*	*			trans	-74.5	91.8	158.3	43.4	0	0	0	0	108	I227 Y231	I227-T229 PolarHBondContact O-N 3.16Å; T229-Y231 VanDerWaalsContact C-N 3.34Å; T229-Y231 PolarHBondContact O-N 2.71Å
230	T	34.8	Very low	42.1	Very low	120 Å²	120	152.9 Å²	152.9	74%	0.736	77%	0.774	S	S	*	*			trans	-65.2	95.3	161.5	36	0	0	0	0	108.2	K228 N232	K228-T230 VanDerWaalsContact C-N 3.31Å; K228-T230 PolarHBondContact O-N 3.06Å; K228-T230 VanDerWaalsContact O-N 3.08Å; T230-N232 PolarHBondContact O-N 3.48Å; T230-N232 VanDerWaalsContact O-N 3.16Å
231	Y	40.6	Very low	41.3	Very low	226 Å²	226	154.3 Å²	154.3	89%	0.886	78%	0.781	S	S	*	*			trans	-74.6	101.3	159.7	-117.3	-87.5	0	0	0	107.3	T229 N233	T229-Y231 VanDerWaalsContact C-N 3.34Å; T229-Y231 PolarHBondContact O-N 2.71Å; Y231-N233 PolarHBondContact O-N 3.35Å
232	N	40.4	Very low	40.7	Very low	136 Å²	136	163.1 Å²	163.1	73%	0.727	81%	0.808	S	S	*	*			trans	-70	118.4	-174.5	-143.8	5.9	0	0	0	108.9	T230 H234	T230-N232 PolarHBondContact O-N 3.48Å; T230-N232 VanDerWaalsContact O-N 3.16Å; N232-H234 PolarHBondContact O-N 3.46Å
233	N	33.7	Very low	40.2	Very low	153 Å²	153	161.1 Å²	161.1	82%	0.818	80%	0.804	S	S	*	*			trans	-75.5	103.8	173.5	-147.2	5.9	0	0	0	107	Y231	Y231-N233 PolarHBondContact O-N 3.35Å
234	H	40.5	Very low	40	Very low	153 Å²	153	165.3 Å²	165.3	71%	0.708	82%	0.816	S	S	*	*			trans	-138.1	105.3	168.8	-108.1	45.3	0	0	0	110.5	N232	N232-H234 PolarHBondContact O-N 3.46Å
235	N	34.2	Very low	39.7	Very low	130 Å²	130	165.4 Å²	165.4	70%	0.695	81%	0.813	S	S	*	*			trans	36.1	110.9	135.5	-71.6	-12.3	0	0	0	117.2
236	N	38.4	Very low	39.5	Very low	158 Å²	158	164.4 Å²	164.4	85%	0.845	81%	0.814	S	S	*	*				-172	120.3	100	-94.7	-20.6	0	0	0	111.9	H238	N236-H238 PolarHBondContact O-N 3.02Å
237	N	35.6	Very low	39	Very low	151 Å²	151	162.1 Å²	162.1	81%	0.807	81%	0.81	S	S	*	*			trans	-50.6	128.3	153.5	-73.1	-33.2	0	0	0	109.5
238	H	45.2	Very low	38.5	Very low	169 Å²	169	162.7 Å²	162.7	78%	0.782	81%	0.811	S	S	*	*			trans	176.1	101.6	130.4	-97.7	-64.4	0	0	0	111.3	N236	N236-H238 PolarHBondContact O-N 3.02Å
239	I	38.4	Very low	38.5	Very low	140 Å²	140	160.6 Å²	160.6	72%	0.718	81%	0.809	S	S	*	*				26.6	106.6	123	-46.3	167.2	0	0	0	115.8
240	H	40.8	Very low	38.3	Very low	176 Å²	176	163.6 Å²	163.6	82%	0.815	81%	0.814	S	S	*	*				-179.5	123.5	117	-116.2	-55.9	0	0	0	112.5
241	T	37.7	Very low	38.6	Very low	136 Å²	136	167.3 Å²	167.3	83%	0.834	82%	0.821	S	S	*	*			trans	-79.6	121.8	155.3	28.9	0	0	0	0	109.5
242	K	38.1	Very low	38.5	Very low	279 Å²	279	161.9 Å²	161.9	100%	1.213	82%	0.815	S	S	*	*			trans	-153.3	0	144.4	-113.7	-170.6	-177.9	-176.8	0	107.9

Retrieved 242 of 242 residues in 56.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).