A0A087XKM6_POEFO Loading...

Ubiquitin-like protease family profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XKM6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 355 aa.

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(Predicted Aligned Error values between residue pairs)

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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	37.2	Very low	37.1	Very low	253 Å²	253	155.9 Å²	155.9	100%	1.246	87%	0.87	S	S	*	*				0	119.7	0	-91.3	156.4	100.8	0	0	108.1
2	G	35.9	Very low	37	Very low	81 Å²	81	158.1 Å²	158.1	84%	0.835	86%	0.855	S	S	*	*			trans	87.6	88.1	156.6	0	0	0	0	0	118.1
3	S	33	Very low	37.3	Very low	125 Å²	125	151.4 Å²	151.4	87%	0.874	83%	0.827	S	S	*	*			trans	-91.8	128	153.7	-57.3	0	0	0	0	108.2
4	L	37.4	Very low	37.3	Very low	177 Å²	177	151.5 Å²	151.5	93%	0.927	82%	0.819	S	S	*	*			trans	-88.2	114.4	176.3	-92.2	138.8	0	0	0	109.8
5	E	35.2	Very low	37.4	Very low	190 Å²	190	145.6 Å²	145.6	89%	0.888	79%	0.794	S	S	*	*			trans	-80.3	136.9	164.3	-72.3	-175.8	157.5	0	0	110
6	H	35.8	Very low	37.5	Very low	189 Å²	189	143.8 Å²	143.8	88%	0.875	78%	0.778	S	S	*	*			trans	-102.6	112.3	178.4	-148.6	63.2	0	0	0	108.6
7	S	34.1	Very low	37.6	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	77%	0.772	S	S	*	*			trans	-87.2	125.3	175.4	-100.2	0	0	0	0	111.4
8	P	41.3	Very low	37.6	Very low	121 Å²	121	140.1 Å²	140.1	79%	0.786	76%	0.755	S	S	*	*			trans	-101.2	81.6	176.6	36.2	-26.6	0	0	0	110.7
9	D	40.5	Very low	37.9	Very low	132 Å²	132	136.7 Å²	136.7	71%	0.706	74%	0.74	S	S	*	*			trans	-139.8	13.7	-177.8	-113.5	-17.3	0	0	0	116.5
10	L	39.8	Very low	38.4	Very low	152 Å²	152	132.3 Å²	132.3	80%	0.796	72%	0.72	S	S	*	*	S	Bend	trans	-107.3	-7.8	-179.5	-110.6	81.5	0	0	0	116.6
11	Q	38.3	Very low	38.2	Very low	184 Å²	184	129.5 Å²	129.5	86%	0.86	71%	0.709	S	S	*	*	S	Bend	trans	-99.9	-9.1	-178.1	-79.4	-175.1	-23.9	0	0	115
12	R	36	Very low	38.4	Very low	182 Å²	182	121.5 Å²	121.5	69%	0.687	67%	0.674	S	S	*	*	H	α-helix	trans	-82.7	-30.5	-177.5	-153.5	171	-175.6	169.4	3.6	113.1	S15 E16	R12-S15 PolarHBondContact O-OG 3.05Å; R12-E16 IonicContact NE-OE1 3.65Å; R12-E16 PolarHBondContact O-N 3.41Å
13	S	40.8	Very low	39.4	Very low	71 Å²	71	122.2 Å²	122.2	50%	0.497	66%	0.659	S	S	.	*	H	α-helix	trans	-78.2	-30.2	-171.9	62.1	0	0	0	0	115.1	K17	S13-K17 VanDerWaalsContact O-CB 3.28Å; S13-K17 WeakPolarHBondContact O-CB 3.07Å; S13-K17 PolarHBondContact O-N 3.47Å
14	E	37.5	Very low	40.3	Very low	153 Å²	153	121.8 Å²	121.8	72%	0.715	64%	0.643	S	S	*	*	H	α-helix	trans	-79.1	-30.4	179.3	-70.6	-174.6	156.7	0	0	113	S18	E14-S18 WeakPolarHBondContact O-CB 3.43Å; E14-S18 PolarHBondContact O-N 3.3Å; E14-S18 VanDerWaalsContact O-N 3.08Å; E14-S18 PolarHBondContact O-OG 3.25Å
15	S	38.2	Very low	41	Very low	63 Å²	63	115.8 Å²	115.8	44%	0.441	62%	0.619	S	S	.	*	H	α-helix	trans	-72.7	-35.9	175.1	73.8	0	0	0	0	112.7	R12 S18 T19	R12-S15 PolarHBondContact O-OG 3.05Å; S15-S18 PolarHBondContact O-OG 3.4Å; S15-S18 VanDerWaalsContact O-OG 3.12Å; S15-T19 VanDerWaalsContact O-CB 3.27Å; S15-T19 WeakPolarHBondContact O-CB 3.23Å; S15-T19 PolarHBondContact O-N 2.9Å; S15-T19 VanDerWaalsContact O-N 3.12Å; S15-T19 PolarHBondContact O-OG1 2.83Å
16	E	39	Very low	42.7	Very low	117 Å²	117	111 Å²	111	55%	0.547	60%	0.599	S	S	.	*	H	α-helix	trans	-74.1	-35.2	176.5	-74.4	175.8	176.9	0	0	111.9	R12 S20	R12-E16 IonicContact NE-OE1 3.65Å; R12-E16 PolarHBondContact O-N 3.41Å; E16-S20 WeakPolarHBondContact O-CB 3.39Å; E16-S20 PolarHBondContact O-N 3.35Å
17	K	38.7	Very low	44.7	Very low	155 Å²	155	103.1 Å²	103.1	67%	0.674	57%	0.567	S	S	*	*	H	α-helix	trans	-75.5	-34.6	179.1	-151.7	176.7	-168.2	-178.2	0	113.2	S13 S20 C21	S13-K17 VanDerWaalsContact O-CB 3.28Å; S13-K17 WeakPolarHBondContact O-CB 3.07Å; S13-K17 PolarHBondContact O-N 3.47Å; K17-S20 PolarHBondContact O-OG 3.35Å; K17-S20 VanDerWaalsContact O-OG 3.1Å; K17-C21 PolarHBondContact O-N 3.24Å; K17-C21 VanDerWaalsContact O-N 3.13Å
18	S	38.2	Very low	47	Very low	65 Å²	65	102.5 Å²	102.5	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-71.4	-38.3	171.4	53.4	0	0	0	0	111.9	E14 S15 V22	E14-S18 WeakPolarHBondContact O-CB 3.43Å; E14-S18 PolarHBondContact O-N 3.3Å; E14-S18 VanDerWaalsContact O-N 3.08Å; E14-S18 PolarHBondContact O-OG 3.25Å; S15-S18 PolarHBondContact O-OG 3.4Å; S15-S18 VanDerWaalsContact O-OG 3.12Å; S18-V22 WeakPolarHBondContact O-CB 3.46Å; S18-V22 VanDerWaalsContact O-CG2 3.24Å; S18-V22 WeakPolarHBondContact O-CG2 3.33Å; S18-V22 PolarHBondContact O-N 3.41Å; S18-V22 VanDerWaalsContact O-N 3.09Å
19	T	43.6	Very low	49.2	Very low	77 Å²	77	99.2 Å²	99.2	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-68.5	-35.8	174.2	-53.8	0	0	0	0	111.9	S15 N23	S15-T19 VanDerWaalsContact O-CB 3.27Å; S15-T19 WeakPolarHBondContact O-CB 3.23Å; S15-T19 PolarHBondContact O-N 2.9Å; S15-T19 VanDerWaalsContact O-N 3.12Å; S15-T19 PolarHBondContact O-OG1 2.83Å; T19-N23 VanDerWaalsContact O-CB 3.22Å; T19-N23 WeakPolarHBondContact O-CB 3.47Å; T19-N23 PolarHBondContact O-N 3.38Å; T19-N23 PolarHBondContact O-ND2 2.66Å; T19-N23 VanDerWaalsContact O-ND2 3.08Å
20	S	46.6	Very low	51.4	Low	48 Å²	48	93.1 Å²	93.1	34%	0.336	50%	0.5	S	S	.	.	H	α-helix	trans	-68	-45.6	175.6	81.6	0	0	0	0	112.2	E16 K17 V22 N23 E24	E16-S20 WeakPolarHBondContact O-CB 3.39Å; E16-S20 PolarHBondContact O-N 3.35Å; K17-S20 PolarHBondContact O-OG 3.35Å; K17-S20 VanDerWaalsContact O-OG 3.1Å; S20-V22 PolarHBondContact O-N 3.4Å; S20-N23 PolarHBondContact O-N 3.45Å; S20-E24 WeakPolarHBondContact O-CB 3.03Å; S20-E24 WeakPolarHBondContact O-CG 3.05Å; S20-E24 PolarHBondContact O-N 2.95Å
21	C	34.2	Very low	53.8	Low	74 Å²	74	86.5 Å²	86.5	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-36	177.8	-78.4	0	0	0	0	112.9	K17 A25	K17-C21 PolarHBondContact O-N 3.24Å; K17-C21 VanDerWaalsContact O-N 3.13Å; C21-A25 VanDerWaalsContact O-CB 3.31Å; C21-A25 WeakPolarHBondContact O-CB 3.45Å; C21-A25 PolarHBondContact O-N 3.08Å
22	V	43	Very low	56.3	Low	85 Å²	85	84.5 Å²	84.5	52%	0.515	45%	0.45	S	S	.	.	H	α-helix	trans	-70.1	-38.1	174.4	172.6	0	0	0	0	111.2	S18 S20 N26	S18-V22 WeakPolarHBondContact O-CB 3.46Å; S18-V22 VanDerWaalsContact O-CG2 3.24Å; S18-V22 WeakPolarHBondContact O-CG2 3.33Å; S18-V22 PolarHBondContact O-N 3.41Å; S18-V22 VanDerWaalsContact O-N 3.09Å; S20-V22 PolarHBondContact O-N 3.4Å; V22-N26 VanDerWaalsContact O-CB 3.31Å; V22-N26 WeakPolarHBondContact O-CB 3.3Å; V22-N26 VanDerWaalsContact O-CG 3.3Å; V22-N26 PolarHBondContact O-N 2.85Å; V22-N26 PolarHBondContact O-ND2 3.26Å
23	N	55.7	Low	59	Low	95 Å²	95	76.5 Å²	76.5	51%	0.508	42%	0.421	S	S	.	.	H	α-helix	trans	-68.8	-35.7	175.3	-76	-26.4	0	0	0	112.8	T19 S20 A27	T19-N23 VanDerWaalsContact O-CB 3.22Å; T19-N23 WeakPolarHBondContact O-CB 3.47Å; T19-N23 PolarHBondContact O-N 3.38Å; T19-N23 PolarHBondContact O-ND2 2.66Å; T19-N23 VanDerWaalsContact O-ND2 3.08Å; S20-N23 PolarHBondContact O-N 3.45Å; N23-A27 VanDerWaalsContact O-CB 3.31Å; N23-A27 WeakPolarHBondContact O-CB 3.24Å; N23-A27 PolarHBondContact O-N 3.34Å
24	E	52.3	Low	61.4	Low	116 Å²	116	73.1 Å²	73.1	54%	0.542	40%	0.397	S	S	.	.	H	α-helix	trans	-68.8	-47.8	173.4	-77.7	175.2	169.9	0	0	111.6	S20 N26 A27 D28	S20-E24 WeakPolarHBondContact O-CB 3.03Å; S20-E24 WeakPolarHBondContact O-CG 3.05Å; S20-E24 PolarHBondContact O-N 2.95Å; E24-N26 VanDerWaalsContact C-N 3.26Å; E24-N26 PolarHBondContact O-N 3.18Å; E24-A27 CarbonylContact O-C 3.58Å; E24-A27 WeakPolarHBondContact O-CA 3.43Å; E24-A27 WeakPolarHBondContact O-CB 3.5Å; E24-A27 PolarHBondContact O-N 2.79Å; E24-D28 PolarHBondContact O-N 3.1Å
25	A	52.9	Low	63.9	Low	51 Å²	51	68.8 Å²	68.8	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-36.7	175	0	0	0	0	0	112.4	C21 T29	C21-A25 VanDerWaalsContact O-CB 3.31Å; C21-A25 WeakPolarHBondContact O-CB 3.45Å; C21-A25 PolarHBondContact O-N 3.08Å; A25-T29 WeakPolarHBondContact O-CB 3.19Å; A25-T29 PolarHBondContact O-N 2.93Å; A25-T29 VanDerWaalsContact O-N 3.09Å; A25-T29 PolarHBondContact O-OG1 3.34Å
26	N	70.1	Confident	66.4	Low	90 Å²	90	69.7 Å²	69.7	48%	0.481	38%	0.377	S	S	.	.	H	α-helix	trans	-71.4	-33.2	172.6	-79.6	-22.5	0	0	0	112.8	V22 E24 L30	V22-N26 VanDerWaalsContact O-CB 3.31Å; V22-N26 WeakPolarHBondContact O-CB 3.3Å; V22-N26 VanDerWaalsContact O-CG 3.3Å; V22-N26 PolarHBondContact O-N 2.85Å; V22-N26 PolarHBondContact O-ND2 3.26Å; E24-N26 VanDerWaalsContact C-N 3.26Å; E24-N26 PolarHBondContact O-N 3.18Å; N26-L30 VanDerWaalsContact O-CB 3.26Å; N26-L30 WeakPolarHBondContact O-CB 3.48Å; N26-L30 PolarHBondContact O-N 3.23Å
27	A	77.2	Confident	68.9	Low	23 Å²	23	66 Å²	66	19%	0.19	36%	0.359	C	S	.	.	H	α-helix	trans	-72.7	-37.2	176.8	0	0	0	0	0	112.5	N23 E24 T31	N23-A27 VanDerWaalsContact O-CB 3.31Å; N23-A27 WeakPolarHBondContact O-CB 3.24Å; N23-A27 PolarHBondContact O-N 3.34Å; E24-A27 CarbonylContact O-C 3.58Å; E24-A27 WeakPolarHBondContact O-CA 3.43Å; E24-A27 WeakPolarHBondContact O-CB 3.5Å; E24-A27 PolarHBondContact O-N 2.79Å; A27-T31 WeakPolarHBondContact O-CB 3.29Å; A27-T31 PolarHBondContact O-N 2.87Å; A27-T31 PolarHBondContact O-OG1 3.05Å
28	D	83.3	Confident	71.3	Confident	99 Å²	99	58.7 Å²	58.7	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-71.7	-41.3	176.6	-73.7	-14.7	0	0	0	111.5	E24 L30 T31 R32	E24-D28 PolarHBondContact O-N 3.1Å; D28-L30 VanDerWaalsContact C-N 3.33Å; D28-L30 PolarHBondContact O-N 2.93Å; D28-T31 PolarHBondContact O-N 3.43Å; D28-R32 WeakPolarHBondContact O-CG 3.31Å; D28-R32 PolarHBondContact O-N 3.29Å
29	T	87.1	Confident	73.7	Confident	51 Å²	51	60.6 Å²	60.6	31%	0.313	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-41.9	173.6	-56.5	0	0	0	0	111.3	A25 T31 R32 E33 F64	A25-T29 WeakPolarHBondContact O-CB 3.19Å; A25-T29 PolarHBondContact O-N 2.93Å; A25-T29 VanDerWaalsContact O-N 3.09Å; A25-T29 PolarHBondContact O-OG1 3.34Å; T29-T31 VanDerWaalsContact C-N 3.32Å; T29-T31 PolarHBondContact O-N 2.92Å; T29-R32 PolarHBondContact OG1-NH2 3.36Å; T29-R32 VanDerWaalsContact OG1-NH2 3.07Å; T29-E33 WeakPolarHBondContact O-CB 3.5Å; T29-E33 PolarHBondContact O-N 3.42Å; T29-F64 HydrophobicContact CG2-CE1 4.06Å; T29-F64 HydrophobicContact CG2-CZ 4.14Å
30	L	87.7	Confident	75.7	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-37.8	173.9	-174.7	67.1	0	0	0	112.5	N26 D28 E33 I34 L60 F64 F68 I75	N26-L30 VanDerWaalsContact O-CB 3.26Å; N26-L30 WeakPolarHBondContact O-CB 3.48Å; N26-L30 PolarHBondContact O-N 3.23Å; D28-L30 VanDerWaalsContact C-N 3.33Å; D28-L30 PolarHBondContact O-N 2.93Å; L30-E33 PolarHBondContact O-N 3.17Å; L30-I34 HydrophobicContact CG-CD1 4.26Å; L30-I34 VanDerWaalsContact O-CG1 3.3Å; L30-I34 WeakPolarHBondContact O-CG1 3.39Å; L30-I34 PolarHBondContact O-N 3.03Å; L30-I34 VanDerWaalsContact O-N 3.11Å; L30-L60 HydrophobicContact CD1-CD1 3.92Å; L30-L60 HydrophobicContact CD1-CD2 3.8Å; L30-L60 HydrophobicContact CD1-CG 4.36Å; L30-F64 HydrophobicContact CD1-CE2 4.23Å; L30-F68 HydrophobicContact CD1-CE1 3.82Å; L30-F68 HydrophobicContact CD1-CZ 4.19Å; L30-F68 HydrophobicContact CD2-CE1 4.47Å; L30-I75 HydrophobicContact CD2-CG1 4.23Å
31	T	89.6	Confident	77.6	Confident	13 Å²	13	60.5 Å²	60.5	8%	0.08	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-49.2	-180	-55.5	0	0	0	0	111.2	A27 D28 T29 E33 I34 Q35 K78 Y82	A27-T31 WeakPolarHBondContact O-CB 3.29Å; A27-T31 PolarHBondContact O-N 2.87Å; A27-T31 PolarHBondContact O-OG1 3.05Å; D28-T31 PolarHBondContact O-N 3.43Å; T29-T31 VanDerWaalsContact C-N 3.32Å; T29-T31 PolarHBondContact O-N 2.92Å; T31-E33 VanDerWaalsContact C-N 3.25Å; T31-E33 PolarHBondContact O-N 2.86Å; T31-I34 PolarHBondContact O-N 2.88Å; T31-I34 VanDerWaalsContact O-N 3.17Å; T31-Q35 WeakPolarHBondContact O-CG 3.24Å; T31-Q35 PolarHBondContact O-N 3.28Å; T31-K78 PolarHBondContact OG1-NZ 2.74Å; T31-Y82 HydrophobicContact CG2-CE2 3.75Å; T31-Y82 VanDerWaalsContact CG2-OH 3.27Å; T31-Y82 WeakPolarHBondContact CG2-OH 3.21Å
32	R	90.3	Very high	80.1	Confident	141 Å²	141	57 Å²	57	53%	0.532	30%	0.301	S	S	.	.	H	α-helix	trans	-56.6	-43.6	175.5	-73.1	-177.9	-71.2	148.9	-3.2	110.7	D28 T29 I34 Q35 D36	D28-R32 WeakPolarHBondContact O-CG 3.31Å; D28-R32 PolarHBondContact O-N 3.29Å; T29-R32 PolarHBondContact OG1-NH2 3.36Å; T29-R32 VanDerWaalsContact OG1-NH2 3.07Å; R32-I34 VanDerWaalsContact C-N 3.33Å; R32-I34 PolarHBondContact O-N 3.4Å; R32-Q35 WeakPolarHBondContact O-CB 3.13Å; R32-Q35 PolarHBondContact O-N 3.06Å; R32-Q35 VanDerWaalsContact O-N 3.12Å; R32-D36 WeakPolarHBondContact O-CB 3.17Å; R32-D36 VanDerWaalsContact O-CG 3.24Å; R32-D36 PolarHBondContact O-N 3.3Å
33	E	92.4	Very high	82	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.065	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-40.1	178.4	-170.3	57.1	-155.6	0	0	113.9	T29 L30 T31 Q35 F37 H59 L60 K63 F64	T29-E33 WeakPolarHBondContact O-CB 3.5Å; T29-E33 PolarHBondContact O-N 3.42Å; L30-E33 PolarHBondContact O-N 3.17Å; T31-E33 VanDerWaalsContact C-N 3.25Å; T31-E33 PolarHBondContact O-N 2.86Å; E33-Q35 VanDerWaalsContact C-N 3.35Å; E33-F37 VanDerWaalsContact O-CB 3.26Å; E33-F37 WeakPolarHBondContact O-CB 3.19Å; E33-F37 PolarHBondContact O-N 3.27Å; E33-H59 IonicContact OE1-CD2 2.73Å; E33-H59 IonicContact OE1-CE1 3.5Å; E33-H59 IonicContact OE1-NE2 2.66Å; E33-H59 PolarHBondContact OE1-NE2 2.83Å; E33-L60 HydrophobicContact CB-CD2 3.99Å; E33-L60 HydrophobicContact CG-CD2 3.54Å; E33-K63 VanDerWaalsContact CD-CE 3.44Å; E33-K63 HydrophobicContact CG-CD 3.89Å; E33-K63 WeakPolarHBondContact OE1-CD 3.46Å; E33-K63 WeakPolarHBondContact OE1-CE 3.24Å; E33-K63 IonicContact OE1-NZ 2.67Å; E33-K63 PolarHBondContact OE1-NZ 2.97Å; E33-K63 WeakPolarHBondContact OE2-CD 3.48Å; E33-K63 WeakPolarHBondContact OE2-CE 3.38Å; E33-K63 IonicContact OE2-NZ 3.94Å; E33-K63 PolarHBondContact OE2-NZ 3.12Å; E33-F64 HydrophobicContact CB-CE2 4.08Å; E33-F64 HydrophobicContact CB-CZ 4.17Å; E33-F64 HydrophobicContact CG-CE2 3.91Å; E33-F64 HydrophobicContact CG-CZ 4.3Å
34	I	91.3	Very high	83.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-45.2	175.6	-69.5	164.5	0	0	0	109.6	L30 T31 R32 F37 L38 V56 L60 I75 K78 V79	L30-I34 HydrophobicContact CG-CD1 4.26Å; L30-I34 VanDerWaalsContact O-CG1 3.3Å; L30-I34 WeakPolarHBondContact O-CG1 3.39Å; L30-I34 PolarHBondContact O-N 3.03Å; L30-I34 VanDerWaalsContact O-N 3.11Å; T31-I34 PolarHBondContact O-N 2.88Å; T31-I34 VanDerWaalsContact O-N 3.17Å; R32-I34 VanDerWaalsContact C-N 3.33Å; R32-I34 PolarHBondContact O-N 3.4Å; I34-F37 PolarHBondContact O-N 3.49Å; I34-L38 HydrophobicContact CG2-CD1 3.79Å; I34-L38 HydrophobicContact CG2-CG 4.32Å; I34-L38 WeakPolarHBondContact O-CB 3.43Å; I34-L38 WeakPolarHBondContact O-CG 3.24Å; I34-L38 PolarHBondContact O-N 2.98Å; I34-V56 HydrophobicContact CG1-CG1 4.24Å; I34-L60 HydrophobicContact CD1-CD1 4.28Å; I34-L60 HydrophobicContact CG1-CD1 3.98Å; I34-L60 HydrophobicContact CG1-CD2 4.28Å; I34-I75 HydrophobicContact CD1-CG1 4.44Å; I34-I75 HydrophobicContact CD1-CG2 4.02Å; I34-K78 HydrophobicContact CD1-CB 4.25Å; I34-K78 HydrophobicContact CD1-CD 4.39Å; I34-V79 HydrophobicContact CG2-CG2 3.81Å
35	Q	91.1	Very high	84.8	Confident	63 Å²	63	56.5 Å²	56.5	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-61.3	-51.9	179	-70.2	174.1	-45.7	0	0	111.3	T31 R32 E33 F37 L38 E39 Y82	T31-Q35 WeakPolarHBondContact O-CG 3.24Å; T31-Q35 PolarHBondContact O-N 3.28Å; R32-Q35 WeakPolarHBondContact O-CB 3.13Å; R32-Q35 PolarHBondContact O-N 3.06Å; R32-Q35 VanDerWaalsContact O-N 3.12Å; E33-Q35 VanDerWaalsContact C-N 3.35Å; Q35-F37 VanDerWaalsContact C-N 3.31Å; Q35-F37 PolarHBondContact O-N 3.39Å; Q35-L38 PolarHBondContact O-N 2.89Å; Q35-L38 VanDerWaalsContact O-N 3.13Å; Q35-E39 WeakPolarHBondContact O-CB 3.19Å; Q35-E39 PolarHBondContact O-N 3.11Å; Q35-Y82 HydrophobicContact CG-CD1 4Å; Q35-Y82 HydrophobicContact CG-CD2 3.92Å; Q35-Y82 HydrophobicContact CG-CE1 4.21Å; Q35-Y82 HydrophobicContact CG-CE2 4.15Å; Q35-Y82 HydrophobicContact CG-CG 3.86Å
36	D	90.2	Very high	86.3	Confident	82 Å²	82	54.1 Å²	54.1	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-57.4	-44.5	179.3	-66.9	-8.2	0	0	0	111.1	R32 E39 V40	R32-D36 WeakPolarHBondContact O-CB 3.17Å; R32-D36 VanDerWaalsContact O-CG 3.24Å; R32-D36 PolarHBondContact O-N 3.3Å; D36-E39 PolarHBondContact O-N 3.22Å; D36-V40 WeakPolarHBondContact O-CB 3.5Å; D36-V40 VanDerWaalsContact O-CG2 3.24Å; D36-V40 WeakPolarHBondContact O-CG2 3.28Å; D36-V40 PolarHBondContact O-N 2.96Å
37	F	90.4	Very high	86.8	Confident	40 Å²	40	52.1 Å²	52.1	18%	0.175	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-43.3	177.7	178	-100.6	0	0	0	112.3	E33 I34 Q35 F41 L51 V56 H59	E33-F37 VanDerWaalsContact O-CB 3.26Å; E33-F37 WeakPolarHBondContact O-CB 3.19Å; E33-F37 PolarHBondContact O-N 3.27Å; I34-F37 PolarHBondContact O-N 3.49Å; Q35-F37 VanDerWaalsContact C-N 3.31Å; Q35-F37 PolarHBondContact O-N 3.39Å; F37-F41 VanDerWaalsContact O-CB 3.22Å; F37-F41 WeakPolarHBondContact O-CB 3.34Å; F37-F41 PolarHBondContact O-N 2.72Å; F37-L51 HydrophobicContact CE1-CD1 3.85Å; F37-L51 HydrophobicContact CE1-CD2 3.99Å; F37-L51 HydrophobicContact CE1-CG 4.5Å; F37-L51 HydrophobicContact CZ-CD1 4.16Å; F37-V56 HydrophobicContact CD1-CB 4.5Å; F37-V56 HydrophobicContact CD1-CG1 4.47Å; F37-V56 HydrophobicContact CD1-CG2 3.99Å; F37-V56 HydrophobicContact CE1-CB 4.36Å; F37-V56 HydrophobicContact CE1-CG2 3.78Å; F37-H59 HydrophobicContact CD2-CB 3.96Å; F37-H59 AromaticContact CD2-CD2 3.45Å; F37-H59 VanDerWaalsContact CD2-CD2 3.45Å; F37-H59 WeakPolarHBondContact CD2-CD2 3.36Å; F37-H59 AromaticContact CD2-CE1 3.76Å; F37-H59 AromaticContact CD2-CG 3.38Å; F37-H59 AromaticContact CD2-ND1 3.62Å; F37-H59 AromaticContact CD2-NE2 3.68Å; F37-H59 HydrophobicContact CE2-CB 3.78Å; F37-H59 AromaticContact CE2-CG 3.65Å; F37-H59 AromaticContact CE2-ND1 3.85Å; F37-H59 HydrophobicContact CG-CB 4.44Å; F37-H59 AromaticContact CG-CD2 3.65Å; F37-H59 AromaticContact CG-CG 3.96Å; F37-H59 HydrophobicContact CZ-CB 4.13Å
38	L	90	Very high	86.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.3	-44	177.3	-68.5	172.2	0	0	0	111	I34 Q35 F41 Y42 L51 V56 V79 I86	I34-L38 HydrophobicContact CG2-CD1 3.79Å; I34-L38 HydrophobicContact CG2-CG 4.32Å; I34-L38 WeakPolarHBondContact O-CB 3.43Å; I34-L38 WeakPolarHBondContact O-CG 3.24Å; I34-L38 PolarHBondContact O-N 2.98Å; Q35-L38 PolarHBondContact O-N 2.89Å; Q35-L38 VanDerWaalsContact O-N 3.13Å; L38-F41 PolarHBondContact O-N 3.49Å; L38-Y42 HydrophobicContact CB-CD2 4.3Å; L38-Y42 HydrophobicContact CB-CE2 4.47Å; L38-Y42 HydrophobicContact CD2-CE2 3.99Å; L38-Y42 WeakPolarHBondContact O-CB 3.32Å; L38-Y42 WeakPolarHBondContact O-CD2 3.37Å; L38-Y42 PolarHBondContact O-N 3.42Å; L38-L51 HydrophobicContact CD2-CD2 3.33Å; L38-V56 HydrophobicContact CD2-CG2 4.49Å; L38-V79 HydrophobicContact CD2-CG1 4.26Å; L38-I86 HydrophobicContact CB-CD1 3.56Å; L38-I86 HydrophobicContact CD1-CD1 4.22Å
39	E	87.9	Confident	86.6	Confident	106 Å²	106	49.9 Å²	49.9	50%	0.495	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-50.7	178.5	-171.9	-177.5	161.6	0	0	110.9	Q35 D36 F41 Y42 R43	Q35-E39 WeakPolarHBondContact O-CB 3.19Å; Q35-E39 PolarHBondContact O-N 3.11Å; D36-E39 PolarHBondContact O-N 3.22Å; E39-F41 VanDerWaalsContact C-N 3.29Å; E39-F41 PolarHBondContact O-N 3.46Å; E39-Y42 PolarHBondContact O-N 3.28Å; E39-R43 WeakPolarHBondContact O-CB 2.91Å; E39-R43 PolarHBondContact O-N 2.87Å
40	V	85.9	Confident	86.3	Confident	98 Å²	98	50.5 Å²	50.5	59%	0.594	24%	0.239	S	C	*	.	H	α-helix	trans	-59	-42.1	176.3	171.2	0	0	0	0	111.1	D36 R44	D36-V40 WeakPolarHBondContact O-CB 3.5Å; D36-V40 VanDerWaalsContact O-CG2 3.24Å; D36-V40 WeakPolarHBondContact O-CG2 3.28Å; D36-V40 PolarHBondContact O-N 2.96Å; V40-R44 VanDerWaalsContact O-CB 3.3Å; V40-R44 WeakPolarHBondContact O-CB 3.41Å; V40-R44 PolarHBondContact O-N 3.23Å
41	F	87.3	Confident	86.1	Confident	25 Å²	25	50.7 Å²	50.7	11%	0.11	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-52.9	179.2	-177.7	-85.1	0	0	0	112.2	F37 L38 E39 R44 Y45 I49 L51	F37-F41 VanDerWaalsContact O-CB 3.22Å; F37-F41 WeakPolarHBondContact O-CB 3.34Å; F37-F41 PolarHBondContact O-N 2.72Å; L38-F41 PolarHBondContact O-N 3.49Å; E39-F41 VanDerWaalsContact C-N 3.29Å; E39-F41 PolarHBondContact O-N 3.46Å; F41-R44 PolarHBondContact O-N 3.02Å; F41-Y45 AromaticContact CD2-CD2 3.76Å; F41-Y45 HydrophobicContact CD2-CD2 3.76Å; F41-Y45 HydrophobicContact CD2-CE2 4.3Å; F41-Y45 AromaticContact CE2-CD2 3.64Å; F41-Y45 HydrophobicContact CE2-CD2 3.64Å; F41-Y45 HydrophobicContact CE2-CE2 4.24Å; F41-Y45 HydrophobicContact CE2-CG 4.48Å; F41-Y45 HydrophobicContact CG-CD2 4.32Å; F41-Y45 HydrophobicContact CZ-CD2 4.09Å; F41-Y45 PolarHBondContact O-N 3.42Å; F41-I49 WeakPolarHBondContact CE1-O 3.42Å; F41-I49 HydrophobicContact CZ-CB 4.18Å; F41-I49 HydrophobicContact CZ-CG2 4.02Å; F41-L51 HydrophobicContact CD1-CB 4.01Å; F41-L51 HydrophobicContact CD1-CD1 4.37Å; F41-L51 HydrophobicContact CD1-CD2 4.11Å; F41-L51 HydrophobicContact CD1-CG 4.39Å; F41-L51 HydrophobicContact CD2-CD1 3.77Å; F41-L51 HydrophobicContact CE1-CB 3.64Å; F41-L51 HydrophobicContact CE1-CD1 4.36Å; F41-L51 HydrophobicContact CE1-CG 4.4Å; F41-L51 HydrophobicContact CE2-CB 4.43Å; F41-L51 HydrophobicContact CE2-CD1 3.72Å; F41-L51 HydrophobicContact CG-CD1 4.1Å; F41-L51 HydrophobicContact CG-CD2 4.17Å; F41-L51 HydrophobicContact CZ-CB 3.86Å; F41-L51 HydrophobicContact CZ-CD1 4.03Å; F41-L51 HydrophobicContact CZ-CG 4.49Å
42	Y	85.6	Confident	86	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72	-30.2	-176.1	-77.1	-64.6	0	0	0	112.5	L38 E39 R44 G46 L51 R83 I86 I87	L38-Y42 HydrophobicContact CB-CD2 4.3Å; L38-Y42 HydrophobicContact CB-CE2 4.47Å; L38-Y42 HydrophobicContact CD2-CE2 3.99Å; L38-Y42 WeakPolarHBondContact O-CB 3.32Å; L38-Y42 WeakPolarHBondContact O-CD2 3.37Å; L38-Y42 PolarHBondContact O-N 3.42Å; E39-Y42 PolarHBondContact O-N 3.28Å; Y42-R44 VanDerWaalsContact C-N 3.28Å; Y42-R44 PolarHBondContact O-N 2.96Å; Y42-G46 WeakPolarHBondContact CD1-O 3.24Å; Y42-G46 WeakPolarHBondContact O-CA 3.41Å; Y42-G46 PolarHBondContact O-N 3.31Å; Y42-L51 HydrophobicContact CE2-CD2 4.44Å; Y42-R83 HydrophobicContact CE2-CG 4.09Å; Y42-R83 WeakPolarHBondContact OH-CD 3.21Å; Y42-R83 PolarHBondContact OH-NE 3.4Å; Y42-R83 PolarHBondContact OH-NH2 3.43Å; Y42-I86 HydrophobicContact CD2-CG2 3.88Å; Y42-I86 HydrophobicContact CG-CG2 4.24Å; Y42-I87 HydrophobicContact CD1-CD1 4.41Å; Y42-I87 HydrophobicContact CD1-CG1 3.78Å; Y42-I87 HydrophobicContact CD2-CG1 4.3Å; Y42-I87 HydrophobicContact CE1-CD1 3.8Å; Y42-I87 HydrophobicContact CE1-CG1 3.67Å; Y42-I87 HydrophobicContact CE2-CD1 4.45Å; Y42-I87 HydrophobicContact CE2-CG1 4.18Å; Y42-I87 HydrophobicContact CG-CG1 4.15Å
43	R	83.4	Confident	86	Confident	183 Å²	183	51.9 Å²	51.9	69%	0.691	25%	0.249	S	C	*	.	H	α-helix	trans	-64.1	-34.5	170.5	-176.9	175.7	174.6	-175.9	-2.2	112.2	E39 F94	E39-R43 WeakPolarHBondContact O-CB 2.91Å; E39-R43 PolarHBondContact O-N 2.87Å; R43-F94 WeakPolarHBondContact O-CD2 3.11Å; R43-F94 WeakPolarHBondContact O-CE2 3.18Å
44	R	83.7	Confident	85.7	Confident	68 Å²	68	54.1 Å²	54.1	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-86.9	-44.8	-177.9	-175.9	174.4	-178.8	135.4	1.4	113.6	V40 F41 Y42 C349 D350	V40-R44 VanDerWaalsContact O-CB 3.3Å; V40-R44 WeakPolarHBondContact O-CB 3.41Å; V40-R44 PolarHBondContact O-N 3.23Å; F41-R44 PolarHBondContact O-N 3.02Å; Y42-R44 VanDerWaalsContact C-N 3.28Å; Y42-R44 PolarHBondContact O-N 2.96Å; R44-C349 VanDerWaalsContact O-CB 3.31Å; R44-C349 WeakPolarHBondContact O-CB 3.19Å; R44-C349 PolarHBondContact O-SG 2.87Å; R44-D350 IonicContact CZ-OD1 2.8Å; R44-D350 VanDerWaalsContact CZ-OD1 3.23Å; R44-D350 IonicContact NE-OD1 2.6Å; R44-D350 PolarHBondContact NE-OD1 3.27Å; R44-D350 IonicContact NH2-OD1 3.74Å; R44-D350 PolarHBondContact NH2-OD1 3.12Å
45	Y	83.8	Confident	85.6	Confident	34 Å²	34	56 Å²	56	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-114.4	2.8	-169.2	-61.8	-61.2	0	0	0	114.1	F41 I49 Y345 K346 C349 D350	F41-Y45 AromaticContact CD2-CD2 3.76Å; F41-Y45 HydrophobicContact CD2-CD2 3.76Å; F41-Y45 HydrophobicContact CD2-CE2 4.3Å; F41-Y45 AromaticContact CE2-CD2 3.64Å; F41-Y45 HydrophobicContact CE2-CD2 3.64Å; F41-Y45 HydrophobicContact CE2-CE2 4.24Å; F41-Y45 HydrophobicContact CE2-CG 4.48Å; F41-Y45 HydrophobicContact CG-CD2 4.32Å; F41-Y45 HydrophobicContact CZ-CD2 4.09Å; F41-Y45 PolarHBondContact O-N 3.42Å; Y45-I49 HydrophobicContact CD1-CD1 3.54Å; Y45-I49 HydrophobicContact CE1-CD1 4.18Å; Y45-I49 HydrophobicContact CG-CD1 3.89Å; Y45-Y345 VanDerWaalsContact O-CE1 3.31Å; Y45-Y345 WeakPolarHBondContact O-CE1 3.46Å; Y45-Y345 PolarHBondContact O-OH 2.66Å; Y45-K346 HydrophobicContact CE1-CG 3.92Å; Y45-C349 HydrophobicContact CD1-CB 3.65Å; Y45-C349 HydrophobicContact CE1-CB 4Å; Y45-D350 WeakPolarHBondContact CE1-OD1 3.47Å; Y45-D350 VanDerWaalsContact CZ-OD1 3.27Å; Y45-D350 PolarHBondContact OH-OD1 3.48Å
46	G	83.2	Confident	85.6	Confident	1 Å²	1	53 Å²	53	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	-156.3	-175	0	0	0	0	0	112.1	Y42	Y42-G46 WeakPolarHBondContact CD1-O 3.24Å; Y42-G46 WeakPolarHBondContact O-CA 3.41Å; Y42-G46 PolarHBondContact O-N 3.31Å
47	S	81.1	Confident	85.5	Confident	49 Å²	49	50.3 Å²	50.3	34%	0.343	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.7	178.3	58.3	0	0	0	0	114
48	F	77.4	Confident	85.4	Confident	38 Å²	38	53.8 Å²	53.8	17%	0.167	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-43.3	-172.7	-177.9	-105.2	0	0	0	113	P50 L109 A112 K342 Y345	F48-P50 WeakPolarHBondContact O-CD 3.45Å; F48-L109 HydrophobicContact CD2-CD2 4.26Å; F48-A112 HydrophobicContact CD2-CB 3.83Å; F48-A112 HydrophobicContact CE2-CB 3.23Å; F48-A112 HydrophobicContact CZ-CB 4.12Å; F48-K342 HydrophobicContact CE1-CG 4.35Å; F48-Y345 HydrophobicContact CB-CD2 4.09Å; F48-Y345 HydrophobicContact CB-CE1 3.96Å; F48-Y345 HydrophobicContact CB-CE2 3.39Å; F48-Y345 AromaticContact CD1-CD1 3.57Å; F48-Y345 HydrophobicContact CD1-CD1 3.57Å; F48-Y345 AromaticContact CD1-CD2 3.14Å; F48-Y345 HydrophobicContact CD1-CD2 3.14Å; F48-Y345 AromaticContact CD1-CE1 3.87Å; F48-Y345 HydrophobicContact CD1-CE1 3.87Å; F48-Y345 AromaticContact CD1-CE2 3.42Å; F48-Y345 HydrophobicContact CD1-CE2 3.42Å; F48-Y345 VanDerWaalsContact CD1-CE2 3.42Å; F48-Y345 AromaticContact CD1-CG 3.23Å; F48-Y345 HydrophobicContact CD1-CG 3.23Å; F48-Y345 AromaticContact CD1-CZ 3.84Å; F48-Y345 HydrophobicContact CE1-CD1 4.3Å; F48-Y345 AromaticContact CE1-CD2 3.63Å; F48-Y345 HydrophobicContact CE1-CD2 3.63Å; F48-Y345 HydrophobicContact CE1-CE2 4.32Å; F48-Y345 AromaticContact CE1-CG 3.62Å; F48-Y345 HydrophobicContact CE1-CG 3.62Å; F48-Y345 HydrophobicContact CG-CD1 4.46Å; F48-Y345 AromaticContact CG-CD2 3.69Å; F48-Y345 HydrophobicContact CG-CD2 3.69Å; F48-Y345 HydrophobicContact CG-CE1 4.35Å; F48-Y345 AromaticContact CG-CE2 3.5Å; F48-Y345 HydrophobicContact CG-CE2 3.5Å; F48-Y345 VanDerWaalsContact CG-CE2 3.5Å; F48-Y345 HydrophobicContact CG-CG 4.18Å; F48-Y345 AromaticContact CG-CZ 3.93Å
49	I	78.9	Confident	85.3	Confident	36 Å²	36	56.1 Å²	56.1	19%	0.185	27%	0.271	C	S	.	.	S	Bend	trans	-79.1	117	173.6	-56.8	-172.2	0	0	0	108.2	F41 Y45 L51 Y345 K346	F41-I49 WeakPolarHBondContact CE1-O 3.42Å; F41-I49 HydrophobicContact CZ-CB 4.18Å; F41-I49 HydrophobicContact CZ-CG2 4.02Å; Y45-I49 HydrophobicContact CD1-CD1 3.54Å; Y45-I49 HydrophobicContact CE1-CD1 4.18Å; Y45-I49 HydrophobicContact CG-CD1 3.89Å; I49-L51 PolarHBondContact O-N 3.05Å; I49-L51 VanDerWaalsContact O-N 3.14Å; I49-Y345 HydrophobicContact CD1-CD1 3.87Å; I49-Y345 HydrophobicContact CD1-CE1 4.14Å; I49-Y345 HydrophobicContact CG1-CD1 3.7Å; I49-Y345 HydrophobicContact CG1-CE1 3.8Å; I49-K346 HydrophobicContact CD1-CB 3.86Å; I49-K346 HydrophobicContact CD1-CG 4.04Å
50	P	80.6	Confident	85.4	Confident	65 Å²	65	51.1 Å²	51.1	42%	0.422	25%	0.247	S	C	.	.			trans	-68.5	117.8	-179.6	27.4	-32.9	0	0	0	109.9	F48 H52	F48-P50 WeakPolarHBondContact O-CD 3.45Å; P50-H52 PolarHBondContact O-N 3.35Å
51	L	84.2	Confident	85.5	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.042	24%	0.242	C	C	.	.			trans	-77.6	115.9	168	-175.1	64	0	0	0	109.8	F37 L38 F41 Y42 I49 D55 V56 R83	F37-L51 HydrophobicContact CE1-CD1 3.85Å; F37-L51 HydrophobicContact CE1-CD2 3.99Å; F37-L51 HydrophobicContact CE1-CG 4.5Å; F37-L51 HydrophobicContact CZ-CD1 4.16Å; L38-L51 HydrophobicContact CD2-CD2 3.33Å; F41-L51 HydrophobicContact CD1-CB 4.01Å; F41-L51 HydrophobicContact CD1-CD1 4.37Å; F41-L51 HydrophobicContact CD1-CD2 4.11Å; F41-L51 HydrophobicContact CD1-CG 4.39Å; F41-L51 HydrophobicContact CD2-CD1 3.77Å; F41-L51 HydrophobicContact CE1-CB 3.64Å; F41-L51 HydrophobicContact CE1-CD1 4.36Å; F41-L51 HydrophobicContact CE1-CG 4.4Å; F41-L51 HydrophobicContact CE2-CB 4.43Å; F41-L51 HydrophobicContact CE2-CD1 3.72Å; F41-L51 HydrophobicContact CG-CD1 4.1Å; F41-L51 HydrophobicContact CG-CD2 4.17Å; F41-L51 HydrophobicContact CZ-CB 3.86Å; F41-L51 HydrophobicContact CZ-CD1 4.03Å; F41-L51 HydrophobicContact CZ-CG 4.49Å; Y42-L51 HydrophobicContact CE2-CD2 4.44Å; I49-L51 PolarHBondContact O-N 3.05Å; I49-L51 VanDerWaalsContact O-N 3.14Å; L51-D55 HydrophobicContact CD1-CB 3.81Å; L51-V56 HydrophobicContact CD2-CG2 4.06Å; L51-V56 HydrophobicContact CG-CG2 4.4Å; L51-R83 PolarHBondContact O-NH1 3.43Å
52	H	87.3	Confident	85.4	Confident	118 Å²	118	59.8 Å²	59.8	55%	0.546	27%	0.272	S	S	.	.			trans	-81.4	142.2	172.2	-69.6	-88.3	0	0	0	109.9	P50 S54 D55	P50-H52 PolarHBondContact O-N 3.35Å; H52-S54 PolarHBondContact O-N 2.84Å; H52-D55 WeakPolarHBondContact CB-OD2 3.23Å; H52-D55 PolarHBondContact N-OD2 3.4Å; H52-D55 VanDerWaalsContact N-OD2 3.1Å; H52-D55 VanDerWaalsContact O-CB 3.31Å; H52-D55 WeakPolarHBondContact O-CB 3.42Å; H52-D55 PolarHBondContact O-N 3.45Å
53	K	89.3	Confident	85.5	Confident	62 Å²	62	65.5 Å²	65.5	27%	0.27	30%	0.296	S	S	.	.	H	α-helix	trans	-58.6	-25.3	175.1	-52.1	-175.7	177.7	-177.5	0	112.4	D55 V56 L57 F76 V79 D80	K53-D55 VanDerWaalsContact C-N 3.29Å; K53-D55 PolarHBondContact O-N 2.96Å; K53-V56 PolarHBondContact O-N 3.44Å; K53-L57 PolarHBondContact O-N 2.7Å; K53-L57 VanDerWaalsContact O-N 3.12Å; K53-F76 HydrophobicContact CB-CD1 3.5Å; K53-F76 HydrophobicContact CB-CD2 4.48Å; K53-F76 HydrophobicContact CB-CE1 3.26Å; K53-F76 HydrophobicContact CB-CE2 4.3Å; K53-F76 HydrophobicContact CB-CG 4.11Å; K53-F76 HydrophobicContact CB-CZ 3.7Å; K53-F76 HydrophobicContact CD-CB 3.75Å; K53-F76 HydrophobicContact CD-CD1 3.78Å; K53-F76 HydrophobicContact CD-CD2 3.8Å; K53-F76 HydrophobicContact CD-CE1 4.26Å; K53-F76 HydrophobicContact CD-CE2 4.29Å; K53-F76 HydrophobicContact CD-CG 3.5Å; K53-F76 HydrophobicContact CD-CZ 4.5Å; K53-F76 HydrophobicContact CG-CD1 4.19Å; K53-F76 HydrophobicContact CG-CE1 4.36Å; K53-F76 HydrophobicContact CG-CG 4.41Å; K53-V79 HydrophobicContact CG-CG1 4.47Å; K53-D80 WeakPolarHBondContact CE-OD1 3.17Å; K53-D80 IonicContact NZ-OD1 3.25Å; K53-D80 PolarHBondContact NZ-OD1 3.16Å; K53-D80 IonicContact NZ-OD2 3.15Å; K53-D80 PolarHBondContact NZ-OD2 3.48Å
54	S	87.9	Confident	85.6	Confident	61 Å²	61	60 Å²	60	43%	0.427	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-28.1	172.8	76.6	0	0	0	0	113.9	H52 L57 R58	H52-S54 PolarHBondContact O-N 2.84Å; S54-L57 PolarHBondContact O-N 3.32Å; S54-R58 WeakPolarHBondContact O-CB 3.43Å; S54-R58 PolarHBondContact O-N 3.26Å
55	D	89.1	Confident	85.8	Confident	40 Å²	40	64 Å²	64	21%	0.214	30%	0.304	C	S	.	.	H	α-helix	trans	-71.3	-40.3	175.9	-58.7	-45.9	0	0	0	110.6	L51 H52 K53 R58 H59	L51-D55 HydrophobicContact CD1-CB 3.81Å; H52-D55 WeakPolarHBondContact CB-OD2 3.23Å; H52-D55 PolarHBondContact N-OD2 3.4Å; H52-D55 VanDerWaalsContact N-OD2 3.1Å; H52-D55 VanDerWaalsContact O-CB 3.31Å; H52-D55 WeakPolarHBondContact O-CB 3.42Å; H52-D55 PolarHBondContact O-N 3.45Å; K53-D55 VanDerWaalsContact C-N 3.29Å; K53-D55 PolarHBondContact O-N 2.96Å; D55-R58 PolarHBondContact O-N 2.98Å; D55-R58 IonicContact OD1-CZ 3.01Å; D55-R58 IonicContact OD1-NH1 3.62Å; D55-R58 PolarHBondContact OD1-NH1 2.65Å; D55-R58 IonicContact OD1-NH2 3.45Å; D55-R58 PolarHBondContact OD1-NH2 3.45Å; D55-H59 WeakPolarHBondContact O-CB 3.49Å; D55-H59 PolarHBondContact O-N 3.21Å
56	V	89.8	Confident	85.8	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-47.6	172	-175.2	0	0	0	0	110.2	I34 F37 L38 L51 K53 R58 H59 L60 I75 V79	I34-V56 HydrophobicContact CG1-CG1 4.24Å; F37-V56 HydrophobicContact CD1-CB 4.5Å; F37-V56 HydrophobicContact CD1-CG1 4.47Å; F37-V56 HydrophobicContact CD1-CG2 3.99Å; F37-V56 HydrophobicContact CE1-CB 4.36Å; F37-V56 HydrophobicContact CE1-CG2 3.78Å; L38-V56 HydrophobicContact CD2-CG2 4.49Å; L51-V56 HydrophobicContact CD2-CG2 4.06Å; L51-V56 HydrophobicContact CG-CG2 4.4Å; K53-V56 PolarHBondContact O-N 3.44Å; V56-R58 VanDerWaalsContact C-N 3.3Å; V56-R58 PolarHBondContact O-N 2.95Å; V56-H59 WeakPolarHBondContact O-CB 3.38Å; V56-H59 PolarHBondContact O-N 3.4Å; V56-L60 HydrophobicContact CG1-CD1 4Å; V56-L60 HydrophobicContact CG1-CG 4.34Å; V56-L60 VanDerWaalsContact O-CG 3.25Å; V56-L60 WeakPolarHBondContact O-CG 3.35Å; V56-L60 PolarHBondContact O-N 3.49Å; V56-I75 HydrophobicContact CG1-CG2 4.34Å; V56-V79 HydrophobicContact CB-CG2 4.25Å; V56-V79 HydrophobicContact CG1-CG2 3.86Å; V56-V79 HydrophobicContact CG2-CG2 3.99Å
57	L	88.4	Confident	85.9	Confident	24 Å²	24	70 Å²	70	13%	0.126	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-41.1	176.3	-70.6	173.7	0	0	0	112.4	K53 S54 H59 L60 K61 F68 K72 I75 F76	K53-L57 PolarHBondContact O-N 2.7Å; K53-L57 VanDerWaalsContact O-N 3.12Å; S54-L57 PolarHBondContact O-N 3.32Å; L57-H59 VanDerWaalsContact C-N 3.35Å; L57-L60 PolarHBondContact O-N 3.04Å; L57-K61 VanDerWaalsContact O-CB 3.27Å; L57-K61 WeakPolarHBondContact O-CB 3.43Å; L57-K61 PolarHBondContact O-N 3.45Å; L57-F68 HydrophobicContact CD2-CB 4.23Å; L57-K72 HydrophobicContact CD1-CD 4.26Å; L57-K72 HydrophobicContact CD1-CG 3.87Å; L57-K72 HydrophobicContact CD2-CG 4.26Å; L57-I75 HydrophobicContact CD2-CB 4.36Å; L57-I75 HydrophobicContact CD2-CD1 3.7Å; L57-I75 HydrophobicContact CD2-CG2 4.04Å; L57-F76 HydrophobicContact CD1-CE1 3.46Å; L57-F76 VanDerWaalsContact CD1-CE1 3.46Å; L57-F76 HydrophobicContact CD1-CZ 3.59Å; L57-F76 HydrophobicContact CD2-CE1 4.3Å; L57-F76 HydrophobicContact CG-CE1 3.75Å; L57-F76 HydrophobicContact CG-CZ 4.39Å
58	R	88.6	Confident	86.2	Confident	114 Å²	114	68.7 Å²	68.7	43%	0.43	33%	0.331	S	S	.	.	H	α-helix	trans	-64.6	-41.3	178	-166.1	-174	-55.3	118.4	6	111.2	S54 D55 V56 R62	S54-R58 WeakPolarHBondContact O-CB 3.43Å; S54-R58 PolarHBondContact O-N 3.26Å; D55-R58 PolarHBondContact O-N 2.98Å; D55-R58 IonicContact OD1-CZ 3.01Å; D55-R58 IonicContact OD1-NH1 3.62Å; D55-R58 PolarHBondContact OD1-NH1 2.65Å; D55-R58 IonicContact OD1-NH2 3.45Å; D55-R58 PolarHBondContact OD1-NH2 3.45Å; V56-R58 VanDerWaalsContact C-N 3.3Å; V56-R58 PolarHBondContact O-N 2.95Å; R58-R62 VanDerWaalsContact O-CG 3.27Å; R58-R62 WeakPolarHBondContact O-CG 3.46Å; R58-R62 PolarHBondContact O-N 2.8Å; R58-R62 VanDerWaalsContact O-N 3.1Å
59	H	87.9	Confident	86.5	Confident	49 Å²	49	69.2 Å²	69.2	23%	0.227	34%	0.339	C	S	.	.	H	α-helix	trans	-60.7	-52.5	174.7	176.3	68.8	0	0	0	111.5	E33 F37 D55 V56 L57 K61 R62 K63	E33-H59 IonicContact OE1-CD2 2.73Å; E33-H59 IonicContact OE1-CE1 3.5Å; E33-H59 IonicContact OE1-NE2 2.66Å; E33-H59 PolarHBondContact OE1-NE2 2.83Å; F37-H59 HydrophobicContact CD2-CB 3.96Å; F37-H59 AromaticContact CD2-CD2 3.45Å; F37-H59 VanDerWaalsContact CD2-CD2 3.45Å; F37-H59 WeakPolarHBondContact CD2-CD2 3.36Å; F37-H59 AromaticContact CD2-CE1 3.76Å; F37-H59 AromaticContact CD2-CG 3.38Å; F37-H59 AromaticContact CD2-ND1 3.62Å; F37-H59 AromaticContact CD2-NE2 3.68Å; F37-H59 HydrophobicContact CE2-CB 3.78Å; F37-H59 AromaticContact CE2-CG 3.65Å; F37-H59 AromaticContact CE2-ND1 3.85Å; F37-H59 HydrophobicContact CG-CB 4.44Å; F37-H59 AromaticContact CG-CD2 3.65Å; F37-H59 AromaticContact CG-CG 3.96Å; F37-H59 HydrophobicContact CZ-CB 4.13Å; D55-H59 WeakPolarHBondContact O-CB 3.49Å; D55-H59 PolarHBondContact O-N 3.21Å; V56-H59 WeakPolarHBondContact O-CB 3.38Å; V56-H59 PolarHBondContact O-N 3.4Å; L57-H59 VanDerWaalsContact C-N 3.35Å; H59-K61 PolarHBondContact O-N 3.43Å; H59-R62 WeakPolarHBondContact O-CB 3.47Å; H59-R62 PolarHBondContact O-N 3.29Å; H59-R62 VanDerWaalsContact O-N 3.12Å; H59-K63 PolarHBondContact O-N 2.95Å
60	L	89.3	Confident	86.8	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-59.8	-45.6	179.1	-66.2	174	0	0	0	112	L30 E33 I34 V56 L57 R62 K63 F64 F68 I75	L30-L60 HydrophobicContact CD1-CD1 3.92Å; L30-L60 HydrophobicContact CD1-CD2 3.8Å; L30-L60 HydrophobicContact CD1-CG 4.36Å; E33-L60 HydrophobicContact CB-CD2 3.99Å; E33-L60 HydrophobicContact CG-CD2 3.54Å; I34-L60 HydrophobicContact CD1-CD1 4.28Å; I34-L60 HydrophobicContact CG1-CD1 3.98Å; I34-L60 HydrophobicContact CG1-CD2 4.28Å; V56-L60 HydrophobicContact CG1-CD1 4Å; V56-L60 HydrophobicContact CG1-CG 4.34Å; V56-L60 VanDerWaalsContact O-CG 3.25Å; V56-L60 WeakPolarHBondContact O-CG 3.35Å; V56-L60 PolarHBondContact O-N 3.49Å; L57-L60 PolarHBondContact O-N 3.04Å; L60-R62 VanDerWaalsContact C-N 3.27Å; L60-R62 PolarHBondContact O-N 2.9Å; L60-K63 PolarHBondContact O-N 3.33Å; L60-F64 HydrophobicContact CD2-CD2 4.32Å; L60-F64 HydrophobicContact CD2-CE2 3.91Å; L60-F64 WeakPolarHBondContact O-CD2 3.38Å; L60-F64 PolarHBondContact O-N 2.97Å; L60-F68 HydrophobicContact CB-CD2 4.04Å; L60-F68 HydrophobicContact CB-CE2 3.85Å; L60-F68 HydrophobicContact CB-CZ 4.36Å; L60-F68 WeakPolarHBondContact O-CE2 3.37Å; L60-I75 HydrophobicContact CD1-CD1 3.97Å; L60-I75 HydrophobicContact CD1-CG1 4.38Å; L60-I75 HydrophobicContact CD1-CG2 3.94Å
61	K	88.6	Confident	87.1	Confident	113 Å²	113	76.4 Å²	76.4	49%	0.491	37%	0.368	S	S	.	.	H	α-helix	trans	-57.3	-41.4	176.1	177.9	166.8	-174.4	166.1	0	112	L57 H59 N65 S66	L57-K61 VanDerWaalsContact O-CB 3.27Å; L57-K61 WeakPolarHBondContact O-CB 3.43Å; L57-K61 PolarHBondContact O-N 3.45Å; H59-K61 PolarHBondContact O-N 3.43Å; K61-N65 WeakPolarHBondContact O-CA 3.29Å; K61-N65 PolarHBondContact O-N 2.83Å; K61-S66 WeakPolarHBondContact CA-O 2.95Å; K61-S66 WeakPolarHBondContact CG-O 3.43Å; K61-S66 PolarHBondContact O-N 2.75Å
62	R	85.7	Confident	87.4	Confident	192 Å²	192	80.5 Å²	80.5	73%	0.725	39%	0.386	S	S	*	.	H	α-helix	trans	-68.1	-44.2	177	-74.5	171.8	178.9	175	-1.9	111.9	R58 H59 L60	R58-R62 VanDerWaalsContact O-CG 3.27Å; R58-R62 WeakPolarHBondContact O-CG 3.46Å; R58-R62 PolarHBondContact O-N 2.8Å; R58-R62 VanDerWaalsContact O-N 3.1Å; H59-R62 WeakPolarHBondContact O-CB 3.47Å; H59-R62 PolarHBondContact O-N 3.29Å; H59-R62 VanDerWaalsContact O-N 3.12Å; L60-R62 VanDerWaalsContact C-N 3.27Å; L60-R62 PolarHBondContact O-N 2.9Å
63	K	86.7	Confident	87.5	Confident	120 Å²	120	79.6 Å²	79.6	52%	0.522	39%	0.392	S	S	.	.	H	α-helix	trans	-71.7	-40.7	-174.9	-169.1	167.2	-175.4	161.2	0	113.3	E33 H59 L60	E33-K63 VanDerWaalsContact CD-CE 3.44Å; E33-K63 HydrophobicContact CG-CD 3.89Å; E33-K63 WeakPolarHBondContact OE1-CD 3.46Å; E33-K63 WeakPolarHBondContact OE1-CE 3.24Å; E33-K63 IonicContact OE1-NZ 2.67Å; E33-K63 PolarHBondContact OE1-NZ 2.97Å; E33-K63 WeakPolarHBondContact OE2-CD 3.48Å; E33-K63 WeakPolarHBondContact OE2-CE 3.38Å; E33-K63 IonicContact OE2-NZ 3.94Å; E33-K63 PolarHBondContact OE2-NZ 3.12Å; H59-K63 PolarHBondContact O-N 2.95Å; L60-K63 PolarHBondContact O-N 3.33Å
64	F	87.2	Confident	87.5	Confident	69 Å²	69	80.1 Å²	80.1	30%	0.303	40%	0.401	S	S	.	.	H	α-helix	trans	-97.8	-0.3	-178.5	-64.1	-76.3	0	0	0	113.5	T29 L30 E33 L60 S66 F68	T29-F64 HydrophobicContact CG2-CE1 4.06Å; T29-F64 HydrophobicContact CG2-CZ 4.14Å; L30-F64 HydrophobicContact CD1-CE2 4.23Å; E33-F64 HydrophobicContact CB-CE2 4.08Å; E33-F64 HydrophobicContact CB-CZ 4.17Å; E33-F64 HydrophobicContact CG-CE2 3.91Å; E33-F64 HydrophobicContact CG-CZ 4.3Å; L60-F64 HydrophobicContact CD2-CD2 4.32Å; L60-F64 HydrophobicContact CD2-CE2 3.91Å; L60-F64 WeakPolarHBondContact O-CD2 3.38Å; L60-F64 PolarHBondContact O-N 2.97Å; F64-S66 PolarHBondContact O-N 3.4Å; F64-S66 VanDerWaalsContact O-N 3.08Å; F64-S66 PolarHBondContact O-OG 2.78Å; F64-F68 HydrophobicContact CB-CE2 4.1Å; F64-F68 HydrophobicContact CB-CZ 3.88Å; F64-F68 HydrophobicContact CD2-CE2 4.27Å; F64-F68 AromaticContact CD2-CZ 3.83Å; F64-F68 HydrophobicContact CD2-CZ 3.83Å; F64-F68 HydrophobicContact CG-CZ 4.09Å
65	N	86	Confident	87.6	Confident	151 Å²	151	77.2 Å²	77.2	81%	0.807	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	38.4	-174.7	-167.2	41.1	0	0	0	113.1	K61	K61-N65 WeakPolarHBondContact O-CA 3.29Å; K61-N65 PolarHBondContact O-N 2.83Å
66	S	85.3	Confident	87.8	Confident	58 Å²	58	78.1 Å²	78.1	41%	0.406	38%	0.383	S	S	.	.			trans	-134.3	148.6	-168.2	-65	0	0	0	0	110.7	K61 F64 F68	K61-S66 WeakPolarHBondContact CA-O 2.95Å; K61-S66 WeakPolarHBondContact CG-O 3.43Å; K61-S66 PolarHBondContact O-N 2.75Å; F64-S66 PolarHBondContact O-N 3.4Å; F64-S66 VanDerWaalsContact O-N 3.08Å; F64-S66 PolarHBondContact O-OG 2.78Å; S66-F68 VanDerWaalsContact O-CD2 3.31Å; S66-F68 WeakPolarHBondContact O-CD2 3.14Å; S66-F68 WeakPolarHBondContact O-CE2 3.23Å
67	D	84.6	Confident	87.9	Confident	104 Å²	104	81.9 Å²	81.9	56%	0.556	41%	0.409	S	S	*	.			trans	-84.4	136.9	173	-165.2	31.6	0	0	0	111.4	S69	D67-S69 VanDerWaalsContact CG-OG 3.31Å; D67-S69 PolarHBondContact OD1-OG 3.12Å; D67-S69 VanDerWaalsContact OD2-CB 3.29Å; D67-S69 WeakPolarHBondContact OD2-CB 3.5Å; D67-S69 PolarHBondContact OD2-OG 2.96Å
68	F	86.4	Confident	87.9	Confident	20 Å²	20	82.8 Å²	82.8	9%	0.088	41%	0.412	C	S	.	.			trans	-116.8	17.7	-176.8	-69.3	-82.5	0	0	0	112.1	L30 L57 L60 F64 S66 D70 R71 K72 I75	L30-F68 HydrophobicContact CD1-CE1 3.82Å; L30-F68 HydrophobicContact CD1-CZ 4.19Å; L30-F68 HydrophobicContact CD2-CE1 4.47Å; L57-F68 HydrophobicContact CD2-CB 4.23Å; L60-F68 HydrophobicContact CB-CD2 4.04Å; L60-F68 HydrophobicContact CB-CE2 3.85Å; L60-F68 HydrophobicContact CB-CZ 4.36Å; L60-F68 WeakPolarHBondContact O-CE2 3.37Å; F64-F68 HydrophobicContact CB-CE2 4.1Å; F64-F68 HydrophobicContact CB-CZ 3.88Å; F64-F68 HydrophobicContact CD2-CE2 4.27Å; F64-F68 AromaticContact CD2-CZ 3.83Å; F64-F68 HydrophobicContact CD2-CZ 3.83Å; F64-F68 HydrophobicContact CG-CZ 4.09Å; S66-F68 VanDerWaalsContact O-CD2 3.31Å; S66-F68 WeakPolarHBondContact O-CD2 3.14Å; S66-F68 WeakPolarHBondContact O-CE2 3.23Å; F68-D70 VanDerWaalsContact C-N 3.27Å; F68-D70 PolarHBondContact O-N 3.12Å; F68-R71 PolarHBondContact O-N 3.04Å; F68-K72 PolarHBondContact O-N 3.05Å; F68-I75 HydrophobicContact CB-CD1 3.8Å; F68-I75 HydrophobicContact CD1-CD1 3.88Å; F68-I75 HydrophobicContact CG-CD1 4.05Å
69	S	84.8	Confident	88.1	Confident	49 Å²	49	77.5 Å²	77.5	34%	0.343	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-54.2	-41.9	-177.7	-66.4	0	0	0	0	112.8	D67 R71 K72	D67-S69 VanDerWaalsContact CG-OG 3.31Å; D67-S69 PolarHBondContact OD1-OG 3.12Å; D67-S69 VanDerWaalsContact OD2-CB 3.29Å; D67-S69 WeakPolarHBondContact OD2-CB 3.5Å; D67-S69 PolarHBondContact OD2-OG 2.96Å; S69-R71 VanDerWaalsContact C-N 3.28Å; S69-R71 PolarHBondContact O-N 2.93Å; S69-K72 WeakPolarHBondContact O-CG 3.29Å
70	D	85.7	Confident	88.2	Confident	163 Å²	163	78.6 Å²	78.6	87%	0.872	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-75.5	-17	-178.1	-54.1	-34.2	0	0	0	113.4	F68	F68-D70 VanDerWaalsContact C-N 3.27Å; F68-D70 PolarHBondContact O-N 3.12Å
71	R	86.1	Confident	88.1	Confident	90 Å²	90	85.7 Å²	85.7	34%	0.34	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-109.9	9.5	-175.7	-61.9	-179.9	70	-175.8	5.1	113.4	F68 S69 S73 T74 I75	F68-R71 PolarHBondContact O-N 3.04Å; S69-R71 VanDerWaalsContact C-N 3.28Å; S69-R71 PolarHBondContact O-N 2.93Å; R71-S73 VanDerWaalsContact C-N 3.33Å; R71-S73 PolarHBondContact O-N 3.26Å; R71-T74 PolarHBondContact O-N 2.91Å; R71-I75 HydrophobicContact CB-CD1 4.27Å; R71-I75 WeakPolarHBondContact O-CG1 3.48Å; R71-I75 PolarHBondContact O-N 3.07Å
72	K	90.6	Very high	88	Confident	94 Å²	94	82.5 Å²	82.5	41%	0.409	42%	0.416	S	S	.	.	H	α-helix	trans	-52.3	-48	-177.9	-77.4	179.6	176.4	165.4	0	112.9	L57 F68 S69 T74 I75 F76	L57-K72 HydrophobicContact CD1-CD 4.26Å; L57-K72 HydrophobicContact CD1-CG 3.87Å; L57-K72 HydrophobicContact CD2-CG 4.26Å; F68-K72 PolarHBondContact O-N 3.05Å; S69-K72 WeakPolarHBondContact O-CG 3.29Å; K72-T74 PolarHBondContact O-N 3.47Å; K72-I75 PolarHBondContact O-N 3.11Å; K72-F76 WeakPolarHBondContact O-CB 3.33Å; K72-F76 WeakPolarHBondContact O-CD1 3.47Å; K72-F76 WeakPolarHBondContact O-CG 3.45Å; K72-F76 PolarHBondContact O-N 3.39Å
73	S	90.3	Very high	88	Confident	98 Å²	98	76.8 Å²	76.8	69%	0.685	39%	0.394	S	S	*	.	H	α-helix	trans	-59.8	-48	-178.1	-176.4	0	0	0	0	111.7	R71 I75 F76 S77	R71-S73 VanDerWaalsContact C-N 3.33Å; R71-S73 PolarHBondContact O-N 3.26Å; S73-I75 PolarHBondContact O-N 3.05Å; S73-F76 PolarHBondContact O-N 2.95Å; S73-S77 PolarHBondContact O-N 2.79Å
74	T	89.4	Confident	87.6	Confident	73 Å²	73	75.8 Å²	75.8	45%	0.448	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-43	177.8	-48.7	0	0	0	0	112.1	R71 K72 K78	R71-T74 PolarHBondContact O-N 2.91Å; K72-T74 PolarHBondContact O-N 3.47Å; T74-K78 WeakPolarHBondContact O-CG 3.21Å; T74-K78 PolarHBondContact O-N 3.43Å; T74-K78 VanDerWaalsContact O-N 3.1Å
75	I	90.1	Very high	87.3	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-63.6	-45.6	177.5	-68.7	166.7	0	0	0	110.2	L30 I34 V56 L57 L60 F68 R71 K72 S73 S77 K78 V79	L30-I75 HydrophobicContact CD2-CG1 4.23Å; I34-I75 HydrophobicContact CD1-CG1 4.44Å; I34-I75 HydrophobicContact CD1-CG2 4.02Å; V56-I75 HydrophobicContact CG1-CG2 4.34Å; L57-I75 HydrophobicContact CD2-CB 4.36Å; L57-I75 HydrophobicContact CD2-CD1 3.7Å; L57-I75 HydrophobicContact CD2-CG2 4.04Å; L60-I75 HydrophobicContact CD1-CD1 3.97Å; L60-I75 HydrophobicContact CD1-CG1 4.38Å; L60-I75 HydrophobicContact CD1-CG2 3.94Å; F68-I75 HydrophobicContact CB-CD1 3.8Å; F68-I75 HydrophobicContact CD1-CD1 3.88Å; F68-I75 HydrophobicContact CG-CD1 4.05Å; R71-I75 HydrophobicContact CB-CD1 4.27Å; R71-I75 WeakPolarHBondContact O-CG1 3.48Å; R71-I75 PolarHBondContact O-N 3.07Å; K72-I75 PolarHBondContact O-N 3.11Å; S73-I75 PolarHBondContact O-N 3.05Å; I75-S77 PolarHBondContact O-N 2.78Å; I75-K78 PolarHBondContact O-N 3.39Å; I75-V79 HydrophobicContact CG2-CG2 4.34Å; I75-V79 WeakPolarHBondContact O-CG2 3.34Å; I75-V79 PolarHBondContact O-N 2.83Å
76	F	93.1	Very high	87	Confident	60 Å²	60	69.4 Å²	69.4	26%	0.263	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-40.9	-178.9	-72	1	0	0	0	112.2	K53 L57 K72 S73 V79 D80	K53-F76 HydrophobicContact CB-CD1 3.5Å; K53-F76 HydrophobicContact CB-CD2 4.48Å; K53-F76 HydrophobicContact CB-CE1 3.26Å; K53-F76 HydrophobicContact CB-CE2 4.3Å; K53-F76 HydrophobicContact CB-CG 4.11Å; K53-F76 HydrophobicContact CB-CZ 3.7Å; K53-F76 HydrophobicContact CD-CB 3.75Å; K53-F76 HydrophobicContact CD-CD1 3.78Å; K53-F76 HydrophobicContact CD-CD2 3.8Å; K53-F76 HydrophobicContact CD-CE1 4.26Å; K53-F76 HydrophobicContact CD-CE2 4.29Å; K53-F76 HydrophobicContact CD-CG 3.5Å; K53-F76 HydrophobicContact CD-CZ 4.5Å; K53-F76 HydrophobicContact CG-CD1 4.19Å; K53-F76 HydrophobicContact CG-CE1 4.36Å; K53-F76 HydrophobicContact CG-CG 4.41Å; L57-F76 HydrophobicContact CD1-CE1 3.46Å; L57-F76 VanDerWaalsContact CD1-CE1 3.46Å; L57-F76 HydrophobicContact CD1-CZ 3.59Å; L57-F76 HydrophobicContact CD2-CE1 4.3Å; L57-F76 HydrophobicContact CG-CE1 3.75Å; L57-F76 HydrophobicContact CG-CZ 4.39Å; K72-F76 WeakPolarHBondContact O-CB 3.33Å; K72-F76 WeakPolarHBondContact O-CD1 3.47Å; K72-F76 WeakPolarHBondContact O-CG 3.45Å; K72-F76 PolarHBondContact O-N 3.39Å; S73-F76 PolarHBondContact O-N 2.95Å; F76-V79 PolarHBondContact O-N 2.82Å; F76-D80 PolarHBondContact O-N 3.32Å
77	S	90.2	Very high	86.6	Confident	78 Å²	78	68.6 Å²	68.6	55%	0.545	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-41.8	174.1	176.4	0	0	0	0	112.1	S73 I75 D80 K81	S73-S77 PolarHBondContact O-N 2.79Å; I75-S77 PolarHBondContact O-N 2.78Å; S77-D80 PolarHBondContact O-N 3.3Å; S77-K81 WeakPolarHBondContact O-CB 3.26Å; S77-K81 PolarHBondContact O-N 2.63Å
78	K	90.2	Very high	86.2	Confident	43 Å²	43	70.6 Å²	70.6	19%	0.187	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-44.5	174.2	-73.9	-175.7	179.4	-168.7	0	111.8	T31 I34 T74 I75 D80 K81 Y82	T31-K78 PolarHBondContact OG1-NZ 2.74Å; I34-K78 HydrophobicContact CD1-CB 4.25Å; I34-K78 HydrophobicContact CD1-CD 4.39Å; T74-K78 WeakPolarHBondContact O-CG 3.21Å; T74-K78 PolarHBondContact O-N 3.43Å; T74-K78 VanDerWaalsContact O-N 3.1Å; I75-K78 PolarHBondContact O-N 3.39Å; K78-D80 VanDerWaalsContact C-N 3.35Å; K78-D80 PolarHBondContact O-N 3.03Å; K78-K81 WeakPolarHBondContact O-CB 3.39Å; K78-K81 PolarHBondContact O-N 3.39Å; K78-Y82 HydrophobicContact CB-CD2 4.34Å; K78-Y82 HydrophobicContact CB-CE2 4.12Å; K78-Y82 HydrophobicContact CG-CE2 4.45Å; K78-Y82 WeakPolarHBondContact O-CD2 3.44Å; K78-Y82 PolarHBondContact O-N 3.47Å
79	V	91.2	Very high	85.7	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.018	40%	0.403	C	S	.	.	H	α-helix	trans	-56.8	-49	176.4	169.9	0	0	0	0	110.7	I34 L38 K53 V56 I75 F76 K81 Y82 R83	I34-V79 HydrophobicContact CG2-CG2 3.81Å; L38-V79 HydrophobicContact CD2-CG1 4.26Å; K53-V79 HydrophobicContact CG-CG1 4.47Å; V56-V79 HydrophobicContact CB-CG2 4.25Å; V56-V79 HydrophobicContact CG1-CG2 3.86Å; V56-V79 HydrophobicContact CG2-CG2 3.99Å; I75-V79 HydrophobicContact CG2-CG2 4.34Å; I75-V79 WeakPolarHBondContact O-CG2 3.34Å; I75-V79 PolarHBondContact O-N 2.83Å; F76-V79 PolarHBondContact O-N 2.82Å; V79-K81 VanDerWaalsContact C-N 3.32Å; V79-K81 PolarHBondContact O-N 2.56Å; V79-Y82 PolarHBondContact O-N 3.33Å; V79-R83 WeakPolarHBondContact O-CB 3.43Å; V79-R83 PolarHBondContact O-N 2.85Å
80	D	89.9	Confident	85	Confident	73 Å²	73	75.8 Å²	75.8	39%	0.39	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-41.4	179.3	-65.9	-30.3	0	0	0	111.8	K53 F76 S77 K78	K53-D80 WeakPolarHBondContact CE-OD1 3.17Å; K53-D80 IonicContact NZ-OD1 3.25Å; K53-D80 PolarHBondContact NZ-OD1 3.16Å; K53-D80 IonicContact NZ-OD2 3.15Å; K53-D80 PolarHBondContact NZ-OD2 3.48Å; F76-D80 PolarHBondContact O-N 3.32Å; S77-D80 PolarHBondContact O-N 3.3Å; K78-D80 VanDerWaalsContact C-N 3.35Å; K78-D80 PolarHBondContact O-N 3.03Å
81	K	88.1	Confident	84.3	Confident	148 Å²	148	70.1 Å²	70.1	64%	0.643	36%	0.364	S	S	*	.	H	α-helix	trans	-59.7	-47.9	178.2	-178.8	-179.1	177.7	-179.2	0	112.5	S77 K78 V79	S77-K81 WeakPolarHBondContact O-CB 3.26Å; S77-K81 PolarHBondContact O-N 2.63Å; K78-K81 WeakPolarHBondContact O-CB 3.39Å; K78-K81 PolarHBondContact O-N 3.39Å; V79-K81 VanDerWaalsContact C-N 3.32Å; V79-K81 PolarHBondContact O-N 2.56Å
82	Y	85.8	Confident	83.6	Confident	47 Å²	47	73.1 Å²	73.1	18%	0.184	39%	0.387	C	S	.	.	H	α-helix	trans	-83.9	-29.4	-174.7	-63.5	-61.4	0	0	0	113.1	T31 Q35 K78 V79 T84 A85 I86	T31-Y82 HydrophobicContact CG2-CE2 3.75Å; T31-Y82 VanDerWaalsContact CG2-OH 3.27Å; T31-Y82 WeakPolarHBondContact CG2-OH 3.21Å; Q35-Y82 HydrophobicContact CG-CD1 4Å; Q35-Y82 HydrophobicContact CG-CD2 3.92Å; Q35-Y82 HydrophobicContact CG-CE1 4.21Å; Q35-Y82 HydrophobicContact CG-CE2 4.15Å; Q35-Y82 HydrophobicContact CG-CG 3.86Å; K78-Y82 HydrophobicContact CB-CD2 4.34Å; K78-Y82 HydrophobicContact CB-CE2 4.12Å; K78-Y82 HydrophobicContact CG-CE2 4.45Å; K78-Y82 WeakPolarHBondContact O-CD2 3.44Å; K78-Y82 PolarHBondContact O-N 3.47Å; V79-Y82 PolarHBondContact O-N 3.33Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-T84 PolarHBondContact O-N 3.16Å; Y82-A85 PolarHBondContact O-N 3.02Å; Y82-I86 WeakPolarHBondContact O-CB 3.27Å; Y82-I86 WeakPolarHBondContact O-CG1 3.2Å; Y82-I86 PolarHBondContact O-N 3.49Å
83	R	86	Confident	82.9	Confident	71 Å²	71	72.4 Å²	72.4	27%	0.268	39%	0.393	S	S	.	.	H	α-helix	trans	-54.5	-47.3	-179.5	175.7	174.4	179.8	154.6	7	112.2	Y42 L51 V79 A85 I86 I87	Y42-R83 HydrophobicContact CE2-CG 4.09Å; Y42-R83 WeakPolarHBondContact OH-CD 3.21Å; Y42-R83 PolarHBondContact OH-NE 3.4Å; Y42-R83 PolarHBondContact OH-NH2 3.43Å; L51-R83 PolarHBondContact O-NH1 3.43Å; V79-R83 WeakPolarHBondContact O-CB 3.43Å; V79-R83 PolarHBondContact O-N 2.85Å; R83-A85 PolarHBondContact O-N 3.48Å; R83-I86 PolarHBondContact O-N 3.3Å; R83-I87 HydrophobicContact CG-CD1 3.46Å; R83-I87 VanDerWaalsContact CG-CD1 3.46Å; R83-I87 HydrophobicContact CG-CG1 4.23Å; R83-I87 WeakPolarHBondContact O-CB 3.47Å; R83-I87 WeakPolarHBondContact O-CG1 2.91Å; R83-I87 PolarHBondContact O-N 3.26Å
84	T	79.4	Confident	82.7	Confident	100 Å²	100	68.4 Å²	68.4	61%	0.613	36%	0.363	S	S	*	.	H	α-helix	trans	-62.9	-44.7	-177.2	-53.1	0	0	0	0	112.1	Y82 Q88	Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-T84 PolarHBondContact O-N 3.16Å; T84-Q88 WeakPolarHBondContact O-CB 3.16Å; T84-Q88 PolarHBondContact O-N 2.94Å; T84-Q88 VanDerWaalsContact O-N 3.12Å
85	A	80.2	Confident	82.7	Confident	58 Å²	58	71.5 Å²	71.5	48%	0.479	37%	0.367	S	S	.	.	H	α-helix	trans	-65.5	-47	179.4	0	0	0	0	0	111.8	Y82 R83 I87 Q88 E89	Y82-A85 PolarHBondContact O-N 3.02Å; R83-A85 PolarHBondContact O-N 3.48Å; A85-I87 PolarHBondContact O-N 3.41Å; A85-Q88 PolarHBondContact O-N 3.15Å; A85-E89 PolarHBondContact O-N 2.85Å; A85-E89 VanDerWaalsContact O-N 3.15Å
86	I	79.6	Confident	82.6	Confident	28 Å²	28	71.5 Å²	71.5	14%	0.144	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-42.2	-179.8	-66.9	169.5	0	0	0	110.9	L38 Y42 Y82 R83 Q88 E89 S90	L38-I86 HydrophobicContact CB-CD1 3.56Å; L38-I86 HydrophobicContact CD1-CD1 4.22Å; Y42-I86 HydrophobicContact CD2-CG2 3.88Å; Y42-I86 HydrophobicContact CG-CG2 4.24Å; Y82-I86 WeakPolarHBondContact O-CB 3.27Å; Y82-I86 WeakPolarHBondContact O-CG1 3.2Å; Y82-I86 PolarHBondContact O-N 3.49Å; R83-I86 PolarHBondContact O-N 3.3Å; I86-Q88 VanDerWaalsContact C-N 3.33Å; I86-Q88 PolarHBondContact O-N 3.01Å; I86-E89 PolarHBondContact O-N 2.96Å; I86-S90 VanDerWaalsContact O-CB 3.23Å; I86-S90 WeakPolarHBondContact O-CB 3.29Å; I86-S90 PolarHBondContact O-N 3.35Å; I86-S90 PolarHBondContact O-OG 3.18Å
87	I	76.4	Confident	82.5	Confident	40 Å²	40	70.4 Å²	70.4	21%	0.205	37%	0.365	C	S	.	.	H	α-helix	trans	-60.7	-45.5	177.1	-72.3	172.1	0	0	0	110.1	Y42 R83 A85 E89 S90 V91	Y42-I87 HydrophobicContact CD1-CD1 4.41Å; Y42-I87 HydrophobicContact CD1-CG1 3.78Å; Y42-I87 HydrophobicContact CD2-CG1 4.3Å; Y42-I87 HydrophobicContact CE1-CD1 3.8Å; Y42-I87 HydrophobicContact CE1-CG1 3.67Å; Y42-I87 HydrophobicContact CE2-CD1 4.45Å; Y42-I87 HydrophobicContact CE2-CG1 4.18Å; Y42-I87 HydrophobicContact CG-CG1 4.15Å; R83-I87 HydrophobicContact CG-CD1 3.46Å; R83-I87 VanDerWaalsContact CG-CD1 3.46Å; R83-I87 HydrophobicContact CG-CG1 4.23Å; R83-I87 WeakPolarHBondContact O-CB 3.47Å; R83-I87 WeakPolarHBondContact O-CG1 2.91Å; R83-I87 PolarHBondContact O-N 3.26Å; A85-I87 PolarHBondContact O-N 3.41Å; I87-E89 VanDerWaalsContact C-N 3.31Å; I87-E89 PolarHBondContact O-N 3.36Å; I87-S90 PolarHBondContact O-OG 3.43Å; I87-V91 HydrophobicContact CG2-CG2 3.84Å; I87-V91 WeakPolarHBondContact O-CB 3.34Å; I87-V91 WeakPolarHBondContact O-CG2 3.29Å; I87-V91 PolarHBondContact O-N 3.01Å
88	Q	76.6	Confident	82.4	Confident	146 Å²	146	68.2 Å²	68.2	68%	0.682	35%	0.345	S	S	*	.	H	α-helix	trans	-62.7	-37.8	-177.6	-168.8	170.2	-0.5	0	0	112.7	T84 A85 I86	T84-Q88 WeakPolarHBondContact O-CB 3.16Å; T84-Q88 PolarHBondContact O-N 2.94Å; T84-Q88 VanDerWaalsContact O-N 3.12Å; A85-Q88 PolarHBondContact O-N 3.15Å; I86-Q88 VanDerWaalsContact C-N 3.33Å; I86-Q88 PolarHBondContact O-N 3.01Å
89	E	75.4	Confident	82.3	Confident	157 Å²	157	71.3 Å²	71.3	73%	0.734	36%	0.359	S	S	*	.	H	α-helix	trans	-78.2	-44.7	178.8	-171.8	171.3	-167.2	0	0	112.8	A85 I86 I87	A85-E89 PolarHBondContact O-N 2.85Å; A85-E89 VanDerWaalsContact O-N 3.15Å; I86-E89 PolarHBondContact O-N 2.96Å; I87-E89 VanDerWaalsContact C-N 3.31Å; I87-E89 PolarHBondContact O-N 3.36Å
90	S	70.4	Confident	82.3	Confident	22 Å²	22	79 Å²	79	15%	0.154	39%	0.392	C	S	.	.	H	α-helix	trans	-70.7	-33.5	-176.6	58.5	0	0	0	0	113.7	I86 I87 L92 S93 F94	I86-S90 VanDerWaalsContact O-CB 3.23Å; I86-S90 WeakPolarHBondContact O-CB 3.29Å; I86-S90 PolarHBondContact O-N 3.35Å; I86-S90 PolarHBondContact O-OG 3.18Å; I87-S90 PolarHBondContact O-OG 3.43Å; S90-L92 VanDerWaalsContact C-N 3.34Å; S90-L92 PolarHBondContact O-N 3.34Å; S90-S93 PolarHBondContact O-N 3.32Å; S90-F94 WeakPolarHBondContact O-CB 3.44Å; S90-F94 PolarHBondContact O-N 2.75Å
91	V	70.5	Confident	82.5	Confident	43 Å²	43	76.2 Å²	76.2	26%	0.261	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-35.9	-176.2	160.2	0	0	0	0	112.9	I87 S93 L105	I87-V91 HydrophobicContact CG2-CG2 3.84Å; I87-V91 WeakPolarHBondContact O-CB 3.34Å; I87-V91 WeakPolarHBondContact O-CG2 3.29Å; I87-V91 PolarHBondContact O-N 3.01Å; V91-S93 VanDerWaalsContact C-N 3.26Å; V91-S93 PolarHBondContact O-N 3.03Å; V91-L105 HydrophobicContact CB-CD2 4.34Å; V91-L105 HydrophobicContact CG1-CD2 3.62Å; V91-L105 HydrophobicContact CG2-CD2 4.22Å
92	L	71.9	Confident	82.7	Confident	154 Å²	154	73.7 Å²	73.7	81%	0.806	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-20.8	-173.1	-68.7	173.8	0	0	0	114.1	S90	S90-L92 VanDerWaalsContact C-N 3.34Å; S90-L92 PolarHBondContact O-N 3.34Å
93	S	77	Confident	83.1	Confident	78 Å²	78	71.4 Å²	71.4	55%	0.545	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	3.2	-178.2	64.1	0	0	0	0	113.6	S90 V91 R95	S90-S93 PolarHBondContact O-N 3.32Å; V91-S93 VanDerWaalsContact C-N 3.26Å; V91-S93 PolarHBondContact O-N 3.03Å; S93-R95 PolarHBondContact O-N 2.8Å; S93-R95 PolarHBondContact O-NH1 3.36Å
94	F	84.6	Confident	83.4	Confident	14 Å²	14	70.9 Å²	70.9	6%	0.061	37%	0.365	C	S	.	.			trans	-63.7	119.6	-176.7	-173.2	-96.5	0	0	0	110.9	R43 S90 V96 L105 L108	R43-F94 WeakPolarHBondContact O-CD2 3.11Å; R43-F94 WeakPolarHBondContact O-CE2 3.18Å; S90-F94 WeakPolarHBondContact O-CB 3.44Å; S90-F94 PolarHBondContact O-N 2.75Å; F94-V96 HydrophobicContact CE1-CG2 4.5Å; F94-V96 HydrophobicContact CZ-CG2 4.4Å; F94-L105 HydrophobicContact CB-CB 4.47Å; F94-L105 HydrophobicContact CD1-CB 4.01Å; F94-L105 HydrophobicContact CD1-CD1 3.89Å; F94-L105 HydrophobicContact CE1-CD1 4.22Å; F94-L105 PolarHBondContact O-N 3.16Å; F94-L108 HydrophobicContact CD1-CD1 4.3Å; F94-L108 HydrophobicContact CE1-CD1 3.5Å; F94-L108 VanDerWaalsContact CE1-CD1 3.5Å; F94-L108 HydrophobicContact CZ-CD1 4.36Å
95	R	89.6	Confident	83.8	Confident	139 Å²	139	67.2 Å²	67.2	53%	0.525	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	149.4	174.4	64.1	-175.6	-178.6	-81.6	2.1	108.7	S93 V97 I102 L103	S93-R95 PolarHBondContact O-N 2.8Å; S93-R95 PolarHBondContact O-NH1 3.36Å; R95-V97 HydrophobicContact CG-CG2 4.19Å; R95-I102 HydrophobicContact CB-CG2 4.31Å; R95-L103 CarbonylContact C-O 3.56Å; R95-L103 WeakPolarHBondContact CA-O 3.39Å; R95-L103 WeakPolarHBondContact CB-O 3.41Å
96	V	89.6	Confident	84.2	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.8	167.8	171.5	0	0	0	0	107.4	F94 I102 L103 L108 M124 L348 E352	F94-V96 HydrophobicContact CE1-CG2 4.5Å; F94-V96 HydrophobicContact CZ-CG2 4.4Å; V96-I102 CarbonylContact O-C 3.56Å; V96-I102 WeakPolarHBondContact O-CA 3.36Å; V96-L103 HydrophobicContact CB-CB 4.32Å; V96-L103 PolarHBondContact N-O 2.83Å; V96-L103 PolarHBondContact O-N 3.4Å; V96-L108 HydrophobicContact CB-CD1 4.44Å; V96-L108 HydrophobicContact CG2-CD1 3.76Å; V96-M124 HydrophobicContact CG1-CE 4.29Å; V96-M124 HydrophobicContact CG1-SD 3.94Å; V96-L348 VanDerWaalsContact CG1-O 3.24Å; V96-L348 WeakPolarHBondContact CG1-O 3.06Å; V96-E352 WeakPolarHBondContact CA-OE1 3.38Å; V96-E352 HydrophobicContact CB-CG 4.39Å; V96-E352 HydrophobicContact CG1-CG 3.95Å; V96-E352 HydrophobicContact CG2-CG 4.45Å
97	V	90.4	Very high	85	Confident	37 Å²	37	71.8 Å²	71.8	22%	0.224	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.5	175.4	-175.6	0	0	0	0	109.1	R95 I102	R95-V97 HydrophobicContact CG-CG2 4.19Å; V97-I102 HydrophobicContact CG1-CG1 4.45Å; V97-I102 HydrophobicContact CG2-CG1 4.36Å; V97-I102 HydrophobicContact CG2-CG2 4.42Å
98	Y	88.6	Confident	85.7	Confident	31 Å²	31	69.9 Å²	69.9	12%	0.122	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	112.7	175.5	-171.7	-110.2	0	0	0	110.8	K100 H101 E127 L128 E131 C351	Y98-K100 PolarHBondContact O-N 3.43Å; Y98-K100 VanDerWaalsContact O-N 3.13Å; Y98-H101 PolarHBondContact N-O 2.97Å; Y98-H101 WeakPolarHBondContact O-CB 3.5Å; Y98-H101 PolarHBondContact O-N 3.34Å; Y98-E127 HydrophobicContact CD1-CB 4.42Å; Y98-E127 HydrophobicContact CD1-CG 4.12Å; Y98-E127 HydrophobicContact CE1-CB 4.28Å; Y98-E127 HydrophobicContact CE1-CG 3.77Å; Y98-L128 HydrophobicContact CD1-CD2 3.99Å; Y98-L128 HydrophobicContact CE1-CD2 3.61Å; Y98-L128 HydrophobicContact CE2-CD2 4.29Å; Y98-L128 HydrophobicContact CG-CD2 4.47Å; Y98-E131 WeakPolarHBondContact OH-CG 3.16Å; Y98-C351 VanDerWaalsContact CB-SG 3.51Å; Y98-C351 HydrophobicContact CD2-CB 3.75Å; Y98-C351 WeakPolarHBondContact CD2-O 3.28Å; Y98-C351 HydrophobicContact CE2-CB 4.06Å; Y98-C351 HydrophobicContact CG-CB 4.23Å; Y98-C351 VanDerWaalsContact CG-SG 3.6Å
99	K	88.3	Confident	86.4	Confident	108 Å²	108	66.2 Å²	66.2	47%	0.47	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	-116	-170.7	-55.4	-174.6	-177.3	-176	0	110.7	E127 E131	K99-E127 HydrophobicContact CD-CG 3.87Å; K99-E127 IonicContact NZ-OE1 2.71Å; K99-E127 PolarHBondContact NZ-OE1 2.83Å; K99-E131 WeakPolarHBondContact CE-OE1 3.26Å; K99-E131 IonicContact NZ-OE1 2.67Å; K99-E131 PolarHBondContact NZ-OE1 2.87Å
100	K	90.5	Very high	87.3	Confident	164 Å²	164	59.7 Å²	59.7	71%	0.713	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-4.9	178.8	68.2	-176.2	177.4	-171	0	113.7	Y98	Y98-K100 PolarHBondContact O-N 3.43Å; Y98-K100 VanDerWaalsContact O-N 3.13Å
101	H	93.2	Very high	88.4	Confident	15 Å²	15	58.7 Å²	58.7	7%	0.069	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.4	-175.4	-64	-84.5	0	0	0	110	Y98 M124 E127	Y98-H101 PolarHBondContact N-O 2.97Å; Y98-H101 WeakPolarHBondContact O-CB 3.5Å; Y98-H101 PolarHBondContact O-N 3.34Å; H101-M124 HydrophobicContact CB-CB 3.97Å; H101-M124 HydrophobicContact CB-CE 3.32Å; H101-M124 HydrophobicContact CB-CG 3.92Å; H101-M124 HydrophobicContact CB-SD 4.46Å; H101-M124 WeakPolarHBondContact O-CE 3.34Å; H101-E127 IonicContact NE2-OE2 3.41Å
102	I	93.4	Very high	89.2	Confident	95 Å²	95	57 Å²	57	49%	0.487	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	120.6	175.2	-56.1	175.3	0	0	0	106.3	R95 V96 V97	R95-I102 HydrophobicContact CB-CG2 4.31Å; V96-I102 CarbonylContact O-C 3.56Å; V96-I102 WeakPolarHBondContact O-CA 3.36Å; V97-I102 HydrophobicContact CG1-CG1 4.45Å; V97-I102 HydrophobicContact CG2-CG1 4.36Å; V97-I102 HydrophobicContact CG2-CG2 4.42Å
103	L	93.6	Very high	89.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.5	169.9	-57.9	-178.5	0	0	0	109.1	R95 V96 D107 L108 Q120 V121 M124 L348	R95-L103 CarbonylContact C-O 3.56Å; R95-L103 WeakPolarHBondContact CA-O 3.39Å; R95-L103 WeakPolarHBondContact CB-O 3.41Å; V96-L103 HydrophobicContact CB-CB 4.32Å; V96-L103 PolarHBondContact N-O 2.83Å; V96-L103 PolarHBondContact O-N 3.4Å; L103-D107 HydrophobicContact CB-CB 4.21Å; L103-D107 HydrophobicContact CD2-CB 4.13Å; L103-L108 HydrophobicContact CB-CD1 4.23Å; L103-L108 HydrophobicContact CB-CD2 4.37Å; L103-L108 HydrophobicContact CB-CG 3.98Å; L103-L108 HydrophobicContact CD1-CD2 3.63Å; L103-L108 HydrophobicContact CD1-CG 4.16Å; L103-Q120 VanDerWaalsContact CD2-C 3.47Å; L103-Q120 HydrophobicContact CD2-CB 3.49Å; L103-Q120 VanDerWaalsContact CD2-CB 3.49Å; L103-V121 HydrophobicContact CD1-CG2 4.43Å; L103-V121 HydrophobicContact CD2-CG2 4.49Å; L103-M124 HydrophobicContact CB-CE 4.41Å; L103-M124 HydrophobicContact CD1-CB 4.23Å; L103-M124 HydrophobicContact CD1-CE 4.19Å; L103-M124 HydrophobicContact CD1-CG 4.41Å; L103-M124 HydrophobicContact CD1-SD 3.43Å; L103-M124 WeakPolarHBondContact CD1-SD 3.46Å; L103-M124 HydrophobicContact CD2-CB 4.29Å; L103-M124 HydrophobicContact CD2-CE 4.36Å; L103-M124 HydrophobicContact CD2-SD 4.44Å; L103-M124 HydrophobicContact CG-CB 4.37Å; L103-M124 HydrophobicContact CG-CE 3.6Å; L103-M124 HydrophobicContact CG-SD 3.55Å; L103-M124 VanDerWaalsContact CG-SD 3.55Å; L103-L348 HydrophobicContact CD1-CB 4.38Å; L103-L348 HydrophobicContact CD1-CD1 3.89Å; L103-L348 HydrophobicContact CD1-CD2 3.99Å; L103-L348 HydrophobicContact CD1-CG 4.32Å
104	T	91.4	Very high	89.9	Confident	60 Å²	60	58.3 Å²	58.3	37%	0.368	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	171.4	168	65.2	0	0	0	0	110.6	E106 D107 L108	T104-E106 PolarHBondContact O-N 2.98Å; T104-E106 PolarHBondContact OG1-N 3.31Å; T104-D107 WeakPolarHBondContact CB-OD2 3.35Å; T104-D107 PolarHBondContact N-OD2 2.84Å; T104-D107 PolarHBondContact O-N 3.46Å; T104-D107 PolarHBondContact OG1-N 3.1Å; T104-D107 PolarHBondContact OG1-OD2 2.93Å; T104-L108 PolarHBondContact O-N 3.37Å; T104-L108 VanDerWaalsContact O-N 3.11Å
105	L	87.9	Confident	90.2	Very high	22 Å²	22	62.3 Å²	62.3	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-57.8	-37.9	168.7	-175.5	61.1	0	0	0	112	V91 F94 D107 L108 L109	V91-L105 HydrophobicContact CB-CD2 4.34Å; V91-L105 HydrophobicContact CG1-CD2 3.62Å; V91-L105 HydrophobicContact CG2-CD2 4.22Å; F94-L105 HydrophobicContact CB-CB 4.47Å; F94-L105 HydrophobicContact CD1-CB 4.01Å; F94-L105 HydrophobicContact CD1-CD1 3.89Å; F94-L105 HydrophobicContact CE1-CD1 4.22Å; F94-L105 PolarHBondContact O-N 3.16Å; L105-D107 PolarHBondContact O-N 2.8Å; L105-L108 PolarHBondContact O-N 2.77Å; L105-L109 HydrophobicContact CD1-CG 4.21Å; L105-L109 HydrophobicContact CG-CD1 4.01Å; L105-L109 HydrophobicContact CG-CG 4.15Å; L105-L109 WeakPolarHBondContact O-CB 3.46Å; L105-L109 WeakPolarHBondContact O-CG 3.38Å; L105-L109 PolarHBondContact O-N 3.22Å
106	E	90.4	Very high	90.4	Very high	159 Å²	159	61.6 Å²	61.6	74%	0.743	30%	0.296	S	S	*	.	H	α-helix	trans	-61.4	-44.2	178.4	-174.7	177.9	179.2	0	0	111.6	T104 L108 L109	T104-E106 PolarHBondContact O-N 2.98Å; T104-E106 PolarHBondContact OG1-N 3.31Å; E106-L108 VanDerWaalsContact C-N 3.35Å; E106-L108 PolarHBondContact O-N 2.68Å; E106-L109 PolarHBondContact O-N 3.11Å
107	D	94.5	Very high	90.7	Very high	23 Å²	23	61.8 Å²	61.8	12%	0.123	30%	0.297	C	S	.	.	H	α-helix	trans	-59.5	-47.6	174.9	-62	-63.2	0	0	0	111.2	L103 T104 L105 L109 T110 N118 Q120 V121	L103-D107 HydrophobicContact CB-CB 4.21Å; L103-D107 HydrophobicContact CD2-CB 4.13Å; T104-D107 WeakPolarHBondContact CB-OD2 3.35Å; T104-D107 PolarHBondContact N-OD2 2.84Å; T104-D107 PolarHBondContact O-N 3.46Å; T104-D107 PolarHBondContact OG1-N 3.1Å; T104-D107 PolarHBondContact OG1-OD2 2.93Å; L105-D107 PolarHBondContact O-N 2.8Å; D107-L109 VanDerWaalsContact C-N 3.3Å; D107-L109 PolarHBondContact O-N 3.31Å; D107-T110 VanDerWaalsContact O-CB 3.32Å; D107-T110 WeakPolarHBondContact O-CB 3.26Å; D107-T110 WeakPolarHBondContact O-CG2 3.24Å; D107-T110 PolarHBondContact O-N 2.99Å; D107-T110 VanDerWaalsContact O-N 3.12Å; D107-T110 PolarHBondContact O-OG1 2.84Å; D107-N118 PolarHBondContact OD1-ND2 3.05Å; D107-Q120 HydrophobicContact CB-CB 4.37Å; D107-V121 HydrophobicContact CB-CG2 4.43Å; D107-V121 VanDerWaalsContact O-CG2 3.23Å; D107-V121 WeakPolarHBondContact O-CG2 3.39Å
108	L	92.3	Very high	91	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-69.2	-28.3	-178.3	-72.5	165.7	0	0	0	112.8	F94 V96 L103 T104 L105 E106 T110 L111 Y345 L348	F94-L108 HydrophobicContact CD1-CD1 4.3Å; F94-L108 HydrophobicContact CE1-CD1 3.5Å; F94-L108 VanDerWaalsContact CE1-CD1 3.5Å; F94-L108 HydrophobicContact CZ-CD1 4.36Å; V96-L108 HydrophobicContact CB-CD1 4.44Å; V96-L108 HydrophobicContact CG2-CD1 3.76Å; L103-L108 HydrophobicContact CB-CD1 4.23Å; L103-L108 HydrophobicContact CB-CD2 4.37Å; L103-L108 HydrophobicContact CB-CG 3.98Å; L103-L108 HydrophobicContact CD1-CD2 3.63Å; L103-L108 HydrophobicContact CD1-CG 4.16Å; T104-L108 PolarHBondContact O-N 3.37Å; T104-L108 VanDerWaalsContact O-N 3.11Å; L105-L108 PolarHBondContact O-N 2.77Å; E106-L108 VanDerWaalsContact C-N 3.35Å; E106-L108 PolarHBondContact O-N 2.68Å; L108-T110 PolarHBondContact O-N 3.12Å; L108-L111 HydrophobicContact CD2-CD1 4.34Å; L108-L111 WeakPolarHBondContact O-CB 3.48Å; L108-L111 PolarHBondContact O-N 3.39Å; L108-Y345 HydrophobicContact CB-CD2 4.01Å; L108-Y345 HydrophobicContact CB-CE2 3.56Å; L108-Y345 HydrophobicContact CD1-CE2 4.44Å; L108-Y345 HydrophobicContact CD2-CD2 4.23Å; L108-Y345 HydrophobicContact CD2-CE2 4.33Å; L108-Y345 HydrophobicContact CG-CE2 4.33Å; L108-L348 HydrophobicContact CD2-CB 4.14Å; L108-L348 HydrophobicContact CD2-CD1 3.95Å
109	L	91.3	Very high	91.4	Very high	69 Å²	69	61.9 Å²	61.9	36%	0.361	30%	0.298	S	S	.	.	H	α-helix	trans	-68	-13	173.5	-74.9	174.4	0	0	0	112.8	F48 L105 E106 D107 L111 A112 H115	F48-L109 HydrophobicContact CD2-CD2 4.26Å; L105-L109 HydrophobicContact CD1-CG 4.21Å; L105-L109 HydrophobicContact CG-CD1 4.01Å; L105-L109 HydrophobicContact CG-CG 4.15Å; L105-L109 WeakPolarHBondContact O-CB 3.46Å; L105-L109 WeakPolarHBondContact O-CG 3.38Å; L105-L109 PolarHBondContact O-N 3.22Å; E106-L109 PolarHBondContact O-N 3.11Å; D107-L109 VanDerWaalsContact C-N 3.3Å; D107-L109 PolarHBondContact O-N 3.31Å; L109-L111 PolarHBondContact O-N 3.14Å; L109-A112 HydrophobicContact CD2-CB 4.32Å; L109-A112 WeakPolarHBondContact O-CA 3.4Å; L109-A112 WeakPolarHBondContact O-CB 3.46Å; L109-A112 PolarHBondContact O-N 3.29Å; L109-H115 PolarHBondContact O-ND1 2.6Å
110	T	94.7	Very high	91.9	Very high	21 Å²	21	60.2 Å²	60.2	13%	0.129	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.3	167.8	69.2	0	0	0	0	113	D107 L108 A112 W116 L117 N118 R341	D107-T110 VanDerWaalsContact O-CB 3.32Å; D107-T110 WeakPolarHBondContact O-CB 3.26Å; D107-T110 WeakPolarHBondContact O-CG2 3.24Å; D107-T110 PolarHBondContact O-N 2.99Å; D107-T110 VanDerWaalsContact O-N 3.12Å; D107-T110 PolarHBondContact O-OG1 2.84Å; L108-T110 PolarHBondContact O-N 3.12Å; T110-A112 VanDerWaalsContact C-N 3.26Å; T110-W116 VanDerWaalsContact CB-O 3.31Å; T110-W116 WeakPolarHBondContact CB-O 3.28Å; T110-L117 WeakPolarHBondContact O-CD2 3.35Å; T110-N118 HydrophobicContact CG2-CB 4.12Å; T110-R341 PolarHBondContact O-NH1 3.1Å
111	L	92.9	Very high	92.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.3	170.1	-68	157	0	0	0	112	L108 L109 L117 V121 R341 I344 Y345 L348	L108-L111 HydrophobicContact CD2-CD1 4.34Å; L108-L111 WeakPolarHBondContact O-CB 3.48Å; L108-L111 PolarHBondContact O-N 3.39Å; L109-L111 PolarHBondContact O-N 3.14Å; L111-L117 HydrophobicContact CD2-CD1 4.35Å; L111-L117 HydrophobicContact CD2-CD2 3.58Å; L111-L117 HydrophobicContact CG-CD2 4Å; L111-V121 HydrophobicContact CD1-CG1 3.96Å; L111-V121 HydrophobicContact CD1-CG2 4.45Å; L111-V121 HydrophobicContact CD2-CG1 4.14Å; L111-V121 HydrophobicContact CG-CG1 4.06Å; L111-R341 WeakPolarHBondContact O-CB 3.27Å; L111-R341 WeakPolarHBondContact O-CD 3.22Å; L111-R341 PolarHBondContact O-NH1 3.14Å; L111-I344 HydrophobicContact CD1-CG2 3.95Å; L111-I344 HydrophobicContact CD2-CB 3.96Å; L111-I344 HydrophobicContact CD2-CG2 3.58Å; L111-I344 HydrophobicContact CG-CG2 4.44Å; L111-Y345 HydrophobicContact CB-CD2 4.49Å; L111-Y345 HydrophobicContact CD1-CD2 4.29Å; L111-L348 HydrophobicContact CD1-CD1 3.76Å
112	A	87.2	Confident	92.3	Very high	7 Å²	7	51.7 Å²	51.7	6%	0.058	26%	0.255	C	S	.	.	S	Bend	trans	-72.7	140.2	175.7	0	0	0	0	0	111.7	F48 L109 T110 E114 H115	F48-A112 HydrophobicContact CD2-CB 3.83Å; F48-A112 HydrophobicContact CE2-CB 3.23Å; F48-A112 HydrophobicContact CZ-CB 4.12Å; L109-A112 HydrophobicContact CD2-CB 4.32Å; L109-A112 WeakPolarHBondContact O-CA 3.4Å; L109-A112 WeakPolarHBondContact O-CB 3.46Å; L109-A112 PolarHBondContact O-N 3.29Å; T110-A112 VanDerWaalsContact C-N 3.26Å; A112-E114 PolarHBondContact O-N 3.18Å; A112-H115 PolarHBondContact O-N 3.47Å; A112-H115 PolarHBondContact O-ND1 2.98Å
113	N	81.4	Confident	92.5	Very high	129 Å²	129	47.5 Å²	47.5	69%	0.69	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	-135.7	170.1	-53.6	-31.5	0	0	0	112	R341	N113-R341 VanDerWaalsContact O-CD 3.23Å; N113-R341 WeakPolarHBondContact O-CD 3.24Å; N113-R341 PolarHBondContact O-NE 2.88Å; N113-R341 VanDerWaalsContact O-NE 3.1Å; N113-R341 PolarHBondContact O-NH1 2.98Å
114	E	81.3	Confident	92.6	Very high	131 Å²	131	47.5 Å²	47.5	61%	0.612	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	34.2	-176.3	-81.1	-170.3	-170.3	0	0	111.8	A112 N245	A112-E114 PolarHBondContact O-N 3.18Å; E114-N245 WeakPolarHBondContact CB-ND2 3.21Å; E114-N245 WeakPolarHBondContact O-CB 3.3Å; E114-N245 PolarHBondContact O-ND2 3.1Å
115	H	91.5	Very high	92.7	Very high	99 Å²	99	44.9 Å²	44.9	46%	0.458	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-83.5	150.8	176.1	-61.6	110.2	0	0	0	112.3	L109 A112 R341	L109-H115 PolarHBondContact O-ND1 2.6Å; A112-H115 PolarHBondContact O-N 3.47Å; A112-H115 PolarHBondContact O-ND1 2.98Å; H115-R341 PolarHBondContact O-NH1 3.43Å; H115-R341 VanDerWaalsContact O-NH1 3.17Å; H115-R341 PolarHBondContact O-NH2 3.45Å
116	W	94.4	Very high	92.8	Very high	124 Å²	124	43.8 Å²	43.8	47%	0.47	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-69.8	128.4	171	-67	-18.7	0	0	0	111.2	T110 N118 V179 E244 N245	T110-W116 VanDerWaalsContact CB-O 3.31Å; T110-W116 WeakPolarHBondContact CB-O 3.28Å; W116-N118 PolarHBondContact O-N 3.01Å; W116-V179 HydrophobicContact CH2-CB 3.57Å; W116-V179 HydrophobicContact CH2-CG1 3.45Å; W116-V179 VanDerWaalsContact CH2-CG1 3.45Å; W116-V179 HydrophobicContact CZ2-CB 4Å; W116-V179 HydrophobicContact CZ2-CG1 4.36Å; W116-V179 HydrophobicContact CZ3-CB 3.96Å; W116-V179 HydrophobicContact CZ3-CG1 3.64Å; W116-E244 PolarHBondContact NE1-O 3.01Å; W116-E244 VanDerWaalsContact NE1-O 3.1Å; W116-N245 HydrophobicContact CG-CB 4.44Å; W116-N245 VanDerWaalsContact NE1-CA 3.34Å; W116-N245 VanDerWaalsContact NE1-CB 3.34Å
117	L	96.1	Very high	92.8	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-63	136.9	170.7	-58.2	-164.7	0	0	0	109.9	T110 L111 V121 W181 G248 V249 L252	T110-L117 WeakPolarHBondContact O-CD2 3.35Å; L111-L117 HydrophobicContact CD2-CD1 4.35Å; L111-L117 HydrophobicContact CD2-CD2 3.58Å; L111-L117 HydrophobicContact CG-CD2 4Å; L117-V121 HydrophobicContact CD1-CG1 4.4Å; L117-W181 PolarHBondContact O-NE1 3.1Å; L117-G248 VanDerWaalsContact CD1-C 3.46Å; L117-V249 HydrophobicContact CD1-CG2 3.97Å; L117-V249 HydrophobicContact CD2-CG2 4.25Å; L117-V249 HydrophobicContact CG-CG2 4.14Å; L117-L252 HydrophobicContact CD1-CD1 3.77Å; L117-L252 HydrophobicContact CD1-CG 4.4Å
118	N	96.8	Very high	92.3	Very high	40 Å²	40	37.6 Å²	37.6	21%	0.214	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-91.7	171.6	175.3	75.5	13.9	0	0	0	112.3	D107 T110 W116 Q120 V121 M122	D107-N118 PolarHBondContact OD1-ND2 3.05Å; T110-N118 HydrophobicContact CG2-CB 4.12Å; W116-N118 PolarHBondContact O-N 3.01Å; N118-Q120 VanDerWaalsContact C-N 3.25Å; N118-Q120 PolarHBondContact O-N 3.36Å; N118-Q120 WeakPolarHBondContact OD1-CB 3.35Å; N118-Q120 PolarHBondContact OD1-N 3.17Å; N118-V121 PolarHBondContact OD1-N 3.35Å; N118-M122 WeakPolarHBondContact O-CB 3.32Å; N118-M122 PolarHBondContact O-N 2.95Å; N118-M122 VanDerWaalsContact O-N 3.17Å
119	D	97.3	Very high	91.8	Very high	30 Å²	30	37.8 Å²	37.8	16%	0.16	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-32.6	178.7	-67.8	-70.6	0	0	0	113	N123 S142 F143 H176 W181	D119-N123 VanDerWaalsContact O-CB 3.24Å; D119-N123 WeakPolarHBondContact O-CB 3.29Å; D119-N123 PolarHBondContact O-N 2.98Å; D119-N123 PolarHBondContact O-ND2 3.4Å; D119-S142 VanDerWaalsContact OD1-CB 3.28Å; D119-S142 WeakPolarHBondContact OD1-CB 3.37Å; D119-S142 PolarHBondContact OD1-OG 3.06Å; D119-F143 HydrophobicContact CB-CE1 4Å; D119-F143 HydrophobicContact CB-CE2 4.3Å; D119-F143 HydrophobicContact CB-CZ 3.58Å; D119-H176 IonicContact OD1-ND1 2.83Å; D119-H176 IonicContact OD2-ND1 3.43Å; D119-W181 VanDerWaalsContact OD1-CH2 3.24Å; D119-W181 WeakPolarHBondContact OD1-CH2 3.47Å
120	Q	97.1	Very high	91.5	Very high	72 Å²	72	35.3 Å²	35.3	34%	0.336	17%	0.17	S	C	.	.	H	α-helix	trans	-67.7	-49.9	-176.8	-64.8	-62.7	-16.8	0	0	111.1	L103 D107 N118 M122 N123 M124	L103-Q120 VanDerWaalsContact CD2-C 3.47Å; L103-Q120 HydrophobicContact CD2-CB 3.49Å; L103-Q120 VanDerWaalsContact CD2-CB 3.49Å; D107-Q120 HydrophobicContact CB-CB 4.37Å; N118-Q120 VanDerWaalsContact C-N 3.25Å; N118-Q120 PolarHBondContact O-N 3.36Å; N118-Q120 WeakPolarHBondContact OD1-CB 3.35Å; N118-Q120 PolarHBondContact OD1-N 3.17Å; Q120-M122 PolarHBondContact O-N 2.8Å; Q120-N123 PolarHBondContact O-N 3.2Å; Q120-M124 PolarHBondContact O-N 3.12Å
121	V	96.6	Very high	90.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-47.7	175.3	170.5	0	0	0	0	110.7	L103 D107 L111 L117 N118 N123 Y125 L348	L103-V121 HydrophobicContact CD1-CG2 4.43Å; L103-V121 HydrophobicContact CD2-CG2 4.49Å; D107-V121 HydrophobicContact CB-CG2 4.43Å; D107-V121 VanDerWaalsContact O-CG2 3.23Å; D107-V121 WeakPolarHBondContact O-CG2 3.39Å; L111-V121 HydrophobicContact CD1-CG1 3.96Å; L111-V121 HydrophobicContact CD1-CG2 4.45Å; L111-V121 HydrophobicContact CD2-CG1 4.14Å; L111-V121 HydrophobicContact CG-CG1 4.06Å; L117-V121 HydrophobicContact CD1-CG1 4.4Å; N118-V121 PolarHBondContact OD1-N 3.35Å; V121-N123 VanDerWaalsContact C-N 3.34Å; V121-N123 PolarHBondContact O-N 2.86Å; V121-Y125 VanDerWaalsContact O-CB 3.27Å; V121-Y125 WeakPolarHBondContact O-CB 3.47Å; V121-Y125 PolarHBondContact O-N 3.16Å; V121-L348 HydrophobicContact CG1-CD1 4.08Å
122	M	96.8	Very high	90.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56	-47.2	178.8	-175.7	65.5	65.4	0	0	111.8	N118 Q120 G126 F139 P174 W181 V251 L252	N118-M122 WeakPolarHBondContact O-CB 3.32Å; N118-M122 PolarHBondContact O-N 2.95Å; N118-M122 VanDerWaalsContact O-N 3.17Å; Q120-M122 PolarHBondContact O-N 2.8Å; M122-G126 PolarHBondContact O-N 3.11Å; M122-F139 HydrophobicContact CG-CE1 4.45Å; M122-F139 HydrophobicContact CG-CZ 4.2Å; M122-F139 HydrophobicContact SD-CZ 3.96Å; M122-P174 HydrophobicContact CG-CB 4.1Å; M122-P174 HydrophobicContact CG-CG 4.42Å; M122-P174 HydrophobicContact SD-CB 4.07Å; M122-W181 HydrophobicContact CB-CH2 4.19Å; M122-W181 HydrophobicContact CB-CZ2 4.47Å; M122-W181 HydrophobicContact CE-CD2 3.72Å; M122-W181 HydrophobicContact CE-CE3 3.79Å; M122-W181 HydrophobicContact CE-CG 4.1Å; M122-W181 HydrophobicContact CE-CH2 4.41Å; M122-W181 HydrophobicContact CE-CZ2 4.4Å; M122-W181 HydrophobicContact CE-CZ3 4.13Å; M122-W181 HydrophobicContact CG-CH2 3.94Å; M122-W181 HydrophobicContact CG-CZ3 3.92Å; M122-V251 HydrophobicContact CE-CB 4.2Å; M122-V251 HydrophobicContact CE-CG1 3.93Å; M122-V251 HydrophobicContact SD-CG1 3.75Å; M122-L252 HydrophobicContact CE-CD2 4.28Å; M122-L252 HydrophobicContact CE-CG 4.31Å; M122-L252 HydrophobicContact SD-CD2 3.33Å; M122-L252 WeakPolarHBondContact SD-CD2 3.48Å; M122-L252 HydrophobicContact SD-CG 4Å
123	N	97	Very high	89.6	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.043	20%	0.2	C	C	.	.	H	α-helix	trans	-74.1	-44.2	-175.9	-72.8	-45.8	0	0	0	112.9	D119 Q120 V121 G126 E127 N141 S142	D119-N123 VanDerWaalsContact O-CB 3.24Å; D119-N123 WeakPolarHBondContact O-CB 3.29Å; D119-N123 PolarHBondContact O-N 2.98Å; D119-N123 PolarHBondContact O-ND2 3.4Å; Q120-N123 PolarHBondContact O-N 3.2Å; V121-N123 VanDerWaalsContact C-N 3.34Å; V121-N123 PolarHBondContact O-N 2.86Å; N123-G126 WeakPolarHBondContact O-CA 3.29Å; N123-G126 PolarHBondContact O-N 2.9Å; N123-G126 VanDerWaalsContact O-N 3.15Å; N123-E127 PolarHBondContact O-N 3.36Å; N123-N141 PolarHBondContact ND2-ND2 2.7Å; N123-N141 VanDerWaalsContact OD1-CA 3.26Å; N123-N141 WeakPolarHBondContact OD1-CA 3.49Å; N123-N141 PolarHBondContact OD1-ND2 3.17Å; N123-S142 PolarHBondContact ND2-OG 3.25Å; N123-S142 PolarHBondContact OD1-N 3.2Å
124	M	95.4	Very high	89.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-42.3	177.9	-173.7	-176	-84.4	0	0	110.9	V96 H101 L103 Q120 G126 E127 L128 L348	V96-M124 HydrophobicContact CG1-CE 4.29Å; V96-M124 HydrophobicContact CG1-SD 3.94Å; H101-M124 HydrophobicContact CB-CB 3.97Å; H101-M124 HydrophobicContact CB-CE 3.32Å; H101-M124 HydrophobicContact CB-CG 3.92Å; H101-M124 HydrophobicContact CB-SD 4.46Å; H101-M124 WeakPolarHBondContact O-CE 3.34Å; L103-M124 HydrophobicContact CB-CE 4.41Å; L103-M124 HydrophobicContact CD1-CB 4.23Å; L103-M124 HydrophobicContact CD1-CE 4.19Å; L103-M124 HydrophobicContact CD1-CG 4.41Å; L103-M124 HydrophobicContact CD1-SD 3.43Å; L103-M124 WeakPolarHBondContact CD1-SD 3.46Å; L103-M124 HydrophobicContact CD2-CB 4.29Å; L103-M124 HydrophobicContact CD2-CE 4.36Å; L103-M124 HydrophobicContact CD2-SD 4.44Å; L103-M124 HydrophobicContact CG-CB 4.37Å; L103-M124 HydrophobicContact CG-CE 3.6Å; L103-M124 HydrophobicContact CG-SD 3.55Å; L103-M124 VanDerWaalsContact CG-SD 3.55Å; Q120-M124 PolarHBondContact O-N 3.12Å; M124-G126 VanDerWaalsContact C-N 3.25Å; M124-G126 PolarHBondContact O-N 2.66Å; M124-E127 VanDerWaalsContact O-CB 3.26Å; M124-E127 WeakPolarHBondContact O-CB 3.34Å; M124-E127 PolarHBondContact O-N 3.43Å; M124-L128 PolarHBondContact O-N 2.94Å; M124-L128 VanDerWaalsContact O-N 3.17Å; M124-L348 HydrophobicContact CB-CD2 4.12Å; M124-L348 HydrophobicContact CG-CD2 3.85Å; M124-L348 HydrophobicContact SD-CD2 3.83Å
125	Y	93.2	Very high	89.6	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-69.5	-26.1	175.2	-164.8	-96.2	0	0	0	112.4	V121 E127 L128 I129 L252 K255 R343 I344 E347 L348	V121-Y125 VanDerWaalsContact O-CB 3.27Å; V121-Y125 WeakPolarHBondContact O-CB 3.47Å; V121-Y125 PolarHBondContact O-N 3.16Å; Y125-E127 VanDerWaalsContact C-N 3.35Å; Y125-L128 HydrophobicContact CD2-CD1 4.13Å; Y125-I129 HydrophobicContact CD1-CD1 3.88Å; Y125-I129 HydrophobicContact CE1-CD1 3.37Å; Y125-I129 HydrophobicContact CE1-CG1 4.42Å; Y125-I129 PolarHBondContact O-N 2.85Å; Y125-L252 HydrophobicContact CD1-CB 4.04Å; Y125-L252 HydrophobicContact CD1-CD1 3.75Å; Y125-L252 HydrophobicContact CD1-CD2 3.67Å; Y125-L252 HydrophobicContact CD1-CG 4.01Å; Y125-L252 HydrophobicContact CE1-CB 3.96Å; Y125-L252 HydrophobicContact CE1-CD1 4.33Å; Y125-L252 HydrophobicContact CE1-CD2 4.37Å; Y125-L252 HydrophobicContact CE1-CG 4.44Å; Y125-L252 HydrophobicContact CG-CD1 4.04Å; Y125-L252 HydrophobicContact CG-CD2 4.49Å; Y125-K255 PolarHBondContact O-NZ 3.1Å; Y125-R343 PolarHBondContact OH-NH2 3.48Å; Y125-I344 HydrophobicContact CD2-CG2 3.75Å; Y125-I344 HydrophobicContact CE2-CB 4.2Å; Y125-I344 HydrophobicContact CE2-CG1 3.98Å; Y125-I344 HydrophobicContact CE2-CG2 3.85Å; Y125-I344 HydrophobicContact CG-CG2 4.3Å; Y125-E347 HydrophobicContact CE2-CB 4.33Å; Y125-E347 VanDerWaalsContact CE2-OE2 3.28Å; Y125-E347 WeakPolarHBondContact CE2-OE2 3.5Å; Y125-E347 PolarHBondContact OH-OE2 3.36Å; Y125-L348 HydrophobicContact CD2-CD2 4.2Å; Y125-L348 HydrophobicContact CD2-CG 4.21Å
126	G	90.4	Very high	89.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-54.5	-48.2	163.9	0	0	0	0	0	113	M122 N123 M124 I129 M130 F139	M122-G126 PolarHBondContact O-N 3.11Å; N123-G126 WeakPolarHBondContact O-CA 3.29Å; N123-G126 PolarHBondContact O-N 2.9Å; N123-G126 VanDerWaalsContact O-N 3.15Å; M124-G126 VanDerWaalsContact C-N 3.25Å; M124-G126 PolarHBondContact O-N 2.66Å; G126-I129 PolarHBondContact O-N 2.94Å; G126-I129 VanDerWaalsContact O-N 3.15Å; G126-M130 PolarHBondContact O-N 2.6Å; G126-M130 VanDerWaalsContact O-N 3.14Å; G126-F139 VanDerWaalsContact CA-CG 3.46Å
127	E	90.1	Very high	88.8	Confident	23 Å²	23	31.9 Å²	31.9	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-45.8	178.7	-164	67.4	-144.2	0	0	112.2	Y98 K99 H101 N123 M124 Y125 I129 M130 E131	Y98-E127 HydrophobicContact CD1-CB 4.42Å; Y98-E127 HydrophobicContact CD1-CG 4.12Å; Y98-E127 HydrophobicContact CE1-CB 4.28Å; Y98-E127 HydrophobicContact CE1-CG 3.77Å; K99-E127 HydrophobicContact CD-CG 3.87Å; K99-E127 IonicContact NZ-OE1 2.71Å; K99-E127 PolarHBondContact NZ-OE1 2.83Å; H101-E127 IonicContact NE2-OE2 3.41Å; N123-E127 PolarHBondContact O-N 3.36Å; M124-E127 VanDerWaalsContact O-CB 3.26Å; M124-E127 WeakPolarHBondContact O-CB 3.34Å; M124-E127 PolarHBondContact O-N 3.43Å; Y125-E127 VanDerWaalsContact C-N 3.35Å; E127-I129 PolarHBondContact O-N 3.21Å; E127-I129 VanDerWaalsContact O-N 3.1Å; E127-M130 HydrophobicContact CB-CE 4.44Å; E127-M130 VanDerWaalsContact CD-CE 3.49Å; E127-M130 HydrophobicContact CG-CE 4.48Å; E127-M130 PolarHBondContact O-N 2.97Å; E127-M130 VanDerWaalsContact O-N 3.14Å; E127-M130 WeakPolarHBondContact OE2-CE 3.37Å; E127-E131 PolarHBondContact O-N 3.46Å
128	L	84.7	Confident	88.7	Confident	29 Å²	29	32.9 Å²	32.9	15%	0.152	17%	0.168	C	C	.	.	H	α-helix	trans	-56.4	-29.4	175.5	-64.7	-177.5	0	0	0	112.6	Y98 M124 Y125 S132 L348 C351	Y98-L128 HydrophobicContact CD1-CD2 3.99Å; Y98-L128 HydrophobicContact CE1-CD2 3.61Å; Y98-L128 HydrophobicContact CE2-CD2 4.29Å; Y98-L128 HydrophobicContact CG-CD2 4.47Å; M124-L128 PolarHBondContact O-N 2.94Å; M124-L128 VanDerWaalsContact O-N 3.17Å; Y125-L128 HydrophobicContact CD2-CD1 4.13Å; L128-S132 WeakPolarHBondContact O-CB 3.13Å; L128-S132 PolarHBondContact O-N 3.02Å; L128-S132 PolarHBondContact O-OG 3.04Å; L128-S132 VanDerWaalsContact O-OG 3.11Å; L128-L348 HydrophobicContact CD1-CD2 3.9Å; L128-C351 HydrophobicContact CD2-CB 3.65Å
129	I	82.7	Confident	88.6	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-85	-31.6	-178.8	-75.4	179.7	0	0	0	113.3	Y125 G126 E127 E131 S132 S133 L172 K255 Y320	Y125-I129 HydrophobicContact CD1-CD1 3.88Å; Y125-I129 HydrophobicContact CE1-CD1 3.37Å; Y125-I129 HydrophobicContact CE1-CG1 4.42Å; Y125-I129 PolarHBondContact O-N 2.85Å; G126-I129 PolarHBondContact O-N 2.94Å; G126-I129 VanDerWaalsContact O-N 3.15Å; E127-I129 PolarHBondContact O-N 3.21Å; E127-I129 VanDerWaalsContact O-N 3.1Å; I129-E131 VanDerWaalsContact C-N 3.29Å; I129-S132 WeakPolarHBondContact CA-OG 3.49Å; I129-S132 PolarHBondContact O-OG 2.98Å; I129-S133 WeakPolarHBondContact O-CB 3.43Å; I129-S133 PolarHBondContact O-N 2.87Å; I129-S133 PolarHBondContact O-OG 3.15Å; I129-S133 VanDerWaalsContact O-OG 3.05Å; I129-L172 HydrophobicContact CG2-CD1 4.24Å; I129-K255 HydrophobicContact CB-CD 4.18Å; I129-K255 HydrophobicContact CD1-CB 4.3Å; I129-K255 HydrophobicContact CD1-CD 3Å; I129-K255 HydrophobicContact CD1-CG 4.25Å; I129-K255 VanDerWaalsContact CD1-NZ 3.28Å; I129-K255 HydrophobicContact CG1-CD 4.03Å; I129-K255 HydrophobicContact CG2-CD 3.99Å; I129-Y320 HydrophobicContact CD1-CD2 4.4Å; I129-Y320 HydrophobicContact CD1-CE2 3.74Å; I129-Y320 HydrophobicContact CG1-CE2 3.89Å
130	M	84.4	Confident	88.6	Confident	16 Å²	16	30.3 Å²	30.3	8%	0.079	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-43.8	167.3	-65.3	-169.9	-71.1	0	0	110.3	G126 E127 S133 H135 H138 F139	G126-M130 PolarHBondContact O-N 2.6Å; G126-M130 VanDerWaalsContact O-N 3.14Å; E127-M130 HydrophobicContact CB-CE 4.44Å; E127-M130 VanDerWaalsContact CD-CE 3.49Å; E127-M130 HydrophobicContact CG-CE 4.48Å; E127-M130 PolarHBondContact O-N 2.97Å; E127-M130 VanDerWaalsContact O-N 3.14Å; E127-M130 WeakPolarHBondContact OE2-CE 3.37Å; M130-S133 PolarHBondContact O-N 2.98Å; M130-S133 PolarHBondContact O-OG 3.15Å; M130-H135 WeakPolarHBondContact O-CA 3.48Å; M130-H135 PolarHBondContact O-N 2.82Å; M130-H138 PolarHBondContact SD-ND1 2.94Å; M130-H138 VanDerWaalsContact SD-ND1 3.4Å; M130-F139 HydrophobicContact CG-CB 3.86Å; M130-F139 HydrophobicContact SD-CB 4.12Å; M130-F139 PolarHBondContact SD-N 2.85Å
131	E	81.4	Confident	88.5	Confident	68 Å²	68	29.1 Å²	29.1	32%	0.318	15%	0.15	S	C	.	.	H	α-helix	trans	-64.4	-51.2	179.3	-74.9	-66.9	158.4	0	0	113.1	Y98 K99 E127 I129 S133 N134 H135	Y98-E131 WeakPolarHBondContact OH-CG 3.16Å; K99-E131 WeakPolarHBondContact CE-OE1 3.26Å; K99-E131 IonicContact NZ-OE1 2.67Å; K99-E131 PolarHBondContact NZ-OE1 2.87Å; E127-E131 PolarHBondContact O-N 3.46Å; I129-E131 VanDerWaalsContact C-N 3.29Å; E131-S133 PolarHBondContact O-N 3.19Å; E131-S133 VanDerWaalsContact O-N 3.12Å; E131-N134 PolarHBondContact O-N 3.37Å; E131-H135 IonicContact OE1-CE1 3.47Å; E131-H135 PolarHBondContact OE1-CE1 3.17Å; E131-H135 IonicContact OE1-NE2 2.87Å; E131-H135 PolarHBondContact OE1-NE2 2.96Å; E131-H135 VanDerWaalsContact OE1-NE2 3.1Å; E131-H135 IonicContact OE2-CE1 3.18Å; E131-H135 PolarHBondContact OE2-CE1 3.34Å
132	S	76.9	Confident	88.5	Confident	63 Å²	63	29.3 Å²	29.3	44%	0.441	15%	0.151	S	C	.	.	H	α-helix	trans	-64.8	-19.3	-179.8	64.9	0	0	0	0	113.8	L128 I129 Y320	L128-S132 WeakPolarHBondContact O-CB 3.13Å; L128-S132 PolarHBondContact O-N 3.02Å; L128-S132 PolarHBondContact O-OG 3.04Å; L128-S132 VanDerWaalsContact O-OG 3.11Å; I129-S132 WeakPolarHBondContact CA-OG 3.49Å; I129-S132 PolarHBondContact O-OG 2.98Å; S132-Y320 VanDerWaalsContact CB-CE1 3.47Å; S132-Y320 WeakPolarHBondContact OG-CE1 3.33Å; S132-Y320 VanDerWaalsContact OG-CZ 3.26Å; S132-Y320 PolarHBondContact OG-OH 3.37Å
133	S	75.2	Confident	88.5	Confident	10 Å²	10	32.9 Å²	32.9	7%	0.07	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	7.8	174.4	73.5	0	0	0	0	114.1	I129 M130 E131 H135 K136 V137	I129-S133 WeakPolarHBondContact O-CB 3.43Å; I129-S133 PolarHBondContact O-N 2.87Å; I129-S133 PolarHBondContact O-OG 3.15Å; I129-S133 VanDerWaalsContact O-OG 3.05Å; M130-S133 PolarHBondContact O-N 2.98Å; M130-S133 PolarHBondContact O-OG 3.15Å; E131-S133 PolarHBondContact O-N 3.19Å; E131-S133 VanDerWaalsContact O-N 3.12Å; S133-H135 PolarHBondContact O-N 3.01Å; S133-K136 WeakPolarHBondContact O-CB 3.38Å; S133-K136 WeakPolarHBondContact O-CG 3.46Å; S133-K136 PolarHBondContact O-N 3.17Å; S133-K136 VanDerWaalsContact O-N 3.12Å; S133-V137 WeakPolarHBondContact OG-CB 3.36Å; S133-V137 PolarHBondContact OG-N 3.15Å; S133-V137 VanDerWaalsContact OG-N 3.12Å
134	N	79.9	Confident	88.6	Confident	128 Å²	128	32.5 Å²	32.5	68%	0.684	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	42.8	-170	-168	31.1	0	0	0	111.5	E131 K136	E131-N134 PolarHBondContact O-N 3.37Å; N134-K136 PolarHBondContact O-N 3.39Å
135	H	83.2	Confident	88.6	Confident	73 Å²	73	33.1 Å²	33.1	34%	0.338	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	16.9	179.9	-58.8	84	0	0	0	115.7	M130 E131 S133 K168	M130-H135 WeakPolarHBondContact O-CA 3.48Å; M130-H135 PolarHBondContact O-N 2.82Å; E131-H135 IonicContact OE1-CE1 3.47Å; E131-H135 PolarHBondContact OE1-CE1 3.17Å; E131-H135 IonicContact OE1-NE2 2.87Å; E131-H135 PolarHBondContact OE1-NE2 2.96Å; E131-H135 VanDerWaalsContact OE1-NE2 3.1Å; E131-H135 IonicContact OE2-CE1 3.18Å; E131-H135 PolarHBondContact OE2-CE1 3.34Å; S133-H135 PolarHBondContact O-N 3.01Å; H135-K168 VanDerWaalsContact O-CD 3.24Å; H135-K168 WeakPolarHBondContact O-CD 3.1Å; H135-K168 WeakPolarHBondContact O-CE 3.26Å; H135-K168 PolarHBondContact O-NZ 3.1Å
136	K	84.1	Confident	88.7	Confident	87 Å²	87	39 Å²	39	38%	0.378	19%	0.19	S	C	.	.	S	Bend	trans	-72.3	-32.8	171.3	-67.8	-178.8	180	178.1	0	111.5	S133 N134 K168 T169 L261	S133-K136 WeakPolarHBondContact O-CB 3.38Å; S133-K136 WeakPolarHBondContact O-CG 3.46Å; S133-K136 PolarHBondContact O-N 3.17Å; S133-K136 VanDerWaalsContact O-N 3.12Å; N134-K136 PolarHBondContact O-N 3.39Å; K136-K168 WeakPolarHBondContact O-CA 3.36Å; K136-K168 WeakPolarHBondContact O-CB 3.27Å; K136-T169 HydrophobicContact CB-CG2 4.16Å; K136-T169 PolarHBondContact O-N 3.43Å; K136-T169 PolarHBondContact O-OG1 2.97Å; K136-T169 VanDerWaalsContact O-OG1 3.11Å; K136-L261 HydrophobicContact CD-CD1 3.76Å
137	V	86.3	Confident	89.1	Confident	10 Å²	10	41.4 Å²	41.4	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.1	170	-178.3	0	0	0	0	108.8	S133 L170 L172	S133-V137 WeakPolarHBondContact OG-CB 3.36Å; S133-V137 PolarHBondContact OG-N 3.15Å; S133-V137 VanDerWaalsContact OG-N 3.12Å; V137-L170 WeakPolarHBondContact CA-O 3.35Å; V137-L170 HydrophobicContact CG1-CB 4.42Å; V137-L170 HydrophobicContact CG1-CD2 3.96Å; V137-L170 HydrophobicContact CG1-CG 4.47Å; V137-L170 HydrophobicContact CG2-CB 4.21Å; V137-L170 HydrophobicContact CG2-CD2 4.12Å; V137-L172 HydrophobicContact CG1-CD1 3.59Å; V137-L172 HydrophobicContact CG1-CG 3.72Å
138	H	93.4	Very high	89.4	Confident	26 Å²	26	41 Å²	41	12%	0.12	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.5	171.4	-172.2	63	0	0	0	110.6	M130 L165 K168 L170 L171 L172	M130-H138 PolarHBondContact SD-ND1 2.94Å; M130-H138 VanDerWaalsContact SD-ND1 3.4Å; H138-L165 WeakPolarHBondContact CD2-CD2 3.17Å; H138-K168 HydrophobicContact CB-CD 4.22Å; H138-K168 HydrophobicContact CB-CG 3.92Å; H138-L170 PolarHBondContact N-O 3.31Å; H138-L171 HydrophobicContact CB-CD2 3.78Å; H138-L171 CarbonylContact O-C 3.44Å; H138-L171 WeakPolarHBondContact O-CA 3.25Å; H138-L172 PolarHBondContact O-N 3.45Å
139	F	94.3	Very high	89.9	Confident	8 Å²	8	43.8 Å²	43.8	4%	0.035	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	115.9	177.5	-167.7	-84.7	0	0	0	109.2	M122 G126 M130 L172 P174	M122-F139 HydrophobicContact CG-CE1 4.45Å; M122-F139 HydrophobicContact CG-CZ 4.2Å; M122-F139 HydrophobicContact SD-CZ 3.96Å; G126-F139 VanDerWaalsContact CA-CG 3.46Å; M130-F139 HydrophobicContact CG-CB 3.86Å; M130-F139 HydrophobicContact SD-CB 4.12Å; M130-F139 PolarHBondContact SD-N 2.85Å; F139-L172 WeakPolarHBondContact CA-O 3.48Å; F139-L172 HydrophobicContact CB-CB 4.49Å; F139-L172 HydrophobicContact CD2-CB 3.57Å; F139-L172 HydrophobicContact CD2-CD1 3.8Å; F139-L172 HydrophobicContact CD2-CG 4.36Å; F139-L172 HydrophobicContact CE2-CB 4.18Å; F139-L172 HydrophobicContact CE2-CD1 4.49Å; F139-L172 HydrophobicContact CG-CB 4.33Å; F139-P174 HydrophobicContact CD1-CG 4.41Å; F139-P174 HydrophobicContact CE1-CB 4.38Å; F139-P174 HydrophobicContact CE1-CG 3.55Å; F139-P174 HydrophobicContact CE2-CG 4.36Å; F139-P174 HydrophobicContact CZ-CB 3.88Å; F139-P174 HydrophobicContact CZ-CG 3.52Å
140	L	96.9	Very high	90.6	Very high	8 Å²	8	48.3 Å²	48.3	4%	0.042	24%	0.241	C	C	.	.			trans	-76.3	145.8	178.7	-74.6	-59.6	0	0	0	109.5	F144 T160 L171 L172 V173 P174	L140-F144 HydrophobicContact CB-CB 4.37Å; L140-F144 HydrophobicContact CB-CD1 4.44Å; L140-F144 HydrophobicContact CB-CG 4.4Å; L140-F144 HydrophobicContact CG-CD1 4.46Å; L140-T160 HydrophobicContact CD1-CG2 4.44Å; L140-L171 HydrophobicContact CD2-CB 4.31Å; L140-L172 PolarHBondContact N-O 2.82Å; L140-V173 HydrophobicContact CB-CG1 4.35Å; L140-V173 HydrophobicContact CB-CG2 4.49Å; L140-V173 HydrophobicContact CD2-CG2 3.99Å; L140-V173 HydrophobicContact CG-CG2 4.22Å; L140-P174 WeakPolarHBondContact O-CD 3.43Å; L140-P174 VanDerWaalsContact O-CG 3.26Å; L140-P174 WeakPolarHBondContact O-CG 3.24Å
141	N	95.4	Very high	91.2	Very high	47 Å²	47	54 Å²	54	25%	0.251	27%	0.265	S	S	.	.			trans	-63.7	141.3	175.8	178.7	-69.8	0	0	0	110.7	N123 F143 F144 W159	N123-N141 PolarHBondContact ND2-ND2 2.7Å; N123-N141 VanDerWaalsContact OD1-CA 3.26Å; N123-N141 WeakPolarHBondContact OD1-CA 3.49Å; N123-N141 PolarHBondContact OD1-ND2 3.17Å; N141-F143 PolarHBondContact O-N 2.91Å; N141-F143 VanDerWaalsContact O-N 3.1Å; N141-F143 WeakPolarHBondContact OD1-CB 3.37Å; N141-F143 WeakPolarHBondContact OD1-CD2 3.46Å; N141-F143 WeakPolarHBondContact OD1-CG 3.24Å; N141-F143 PolarHBondContact OD1-N 2.87Å; N141-F144 WeakPolarHBondContact O-CB 3.49Å; N141-F144 PolarHBondContact O-N 2.67Å; N141-W159 HydrophobicContact CB-CZ3 4.15Å
142	S	96.9	Very high	91.9	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.021	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.5	-177.7	62.3	0	0	0	0	115.1	D119 N123 F144 W181	D119-S142 VanDerWaalsContact OD1-CB 3.28Å; D119-S142 WeakPolarHBondContact OD1-CB 3.37Å; D119-S142 PolarHBondContact OD1-OG 3.06Å; N123-S142 PolarHBondContact ND2-OG 3.25Å; N123-S142 PolarHBondContact OD1-N 3.2Å; S142-F144 VanDerWaalsContact C-N 3.25Å; S142-F144 PolarHBondContact O-N 3.07Å; S142-W181 VanDerWaalsContact CB-CH2 3.47Å
143	F	97.1	Very high	92.9	Very high	75 Å²	75	51.2 Å²	51.2	33%	0.329	25%	0.252	S	S	.	.	H	α-helix	trans	-75.1	-14	176.6	-56.4	-58.7	0	0	0	113.2	D119 N141 H145 R146 Q147 W159	D119-F143 HydrophobicContact CB-CE1 4Å; D119-F143 HydrophobicContact CB-CE2 4.3Å; D119-F143 HydrophobicContact CB-CZ 3.58Å; N141-F143 PolarHBondContact O-N 2.91Å; N141-F143 VanDerWaalsContact O-N 3.1Å; N141-F143 WeakPolarHBondContact OD1-CB 3.37Å; N141-F143 WeakPolarHBondContact OD1-CD2 3.46Å; N141-F143 WeakPolarHBondContact OD1-CG 3.24Å; N141-F143 PolarHBondContact OD1-N 2.87Å; F143-H145 PolarHBondContact O-N 3.29Å; F143-R146 PolarHBondContact O-N 3.3Å; F143-Q147 WeakPolarHBondContact O-CB 3.38Å; F143-Q147 PolarHBondContact O-N 3.26Å; F143-W159 HydrophobicContact CB-CH2 3.79Å; F143-W159 HydrophobicContact CB-CZ3 4.31Å
144	F	98	Very high	93.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.1	-51.9	-176	171	-97.6	0	0	0	112.2	L140 N141 S142 R146 Q147 L148 V156 W159 V173 I210 Y213	L140-F144 HydrophobicContact CB-CB 4.37Å; L140-F144 HydrophobicContact CB-CD1 4.44Å; L140-F144 HydrophobicContact CB-CG 4.4Å; L140-F144 HydrophobicContact CG-CD1 4.46Å; N141-F144 WeakPolarHBondContact O-CB 3.49Å; N141-F144 PolarHBondContact O-N 2.67Å; S142-F144 VanDerWaalsContact C-N 3.25Å; S142-F144 PolarHBondContact O-N 3.07Å; F144-R146 PolarHBondContact O-N 2.91Å; F144-Q147 PolarHBondContact O-N 3.38Å; F144-L148 HydrophobicContact CE1-CD2 4.17Å; F144-L148 HydrophobicContact CZ-CD2 4.37Å; F144-L148 WeakPolarHBondContact O-CB 3.49Å; F144-L148 PolarHBondContact O-N 3.49Å; F144-V156 HydrophobicContact CD2-CB 4.12Å; F144-V156 HydrophobicContact CD2-CG1 4.02Å; F144-V156 HydrophobicContact CE2-CB 3.72Å; F144-V156 HydrophobicContact CE2-CG1 4.02Å; F144-V156 HydrophobicContact CE2-CG2 3.9Å; F144-V156 HydrophobicContact CZ-CG2 4.34Å; F144-W159 VanDerWaalsContact CA-CZ3 3.43Å; F144-W159 HydrophobicContact CB-CE3 3.95Å; F144-W159 HydrophobicContact CB-CZ3 3.79Å; F144-W159 HydrophobicContact CD2-CD2 4.34Å; F144-W159 AromaticContact CD2-CE3 3.95Å; F144-W159 HydrophobicContact CD2-CE3 3.95Å; F144-W159 HydrophobicContact CG-CE3 4.47Å; F144-V173 HydrophobicContact CD1-CG1 3.92Å; F144-V173 HydrophobicContact CE1-CG1 4.33Å; F144-I210 HydrophobicContact CE1-CD1 4.24Å; F144-Y213 HydrophobicContact CE1-CD1 4.25Å; F144-Y213 HydrophobicContact CE1-CE1 4.35Å; F144-Y213 HydrophobicContact CE1-CG 4.47Å; F144-Y213 HydrophobicContact CE2-CD2 4.38Å; F144-Y213 HydrophobicContact CE2-CE1 4.26Å; F144-Y213 AromaticContact CE2-CE2 3.91Å; F144-Y213 HydrophobicContact CE2-CE2 3.91Å; F144-Y213 AromaticContact CE2-CZ 3.84Å; F144-Y213 AromaticContact CZ-CD1 3.67Å; F144-Y213 HydrophobicContact CZ-CD1 3.67Å; F144-Y213 AromaticContact CZ-CD2 3.75Å; F144-Y213 HydrophobicContact CZ-CD2 3.75Å; F144-Y213 AromaticContact CZ-CE1 3.53Å; F144-Y213 HydrophobicContact CZ-CE1 3.53Å; F144-Y213 AromaticContact CZ-CE2 3.64Å; F144-Y213 HydrophobicContact CZ-CE2 3.64Å; F144-Y213 AromaticContact CZ-CG 3.77Å; F144-Y213 HydrophobicContact CZ-CG 3.77Å; F144-Y213 AromaticContact CZ-CZ 3.53Å
145	H	96.6	Very high	94.7	Very high	13 Å²	13	51.7 Å²	51.7	6%	0.06	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-44.5	-177.8	173.1	-102.1	0	0	0	111.3	F143 Q147 L148 M149 I175	F143-H145 PolarHBondContact O-N 3.29Å; H145-Q147 VanDerWaalsContact C-N 3.31Å; H145-Q147 PolarHBondContact O-N 3.38Å; H145-L148 WeakPolarHBondContact O-CB 3.44Å; H145-L148 PolarHBondContact O-N 3.37Å; H145-M149 WeakPolarHBondContact NE2-CG 3.5Å; H145-M149 VanDerWaalsContact O-CG 3.28Å; H145-M149 WeakPolarHBondContact O-CG 3.27Å; H145-M149 PolarHBondContact O-N 2.87Å; H145-I175 HydrophobicContact CB-CD1 3.69Å
146	R	95.6	Very high	95.4	Very high	128 Å²	128	48.2 Å²	48.2	48%	0.483	24%	0.243	S	C	.	.	H	α-helix	trans	-58.1	-44.4	176.8	-176.4	-177.4	-69.1	173.8	-0.2	111.4	F143 F144 M149 T150	F143-R146 PolarHBondContact O-N 3.3Å; F144-R146 PolarHBondContact O-N 2.91Å; R146-M149 PolarHBondContact O-N 3.01Å; R146-T150 WeakPolarHBondContact O-CG2 3.39Å; R146-T150 PolarHBondContact O-N 2.76Å; R146-T150 VanDerWaalsContact O-N 3.08Å; R146-T150 PolarHBondContact O-OG1 3.29Å
147	Q	97.6	Very high	95.9	Very high	50 Å²	50	49.3 Å²	49.3	23%	0.234	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-42.5	177.7	-174.1	73.4	-1.6	0	0	112	F143 F144 H145 M149 T150 K151 G155 V156 W159	F143-Q147 WeakPolarHBondContact O-CB 3.38Å; F143-Q147 PolarHBondContact O-N 3.26Å; F144-Q147 PolarHBondContact O-N 3.38Å; H145-Q147 VanDerWaalsContact C-N 3.31Å; H145-Q147 PolarHBondContact O-N 3.38Å; Q147-M149 VanDerWaalsContact C-N 3.31Å; Q147-M149 PolarHBondContact O-N 3.16Å; Q147-T150 WeakPolarHBondContact CA-OG1 3.36Å; Q147-T150 PolarHBondContact O-N 3.36Å; Q147-T150 PolarHBondContact O-OG1 2.59Å; Q147-T150 VanDerWaalsContact O-OG1 3.13Å; Q147-K151 PolarHBondContact O-N 2.95Å; Q147-G155 WeakPolarHBondContact CG-O 3.42Å; Q147-G155 PolarHBondContact NE2-O 2.81Å; Q147-V156 HydrophobicContact CB-CG1 3.72Å; Q147-V156 HydrophobicContact CG-CG1 3.53Å; Q147-W159 HydrophobicContact CB-CH2 4.27Å; Q147-W159 HydrophobicContact CB-CZ2 3.88Å; Q147-W159 HydrophobicContact CG-CZ2 3.83Å
148	L	97.5	Very high	96.3	Very high	16 Å²	16	58.9 Å²	58.9	8%	0.084	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-42.3	175.8	174.2	64.8	0	0	0	111.3	F144 H145 G152 V156 I210 Y213	F144-L148 HydrophobicContact CE1-CD2 4.17Å; F144-L148 HydrophobicContact CZ-CD2 4.37Å; F144-L148 WeakPolarHBondContact O-CB 3.49Å; F144-L148 PolarHBondContact O-N 3.49Å; H145-L148 WeakPolarHBondContact O-CB 3.44Å; H145-L148 PolarHBondContact O-N 3.37Å; L148-G152 WeakPolarHBondContact O-CA 3.47Å; L148-G152 PolarHBondContact O-N 3.03Å; L148-V156 HydrophobicContact CB-CG1 4.09Å; L148-V156 HydrophobicContact CB-CG2 4.33Å; L148-V156 HydrophobicContact CD1-CG2 3.83Å; L148-I210 HydrophobicContact CD2-CD1 4.24Å; L148-Y213 HydrophobicContact CD1-CD2 4.21Å; L148-Y213 HydrophobicContact CD2-CG 4.29Å
149	M	95.4	Very high	96.4	Very high	86 Å²	86	62.7 Å²	62.7	42%	0.424	29%	0.293	S	S	.	.	H	α-helix	trans	-71.1	-31.9	-178.9	-68.1	-46	-58.9	0	0	113.4	H145 R146 Q147 N209	H145-M149 WeakPolarHBondContact NE2-CG 3.5Å; H145-M149 VanDerWaalsContact O-CG 3.28Å; H145-M149 WeakPolarHBondContact O-CG 3.27Å; H145-M149 PolarHBondContact O-N 2.87Å; R146-M149 PolarHBondContact O-N 3.01Å; Q147-M149 VanDerWaalsContact C-N 3.31Å; Q147-M149 PolarHBondContact O-N 3.16Å; M149-N209 VanDerWaalsContact CE-ND2 3.34Å; M149-N209 WeakPolarHBondContact CE-ND2 3.46Å; M149-N209 HydrophobicContact SD-CB 3.9Å; M149-N209 PolarHBondContact SD-ND2 3.16Å
150	T	95.9	Very high	96.4	Very high	99 Å²	99	62.4 Å²	62.4	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-86.9	-37.7	-177.6	49.9	0	0	0	0	113.1	R146 Q147	R146-T150 WeakPolarHBondContact O-CG2 3.39Å; R146-T150 PolarHBondContact O-N 2.76Å; R146-T150 VanDerWaalsContact O-N 3.08Å; R146-T150 PolarHBondContact O-OG1 3.29Å; Q147-T150 WeakPolarHBondContact CA-OG1 3.36Å; Q147-T150 PolarHBondContact O-N 3.36Å; Q147-T150 PolarHBondContact O-OG1 2.59Å; Q147-T150 VanDerWaalsContact O-OG1 3.13Å
151	K	97	Very high	96.2	Very high	137 Å²	137	69.6 Å²	69.6	60%	0.596	32%	0.323	S	S	*	.	H	α-helix	trans	-119.2	3	-172.5	-59	-159.5	-165.6	-173.5	0	114.3	Q147 G155	Q147-K151 PolarHBondContact O-N 2.95Å; K151-G155 PolarHBondContact O-N 2.88Å
152	G	96.9	Very high	96	Very high	32 Å²	32	76.4 Å²	76.4	33%	0.33	35%	0.353	S	S	.	.	H	α-helix	trans	64.8	-164	-176.7	0	0	0	0	0	113	L148 D154 G155	L148-G152 WeakPolarHBondContact O-CA 3.47Å; L148-G152 PolarHBondContact O-N 3.03Å; G152-D154 VanDerWaalsContact C-N 3.32Å; G152-D154 PolarHBondContact O-N 3.3Å; G152-G155 PolarHBondContact O-N 2.73Å
153	Y	97.1	Very high	95.8	Very high	39 Å²	39	78.2 Å²	78.2	15%	0.153	36%	0.364	C	S	.	.	H	α-helix	trans	-57.6	-43.4	-178.6	179.8	-100.3	0	0	0	112.3	G155 V156 R157 Y213 E217 E220	Y153-G155 PolarHBondContact O-N 3.15Å; Y153-V156 CarbonylContact O-C 3.59Å; Y153-V156 WeakPolarHBondContact O-CG2 3.28Å; Y153-V156 PolarHBondContact O-N 3.25Å; Y153-R157 HydrophobicContact CD1-CB 4.32Å; Y153-R157 HydrophobicContact CE1-CB 3.93Å; Y153-R157 HydrophobicContact CE1-CG 3.75Å; Y153-R157 PolarHBondContact O-N 3.36Å; Y153-Y213 AromaticContact CD2-CD2 3.91Å; Y153-Y213 HydrophobicContact CD2-CD2 3.91Å; Y153-Y213 HydrophobicContact CD2-CE2 4.13Å; Y153-Y213 HydrophobicContact CE2-CD2 4.14Å; Y153-Y213 AromaticContact CE2-CE2 3.95Å; Y153-Y213 HydrophobicContact CE2-CE2 3.95Å; Y153-E217 HydrophobicContact CE2-CB 4.08Å; Y153-E217 WeakPolarHBondContact CE2-OE2 3.3Å; Y153-E217 VanDerWaalsContact CZ-OE2 3.25Å; Y153-E217 PolarHBondContact OH-OE2 3.33Å; Y153-E220 HydrophobicContact CE1-CB 4.25Å; Y153-E220 HydrophobicContact CE1-CG 4.38Å; Y153-E220 WeakPolarHBondContact OH-CB 3.23Å; Y153-E220 VanDerWaalsContact OH-CG 3.29Å; Y153-E220 WeakPolarHBondContact OH-CG 3.24Å
154	D	96.4	Very high	95.8	Very high	129 Å²	129	78.4 Å²	78.4	69%	0.69	37%	0.368	S	S	*	.	H	α-helix	trans	-60.4	-32.7	-177.8	-69.6	-41.4	0	0	0	113	G152 V156	G152-D154 VanDerWaalsContact C-N 3.32Å; G152-D154 PolarHBondContact O-N 3.3Å; D154-V156 VanDerWaalsContact C-N 3.26Å; D154-V156 PolarHBondContact O-N 3.07Å
155	G	97.1	Very high	95.7	Very high	20 Å²	20	78.5 Å²	78.5	21%	0.206	37%	0.369	C	S	.	.	H	α-helix	trans	-69.3	-20.6	176.5	0	0	0	0	0	114.9	Q147 K151 G152 Y153 W159	Q147-G155 WeakPolarHBondContact CG-O 3.42Å; Q147-G155 PolarHBondContact NE2-O 2.81Å; K151-G155 PolarHBondContact O-N 2.88Å; G152-G155 PolarHBondContact O-N 2.73Å; Y153-G155 PolarHBondContact O-N 3.15Å; G155-W159 PolarHBondContact O-NE1 3.07Å
156	V	97.3	Very high	95.7	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-117.3	-6.1	180	-62.7	0	0	0	0	114.2	F144 Q147 L148 Y153 D154 R158 W159 Y213	F144-V156 HydrophobicContact CD2-CB 4.12Å; F144-V156 HydrophobicContact CD2-CG1 4.02Å; F144-V156 HydrophobicContact CE2-CB 3.72Å; F144-V156 HydrophobicContact CE2-CG1 4.02Å; F144-V156 HydrophobicContact CE2-CG2 3.9Å; F144-V156 HydrophobicContact CZ-CG2 4.34Å; Q147-V156 HydrophobicContact CB-CG1 3.72Å; Q147-V156 HydrophobicContact CG-CG1 3.53Å; L148-V156 HydrophobicContact CB-CG1 4.09Å; L148-V156 HydrophobicContact CB-CG2 4.33Å; L148-V156 HydrophobicContact CD1-CG2 3.83Å; Y153-V156 CarbonylContact O-C 3.59Å; Y153-V156 WeakPolarHBondContact O-CG2 3.28Å; Y153-V156 PolarHBondContact O-N 3.25Å; D154-V156 VanDerWaalsContact C-N 3.26Å; D154-V156 PolarHBondContact O-N 3.07Å; V156-R158 PolarHBondContact O-N 3.38Å; V156-W159 VanDerWaalsContact CA-CD1 3.49Å; V156-W159 HydrophobicContact CB-CG 4.28Å; V156-W159 VanDerWaalsContact O-CB 3.28Å; V156-W159 WeakPolarHBondContact O-CB 3.4Å; V156-W159 PolarHBondContact O-N 2.86Å; V156-Y213 HydrophobicContact CG2-CD2 4Å; V156-Y213 HydrophobicContact CG2-CE2 3.9Å
157	R	95.4	Very high	95.7	Very high	110 Å²	110	76 Å²	76	42%	0.415	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-30.6	-177.5	-178.9	177.2	177	-167.3	0.6	114.5	Y153 E220	Y153-R157 HydrophobicContact CD1-CB 4.32Å; Y153-R157 HydrophobicContact CE1-CB 3.93Å; Y153-R157 HydrophobicContact CE1-CG 3.75Å; Y153-R157 PolarHBondContact O-N 3.36Å; R157-E220 IonicContact CZ-OE1 3.36Å; R157-E220 IonicContact CZ-OE2 3.23Å; R157-E220 IonicContact NE-OE1 3.78Å; R157-E220 PolarHBondContact NE-OE1 3.22Å; R157-E220 IonicContact NE-OE2 3.81Å; R157-E220 IonicContact NH2-OE1 2.93Å; R157-E220 PolarHBondContact NH2-OE1 2.87Å; R157-E220 IonicContact NH2-OE2 2.71Å
158	R	95.3	Very high	95.4	Very high	210 Å²	210	75.4 Å²	75.4	79%	0.792	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-11.3	-180	-65.5	-176.3	-179.7	176.4	1.2	114.4	V156 T160 K161	V156-R158 PolarHBondContact O-N 3.38Å; R158-T160 PolarHBondContact O-N 3.13Å; R158-K161 VanDerWaalsContact O-CB 3.26Å; R158-K161 WeakPolarHBondContact O-CB 3.35Å; R158-K161 PolarHBondContact O-N 3.36Å
159	W	95.7	Very high	95	Very high	107 Å²	107	76.4 Å²	76.4	41%	0.405	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-31.2	-175.3	-72.2	46.9	0	0	0	111.7	N141 F143 F144 Q147 G155 V156	N141-W159 HydrophobicContact CB-CZ3 4.15Å; F143-W159 HydrophobicContact CB-CH2 3.79Å; F143-W159 HydrophobicContact CB-CZ3 4.31Å; F144-W159 VanDerWaalsContact CA-CZ3 3.43Å; F144-W159 HydrophobicContact CB-CE3 3.95Å; F144-W159 HydrophobicContact CB-CZ3 3.79Å; F144-W159 HydrophobicContact CD2-CD2 4.34Å; F144-W159 AromaticContact CD2-CE3 3.95Å; F144-W159 HydrophobicContact CD2-CE3 3.95Å; F144-W159 HydrophobicContact CG-CE3 4.47Å; Q147-W159 HydrophobicContact CB-CH2 4.27Å; Q147-W159 HydrophobicContact CB-CZ2 3.88Å; Q147-W159 HydrophobicContact CG-CZ2 3.83Å; G155-W159 PolarHBondContact O-NE1 3.07Å; V156-W159 VanDerWaalsContact CA-CD1 3.49Å; V156-W159 HydrophobicContact CB-CG 4.28Å; V156-W159 VanDerWaalsContact O-CB 3.28Å; V156-W159 WeakPolarHBondContact O-CB 3.4Å; V156-W159 PolarHBondContact O-N 2.86Å
160	T	92.9	Very high	94.6	Very high	1 Å²	1	72.5 Å²	72.5	1%	0.006	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	24.6	177.3	50	0	0	0	0	111.8	L140 R158 Q162 V163 L165 Y213 E217	L140-T160 HydrophobicContact CD1-CG2 4.44Å; R158-T160 PolarHBondContact O-N 3.13Å; T160-Q162 VanDerWaalsContact C-N 3.26Å; T160-Q162 PolarHBondContact O-N 3.43Å; T160-V163 PolarHBondContact O-N 3.11Å; T160-L165 HydrophobicContact CG2-CD1 3.92Å; T160-L165 HydrophobicContact CG2-CD2 3.82Å; T160-L165 HydrophobicContact CG2-CG 3.89Å; T160-Y213 WeakPolarHBondContact CG2-OH 3.33Å; T160-Y213 PolarHBondContact OG1-OH 3.49Å; T160-E217 PolarHBondContact OG1-OE1 3.44Å
161	K	92.3	Very high	94.6	Very high	160 Å²	160	67.9 Å²	67.9	70%	0.696	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-37.4	-179.2	-175.8	-179.6	176.8	-172.6	0	112.3	R158	R158-K161 VanDerWaalsContact O-CB 3.26Å; R158-K161 WeakPolarHBondContact O-CB 3.35Å; R158-K161 PolarHBondContact O-N 3.36Å
162	Q	92.1	Very high	94.5	Very high	190 Å²	190	61.5 Å²	61.5	89%	0.888	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	6.6	-176.7	-64.3	178.5	-4	0	0	113.1	T160	T160-Q162 VanDerWaalsContact C-N 3.26Å; T160-Q162 PolarHBondContact O-N 3.43Å
163	V	93.6	Very high	94.5	Very high	41 Å²	41	60.1 Å²	60.1	25%	0.248	28%	0.284	C	S	.	.			trans	-129.6	124.9	-175.8	-176.6	0	0	0	0	109.1	T160 L165	T160-V163 PolarHBondContact O-N 3.11Å; V163-L165 HydrophobicContact CG1-CD2 4.15Å; V163-L165 PolarHBondContact O-N 3.37Å
164	D	95.5	Very high	94.5	Very high	78 Å²	78	58.3 Å²	58.3	42%	0.417	28%	0.277	S	S	.	.			trans	-83.6	102.3	166.6	-178.7	5	0	0	0	109.5	F166 S167	D164-F166 VanDerWaalsContact C-N 3.28Å; D164-F166 PolarHBondContact O-N 3.34Å; D164-F166 PolarHBondContact OD1-N 3Å; D164-S167 PolarHBondContact O-N 3.47Å; D164-S167 PolarHBondContact O-OG 3.15Å; D164-S167 PolarHBondContact OD1-N 2.99Å
165	L	96.5	Very high	94.4	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-63.5	-32.4	178.8	-67.5	-168.3	0	0	0	112.9	H138 T160 V163 S167 K168 L171 Y213 L214 E217	H138-L165 WeakPolarHBondContact CD2-CD2 3.17Å; T160-L165 HydrophobicContact CG2-CD1 3.92Å; T160-L165 HydrophobicContact CG2-CD2 3.82Å; T160-L165 HydrophobicContact CG2-CG 3.89Å; V163-L165 HydrophobicContact CG1-CD2 4.15Å; V163-L165 PolarHBondContact O-N 3.37Å; L165-S167 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 2.96Å; L165-K168 VanDerWaalsContact O-CB 3.29Å; L165-K168 WeakPolarHBondContact O-CB 3.26Å; L165-K168 WeakPolarHBondContact O-CG 3.03Å; L165-K168 PolarHBondContact O-N 2.89Å; L165-L171 HydrophobicContact CB-CD1 4.28Å; L165-L171 HydrophobicContact CB-CD2 4.36Å; L165-L171 HydrophobicContact CD1-CD1 4.09Å; L165-L171 HydrophobicContact CD2-CD2 3.97Å; L165-Y213 HydrophobicContact CD1-CE1 3.8Å; L165-Y213 WeakPolarHBondContact CD1-OH 3.46Å; L165-L214 HydrophobicContact CD1-CD2 4.25Å; L165-E217 HydrophobicContact CD1-CG 4.37Å
166	F	97.1	Very high	94.3	Very high	16 Å²	16	53.1 Å²	53.1	7%	0.07	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-82.8	-10.7	-173.9	-58.4	-70.1	0	0	0	112.8	D164 K168 E217 A218 Q223 F226	D164-F166 VanDerWaalsContact C-N 3.28Å; D164-F166 PolarHBondContact O-N 3.34Å; D164-F166 PolarHBondContact OD1-N 3Å; F166-K168 VanDerWaalsContact C-N 3.28Å; F166-E217 HydrophobicContact CE2-CB 4.41Å; F166-E217 HydrophobicContact CE2-CG 4.04Å; F166-E217 HydrophobicContact CZ-CB 4.25Å; F166-E217 HydrophobicContact CZ-CG 4.31Å; F166-A218 HydrophobicContact CE1-CB 4.07Å; F166-A218 HydrophobicContact CE2-CB 4.05Å; F166-A218 VanDerWaalsContact CZ-CA 3.48Å; F166-A218 HydrophobicContact CZ-CB 3.5Å; F166-A218 VanDerWaalsContact CZ-CB 3.5Å; F166-Q223 HydrophobicContact CD2-CB 4.12Å; F166-Q223 HydrophobicContact CD2-CG 3.85Å; F166-Q223 HydrophobicContact CE2-CB 4.36Å; F166-Q223 HydrophobicContact CE2-CG 4.41Å; F166-Q223 HydrophobicContact CG-CG 4.43Å; F166-F226 HydrophobicContact CB-CD2 3.81Å; F166-F226 HydrophobicContact CB-CE2 3.66Å; F166-F226 HydrophobicContact CB-CG 4.47Å; F166-F226 HydrophobicContact CB-CZ 4.2Å; F166-F226 HydrophobicContact CD1-CB 3.6Å; F166-F226 AromaticContact CD1-CD1 3.92Å; F166-F226 HydrophobicContact CD1-CD1 3.92Å; F166-F226 AromaticContact CD1-CD2 3.54Å; F166-F226 HydrophobicContact CD1-CD2 3.54Å; F166-F226 HydrophobicContact CD1-CE1 4.48Å; F166-F226 HydrophobicContact CD1-CE2 4.14Å; F166-F226 AromaticContact CD1-CG 3.4Å; F166-F226 HydrophobicContact CD1-CG 3.4Å; F166-F226 HydrophobicContact CE1-CB 3.52Å; F166-F226 HydrophobicContact CE1-CD2 4.31Å; F166-F226 AromaticContact CE1-CG 3.89Å; F166-F226 HydrophobicContact CE1-CG 3.89Å; F166-F226 HydrophobicContact CG-CB 4.46Å; F166-F226 AromaticContact CG-CD2 3.73Å; F166-F226 HydrophobicContact CG-CD2 3.73Å; F166-F226 HydrophobicContact CG-CE2 4.12Å; F166-F226 HydrophobicContact CG-CG 4.1Å; F166-F226 HydrophobicContact CZ-CB 4.33Å
167	S	95.2	Very high	94.1	Very high	74 Å²	74	55.6 Å²	55.6	52%	0.517	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-78.2	-11.4	167.2	73.8	0	0	0	0	113.6	D164 L165	D164-S167 PolarHBondContact O-N 3.47Å; D164-S167 PolarHBondContact O-OG 3.15Å; D164-S167 PolarHBondContact OD1-N 2.99Å; L165-S167 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 2.96Å
168	K	91.4	Very high	93.6	Very high	36 Å²	36	58.7 Å²	58.7	16%	0.157	28%	0.275	C	S	.	.			trans	-82	153.8	-176.2	-54.4	-58.1	179.9	-171.1	0	110.6	H135 K136 H138 L165 F166 L171 I188	H135-K168 VanDerWaalsContact O-CD 3.24Å; H135-K168 WeakPolarHBondContact O-CD 3.1Å; H135-K168 WeakPolarHBondContact O-CE 3.26Å; H135-K168 PolarHBondContact O-NZ 3.1Å; K136-K168 WeakPolarHBondContact O-CA 3.36Å; K136-K168 WeakPolarHBondContact O-CB 3.27Å; H138-K168 HydrophobicContact CB-CD 4.22Å; H138-K168 HydrophobicContact CB-CG 3.92Å; L165-K168 VanDerWaalsContact O-CB 3.29Å; L165-K168 WeakPolarHBondContact O-CB 3.26Å; L165-K168 WeakPolarHBondContact O-CG 3.03Å; L165-K168 PolarHBondContact O-N 2.89Å; F166-K168 VanDerWaalsContact C-N 3.28Å; K168-L171 HydrophobicContact CB-CD2 3.9Å; K168-L171 HydrophobicContact CG-CD2 4.04Å; K168-I188 WeakPolarHBondContact O-CB 3.46Å; K168-I188 WeakPolarHBondContact O-CG1 3.28Å
169	T	88.1	Confident	93.4	Very high	38 Å²	38	52.5 Å²	52.5	23%	0.233	26%	0.261	C	S	.	.	S	Bend	trans	-78.9	-35.2	170.7	58.6	0	0	0	0	110.6	K136 I188	K136-T169 HydrophobicContact CB-CG2 4.16Å; K136-T169 PolarHBondContact O-N 3.43Å; K136-T169 PolarHBondContact O-OG1 2.97Å; K136-T169 VanDerWaalsContact O-OG1 3.11Å; T169-I188 PolarHBondContact O-N 3.4Å
170	L	89	Confident	93.2	Very high	3 Å²	3	48 Å²	48	2%	0.016	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	137.4	-172.1	-178	74.5	0	0	0	111.3	V137 H138 L172 A186 A258	V137-L170 WeakPolarHBondContact CA-O 3.35Å; V137-L170 HydrophobicContact CG1-CB 4.42Å; V137-L170 HydrophobicContact CG1-CD2 3.96Å; V137-L170 HydrophobicContact CG1-CG 4.47Å; V137-L170 HydrophobicContact CG2-CB 4.21Å; V137-L170 HydrophobicContact CG2-CD2 4.12Å; H138-L170 PolarHBondContact N-O 3.31Å; L170-L172 HydrophobicContact CD2-CD2 3.6Å; L170-L172 HydrophobicContact CD2-CG 4.04Å; L170-L172 HydrophobicContact CG-CD2 4.12Å; L170-A186 WeakPolarHBondContact CA-O 3.28Å; L170-A258 HydrophobicContact CD1-CB 3.96Å; L170-A258 WeakPolarHBondContact CD1-O 3.47Å; L170-A258 VanDerWaalsContact CD2-C 3.44Å; L170-A258 HydrophobicContact CD2-CB 3.44Å; L170-A258 VanDerWaalsContact CD2-CB 3.44Å; L170-A258 WeakPolarHBondContact CD2-O 3.33Å; L170-A258 HydrophobicContact CG-CB 4.24Å
171	L	95.1	Very high	93.4	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.2	166.4	-48.2	-179.6	0	0	0	110.1	H138 L140 L165 K168 T185 A186 I188 L214	H138-L171 HydrophobicContact CB-CD2 3.78Å; H138-L171 CarbonylContact O-C 3.44Å; H138-L171 WeakPolarHBondContact O-CA 3.25Å; L140-L171 HydrophobicContact CD2-CB 4.31Å; L165-L171 HydrophobicContact CB-CD1 4.28Å; L165-L171 HydrophobicContact CB-CD2 4.36Å; L165-L171 HydrophobicContact CD1-CD1 4.09Å; L165-L171 HydrophobicContact CD2-CD2 3.97Å; K168-L171 HydrophobicContact CB-CD2 3.9Å; K168-L171 HydrophobicContact CG-CD2 4.04Å; L171-T185 CarbonylContact O-C 3.58Å; L171-T185 WeakPolarHBondContact O-CA 3.48Å; L171-A186 HydrophobicContact CB-CB 4.13Å; L171-A186 HydrophobicContact CD1-CB 4.31Å; L171-A186 HydrophobicContact CG-CB 4.39Å; L171-A186 PolarHBondContact N-O 3.02Å; L171-A186 PolarHBondContact O-N 3.24Å; L171-I188 HydrophobicContact CD1-CD1 3.8Å; L171-I188 HydrophobicContact CD2-CD1 4.5Å; L171-I188 HydrophobicContact CG-CD1 3.79Å; L171-I188 HydrophobicContact CG-CG1 4.31Å; L171-L214 HydrophobicContact CD1-CD2 3.56Å
172	L	94.8	Very high	93.4	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.2	173.4	-61.4	-180	0	0	0	108.1	I129 V137 H138 F139 L140 L170 P174 L183 T185 K255 A258	I129-L172 HydrophobicContact CG2-CD1 4.24Å; V137-L172 HydrophobicContact CG1-CD1 3.59Å; V137-L172 HydrophobicContact CG1-CG 3.72Å; H138-L172 PolarHBondContact O-N 3.45Å; F139-L172 WeakPolarHBondContact CA-O 3.48Å; F139-L172 HydrophobicContact CB-CB 4.49Å; F139-L172 HydrophobicContact CD2-CB 3.57Å; F139-L172 HydrophobicContact CD2-CD1 3.8Å; F139-L172 HydrophobicContact CD2-CG 4.36Å; F139-L172 HydrophobicContact CE2-CB 4.18Å; F139-L172 HydrophobicContact CE2-CD1 4.49Å; F139-L172 HydrophobicContact CG-CB 4.33Å; L140-L172 PolarHBondContact N-O 2.82Å; L170-L172 HydrophobicContact CD2-CD2 3.6Å; L170-L172 HydrophobicContact CD2-CG 4.04Å; L170-L172 HydrophobicContact CG-CD2 4.12Å; L172-P174 WeakPolarHBondContact O-CD 3Å; L172-L183 HydrophobicContact CB-CD1 4.2Å; L172-L183 HydrophobicContact CD2-CD2 4.28Å; L172-T185 HydrophobicContact CD2-CG2 3.57Å; L172-K255 HydrophobicContact CD1-CB 4.49Å; L172-K255 HydrophobicContact CD1-CD 4.14Å; L172-K255 HydrophobicContact CD1-CG 3.87Å; L172-A258 HydrophobicContact CD2-CB 4.1Å
173	V	96.8	Very high	93.4	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.024	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	94.8	-179.2	-167.1	0	0	0	0	108.5	L140 F144 I175 V184 I210	L140-V173 HydrophobicContact CB-CG1 4.35Å; L140-V173 HydrophobicContact CB-CG2 4.49Å; L140-V173 HydrophobicContact CD2-CG2 3.99Å; L140-V173 HydrophobicContact CG-CG2 4.22Å; F144-V173 HydrophobicContact CD1-CG1 3.92Å; F144-V173 HydrophobicContact CE1-CG1 4.33Å; V173-I175 HydrophobicContact CB-CD1 4.36Å; V173-I175 HydrophobicContact CG1-CD1 3.73Å; V173-I175 WeakPolarHBondContact O-CG1 3.46Å; V173-V184 HydrophobicContact CB-CB 4.36Å; V173-V184 PolarHBondContact N-O 3.47Å; V173-V184 PolarHBondContact O-N 3.31Å; V173-I210 HydrophobicContact CG1-CD1 3.86Å; V173-I210 HydrophobicContact CG1-CG1 4.48Å; V173-I210 HydrophobicContact CG2-CG2 4.18Å
174	P	96.3	Very high	93.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	135.4	172.2	31.3	-37.9	0	0	0	109.5	M122 F139 L140 L172 W181 V251	M122-P174 HydrophobicContact CG-CB 4.1Å; M122-P174 HydrophobicContact CG-CG 4.42Å; M122-P174 HydrophobicContact SD-CB 4.07Å; F139-P174 HydrophobicContact CD1-CG 4.41Å; F139-P174 HydrophobicContact CE1-CB 4.38Å; F139-P174 HydrophobicContact CE1-CG 3.55Å; F139-P174 HydrophobicContact CE2-CG 4.36Å; F139-P174 HydrophobicContact CZ-CB 3.88Å; F139-P174 HydrophobicContact CZ-CG 3.52Å; L140-P174 WeakPolarHBondContact O-CD 3.43Å; L140-P174 VanDerWaalsContact O-CG 3.26Å; L140-P174 WeakPolarHBondContact O-CG 3.24Å; L172-P174 WeakPolarHBondContact O-CD 3Å; P174-W181 HydrophobicContact CB-CE3 4.4Å; P174-W181 HydrophobicContact CB-CZ3 4.08Å; P174-V251 HydrophobicContact CB-CG1 4.38Å
175	I	95.8	Very high	93.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117.1	-177.4	-49.1	-64.2	0	0	0	107.7	H145 V173 L177 W181 C182 V184 V206 I210	H145-I175 HydrophobicContact CB-CD1 3.69Å; V173-I175 HydrophobicContact CB-CD1 4.36Å; V173-I175 HydrophobicContact CG1-CD1 3.73Å; V173-I175 WeakPolarHBondContact O-CG1 3.46Å; I175-L177 HydrophobicContact CG2-CD1 4.41Å; I175-L177 HydrophobicContact CG2-CD2 3.76Å; I175-L177 HydrophobicContact CG2-CG 3.83Å; I175-W181 WeakPolarHBondContact O-CA 3.47Å; I175-C182 PolarHBondContact N-O 3.43Å; I175-C182 PolarHBondContact O-N 3.31Å; I175-V184 HydrophobicContact CD1-CG2 4.38Å; I175-V184 HydrophobicContact CG1-CG2 4.07Å; I175-V206 HydrophobicContact CB-CG1 4.27Å; I175-V206 HydrophobicContact CD1-CG1 3.85Å; I175-V206 HydrophobicContact CG1-CG1 3.67Å; I175-V206 HydrophobicContact CG2-CG1 3.76Å; I175-I210 HydrophobicContact CD1-CD1 4.34Å
176	H	95.3	Very high	93.1	Very high	40 Å²	40	25.9 Å²	25.9	19%	0.185	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	111.6	173.6	-164.9	-167.8	0	0	0	109.9	D119 E178 W181	D119-H176 IonicContact OD1-ND1 2.83Å; D119-H176 IonicContact OD2-ND1 3.43Å; H176-E178 PolarHBondContact NE2-O 2.65Å; H176-E178 VanDerWaalsContact NE2-O 3.16Å; H176-W181 HydrophobicContact CB-CD2 4.24Å; H176-W181 HydrophobicContact CB-CE3 3.82Å; H176-W181 HydrophobicContact CB-CH2 3.65Å; H176-W181 HydrophobicContact CB-CZ2 4.04Å; H176-W181 HydrophobicContact CB-CZ3 3.52Å; H176-W181 AromaticContact CD2-CD2 3.97Å; H176-W181 AromaticContact CD2-CE2 3.69Å; H176-W181 AromaticContact CD2-CZ2 3.95Å; H176-W181 AromaticContact CD2-NE1 3.95Å; H176-W181 AromaticContact CG-CE2 3.85Å; H176-W181 AromaticContact CG-CH2 3.79Å; H176-W181 AromaticContact CG-CZ2 3.66Å; H176-W181 AromaticContact ND1-CH2 3.98Å; H176-W181 AromaticContact ND1-CZ2 3.7Å; H176-W181 AromaticContact NE2-NE1 3.98Å
177	L	91.3	Very high	92.8	Very high	52 Å²	52	26.7 Å²	26.7	27%	0.272	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	81	178.2	-59.7	-179.8	0	0	0	109.7	I175 V179 H180 L203 V206	I175-L177 HydrophobicContact CG2-CD1 4.41Å; I175-L177 HydrophobicContact CG2-CD2 3.76Å; I175-L177 HydrophobicContact CG2-CG 3.83Å; L177-V179 VanDerWaalsContact C-N 3.3Å; L177-V179 PolarHBondContact O-N 2.93Å; L177-H180 PolarHBondContact N-O 3.49Å; L177-H180 PolarHBondContact O-N 2.71Å; L177-L203 HydrophobicContact CD1-CD1 3.49Å; L177-L203 VanDerWaalsContact CD1-CD1 3.49Å; L177-L203 HydrophobicContact CD1-CD2 3.72Å; L177-L203 HydrophobicContact CD1-CG 4.21Å; L177-V206 HydrophobicContact CD1-CG2 4.35Å
178	E	86.7	Confident	92.6	Very high	175 Å²	175	23.3 Å²	23.3	82%	0.818	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	-78.7	-179.6	-60.5	-178.7	178.6	0	0	114.2	H176	H176-E178 PolarHBondContact NE2-O 2.65Å; H176-E178 VanDerWaalsContact NE2-O 3.16Å
179	V	89.3	Confident	92.5	Very high	81 Å²	81	26.5 Å²	26.5	49%	0.491	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	10.6	-178.4	-60.5	0	0	0	0	112.6	W116 L177	W116-V179 HydrophobicContact CH2-CB 3.57Å; W116-V179 HydrophobicContact CH2-CG1 3.45Å; W116-V179 VanDerWaalsContact CH2-CG1 3.45Å; W116-V179 HydrophobicContact CZ2-CB 4Å; W116-V179 HydrophobicContact CZ2-CG1 4.36Å; W116-V179 HydrophobicContact CZ3-CB 3.96Å; W116-V179 HydrophobicContact CZ3-CG1 3.64Å; L177-V179 VanDerWaalsContact C-N 3.3Å; L177-V179 PolarHBondContact O-N 2.93Å
180	H	93.3	Very high	92.6	Very high	11 Å²	11	27.6 Å²	27.6	5%	0.051	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	138.8	-174.6	-175.3	42.3	0	0	0	113.2	L177 D197 Q199 H201 C247	L177-H180 PolarHBondContact N-O 3.49Å; L177-H180 PolarHBondContact O-N 2.71Å; H180-D197 IonicContact CE1-OD1 3.59Å; H180-D197 PolarHBondContact CE1-OD1 2.85Å; H180-D197 VanDerWaalsContact NE2-CG 3.26Å; H180-D197 IonicContact NE2-OD1 2.72Å; H180-D197 PolarHBondContact NE2-OD1 3.08Å; H180-D197 IonicContact NE2-OD2 3.47Å; H180-D197 PolarHBondContact NE2-OD2 2.88Å; H180-Q199 PolarHBondContact CE1-OE1 3.29Å; H180-Q199 PolarHBondContact ND1-OE1 3.01Å; H180-H201 AromaticContact CD2-ND1 3.99Å; H180-H201 AromaticContact NE2-ND1 3.89Å; H180-C247 WeakPolarHBondContact ND1-CB 3.39Å
181	W	95.2	Very high	92.8	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.019	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128.6	172.4	-74.3	104	0	0	0	110.4	L117 D119 M122 S142 P174 I175 H176 C247 V251	L117-W181 PolarHBondContact O-NE1 3.1Å; D119-W181 VanDerWaalsContact OD1-CH2 3.24Å; D119-W181 WeakPolarHBondContact OD1-CH2 3.47Å; M122-W181 HydrophobicContact CB-CH2 4.19Å; M122-W181 HydrophobicContact CB-CZ2 4.47Å; M122-W181 HydrophobicContact CE-CD2 3.72Å; M122-W181 HydrophobicContact CE-CE3 3.79Å; M122-W181 HydrophobicContact CE-CG 4.1Å; M122-W181 HydrophobicContact CE-CH2 4.41Å; M122-W181 HydrophobicContact CE-CZ2 4.4Å; M122-W181 HydrophobicContact CE-CZ3 4.13Å; M122-W181 HydrophobicContact CG-CH2 3.94Å; M122-W181 HydrophobicContact CG-CZ3 3.92Å; S142-W181 VanDerWaalsContact CB-CH2 3.47Å; P174-W181 HydrophobicContact CB-CE3 4.4Å; P174-W181 HydrophobicContact CB-CZ3 4.08Å; I175-W181 WeakPolarHBondContact O-CA 3.47Å; H176-W181 HydrophobicContact CB-CD2 4.24Å; H176-W181 HydrophobicContact CB-CE3 3.82Å; H176-W181 HydrophobicContact CB-CH2 3.65Å; H176-W181 HydrophobicContact CB-CZ2 4.04Å; H176-W181 HydrophobicContact CB-CZ3 3.52Å; H176-W181 AromaticContact CD2-CD2 3.97Å; H176-W181 AromaticContact CD2-CE2 3.69Å; H176-W181 AromaticContact CD2-CZ2 3.95Å; H176-W181 AromaticContact CD2-NE1 3.95Å; H176-W181 AromaticContact CG-CE2 3.85Å; H176-W181 AromaticContact CG-CH2 3.79Å; H176-W181 AromaticContact CG-CZ2 3.66Å; H176-W181 AromaticContact ND1-CH2 3.98Å; H176-W181 AromaticContact ND1-CZ2 3.7Å; H176-W181 AromaticContact NE2-NE1 3.98Å; W181-C247 HydrophobicContact CB-CB 4.21Å; W181-C247 PolarHBondContact N-SG 3.27Å; W181-C247 VanDerWaalsContact N-SG 3.37Å; W181-C247 WeakPolarHBondContact O-CB 3.33Å; W181-V251 HydrophobicContact CB-CG2 3.98Å
182	C	93.2	Very high	92.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	170.7	166.6	68.4	0	0	0	0	110.6	I175 L195 Y196 D197 L203	I175-C182 PolarHBondContact N-O 3.43Å; I175-C182 PolarHBondContact O-N 3.31Å; C182-L195 HydrophobicContact CB-CD1 4.45Å; C182-Y196 WeakPolarHBondContact CB-O 3.27Å; C182-D197 HydrophobicContact CB-CB 4.21Å; C182-L203 HydrophobicContact CB-CD1 4.49Å
183	L	92.9	Very high	92.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.6	-176.5	-179.3	67.3	0	0	0	110.2	L172 T185 Y196 V251 T254	L172-L183 HydrophobicContact CB-CD1 4.2Å; L172-L183 HydrophobicContact CD2-CD2 4.28Å; L183-T185 HydrophobicContact CD2-CG2 3.9Å; L183-T185 HydrophobicContact CG-CG2 3.95Å; L183-Y196 HydrophobicContact CD2-CD2 4.46Å; L183-Y196 PolarHBondContact N-O 3.45Å; L183-Y196 PolarHBondContact O-N 2.9Å; L183-V251 HydrophobicContact CB-CG1 4.14Å; L183-V251 HydrophobicContact CB-CG2 4.1Å; L183-V251 HydrophobicContact CD1-CG1 4.28Å; L183-T254 HydrophobicContact CD2-CG2 3.72Å
184	V	93.6	Very high	92.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.7	162.7	175.9	0	0	0	0	108.6	V173 I175 I193 C194 L195 V206 I210	V173-V184 HydrophobicContact CB-CB 4.36Å; V173-V184 PolarHBondContact N-O 3.47Å; V173-V184 PolarHBondContact O-N 3.31Å; I175-V184 HydrophobicContact CD1-CG2 4.38Å; I175-V184 HydrophobicContact CG1-CG2 4.07Å; V184-I193 HydrophobicContact CG1-CG2 3.67Å; V184-C194 CarbonylContact C-O 3.59Å; V184-C194 WeakPolarHBondContact CA-O 3.36Å; V184-L195 HydrophobicContact CG2-CD1 3.8Å; V184-V206 HydrophobicContact CG2-CG1 3.85Å; V184-I210 HydrophobicContact CB-CG1 4.16Å; V184-I210 HydrophobicContact CG1-CB 3.98Å; V184-I210 HydrophobicContact CG1-CG1 3.94Å; V184-I210 HydrophobicContact CG1-CG2 3.97Å; V184-I210 HydrophobicContact CG2-CG1 4.29Å
185	T	92.3	Very high	91.8	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	148.2	171.4	72.3	0	0	0	0	110.7	L171 L172 L183 I193 C194 Y196 A258	L171-T185 CarbonylContact O-C 3.58Å; L171-T185 WeakPolarHBondContact O-CA 3.48Å; L172-T185 HydrophobicContact CD2-CG2 3.57Å; L183-T185 HydrophobicContact CD2-CG2 3.9Å; L183-T185 HydrophobicContact CG-CG2 3.95Å; T185-I193 CarbonylContact O-C 3.6Å; T185-I193 VanDerWaalsContact O-CA 3.24Å; T185-I193 WeakPolarHBondContact O-CA 3.4Å; T185-C194 PolarHBondContact N-O 3.46Å; T185-C194 PolarHBondContact O-N 3.5Å; T185-Y196 HydrophobicContact CG2-CD2 3.83Å; T185-Y196 HydrophobicContact CG2-CE2 3.48Å; T185-Y196 VanDerWaalsContact CG2-CE2 3.48Å; T185-Y196 WeakPolarHBondContact OG1-CE2 3.41Å; T185-A258 HydrophobicContact CG2-CB 3.91Å
186	A	93.5	Very high	91.4	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	108.7	169.6	0	0	0	0	0	109.5	L170 L171 I188 K192 I193 L214 W230	L170-A186 WeakPolarHBondContact CA-O 3.28Å; L171-A186 HydrophobicContact CB-CB 4.13Å; L171-A186 HydrophobicContact CD1-CB 4.31Å; L171-A186 HydrophobicContact CG-CB 4.39Å; L171-A186 PolarHBondContact N-O 3.02Å; L171-A186 PolarHBondContact O-N 3.24Å; A186-I188 PolarHBondContact O-N 3.43Å; A186-K192 CarbonylContact C-O 3.6Å; A186-K192 WeakPolarHBondContact CA-O 3.44Å; A186-I193 HydrophobicContact CB-CG1 4.2Å; A186-L214 HydrophobicContact CB-CD1 3.64Å; A186-W230 HydrophobicContact CB-CH2 4.38Å; A186-W230 HydrophobicContact CB-CZ3 4.04Å
187	D	90.3	Very high	91.2	Very high	33 Å²	33	33.5 Å²	33.5	18%	0.176	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	112	166.6	-174.5	-37.3	0	0	0	107.6	S189 A190 K191 K192	D187-S189 PolarHBondContact OD1-N 2.95Å; D187-A190 HydrophobicContact CB-CB 4.09Å; D187-A190 PolarHBondContact OD1-N 2.64Å; D187-K191 CarbonylContact O-C 3.53Å; D187-K191 VanDerWaalsContact O-CA 3.24Å; D187-K191 WeakPolarHBondContact O-CA 3.44Å; D187-K191 PolarHBondContact O-N 3.38Å; D187-K192 HydrophobicContact CB-CB 4.38Å; D187-K192 PolarHBondContact N-O 3.45Å; D187-K192 PolarHBondContact O-N 2.89Å
188	I	91.6	Very high	91	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.015	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-37.7	-174.8	-59.1	-54.6	0	0	0	110.9	K168 T169 L171 A186 K191 F226 W230	K168-I188 WeakPolarHBondContact O-CB 3.46Å; K168-I188 WeakPolarHBondContact O-CG1 3.28Å; T169-I188 PolarHBondContact O-N 3.4Å; L171-I188 HydrophobicContact CD1-CD1 3.8Å; L171-I188 HydrophobicContact CD2-CD1 4.5Å; L171-I188 HydrophobicContact CG-CD1 3.79Å; L171-I188 HydrophobicContact CG-CG1 4.31Å; A186-I188 PolarHBondContact O-N 3.43Å; I188-K191 PolarHBondContact O-N 2.82Å; I188-F226 HydrophobicContact CG2-CD1 4.24Å; I188-F226 HydrophobicContact CG2-CE1 3.51Å; I188-F226 HydrophobicContact CG2-CZ 3.91Å; I188-W230 HydrophobicContact CD1-CH2 3.85Å
189	S	89.1	Confident	91.1	Very high	102 Å²	102	25.8 Å²	25.8	71%	0.713	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-44.3	-176.1	-61.6	0	0	0	0	111	D187 K191	D187-S189 PolarHBondContact OD1-N 2.95Å; S189-K191 PolarHBondContact O-N 3.34Å
190	A	88.5	Confident	90.5	Very high	61 Å²	61	24.4 Å²	24.4	50%	0.504	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-7.2	176.8	0	0	0	0	0	113.3	D187 K192	D187-A190 HydrophobicContact CB-CB 4.09Å; D187-A190 PolarHBondContact OD1-N 2.64Å; A190-K192 HydrophobicContact CB-CB 4.08Å; A190-K192 PolarHBondContact O-N 3.36Å
191	K	94.9	Very high	89.6	Confident	47 Å²	47	28.5 Å²	28.5	20%	0.204	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	48	-169.8	-59.4	179.4	173.7	-170.7	0	111.4	D187 I188 S189 S225 D228 G229 W230 T231	D187-K191 CarbonylContact O-C 3.53Å; D187-K191 VanDerWaalsContact O-CA 3.24Å; D187-K191 WeakPolarHBondContact O-CA 3.44Å; D187-K191 PolarHBondContact O-N 3.38Å; I188-K191 PolarHBondContact O-N 2.82Å; S189-K191 PolarHBondContact O-N 3.34Å; K191-S225 WeakPolarHBondContact CE-O 3.41Å; K191-S225 PolarHBondContact NZ-O 3.4Å; K191-D228 WeakPolarHBondContact CD-O 3.39Å; K191-D228 PolarHBondContact NZ-O 3.1Å; K191-D228 IonicContact NZ-OD1 3.67Å; K191-G229 WeakPolarHBondContact CB-O 3.24Å; K191-W230 VanDerWaalsContact CA-CE3 3.47Å; K191-W230 HydrophobicContact CB-CD2 3.89Å; K191-W230 HydrophobicContact CB-CE3 3.95Å; K191-W230 HydrophobicContact CB-CG 4.21Å; K191-W230 HydrophobicContact CB-CZ3 4.38Å; K191-W230 CarbonylContact O-C 3.51Å; K191-W230 WeakPolarHBondContact O-CA 3.43Å; K191-T231 PolarHBondContact O-N 2.97Å
192	K	92.3	Very high	88.3	Confident	88 Å²	88	33.2 Å²	33.2	38%	0.383	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.8	-173.7	-174.1	176.5	178	-177.2	0	110.5	A186 D187 A190 S233	A186-K192 CarbonylContact C-O 3.6Å; A186-K192 WeakPolarHBondContact CA-O 3.44Å; D187-K192 HydrophobicContact CB-CB 4.38Å; D187-K192 PolarHBondContact N-O 3.45Å; D187-K192 PolarHBondContact O-N 2.89Å; A190-K192 HydrophobicContact CB-CB 4.08Å; A190-K192 PolarHBondContact O-N 3.36Å; K192-S233 WeakPolarHBondContact CE-OG 3.49Å
193	I	92.6	Very high	87.8	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126	173.6	-66.5	171.1	0	0	0	108.7	V184 T185 A186 A207 L211 L214 W230 T231 V232 S233	V184-I193 HydrophobicContact CG1-CG2 3.67Å; T185-I193 CarbonylContact O-C 3.6Å; T185-I193 VanDerWaalsContact O-CA 3.24Å; T185-I193 WeakPolarHBondContact O-CA 3.4Å; A186-I193 HydrophobicContact CB-CG1 4.2Å; I193-A207 HydrophobicContact CG2-CB 3.98Å; I193-L211 VanDerWaalsContact CD1-CA 3.48Å; I193-L211 HydrophobicContact CD1-CB 3.41Å; I193-L211 VanDerWaalsContact CD1-CB 3.41Å; I193-L211 HydrophobicContact CD1-CD1 3.67Å; I193-L211 HydrophobicContact CD1-CG 4.02Å; I193-L214 HydrophobicContact CD1-CD1 4.24Å; I193-W230 HydrophobicContact CD1-CE3 4.09Å; I193-W230 HydrophobicContact CG1-CE3 3.84Å; I193-W230 HydrophobicContact CG1-CZ3 4.13Å; I193-T231 PolarHBondContact N-O 2.96Å; I193-V232 HydrophobicContact CB-CG2 4.34Å; I193-V232 HydrophobicContact CG2-CG1 4.41Å; I193-V232 CarbonylContact O-C 3.5Å; I193-V232 WeakPolarHBondContact O-CA 3.41Å; I193-S233 PolarHBondContact O-N 3.17Å; I193-S233 PolarHBondContact O-OG 3.03Å
194	C	88.1	Confident	87.2	Confident	10 Å²	10	37.5 Å²	37.5	7%	0.068	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.8	175	-60.5	0	0	0	0	109.9	V184 T185 Y196 S233 V235	V184-C194 CarbonylContact C-O 3.59Å; V184-C194 WeakPolarHBondContact CA-O 3.36Å; T185-C194 PolarHBondContact N-O 3.46Å; T185-C194 PolarHBondContact O-N 3.5Å; C194-Y196 HydrophobicContact CB-CD2 4.31Å; C194-Y196 HydrophobicContact CB-CE2 3.52Å; C194-S233 WeakPolarHBondContact CA-O 3.07Å; C194-S233 PolarHBondContact SG-OG 3.38Å; C194-V235 HydrophobicContact CB-CG2 4.06Å
195	L	88.8	Confident	87	Confident	8 Å²	8	44 Å²	44	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.9	166.1	174.8	69.8	0	0	0	109	C182 V184 L203 A207 S233 F234	C182-L195 HydrophobicContact CB-CD1 4.45Å; V184-L195 HydrophobicContact CG2-CD1 3.8Å; L195-L203 HydrophobicContact CD2-CB 3.79Å; L195-A207 HydrophobicContact CB-CB 4.44Å; L195-S233 PolarHBondContact N-O 3.49Å; L195-F234 HydrophobicContact CB-CD1 4.12Å; L195-F234 HydrophobicContact CB-CE1 4.3Å; L195-F234 HydrophobicContact CD2-CD1 4.14Å; L195-F234 HydrophobicContact CD2-CE1 4.29Å
196	Y	87.6	Confident	87	Confident	14 Å²	14	44.3 Å²	44.3	6%	0.055	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.4	172.9	-57.9	-86.3	0	0	0	109.1	C182 L183 T185 C194 V235 I238 T254 I257	C182-Y196 WeakPolarHBondContact CB-O 3.27Å; L183-Y196 HydrophobicContact CD2-CD2 4.46Å; L183-Y196 PolarHBondContact N-O 3.45Å; L183-Y196 PolarHBondContact O-N 2.9Å; T185-Y196 HydrophobicContact CG2-CD2 3.83Å; T185-Y196 HydrophobicContact CG2-CE2 3.48Å; T185-Y196 VanDerWaalsContact CG2-CE2 3.48Å; T185-Y196 WeakPolarHBondContact OG1-CE2 3.41Å; C194-Y196 HydrophobicContact CB-CD2 4.31Å; C194-Y196 HydrophobicContact CB-CE2 3.52Å; Y196-V235 HydrophobicContact CD1-CB 4.07Å; Y196-V235 HydrophobicContact CD1-CG1 4.49Å; Y196-V235 HydrophobicContact CD1-CG2 4.13Å; Y196-V235 HydrophobicContact CE1-CB 3.87Å; Y196-V235 HydrophobicContact CE1-CG1 4.07Å; Y196-V235 HydrophobicContact CE1-CG2 3.57Å; Y196-I238 HydrophobicContact CD1-CD1 4.36Å; Y196-I238 HydrophobicContact CD1-CG2 3.84Å; Y196-I238 HydrophobicContact CE1-CG2 4.24Å; Y196-T254 HydrophobicContact CD1-CG2 3.68Å; Y196-T254 HydrophobicContact CD2-CG2 3.85Å; Y196-T254 HydrophobicContact CE1-CG2 4.25Å; Y196-T254 HydrophobicContact CE2-CG2 4.39Å; Y196-T254 HydrophobicContact CG-CG2 3.44Å; Y196-T254 VanDerWaalsContact CG-CG2 3.44Å; Y196-I257 HydrophobicContact CD1-CD1 3.68Å; Y196-I257 HydrophobicContact CE1-CB 4.34Å; Y196-I257 HydrophobicContact CE1-CD1 3.34Å; Y196-I257 HydrophobicContact CE1-CG1 4.33Å; Y196-I257 HydrophobicContact CE1-CG2 3.98Å; Y196-I257 WeakPolarHBondContact OH-CG2 3.49Å
197	D	89.6	Confident	86.9	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.053	26%	0.255	C	S	.	.			trans	-139	112.3	179.4	-175.4	-7.8	0	0	0	109.9	H180 C182 Q199 G200 H201 L203	H180-D197 IonicContact CE1-OD1 3.59Å; H180-D197 PolarHBondContact CE1-OD1 2.85Å; H180-D197 VanDerWaalsContact NE2-CG 3.26Å; H180-D197 IonicContact NE2-OD1 2.72Å; H180-D197 PolarHBondContact NE2-OD1 3.08Å; H180-D197 IonicContact NE2-OD2 3.47Å; H180-D197 PolarHBondContact NE2-OD2 2.88Å; C182-D197 HydrophobicContact CB-CB 4.21Å; D197-Q199 PolarHBondContact O-N 3.21Å; D197-Q199 PolarHBondContact OD1-N 3.37Å; D197-G200 PolarHBondContact O-N 2.94Å; D197-G200 VanDerWaalsContact O-N 3.16Å; D197-H201 VanDerWaalsContact OD2-CB 3.24Å; D197-H201 WeakPolarHBondContact OD2-CB 3.35Å; D197-H201 IonicContact OD2-CG 3.76Å; D197-H201 PolarHBondContact OD2-N 2.95Å; D197-H201 VanDerWaalsContact OD2-N 3.07Å; D197-H201 IonicContact OD2-ND1 3.92Å; D197-L203 WeakPolarHBondContact OD2-CD1 3.41Å
198	S	88.4	Confident	87.1	Confident	6 Å²	6	48.9 Å²	48.9	4%	0.042	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.1	-179.8	46.5	0	0	0	0	114.1	Q240 Q241	S198-Q240 CarbonylContact O-C 3.59Å; S198-Q240 WeakPolarHBondContact O-CA 3.34Å; S198-Q240 PolarHBondContact O-OE1 2.82Å; S198-Q241 WeakPolarHBondContact O-CG 3.36Å; S198-Q241 PolarHBondContact O-N 2.84Å; S198-Q241 PolarHBondContact OG-OE1 3.37Å
199	Q	87.8	Confident	87.3	Confident	58 Å²	58	50.3 Å²	50.3	27%	0.271	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-2.9	173.2	-66.4	-177.9	-17.9	0	0	112.7	H180 D197 H201 Q241	H180-Q199 PolarHBondContact CE1-OE1 3.29Å; H180-Q199 PolarHBondContact ND1-OE1 3.01Å; D197-Q199 PolarHBondContact O-N 3.21Å; D197-Q199 PolarHBondContact OD1-N 3.37Å; Q199-H201 VanDerWaalsContact C-N 3.33Å; Q199-H201 PolarHBondContact O-N 3.47Å; Q199-H201 PolarHBondContact OE1-CE1 3.4Å; Q199-Q241 HydrophobicContact CG-CG 3.72Å; Q199-Q241 VanDerWaalsContact CG-NE2 3.31Å
200	G	76.8	Confident	87.7	Confident	53 Å²	53	45.6 Å²	45.6	55%	0.546	24%	0.244	S	C	.	.			trans	68.5	24	175.2	0	0	0	0	0	115.2	D197	D197-G200 PolarHBondContact O-N 2.94Å; D197-G200 VanDerWaalsContact O-N 3.16Å
201	H	74.4	Confident	88.1	Confident	97 Å²	97	44 Å²	44	45%	0.449	23%	0.227	S	C	.	.			trans	-67.8	139.1	175.1	-63.6	97.4	0	0	0	110.8	H180 D197 Q199 L203	H180-H201 AromaticContact CD2-ND1 3.99Å; H180-H201 AromaticContact NE2-ND1 3.89Å; D197-H201 VanDerWaalsContact OD2-CB 3.24Å; D197-H201 WeakPolarHBondContact OD2-CB 3.35Å; D197-H201 IonicContact OD2-CG 3.76Å; D197-H201 PolarHBondContact OD2-N 2.95Å; D197-H201 VanDerWaalsContact OD2-N 3.07Å; D197-H201 IonicContact OD2-ND1 3.92Å; Q199-H201 VanDerWaalsContact C-N 3.33Å; Q199-H201 PolarHBondContact O-N 3.47Å; Q199-H201 PolarHBondContact OE1-CE1 3.4Å; H201-L203 HydrophobicContact CB-CD1 4.04Å; H201-L203 HydrophobicContact CB-CD2 4.27Å; H201-L203 HydrophobicContact CB-CG 3.74Å; H201-L203 PolarHBondContact O-N 3.39Å
202	S	69.3	Low	88.2	Confident	104 Å²	104	48.8 Å²	48.8	73%	0.727	25%	0.248	S	C	*	.			trans	-75.5	69.9	175.1	-169.3	0	0	0	0	111.4	Q204	S202-Q204 PolarHBondContact O-N 2.86Å; S202-Q204 VanDerWaalsContact O-N 3.11Å; S202-Q204 WeakPolarHBondContact OG-CG 3.36Å
203	L	80.9	Confident	88.5	Confident	37 Å²	37	45 Å²	45	19%	0.194	23%	0.231	C	C	.	.			trans	-88.1	38.6	-177	-61.4	170	0	0	0	112.8	L177 C182 L195 D197 H201 K205 V206	L177-L203 HydrophobicContact CD1-CD1 3.49Å; L177-L203 VanDerWaalsContact CD1-CD1 3.49Å; L177-L203 HydrophobicContact CD1-CD2 3.72Å; L177-L203 HydrophobicContact CD1-CG 4.21Å; C182-L203 HydrophobicContact CB-CD1 4.49Å; L195-L203 HydrophobicContact CD2-CB 3.79Å; D197-L203 WeakPolarHBondContact OD2-CD1 3.41Å; H201-L203 HydrophobicContact CB-CD1 4.04Å; H201-L203 HydrophobicContact CB-CD2 4.27Å; H201-L203 HydrophobicContact CB-CG 3.74Å; H201-L203 PolarHBondContact O-N 3.39Å; L203-K205 PolarHBondContact O-N 2.99Å; L203-V206 HydrophobicContact CB-CB 4.39Å; L203-V206 HydrophobicContact CB-CG2 3.94Å; L203-V206 VanDerWaalsContact O-CB 3.32Å; L203-V206 WeakPolarHBondContact O-CB 3.39Å; L203-V206 PolarHBondContact O-N 2.89Å
204	Q	81.1	Confident	88.7	Confident	52 Å²	52	45 Å²	45	24%	0.243	23%	0.231	C	C	.	.	H	α-helix	trans	-44.5	-39.1	178.4	-69.5	-73.6	-29.7	0	0	114	S202 V206 R208 F234	S202-Q204 PolarHBondContact O-N 2.86Å; S202-Q204 VanDerWaalsContact O-N 3.11Å; S202-Q204 WeakPolarHBondContact OG-CG 3.36Å; Q204-V206 VanDerWaalsContact C-N 3.32Å; Q204-V206 PolarHBondContact O-N 3.13Å; Q204-R208 PolarHBondContact O-N 3.31Å; Q204-F234 VanDerWaalsContact CD-CE2 3.4Å; Q204-F234 HydrophobicContact CG-CE1 4.25Å; Q204-F234 HydrophobicContact CG-CZ 4.34Å
205	K	88.9	Confident	89.2	Confident	138 Å²	138	48.3 Å²	48.3	60%	0.6	25%	0.246	S	C	*	.	H	α-helix	trans	-65	-35	179.9	-170.6	177	179.7	-178.8	0	112.3	L203 R208 N209	L203-K205 PolarHBondContact O-N 2.99Å; K205-R208 PolarHBondContact O-N 3.37Å; K205-N209 PolarHBondContact O-N 3.13Å; K205-N209 PolarHBondContact O-ND2 2.92Å; K205-N209 VanDerWaalsContact O-ND2 3.17Å; K205-N209 PolarHBondContact O-OD1 2.93Å
206	V	92	Very high	89.6	Confident	10 Å²	10	49.9 Å²	49.9	6%	0.061	26%	0.258	C	S	.	.	H	α-helix	trans	-64.3	-51.1	-177.8	179.5	0	0	0	0	110.3	I175 L177 V184 L203 Q204 R208 N209 I210	I175-V206 HydrophobicContact CB-CG1 4.27Å; I175-V206 HydrophobicContact CD1-CG1 3.85Å; I175-V206 HydrophobicContact CG1-CG1 3.67Å; I175-V206 HydrophobicContact CG2-CG1 3.76Å; L177-V206 HydrophobicContact CD1-CG2 4.35Å; V184-V206 HydrophobicContact CG2-CG1 3.85Å; L203-V206 HydrophobicContact CB-CB 4.39Å; L203-V206 HydrophobicContact CB-CG2 3.94Å; L203-V206 VanDerWaalsContact O-CB 3.32Å; L203-V206 WeakPolarHBondContact O-CB 3.39Å; L203-V206 PolarHBondContact O-N 2.89Å; Q204-V206 VanDerWaalsContact C-N 3.32Å; Q204-V206 PolarHBondContact O-N 3.13Å; V206-R208 VanDerWaalsContact C-N 3.3Å; V206-R208 PolarHBondContact O-N 3.21Å; V206-N209 WeakPolarHBondContact O-CB 3.4Å; V206-N209 PolarHBondContact O-N 2.96Å; V206-N209 VanDerWaalsContact O-N 3.1Å; V206-I210 PolarHBondContact O-N 2.98Å; V206-I210 VanDerWaalsContact O-N 3.16Å
207	A	92.4	Very high	90	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-41	176.9	0	0	0	0	0	112.2	I193 L195 N209 I210 L211 V232 F234	I193-A207 HydrophobicContact CG2-CB 3.98Å; L195-A207 HydrophobicContact CB-CB 4.44Å; A207-N209 PolarHBondContact O-N 2.84Å; A207-I210 PolarHBondContact O-N 2.67Å; A207-L211 PolarHBondContact O-N 2.71Å; A207-V232 HydrophobicContact CB-CG1 3.73Å; A207-F234 HydrophobicContact CB-CE1 4.42Å
208	R	93.7	Very high	90.4	Very high	128 Å²	128	48.8 Å²	48.8	48%	0.483	25%	0.253	S	S	.	.	H	α-helix	trans	-64.5	-35.4	175.6	-73.3	-169.4	-73.2	-91.4	4.7	113.4	Q204 K205 V206 L211 K212	Q204-R208 PolarHBondContact O-N 3.31Å; K205-R208 PolarHBondContact O-N 3.37Å; V206-R208 VanDerWaalsContact C-N 3.3Å; V206-R208 PolarHBondContact O-N 3.21Å; R208-L211 WeakPolarHBondContact O-CB 3.44Å; R208-L211 PolarHBondContact O-N 3.45Å; R208-K212 PolarHBondContact O-N 2.71Å
209	N	95.8	Very high	90.8	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-66.2	-40.7	176.2	-64.4	-26.7	0	0	0	111.2	M149 K205 V206 A207 K212 Y213	M149-N209 VanDerWaalsContact CE-ND2 3.34Å; M149-N209 WeakPolarHBondContact CE-ND2 3.46Å; M149-N209 HydrophobicContact SD-CB 3.9Å; M149-N209 PolarHBondContact SD-ND2 3.16Å; K205-N209 PolarHBondContact O-N 3.13Å; K205-N209 PolarHBondContact O-ND2 2.92Å; K205-N209 VanDerWaalsContact O-ND2 3.17Å; K205-N209 PolarHBondContact O-OD1 2.93Å; V206-N209 WeakPolarHBondContact O-CB 3.4Å; V206-N209 PolarHBondContact O-N 2.96Å; V206-N209 VanDerWaalsContact O-N 3.1Å; A207-N209 PolarHBondContact O-N 2.84Å; N209-K212 PolarHBondContact O-N 3.39Å; N209-Y213 PolarHBondContact O-N 3.41Å
210	I	97.3	Very high	91.2	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-65.3	-41.8	175.1	-59.1	-50.5	0	0	0	111	F144 L148 V173 I175 V184 V206 A207 K212 Y213 L214	F144-I210 HydrophobicContact CE1-CD1 4.24Å; L148-I210 HydrophobicContact CD2-CD1 4.24Å; V173-I210 HydrophobicContact CG1-CD1 3.86Å; V173-I210 HydrophobicContact CG1-CG1 4.48Å; V173-I210 HydrophobicContact CG2-CG2 4.18Å; I175-I210 HydrophobicContact CD1-CD1 4.34Å; V184-I210 HydrophobicContact CB-CG1 4.16Å; V184-I210 HydrophobicContact CG1-CB 3.98Å; V184-I210 HydrophobicContact CG1-CG1 3.94Å; V184-I210 HydrophobicContact CG1-CG2 3.97Å; V184-I210 HydrophobicContact CG2-CG1 4.29Å; V206-I210 PolarHBondContact O-N 2.98Å; V206-I210 VanDerWaalsContact O-N 3.16Å; A207-I210 PolarHBondContact O-N 2.67Å; I210-K212 VanDerWaalsContact C-N 3.34Å; I210-K212 PolarHBondContact O-N 3.27Å; I210-Y213 WeakPolarHBondContact O-CB 3.2Å; I210-Y213 PolarHBondContact O-N 2.71Å; I210-L214 HydrophobicContact CG2-CD1 4.42Å; I210-L214 WeakPolarHBondContact O-CG 3.45Å; I210-L214 PolarHBondContact O-N 3.3Å
211	L	97.1	Very high	92.1	Very high	28 Å²	28	58 Å²	58	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-55.9	-49.3	172.8	179	50.1	0	0	0	111.8	I193 A207 R208 Y213 L214 M215 W230 V232	I193-L211 VanDerWaalsContact CD1-CA 3.48Å; I193-L211 HydrophobicContact CD1-CB 3.41Å; I193-L211 VanDerWaalsContact CD1-CB 3.41Å; I193-L211 HydrophobicContact CD1-CD1 3.67Å; I193-L211 HydrophobicContact CD1-CG 4.02Å; A207-L211 PolarHBondContact O-N 2.71Å; R208-L211 WeakPolarHBondContact O-CB 3.44Å; R208-L211 PolarHBondContact O-N 3.45Å; L211-Y213 VanDerWaalsContact C-N 3.26Å; L211-Y213 PolarHBondContact O-N 2.67Å; L211-L214 PolarHBondContact O-N 2.87Å; L211-L214 VanDerWaalsContact O-N 3.12Å; L211-M215 HydrophobicContact CD1-CG 4.09Å; L211-M215 HydrophobicContact CD1-SD 4.18Å; L211-M215 HydrophobicContact CG-SD 4.13Å; L211-M215 WeakPolarHBondContact O-CG 3.45Å; L211-M215 PolarHBondContact O-N 3.1Å; L211-W230 HydrophobicContact CD1-CB 3.35Å; L211-W230 HydrophobicContact CD1-CD2 4.01Å; L211-W230 HydrophobicContact CD1-CG 3.42Å; L211-W230 VanDerWaalsContact CD1-CG 3.42Å; L211-W230 HydrophobicContact CD2-CB 4.33Å; L211-W230 HydrophobicContact CG-CB 4.49Å; L211-V232 HydrophobicContact CD2-CG2 3.83Å
212	K	97.2	Very high	93.1	Very high	148 Å²	148	62.4 Å²	62.4	64%	0.643	30%	0.295	S	S	*	.	H	α-helix	trans	-60	-38.1	178.8	-173.8	178.6	180	-179.7	0	111.9	R208 N209 I210 S216	R208-K212 PolarHBondContact O-N 2.71Å; N209-K212 PolarHBondContact O-N 3.39Å; I210-K212 VanDerWaalsContact C-N 3.34Å; I210-K212 PolarHBondContact O-N 3.27Å; K212-S216 WeakPolarHBondContact O-CB 3.31Å; K212-S216 PolarHBondContact O-N 2.8Å; K212-S216 VanDerWaalsContact O-N 3.11Å; K212-S216 PolarHBondContact O-OG 3.07Å
213	Y	98.1	Very high	94.4	Very high	7 Å²	7	60.6 Å²	60.6	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-50	173	163.4	-100.7	0	0	0	111.4	F144 L148 Y153 V156 T160 L165 N209 I210 L211 M215 S216 E217	F144-Y213 HydrophobicContact CE1-CD1 4.25Å; F144-Y213 HydrophobicContact CE1-CE1 4.35Å; F144-Y213 HydrophobicContact CE1-CG 4.47Å; F144-Y213 HydrophobicContact CE2-CD2 4.38Å; F144-Y213 HydrophobicContact CE2-CE1 4.26Å; F144-Y213 AromaticContact CE2-CE2 3.91Å; F144-Y213 HydrophobicContact CE2-CE2 3.91Å; F144-Y213 AromaticContact CE2-CZ 3.84Å; F144-Y213 AromaticContact CZ-CD1 3.67Å; F144-Y213 HydrophobicContact CZ-CD1 3.67Å; F144-Y213 AromaticContact CZ-CD2 3.75Å; F144-Y213 HydrophobicContact CZ-CD2 3.75Å; F144-Y213 AromaticContact CZ-CE1 3.53Å; F144-Y213 HydrophobicContact CZ-CE1 3.53Å; F144-Y213 AromaticContact CZ-CE2 3.64Å; F144-Y213 HydrophobicContact CZ-CE2 3.64Å; F144-Y213 AromaticContact CZ-CG 3.77Å; F144-Y213 HydrophobicContact CZ-CG 3.77Å; F144-Y213 AromaticContact CZ-CZ 3.53Å; L148-Y213 HydrophobicContact CD1-CD2 4.21Å; L148-Y213 HydrophobicContact CD2-CG 4.29Å; Y153-Y213 AromaticContact CD2-CD2 3.91Å; Y153-Y213 HydrophobicContact CD2-CD2 3.91Å; Y153-Y213 HydrophobicContact CD2-CE2 4.13Å; Y153-Y213 HydrophobicContact CE2-CD2 4.14Å; Y153-Y213 AromaticContact CE2-CE2 3.95Å; Y153-Y213 HydrophobicContact CE2-CE2 3.95Å; V156-Y213 HydrophobicContact CG2-CD2 4Å; V156-Y213 HydrophobicContact CG2-CE2 3.9Å; T160-Y213 WeakPolarHBondContact CG2-OH 3.33Å; T160-Y213 PolarHBondContact OG1-OH 3.49Å; L165-Y213 HydrophobicContact CD1-CE1 3.8Å; L165-Y213 WeakPolarHBondContact CD1-OH 3.46Å; N209-Y213 PolarHBondContact O-N 3.41Å; I210-Y213 WeakPolarHBondContact O-CB 3.2Å; I210-Y213 PolarHBondContact O-N 2.71Å; L211-Y213 VanDerWaalsContact C-N 3.26Å; L211-Y213 PolarHBondContact O-N 2.67Å; Y213-M215 VanDerWaalsContact C-N 3.34Å; Y213-M215 PolarHBondContact O-N 3.06Å; Y213-S216 WeakPolarHBondContact O-CB 3.27Å; Y213-S216 PolarHBondContact O-N 3.04Å; Y213-S216 VanDerWaalsContact O-N 3.07Å; Y213-E217 HydrophobicContact CE2-CB 4.38Å; Y213-E217 PolarHBondContact O-N 2.92Å
214	L	97.9	Very high	95.1	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-42	-178.9	-68.5	175.6	0	0	0	112.2	L165 L171 A186 I193 I210 L211 S216 E217 A218 W230	L165-L214 HydrophobicContact CD1-CD2 4.25Å; L171-L214 HydrophobicContact CD1-CD2 3.56Å; A186-L214 HydrophobicContact CB-CD1 3.64Å; I193-L214 HydrophobicContact CD1-CD1 4.24Å; I210-L214 HydrophobicContact CG2-CD1 4.42Å; I210-L214 WeakPolarHBondContact O-CG 3.45Å; I210-L214 PolarHBondContact O-N 3.3Å; L211-L214 PolarHBondContact O-N 2.87Å; L211-L214 VanDerWaalsContact O-N 3.12Å; L214-S216 VanDerWaalsContact C-N 3.31Å; L214-S216 PolarHBondContact O-N 2.75Å; L214-E217 PolarHBondContact O-N 3.4Å; L214-A218 VanDerWaalsContact O-CB 3.28Å; L214-A218 WeakPolarHBondContact O-CB 3.31Å; L214-A218 PolarHBondContact O-N 2.79Å; L214-W230 HydrophobicContact CD1-CH2 3.87Å; L214-W230 HydrophobicContact CD1-CZ2 4.18Å; L214-W230 HydrophobicContact CD1-CZ3 4.1Å
215	M	97.1	Very high	95.8	Very high	80 Å²	80	62.8 Å²	62.8	39%	0.394	30%	0.304	S	S	.	.	H	α-helix	trans	-62.3	-39.3	174.8	-66.9	172.9	75.7	0	0	112	L211 Y213 K219 Q227	L211-M215 HydrophobicContact CD1-CG 4.09Å; L211-M215 HydrophobicContact CD1-SD 4.18Å; L211-M215 HydrophobicContact CG-SD 4.13Å; L211-M215 WeakPolarHBondContact O-CG 3.45Å; L211-M215 PolarHBondContact O-N 3.1Å; Y213-M215 VanDerWaalsContact C-N 3.34Å; Y213-M215 PolarHBondContact O-N 3.06Å; M215-K219 PolarHBondContact O-N 3.37Å; M215-Q227 WeakPolarHBondContact CE-O 3.46Å
216	S	97.3	Very high	96.1	Very high	40 Å²	40	57.8 Å²	57.8	28%	0.28	28%	0.282	S	S	.	.	H	α-helix	trans	-69.1	-43	177.7	-56.3	0	0	0	0	111.7	K212 Y213 L214 K219 E220	K212-S216 WeakPolarHBondContact O-CB 3.31Å; K212-S216 PolarHBondContact O-N 2.8Å; K212-S216 VanDerWaalsContact O-N 3.11Å; K212-S216 PolarHBondContact O-OG 3.07Å; Y213-S216 WeakPolarHBondContact O-CB 3.27Å; Y213-S216 PolarHBondContact O-N 3.04Å; Y213-S216 VanDerWaalsContact O-N 3.07Å; L214-S216 VanDerWaalsContact C-N 3.31Å; L214-S216 PolarHBondContact O-N 2.75Å; S216-K219 PolarHBondContact O-N 3.1Å; S216-E220 WeakPolarHBondContact O-CB 3.43Å; S216-E220 PolarHBondContact O-N 2.9Å
217	E	97.9	Very high	96.3	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.009	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-42.5	174.8	-171.2	73.3	-175.7	0	0	110.8	Y153 T160 L165 F166 Y213 L214 K219 E220 K221	Y153-E217 HydrophobicContact CE2-CB 4.08Å; Y153-E217 WeakPolarHBondContact CE2-OE2 3.3Å; Y153-E217 VanDerWaalsContact CZ-OE2 3.25Å; Y153-E217 PolarHBondContact OH-OE2 3.33Å; T160-E217 PolarHBondContact OG1-OE1 3.44Å; L165-E217 HydrophobicContact CD1-CG 4.37Å; F166-E217 HydrophobicContact CE2-CB 4.41Å; F166-E217 HydrophobicContact CE2-CG 4.04Å; F166-E217 HydrophobicContact CZ-CB 4.25Å; F166-E217 HydrophobicContact CZ-CG 4.31Å; Y213-E217 HydrophobicContact CE2-CB 4.38Å; Y213-E217 PolarHBondContact O-N 2.92Å; L214-E217 PolarHBondContact O-N 3.4Å; E217-K219 VanDerWaalsContact C-N 3.32Å; E217-K219 PolarHBondContact O-N 3.02Å; E217-E220 PolarHBondContact O-N 3.41Å; E217-K221 HydrophobicContact CG-CG 4.23Å; E217-K221 WeakPolarHBondContact O-CB 3.4Å; E217-K221 VanDerWaalsContact O-CG 3.23Å; E217-K221 WeakPolarHBondContact O-CG 3.41Å; E217-K221 PolarHBondContact O-N 3.08Å; E217-K221 WeakPolarHBondContact OE1-CE 3.46Å; E217-K221 IonicContact OE1-NZ 3.84Å
218	A	97.4	Very high	96.4	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-43.1	176.5	0	0	0	0	0	111.4	F166 L214 K222 Q223 F226 Q227	F166-A218 HydrophobicContact CE1-CB 4.07Å; F166-A218 HydrophobicContact CE2-CB 4.05Å; F166-A218 VanDerWaalsContact CZ-CA 3.48Å; F166-A218 HydrophobicContact CZ-CB 3.5Å; F166-A218 VanDerWaalsContact CZ-CB 3.5Å; L214-A218 VanDerWaalsContact O-CB 3.28Å; L214-A218 WeakPolarHBondContact O-CB 3.31Å; L214-A218 PolarHBondContact O-N 2.79Å; A218-K222 PolarHBondContact O-N 3.12Å; A218-Q223 HydrophobicContact CB-CB 4.39Å; A218-Q223 PolarHBondContact O-N 3.16Å; A218-F226 HydrophobicContact CB-CB 3.95Å; A218-Q227 HydrophobicContact CB-CG 3.81Å
219	K	96.9	Very high	96.4	Very high	150 Å²	150	62 Å²	62	65%	0.652	33%	0.325	S	S	*	.	H	α-helix	trans	-62.8	-47.9	175.6	-175.1	178	179.1	178.8	0	111.8	M215 S216 E217 K221 K222	M215-K219 PolarHBondContact O-N 3.37Å; S216-K219 PolarHBondContact O-N 3.1Å; E217-K219 VanDerWaalsContact C-N 3.32Å; E217-K219 PolarHBondContact O-N 3.02Å; K219-K221 PolarHBondContact O-N 3.04Å; K219-K222 PolarHBondContact O-N 3.01Å; K219-K222 VanDerWaalsContact O-N 3.16Å
220	E	95.8	Very high	96.5	Very high	81 Å²	81	61.8 Å²	61.8	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-43.3	178.4	176.9	65.4	-167.3	0	0	112	Y153 R157 S216 E217 K222	Y153-E220 HydrophobicContact CE1-CB 4.25Å; Y153-E220 HydrophobicContact CE1-CG 4.38Å; Y153-E220 WeakPolarHBondContact OH-CB 3.23Å; Y153-E220 VanDerWaalsContact OH-CG 3.29Å; Y153-E220 WeakPolarHBondContact OH-CG 3.24Å; R157-E220 IonicContact CZ-OE1 3.36Å; R157-E220 IonicContact CZ-OE2 3.23Å; R157-E220 IonicContact NE-OE1 3.78Å; R157-E220 PolarHBondContact NE-OE1 3.22Å; R157-E220 IonicContact NE-OE2 3.81Å; R157-E220 IonicContact NH2-OE1 2.93Å; R157-E220 PolarHBondContact NH2-OE1 2.87Å; R157-E220 IonicContact NH2-OE2 2.71Å; S216-E220 WeakPolarHBondContact O-CB 3.43Å; S216-E220 PolarHBondContact O-N 2.9Å; E217-E220 PolarHBondContact O-N 3.41Å; E220-K222 PolarHBondContact O-N 2.96Å
221	K	95.4	Very high	96.3	Very high	80 Å²	80	65.5 Å²	65.5	35%	0.348	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	3.3	179	-58.2	-64.7	-179.4	168.1	0	113.4	E217 K219 Q223	E217-K221 HydrophobicContact CG-CG 4.23Å; E217-K221 WeakPolarHBondContact O-CB 3.4Å; E217-K221 VanDerWaalsContact O-CG 3.23Å; E217-K221 WeakPolarHBondContact O-CG 3.41Å; E217-K221 PolarHBondContact O-N 3.08Å; E217-K221 WeakPolarHBondContact OE1-CE 3.46Å; E217-K221 IonicContact OE1-NZ 3.84Å; K219-K221 PolarHBondContact O-N 3.04Å; K221-Q223 HydrophobicContact CB-CG 4.04Å; K221-Q223 PolarHBondContact O-N 2.77Å
222	K	96.1	Very high	96.1	Very high	188 Å²	188	66.4 Å²	66.4	82%	0.817	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	32.5	-178.1	-56.2	179.1	-179.7	178.6	0	113.6	A218 K219 E220 A224	A218-K222 PolarHBondContact O-N 3.12Å; K219-K222 PolarHBondContact O-N 3.01Å; K219-K222 VanDerWaalsContact O-N 3.16Å; E220-K222 PolarHBondContact O-N 2.96Å; K222-A224 PolarHBondContact O-N 2.94Å
223	Q	96.1	Very high	95.5	Very high	66 Å²	66	60.7 Å²	60.7	31%	0.308	33%	0.33	S	S	.	.			trans	-92.7	77.9	178.4	-72.7	-68.4	-23	0	0	110	F166 A218 K221 S225 F226	F166-Q223 HydrophobicContact CD2-CB 4.12Å; F166-Q223 HydrophobicContact CD2-CG 3.85Å; F166-Q223 HydrophobicContact CE2-CB 4.36Å; F166-Q223 HydrophobicContact CE2-CG 4.41Å; F166-Q223 HydrophobicContact CG-CG 4.43Å; A218-Q223 HydrophobicContact CB-CB 4.39Å; A218-Q223 PolarHBondContact O-N 3.16Å; K221-Q223 HydrophobicContact CB-CG 4.04Å; K221-Q223 PolarHBondContact O-N 2.77Å; Q223-S225 PolarHBondContact O-N 2.91Å; Q223-F226 HydrophobicContact CB-CD2 4.13Å; Q223-F226 PolarHBondContact O-N 2.72Å
224	A	95.5	Very high	94.5	Very high	71 Å²	71	63.6 Å²	63.6	59%	0.587	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-57.3	-35.5	-173.6	0	0	0	0	0	113.5	K222 F226 Q227	K222-A224 PolarHBondContact O-N 2.94Å; A224-F226 PolarHBondContact O-N 3.48Å; A224-F226 VanDerWaalsContact O-N 3.1Å; A224-Q227 PolarHBondContact O-N 3.21Å
225	S	95.2	Very high	93.2	Very high	64 Å²	64	65.7 Å²	65.7	45%	0.448	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-61.7	-18.9	-179.6	54	0	0	0	0	114.3	K191 Q223	K191-S225 WeakPolarHBondContact CE-O 3.41Å; K191-S225 PolarHBondContact NZ-O 3.4Å; Q223-S225 PolarHBondContact O-N 2.91Å
226	F	96.1	Very high	91.8	Very high	33 Å²	33	70 Å²	70	15%	0.145	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-110.6	9.1	-176.7	-60.1	-76.2	0	0	0	113.6	F166 I188 A218 Q223 A224 D228 W230	F166-F226 HydrophobicContact CB-CD2 3.81Å; F166-F226 HydrophobicContact CB-CE2 3.66Å; F166-F226 HydrophobicContact CB-CG 4.47Å; F166-F226 HydrophobicContact CB-CZ 4.2Å; F166-F226 HydrophobicContact CD1-CB 3.6Å; F166-F226 AromaticContact CD1-CD1 3.92Å; F166-F226 HydrophobicContact CD1-CD1 3.92Å; F166-F226 AromaticContact CD1-CD2 3.54Å; F166-F226 HydrophobicContact CD1-CD2 3.54Å; F166-F226 HydrophobicContact CD1-CE1 4.48Å; F166-F226 HydrophobicContact CD1-CE2 4.14Å; F166-F226 AromaticContact CD1-CG 3.4Å; F166-F226 HydrophobicContact CD1-CG 3.4Å; F166-F226 HydrophobicContact CE1-CB 3.52Å; F166-F226 HydrophobicContact CE1-CD2 4.31Å; F166-F226 AromaticContact CE1-CG 3.89Å; F166-F226 HydrophobicContact CE1-CG 3.89Å; F166-F226 HydrophobicContact CG-CB 4.46Å; F166-F226 AromaticContact CG-CD2 3.73Å; F166-F226 HydrophobicContact CG-CD2 3.73Å; F166-F226 HydrophobicContact CG-CE2 4.12Å; F166-F226 HydrophobicContact CG-CG 4.1Å; F166-F226 HydrophobicContact CZ-CB 4.33Å; I188-F226 HydrophobicContact CG2-CD1 4.24Å; I188-F226 HydrophobicContact CG2-CE1 3.51Å; I188-F226 HydrophobicContact CG2-CZ 3.91Å; A218-F226 HydrophobicContact CB-CB 3.95Å; Q223-F226 HydrophobicContact CB-CD2 4.13Å; Q223-F226 PolarHBondContact O-N 2.72Å; A224-F226 PolarHBondContact O-N 3.48Å; A224-F226 VanDerWaalsContact O-N 3.1Å; F226-D228 VanDerWaalsContact C-N 3.34Å; F226-W230 HydrophobicContact CD1-CZ2 4.27Å; F226-W230 PolarHBondContact O-NE1 2.97Å
227	Q	95.3	Very high	90.6	Very high	68 Å²	68	77 Å²	77	32%	0.318	40%	0.403	S	S	.	.	S	Bend	trans	-81.4	-13.3	177.6	-64.5	-178.1	35.2	0	0	113.1	M215 A218 A224	M215-Q227 WeakPolarHBondContact CE-O 3.46Å; A218-Q227 HydrophobicContact CB-CG 3.81Å; A224-Q227 PolarHBondContact O-N 3.21Å
228	D	94.6	Very high	89.6	Confident	106 Å²	106	77.7 Å²	77.7	57%	0.567	41%	0.406	S	S	*	.	S	Bend	trans	-147.4	-178.8	-179.7	64.5	36.3	0	0	0	112.8	K191 F226 W230	K191-D228 WeakPolarHBondContact CD-O 3.39Å; K191-D228 PolarHBondContact NZ-O 3.1Å; K191-D228 IonicContact NZ-OD1 3.67Å; F226-D228 VanDerWaalsContact C-N 3.34Å; D228-W230 VanDerWaalsContact C-N 3.28Å; D228-W230 PolarHBondContact O-N 3.45Å
229	G	94.8	Very high	88.9	Confident	54 Å²	54	79 Å²	79	56%	0.557	41%	0.414	S	S	*	.			trans	78	10.7	174.6	0	0	0	0	0	114.5	K191	K191-G229 WeakPolarHBondContact CB-O 3.24Å
230	W	96.6	Very high	88.4	Confident	29 Å²	29	75.9 Å²	75.9	11%	0.11	40%	0.402	C	S	.	.			trans	-79.5	138.9	178.2	-69.3	88.4	0	0	0	112.3	A186 I188 K191 I193 L211 L214 F226 D228	A186-W230 HydrophobicContact CB-CH2 4.38Å; A186-W230 HydrophobicContact CB-CZ3 4.04Å; I188-W230 HydrophobicContact CD1-CH2 3.85Å; K191-W230 VanDerWaalsContact CA-CE3 3.47Å; K191-W230 HydrophobicContact CB-CD2 3.89Å; K191-W230 HydrophobicContact CB-CE3 3.95Å; K191-W230 HydrophobicContact CB-CG 4.21Å; K191-W230 HydrophobicContact CB-CZ3 4.38Å; K191-W230 CarbonylContact O-C 3.51Å; K191-W230 WeakPolarHBondContact O-CA 3.43Å; I193-W230 HydrophobicContact CD1-CE3 4.09Å; I193-W230 HydrophobicContact CG1-CE3 3.84Å; I193-W230 HydrophobicContact CG1-CZ3 4.13Å; L211-W230 HydrophobicContact CD1-CB 3.35Å; L211-W230 HydrophobicContact CD1-CD2 4.01Å; L211-W230 HydrophobicContact CD1-CG 3.42Å; L211-W230 VanDerWaalsContact CD1-CG 3.42Å; L211-W230 HydrophobicContact CD2-CB 4.33Å; L211-W230 HydrophobicContact CG-CB 4.49Å; L214-W230 HydrophobicContact CD1-CH2 3.87Å; L214-W230 HydrophobicContact CD1-CZ2 4.18Å; L214-W230 HydrophobicContact CD1-CZ3 4.1Å; F226-W230 HydrophobicContact CD1-CZ2 4.27Å; F226-W230 PolarHBondContact O-NE1 2.97Å; D228-W230 VanDerWaalsContact C-N 3.28Å; D228-W230 PolarHBondContact O-N 3.45Å
231	T	94.3	Very high	88.1	Confident	79 Å²	79	72.8 Å²	72.8	49%	0.485	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	147.1	171.5	58.2	0	0	0	0	110.3	K191 I193	K191-T231 PolarHBondContact O-N 2.97Å; I193-T231 PolarHBondContact N-O 2.96Å
232	V	91.9	Very high	87.9	Confident	48 Å²	48	74.7 Å²	74.7	29%	0.291	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.3	175.3	-173.6	0	0	0	0	108.1	I193 A207 L211 F234	I193-V232 HydrophobicContact CB-CG2 4.34Å; I193-V232 HydrophobicContact CG2-CG1 4.41Å; I193-V232 CarbonylContact O-C 3.5Å; I193-V232 WeakPolarHBondContact O-CA 3.41Å; A207-V232 HydrophobicContact CB-CG1 3.73Å; L211-V232 HydrophobicContact CD2-CG2 3.83Å; V232-F234 HydrophobicContact CG1-CE1 4.27Å; V232-F234 HydrophobicContact CG1-CE2 4.12Å; V232-F234 HydrophobicContact CG1-CZ 3.54Å
233	S	84.3	Confident	87.7	Confident	28 Å²	28	67.2 Å²	67.2	20%	0.196	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.8	178.2	56.9	0	0	0	0	111.7	K192 I193 C194 L195	K192-S233 WeakPolarHBondContact CE-OG 3.49Å; I193-S233 PolarHBondContact O-N 3.17Å; I193-S233 PolarHBondContact O-OG 3.03Å; C194-S233 WeakPolarHBondContact CA-O 3.07Å; C194-S233 PolarHBondContact SG-OG 3.38Å; L195-S233 PolarHBondContact N-O 3.49Å
234	F	78.4	Confident	87.4	Confident	67 Å²	67	70.9 Å²	70.9	29%	0.294	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.8	177.4	-55.3	-78.2	0	0	0	106.9	L195 Q204 A207 V232 E236	L195-F234 HydrophobicContact CB-CD1 4.12Å; L195-F234 HydrophobicContact CB-CE1 4.3Å; L195-F234 HydrophobicContact CD2-CD1 4.14Å; L195-F234 HydrophobicContact CD2-CE1 4.29Å; Q204-F234 VanDerWaalsContact CD-CE2 3.4Å; Q204-F234 HydrophobicContact CG-CE1 4.25Å; Q204-F234 HydrophobicContact CG-CZ 4.34Å; A207-F234 HydrophobicContact CB-CE1 4.42Å; V232-F234 HydrophobicContact CG1-CE1 4.27Å; V232-F234 HydrophobicContact CG1-CE2 4.12Å; V232-F234 HydrophobicContact CG1-CZ 3.54Å; F234-E236 PolarHBondContact O-N 3.31Å
235	V	71.3	Confident	87.3	Confident	45 Å²	45	68.5 Å²	68.5	27%	0.273	37%	0.37	S	S	.	.			trans	-95.4	102.5	-175.9	-168.6	0	0	0	0	107.6	C194 Y196 I238	C194-V235 HydrophobicContact CB-CG2 4.06Å; Y196-V235 HydrophobicContact CD1-CB 4.07Å; Y196-V235 HydrophobicContact CD1-CG1 4.49Å; Y196-V235 HydrophobicContact CD1-CG2 4.13Å; Y196-V235 HydrophobicContact CE1-CB 3.87Å; Y196-V235 HydrophobicContact CE1-CG1 4.07Å; Y196-V235 HydrophobicContact CE1-CG2 3.57Å; V235-I238 HydrophobicContact CB-CG2 4.06Å; V235-I238 HydrophobicContact CG1-CG2 3.51Å
236	E	65.8	Low	87.2	Confident	172 Å²	172	65.7 Å²	65.7	80%	0.804	35%	0.35	S	S	*	.			trans	-83.6	-25.3	-179.7	-63.8	179.7	179.9	0	0	111.8	F234 I238	F234-E236 PolarHBondContact O-N 3.31Å; E236-I238 VanDerWaalsContact C-N 3.27Å; E236-I238 PolarHBondContact O-N 2.79Å; E236-I238 VanDerWaalsContact O-N 3.12Å
237	E	72.4	Confident	87.1	Confident	187 Å²	187	64.2 Å²	64.2	87%	0.874	34%	0.343	S	S	*	.	S	Bend	trans	-88.1	47.8	-178.9	-60.9	-176.9	177.5	0	0	112.9
238	I	77.7	Confident	87	Confident	16 Å²	16	61 Å²	61	8%	0.082	33%	0.328	C	S	.	.	S	Bend	trans	-111.7	151.1	172.9	63.9	176.7	0	0	0	112	Y196 V235 E236 Q240 I257	Y196-I238 HydrophobicContact CD1-CD1 4.36Å; Y196-I238 HydrophobicContact CD1-CG2 3.84Å; Y196-I238 HydrophobicContact CE1-CG2 4.24Å; V235-I238 HydrophobicContact CB-CG2 4.06Å; V235-I238 HydrophobicContact CG1-CG2 3.51Å; E236-I238 VanDerWaalsContact C-N 3.27Å; E236-I238 PolarHBondContact O-N 2.79Å; E236-I238 VanDerWaalsContact O-N 3.12Å; I238-Q240 PolarHBondContact O-N 2.6Å; I238-Q240 PolarHBondContact O-NE2 2.8Å; I238-I257 HydrophobicContact CG2-CD1 4.1Å
239	P	82.3	Confident	86.9	Confident	26 Å²	26	55.9 Å²	55.9	17%	0.169	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-51	124.4	170.2	-28.6	37.8	0	0	0	110.9	F250 F330 F332	P239-F250 HydrophobicContact CB-CE1 3.86Å; P239-F250 VanDerWaalsContact O-CE1 3.25Å; P239-F250 WeakPolarHBondContact O-CE1 3.38Å; P239-F330 HydrophobicContact CG-CB 4.27Å; P239-F330 HydrophobicContact CG-CD1 3.79Å; P239-F332 HydrophobicContact CB-CE2 4.43Å; P239-F332 WeakPolarHBondContact CB-O 3.44Å; P239-F332 VanDerWaalsContact CG-O 3.24Å; P239-F332 WeakPolarHBondContact CG-O 3.23Å
240	Q	87.1	Confident	86.7	Confident	85 Å²	85	53.6 Å²	53.6	40%	0.397	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-91	143.2	175.3	-61.8	-62.2	-60.6	0	0	109.4	S198 I238	S198-Q240 CarbonylContact O-C 3.59Å; S198-Q240 WeakPolarHBondContact O-CA 3.34Å; S198-Q240 PolarHBondContact O-OE1 2.82Å; I238-Q240 PolarHBondContact O-N 2.6Å; I238-Q240 PolarHBondContact O-NE2 2.8Å
241	Q	89.4	Confident	86.4	Confident	17 Å²	17	52.4 Å²	52.4	8%	0.079	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-81.6	154.1	172.7	73.4	-173.1	53.9	0	0	110.5	S198 Q199 N243 C247 F250	S198-Q241 WeakPolarHBondContact O-CG 3.36Å; S198-Q241 PolarHBondContact O-N 2.84Å; S198-Q241 PolarHBondContact OG-OE1 3.37Å; Q199-Q241 HydrophobicContact CG-CG 3.72Å; Q199-Q241 VanDerWaalsContact CG-NE2 3.31Å; Q241-N243 WeakPolarHBondContact CG-O 2.96Å; Q241-N243 PolarHBondContact NE2-O 3.1Å; Q241-C247 VanDerWaalsContact OE1-N 3.11Å; Q241-F250 HydrophobicContact CB-CD2 4.07Å; Q241-F250 HydrophobicContact CB-CE1 4.4Å; Q241-F250 HydrophobicContact CB-CE2 3.48Å; Q241-F250 VanDerWaalsContact CB-CE2 3.48Å; Q241-F250 HydrophobicContact CB-CZ 3.68Å
242	T	91.1	Very high	86.2	Confident	119 Å²	119	48.7 Å²	48.7	73%	0.73	25%	0.249	S	C	*	.	S	Bend	trans	-112.5	6.1	177.9	76.7	0	0	0	0	113.3	Q334	T242-Q334 HydrophobicContact CG2-CB 4.23Å; T242-Q334 HydrophobicContact CG2-CG 4.1Å; T242-Q334 WeakPolarHBondContact OG1-CG 3.16Å
243	N	92.1	Very high	85.7	Confident	31 Å²	31	47 Å²	47	17%	0.166	24%	0.238	C	C	.	.	S	Bend	trans	-130.2	-175.3	175.9	65	27.1	0	0	0	110.4	Q241 N245 D246	Q241-N243 WeakPolarHBondContact CG-O 2.96Å; Q241-N243 PolarHBondContact NE2-O 3.1Å; N243-N245 PolarHBondContact ND2-OD1 3.25Å; N243-N245 VanDerWaalsContact ND2-OD1 3.1Å; N243-N245 PolarHBondContact OD1-N 3.22Å; N243-N245 PolarHBondContact OD1-OD1 2.72Å; N243-D246 PolarHBondContact ND2-OD2 3.05Å; N243-D246 WeakPolarHBondContact OD1-CB 3.43Å; N243-D246 PolarHBondContact OD1-N 3.19Å; N243-D246 VanDerWaalsContact OD1-N 3.1Å; N243-D246 PolarHBondContact OD1-OD2 3.45Å
244	E	89.8	Confident	84.9	Confident	144 Å²	144	46.1 Å²	46.1	67%	0.673	23%	0.231	S	C	*	.	S	Bend	trans	-99.7	-2.2	-177	-64	-178.2	174.3	0	0	113.4	W116	W116-E244 PolarHBondContact NE1-O 3.01Å; W116-E244 VanDerWaalsContact NE1-O 3.1Å
245	N	92.7	Very high	83.8	Confident	21 Å²	21	43.3 Å²	43.3	11%	0.112	22%	0.219	C	C	.	.	S	Bend	trans	-123.6	-10.1	-162.7	52.5	46.2	0	0	0	116.6	E114 W116 N243 R341	E114-N245 WeakPolarHBondContact CB-ND2 3.21Å; E114-N245 WeakPolarHBondContact O-CB 3.3Å; E114-N245 PolarHBondContact O-ND2 3.1Å; W116-N245 HydrophobicContact CG-CB 4.44Å; W116-N245 VanDerWaalsContact NE1-CA 3.34Å; W116-N245 VanDerWaalsContact NE1-CB 3.34Å; N243-N245 PolarHBondContact ND2-OD1 3.25Å; N243-N245 VanDerWaalsContact ND2-OD1 3.1Å; N243-N245 PolarHBondContact OD1-N 3.22Å; N243-N245 PolarHBondContact OD1-OD1 2.72Å; N245-R341 PolarHBondContact O-NH2 3.32Å
246	D	94.2	Very high	82.6	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.027	22%	0.219	C	C	.	.			trans	-88.9	-4	-179.9	-73.9	-34.5	0	0	0	114.7	N243 G248 V249 F250 Q334 I337 R341	N243-D246 PolarHBondContact ND2-OD2 3.05Å; N243-D246 WeakPolarHBondContact OD1-CB 3.43Å; N243-D246 PolarHBondContact OD1-N 3.19Å; N243-D246 VanDerWaalsContact OD1-N 3.1Å; N243-D246 PolarHBondContact OD1-OD2 3.45Å; D246-G248 PolarHBondContact O-N 3.17Å; D246-V249 WeakPolarHBondContact O-CA 3.29Å; D246-V249 WeakPolarHBondContact O-CB 3.41Å; D246-V249 PolarHBondContact O-N 3.38Å; D246-F250 HydrophobicContact CB-CD2 3.99Å; D246-F250 HydrophobicContact CB-CE2 3.91Å; D246-F250 WeakPolarHBondContact O-CD2 3.35Å; D246-F250 PolarHBondContact O-N 3.32Å; D246-Q334 PolarHBondContact OD2-NE2 3.31Å; D246-I337 HydrophobicContact CB-CG2 4.06Å; D246-I337 VanDerWaalsContact OD1-CG2 3.27Å; D246-I337 WeakPolarHBondContact OD1-CG2 3.45Å; D246-I337 WeakPolarHBondContact OD2-CG2 3.44Å; D246-R341 IonicContact OD1-CZ 2.62Å; D246-R341 IonicContact OD1-NE 3.92Å; D246-R341 PolarHBondContact OD1-NE 2.95Å; D246-R341 IonicContact OD1-NH2 2.9Å; D246-R341 PolarHBondContact OD1-NH2 3.46Å
247	C	93.3	Very high	81.7	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-51.1	-38.7	-176.6	54.9	0	0	0	0	113.3	H180 W181 Q241 V249 F250 V251	H180-C247 WeakPolarHBondContact ND1-CB 3.39Å; W181-C247 HydrophobicContact CB-CB 4.21Å; W181-C247 PolarHBondContact N-SG 3.27Å; W181-C247 VanDerWaalsContact N-SG 3.37Å; W181-C247 WeakPolarHBondContact O-CB 3.33Å; Q241-C247 VanDerWaalsContact OE1-N 3.11Å; C247-V249 PolarHBondContact O-N 2.81Å; C247-F250 PolarHBondContact O-N 3.42Å; C247-V251 WeakPolarHBondContact O-CG2 3.48Å; C247-V251 PolarHBondContact O-N 2.75Å
248	G	93.6	Very high	80.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.5	-38.7	174.5	0	0	0	0	0	113.4	L117 D246 V251 L252	L117-G248 VanDerWaalsContact CD1-C 3.46Å; D246-G248 PolarHBondContact O-N 3.17Å; G248-V251 WeakPolarHBondContact O-CB 3.34Å; G248-V251 PolarHBondContact O-N 3.37Å; G248-L252 WeakPolarHBondContact O-CG 3.38Å; G248-L252 PolarHBondContact O-N 3.22Å; G248-L252 VanDerWaalsContact O-N 3.11Å
249	V	92.8	Very high	78.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.7	-41.7	176.7	-174.4	0	0	0	0	110.4	L117 D246 C247 V251 L252 E253 I337 I340 R341 I344	L117-V249 HydrophobicContact CD1-CG2 3.97Å; L117-V249 HydrophobicContact CD2-CG2 4.25Å; L117-V249 HydrophobicContact CG-CG2 4.14Å; D246-V249 WeakPolarHBondContact O-CA 3.29Å; D246-V249 WeakPolarHBondContact O-CB 3.41Å; D246-V249 PolarHBondContact O-N 3.38Å; C247-V249 PolarHBondContact O-N 2.81Å; V249-V251 VanDerWaalsContact C-N 3.32Å; V249-V251 PolarHBondContact O-N 2.95Å; V249-L252 PolarHBondContact O-N 3.1Å; V249-L252 VanDerWaalsContact O-N 3.13Å; V249-E253 PolarHBondContact O-N 3.12Å; V249-I337 HydrophobicContact CB-CD1 4.47Å; V249-I337 HydrophobicContact CB-CG2 4.3Å; V249-I337 HydrophobicContact CG1-CD1 4.02Å; V249-I337 HydrophobicContact CG1-CG2 4.09Å; V249-I337 HydrophobicContact CG2-CG2 4.36Å; V249-I340 HydrophobicContact CG1-CB 4.19Å; V249-I340 HydrophobicContact CG1-CG2 3.52Å; V249-R341 HydrophobicContact CG1-CG 4.36Å; V249-R341 HydrophobicContact CG2-CG 3.71Å; V249-I344 HydrophobicContact CG1-CD1 4.14Å
250	F	90.7	Very high	76.4	Confident	5 Å²	5	31.6 Å²	31.6	2%	0.022	17%	0.169	C	C	.	.	H	α-helix	trans	-58.3	-44.4	173.2	-82.4	-103.9	0	0	0	111	P239 Q241 D246 C247 L252 E253 T254 F332 I337	P239-F250 HydrophobicContact CB-CE1 3.86Å; P239-F250 VanDerWaalsContact O-CE1 3.25Å; P239-F250 WeakPolarHBondContact O-CE1 3.38Å; Q241-F250 HydrophobicContact CB-CD2 4.07Å; Q241-F250 HydrophobicContact CB-CE1 4.4Å; Q241-F250 HydrophobicContact CB-CE2 3.48Å; Q241-F250 VanDerWaalsContact CB-CE2 3.48Å; Q241-F250 HydrophobicContact CB-CZ 3.68Å; D246-F250 HydrophobicContact CB-CD2 3.99Å; D246-F250 HydrophobicContact CB-CE2 3.91Å; D246-F250 WeakPolarHBondContact O-CD2 3.35Å; D246-F250 PolarHBondContact O-N 3.32Å; C247-F250 PolarHBondContact O-N 3.42Å; F250-L252 VanDerWaalsContact C-N 3.3Å; F250-L252 PolarHBondContact O-N 3.48Å; F250-E253 PolarHBondContact O-N 2.92Å; F250-T254 VanDerWaalsContact O-CB 3.29Å; F250-T254 WeakPolarHBondContact O-CB 3.45Å; F250-T254 PolarHBondContact O-N 3.38Å; F250-T254 PolarHBondContact O-OG1 2.84Å; F250-F332 AromaticContact CD1-CE2 3.7Å; F250-F332 HydrophobicContact CD1-CE2 3.7Å; F250-F332 AromaticContact CD1-CZ 3.82Å; F250-F332 HydrophobicContact CD1-CZ 3.82Å; F250-F332 AromaticContact CE1-CE2 3.65Å; F250-F332 HydrophobicContact CE1-CE2 3.65Å; F250-F332 HydrophobicContact CE1-CZ 4.16Å; F250-F332 HydrophobicContact CG-CE2 4.26Å; F250-F332 HydrophobicContact CG-CZ 4.44Å; F250-F332 HydrophobicContact CZ-CE2 4.15Å; F250-I337 HydrophobicContact CD2-CD1 3.84Å; F250-I337 HydrophobicContact CE2-CD1 3.49Å; F250-I337 VanDerWaalsContact CE2-CD1 3.49Å; F250-I337 HydrophobicContact CE2-CG1 3.85Å; F250-I337 HydrophobicContact CZ-CD1 4.04Å; F250-I337 HydrophobicContact CZ-CG1 4.35Å
251	V	90.1	Very high	74.2	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.024	16%	0.158	C	C	.	.	H	α-helix	trans	-56.7	-43.2	174.5	165.1	0	0	0	0	111.9	M122 P174 W181 L183 C247 G248 V249	M122-V251 HydrophobicContact CE-CB 4.2Å; M122-V251 HydrophobicContact CE-CG1 3.93Å; M122-V251 HydrophobicContact SD-CG1 3.75Å; P174-V251 HydrophobicContact CB-CG1 4.38Å; W181-V251 HydrophobicContact CB-CG2 3.98Å; L183-V251 HydrophobicContact CB-CG1 4.14Å; L183-V251 HydrophobicContact CB-CG2 4.1Å; L183-V251 HydrophobicContact CD1-CG1 4.28Å; C247-V251 WeakPolarHBondContact O-CG2 3.48Å; C247-V251 PolarHBondContact O-N 2.75Å; G248-V251 WeakPolarHBondContact O-CB 3.34Å; G248-V251 PolarHBondContact O-N 3.37Å; V249-V251 VanDerWaalsContact C-N 3.32Å; V249-V251 PolarHBondContact O-N 2.95Å
252	L	88.5	Confident	72	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-72	-28.7	180	-66.4	-171.5	0	0	0	113.6	L117 M122 Y125 G248 V249 F250 K255 I344	L117-L252 HydrophobicContact CD1-CD1 3.77Å; L117-L252 HydrophobicContact CD1-CG 4.4Å; M122-L252 HydrophobicContact CE-CD2 4.28Å; M122-L252 HydrophobicContact CE-CG 4.31Å; M122-L252 HydrophobicContact SD-CD2 3.33Å; M122-L252 WeakPolarHBondContact SD-CD2 3.48Å; M122-L252 HydrophobicContact SD-CG 4Å; Y125-L252 HydrophobicContact CD1-CB 4.04Å; Y125-L252 HydrophobicContact CD1-CD1 3.75Å; Y125-L252 HydrophobicContact CD1-CD2 3.67Å; Y125-L252 HydrophobicContact CD1-CG 4.01Å; Y125-L252 HydrophobicContact CE1-CB 3.96Å; Y125-L252 HydrophobicContact CE1-CD1 4.33Å; Y125-L252 HydrophobicContact CE1-CD2 4.37Å; Y125-L252 HydrophobicContact CE1-CG 4.44Å; Y125-L252 HydrophobicContact CG-CD1 4.04Å; Y125-L252 HydrophobicContact CG-CD2 4.49Å; G248-L252 WeakPolarHBondContact O-CG 3.38Å; G248-L252 PolarHBondContact O-N 3.22Å; G248-L252 VanDerWaalsContact O-N 3.11Å; V249-L252 PolarHBondContact O-N 3.1Å; V249-L252 VanDerWaalsContact O-N 3.13Å; F250-L252 VanDerWaalsContact C-N 3.3Å; F250-L252 PolarHBondContact O-N 3.48Å; L252-K255 WeakPolarHBondContact O-CD 3.17Å; L252-K255 WeakPolarHBondContact O-CG 3.23Å; L252-I344 HydrophobicContact CB-CD1 4.06Å; L252-I344 HydrophobicContact CD1-CD1 4.11Å; L252-I344 HydrophobicContact CD1-CG2 4.32Å
253	E	83.2	Confident	69.3	Low	13 Å²	13	30.8 Å²	30.8	6%	0.061	17%	0.165	C	C	.	.	H	α-helix	trans	-84.9	-30.4	177.5	-158.2	64.6	-168.7	0	0	113	V249 F250 K255 Q256 F332 I340 R343	V249-E253 PolarHBondContact O-N 3.12Å; F250-E253 PolarHBondContact O-N 2.92Å; E253-K255 PolarHBondContact O-N 3.46Å; E253-Q256 PolarHBondContact O-N 3.42Å; E253-Q256 VanDerWaalsContact O-N 3.15Å; E253-F332 HydrophobicContact CB-CD1 4.4Å; E253-F332 HydrophobicContact CB-CE1 3.72Å; E253-F332 HydrophobicContact CB-CE2 4.39Å; E253-F332 HydrophobicContact CB-CZ 3.74Å; E253-F332 HydrophobicContact CG-CD1 3.55Å; E253-F332 HydrophobicContact CG-CD2 4.49Å; E253-F332 HydrophobicContact CG-CE1 3.34Å; E253-F332 HydrophobicContact CG-CE2 4.35Å; E253-F332 HydrophobicContact CG-CG 4.13Å; E253-F332 HydrophobicContact CG-CZ 3.81Å; E253-I340 HydrophobicContact CG-CD1 4.18Å; E253-I340 WeakPolarHBondContact OE2-CG2 3.25Å; E253-R343 IonicContact OE1-CZ 3.19Å; E253-R343 IonicContact OE1-NH1 3.52Å; E253-R343 PolarHBondContact OE1-NH1 3.24Å; E253-R343 IonicContact OE1-NH2 3.77Å; E253-R343 IonicContact OE2-CZ 3.03Å; E253-R343 IonicContact OE2-NH1 3.8Å; E253-R343 PolarHBondContact OE2-NH1 3.33Å; E253-R343 IonicContact OE2-NH2 2.63Å; E253-R343 PolarHBondContact OE2-NH2 3.49Å
254	T	66.7	Low	66.6	Low	9 Å²	9	31.3 Å²	31.3	6%	0.055	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-56.8	-18.1	178.1	-61.8	0	0	0	0	112.8	L183 Y196 F250 Q256 I257	L183-T254 HydrophobicContact CD2-CG2 3.72Å; Y196-T254 HydrophobicContact CD1-CG2 3.68Å; Y196-T254 HydrophobicContact CD2-CG2 3.85Å; Y196-T254 HydrophobicContact CE1-CG2 4.25Å; Y196-T254 HydrophobicContact CE2-CG2 4.39Å; Y196-T254 HydrophobicContact CG-CG2 3.44Å; Y196-T254 VanDerWaalsContact CG-CG2 3.44Å; F250-T254 VanDerWaalsContact O-CB 3.29Å; F250-T254 WeakPolarHBondContact O-CB 3.45Å; F250-T254 PolarHBondContact O-N 3.38Å; F250-T254 PolarHBondContact O-OG1 2.84Å; T254-Q256 PolarHBondContact O-N 3.14Å; T254-I257 HydrophobicContact CG2-CD1 3.72Å; T254-I257 HydrophobicContact CG2-CG1 4.32Å; T254-I257 WeakPolarHBondContact O-CB 3.46Å; T254-I257 WeakPolarHBondContact O-CG1 3.31Å; T254-I257 PolarHBondContact O-N 2.91Å
255	K	54.2	Low	64.3	Low	8 Å²	8	27.9 Å²	27.9	4%	0.035	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-53.8	-22.7	174.6	-62.4	-175.9	171	-172.5	0	113.8	Y125 I129 L172 L252 E253	Y125-K255 PolarHBondContact O-NZ 3.1Å; I129-K255 HydrophobicContact CB-CD 4.18Å; I129-K255 HydrophobicContact CD1-CB 4.3Å; I129-K255 HydrophobicContact CD1-CD 3Å; I129-K255 HydrophobicContact CD1-CG 4.25Å; I129-K255 VanDerWaalsContact CD1-NZ 3.28Å; I129-K255 HydrophobicContact CG1-CD 4.03Å; I129-K255 HydrophobicContact CG2-CD 3.99Å; L172-K255 HydrophobicContact CD1-CB 4.49Å; L172-K255 HydrophobicContact CD1-CD 4.14Å; L172-K255 HydrophobicContact CD1-CG 3.87Å; L252-K255 WeakPolarHBondContact O-CD 3.17Å; L252-K255 WeakPolarHBondContact O-CG 3.23Å; E253-K255 PolarHBondContact O-N 3.46Å
256	Q	47.4	Very low	61.5	Low	56 Å²	56	32.3 Å²	32.3	26%	0.262	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-71.1	-24.3	175.6	-157.4	162.8	93.8	0	0	113.9	E253 T254 C323 F330	E253-Q256 PolarHBondContact O-N 3.42Å; E253-Q256 VanDerWaalsContact O-N 3.15Å; T254-Q256 PolarHBondContact O-N 3.14Å; Q256-C323 HydrophobicContact CG-CB 4.18Å; Q256-F330 HydrophobicContact CB-CE2 4.33Å; Q256-F330 HydrophobicContact CB-CZ 4.17Å
257	I	45.8	Very low	58.7	Low	54 Å²	54	37.9 Å²	37.9	28%	0.277	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-40.6	177.9	-54.5	178	0	0	0	111.3	Y196 I238 T254 S259 F330	Y196-I257 HydrophobicContact CD1-CD1 3.68Å; Y196-I257 HydrophobicContact CE1-CB 4.34Å; Y196-I257 HydrophobicContact CE1-CD1 3.34Å; Y196-I257 HydrophobicContact CE1-CG1 4.33Å; Y196-I257 HydrophobicContact CE1-CG2 3.98Å; Y196-I257 WeakPolarHBondContact OH-CG2 3.49Å; I238-I257 HydrophobicContact CG2-CD1 4.1Å; T254-I257 HydrophobicContact CG2-CD1 3.72Å; T254-I257 HydrophobicContact CG2-CG1 4.32Å; T254-I257 WeakPolarHBondContact O-CB 3.46Å; T254-I257 WeakPolarHBondContact O-CG1 3.31Å; T254-I257 PolarHBondContact O-N 2.91Å; I257-S259 PolarHBondContact O-N 3.05Å; I257-F330 HydrophobicContact CB-CE2 4.02Å; I257-F330 HydrophobicContact CB-CZ 4.18Å; I257-F330 HydrophobicContact CD1-CD1 4.17Å; I257-F330 HydrophobicContact CD1-CD2 4.2Å; I257-F330 HydrophobicContact CD1-CE1 3.55Å; I257-F330 HydrophobicContact CD1-CE2 3.76Å; I257-F330 HydrophobicContact CD1-CZ 3.44Å; I257-F330 VanDerWaalsContact CD1-CZ 3.44Å; I257-F330 HydrophobicContact CG1-CD1 4.36Å; I257-F330 HydrophobicContact CG1-CD2 3.71Å; I257-F330 HydrophobicContact CG1-CE1 3.6Å; I257-F330 HydrophobicContact CG1-CE2 2.94Å; I257-F330 HydrophobicContact CG1-CG 4.44Å; I257-F330 HydrophobicContact CG1-CZ 2.9Å
258	A	41.8	Very low	55.9	Low	8 Å²	8	46.2 Å²	46.2	7%	0.066	25%	0.245	C	C	.	.	S	Bend	trans	-92	-5.5	-149.3	0	0	0	0	0	112.8	L170 L172 T185 P260	L170-A258 HydrophobicContact CD1-CB 3.96Å; L170-A258 WeakPolarHBondContact CD1-O 3.47Å; L170-A258 VanDerWaalsContact CD2-C 3.44Å; L170-A258 HydrophobicContact CD2-CB 3.44Å; L170-A258 VanDerWaalsContact CD2-CB 3.44Å; L170-A258 WeakPolarHBondContact CD2-O 3.33Å; L170-A258 HydrophobicContact CG-CB 4.24Å; L172-A258 HydrophobicContact CD2-CB 4.1Å; T185-A258 HydrophobicContact CG2-CB 3.91Å; A258-P260 VanDerWaalsContact O-CD 3.31Å; A258-P260 WeakPolarHBondContact O-CD 3.31Å
259	S	40.8	Very low	53.2	Low	20 Å²	20	48.8 Å²	48.8	14%	0.14	26%	0.262	C	S	.	.			trans	-85.7	120.7	175.6	107.4	0	0	0	0	110.8	I257 L261 L324	I257-S259 PolarHBondContact O-N 3.05Å; S259-L261 PolarHBondContact O-N 3.26Å; S259-L261 WeakPolarHBondContact OG-CB 3.32Å; S259-L261 PolarHBondContact OG-N 3.29Å; S259-L324 WeakPolarHBondContact OG-CD2 3.49Å
260	P	40.1	Very low	50.8	Low	62 Å²	62	53.2 Å²	53.2	40%	0.403	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-68	-3.4	160.9	-14.2	30.1	0	0	0	111.9	A258 S262 L263	A258-P260 VanDerWaalsContact O-CD 3.31Å; A258-P260 WeakPolarHBondContact O-CD 3.31Å; P260-S262 PolarHBondContact O-N 2.61Å; P260-L263 PolarHBondContact O-N 3.12Å
261	L	40	Very low	48.2	Very low	34 Å²	34	59.8 Å²	59.8	18%	0.178	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-67.2	-4.8	-178	-143.9	78.3	0	0	0	113.4	K136 S259 L263 A264	K136-L261 HydrophobicContact CD-CD1 3.76Å; S259-L261 PolarHBondContact O-N 3.26Å; S259-L261 WeakPolarHBondContact OG-CB 3.32Å; S259-L261 PolarHBondContact OG-N 3.29Å; L261-L263 PolarHBondContact O-N 3.48Å; L261-A264 HydrophobicContact CD1-CB 4.11Å; L261-A264 HydrophobicContact CG-CB 4.43Å; L261-A264 PolarHBondContact O-N 2.99Å
262	S	42.5	Very low	46.2	Very low	41 Å²	41	62.3 Å²	62.3	29%	0.287	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-59.4	-21.8	164	-177.4	0	0	0	0	112.8	P260 S327	P260-S262 PolarHBondContact O-N 2.61Å; S262-S327 PolarHBondContact OG-OG 3.29Å
263	L	36.2	Very low	44.2	Very low	128 Å²	128	70.1 Å²	70.1	67%	0.67	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-24.2	177.9	-118.1	87.1	0	0	0	114.1	P260 L261	P260-L263 PolarHBondContact O-N 3.12Å; L261-L263 PolarHBondContact O-N 3.48Å
264	A	35.1	Very low	42.6	Very low	43 Å²	43	74.3 Å²	74.3	36%	0.355	40%	0.403	S	S	.	.	H	α-helix	trans	-89	-22.8	-171.7	0	0	0	0	0	113.6	L261 E266 I267 F268	L261-A264 HydrophobicContact CD1-CB 4.11Å; L261-A264 HydrophobicContact CG-CB 4.43Å; L261-A264 PolarHBondContact O-N 2.99Å; A264-E266 VanDerWaalsContact C-N 3.28Å; A264-I267 PolarHBondContact O-N 2.85Å; A264-F268 PolarHBondContact O-N 3.3Å
265	I	39.9	Very low	41.7	Very low	71 Å²	71	77.1 Å²	77.1	36%	0.364	42%	0.417	S	S	.	.	H	α-helix	trans	-71.8	-26.9	174.5	-63.2	177.1	0	0	0	110.7	I267 F268 C269	I265-I267 VanDerWaalsContact C-N 3.26Å; I265-I267 PolarHBondContact O-N 2.84Å; I265-F268 PolarHBondContact O-N 2.85Å; I265-C269 WeakPolarHBondContact O-CB 3.45Å; I265-C269 PolarHBondContact O-N 3.18Å; I265-C269 VanDerWaalsContact O-N 3.08Å
266	E	35.5	Very low	41.3	Very low	115 Å²	115	79.6 Å²	79.6	54%	0.537	43%	0.431	S	S	.	.	H	α-helix	trans	-55.5	-42.6	167.9	-74.5	-174.1	150.4	0	0	111	A264 I270	A264-E266 VanDerWaalsContact C-N 3.28Å; E266-I270 WeakPolarHBondContact O-CB 3.26Å; E266-I270 WeakPolarHBondContact O-CD1 3.31Å; E266-I270 WeakPolarHBondContact O-CG1 3.22Å; E266-I270 PolarHBondContact O-N 3.41Å
267	I	33.6	Very low	41.4	Very low	122 Å²	122	81.3 Å²	81.3	63%	0.626	44%	0.441	S	S	*	.	H	α-helix	trans	-75.4	-33.3	-175.2	-58.7	176.6	0	0	0	112.4	A264 I265	A264-I267 PolarHBondContact O-N 2.85Å; I265-I267 VanDerWaalsContact C-N 3.26Å; I265-I267 PolarHBondContact O-N 2.84Å
268	F	34.8	Very low	41.7	Very low	175 Å²	175	82.5 Å²	82.5	77%	0.768	44%	0.444	S	S	*	.	H	α-helix	trans	-80.4	-33.7	-179.5	-154.2	-94.7	0	0	0	113	A264 I265 I270	A264-F268 PolarHBondContact O-N 3.3Å; I265-F268 PolarHBondContact O-N 2.85Å; F268-I270 VanDerWaalsContact C-N 3.34Å
269	C	38.6	Very low	42	Very low	54 Å²	54	85.3 Å²	85.3	37%	0.365	46%	0.461	S	S	.	.	H	α-helix	trans	-77.3	-15.8	177	-76.5	0	0	0	0	114	I265	I265-C269 WeakPolarHBondContact O-CB 3.45Å; I265-C269 PolarHBondContact O-N 3.18Å; I265-C269 VanDerWaalsContact O-N 3.08Å
270	I	40.5	Very low	42.3	Very low	94 Å²	94	88.4 Å²	88.4	48%	0.482	48%	0.475	S	S	.	.	H	α-helix	trans	-83.6	-19.4	178.7	-68.9	168.5	0	0	0	112.7	E266 F268 S272 L276	E266-I270 WeakPolarHBondContact O-CB 3.26Å; E266-I270 WeakPolarHBondContact O-CD1 3.31Å; E266-I270 WeakPolarHBondContact O-CG1 3.22Å; E266-I270 PolarHBondContact O-N 3.41Å; F268-I270 VanDerWaalsContact C-N 3.34Å; I270-S272 VanDerWaalsContact C-N 3.29Å; I270-S272 PolarHBondContact O-N 3.46Å; I270-L276 HydrophobicContact CG1-CD2 4.2Å
271	N	37.5	Very low	42.6	Very low	143 Å²	143	90.1 Å²	90.1	77%	0.765	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	6.2	-178.1	-82	-25.5	0	0	0	115.6
272	S	47.9	Very low	43.1	Very low	56 Å²	56	92.7 Å²	92.7	39%	0.392	49%	0.49	S	S	.	.	S	Bend	trans	-128.5	92.2	162.2	41.5	0	0	0	0	108.6	I270 S274 L275	I270-S272 VanDerWaalsContact C-N 3.29Å; I270-S272 PolarHBondContact O-N 3.46Å; S272-S274 PolarHBondContact O-N 3.26Å; S272-L275 PolarHBondContact O-N 3.11Å
273	F	45.4	Very low	43.2	Very low	167 Å²	167	94.5 Å²	94.5	73%	0.732	50%	0.496	S	S	*	.	H	α-helix	trans	-48.1	-27.3	-177.5	-156.4	-98.4	0	0	0	113.5	L277	F273-L277 HydrophobicContact CD1-CD1 4.11Å; F273-L277 HydrophobicContact CE1-CD1 3.92Å
274	S	50.9	Low	43.4	Very low	101 Å²	101	93.8 Å²	93.8	71%	0.706	49%	0.492	S	S	*	.	H	α-helix	trans	-73.6	-30.6	176.6	-172.7	0	0	0	0	114.9	S272 F278	S272-S274 PolarHBondContact O-N 3.26Å; S274-F278 PolarHBondContact O-N 3.31Å
275	L	47.8	Very low	43.6	Very low	68 Å²	68	97 Å²	97	36%	0.356	50%	0.499	S	S	.	.	H	α-helix	trans	-84.4	-34.2	-176.6	-154.4	77.5	0	0	0	111.1	S272 F278 V279	S272-L275 PolarHBondContact O-N 3.11Å; L275-F278 WeakPolarHBondContact O-CB 3.34Å; L275-F278 PolarHBondContact O-N 2.74Å; L275-V279 VanDerWaalsContact O-CG2 3.29Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.13Å
276	L	45.3	Very low	43.5	Very low	60 Å²	60	96.1 Å²	96.1	31%	0.314	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-45	176.4	-172.5	67.1	0	0	0	111.8	I270 F278 V279 I280	I270-L276 HydrophobicContact CG1-CD2 4.2Å; L276-F278 VanDerWaalsContact C-N 3.29Å; L276-F278 PolarHBondContact O-N 3.02Å; L276-V279 PolarHBondContact O-N 3.21Å; L276-I280 HydrophobicContact CD1-CD1 4.13Å; L276-I280 HydrophobicContact CG-CD1 3.86Å; L276-I280 WeakPolarHBondContact O-CB 3.48Å; L276-I280 VanDerWaalsContact O-CG1 3.23Å; L276-I280 WeakPolarHBondContact O-CG1 3.06Å; L276-I280 PolarHBondContact O-N 3.34Å
277	L	49.1	Very low	43.4	Very low	92 Å²	92	95.2 Å²	95.2	48%	0.482	51%	0.505	S	S	.	.	H	α-helix	trans	-63.4	-35.1	174.2	-104.5	113.3	0	0	0	112.4	F273 N281	F273-L277 HydrophobicContact CD1-CD1 4.11Å; F273-L277 HydrophobicContact CE1-CD1 3.92Å; L277-N281 WeakPolarHBondContact O-CB 3.21Å; L277-N281 PolarHBondContact O-N 3.49Å; L277-N281 PolarHBondContact O-ND2 3.42Å
278	F	51.9	Low	43.6	Very low	79 Å²	79	94.2 Å²	94.2	35%	0.346	51%	0.509	S	S	.	.	H	α-helix	trans	-68.8	-44.6	178	-172.6	-97.9	0	0	0	111.8	S274 L275 L276 F282 F301	S274-F278 PolarHBondContact O-N 3.31Å; L275-F278 WeakPolarHBondContact O-CB 3.34Å; L275-F278 PolarHBondContact O-N 2.74Å; L276-F278 VanDerWaalsContact C-N 3.29Å; L276-F278 PolarHBondContact O-N 3.02Å; F278-F282 VanDerWaalsContact O-CB 3.24Å; F278-F282 WeakPolarHBondContact O-CB 3.21Å; F278-F282 PolarHBondContact O-N 2.92Å; F278-F301 AromaticContact CE2-CE1 3.61Å; F278-F301 HydrophobicContact CE2-CE1 3.61Å; F278-F301 AromaticContact CE2-CZ 3.56Å; F278-F301 HydrophobicContact CE2-CZ 3.56Å; F278-F301 AromaticContact CZ-CE1 3.87Å; F278-F301 HydrophobicContact CZ-CE1 3.87Å; F278-F301 AromaticContact CZ-CZ 3.91Å; F278-F301 HydrophobicContact CZ-CZ 3.91Å
279	V	48.7	Very low	43.7	Very low	67 Å²	67	88.9 Å²	88.9	41%	0.406	49%	0.488	S	S	.	.	H	α-helix	trans	-68.2	-41.8	178.6	173.4	0	0	0	0	111.2	L275 L276 F282 I283	L275-V279 VanDerWaalsContact O-CG2 3.29Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.13Å; L276-V279 PolarHBondContact O-N 3.21Å; V279-F282 PolarHBondContact O-N 3.42Å; V279-I283 HydrophobicContact CG1-CD1 3.64Å; V279-I283 HydrophobicContact CG1-CG1 4.3Å; V279-I283 WeakPolarHBondContact O-CB 3.47Å; V279-I283 VanDerWaalsContact O-CG1 3.24Å; V279-I283 WeakPolarHBondContact O-CG1 3.24Å; V279-I283 PolarHBondContact O-N 2.98Å
280	I	47.9	Very low	43.7	Very low	84 Å²	84	94.1 Å²	94.1	43%	0.431	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-47.3	176.8	-69.4	170.5	0	0	0	110.9	L276 F282 I283 L284	L276-I280 HydrophobicContact CD1-CD1 4.13Å; L276-I280 HydrophobicContact CG-CD1 3.86Å; L276-I280 WeakPolarHBondContact O-CB 3.48Å; L276-I280 VanDerWaalsContact O-CG1 3.23Å; L276-I280 WeakPolarHBondContact O-CG1 3.06Å; L276-I280 PolarHBondContact O-N 3.34Å; I280-F282 VanDerWaalsContact C-N 3.32Å; I280-F282 PolarHBondContact O-N 2.85Å; I280-I283 PolarHBondContact O-N 3.48Å; I280-L284 HydrophobicContact CG2-CD1 3.88Å; I280-L284 HydrophobicContact CG2-CG 4.49Å; I280-L284 WeakPolarHBondContact O-CB 3.44Å; I280-L284 VanDerWaalsContact O-CG 3.3Å; I280-L284 WeakPolarHBondContact O-CG 3.1Å; I280-L284 PolarHBondContact O-N 3.35Å
281	N	46.1	Very low	43.6	Very low	99 Å²	99	98.5 Å²	98.5	53%	0.529	53%	0.525	S	S	.	.	H	α-helix	trans	-64.4	-36.7	177.3	-81.1	-64.2	0	0	0	112.1	L277 F285	L277-N281 WeakPolarHBondContact O-CB 3.21Å; L277-N281 PolarHBondContact O-N 3.49Å; L277-N281 PolarHBondContact O-ND2 3.42Å; N281-F285 WeakPolarHBondContact O-CB 3.46Å; N281-F285 PolarHBondContact O-N 3.31Å
282	F	49.8	Very low	43.5	Very low	88 Å²	88	100.4 Å²	100.4	39%	0.386	53%	0.527	S	S	.	.	H	α-helix	trans	-69.9	-38.9	176.9	-173.2	-99.7	0	0	0	112.8	F278 V279 I280 F285 S286 F315	F278-F282 VanDerWaalsContact O-CB 3.24Å; F278-F282 WeakPolarHBondContact O-CB 3.21Å; F278-F282 PolarHBondContact O-N 2.92Å; V279-F282 PolarHBondContact O-N 3.42Å; I280-F282 VanDerWaalsContact C-N 3.32Å; I280-F282 PolarHBondContact O-N 2.85Å; F282-F285 PolarHBondContact O-N 3.2Å; F282-S286 WeakPolarHBondContact O-CB 3.49Å; F282-S286 PolarHBondContact O-N 3.37Å; F282-S286 PolarHBondContact O-OG 2.83Å; F282-F315 HydrophobicContact CE1-CZ 4.35Å
283	I	44.5	Very low	42.8	Very low	78 Å²	78	101.2 Å²	101.2	40%	0.4	53%	0.527	S	S	.	.	H	α-helix	trans	-67.1	-43.7	176.1	-70.6	170.6	0	0	0	110.6	V279 I280 F285 S286 S287	V279-I283 HydrophobicContact CG1-CD1 3.64Å; V279-I283 HydrophobicContact CG1-CG1 4.3Å; V279-I283 WeakPolarHBondContact O-CB 3.47Å; V279-I283 VanDerWaalsContact O-CG1 3.24Å; V279-I283 WeakPolarHBondContact O-CG1 3.24Å; V279-I283 PolarHBondContact O-N 2.98Å; I280-I283 PolarHBondContact O-N 3.48Å; I283-F285 VanDerWaalsContact C-N 3.31Å; I283-F285 PolarHBondContact O-N 2.84Å; I283-S286 PolarHBondContact O-N 2.69Å; I283-S287 PolarHBondContact O-N 3.34Å; I283-S287 PolarHBondContact O-OG 3.23Å
284	L	39.9	Very low	42.4	Very low	113 Å²	113	98.7 Å²	98.7	59%	0.592	52%	0.52	S	S	*	.	H	α-helix	trans	-62.7	-38.6	175.1	-70.2	171.9	0	0	0	111.7	I280 S287	I280-L284 HydrophobicContact CG2-CD1 3.88Å; I280-L284 HydrophobicContact CG2-CG 4.49Å; I280-L284 WeakPolarHBondContact O-CB 3.44Å; I280-L284 VanDerWaalsContact O-CG 3.3Å; I280-L284 WeakPolarHBondContact O-CG 3.1Å; I280-L284 PolarHBondContact O-N 3.35Å; L284-S287 PolarHBondContact O-N 2.95Å
285	F	39.5	Very low	41.7	Very low	112 Å²	112	98.5 Å²	98.5	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-70.4	-37.6	176.2	-170.8	-106.7	0	0	0	113	N281 F282 I283 S287 S288 L289	N281-F285 WeakPolarHBondContact O-CB 3.46Å; N281-F285 PolarHBondContact O-N 3.31Å; F282-F285 PolarHBondContact O-N 3.2Å; I283-F285 VanDerWaalsContact C-N 3.31Å; I283-F285 PolarHBondContact O-N 2.84Å; F285-S287 VanDerWaalsContact C-N 3.3Å; F285-S287 PolarHBondContact O-N 3.47Å; F285-S288 PolarHBondContact O-N 3.37Å; F285-L289 HydrophobicContact CD1-CD1 3.76Å; F285-L289 HydrophobicContact CE1-CD1 3.41Å; F285-L289 VanDerWaalsContact CE1-CD1 3.41Å; F285-L289 HydrophobicContact CZ-CD1 3.94Å
286	S	37.2	Very low	41	Very low	51 Å²	51	103 Å²	103	36%	0.357	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-32.1	176.5	-56.6	0	0	0	0	112.5	F282 I283 S288 L289	F282-S286 WeakPolarHBondContact O-CB 3.49Å; F282-S286 PolarHBondContact O-N 3.37Å; F282-S286 PolarHBondContact O-OG 2.83Å; I283-S286 PolarHBondContact O-N 2.69Å; S286-S288 PolarHBondContact O-N 3.38Å; S286-L289 PolarHBondContact O-N 3.39Å
287	S	35	Very low	40.5	Very low	97 Å²	97	102.6 Å²	102.6	68%	0.678	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-14.7	178.5	-51.5	0	0	0	0	112.9	I283 L284 F285	I283-S287 PolarHBondContact O-N 3.34Å; I283-S287 PolarHBondContact O-OG 3.23Å; L284-S287 PolarHBondContact O-N 2.95Å; F285-S287 VanDerWaalsContact C-N 3.3Å; F285-S287 PolarHBondContact O-N 3.47Å
288	S	37	Very low	39.8	Very low	101 Å²	101	104 Å²	104	71%	0.706	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-4.3	-178.9	-175.5	0	0	0	0	113.6	F285 S286	F285-S288 PolarHBondContact O-N 3.37Å; S286-S288 PolarHBondContact O-N 3.38Å
289	L	37.8	Very low	39	Very low	62 Å²	62	108.1 Å²	108.1	33%	0.325	56%	0.556	S	S	.	*			trans	-107	110.7	-175.1	-78.3	168.4	0	0	0	110.9	F285 S286	F285-L289 HydrophobicContact CD1-CD1 3.76Å; F285-L289 HydrophobicContact CE1-CD1 3.41Å; F285-L289 VanDerWaalsContact CE1-CD1 3.41Å; F285-L289 HydrophobicContact CZ-CD1 3.94Å; S286-L289 PolarHBondContact O-N 3.39Å
290	E	37.4	Very low	38.2	Very low	164 Å²	164	110 Å²	110	77%	0.766	57%	0.571	S	S	*	*			trans	-54.4	139.5	162.7	-74	-177.6	164	0	0	110.2	K292	E290-K292 PolarHBondContact O-N 3.06Å
291	E	38	Very low	37.6	Very low	186 Å²	186	111.9 Å²	111.9	87%	0.869	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47	-9.3	-169.6	-129.8	172.9	-176	0	0	117
292	K	35.3	Very low	37	Very low	183 Å²	183	117.8 Å²	117.8	80%	0.796	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-5.2	-170	-64.3	179.8	-178.6	170.2	0	115.3	E290	E290-K292 PolarHBondContact O-N 3.06Å
293	N	34.6	Very low	36.4	Very low	74 Å²	74	121.9 Å²	121.9	40%	0.396	61%	0.612	S	S	.	*			trans	-122.2	6.9	-172.2	-77.6	-45.9	0	0	0	117	P295 K296	N293-P295 VanDerWaalsContact C-N 3.34Å; N293-P295 VanDerWaalsContact O-N 3.16Å; N293-K296 PolarHBondContact O-N 3.27Å; N293-K296 VanDerWaalsContact O-N 3.16Å
294	L	37.5	Very low	36.2	Very low	114 Å²	114	125.2 Å²	125.2	60%	0.597	63%	0.626	S	S	*	*	H	α-helix	trans	-48.2	-40.5	177.8	-102.9	87.6	0	0	0	116	K296	L294-K296 VanDerWaalsContact C-N 3.32Å; L294-K296 PolarHBondContact O-N 3.24Å
295	P	36.3	Very low	36.5	Very low	96 Å²	96	126.2 Å²	126.2	62%	0.623	64%	0.642	S	S	*	*	H	α-helix	trans	-75.5	-14.8	-175.6	25.3	-31.2	0	0	0	114.7	N293	N293-P295 VanDerWaalsContact C-N 3.34Å; N293-P295 VanDerWaalsContact O-N 3.16Å
296	K	33	Very low	36.5	Very low	162 Å²	162	122.8 Å²	122.8	70%	0.704	64%	0.639	S	S	*	*	H	α-helix	trans	-83.9	-32.1	177.9	-76.4	179.7	178.4	174.2	0	112.8	N293 L294 F298 F299	N293-K296 PolarHBondContact O-N 3.27Å; N293-K296 VanDerWaalsContact O-N 3.16Å; L294-K296 VanDerWaalsContact C-N 3.32Å; L294-K296 PolarHBondContact O-N 3.24Å; K296-F298 VanDerWaalsContact C-N 3.29Å; K296-F298 PolarHBondContact O-N 3.38Å; K296-F299 PolarHBondContact O-N 3.49Å
297	C	34.8	Very low	36.5	Very low	53 Å²	53	127.5 Å²	127.5	36%	0.358	65%	0.65	S	S	.	*	H	α-helix	trans	-72.3	-22.1	177.3	-73.2	0	0	0	0	113.3	F299	C297-F299 PolarHBondContact O-N 3.5Å
298	F	34.3	Very low	36.8	Very low	121 Å²	121	127.7 Å²	127.7	53%	0.531	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-63.7	-22.2	175.2	-112	-88.3	0	0	0	113.7	K296 F308	K296-F298 VanDerWaalsContact C-N 3.29Å; K296-F298 PolarHBondContact O-N 3.38Å; F298-F308 HydrophobicContact CD1-CE2 4.12Å; F298-F308 HydrophobicContact CD1-CZ 4.14Å; F298-F308 HydrophobicContact CE1-CE2 4.02Å; F298-F308 AromaticContact CE1-CZ 3.94Å; F298-F308 HydrophobicContact CE1-CZ 3.94Å
299	F	34.5	Very low	36.8	Very low	166 Å²	166	129 Å²	129	73%	0.728	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-86.1	-13.5	-173	-100.5	-87.6	0	0	0	115	K296 C297	K296-F299 PolarHBondContact O-N 3.49Å; C297-F299 PolarHBondContact O-N 3.5Å
300	S	31.6	Very low	36.7	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-87.9	-5.5	-178	-165.6	0	0	0	0	114.5
301	F	34.4	Very low	36.9	Very low	124 Å²	124	127.1 Å²	127.1	54%	0.544	63%	0.631	S	S	.	*			trans	-104.9	36.4	-174.3	-98.1	-84.1	0	0	0	113.5	F278 E303	F278-F301 AromaticContact CE2-CE1 3.61Å; F278-F301 HydrophobicContact CE2-CE1 3.61Å; F278-F301 AromaticContact CE2-CZ 3.56Å; F278-F301 HydrophobicContact CE2-CZ 3.56Å; F278-F301 AromaticContact CZ-CE1 3.87Å; F278-F301 HydrophobicContact CZ-CE1 3.87Å; F278-F301 AromaticContact CZ-CZ 3.91Å; F278-F301 HydrophobicContact CZ-CZ 3.91Å; F301-E303 VanDerWaalsContact C-N 3.31Å; F301-E303 PolarHBondContact O-N 3.35Å
302	R	34.2	Very low	36.8	Very low	224 Å²	224	124.8 Å²	124.8	85%	0.845	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	13	-171.5	-144.2	-177.1	-176.4	-171.4	0	115.7
303	E	38	Very low	36.8	Very low	174 Å²	174	119.6 Å²	119.6	81%	0.813	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	5.4	-170.5	-70.9	-167.4	162.1	0	0	118.1	F301	F301-E303 VanDerWaalsContact C-N 3.31Å; F301-E303 PolarHBondContact O-N 3.35Å
304	H	39.8	Very low	36.9	Very low	148 Å²	148	122 Å²	122	69%	0.685	61%	0.606	S	S	*	*			trans	-126.9	94.3	173.5	-69.7	-49.2	0	0	0	113.2	G306 Y307	H304-G306 VanDerWaalsContact C-N 3.25Å; H304-G306 PolarHBondContact O-N 3.26Å; H304-Y307 HydrophobicContact CB-CD2 4.5Å
305	S	46.8	Very low	36.9	Very low	133 Å²	133	120.8 Å²	120.8	93%	0.93	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	40.9	-170.2	56.4	0	0	0	0	116.1
306	G	38.4	Very low	36.9	Very low	41 Å²	41	120.1 Å²	120.1	42%	0.423	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-139.8	-39.4	170.3	0	0	0	0	0	112.4	H304	H304-G306 VanDerWaalsContact C-N 3.25Å; H304-G306 PolarHBondContact O-N 3.26Å
307	Y	38.8	Very low	37	Very low	150 Å²	150	116.1 Å²	116.1	59%	0.588	58%	0.577	S	S	*	*	H	α-helix	trans	-75.1	-25.6	-179.9	-63.1	-78.7	0	0	0	113.3	H304 L310 L311	H304-Y307 HydrophobicContact CB-CD2 4.5Å; Y307-L310 PolarHBondContact O-N 2.98Å; Y307-L311 VanDerWaalsContact O-CB 3.23Å; Y307-L311 WeakPolarHBondContact O-CB 3.33Å; Y307-L311 WeakPolarHBondContact O-CD1 3.26Å; Y307-L311 WeakPolarHBondContact O-CG 3.08Å; Y307-L311 PolarHBondContact O-N 3Å
308	F	40.1	Very low	37.3	Very low	101 Å²	101	114.7 Å²	114.7	44%	0.443	57%	0.568	S	S	.	*	H	α-helix	trans	-68.6	-38	-180	-162.8	-91.3	0	0	0	112.7	F298 Y312	F298-F308 HydrophobicContact CD1-CE2 4.12Å; F298-F308 HydrophobicContact CD1-CZ 4.14Å; F298-F308 HydrophobicContact CE1-CE2 4.02Å; F298-F308 AromaticContact CE1-CZ 3.94Å; F298-F308 HydrophobicContact CE1-CZ 3.94Å; F308-Y312 WeakPolarHBondContact O-CB 3.38Å; F308-Y312 PolarHBondContact O-N 3.46Å
309	L	36.4	Very low	37.6	Very low	127 Å²	127	114.7 Å²	114.7	67%	0.665	57%	0.57	S	S	*	*	H	α-helix	trans	-70.5	-40	175.5	-159.7	76.4	0	0	0	110.5	Y312 V313	L309-Y312 PolarHBondContact O-N 3.06Å; L309-V313 WeakPolarHBondContact O-CB 3.39Å; L309-V313 WeakPolarHBondContact O-CG2 3.37Å; L309-V313 PolarHBondContact O-N 3.45Å
310	L	37.6	Very low	37.7	Very low	119 Å²	119	108.5 Å²	108.5	62%	0.623	54%	0.542	S	S	*	.	H	α-helix	trans	-63.6	-44.1	174.1	-115.4	130.8	0	0	0	111.9	Y307 F314	Y307-L310 PolarHBondContact O-N 2.98Å; L310-F314 WeakPolarHBondContact O-CB 3.44Å; L310-F314 PolarHBondContact O-N 3.09Å
311	L	39.6	Very low	38.1	Very low	68 Å²	68	104.9 Å²	104.9	36%	0.356	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-41.8	174	-86.1	151.7	0	0	0	111.3	Y307 F314 F315	Y307-L311 VanDerWaalsContact O-CB 3.23Å; Y307-L311 WeakPolarHBondContact O-CB 3.33Å; Y307-L311 WeakPolarHBondContact O-CD1 3.26Å; Y307-L311 WeakPolarHBondContact O-CG 3.08Å; Y307-L311 PolarHBondContact O-N 3Å; L311-F314 PolarHBondContact O-N 2.96Å; L311-F315 HydrophobicContact CB-CD2 4.47Å; L311-F315 HydrophobicContact CD2-CD2 3.96Å; L311-F315 HydrophobicContact CD2-CE2 3.66Å; L311-F315 WeakPolarHBondContact O-CB 3.15Å; L311-F315 VanDerWaalsContact O-CD2 3.26Å; L311-F315 WeakPolarHBondContact O-CD2 3.16Å; L311-F315 PolarHBondContact O-N 2.92Å
312	Y	36.4	Very low	38.1	Very low	137 Å²	137	105.2 Å²	105.2	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-66.8	-39.5	178.4	-174.2	-93.5	0	0	0	112.1	F308 L309 N316	F308-Y312 WeakPolarHBondContact O-CB 3.38Å; F308-Y312 PolarHBondContact O-N 3.46Å; L309-Y312 PolarHBondContact O-N 3.06Å; Y312-N316 VanDerWaalsContact CE1-ND2 3.34Å; Y312-N316 WeakPolarHBondContact CE1-ND2 3.22Å; Y312-N316 VanDerWaalsContact CE2-ND2 3.29Å; Y312-N316 WeakPolarHBondContact CE2-ND2 3.42Å; Y312-N316 VanDerWaalsContact O-CB 3.27Å; Y312-N316 WeakPolarHBondContact O-CB 3.3Å; Y312-N316 PolarHBondContact O-N 3.04Å; Y312-N316 PolarHBondContact O-ND2 3.28Å
313	V	35.7	Very low	38.2	Very low	74 Å²	74	97 Å²	97	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-63.2	-54.6	169.6	172.8	0	0	0	0	108.3	L309 F315 N316 T317	L309-V313 WeakPolarHBondContact O-CB 3.39Å; L309-V313 WeakPolarHBondContact O-CG2 3.37Å; L309-V313 PolarHBondContact O-N 3.45Å; V313-F315 VanDerWaalsContact C-N 3.29Å; V313-F315 PolarHBondContact O-N 3.49Å; V313-N316 CarbonylContact O-C 3.58Å; V313-N316 PolarHBondContact O-N 3.09Å; V313-T317 HydrophobicContact CG1-CG2 3.58Å; V313-T317 VanDerWaalsContact O-CB 3.29Å; V313-T317 WeakPolarHBondContact O-CB 3.31Å; V313-T317 VanDerWaalsContact O-CG2 3.29Å; V313-T317 WeakPolarHBondContact O-CG2 3.47Å; V313-T317 PolarHBondContact O-N 3.19Å; V313-T317 PolarHBondContact O-OG1 2.94Å
314	F	36.9	Very low	38.1	Very low	126 Å²	126	90.1 Å²	90.1	55%	0.553	46%	0.459	S	S	*	.	H	α-helix	trans	-58.6	-33.5	-179.4	-147.3	-91.4	0	0	0	114.5	L310 L311 T317 S321	L310-F314 WeakPolarHBondContact O-CB 3.44Å; L310-F314 PolarHBondContact O-N 3.09Å; L311-F314 PolarHBondContact O-N 2.96Å; F314-T317 WeakPolarHBondContact CA-OG1 3.15Å; F314-S321 PolarHBondContact O-OG 2.98Å
315	F	36.6	Very low	37.8	Very low	87 Å²	87	86 Å²	86	38%	0.382	45%	0.451	S	S	.	.	H	α-helix	trans	-82	-26.3	176.5	-91.9	-88.2	0	0	0	113.3	F282 L311 V313	F282-F315 HydrophobicContact CE1-CZ 4.35Å; L311-F315 HydrophobicContact CB-CD2 4.47Å; L311-F315 HydrophobicContact CD2-CD2 3.96Å; L311-F315 HydrophobicContact CD2-CE2 3.66Å; L311-F315 WeakPolarHBondContact O-CB 3.15Å; L311-F315 VanDerWaalsContact O-CD2 3.26Å; L311-F315 WeakPolarHBondContact O-CD2 3.16Å; L311-F315 PolarHBondContact O-N 2.92Å; V313-F315 VanDerWaalsContact C-N 3.29Å; V313-F315 PolarHBondContact O-N 3.49Å
316	N	36.2	Very low	37.3	Very low	82 Å²	82	84 Å²	84	44%	0.439	43%	0.43	S	S	.	.	H	α-helix	trans	-97.3	-20.2	175.6	-77	-73.3	0	0	0	113.7	Y312 V313 A318	Y312-N316 VanDerWaalsContact CE1-ND2 3.34Å; Y312-N316 WeakPolarHBondContact CE1-ND2 3.22Å; Y312-N316 VanDerWaalsContact CE2-ND2 3.29Å; Y312-N316 WeakPolarHBondContact CE2-ND2 3.42Å; Y312-N316 VanDerWaalsContact O-CB 3.27Å; Y312-N316 WeakPolarHBondContact O-CB 3.3Å; Y312-N316 PolarHBondContact O-N 3.04Å; Y312-N316 PolarHBondContact O-ND2 3.28Å; V313-N316 CarbonylContact O-C 3.58Å; V313-N316 PolarHBondContact O-N 3.09Å; N316-A318 PolarHBondContact O-N 3.34Å
317	T	36.7	Very low	37.3	Very low	79 Å²	79	86.1 Å²	86.1	49%	0.485	44%	0.438	S	S	.	.	S	Bend	trans	-80.3	50.2	174	56.8	0	0	0	0	110.7	V313 F314	V313-T317 HydrophobicContact CG1-CG2 3.58Å; V313-T317 VanDerWaalsContact O-CB 3.29Å; V313-T317 WeakPolarHBondContact O-CB 3.31Å; V313-T317 VanDerWaalsContact O-CG2 3.29Å; V313-T317 WeakPolarHBondContact O-CG2 3.47Å; V313-T317 PolarHBondContact O-N 3.19Å; V313-T317 PolarHBondContact O-OG1 2.94Å; F314-T317 WeakPolarHBondContact CA-OG1 3.15Å
318	A	40	Very low	37.3	Very low	22 Å²	22	87.4 Å²	87.4	18%	0.182	44%	0.442	C	S	.	.			trans	80	132.8	169.7	0	0	0	0	0	116.6	N316 Y320 S321 E347	N316-A318 PolarHBondContact O-N 3.34Å; A318-Y320 HydrophobicContact CB-CG 4.42Å; A318-Y320 PolarHBondContact O-N 3.11Å; A318-S321 PolarHBondContact O-N 3.49Å; A318-S321 PolarHBondContact O-OG 2.83Å; A318-E347 HydrophobicContact CB-CG 4.48Å; A318-E347 WeakPolarHBondContact CB-OE1 3.33Å
319	Q	40.7	Very low	37.4	Very low	121 Å²	121	87.4 Å²	87.4	57%	0.565	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	-17.9	157.7	-100.6	172.1	-45.1	0	0	112.6	S321 R322 C323	Q319-S321 VanDerWaalsContact C-N 3.33Å; Q319-S321 PolarHBondContact O-N 3.17Å; Q319-R322 WeakPolarHBondContact O-CB 3.45Å; Q319-R322 PolarHBondContact O-N 3.12Å; Q319-R322 VanDerWaalsContact O-N 3.16Å; Q319-C323 PolarHBondContact O-N 2.82Å
320	Y	37.7	Very low	38.3	Very low	37 Å²	37	84 Å²	84	15%	0.145	43%	0.431	C	S	.	.	H	α-helix	trans	-45.2	-43.8	166	-170.1	-101.5	0	0	0	114.9	I129 S132 A318 R322 L324	I129-Y320 HydrophobicContact CD1-CD2 4.4Å; I129-Y320 HydrophobicContact CD1-CE2 3.74Å; I129-Y320 HydrophobicContact CG1-CE2 3.89Å; S132-Y320 VanDerWaalsContact CB-CE1 3.47Å; S132-Y320 WeakPolarHBondContact OG-CE1 3.33Å; S132-Y320 VanDerWaalsContact OG-CZ 3.26Å; S132-Y320 PolarHBondContact OG-OH 3.37Å; A318-Y320 HydrophobicContact CB-CG 4.42Å; A318-Y320 PolarHBondContact O-N 3.11Å; Y320-R322 VanDerWaalsContact C-N 3.34Å; Y320-R322 PolarHBondContact O-N 2.99Å; Y320-L324 HydrophobicContact CD1-CD1 4.15Å; Y320-L324 HydrophobicContact CE1-CD1 3.83Å
321	S	39	Very low	39.5	Very low	28 Å²	28	85.3 Å²	85.3	20%	0.196	44%	0.435	C	S	.	.	H	α-helix	trans	-74.1	-25.2	179.9	56.9	0	0	0	0	112.9	F314 A318 Q319 A325	F314-S321 PolarHBondContact O-OG 2.98Å; A318-S321 PolarHBondContact O-N 3.49Å; A318-S321 PolarHBondContact O-OG 2.83Å; Q319-S321 VanDerWaalsContact C-N 3.33Å; Q319-S321 PolarHBondContact O-N 3.17Å; S321-A325 PolarHBondContact O-N 2.65Å
322	R	35.6	Very low	41.3	Very low	132 Å²	132	83 Å²	83	50%	0.498	42%	0.422	S	S	.	.	H	α-helix	trans	-76.6	-32.3	-177.7	-127.4	174.4	174.8	170.6	-4.6	113.3	Q319 Y320	Q319-R322 WeakPolarHBondContact O-CB 3.45Å; Q319-R322 PolarHBondContact O-N 3.12Å; Q319-R322 VanDerWaalsContact O-N 3.16Å; Y320-R322 VanDerWaalsContact C-N 3.34Å; Y320-R322 PolarHBondContact O-N 2.99Å
323	C	35.5	Very low	43.7	Very low	52 Å²	52	78.8 Å²	78.8	35%	0.351	41%	0.412	S	S	.	.	H	α-helix	trans	-83.3	-29.2	-179.8	-56.1	0	0	0	0	112.4	Q256 Q319 A325	Q256-C323 HydrophobicContact CG-CB 4.18Å; Q319-C323 PolarHBondContact O-N 2.82Å; C323-A325 VanDerWaalsContact C-N 3.26Å; C323-A325 PolarHBondContact O-N 3.4Å
324	L	35.6	Very low	46.2	Very low	28 Å²	28	76.9 Å²	76.9	15%	0.147	40%	0.398	C	S	.	.	H	α-helix	trans	-68.4	-23.1	170.4	-74.8	166.9	0	0	0	113.1	S259 Y320	S259-L324 WeakPolarHBondContact OG-CD2 3.49Å; Y320-L324 HydrophobicContact CD1-CD1 4.15Å; Y320-L324 HydrophobicContact CE1-CD1 3.83Å
325	A	34.6	Very low	48.8	Very low	63 Å²	63	79.9 Å²	79.9	52%	0.521	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.4	-175.8	0	0	0	0	0	115.2	S321 C323	S321-A325 PolarHBondContact O-N 2.65Å; C323-A325 VanDerWaalsContact C-N 3.26Å; C323-A325 PolarHBondContact O-N 3.4Å
326	L	36	Very low	51.3	Low	91 Å²	91	78.5 Å²	78.5	48%	0.476	41%	0.408	S	S	.	.	S	Bend	trans	-116.5	2.2	-166.1	-70	175.5	0	0	0	115.8	R328	L326-R328 HydrophobicContact CB-CG 4.46Å; L326-R328 WeakPolarHBondContact O-CG 3.43Å; L326-R328 PolarHBondContact O-N 3.04Å
327	S	36.8	Very low	53.8	Low	85 Å²	85	74.7 Å²	74.7	59%	0.594	39%	0.387	S	S	*	.			trans	46.8	35	175	-54.6	0	0	0	0	114.3	S262	S262-S327 PolarHBondContact OG-OG 3.29Å
328	R	39.1	Very low	56.4	Low	177 Å²	177	74.5 Å²	74.5	67%	0.668	39%	0.387	S	S	*	.			trans	-93.6	138.9	178.6	-69.6	-166	179.9	-175.3	0.5	110.6	L326	L326-R328 HydrophobicContact CB-CG 4.46Å; L326-R328 WeakPolarHBondContact O-CG 3.43Å; L326-R328 PolarHBondContact O-N 3.04Å
329	P	43.8	Very low	58.6	Low	100 Å²	100	78.3 Å²	78.3	65%	0.649	41%	0.405	S	S	*	.			trans	-60.8	163.6	172.1	26.6	-33.6	0	0	0	111	Q331	P329-Q331 WeakPolarHBondContact O-CG 3.44Å; P329-Q331 PolarHBondContact O-N 3.37Å
330	F	53.7	Low	60.8	Low	56 Å²	56	73.1 Å²	73.1	25%	0.246	38%	0.381	C	S	.	.			trans	-45.5	108.8	179.3	-95.5	-115.9	0	0	0	111.8	P239 Q256 I257 F332	P239-F330 HydrophobicContact CG-CB 4.27Å; P239-F330 HydrophobicContact CG-CD1 3.79Å; Q256-F330 HydrophobicContact CB-CE2 4.33Å; Q256-F330 HydrophobicContact CB-CZ 4.17Å; I257-F330 HydrophobicContact CB-CE2 4.02Å; I257-F330 HydrophobicContact CB-CZ 4.18Å; I257-F330 HydrophobicContact CD1-CD1 4.17Å; I257-F330 HydrophobicContact CD1-CD2 4.2Å; I257-F330 HydrophobicContact CD1-CE1 3.55Å; I257-F330 HydrophobicContact CD1-CE2 3.76Å; I257-F330 HydrophobicContact CD1-CZ 3.44Å; I257-F330 VanDerWaalsContact CD1-CZ 3.44Å; I257-F330 HydrophobicContact CG1-CD1 4.36Å; I257-F330 HydrophobicContact CG1-CD2 3.71Å; I257-F330 HydrophobicContact CG1-CE1 3.6Å; I257-F330 HydrophobicContact CG1-CE2 2.94Å; I257-F330 HydrophobicContact CG1-CG 4.44Å; I257-F330 HydrophobicContact CG1-CZ 2.9Å; F330-F332 HydrophobicContact CD1-CD1 4.27Å; F330-F332 AromaticContact CD1-CE1 3.88Å; F330-F332 HydrophobicContact CD1-CE1 3.88Å; F330-F332 HydrophobicContact CE1-CD1 4.22Å; F330-F332 AromaticContact CE1-CE1 3.54Å; F330-F332 HydrophobicContact CE1-CE1 3.54Å; F330-F332 HydrophobicContact CE1-CZ 4.45Å; F330-F332 HydrophobicContact CZ-CE1 4.42Å
331	Q	63.4	Low	63.4	Low	147 Å²	147	71.6 Å²	71.6	69%	0.687	38%	0.375	S	S	*	.			trans	-126.5	43	177.5	-76.4	-171.3	-8.1	0	0	111.3	P329	P329-Q331 WeakPolarHBondContact O-CG 3.44Å; P329-Q331 PolarHBondContact O-N 3.37Å
332	F	78	Confident	65.7	Low	20 Å²	20	75.4 Å²	75.4	9%	0.088	39%	0.388	C	S	.	.			trans	-116.3	148.7	157	84	-91.6	0	0	0	109.7	P239 F250 E253 F330 D336 I337 I340	P239-F332 HydrophobicContact CB-CE2 4.43Å; P239-F332 WeakPolarHBondContact CB-O 3.44Å; P239-F332 VanDerWaalsContact CG-O 3.24Å; P239-F332 WeakPolarHBondContact CG-O 3.23Å; F250-F332 AromaticContact CD1-CE2 3.7Å; F250-F332 HydrophobicContact CD1-CE2 3.7Å; F250-F332 AromaticContact CD1-CZ 3.82Å; F250-F332 HydrophobicContact CD1-CZ 3.82Å; F250-F332 AromaticContact CE1-CE2 3.65Å; F250-F332 HydrophobicContact CE1-CE2 3.65Å; F250-F332 HydrophobicContact CE1-CZ 4.16Å; F250-F332 HydrophobicContact CG-CE2 4.26Å; F250-F332 HydrophobicContact CG-CZ 4.44Å; F250-F332 HydrophobicContact CZ-CE2 4.15Å; E253-F332 HydrophobicContact CB-CD1 4.4Å; E253-F332 HydrophobicContact CB-CE1 3.72Å; E253-F332 HydrophobicContact CB-CE2 4.39Å; E253-F332 HydrophobicContact CB-CZ 3.74Å; E253-F332 HydrophobicContact CG-CD1 3.55Å; E253-F332 HydrophobicContact CG-CD2 4.49Å; E253-F332 HydrophobicContact CG-CE1 3.34Å; E253-F332 HydrophobicContact CG-CE2 4.35Å; E253-F332 HydrophobicContact CG-CG 4.13Å; E253-F332 HydrophobicContact CG-CZ 3.81Å; F330-F332 HydrophobicContact CD1-CD1 4.27Å; F330-F332 AromaticContact CD1-CE1 3.88Å; F330-F332 HydrophobicContact CD1-CE1 3.88Å; F330-F332 HydrophobicContact CE1-CD1 4.22Å; F330-F332 AromaticContact CE1-CE1 3.54Å; F330-F332 HydrophobicContact CE1-CE1 3.54Å; F330-F332 HydrophobicContact CE1-CZ 4.45Å; F330-F332 HydrophobicContact CZ-CE1 4.42Å; F332-D336 HydrophobicContact CB-CB 4.22Å; F332-I337 HydrophobicContact CD2-CD1 4.21Å; F332-I337 HydrophobicContact CE2-CD1 4.01Å; F332-I340 HydrophobicContact CB-CD1 4.06Å; F332-I340 HydrophobicContact CD2-CD1 3.78Å; F332-I340 HydrophobicContact CE2-CD1 4.46Å; F332-I340 HydrophobicContact CG-CD1 4.01Å
333	S	85.4	Confident	68.2	Low	48 Å²	48	70.9 Å²	70.9	34%	0.336	37%	0.371	S	S	.	.			trans	-126	173.8	177.5	69.4	0	0	0	0	109.1	K335 D336	S333-K335 PolarHBondContact O-N 3.24Å; S333-K335 PolarHBondContact OG-N 2.72Å; S333-D336 PolarHBondContact N-OD2 3Å; S333-D336 WeakPolarHBondContact O-CB 3.48Å; S333-D336 PolarHBondContact O-N 3.49Å; S333-D336 PolarHBondContact OG-OD2 3.46Å
334	Q	89.7	Confident	70.7	Confident	33 Å²	33	68.4 Å²	68.4	15%	0.154	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-49.8	-30.9	170.7	-176.7	62.7	62.3	0	0	113.6	T242 D246 D336 I337	T242-Q334 HydrophobicContact CG2-CB 4.23Å; T242-Q334 HydrophobicContact CG2-CG 4.1Å; T242-Q334 WeakPolarHBondContact OG1-CG 3.16Å; D246-Q334 PolarHBondContact OD2-NE2 3.31Å; Q334-D336 PolarHBondContact O-N 2.62Å; Q334-I337 WeakPolarHBondContact O-CG1 3.31Å; Q334-I337 PolarHBondContact O-N 3.07Å
335	K	90.4	Very high	73.4	Confident	189 Å²	189	67 Å²	67	82%	0.822	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-68.1	-22	-179.8	-63.2	179.7	179.8	176.5	0	113.1	S333	S333-K335 PolarHBondContact O-N 3.24Å; S333-K335 PolarHBondContact OG-N 2.72Å
336	D	88.6	Confident	75.8	Confident	59 Å²	59	68.4 Å²	68.4	32%	0.316	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-88	-15.5	-176.9	-55.9	-62.6	0	0	0	112.3	F332 S333 Q334 N339 I340	F332-D336 HydrophobicContact CB-CB 4.22Å; S333-D336 PolarHBondContact N-OD2 3Å; S333-D336 WeakPolarHBondContact O-CB 3.48Å; S333-D336 PolarHBondContact O-N 3.49Å; S333-D336 PolarHBondContact OG-OD2 3.46Å; Q334-D336 PolarHBondContact O-N 2.62Å; D336-N339 WeakPolarHBondContact O-CA 3.07Å; D336-N339 WeakPolarHBondContact O-CB 3.5Å; D336-N339 PolarHBondContact O-N 3.47Å; D336-I340 HydrophobicContact CB-CD1 4.02Å; D336-I340 WeakPolarHBondContact O-CG1 3.32Å; D336-I340 PolarHBondContact O-N 2.9Å
337	I	89.9	Confident	78.1	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-56	-42.2	-173.7	-60.1	-65.4	0	0	0	113.8	D246 V249 F250 F332 Q334 N339 I340 R341	D246-I337 HydrophobicContact CB-CG2 4.06Å; D246-I337 VanDerWaalsContact OD1-CG2 3.27Å; D246-I337 WeakPolarHBondContact OD1-CG2 3.45Å; D246-I337 WeakPolarHBondContact OD2-CG2 3.44Å; V249-I337 HydrophobicContact CB-CD1 4.47Å; V249-I337 HydrophobicContact CB-CG2 4.3Å; V249-I337 HydrophobicContact CG1-CD1 4.02Å; V249-I337 HydrophobicContact CG1-CG2 4.09Å; V249-I337 HydrophobicContact CG2-CG2 4.36Å; F250-I337 HydrophobicContact CD2-CD1 3.84Å; F250-I337 HydrophobicContact CE2-CD1 3.49Å; F250-I337 VanDerWaalsContact CE2-CD1 3.49Å; F250-I337 HydrophobicContact CE2-CG1 3.85Å; F250-I337 HydrophobicContact CZ-CD1 4.04Å; F250-I337 HydrophobicContact CZ-CG1 4.35Å; F332-I337 HydrophobicContact CD2-CD1 4.21Å; F332-I337 HydrophobicContact CE2-CD1 4.01Å; Q334-I337 WeakPolarHBondContact O-CG1 3.31Å; Q334-I337 PolarHBondContact O-N 3.07Å; I337-N339 PolarHBondContact O-N 3.46Å; I337-I340 HydrophobicContact CD1-CD1 4.16Å; I337-I340 PolarHBondContact O-N 3.3Å; I337-I340 VanDerWaalsContact O-N 3.16Å; I337-R341 HydrophobicContact CG2-CG 4.12Å; I337-R341 WeakPolarHBondContact O-CB 2.99Å; I337-R341 WeakPolarHBondContact O-CG 3.34Å; I337-R341 PolarHBondContact O-N 3.24Å
338	P	90.3	Very high	80.6	Confident	75 Å²	75	61.5 Å²	61.5	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-59.2	-32.8	176	-25.8	35.9	0	0	0	113.5	K342	P338-K342 WeakPolarHBondContact O-CG 3.36Å; P338-K342 PolarHBondContact O-N 3.01Å
339	N	86.7	Confident	82.9	Confident	103 Å²	103	53.1 Å²	53.1	55%	0.551	27%	0.265	S	S	*	.	H	α-helix	trans	-78.6	-39.1	176.9	-67.1	-32.5	0	0	0	111.3	D336 I337 K342 R343	D336-N339 WeakPolarHBondContact O-CA 3.07Å; D336-N339 WeakPolarHBondContact O-CB 3.5Å; D336-N339 PolarHBondContact O-N 3.47Å; I337-N339 PolarHBondContact O-N 3.46Å; N339-K342 PolarHBondContact O-N 2.97Å; N339-R343 PolarHBondContact O-N 3.08Å
340	I	87.5	Confident	84.7	Confident	11 Å²	11	50 Å²	50	6%	0.056	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-44.8	175.7	-65.8	164.9	0	0	0	110.5	V249 E253 F332 D336 I337 K342 R343 I344	V249-I340 HydrophobicContact CG1-CB 4.19Å; V249-I340 HydrophobicContact CG1-CG2 3.52Å; E253-I340 HydrophobicContact CG-CD1 4.18Å; E253-I340 WeakPolarHBondContact OE2-CG2 3.25Å; F332-I340 HydrophobicContact CB-CD1 4.06Å; F332-I340 HydrophobicContact CD2-CD1 3.78Å; F332-I340 HydrophobicContact CE2-CD1 4.46Å; F332-I340 HydrophobicContact CG-CD1 4.01Å; D336-I340 HydrophobicContact CB-CD1 4.02Å; D336-I340 WeakPolarHBondContact O-CG1 3.32Å; D336-I340 PolarHBondContact O-N 2.9Å; I337-I340 HydrophobicContact CD1-CD1 4.16Å; I337-I340 PolarHBondContact O-N 3.3Å; I337-I340 VanDerWaalsContact O-N 3.16Å; I340-K342 VanDerWaalsContact C-N 3.34Å; I340-K342 PolarHBondContact O-N 3.31Å; I340-R343 WeakPolarHBondContact O-CA 3Å; I340-R343 WeakPolarHBondContact O-CB 3.35Å; I340-R343 PolarHBondContact O-N 2.86Å; I340-R343 VanDerWaalsContact O-N 3.07Å; I340-I344 HydrophobicContact CG2-CD1 3.8Å; I340-I344 HydrophobicContact CG2-CG1 4.3Å; I340-I344 WeakPolarHBondContact O-CG1 3.16Å; I340-I344 PolarHBondContact O-N 3.21Å
341	R	91.6	Very high	85.8	Confident	6 Å²	6	48 Å²	48	2%	0.023	24%	0.236	C	C	.	.	H	α-helix	trans	-54.4	-47.4	174.3	-80	174.7	171.5	-85	2	112.3	T110 L111 N113 H115 N245 D246 V249 I337 R343 I344 Y345	T110-R341 PolarHBondContact O-NH1 3.1Å; L111-R341 WeakPolarHBondContact O-CB 3.27Å; L111-R341 WeakPolarHBondContact O-CD 3.22Å; L111-R341 PolarHBondContact O-NH1 3.14Å; N113-R341 VanDerWaalsContact O-CD 3.23Å; N113-R341 WeakPolarHBondContact O-CD 3.24Å; N113-R341 PolarHBondContact O-NE 2.88Å; N113-R341 VanDerWaalsContact O-NE 3.1Å; N113-R341 PolarHBondContact O-NH1 2.98Å; H115-R341 PolarHBondContact O-NH1 3.43Å; H115-R341 VanDerWaalsContact O-NH1 3.17Å; H115-R341 PolarHBondContact O-NH2 3.45Å; N245-R341 PolarHBondContact O-NH2 3.32Å; D246-R341 IonicContact OD1-CZ 2.62Å; D246-R341 IonicContact OD1-NE 3.92Å; D246-R341 PolarHBondContact OD1-NE 2.95Å; D246-R341 IonicContact OD1-NH2 2.9Å; D246-R341 PolarHBondContact OD1-NH2 3.46Å; V249-R341 HydrophobicContact CG1-CG 4.36Å; V249-R341 HydrophobicContact CG2-CG 3.71Å; I337-R341 HydrophobicContact CG2-CG 4.12Å; I337-R341 WeakPolarHBondContact O-CB 2.99Å; I337-R341 WeakPolarHBondContact O-CG 3.34Å; I337-R341 PolarHBondContact O-N 3.24Å; R341-R343 VanDerWaalsContact C-N 3.35Å; R341-R343 PolarHBondContact O-N 2.73Å; R341-I344 PolarHBondContact O-N 2.92Å; R341-Y345 PolarHBondContact O-N 3.15Å
342	K	88.4	Confident	85.6	Confident	107 Å²	107	44.2 Å²	44.2	47%	0.465	22%	0.218	S	C	.	.	H	α-helix	trans	-63.8	-38.2	175.4	-70.3	171.6	-174.2	172.8	0	112.5	F48 P338 N339 I340 K346	F48-K342 HydrophobicContact CE1-CG 4.35Å; P338-K342 WeakPolarHBondContact O-CG 3.36Å; P338-K342 PolarHBondContact O-N 3.01Å; N339-K342 PolarHBondContact O-N 2.97Å; I340-K342 VanDerWaalsContact C-N 3.34Å; I340-K342 PolarHBondContact O-N 3.31Å; K342-K346 WeakPolarHBondContact O-CB 3.31Å; K342-K346 PolarHBondContact O-N 3.12Å
343	R	87.6	Confident	84.3	Confident	37 Å²	37	48.4 Å²	48.4	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-63.3	-50.6	176.5	-166.7	-165.4	77.1	-151.6	-11.1	110.9	Y125 E253 N339 I340 R341 Y345 K346 E347	Y125-R343 PolarHBondContact OH-NH2 3.48Å; E253-R343 IonicContact OE1-CZ 3.19Å; E253-R343 IonicContact OE1-NH1 3.52Å; E253-R343 PolarHBondContact OE1-NH1 3.24Å; E253-R343 IonicContact OE1-NH2 3.77Å; E253-R343 IonicContact OE2-CZ 3.03Å; E253-R343 IonicContact OE2-NH1 3.8Å; E253-R343 PolarHBondContact OE2-NH1 3.33Å; E253-R343 IonicContact OE2-NH2 2.63Å; E253-R343 PolarHBondContact OE2-NH2 3.49Å; N339-R343 PolarHBondContact O-N 3.08Å; I340-R343 WeakPolarHBondContact O-CA 3Å; I340-R343 WeakPolarHBondContact O-CB 3.35Å; I340-R343 PolarHBondContact O-N 2.86Å; I340-R343 VanDerWaalsContact O-N 3.07Å; R341-R343 VanDerWaalsContact C-N 3.35Å; R341-R343 PolarHBondContact O-N 2.73Å; R343-Y345 VanDerWaalsContact C-N 3.34Å; R343-Y345 PolarHBondContact O-N 3.39Å; R343-K346 PolarHBondContact O-N 3.05Å; R343-K346 VanDerWaalsContact O-N 3.15Å; R343-E347 IonicContact NE-OE1 3.1Å; R343-E347 PolarHBondContact NE-OE1 2.9Å; R343-E347 IonicContact NE-OE2 2.6Å; R343-E347 WeakPolarHBondContact O-CG 3.27Å; R343-E347 PolarHBondContact O-N 3.41Å
344	I	88.6	Confident	82	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-46.3	178.3	-67.5	169.6	0	0	0	110.6	L111 Y125 V249 L252 I340 R341 K346 E347 L348	L111-I344 HydrophobicContact CD1-CG2 3.95Å; L111-I344 HydrophobicContact CD2-CB 3.96Å; L111-I344 HydrophobicContact CD2-CG2 3.58Å; L111-I344 HydrophobicContact CG-CG2 4.44Å; Y125-I344 HydrophobicContact CD2-CG2 3.75Å; Y125-I344 HydrophobicContact CE2-CB 4.2Å; Y125-I344 HydrophobicContact CE2-CG1 3.98Å; Y125-I344 HydrophobicContact CE2-CG2 3.85Å; Y125-I344 HydrophobicContact CG-CG2 4.3Å; V249-I344 HydrophobicContact CG1-CD1 4.14Å; L252-I344 HydrophobicContact CB-CD1 4.06Å; L252-I344 HydrophobicContact CD1-CD1 4.11Å; L252-I344 HydrophobicContact CD1-CG2 4.32Å; I340-I344 HydrophobicContact CG2-CD1 3.8Å; I340-I344 HydrophobicContact CG2-CG1 4.3Å; I340-I344 WeakPolarHBondContact O-CG1 3.16Å; I340-I344 PolarHBondContact O-N 3.21Å; R341-I344 PolarHBondContact O-N 2.92Å; I344-K346 VanDerWaalsContact C-N 3.32Å; I344-K346 PolarHBondContact O-N 3.12Å; I344-E347 PolarHBondContact O-N 2.8Å; I344-L348 HydrophobicContact CG2-CD1 3.96Å; I344-L348 WeakPolarHBondContact O-CG 3.4Å; I344-L348 PolarHBondContact O-N 3.46Å
345	Y	91.1	Very high	79.3	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.8	-48.9	175.9	-177.9	-77.2	0	0	0	111.3	Y45 F48 I49 L108 L111 R341 R343 E347 L348 C349	Y45-Y345 VanDerWaalsContact O-CE1 3.31Å; Y45-Y345 WeakPolarHBondContact O-CE1 3.46Å; Y45-Y345 PolarHBondContact O-OH 2.66Å; F48-Y345 HydrophobicContact CB-CD2 4.09Å; F48-Y345 HydrophobicContact CB-CE1 3.96Å; F48-Y345 HydrophobicContact CB-CE2 3.39Å; F48-Y345 AromaticContact CD1-CD1 3.57Å; F48-Y345 HydrophobicContact CD1-CD1 3.57Å; F48-Y345 AromaticContact CD1-CD2 3.14Å; F48-Y345 HydrophobicContact CD1-CD2 3.14Å; F48-Y345 AromaticContact CD1-CE1 3.87Å; F48-Y345 HydrophobicContact CD1-CE1 3.87Å; F48-Y345 AromaticContact CD1-CE2 3.42Å; F48-Y345 HydrophobicContact CD1-CE2 3.42Å; F48-Y345 VanDerWaalsContact CD1-CE2 3.42Å; F48-Y345 AromaticContact CD1-CG 3.23Å; F48-Y345 HydrophobicContact CD1-CG 3.23Å; F48-Y345 AromaticContact CD1-CZ 3.84Å; F48-Y345 HydrophobicContact CE1-CD1 4.3Å; F48-Y345 AromaticContact CE1-CD2 3.63Å; F48-Y345 HydrophobicContact CE1-CD2 3.63Å; F48-Y345 HydrophobicContact CE1-CE2 4.32Å; F48-Y345 AromaticContact CE1-CG 3.62Å; F48-Y345 HydrophobicContact CE1-CG 3.62Å; F48-Y345 HydrophobicContact CG-CD1 4.46Å; F48-Y345 AromaticContact CG-CD2 3.69Å; F48-Y345 HydrophobicContact CG-CD2 3.69Å; F48-Y345 HydrophobicContact CG-CE1 4.35Å; F48-Y345 AromaticContact CG-CE2 3.5Å; F48-Y345 HydrophobicContact CG-CE2 3.5Å; F48-Y345 VanDerWaalsContact CG-CE2 3.5Å; F48-Y345 HydrophobicContact CG-CG 4.18Å; F48-Y345 AromaticContact CG-CZ 3.93Å; I49-Y345 HydrophobicContact CD1-CD1 3.87Å; I49-Y345 HydrophobicContact CD1-CE1 4.14Å; I49-Y345 HydrophobicContact CG1-CD1 3.7Å; I49-Y345 HydrophobicContact CG1-CE1 3.8Å; L108-Y345 HydrophobicContact CB-CD2 4.01Å; L108-Y345 HydrophobicContact CB-CE2 3.56Å; L108-Y345 HydrophobicContact CD1-CE2 4.44Å; L108-Y345 HydrophobicContact CD2-CD2 4.23Å; L108-Y345 HydrophobicContact CD2-CE2 4.33Å; L108-Y345 HydrophobicContact CG-CE2 4.33Å; L111-Y345 HydrophobicContact CB-CD2 4.49Å; L111-Y345 HydrophobicContact CD1-CD2 4.29Å; R341-Y345 PolarHBondContact O-N 3.15Å; R343-Y345 VanDerWaalsContact C-N 3.34Å; R343-Y345 PolarHBondContact O-N 3.39Å; Y345-E347 PolarHBondContact O-N 2.84Å; Y345-L348 PolarHBondContact O-N 2.86Å; Y345-C349 WeakPolarHBondContact CE1-SG 3.48Å; Y345-C349 PolarHBondContact O-N 3.3Å; Y345-C349 PolarHBondContact O-SG 3.37Å
346	K	85.9	Confident	78.7	Confident	92 Å²	92	57.7 Å²	57.7	40%	0.4	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-44.4	-179.3	-173.9	-178.9	174	-171.3	0	111.8	Y45 I49 K342 R343 I344 L348 C349 D350	Y45-K346 HydrophobicContact CE1-CG 3.92Å; I49-K346 HydrophobicContact CD1-CB 3.86Å; I49-K346 HydrophobicContact CD1-CG 4.04Å; K342-K346 WeakPolarHBondContact O-CB 3.31Å; K342-K346 PolarHBondContact O-N 3.12Å; R343-K346 PolarHBondContact O-N 3.05Å; R343-K346 VanDerWaalsContact O-N 3.15Å; I344-K346 VanDerWaalsContact C-N 3.32Å; I344-K346 PolarHBondContact O-N 3.12Å; K346-L348 VanDerWaalsContact C-N 3.3Å; K346-L348 PolarHBondContact O-N 2.67Å; K346-C349 PolarHBondContact O-N 2.86Å; K346-D350 WeakPolarHBondContact CE-OD2 3.49Å; K346-D350 WeakPolarHBondContact CG-OD2 3.46Å; K346-D350 WeakPolarHBondContact O-CB 3.4Å; K346-D350 VanDerWaalsContact O-CG 3.23Å; K346-D350 PolarHBondContact O-N 3.4Å
347	E	84.7	Confident	78.2	Confident	31 Å²	31	57.6 Å²	57.6	15%	0.145	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-37.9	178	-73.4	171.3	174.3	0	0	112	Y125 A318 R343 I344 Y345 D350 C351	Y125-E347 HydrophobicContact CE2-CB 4.33Å; Y125-E347 VanDerWaalsContact CE2-OE2 3.28Å; Y125-E347 WeakPolarHBondContact CE2-OE2 3.5Å; Y125-E347 PolarHBondContact OH-OE2 3.36Å; A318-E347 HydrophobicContact CB-CG 4.48Å; A318-E347 WeakPolarHBondContact CB-OE1 3.33Å; R343-E347 IonicContact NE-OE1 3.1Å; R343-E347 PolarHBondContact NE-OE1 2.9Å; R343-E347 IonicContact NE-OE2 2.6Å; R343-E347 WeakPolarHBondContact O-CG 3.27Å; R343-E347 PolarHBondContact O-N 3.41Å; I344-E347 PolarHBondContact O-N 2.8Å; Y345-E347 PolarHBondContact O-N 2.84Å; E347-D350 PolarHBondContact O-N 3.15Å; E347-C351 PolarHBondContact O-N 3.13Å
348	L	88.3	Confident	77.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.5	-48	172.4	-70.2	166.1	0	0	0	111.4	V96 L103 L108 L111 V121 M124 Y125 L128 I344 Y345 K346 D350 C351	V96-L348 VanDerWaalsContact CG1-O 3.24Å; V96-L348 WeakPolarHBondContact CG1-O 3.06Å; L103-L348 HydrophobicContact CD1-CB 4.38Å; L103-L348 HydrophobicContact CD1-CD1 3.89Å; L103-L348 HydrophobicContact CD1-CD2 3.99Å; L103-L348 HydrophobicContact CD1-CG 4.32Å; L108-L348 HydrophobicContact CD2-CB 4.14Å; L108-L348 HydrophobicContact CD2-CD1 3.95Å; L111-L348 HydrophobicContact CD1-CD1 3.76Å; V121-L348 HydrophobicContact CG1-CD1 4.08Å; M124-L348 HydrophobicContact CB-CD2 4.12Å; M124-L348 HydrophobicContact CG-CD2 3.85Å; M124-L348 HydrophobicContact SD-CD2 3.83Å; Y125-L348 HydrophobicContact CD2-CD2 4.2Å; Y125-L348 HydrophobicContact CD2-CG 4.21Å; L128-L348 HydrophobicContact CD1-CD2 3.9Å; I344-L348 HydrophobicContact CG2-CD1 3.96Å; I344-L348 WeakPolarHBondContact O-CG 3.4Å; I344-L348 PolarHBondContact O-N 3.46Å; Y345-L348 PolarHBondContact O-N 2.86Å; K346-L348 VanDerWaalsContact C-N 3.3Å; K346-L348 PolarHBondContact O-N 2.67Å; L348-D350 VanDerWaalsContact C-N 3.26Å; L348-D350 PolarHBondContact O-N 3.46Å; L348-C351 PolarHBondContact O-N 3.08Å; L348-C351 PolarHBondContact O-SG 3Å
349	C	86.7	Confident	76.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-31.8	177.1	-71.6	0	0	0	0	113.4	R44 Y45 Y345 K346 C351	R44-C349 VanDerWaalsContact O-CB 3.31Å; R44-C349 WeakPolarHBondContact O-CB 3.19Å; R44-C349 PolarHBondContact O-SG 2.87Å; Y45-C349 HydrophobicContact CD1-CB 3.65Å; Y45-C349 HydrophobicContact CE1-CB 4Å; Y345-C349 WeakPolarHBondContact CE1-SG 3.48Å; Y345-C349 PolarHBondContact O-N 3.3Å; Y345-C349 PolarHBondContact O-SG 3.37Å; K346-C349 PolarHBondContact O-N 2.86Å; C349-C351 VanDerWaalsContact C-N 3.27Å; C349-C351 PolarHBondContact O-N 2.93Å
350	D	82.6	Confident	76.2	Confident	36 Å²	36	57.2 Å²	57.2	19%	0.193	27%	0.268	C	S	.	.	H	α-helix	trans	-76.2	-12.5	-177.9	-74.3	-25.6	0	0	0	113.5	R44 Y45 K346 E347 L348 E352	R44-D350 IonicContact CZ-OD1 2.8Å; R44-D350 VanDerWaalsContact CZ-OD1 3.23Å; R44-D350 IonicContact NE-OD1 2.6Å; R44-D350 PolarHBondContact NE-OD1 3.27Å; R44-D350 IonicContact NH2-OD1 3.74Å; R44-D350 PolarHBondContact NH2-OD1 3.12Å; Y45-D350 WeakPolarHBondContact CE1-OD1 3.47Å; Y45-D350 VanDerWaalsContact CZ-OD1 3.27Å; Y45-D350 PolarHBondContact OH-OD1 3.48Å; K346-D350 WeakPolarHBondContact CE-OD2 3.49Å; K346-D350 WeakPolarHBondContact CG-OD2 3.46Å; K346-D350 WeakPolarHBondContact O-CB 3.4Å; K346-D350 VanDerWaalsContact O-CG 3.23Å; K346-D350 PolarHBondContact O-N 3.4Å; E347-D350 PolarHBondContact O-N 3.15Å; L348-D350 VanDerWaalsContact C-N 3.26Å; L348-D350 PolarHBondContact O-N 3.46Å; D350-E352 VanDerWaalsContact C-N 3.33Å; D350-E352 PolarHBondContact O-N 3.1Å
351	C	76.2	Confident	75.4	Confident	13 Å²	13	60.3 Å²	60.3	9%	0.088	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-79.6	-8.8	-178.5	79.5	0	0	0	0	114.8	Y98 L128 E347 L348 C349 L353	Y98-C351 VanDerWaalsContact CB-SG 3.51Å; Y98-C351 HydrophobicContact CD2-CB 3.75Å; Y98-C351 WeakPolarHBondContact CD2-O 3.28Å; Y98-C351 HydrophobicContact CE2-CB 4.06Å; Y98-C351 HydrophobicContact CG-CB 4.23Å; Y98-C351 VanDerWaalsContact CG-SG 3.6Å; L128-C351 HydrophobicContact CD2-CB 3.65Å; E347-C351 PolarHBondContact O-N 3.13Å; L348-C351 PolarHBondContact O-N 3.08Å; L348-C351 PolarHBondContact O-SG 3Å; C349-C351 VanDerWaalsContact C-N 3.27Å; C349-C351 PolarHBondContact O-N 2.93Å; C351-L353 PolarHBondContact O-N 3.04Å
352	E	59.8	Low	74.2	Confident	67 Å²	67	64.1 Å²	64.1	31%	0.313	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-63	-5.3	177.3	-71.6	-161.3	126.8	0	0	114.8	V96 D350 H354	V96-E352 WeakPolarHBondContact CA-OE1 3.38Å; V96-E352 HydrophobicContact CB-CG 4.39Å; V96-E352 HydrophobicContact CG1-CG 3.95Å; V96-E352 HydrophobicContact CG2-CG 4.45Å; D350-E352 VanDerWaalsContact C-N 3.33Å; D350-E352 PolarHBondContact O-N 3.1Å; E352-H354 VanDerWaalsContact C-N 3.31Å; E352-H354 PolarHBondContact O-N 3.23Å
353	L	49.9	Very low	73.2	Confident	109 Å²	109	60.8 Å²	60.8	57%	0.571	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-85.8	11.4	-169	-66.5	177.4	0	0	0	115.7	C351	C351-L353 PolarHBondContact O-N 3.04Å
354	H	37.4	Very low	72	Confident	169 Å²	169	62.8 Å²	62.8	78%	0.782	30%	0.3	S	S	*	.			trans	-126.9	48	-177.4	-66.6	-58.5	0	0	0	112.9	E352	E352-H354 VanDerWaalsContact C-N 3.31Å; E352-H354 PolarHBondContact O-N 3.23Å
355	E	32.4	Very low	70.5	Confident	237 Å²	237	68.5 Å²	68.5	100%	1.107	33%	0.327	S	S	*	.			trans	-97.8	0	154.7	-77.6	-169.3	164.8	0	0	111.1

Retrieved 355 of 355 residues in 874.3 ms (Link to these results)

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