A0A077ZJF0_TRITR Loading...

Tyrosine-protein kinase Fps85D

AlphaFold DB , UniProt , Accession A0A077ZJF0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 577 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	Very low	35	Very low	245 Å²	245	153.1 Å²	153.1	100%	1.207	82%	0.815	S	S	*	*				0	101.9	0	-75.7	179.4	105.9	0	0	107.9
2	S	38.2	Very low	35.1	Very low	121 Å²	121	149.5 Å²	149.5	85%	0.846	81%	0.811	S	S	*	*			trans	166.6	88.4	148	57.4	0	0	0	0	106.7
3	S	35.1	Very low	35.2	Very low	99 Å²	99	145.9 Å²	145.9	69%	0.692	79%	0.791	S	S	*	*			trans	-75.6	117.3	162.6	47.1	0	0	0	0	107.7
4	E	41.1	Very low	35.3	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	78%	0.781	S	S	*	*			trans	-107	88.5	159	-77.4	-173.1	160.7	0	0	107	S6	E4-S6 PolarHBondContact O-N 2.98Å
5	D	39	Very low	35.6	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	77%	0.766	S	S	*	*			trans	-74.8	92.7	169	-71.4	-44.2	0	0	0	108.5	N7	D5-N7 VanDerWaalsContact C-N 3.33Å; D5-N7 PolarHBondContact O-N 3.45Å; D5-N7 VanDerWaalsContact O-N 3.13Å
6	S	35.4	Very low	35.8	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	76%	0.758	S	S	*	*			trans	-80.2	85.3	165.6	55.2	0	0	0	0	109.1	E4 F8	E4-S6 PolarHBondContact O-N 2.98Å; S6-F8 PolarHBondContact O-N 2.93Å
7	N	33.4	Very low	36.5	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	75%	0.751	S	S	*	*			trans	-63	96.8	167	-89.8	-29.6	0	0	0	109.8	D5 I9	D5-N7 VanDerWaalsContact C-N 3.33Å; D5-N7 PolarHBondContact O-N 3.45Å; D5-N7 VanDerWaalsContact O-N 3.13Å; N7-I9 VanDerWaalsContact C-N 3.32Å; N7-I9 PolarHBondContact O-N 3.05Å; N7-I9 VanDerWaalsContact O-N 3.11Å
8	F	30.3	Very low	37.2	Very low	186 Å²	186	133.5 Å²	133.5	82%	0.816	74%	0.736	S	S	*	*			trans	-74.9	89.7	160.3	-99.7	-92.9	0	0	0	108.1	S6 L10	S6-F8 PolarHBondContact O-N 2.93Å; F8-L10 PolarHBondContact O-N 3.23Å; F8-L10 VanDerWaalsContact O-N 3.15Å
9	I	32.4	Very low	38	Very low	135 Å²	135	129.7 Å²	129.7	69%	0.692	72%	0.724	S	S	*	*			trans	-72.7	100.8	163.6	-60.9	174.7	0	0	0	105.5	N7 E11	N7-I9 VanDerWaalsContact C-N 3.32Å; N7-I9 PolarHBondContact O-N 3.05Å; N7-I9 VanDerWaalsContact O-N 3.11Å; I9-E11 VanDerWaalsContact C-N 3.25Å; I9-E11 HydrophobicContact CG2-CG 4.22Å; I9-E11 PolarHBondContact O-N 3.27Å
10	L	32.6	Very low	38.5	Very low	158 Å²	158	127.6 Å²	127.6	83%	0.827	72%	0.717	S	S	*	*			trans	-68	92.5	161.9	-75.4	164.4	0	0	0	106.4	F8 S12	F8-L10 PolarHBondContact O-N 3.23Å; F8-L10 VanDerWaalsContact O-N 3.15Å; L10-S12 VanDerWaalsContact C-N 3.3Å; L10-S12 PolarHBondContact O-N 3.2Å
11	E	30.4	Very low	39.2	Very low	171 Å²	171	126.5 Å²	126.5	80%	0.799	71%	0.707	S	S	*	*			trans	-59.9	101.5	158.6	-74.2	-176.5	160.7	0	0	106.3	I9 D13	I9-E11 VanDerWaalsContact C-N 3.25Å; I9-E11 HydrophobicContact CG2-CG 4.22Å; I9-E11 PolarHBondContact O-N 3.27Å; E11-D13 PolarHBondContact O-N 2.92Å
12	S	36.7	Very low	40.1	Very low	110 Å²	110	117 Å²	117	77%	0.769	66%	0.661	S	S	*	*			trans	-65.5	101.8	169.7	54.3	0	0	0	0	107.1	L10 S14	L10-S12 VanDerWaalsContact C-N 3.3Å; L10-S12 PolarHBondContact O-N 3.2Å; S12-S14 VanDerWaalsContact C-N 3.31Å; S12-S14 PolarHBondContact O-N 2.94Å
13	D	35.5	Very low	41	Very low	103 Å²	103	114.1 Å²	114.1	55%	0.551	64%	0.644	S	S	*	*			trans	-53.5	92.7	169.8	-96.2	-37.2	0	0	0	109.5	E11 T15 L16	E11-D13 PolarHBondContact O-N 2.92Å; D13-T15 PolarHBondContact O-N 3.02Å; D13-T15 VanDerWaalsContact O-N 3.1Å; D13-T15 PolarHBondContact OD1-OG1 3.24Å; D13-L16 HydrophobicContact CB-CB 4.35Å; D13-L16 HydrophobicContact CB-CD1 3.95Å; D13-L16 PolarHBondContact O-N 2.98Å
14	S	37.5	Very low	42	Very low	93 Å²	93	114.9 Å²	114.9	65%	0.65	64%	0.64	S	S	*	*	H	α-helix	trans	-62.8	-11.1	170.2	56.4	0	0	0	0	112.2	S12 V18	S12-S14 VanDerWaalsContact C-N 3.31Å; S12-S14 PolarHBondContact O-N 2.94Å; S14-V18 WeakPolarHBondContact O-CG2 3.5Å
15	T	39	Very low	42.9	Very low	91 Å²	91	108.6 Å²	108.6	56%	0.558	61%	0.61	S	S	*	*	H	α-helix	trans	-74.8	-30.1	176.2	54.7	0	0	0	0	112.7	D13 A19	D13-T15 PolarHBondContact O-N 3.02Å; D13-T15 VanDerWaalsContact O-N 3.1Å; D13-T15 PolarHBondContact OD1-OG1 3.24Å; T15-A19 WeakPolarHBondContact O-CB 3.22Å; T15-A19 PolarHBondContact O-N 3.32Å
16	L	39.3	Very low	43.8	Very low	123 Å²	123	107 Å²	107	64%	0.644	60%	0.597	S	S	*	*	H	α-helix	trans	-72	-35.4	-178.6	-106.8	144.5	0	0	0	112.1	D13 C20	D13-L16 HydrophobicContact CB-CB 4.35Å; D13-L16 HydrophobicContact CB-CD1 3.95Å; D13-L16 PolarHBondContact O-N 2.98Å; L16-C20 WeakPolarHBondContact O-CB 3.44Å; L16-C20 PolarHBondContact O-N 2.76Å
17	D	48.2	Very low	44.9	Very low	118 Å²	118	106 Å²	106	63%	0.631	59%	0.59	S	S	*	*	H	α-helix	trans	-71	-44.4	179.6	-130.8	-0.9	0	0	0	111.1	A19 C20 E21	D17-A19 PolarHBondContact O-N 2.84Å; D17-C20 PolarHBondContact O-N 3.45Å; D17-E21 PolarHBondContact O-N 3.36Å
18	V	49.2	Very low	46.1	Very low	81 Å²	81	102.3 Å²	102.3	49%	0.491	57%	0.572	S	S	.	*	H	α-helix	trans	-64	-41.4	179	178.7	0	0	0	0	111.6	S14 C20 E21 D22	S14-V18 WeakPolarHBondContact O-CG2 3.5Å; V18-C20 VanDerWaalsContact C-N 3.34Å; V18-C20 PolarHBondContact O-N 3.2Å; V18-E21 PolarHBondContact O-N 3.27Å; V18-D22 WeakPolarHBondContact O-CB 3.23Å; V18-D22 PolarHBondContact O-N 3.48Å
19	A	51.2	Low	47.5	Very low	61 Å²	61	93.9 Å²	93.9	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-66.3	-37	178.7	0	0	0	0	0	112.3	T15 D17 A23	T15-A19 WeakPolarHBondContact O-CB 3.22Å; T15-A19 PolarHBondContact O-N 3.32Å; D17-A19 PolarHBondContact O-N 2.84Å; A19-A23 WeakPolarHBondContact O-CB 3.34Å; A19-A23 PolarHBondContact O-N 3.48Å
20	C	47.6	Very low	48.8	Very low	87 Å²	87	90.1 Å²	90.1	59%	0.588	53%	0.525	S	S	*	.	H	α-helix	trans	-71.2	-41.1	177.9	-161.6	0	0	0	0	111.4	L16 D17 V18 A23 L24	L16-C20 WeakPolarHBondContact O-CB 3.44Å; L16-C20 PolarHBondContact O-N 2.76Å; D17-C20 PolarHBondContact O-N 3.45Å; V18-C20 VanDerWaalsContact C-N 3.34Å; V18-C20 PolarHBondContact O-N 3.2Å; C20-A23 PolarHBondContact O-N 3.28Å; C20-L24 WeakPolarHBondContact O-CB 3.35Å; C20-L24 PolarHBondContact O-N 2.78Å; C20-L24 VanDerWaalsContact O-N 3.08Å
21	E	53.4	Low	49.9	Very low	105 Å²	105	86.8 Å²	86.8	49%	0.491	52%	0.515	S	S	.	.	H	α-helix	trans	-59	-52.8	170.9	-76.2	-170.4	159.7	0	0	110.7	D17 V18 A23 L24 F25	D17-E21 PolarHBondContact O-N 3.36Å; V18-E21 PolarHBondContact O-N 3.27Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 3.04Å; E21-L24 WeakPolarHBondContact O-CB 3.29Å; E21-L24 PolarHBondContact O-N 2.74Å; E21-L24 VanDerWaalsContact O-N 3.11Å; E21-F25 HydrophobicContact CB-CD2 4.24Å; E21-F25 HydrophobicContact CB-CE2 4.16Å; E21-F25 WeakPolarHBondContact O-CD2 3.36Å; E21-F25 PolarHBondContact O-N 3.3Å
22	D	57.3	Low	51.1	Low	45 Å²	45	79.1 Å²	79.1	24%	0.241	48%	0.481	C	S	.	.	H	α-helix	trans	-56.5	-40.9	179.8	-91.1	-4.3	0	0	0	113.2	V18 F25 K26 R145	V18-D22 WeakPolarHBondContact O-CB 3.23Å; V18-D22 PolarHBondContact O-N 3.48Å; D22-F25 PolarHBondContact O-N 3.1Å; D22-K26 WeakPolarHBondContact O-CB 3.41Å; D22-K26 WeakPolarHBondContact O-CG 3.44Å; D22-K26 PolarHBondContact O-N 3.36Å; D22-R145 IonicContact OD1-CZ 2.88Å; D22-R145 IonicContact OD1-NH2 3.05Å; D22-R145 PolarHBondContact OD1-NH2 2.7Å
23	A	56.7	Low	52.2	Low	61 Å²	61	76.8 Å²	76.8	50%	0.504	46%	0.455	S	S	.	.	H	α-helix	trans	-66	-42.3	177	0	0	0	0	0	112	A19 C20 E21 S27	A19-A23 WeakPolarHBondContact O-CB 3.34Å; A19-A23 PolarHBondContact O-N 3.48Å; C20-A23 PolarHBondContact O-N 3.28Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 3.04Å; A23-S27 WeakPolarHBondContact O-CB 3.42Å; A23-S27 PolarHBondContact O-N 3.27Å
24	L	55.7	Low	53	Low	115 Å²	115	81 Å²	81	60%	0.602	47%	0.469	S	S	*	.	H	α-helix	trans	-61.8	-46.6	175.6	-170.3	78.3	0	0	0	110.6	C20 E21 S27 V28	C20-L24 WeakPolarHBondContact O-CB 3.35Å; C20-L24 PolarHBondContact O-N 2.78Å; C20-L24 VanDerWaalsContact O-N 3.08Å; E21-L24 WeakPolarHBondContact O-CB 3.29Å; E21-L24 PolarHBondContact O-N 2.74Å; E21-L24 VanDerWaalsContact O-N 3.11Å; L24-S27 WeakPolarHBondContact O-CB 3.37Å; L24-S27 PolarHBondContact O-N 3.19Å; L24-V28 VanDerWaalsContact O-CG2 3.31Å; L24-V28 WeakPolarHBondContact O-CG2 3.44Å; L24-V28 PolarHBondContact O-N 3.21Å
25	F	59.7	Low	53.4	Low	59 Å²	59	79 Å²	79	26%	0.259	46%	0.463	S	S	.	.	H	α-helix	trans	-66	-41.8	179.2	-76.6	-71.3	0	0	0	112.6	E21 D22 S27 V28 A29 Y132 R145	E21-F25 HydrophobicContact CB-CD2 4.24Å; E21-F25 HydrophobicContact CB-CE2 4.16Å; E21-F25 WeakPolarHBondContact O-CD2 3.36Å; E21-F25 PolarHBondContact O-N 3.3Å; D22-F25 PolarHBondContact O-N 3.1Å; F25-S27 VanDerWaalsContact C-N 3.28Å; F25-S27 PolarHBondContact O-N 3.35Å; F25-V28 PolarHBondContact O-N 3.43Å; F25-A29 VanDerWaalsContact O-CB 3.31Å; F25-A29 WeakPolarHBondContact O-CB 3.38Å; F25-A29 PolarHBondContact O-N 2.91Å; F25-Y132 WeakPolarHBondContact CD1-O 3.16Å; F25-R145 VanDerWaalsContact CG-NH1 3.35Å
26	K	58.8	Low	53.7	Low	105 Å²	105	75.9 Å²	75.9	46%	0.457	45%	0.445	S	S	.	.	H	α-helix	trans	-61.8	-37.6	174.1	-75.9	173.9	-178.5	168.4	0	111.8	D22 A30	D22-K26 WeakPolarHBondContact O-CB 3.41Å; D22-K26 WeakPolarHBondContact O-CG 3.44Å; D22-K26 PolarHBondContact O-N 3.36Å; K26-A30 WeakPolarHBondContact O-CB 3.32Å; K26-A30 PolarHBondContact O-N 3.07Å
27	S	58.6	Low	53.8	Low	81 Å²	81	73.2 Å²	73.2	57%	0.566	44%	0.435	S	S	*	.	H	α-helix	trans	-65.4	-45.7	173.5	-179.5	0	0	0	0	111.9	A23 L24 F25 A30 S31	A23-S27 WeakPolarHBondContact O-CB 3.42Å; A23-S27 PolarHBondContact O-N 3.27Å; L24-S27 WeakPolarHBondContact O-CB 3.37Å; L24-S27 PolarHBondContact O-N 3.19Å; F25-S27 VanDerWaalsContact C-N 3.28Å; F25-S27 PolarHBondContact O-N 3.35Å; S27-A30 PolarHBondContact O-N 2.93Å; S27-S31 VanDerWaalsContact O-CB 3.3Å; S27-S31 WeakPolarHBondContact O-CB 3.42Å; S27-S31 PolarHBondContact O-N 3.25Å
28	V	59.1	Low	53.6	Low	61 Å²	61	72.1 Å²	72.1	37%	0.37	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-43.7	176.1	171.3	0	0	0	0	110.8	L24 F25 S31 A32 Y132	L24-V28 VanDerWaalsContact O-CG2 3.31Å; L24-V28 WeakPolarHBondContact O-CG2 3.44Å; L24-V28 PolarHBondContact O-N 3.21Å; F25-V28 PolarHBondContact O-N 3.43Å; V28-S31 CarbonylContact O-C 3.51Å; V28-S31 WeakPolarHBondContact O-CB 3.5Å; V28-S31 PolarHBondContact O-N 3.34Å; V28-A32 VanDerWaalsContact O-CB 3.24Å; V28-A32 WeakPolarHBondContact O-CB 3.13Å; V28-A32 PolarHBondContact O-N 3.32Å; V28-Y132 HydrophobicContact CG1-CD1 4.03Å
29	A	58	Low	53.7	Low	8 Å²	8	69.4 Å²	69.4	7%	0.066	41%	0.411	C	S	.	.	H	α-helix	trans	-63.3	-46.9	177.5	0	0	0	0	0	111.9	F25 S31 A32 R33 V134	F25-A29 VanDerWaalsContact O-CB 3.31Å; F25-A29 WeakPolarHBondContact O-CB 3.38Å; F25-A29 PolarHBondContact O-N 2.91Å; A29-S31 VanDerWaalsContact C-N 3.28Å; A29-S31 PolarHBondContact O-N 3.16Å; A29-A32 PolarHBondContact O-N 3.25Å; A29-A32 VanDerWaalsContact O-N 3.15Å; A29-R33 WeakPolarHBondContact O-CG 3.37Å; A29-R33 PolarHBondContact O-N 3.2Å; A29-V134 HydrophobicContact CB-CB 4.37Å; A29-V134 HydrophobicContact CB-CG1 4.04Å; A29-V134 HydrophobicContact CB-CG2 3.66Å
30	A	59.6	Low	53.9	Low	56 Å²	56	70.3 Å²	70.3	46%	0.463	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-34.9	176	0	0	0	0	0	112	K26 S27 K34	K26-A30 WeakPolarHBondContact O-CB 3.32Å; K26-A30 PolarHBondContact O-N 3.07Å; S27-A30 PolarHBondContact O-N 2.93Å; A30-K34 WeakPolarHBondContact O-CG 3.25Å; A30-K34 PolarHBondContact O-N 3.16Å
31	S	56.8	Low	55.1	Low	88 Å²	88	71.8 Å²	71.8	62%	0.615	40%	0.402	S	S	*	.	H	α-helix	trans	-70.4	-37.2	172.6	-167.9	0	0	0	0	112	S27 V28 A29 K34	S27-S31 VanDerWaalsContact O-CB 3.3Å; S27-S31 WeakPolarHBondContact O-CB 3.42Å; S27-S31 PolarHBondContact O-N 3.25Å; V28-S31 CarbonylContact O-C 3.51Å; V28-S31 WeakPolarHBondContact O-CB 3.5Å; V28-S31 PolarHBondContact O-N 3.34Å; A29-S31 VanDerWaalsContact C-N 3.28Å; A29-S31 PolarHBondContact O-N 3.16Å; S31-K34 PolarHBondContact O-N 2.88Å
32	A	54.7	Low	56.4	Low	10 Å²	10	70.8 Å²	70.8	8%	0.083	40%	0.395	C	S	.	.	H	α-helix	trans	-68.3	-42	179.1	0	0	0	0	0	111.2	V28 A29 K34 C36 F128 Y132	V28-A32 VanDerWaalsContact O-CB 3.24Å; V28-A32 WeakPolarHBondContact O-CB 3.13Å; V28-A32 PolarHBondContact O-N 3.32Å; A29-A32 PolarHBondContact O-N 3.25Å; A29-A32 VanDerWaalsContact O-N 3.15Å; A32-K34 VanDerWaalsContact C-N 3.27Å; A32-K34 PolarHBondContact O-N 3.26Å; A32-C36 WeakPolarHBondContact O-CA 3.43Å; A32-C36 WeakPolarHBondContact O-CB 3.47Å; A32-C36 PolarHBondContact O-N 3.43Å; A32-F128 HydrophobicContact CB-CE2 3.92Å; A32-F128 HydrophobicContact CB-CZ 4.47Å; A32-Y132 HydrophobicContact CB-CD1 4.06Å; A32-Y132 HydrophobicContact CB-CD2 4Å; A32-Y132 HydrophobicContact CB-CE1 4.12Å; A32-Y132 HydrophobicContact CB-CE2 4.06Å; A32-Y132 HydrophobicContact CB-CG 4.01Å
33	R	61.1	Low	57.9	Low	61 Å²	61	68.6 Å²	68.6	23%	0.23	38%	0.384	C	S	.	.	H	α-helix	trans	-64.4	-27.4	174.5	-67.9	-172	-170.9	-111.7	3.9	113.1	A29 G35 E113 D114 D117 F128 Y129	A29-R33 WeakPolarHBondContact O-CG 3.37Å; A29-R33 PolarHBondContact O-N 3.2Å; R33-G35 PolarHBondContact O-N 2.89Å; R33-G35 VanDerWaalsContact O-N 3.08Å; R33-E113 VanDerWaalsContact NH1-CB 3.26Å; R33-E113 PolarHBondContact NH1-O 3.12Å; R33-D114 IonicContact CZ-OD1 2.99Å; R33-D114 IonicContact NH1-OD1 2.73Å; R33-D114 PolarHBondContact NH1-OD1 3.06Å; R33-D114 IonicContact NH2-OD1 3.74Å; R33-D114 PolarHBondContact NH2-OD1 3Å; R33-D117 IonicContact CZ-OD2 2.81Å; R33-D117 IonicContact NE-OD2 3.28Å; R33-D117 IonicContact NH1-OD2 3.02Å; R33-D117 PolarHBondContact NH1-OD2 2.86Å; R33-F128 HydrophobicContact CG-CE2 4.47Å; R33-F128 HydrophobicContact CG-CZ 3.81Å; R33-Y129 PolarHBondContact NH2-OH 3.21Å
34	K	50.9	Low	59.4	Low	192 Å²	192	65.8 Å²	65.8	84%	0.835	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	12.8	-176.4	-86	-175.9	178.2	-178.8	0	116.2	A30 S31 A32	A30-K34 WeakPolarHBondContact O-CG 3.25Å; A30-K34 PolarHBondContact O-N 3.16Å; S31-K34 PolarHBondContact O-N 2.88Å; A32-K34 VanDerWaalsContact C-N 3.27Å; A32-K34 PolarHBondContact O-N 3.26Å
35	G	47.1	Very low	61	Low	52 Å²	52	62.8 Å²	62.8	54%	0.536	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	157.3	33.1	168.7	0	0	0	0	0	115.2	R33 P37	R33-G35 PolarHBondContact O-N 2.89Å; R33-G35 VanDerWaalsContact O-N 3.08Å; G35-P37 WeakPolarHBondContact O-CD 3.44Å; G35-P37 WeakPolarHBondContact O-CG 3.25Å
36	C	44.5	Very low	62.5	Low	25 Å²	25	60.3 Å²	60.3	17%	0.169	33%	0.333	C	S	.	.			trans	-41.8	83.7	-166.5	-151	0	0	0	0	115.7	A32 L38	A32-C36 WeakPolarHBondContact O-CA 3.43Å; A32-C36 WeakPolarHBondContact O-CB 3.47Å; A32-C36 PolarHBondContact O-N 3.43Å; C36-L38 PolarHBondContact O-N 3.44Å
37	P	42.5	Very low	64.1	Low	66 Å²	66	55.9 Å²	55.9	43%	0.429	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-15.9	175.8	0.1	21.8	0	0	0	109.9	G35 D40 Y41	G35-P37 WeakPolarHBondContact O-CD 3.44Å; G35-P37 WeakPolarHBondContact O-CG 3.25Å; P37-D40 PolarHBondContact O-N 2.81Å; P37-Y41 HydrophobicContact CB-CE2 4.24Å; P37-Y41 WeakPolarHBondContact O-CD2 3.46Å; P37-Y41 WeakPolarHBondContact O-CE2 3.45Å
38	L	42.8	Very low	65.4	Low	95 Å²	95	54.6 Å²	54.6	50%	0.497	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-12.3	-161.8	-81.4	168.5	0	0	0	114.8	C36 Y41 K131 Y132	C36-L38 PolarHBondContact O-N 3.44Å; L38-Y41 HydrophobicContact CD2-CE2 4.08Å; L38-K131 PolarHBondContact O-NZ 3.1Å; L38-Y132 WeakPolarHBondContact CB-OH 3.44Å
39	L	50.6	Low	66.7	Low	25 Å²	25	52.9 Å²	52.9	13%	0.131	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-33.5	164.6	-69.8	167.2	0	0	0	110.7	Y41 F119 V127 F128 K131 Y132	L39-Y41 PolarHBondContact O-N 2.82Å; L39-F119 HydrophobicContact CD1-CE1 4.33Å; L39-V127 HydrophobicContact CD2-CB 3.99Å; L39-V127 HydrophobicContact CD2-CG1 3.4Å; L39-V127 VanDerWaalsContact CD2-CG1 3.4Å; L39-F128 HydrophobicContact CD1-CB 3.48Å; L39-F128 VanDerWaalsContact CD1-CB 3.48Å; L39-F128 HydrophobicContact CD1-CD2 3.73Å; L39-F128 HydrophobicContact CD1-CG 4.08Å; L39-K131 HydrophobicContact CD2-CD 4.3Å; L39-Y132 HydrophobicContact CD1-CE2 4.29Å; L39-Y132 HydrophobicContact CG-CE2 4.37Å
40	D	55.6	Low	68.2	Low	79 Å²	79	52.6 Å²	52.6	42%	0.422	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	1.4	-171.7	-65.2	-7.3	0	0	0	114.2	P37 L456	P37-D40 PolarHBondContact O-N 2.81Å; D40-L456 WeakPolarHBondContact O-CB 3.19Å; D40-L456 VanDerWaalsContact O-CD1 3.32Å; D40-L456 WeakPolarHBondContact O-CD1 3.33Å; D40-L456 WeakPolarHBondContact O-CG 3.38Å
41	Y	72.5	Confident	69.6	Low	119 Å²	119	51.1 Å²	51.1	47%	0.467	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-30.6	176.4	-68.7	-65.2	0	0	0	112.9	P37 L38 L39 V455 L456	P37-Y41 HydrophobicContact CB-CE2 4.24Å; P37-Y41 WeakPolarHBondContact O-CD2 3.46Å; P37-Y41 WeakPolarHBondContact O-CE2 3.45Å; L38-Y41 HydrophobicContact CD2-CE2 4.08Å; L39-Y41 PolarHBondContact O-N 2.82Å; Y41-V455 CarbonylContact O-C 3.46Å; Y41-V455 WeakPolarHBondContact O-CA 3.16Å; Y41-V455 WeakPolarHBondContact O-CG1 3.36Å; Y41-L456 PolarHBondContact O-N 2.74Å
42	F	82.1	Confident	71.3	Confident	83 Å²	83	47.1 Å²	47.1	36%	0.364	25%	0.25	S	S	.	.	B	Isolated β-bridge	trans	-121.5	135.4	-176.9	-73	-87.7	0	0	0	110.7	D451 L454 V455	F42-D451 HydrophobicContact CE1-CB 3.85Å; F42-D451 HydrophobicContact CZ-CB 4.08Å; F42-L454 CarbonylContact C-O 3.57Å; F42-L454 WeakPolarHBondContact CA-O 3.47Å; F42-L454 HydrophobicContact CD1-CB 3.91Å; F42-L454 HydrophobicContact CE1-CB 4.4Å; F42-V455 HydrophobicContact CD1-CG2 3.81Å; F42-V455 HydrophobicContact CE1-CG2 3.5Å; F42-V455 VanDerWaalsContact CE1-CG2 3.5Å; F42-V455 HydrophobicContact CE2-CG2 4.35Å; F42-V455 HydrophobicContact CG-CG2 4.38Å; F42-V455 HydrophobicContact CZ-CG2 3.79Å
43	A	87.9	Confident	73.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-52.1	136	171.7	0	0	0	0	0	111.1	L454 L456 K543 I544 R547	A43-L454 PolarHBondContact N-O 2.85Å; A43-L456 HydrophobicContact CB-CD2 4.1Å; A43-K543 VanDerWaalsContact CB-C 3.43Å; A43-K543 HydrophobicContact CB-CB 3.53Å; A43-I544 HydrophobicContact CB-CG1 3.99Å; A43-R547 WeakPolarHBondContact O-CD 3.31Å; A43-R547 PolarHBondContact O-NE 2.84Å; A43-R547 PolarHBondContact O-NH1 3.48Å
44	P	89	Confident	74.7	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.013	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-70.7	160.6	-179.1	25.6	-34	0	0	0	113.6	T121 H123 I544 N548	P44-T121 HydrophobicContact CB-CG2 4.22Å; P44-T121 WeakPolarHBondContact CB-OG1 3.24Å; P44-T121 HydrophobicContact CG-CG2 3.64Å; P44-H123 WeakPolarHBondContact CA-ND1 3.35Å; P44-H123 HydrophobicContact CB-CB 4.22Å; P44-H123 WeakPolarHBondContact CB-ND1 3.35Å; P44-I544 HydrophobicContact CG-CD1 3.53Å; P44-I544 HydrophobicContact CG-CG1 3.76Å; P44-N548 PolarHBondContact O-ND2 2.67Å
45	Q	89.5	Confident	76.5	Confident	51 Å²	51	37.7 Å²	37.7	24%	0.238	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-83.8	143.8	164.6	-68.7	-176.1	5.5	0	0	109.6	L50 H123 N548	Q45-L50 HydrophobicContact CB-CD2 3.57Å; Q45-H123 PolarHBondContact N-ND1 3.28Å; Q45-H123 WeakPolarHBondContact O-CB 3.28Å; Q45-N548 WeakPolarHBondContact CA-OD1 3.48Å
46	L	91.3	Very high	78.5	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.037	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-76.6	150	172.5	-66.1	175.9	0	0	0	110	A48 Y49 L50 L523 E533 I544 N548 V550	L46-A48 PolarHBondContact O-N 3.07Å; L46-A48 VanDerWaalsContact O-N 3.13Å; L46-Y49 HydrophobicContact CB-CD2 3.86Å; L46-Y49 HydrophobicContact CB-CE2 4.35Å; L46-Y49 HydrophobicContact CD1-CD2 4.47Å; L46-Y49 HydrophobicContact CD1-CE2 4.19Å; L46-Y49 PolarHBondContact O-N 2.8Å; L46-L50 PolarHBondContact O-N 2.89Å; L46-L523 HydrophobicContact CD2-CB 4.12Å; L46-L523 HydrophobicContact CD2-CD1 3.64Å; L46-L523 HydrophobicContact CD2-CG 4.35Å; L46-E533 WeakPolarHBondContact CA-OE2 3.34Å; L46-E533 HydrophobicContact CD2-CB 4Å; L46-E533 WeakPolarHBondContact CD2-OE2 3.38Å; L46-I544 HydrophobicContact CD1-CG2 4.35Å; L46-I544 HydrophobicContact CD2-CG2 3.92Å; L46-I544 HydrophobicContact CG-CG2 3.91Å; L46-N548 HydrophobicContact CD1-CB 4.49Å; L46-N548 PolarHBondContact N-OD1 3.02Å; L46-N548 VanDerWaalsContact N-OD1 3.11Å; L46-V550 HydrophobicContact CD1-CG2 3.71Å
47	L	91.5	Very high	80.8	Confident	13 Å²	13	37.2 Å²	37.2	7%	0.068	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-48.2	-46.3	-177.9	175.9	65.7	0	0	0	112.3	Y49 L50 F53 I74 I122 E533	L47-Y49 PolarHBondContact O-N 2.92Å; L47-L50 HydrophobicContact CD1-CD1 4.1Å; L47-L50 WeakPolarHBondContact O-CB 3.32Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-L50 VanDerWaalsContact O-N 3.09Å; L47-F53 HydrophobicContact CD1-CB 4.08Å; L47-F53 HydrophobicContact CD1-CD1 4.47Å; L47-F53 HydrophobicContact CD1-CD2 3.51Å; L47-F53 HydrophobicContact CD1-CE2 4Å; L47-F53 HydrophobicContact CD1-CG 3.77Å; L47-F53 HydrophobicContact CD2-CD2 4.26Å; L47-F53 HydrophobicContact CD2-CE2 3.88Å; L47-F53 HydrophobicContact CD2-CZ 4.06Å; L47-F53 HydrophobicContact CG-CD1 4.22Å; L47-F53 HydrophobicContact CG-CD2 3.89Å; L47-F53 HydrophobicContact CG-CE1 4.31Å; L47-F53 HydrophobicContact CG-CE2 3.99Å; L47-F53 HydrophobicContact CG-CG 4Å; L47-F53 HydrophobicContact CG-CZ 4.18Å; L47-F53 WeakPolarHBondContact O-CB 3.42Å; L47-F53 WeakPolarHBondContact O-CD1 3.49Å; L47-I74 HydrophobicContact CD1-CD1 4.43Å; L47-I74 HydrophobicContact CD1-CG2 3.89Å; L47-I122 HydrophobicContact CB-CD1 4.36Å; L47-I122 HydrophobicContact CD1-CD1 4.31Å; L47-I122 HydrophobicContact CD1-CG2 4.14Å; L47-I122 HydrophobicContact CD2-CD1 3.78Å; L47-I122 HydrophobicContact CG-CD1 4.36Å; L47-E533 PolarHBondContact N-OE2 3.25Å
48	A	85.4	Confident	83.3	Confident	54 Å²	54	34.9 Å²	34.9	45%	0.446	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-63.1	-14.3	-176.8	0	0	0	0	0	114.4	L46	L46-A48 PolarHBondContact O-N 3.07Å; L46-A48 VanDerWaalsContact O-N 3.13Å
49	Y	86.3	Confident	85.7	Confident	25 Å²	25	31.9 Å²	31.9	10%	0.098	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-112.3	1.4	-179.7	-58.9	-89.2	0	0	0	113	L46 L47 Y155 N548 V550	L46-Y49 HydrophobicContact CB-CD2 3.86Å; L46-Y49 HydrophobicContact CB-CE2 4.35Å; L46-Y49 HydrophobicContact CD1-CD2 4.47Å; L46-Y49 HydrophobicContact CD1-CE2 4.19Å; L46-Y49 PolarHBondContact O-N 2.8Å; L47-Y49 PolarHBondContact O-N 2.92Å; Y49-Y155 WeakPolarHBondContact O-CE2 3.35Å; Y49-N548 HydrophobicContact CD2-CB 4.25Å; Y49-N548 HydrophobicContact CE2-CB 4.37Å; Y49-V550 HydrophobicContact CE2-CG2 3.99Å
50	L	89.8	Confident	87.9	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.193	C	C	.	.			trans	-70.2	129.2	176.8	-65.4	-179.3	0	0	0	110.5	Q45 L46 L47 Y52 F53 I74 H123	Q45-L50 HydrophobicContact CB-CD2 3.57Å; L46-L50 PolarHBondContact O-N 2.89Å; L47-L50 HydrophobicContact CD1-CD1 4.1Å; L47-L50 WeakPolarHBondContact O-CB 3.32Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-L50 VanDerWaalsContact O-N 3.09Å; L50-Y52 HydrophobicContact CB-CE1 4.43Å; L50-Y52 HydrophobicContact CB-CE2 4.25Å; L50-Y52 HydrophobicContact CD1-CE2 3.82Å; L50-Y52 HydrophobicContact CD2-CE1 4.4Å; L50-Y52 HydrophobicContact CG-CE2 4.48Å; L50-Y52 PolarHBondContact O-N 3.47Å; L50-Y52 VanDerWaalsContact O-N 3.16Å; L50-F53 HydrophobicContact CB-CB 4.02Å; L50-F53 PolarHBondContact O-N 3.25Å; L50-F53 VanDerWaalsContact O-N 3.14Å; L50-I74 HydrophobicContact CD1-CD1 4.27Å; L50-H123 HydrophobicContact CD1-CB 4.34Å; L50-H123 HydrophobicContact CD2-CB 4.1Å; L50-H123 VanDerWaalsContact CD2-CD2 3.48Å; L50-H123 WeakPolarHBondContact CD2-CD2 3.39Å
51	P	89.4	Confident	89.7	Confident	25 Å²	25	34.9 Å²	34.9	16%	0.162	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.5	179.8	-24.7	34.8	0	0	0	114.7	S152 Y155	P51-S152 PolarHBondContact O-N 2.85Å; P51-Y155 HydrophobicContact CB-CD1 4.08Å; P51-Y155 HydrophobicContact CB-CE1 3.95Å; P51-Y155 HydrophobicContact CG-CE1 4.11Å; P51-Y155 HydrophobicContact CG-CE2 4.47Å
52	Y	93.6	Very high	90.8	Very high	5 Å²	5	29.2 Å²	29.2	2%	0.02	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	15.5	-179.7	52	-93.7	0	0	0	113.3	L50 H54 F72 I74 V126 E149 V150	L50-Y52 HydrophobicContact CB-CE1 4.43Å; L50-Y52 HydrophobicContact CB-CE2 4.25Å; L50-Y52 HydrophobicContact CD1-CE2 3.82Å; L50-Y52 HydrophobicContact CD2-CE1 4.4Å; L50-Y52 HydrophobicContact CG-CE2 4.48Å; L50-Y52 PolarHBondContact O-N 3.47Å; L50-Y52 VanDerWaalsContact O-N 3.16Å; Y52-H54 PolarHBondContact O-CD2 3.5Å; Y52-H54 VanDerWaalsContact O-CD2 3.3Å; Y52-F72 HydrophobicContact CD2-CE2 4.1Å; Y52-F72 HydrophobicContact CE2-CE2 4.16Å; Y52-I74 HydrophobicContact CD2-CD1 4Å; Y52-I74 HydrophobicContact CD2-CG1 3.97Å; Y52-I74 HydrophobicContact CE2-CD1 3.64Å; Y52-I74 HydrophobicContact CE2-CG1 4.12Å; Y52-I74 PolarHBondContact O-N 3.1Å; Y52-V126 HydrophobicContact CE2-CG1 4.08Å; Y52-E149 HydrophobicContact CD1-CB 3.83Å; Y52-E149 HydrophobicContact CD1-CG 3.55Å; Y52-E149 WeakPolarHBondContact CD1-OE2 3.4Å; Y52-E149 HydrophobicContact CE1-CG 3.88Å; Y52-E149 WeakPolarHBondContact CE1-OE1 3.02Å; Y52-E149 VanDerWaalsContact CE1-OE2 3.32Å; Y52-E149 WeakPolarHBondContact CE1-OE2 3.39Å; Y52-E149 HydrophobicContact CG-CB 4.04Å; Y52-E149 HydrophobicContact CG-CG 3.95Å; Y52-V150 WeakPolarHBondContact CA-O 3.42Å; Y52-V150 WeakPolarHBondContact CB-O 3.19Å
53	F	93.1	Very high	91.4	Very high	34 Å²	34	27.3 Å²	27.3	15%	0.149	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.1	166.9	175.2	-119	0	0	0	110.2	L47 L50 I74 L76 S152	L47-F53 HydrophobicContact CD1-CB 4.08Å; L47-F53 HydrophobicContact CD1-CD1 4.47Å; L47-F53 HydrophobicContact CD1-CD2 3.51Å; L47-F53 HydrophobicContact CD1-CE2 4Å; L47-F53 HydrophobicContact CD1-CG 3.77Å; L47-F53 HydrophobicContact CD2-CD2 4.26Å; L47-F53 HydrophobicContact CD2-CE2 3.88Å; L47-F53 HydrophobicContact CD2-CZ 4.06Å; L47-F53 HydrophobicContact CG-CD1 4.22Å; L47-F53 HydrophobicContact CG-CD2 3.89Å; L47-F53 HydrophobicContact CG-CE1 4.31Å; L47-F53 HydrophobicContact CG-CE2 3.99Å; L47-F53 HydrophobicContact CG-CG 4Å; L47-F53 HydrophobicContact CG-CZ 4.18Å; L47-F53 WeakPolarHBondContact O-CB 3.42Å; L47-F53 WeakPolarHBondContact O-CD1 3.49Å; L50-F53 HydrophobicContact CB-CB 4.02Å; L50-F53 PolarHBondContact O-N 3.25Å; L50-F53 VanDerWaalsContact O-N 3.14Å; F53-I74 CarbonylContact C-O 3.58Å; F53-I74 WeakPolarHBondContact CA-O 3.39Å; F53-I74 HydrophobicContact CD2-CB 4.22Å; F53-I74 HydrophobicContact CD2-CG2 4.05Å; F53-L76 HydrophobicContact CE2-CD2 3.99Å; F53-L76 HydrophobicContact CE2-CG 3.86Å; F53-L76 HydrophobicContact CZ-CD1 4.04Å; F53-L76 HydrophobicContact CZ-CD2 4.13Å; F53-L76 HydrophobicContact CZ-CG 3.78Å; F53-S152 WeakPolarHBondContact O-CB 3.29Å; F53-S152 PolarHBondContact O-OG 2.91Å
54	H	92.2	Very high	91.7	Very high	11 Å²	11	34.1 Å²	34.1	5%	0.051	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-3.8	-171.7	-70.7	-110.3	0	0	0	114.8	Y52 L57 I74 F75 V150 Q151 S152 N154	Y52-H54 PolarHBondContact O-CD2 3.5Å; Y52-H54 VanDerWaalsContact O-CD2 3.3Å; H54-L57 HydrophobicContact CB-CD1 3.59Å; H54-L57 HydrophobicContact CB-CG 4.27Å; H54-I74 PolarHBondContact N-O 3.37Å; H54-F75 HydrophobicContact CB-CB 4.45Å; H54-V150 PolarHBondContact NE2-O 3.17Å; H54-Q151 PolarHBondContact CE1-O 2.81Å; H54-S152 WeakPolarHBondContact CE1-CA 3.43Å; H54-S152 PolarHBondContact ND1-OG 3.11Å; H54-N154 PolarHBondContact O-ND2 3.39Å
55	G	88.7	Confident	91.9	Very high	19 Å²	19	37.3 Å²	37.3	20%	0.196	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.6	-151.4	-172.3	0	0	0	0	0	111.6	F75 L76	G55-F75 CarbonylContact O-C 3.53Å; G55-F75 WeakPolarHBondContact O-CA 3.14Å; G55-F75 WeakPolarHBondContact O-CB 3.28Å; G55-L76 PolarHBondContact O-N 2.79Å
56	A	90.3	Very high	92.1	Very high	43 Å²	43	35 Å²	35	36%	0.355	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.5	177.5	0	0	0	0	0	111	L76 E78 L82	A56-L76 WeakPolarHBondContact CA-O 3.34Å; A56-E78 HydrophobicContact CB-CG 3.88Å; A56-L82 HydrophobicContact CB-CD2 3.83Å
57	L	92.5	Very high	92	Very high	24 Å²	24	40.5 Å²	40.5	13%	0.126	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	155.8	174.9	-67	178.6	0	0	0	110.5	H54 E61 A62 L65 F75 L76 E78	H54-L57 HydrophobicContact CB-CD1 3.59Å; H54-L57 HydrophobicContact CB-CG 4.27Å; L57-E61 HydrophobicContact CD2-CB 4.34Å; L57-A62 HydrophobicContact CD1-CB 4.23Å; L57-L65 HydrophobicContact CD1-CD1 4.01Å; L57-F75 HydrophobicContact CB-CB 4.14Å; L57-F75 HydrophobicContact CB-CD2 3.73Å; L57-F75 HydrophobicContact CB-CE2 4.5Å; L57-F75 HydrophobicContact CB-CG 4.2Å; L57-F75 HydrophobicContact CD1-CB 4.04Å; L57-F75 HydrophobicContact CG-CB 4.26Å; L57-F75 WeakPolarHBondContact O-CD2 3.36Å; L57-L76 PolarHBondContact N-O 3.14Å; L57-E78 PolarHBondContact O-N 3.44Å; L57-E78 VanDerWaalsContact O-N 3.1Å
58	S	94.7	Very high	92	Very high	17 Å²	17	45.9 Å²	45.9	12%	0.119	26%	0.257	C	S	.	.			trans	-74.9	153.6	160.8	68.6	0	0	0	0	111.6	S60 E61 A62 H79	S58-S60 PolarHBondContact O-N 3.39Å; S58-S60 VanDerWaalsContact O-N 3.16Å; S58-E61 VanDerWaalsContact CB-OE2 3.31Å; S58-E61 WeakPolarHBondContact CB-OE2 3.2Å; S58-E61 PolarHBondContact N-OE2 3.07Å; S58-E61 PolarHBondContact O-N 3.13Å; S58-E61 VanDerWaalsContact OG-CD 3.22Å; S58-E61 VanDerWaalsContact OG-CG 3.25Å; S58-E61 WeakPolarHBondContact OG-CG 3.23Å; S58-E61 PolarHBondContact OG-N 3.38Å; S58-E61 PolarHBondContact OG-OE2 3.19Å; S58-A62 WeakPolarHBondContact O-CB 3.45Å; S58-A62 PolarHBondContact O-N 2.98Å; S58-H79 VanDerWaalsContact CB-CE1 3.45Å; S58-H79 WeakPolarHBondContact CB-CE1 3.47Å
59	P	94.6	Very high	92.3	Very high	33 Å²	33	49.3 Å²	49.3	21%	0.214	26%	0.261	C	S	.	.	H	α-helix	trans	-56.3	-30.7	173.2	-28.9	37.1	0	0	0	113.8	N63 D77 H79 F97	P59-N63 WeakPolarHBondContact O-CB 3.35Å; P59-N63 PolarHBondContact O-N 2.91Å; P59-N63 VanDerWaalsContact O-N 3.1Å; P59-D77 WeakPolarHBondContact CD-OD1 3.33Å; P59-H79 WeakPolarHBondContact CD-ND1 3.38Å; P59-F97 HydrophobicContact CB-CD1 4.22Å; P59-F97 HydrophobicContact CB-CE1 3.61Å; P59-F97 HydrophobicContact CB-CE2 4.48Å; P59-F97 HydrophobicContact CB-CZ 3.76Å; P59-F97 WeakPolarHBondContact O-CE1 3.24Å; P59-F97 VanDerWaalsContact O-CZ 3.29Å; P59-F97 WeakPolarHBondContact O-CZ 3.4Å
60	S	94.8	Very high	92.6	Very high	73 Å²	73	50 Å²	50	51%	0.51	27%	0.267	S	S	.	.	H	α-helix	trans	-67.7	-50.8	177.6	-167.4	0	0	0	0	111.4	S58 A62 N63 E64	S58-S60 PolarHBondContact O-N 3.39Å; S58-S60 VanDerWaalsContact O-N 3.16Å; S60-A62 VanDerWaalsContact C-N 3.32Å; S60-A62 PolarHBondContact O-N 2.92Å; S60-N63 PolarHBondContact O-N 3Å; S60-E64 WeakPolarHBondContact O-CG 3.45Å; S60-E64 PolarHBondContact O-N 3.01Å; S60-E64 VanDerWaalsContact O-N 3.15Å
61	E	94.6	Very high	92.9	Very high	93 Å²	93	50.7 Å²	50.7	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-61.3	-42.6	177.8	-69.8	161.2	140.9	0	0	111	L57 S58 N63 E64 L65	L57-E61 HydrophobicContact CD2-CB 4.34Å; S58-E61 VanDerWaalsContact CB-OE2 3.31Å; S58-E61 WeakPolarHBondContact CB-OE2 3.2Å; S58-E61 PolarHBondContact N-OE2 3.07Å; S58-E61 PolarHBondContact O-N 3.13Å; S58-E61 VanDerWaalsContact OG-CD 3.22Å; S58-E61 VanDerWaalsContact OG-CG 3.25Å; S58-E61 WeakPolarHBondContact OG-CG 3.23Å; S58-E61 PolarHBondContact OG-N 3.38Å; S58-E61 PolarHBondContact OG-OE2 3.19Å; E61-N63 VanDerWaalsContact C-N 3.33Å; E61-N63 PolarHBondContact O-N 3.13Å; E61-E64 PolarHBondContact O-N 2.96Å; E61-L65 WeakPolarHBondContact O-CG 3.45Å
62	A	94.9	Very high	93.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-40.6	178	0	0	0	0	0	112.3	L57 S58 S60 L65 L73 F75 V87	L57-A62 HydrophobicContact CD1-CB 4.23Å; S58-A62 WeakPolarHBondContact O-CB 3.45Å; S58-A62 PolarHBondContact O-N 2.98Å; S60-A62 VanDerWaalsContact C-N 3.32Å; S60-A62 PolarHBondContact O-N 2.92Å; A62-L65 PolarHBondContact O-N 2.88Å; A62-L73 HydrophobicContact CB-CD1 4.31Å; A62-F75 HydrophobicContact CB-CD1 3.9Å; A62-F75 HydrophobicContact CB-CD2 4.31Å; A62-F75 HydrophobicContact CB-CE1 3.8Å; A62-F75 HydrophobicContact CB-CE2 4.18Å; A62-F75 HydrophobicContact CB-CG 4.16Å; A62-F75 HydrophobicContact CB-CZ 3.94Å; A62-V87 HydrophobicContact CB-CG1 3.93Å
63	N	95.2	Very high	93.4	Very high	44 Å²	44	49.3 Å²	49.3	24%	0.235	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-36.2	176.7	166.5	58.1	0	0	0	113.1	P59 S60 E61 L65 L66 R89 P95 F97	P59-N63 WeakPolarHBondContact O-CB 3.35Å; P59-N63 PolarHBondContact O-N 2.91Å; P59-N63 VanDerWaalsContact O-N 3.1Å; S60-N63 PolarHBondContact O-N 3Å; E61-N63 VanDerWaalsContact C-N 3.33Å; E61-N63 PolarHBondContact O-N 3.13Å; N63-L65 PolarHBondContact O-N 2.96Å; N63-L66 PolarHBondContact O-N 2.97Å; N63-R89 PolarHBondContact O-NH2 2.77Å; N63-R89 VanDerWaalsContact O-NH2 3.08Å; N63-R89 PolarHBondContact OD1-NH2 2.92Å; N63-R89 VanDerWaalsContact OD1-NH2 3.08Å; N63-P95 HydrophobicContact CB-CB 4.01Å; N63-P95 HydrophobicContact CB-CG 4.09Å; N63-P95 WeakPolarHBondContact OD1-CB 3.37Å; N63-P95 VanDerWaalsContact OD1-CG 3.31Å; N63-P95 WeakPolarHBondContact OD1-CG 3.46Å; N63-F97 HydrophobicContact CB-CZ 4.26Å
64	E	94.1	Very high	93.6	Very high	142 Å²	142	47.7 Å²	47.7	66%	0.664	26%	0.255	S	S	*	.	H	α-helix	trans	-62.1	-22.8	178.8	-73.2	178.9	-173.1	0	0	112.9	S60 E61	S60-E64 WeakPolarHBondContact O-CG 3.45Å; S60-E64 PolarHBondContact O-N 3.01Å; S60-E64 VanDerWaalsContact O-N 3.15Å; E61-E64 PolarHBondContact O-N 2.96Å
65	L	93.4	Very high	93.7	Very high	69 Å²	69	47.1 Å²	47.1	36%	0.361	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-19.4	179.4	-62.2	172	0	0	0	113.9	L57 E61 A62 N63 L73 V150	L57-L65 HydrophobicContact CD1-CD1 4.01Å; E61-L65 WeakPolarHBondContact O-CG 3.45Å; A62-L65 PolarHBondContact O-N 2.88Å; N63-L65 PolarHBondContact O-N 2.96Å; L65-L73 HydrophobicContact CB-CD2 3.64Å; L65-L73 HydrophobicContact CD1-CD2 3.86Å; L65-L73 HydrophobicContact CG-CD2 4.41Å; L65-V150 HydrophobicContact CB-CG1 4.42Å
66	L	93	Very high	93.9	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	25%	0.247	C	C	.	.			trans	-83.6	128.6	179.8	-60.9	178.8	0	0	0	110.4	N63 D71 L73 V87 R89 V150	N63-L66 PolarHBondContact O-N 2.97Å; L66-D71 HydrophobicContact CD2-CB 3.96Å; L66-D71 WeakPolarHBondContact CD2-O 3.37Å; L66-L73 HydrophobicContact CD2-CD2 4.17Å; L66-L73 HydrophobicContact CD2-CG 4.31Å; L66-V87 HydrophobicContact CD1-CB 4.22Å; L66-V87 HydrophobicContact CD1-CG1 3.91Å; L66-V87 HydrophobicContact CD1-CG2 3.62Å; L66-V87 HydrophobicContact CD2-CG1 4.46Å; L66-V87 HydrophobicContact CG-CG1 4.29Å; L66-R89 HydrophobicContact CB-CB 4.27Å; L66-R89 HydrophobicContact CD1-CB 4.15Å; L66-R89 PolarHBondContact O-NE 2.75Å; L66-R89 PolarHBondContact O-NH2 3.4Å; L66-V150 HydrophobicContact CD2-CG2 3.91Å
67	L	89	Confident	94	Very high	122 Å²	122	45.6 Å²	45.6	64%	0.639	23%	0.233	S	C	*	.			trans	-110.4	-37	-175.6	-63.1	178	0	0	0	113.5	D71	L67-D71 PolarHBondContact N-OD2 2.96Å; L67-D71 VanDerWaalsContact N-OD2 3.11Å
68	H	92	Very high	93.9	Very high	126 Å²	126	49.6 Å²	49.6	58%	0.583	25%	0.252	S	S	*	.	S	Bend	trans	-126.8	158.1	-171.2	-55	-54.9	0	0	0	112.1	D70 D71 R89	H68-D70 PolarHBondContact O-N 2.78Å; H68-D71 IonicContact CD2-OD2 4Å; H68-D71 IonicContact CG-OD2 2.72Å; H68-D71 PolarHBondContact N-OD2 3.12Å; H68-D71 WeakPolarHBondContact O-CB 3.11Å; H68-D71 VanDerWaalsContact O-CG 3.27Å; H68-D71 PolarHBondContact O-N 2.62Å; H68-D71 VanDerWaalsContact O-N 3.08Å; H68-R89 WeakPolarHBondContact O-CB 3.19Å; H68-R89 VanDerWaalsContact O-CD 3.31Å; H68-R89 WeakPolarHBondContact O-CD 3.27Å
69	K	91.9	Very high	93.8	Very high	126 Å²	126	55.6 Å²	55.6	55%	0.548	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	138.6	174.3	-176.4	-160.7	165.6	-161.6	0	109.7	D71 C91	K69-D71 PolarHBondContact O-N 3.32Å; K69-D71 VanDerWaalsContact O-N 3.16Å; K69-C91 HydrophobicContact CD-CB 4.36Å
70	D	93.4	Very high	93.4	Very high	38 Å²	38	56.7 Å²	56.7	20%	0.203	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	1.6	-179.1	-48.6	-38.5	0	0	0	113.9	H68 F72 R89 G147 A148	H68-D70 PolarHBondContact O-N 2.78Å; D70-F72 PolarHBondContact O-N 3.37Å; D70-R89 PolarHBondContact N-O 2.73Å; D70-G147 CarbonylContact O-C 3.48Å; D70-G147 WeakPolarHBondContact O-CA 3.41Å; D70-G147 PolarHBondContact O-N 2.83Å; D70-A148 PolarHBondContact O-N 2.82Å
71	D	95.1	Very high	93	Very high	17 Å²	17	64.2 Å²	64.2	9%	0.091	30%	0.299	C	S	.	.			trans	-59.1	136.8	163.9	-73.9	-1.7	0	0	0	108.7	L66 L67 H68 K69 V88 R89 A148 V150	L66-D71 HydrophobicContact CD2-CB 3.96Å; L66-D71 WeakPolarHBondContact CD2-O 3.37Å; L67-D71 PolarHBondContact N-OD2 2.96Å; L67-D71 VanDerWaalsContact N-OD2 3.11Å; H68-D71 IonicContact CD2-OD2 4Å; H68-D71 IonicContact CG-OD2 2.72Å; H68-D71 PolarHBondContact N-OD2 3.12Å; H68-D71 WeakPolarHBondContact O-CB 3.11Å; H68-D71 VanDerWaalsContact O-CG 3.27Å; H68-D71 PolarHBondContact O-N 2.62Å; H68-D71 VanDerWaalsContact O-N 3.08Å; K69-D71 PolarHBondContact O-N 3.32Å; K69-D71 VanDerWaalsContact O-N 3.16Å; D71-V88 WeakPolarHBondContact O-CA 3.42Å; D71-R89 PolarHBondContact O-N 2.98Å; D71-R89 VanDerWaalsContact O-N 3.08Å; D71-A148 CarbonylContact C-O 3.59Å; D71-A148 WeakPolarHBondContact CA-O 3.46Å; D71-V150 HydrophobicContact CB-CG2 3.89Å
72	F	97.4	Very high	92.7	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	159.1	177.2	78.2	-83.1	0	0	0	112.8	Y52 D70 V86 V87 V88 V126 L146 A148 E149 V150	Y52-F72 HydrophobicContact CD2-CE2 4.1Å; Y52-F72 HydrophobicContact CE2-CE2 4.16Å; D70-F72 PolarHBondContact O-N 3.37Å; F72-V86 HydrophobicContact CB-CG1 4.25Å; F72-V86 HydrophobicContact CD2-CG1 4.23Å; F72-V87 WeakPolarHBondContact CA-O 3.45Å; F72-V87 WeakPolarHBondContact CB-O 3.37Å; F72-V88 HydrophobicContact CB-CB 4.04Å; F72-V88 HydrophobicContact CB-CG2 4.16Å; F72-V126 HydrophobicContact CE2-CG1 3.72Å; F72-V126 HydrophobicContact CZ-CG1 4.02Å; F72-L146 HydrophobicContact CB-CD2 4.03Å; F72-L146 HydrophobicContact CD1-CB 3.88Å; F72-L146 HydrophobicContact CD1-CD2 4.42Å; F72-L146 HydrophobicContact CD2-CD2 4.26Å; F72-L146 HydrophobicContact CE1-CB 3.91Å; F72-L146 HydrophobicContact CE2-CD1 4.47Å; F72-L146 HydrophobicContact CG-CB 4.27Å; F72-L146 HydrophobicContact CG-CD2 3.98Å; F72-L146 HydrophobicContact CZ-CB 4.34Å; F72-A148 WeakPolarHBondContact CD1-O 3.46Å; F72-A148 PolarHBondContact N-O 3.41Å; F72-E149 HydrophobicContact CE1-CB 4.46Å; F72-E149 HydrophobicContact CE1-CG 3.72Å; F72-E149 HydrophobicContact CE2-CG 4.23Å; F72-E149 HydrophobicContact CZ-CB 4.38Å; F72-E149 HydrophobicContact CZ-CG 3.4Å; F72-V150 PolarHBondContact O-N 3.36Å
73	L	97.2	Very high	92.5	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	165.9	168.7	63	85.7	0	0	0	111	A62 L65 L66 F75 V86 V87 V150	A62-L73 HydrophobicContact CB-CD1 4.31Å; L65-L73 HydrophobicContact CB-CD2 3.64Å; L65-L73 HydrophobicContact CD1-CD2 3.86Å; L65-L73 HydrophobicContact CG-CD2 4.41Å; L66-L73 HydrophobicContact CD2-CD2 4.17Å; L66-L73 HydrophobicContact CD2-CG 4.31Å; L73-F75 HydrophobicContact CD1-CB 4.13Å; L73-F75 HydrophobicContact CD1-CD1 3.78Å; L73-F75 HydrophobicContact CD1-CG 4.32Å; L73-V86 WeakPolarHBondContact O-CA 3.38Å; L73-V87 HydrophobicContact CD1-CG1 3.59Å; L73-V87 HydrophobicContact CD2-CG1 4.3Å; L73-V87 HydrophobicContact CG-CG1 3.59Å; L73-V87 PolarHBondContact N-O 2.75Å; L73-V87 VanDerWaalsContact N-O 3.13Å; L73-V87 PolarHBondContact O-N 3.44Å; L73-V87 VanDerWaalsContact O-N 3.11Å; L73-V150 HydrophobicContact CB-CB 4.24Å; L73-V150 HydrophobicContact CD2-CB 4.31Å; L73-V150 HydrophobicContact CD2-CG1 4.35Å
74	I	96.2	Very high	92.4	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.9	175.1	-48.3	-176.3	0	0	0	109.3	L47 L50 Y52 F53 H54 T85 V86 I100 I122 V126	L47-I74 HydrophobicContact CD1-CD1 4.43Å; L47-I74 HydrophobicContact CD1-CG2 3.89Å; L50-I74 HydrophobicContact CD1-CD1 4.27Å; Y52-I74 HydrophobicContact CD2-CD1 4Å; Y52-I74 HydrophobicContact CD2-CG1 3.97Å; Y52-I74 HydrophobicContact CE2-CD1 3.64Å; Y52-I74 HydrophobicContact CE2-CG1 4.12Å; Y52-I74 PolarHBondContact O-N 3.1Å; F53-I74 CarbonylContact C-O 3.58Å; F53-I74 WeakPolarHBondContact CA-O 3.39Å; F53-I74 HydrophobicContact CD2-CB 4.22Å; F53-I74 HydrophobicContact CD2-CG2 4.05Å; H54-I74 PolarHBondContact N-O 3.37Å; I74-T85 WeakPolarHBondContact CA-O 3.44Å; I74-V86 HydrophobicContact CG1-CG2 4.18Å; I74-I100 HydrophobicContact CG2-CD1 4.32Å; I74-I122 HydrophobicContact CD1-CG2 3.89Å; I74-V126 HydrophobicContact CD1-CG2 3.68Å
75	F	94.5	Very high	92.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	166.8	175.2	71.2	-74	0	0	0	110.4	H54 G55 L57 A62 L73 D77 P84 T85 V87 F97	H54-F75 HydrophobicContact CB-CB 4.45Å; G55-F75 CarbonylContact O-C 3.53Å; G55-F75 WeakPolarHBondContact O-CA 3.14Å; G55-F75 WeakPolarHBondContact O-CB 3.28Å; L57-F75 HydrophobicContact CB-CB 4.14Å; L57-F75 HydrophobicContact CB-CD2 3.73Å; L57-F75 HydrophobicContact CB-CE2 4.5Å; L57-F75 HydrophobicContact CB-CG 4.2Å; L57-F75 HydrophobicContact CD1-CB 4.04Å; L57-F75 HydrophobicContact CG-CB 4.26Å; L57-F75 WeakPolarHBondContact O-CD2 3.36Å; A62-F75 HydrophobicContact CB-CD1 3.9Å; A62-F75 HydrophobicContact CB-CD2 4.31Å; A62-F75 HydrophobicContact CB-CE1 3.8Å; A62-F75 HydrophobicContact CB-CE2 4.18Å; A62-F75 HydrophobicContact CB-CG 4.16Å; A62-F75 HydrophobicContact CB-CZ 3.94Å; L73-F75 HydrophobicContact CD1-CB 4.13Å; L73-F75 HydrophobicContact CD1-CD1 3.78Å; L73-F75 HydrophobicContact CD1-CG 4.32Å; F75-D77 HydrophobicContact CE2-CB 3.85Å; F75-D77 HydrophobicContact CZ-CB 4.44Å; F75-P84 CarbonylContact O-C 3.5Å; F75-P84 WeakPolarHBondContact O-CA 3.45Å; F75-T85 VanDerWaalsContact CD1-O 3.23Å; F75-T85 WeakPolarHBondContact CD1-O 3.48Å; F75-T85 HydrophobicContact CE1-CG2 3.74Å; F75-T85 HydrophobicContact CZ-CG2 3.85Å; F75-T85 PolarHBondContact N-O 3.4Å; F75-T85 PolarHBondContact O-N 3Å; F75-V87 HydrophobicContact CD1-CG1 4.28Å; F75-V87 HydrophobicContact CE1-CB 4Å; F75-V87 HydrophobicContact CE1-CG1 4.05Å; F75-F97 HydrophobicContact CE1-CD1 4.21Å; F75-F97 HydrophobicContact CE1-CE1 4.47Å; F75-F97 AromaticContact CZ-CD1 3.98Å; F75-F97 HydrophobicContact CZ-CD1 3.98Å; F75-F97 HydrophobicContact CZ-CE1 4.19Å
76	L	92.8	Very high	92.6	Very high	14 Å²	14	53.6 Å²	53.6	7%	0.073	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119.6	169.2	-53.9	178.7	0	0	0	107.9	F53 G55 A56 L57 E78 L82 P84 F531	F53-L76 HydrophobicContact CE2-CD2 3.99Å; F53-L76 HydrophobicContact CE2-CG 3.86Å; F53-L76 HydrophobicContact CZ-CD1 4.04Å; F53-L76 HydrophobicContact CZ-CD2 4.13Å; F53-L76 HydrophobicContact CZ-CG 3.78Å; G55-L76 PolarHBondContact O-N 2.79Å; A56-L76 WeakPolarHBondContact CA-O 3.34Å; L57-L76 PolarHBondContact N-O 3.14Å; L76-E78 PolarHBondContact O-N 3.34Å; L76-L82 HydrophobicContact CB-CB 4.02Å; L76-L82 HydrophobicContact CB-CD2 4.03Å; L76-P84 HydrophobicContact CD2-CB 4.19Å; L76-P84 HydrophobicContact CD2-CG 3.87Å; L76-F531 HydrophobicContact CD2-CE2 4.39Å
77	D	93.2	Very high	92.8	Very high	15 Å²	15	53.4 Å²	53.4	8%	0.08	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	110	-174.7	-169.7	-18.1	0	0	0	111.6	P59 F75 H79 D80 L82 I83	P59-D77 WeakPolarHBondContact CD-OD1 3.33Å; F75-D77 HydrophobicContact CE2-CB 3.85Å; F75-D77 HydrophobicContact CZ-CB 4.44Å; D77-H79 PolarHBondContact O-N 3.05Å; D77-H79 WeakPolarHBondContact OD1-CA 3.3Å; D77-H79 WeakPolarHBondContact OD1-CB 3.17Å; D77-H79 PolarHBondContact OD1-N 2.85Å; D77-H79 IonicContact OD1-ND1 3.88Å; D77-D80 HydrophobicContact CB-CB 4.27Å; D77-D80 CarbonylContact O-C 3.37Å; D77-D80 PolarHBondContact O-N 3.01Å; D77-D80 VanDerWaalsContact O-N 3.12Å; D77-D80 PolarHBondContact OD1-N 3.18Å; D77-L82 VanDerWaalsContact O-CA 3.26Å; D77-L82 WeakPolarHBondContact O-CA 3.35Å; D77-L82 PolarHBondContact O-N 3.5Å; D77-I83 PolarHBondContact N-O 3.31Å
78	E	90.5	Very high	93.2	Very high	109 Å²	109	47.6 Å²	47.6	51%	0.509	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.7	178	-69.9	-171.3	156.7	0	0	113.5	A56 L57 L76 L82	A56-E78 HydrophobicContact CB-CG 3.88Å; L57-E78 PolarHBondContact O-N 3.44Å; L57-E78 VanDerWaalsContact O-N 3.1Å; L76-E78 PolarHBondContact O-N 3.34Å; E78-L82 HydrophobicContact CG-CD2 4.21Å
79	H	91.4	Very high	93.3	Very high	143 Å²	143	42.6 Å²	42.6	66%	0.662	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-18.7	178.5	-65.8	77.7	0	0	0	112.5	S58 P59 D77	S58-H79 VanDerWaalsContact CB-CE1 3.45Å; S58-H79 WeakPolarHBondContact CB-CE1 3.47Å; P59-H79 WeakPolarHBondContact CD-ND1 3.38Å; D77-H79 PolarHBondContact O-N 3.05Å; D77-H79 WeakPolarHBondContact OD1-CA 3.3Å; D77-H79 WeakPolarHBondContact OD1-CB 3.17Å; D77-H79 PolarHBondContact OD1-N 2.85Å; D77-H79 IonicContact OD1-ND1 3.88Å
80	D	86.6	Confident	93.3	Very high	56 Å²	56	37 Å²	37	30%	0.299	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	56.3	-179	-158	10.1	0	0	0	112	D77 L82 I83 Q99	D77-D80 HydrophobicContact CB-CB 4.27Å; D77-D80 CarbonylContact O-C 3.37Å; D77-D80 PolarHBondContact O-N 3.01Å; D77-D80 VanDerWaalsContact O-N 3.12Å; D77-D80 PolarHBondContact OD1-N 3.18Å; D80-L82 PolarHBondContact O-N 2.84Å; D80-I83 WeakPolarHBondContact O-CB 3.34Å; D80-I83 WeakPolarHBondContact O-CD1 3.25Å; D80-I83 WeakPolarHBondContact O-CG1 3.14Å; D80-I83 PolarHBondContact O-N 2.96Å; D80-Q99 PolarHBondContact OD2-NE2 3.44Å
81	R	86.3	Confident	93	Very high	231 Å²	231	39.9 Å²	39.9	87%	0.872	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	34.9	170	-55	-179.6	179.2	178.3	0.8	114.1	I83	R81-I83 VanDerWaalsContact C-N 3.29Å; R81-I83 PolarHBondContact O-N 3.28Å
82	L	88.3	Confident	92.7	Very high	76 Å²	76	43.2 Å²	43.2	40%	0.398	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	32.1	179.7	-56.1	174.9	0	0	0	113.5	A56 L76 D77 E78 D80 F531	A56-L82 HydrophobicContact CB-CD2 3.83Å; L76-L82 HydrophobicContact CB-CB 4.02Å; L76-L82 HydrophobicContact CB-CD2 4.03Å; D77-L82 VanDerWaalsContact O-CA 3.26Å; D77-L82 WeakPolarHBondContact O-CA 3.35Å; D77-L82 PolarHBondContact O-N 3.5Å; E78-L82 HydrophobicContact CG-CD2 4.21Å; D80-L82 PolarHBondContact O-N 2.84Å; L82-F531 WeakPolarHBondContact O-CE2 3.24Å
83	I	90.8	Very high	92.2	Very high	47 Å²	47	48.2 Å²	48.2	24%	0.241	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	130.6	172.5	-68.8	169.1	0	0	0	110.2	D77 D80 R81 T85 Q99	D77-I83 PolarHBondContact N-O 3.31Å; D80-I83 WeakPolarHBondContact O-CB 3.34Å; D80-I83 WeakPolarHBondContact O-CD1 3.25Å; D80-I83 WeakPolarHBondContact O-CG1 3.14Å; D80-I83 PolarHBondContact O-N 2.96Å; R81-I83 VanDerWaalsContact C-N 3.29Å; R81-I83 PolarHBondContact O-N 3.28Å; I83-T85 PolarHBondContact O-N 2.82Å; I83-T85 PolarHBondContact O-OG1 3.19Å; I83-T85 VanDerWaalsContact O-OG1 3.04Å; I83-Q99 HydrophobicContact CG2-CB 4.26Å; I83-Q99 HydrophobicContact CG2-CG 4.26Å
84	P	93	Very high	91.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	124.2	178.3	-20.8	28.4	0	0	0	108.1	F75 L76 I100 I122 F531	F75-P84 CarbonylContact O-C 3.5Å; F75-P84 WeakPolarHBondContact O-CA 3.45Å; L76-P84 HydrophobicContact CD2-CB 4.19Å; L76-P84 HydrophobicContact CD2-CG 3.87Å; P84-I100 HydrophobicContact CB-CB 4.21Å; P84-I100 HydrophobicContact CB-CD1 4.07Å; P84-I100 HydrophobicContact CB-CG1 4.39Å; P84-I100 WeakPolarHBondContact O-CB 3.46Å; P84-I100 PolarHBondContact O-N 3.11Å; P84-I122 HydrophobicContact CB-CD1 4.25Å; P84-I122 HydrophobicContact CG-CD1 4.32Å; P84-F531 VanDerWaalsContact CD-CE1 3.4Å; P84-F531 HydrophobicContact CG-CD1 3.91Å; P84-F531 HydrophobicContact CG-CD2 3.14Å; P84-F531 HydrophobicContact CG-CE1 3.87Å; P84-F531 HydrophobicContact CG-CE2 3.24Å; P84-F531 HydrophobicContact CG-CG 3.6Å; P84-F531 HydrophobicContact CG-CZ 3.62Å
85	T	95.6	Very high	91.8	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.2	-173.4	-60.8	0	0	0	0	107.7	I74 F75 I83 F97 I98	I74-T85 WeakPolarHBondContact CA-O 3.44Å; F75-T85 VanDerWaalsContact CD1-O 3.23Å; F75-T85 WeakPolarHBondContact CD1-O 3.48Å; F75-T85 HydrophobicContact CE1-CG2 3.74Å; F75-T85 HydrophobicContact CZ-CG2 3.85Å; F75-T85 PolarHBondContact N-O 3.4Å; F75-T85 PolarHBondContact O-N 3Å; I83-T85 PolarHBondContact O-N 2.82Å; I83-T85 PolarHBondContact O-OG1 3.19Å; I83-T85 VanDerWaalsContact O-OG1 3.04Å; T85-F97 HydrophobicContact CG2-CB 4.07Å; T85-F97 HydrophobicContact CG2-CD1 4.38Å; T85-I98 CarbonylContact C-O 3.59Å; T85-I98 WeakPolarHBondContact CA-O 3.5Å
86	V	97.1	Very high	91.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.5	166.5	-179.2	0	0	0	0	107.4	F72 L73 I74 I98 I100 F110 L146	F72-V86 HydrophobicContact CB-CG1 4.25Å; F72-V86 HydrophobicContact CD2-CG1 4.23Å; L73-V86 WeakPolarHBondContact O-CA 3.38Å; I74-V86 HydrophobicContact CG1-CG2 4.18Å; V86-I98 PolarHBondContact N-O 3.23Å; V86-I98 PolarHBondContact O-N 3.47Å; V86-I100 HydrophobicContact CG2-CD1 3.91Å; V86-I100 HydrophobicContact CG2-CG1 4.09Å; V86-F110 HydrophobicContact CB-CE1 4.2Å; V86-F110 HydrophobicContact CG2-CE1 3.55Å; V86-F110 HydrophobicContact CG2-CZ 3.69Å; V86-L146 HydrophobicContact CG1-CD2 3.81Å
87	V	96.9	Very high	92	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.3	164.4	64.3	0	0	0	0	108.3	A62 L66 F72 L73 F75 P95 Q96 F97	A62-V87 HydrophobicContact CB-CG1 3.93Å; L66-V87 HydrophobicContact CD1-CB 4.22Å; L66-V87 HydrophobicContact CD1-CG1 3.91Å; L66-V87 HydrophobicContact CD1-CG2 3.62Å; L66-V87 HydrophobicContact CD2-CG1 4.46Å; L66-V87 HydrophobicContact CG-CG1 4.29Å; F72-V87 WeakPolarHBondContact CA-O 3.45Å; F72-V87 WeakPolarHBondContact CB-O 3.37Å; L73-V87 HydrophobicContact CD1-CG1 3.59Å; L73-V87 HydrophobicContact CD2-CG1 4.3Å; L73-V87 HydrophobicContact CG-CG1 3.59Å; L73-V87 PolarHBondContact N-O 2.75Å; L73-V87 VanDerWaalsContact N-O 3.13Å; L73-V87 PolarHBondContact O-N 3.44Å; L73-V87 VanDerWaalsContact O-N 3.11Å; F75-V87 HydrophobicContact CD1-CG1 4.28Å; F75-V87 HydrophobicContact CE1-CB 4Å; F75-V87 HydrophobicContact CE1-CG1 4.05Å; V87-P95 HydrophobicContact CG2-CB 3.86Å; V87-Q96 WeakPolarHBondContact CA-O 3.41Å; V87-F97 HydrophobicContact CB-CD1 3.82Å; V87-F97 HydrophobicContact CB-CE1 3.86Å; V87-F97 HydrophobicContact CG2-CD1 3.62Å; V87-F97 HydrophobicContact CG2-CE1 3.38Å; V87-F97 HydrophobicContact CG2-CE2 4.41Å; V87-F97 HydrophobicContact CG2-CG 4.24Å; V87-F97 HydrophobicContact CG2-CZ 3.82Å
88	V	96.9	Very high	92.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.4	178.8	60.5	0	0	0	0	110.4	D71 F72 Q96 I98 V144 R145 L146	D71-V88 WeakPolarHBondContact O-CA 3.42Å; F72-V88 HydrophobicContact CB-CB 4.04Å; F72-V88 HydrophobicContact CB-CG2 4.16Å; V88-Q96 HydrophobicContact CG1-CB 4.01Å; V88-Q96 PolarHBondContact N-O 3.11Å; V88-Q96 PolarHBondContact O-N 2.93Å; V88-I98 HydrophobicContact CG1-CD1 4Å; V88-V144 HydrophobicContact CG1-CB 3.72Å; V88-V144 HydrophobicContact CG1-CG1 4.1Å; V88-V144 HydrophobicContact CG1-CG2 3.47Å; V88-V144 VanDerWaalsContact CG1-CG2 3.47Å; V88-R145 WeakPolarHBondContact CG2-O 3.26Å; V88-L146 HydrophobicContact CB-CD2 4.38Å; V88-L146 HydrophobicContact CG2-CD2 4.42Å
89	R	94.2	Very high	92.4	Very high	22 Å²	22	57.6 Å²	57.6	8%	0.083	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	115.9	179.6	-174.8	170.1	-74.7	-59.1	-9.2	110.2	N63 L66 H68 D70 D71 N93	N63-R89 PolarHBondContact O-NH2 2.77Å; N63-R89 VanDerWaalsContact O-NH2 3.08Å; N63-R89 PolarHBondContact OD1-NH2 2.92Å; N63-R89 VanDerWaalsContact OD1-NH2 3.08Å; L66-R89 HydrophobicContact CB-CB 4.27Å; L66-R89 HydrophobicContact CD1-CB 4.15Å; L66-R89 PolarHBondContact O-NE 2.75Å; L66-R89 PolarHBondContact O-NH2 3.4Å; H68-R89 WeakPolarHBondContact O-CB 3.19Å; H68-R89 VanDerWaalsContact O-CD 3.31Å; H68-R89 WeakPolarHBondContact O-CD 3.27Å; D70-R89 PolarHBondContact N-O 2.73Å; D71-R89 PolarHBondContact O-N 2.98Å; D71-R89 VanDerWaalsContact O-N 3.08Å; R89-N93 WeakPolarHBondContact CD-OD1 3.42Å; R89-N93 PolarHBondContact NH1-O 3.23Å; R89-N93 PolarHBondContact NH1-OD1 3.15Å
90	D	92	Very high	92.5	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.048	25%	0.252	C	S	.	.			trans	-76.8	178	-177.1	71.4	25.5	0	0	0	113.8	T92 N93 K94 Q96 V144	D90-T92 PolarHBondContact O-N 3.08Å; D90-T92 VanDerWaalsContact OD1-C 3.28Å; D90-T92 WeakPolarHBondContact OD1-CA 3.46Å; D90-T92 WeakPolarHBondContact OD1-CB 3.28Å; D90-T92 PolarHBondContact OD1-N 3.48Å; D90-T92 PolarHBondContact OD1-OG1 3.14Å; D90-T92 PolarHBondContact OD2-OG1 3.29Å; D90-N93 PolarHBondContact O-N 3.32Å; D90-N93 PolarHBondContact OD1-N 3.35Å; D90-N93 VanDerWaalsContact OD1-N 3.11Å; D90-K94 PolarHBondContact N-O 2.72Å; D90-K94 PolarHBondContact OD1-N 3.26Å; D90-Q96 HydrophobicContact CB-CG 3.91Å; D90-Q96 PolarHBondContact OD2-NE2 2.85Å; D90-V144 HydrophobicContact CB-CG1 3.68Å
91	C	87.3	Confident	92.8	Very high	98 Å²	98	52.6 Å²	52.6	66%	0.662	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.9	178.5	64.1	0	0	0	0	114.4	K69 N93	K69-C91 HydrophobicContact CD-CB 4.36Å; C91-N93 VanDerWaalsContact C-N 3.3Å
92	T	89.2	Confident	93	Very high	87 Å²	87	44.8 Å²	44.8	53%	0.534	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	8.3	174.6	75.6	0	0	0	0	112.5	D90 K94	D90-T92 PolarHBondContact O-N 3.08Å; D90-T92 VanDerWaalsContact OD1-C 3.28Å; D90-T92 WeakPolarHBondContact OD1-CA 3.46Å; D90-T92 WeakPolarHBondContact OD1-CB 3.28Å; D90-T92 PolarHBondContact OD1-N 3.48Å; D90-T92 PolarHBondContact OD1-OG1 3.14Å; D90-T92 PolarHBondContact OD2-OG1 3.29Å; T92-K94 PolarHBondContact O-N 3.03Å; T92-K94 WeakPolarHBondContact OG1-CG 3.37Å
93	N	86.6	Confident	93.1	Very high	104 Å²	104	42.4 Å²	42.4	56%	0.556	22%	0.22	S	C	*	.	S	Bend	trans	62.1	29	-176.4	-165	24.5	0	0	0	113.3	R89 D90 C91	R89-N93 WeakPolarHBondContact CD-OD1 3.42Å; R89-N93 PolarHBondContact NH1-O 3.23Å; R89-N93 PolarHBondContact NH1-OD1 3.15Å; D90-N93 PolarHBondContact O-N 3.32Å; D90-N93 PolarHBondContact OD1-N 3.35Å; D90-N93 VanDerWaalsContact OD1-N 3.11Å; C91-N93 VanDerWaalsContact C-N 3.3Å
94	K	91.3	Very high	92.8	Very high	131 Å²	131	47.8 Å²	47.8	57%	0.57	26%	0.255	S	S	*	.			trans	-106	143.4	175.2	-67.1	-178.6	-178.9	178.6	0	110.6	D90 T92	D90-K94 PolarHBondContact N-O 2.72Å; D90-K94 PolarHBondContact OD1-N 3.26Å; T92-K94 PolarHBondContact O-N 3.03Å; T92-K94 WeakPolarHBondContact OG1-CG 3.37Å
95	P	94.3	Very high	92.3	Very high	38 Å²	38	51.3 Å²	51.3	25%	0.247	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.3	173.5	31.1	-35.5	0	0	0	110.1	N63 V87 F97	N63-P95 HydrophobicContact CB-CB 4.01Å; N63-P95 HydrophobicContact CB-CG 4.09Å; N63-P95 WeakPolarHBondContact OD1-CB 3.37Å; N63-P95 VanDerWaalsContact OD1-CG 3.31Å; N63-P95 WeakPolarHBondContact OD1-CG 3.46Å; V87-P95 HydrophobicContact CG2-CB 3.86Å; P95-F97 HydrophobicContact CB-CE2 3.76Å; P95-F97 HydrophobicContact CB-CZ 3.92Å; P95-F97 HydrophobicContact CG-CE2 3.88Å; P95-F97 HydrophobicContact CG-CZ 4.23Å
96	Q	95.8	Very high	91.9	Very high	26 Å²	26	51.5 Å²	51.5	12%	0.121	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.1	169.7	-62.9	-64	-36.6	0	0	108.3	V87 V88 D90 T138 V144	V87-Q96 WeakPolarHBondContact CA-O 3.41Å; V88-Q96 HydrophobicContact CG1-CB 4.01Å; V88-Q96 PolarHBondContact N-O 3.11Å; V88-Q96 PolarHBondContact O-N 2.93Å; D90-Q96 HydrophobicContact CB-CG 3.91Å; D90-Q96 PolarHBondContact OD2-NE2 2.85Å; Q96-T138 HydrophobicContact CB-CG2 3.9Å; Q96-T138 HydrophobicContact CG-CG2 4.13Å; Q96-T138 PolarHBondContact OE1-OG1 2.81Å; Q96-V144 HydrophobicContact CB-CG1 4.05Å; Q96-V144 HydrophobicContact CG-CG1 3.64Å
97	F	95.4	Very high	91.5	Very high	79 Å²	79	51.5 Å²	51.5	35%	0.346	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.2	180	-59.5	-90	0	0	0	109	P59 N63 F75 T85 V87 P95	P59-F97 HydrophobicContact CB-CD1 4.22Å; P59-F97 HydrophobicContact CB-CE1 3.61Å; P59-F97 HydrophobicContact CB-CE2 4.48Å; P59-F97 HydrophobicContact CB-CZ 3.76Å; P59-F97 WeakPolarHBondContact O-CE1 3.24Å; P59-F97 VanDerWaalsContact O-CZ 3.29Å; P59-F97 WeakPolarHBondContact O-CZ 3.4Å; N63-F97 HydrophobicContact CB-CZ 4.26Å; F75-F97 HydrophobicContact CE1-CD1 4.21Å; F75-F97 HydrophobicContact CE1-CE1 4.47Å; F75-F97 AromaticContact CZ-CD1 3.98Å; F75-F97 HydrophobicContact CZ-CD1 3.98Å; F75-F97 HydrophobicContact CZ-CE1 4.19Å; T85-F97 HydrophobicContact CG2-CB 4.07Å; T85-F97 HydrophobicContact CG2-CD1 4.38Å; V87-F97 HydrophobicContact CB-CD1 3.82Å; V87-F97 HydrophobicContact CB-CE1 3.86Å; V87-F97 HydrophobicContact CG2-CD1 3.62Å; V87-F97 HydrophobicContact CG2-CE1 3.38Å; V87-F97 HydrophobicContact CG2-CE2 4.41Å; V87-F97 HydrophobicContact CG2-CG 4.24Å; V87-F97 HydrophobicContact CG2-CZ 3.82Å; P95-F97 HydrophobicContact CB-CE2 3.76Å; P95-F97 HydrophobicContact CB-CZ 3.92Å; P95-F97 HydrophobicContact CG-CE2 3.88Å; P95-F97 HydrophobicContact CG-CZ 4.23Å
98	I	96	Very high	91.3	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.062	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	112.8	-176.6	-55.9	160	0	0	0	107.6	T85 V86 V88 F110 I136 T138 V144	T85-I98 CarbonylContact C-O 3.59Å; T85-I98 WeakPolarHBondContact CA-O 3.5Å; V86-I98 PolarHBondContact N-O 3.23Å; V86-I98 PolarHBondContact O-N 3.47Å; V88-I98 HydrophobicContact CG1-CD1 4Å; I98-F110 HydrophobicContact CG2-CB 4.32Å; I98-F110 HydrophobicContact CG2-CD1 3.51Å; I98-F110 HydrophobicContact CG2-CE1 4.14Å; I98-F110 HydrophobicContact CG2-CG 4.21Å; I98-I136 HydrophobicContact CD1-CB 4.1Å; I98-I136 HydrophobicContact CD1-CD1 4.04Å; I98-I136 HydrophobicContact CD1-CG2 3.72Å; I98-I136 HydrophobicContact CG1-CG2 4.38Å; I98-I136 HydrophobicContact CG2-CG2 4.08Å; I98-T138 HydrophobicContact CD1-CG2 4.36Å; I98-T138 HydrophobicContact CG1-CG2 4.18Å; I98-V144 HydrophobicContact CD1-CG2 3.57Å
99	Q	94.7	Very high	91.2	Very high	49 Å²	49	51.6 Å²	51.6	23%	0.229	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	136.1	175.5	-68.8	173.7	-27.5	0	0	109.6	D80 I83 E101	D80-Q99 PolarHBondContact OD2-NE2 3.44Å; I83-Q99 HydrophobicContact CG2-CB 4.26Å; I83-Q99 HydrophobicContact CG2-CG 4.26Å; Q99-E101 PolarHBondContact O-N 2.95Å
100	I	95	Very high	91.2	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.277	C	S	.	.			trans	-87.9	106.9	169.4	-52.4	178.1	0	0	0	106.5	I74 P84 V86 F108 F110 I122 L125	I74-I100 HydrophobicContact CG2-CD1 4.32Å; P84-I100 HydrophobicContact CB-CB 4.21Å; P84-I100 HydrophobicContact CB-CD1 4.07Å; P84-I100 HydrophobicContact CB-CG1 4.39Å; P84-I100 WeakPolarHBondContact O-CB 3.46Å; P84-I100 PolarHBondContact O-N 3.11Å; V86-I100 HydrophobicContact CG2-CD1 3.91Å; V86-I100 HydrophobicContact CG2-CG1 4.09Å; I100-F108 HydrophobicContact CG2-CB 3.95Å; I100-F108 HydrophobicContact CG2-CD1 3.89Å; I100-F108 HydrophobicContact CG2-CG 4.32Å; I100-F110 HydrophobicContact CD1-CE1 4.36Å; I100-F110 HydrophobicContact CG1-CD1 4.33Å; I100-F110 HydrophobicContact CG1-CE1 3.71Å; I100-I122 HydrophobicContact CD1-CD1 4.42Å; I100-I122 HydrophobicContact CD1-CG1 4.4Å; I100-I122 HydrophobicContact CD1-CG2 3.72Å; I100-I122 HydrophobicContact CG2-CG1 4.33Å; I100-L125 HydrophobicContact CG2-CD2 3.89Å
101	E	92.6	Very high	91.1	Very high	93 Å²	93	52.9 Å²	52.9	44%	0.435	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	139.2	178.1	-64.6	-177.6	-178	0	0	109.4	Q99 F108 C109	Q99-E101 PolarHBondContact O-N 2.95Å; E101-F108 CarbonylContact O-C 3.59Å; E101-F108 VanDerWaalsContact O-CA 3.31Å; E101-F108 WeakPolarHBondContact O-CA 3.45Å; E101-C109 PolarHBondContact N-O 3.18Å; E101-C109 PolarHBondContact O-N 3.31Å
102	Q	91.3	Very high	91.1	Very high	67 Å²	67	53.3 Å²	53.3	31%	0.313	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.9	169.9	-170.5	170	28.1	0	0	109.1	G106 C107 F108 T532	Q102-G106 PolarHBondContact NE2-O 3.08Å; Q102-G106 VanDerWaalsContact NE2-O 3.08Å; Q102-C107 CarbonylContact C-O 3.56Å; Q102-C107 VanDerWaalsContact CA-O 3.31Å; Q102-C107 WeakPolarHBondContact CA-O 3.38Å; Q102-F108 HydrophobicContact CB-CD1 4.03Å; Q102-F108 HydrophobicContact CB-CE1 3.93Å; Q102-F108 HydrophobicContact CG-CD1 4.17Å; Q102-F108 HydrophobicContact CG-CE1 3.89Å; Q102-F108 HydrophobicContact CG-CZ 4.37Å; Q102-T532 PolarHBondContact NE2-O 3.12Å
103	T	89.2	Confident	90.9	Very high	26 Å²	26	53.9 Å²	53.9	16%	0.16	28%	0.276	C	S	.	.			trans	-75.2	166.7	178.2	59.4	0	0	0	0	111.5	D105 G106 C107 K115	T103-D105 WeakPolarHBondContact CB-OD1 3.5Å; T103-D105 PolarHBondContact O-N 3.02Å; T103-D105 PolarHBondContact OG1-OD1 2.98Å; T103-G106 PolarHBondContact O-N 2.88Å; T103-C107 PolarHBondContact N-O 3.2Å; T103-C107 WeakPolarHBondContact OG1-CB 3.37Å; T103-C107 PolarHBondContact OG1-N 3.22Å; T103-C107 VanDerWaalsContact OG1-N 3.09Å; T103-C107 PolarHBondContact OG1-O 2.81Å; T103-C107 VanDerWaalsContact OG1-O 3.08Å; T103-K115 HydrophobicContact CG2-CD 4.27Å; T103-K115 HydrophobicContact CG2-CG 3.97Å
104	T	85.3	Confident	91	Very high	160 Å²	160	49 Å²	49	98%	0.982	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.9	-179.3	49.5	0	0	0	0	114	G106	T104-G106 VanDerWaalsContact C-N 3.31Å
105	D	82.9	Confident	90.7	Very high	73 Å²	73	46.7 Å²	46.7	39%	0.39	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	0.2	172.8	59.9	-48.9	0	0	0	113.2	T103 C107 Y520	T103-D105 WeakPolarHBondContact CB-OD1 3.5Å; T103-D105 PolarHBondContact O-N 3.02Å; T103-D105 PolarHBondContact OG1-OD1 2.98Å; D105-C107 PolarHBondContact OD2-SG 3.37Å; D105-Y520 WeakPolarHBondContact O-CE2 3.41Å
106	G	85.6	Confident	90	Very high	5 Å²	5	55.9 Å²	55.9	5%	0.052	27%	0.269	C	S	.	.	S	Bend	trans	91.6	2.9	174.3	0	0	0	0	0	115.2	Q102 T103 T104	Q102-G106 PolarHBondContact NE2-O 3.08Å; Q102-G106 VanDerWaalsContact NE2-O 3.08Å; T103-G106 PolarHBondContact O-N 2.88Å; T104-G106 VanDerWaalsContact C-N 3.31Å
107	C	89.9	Confident	89.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.273	C	S	.	.			trans	-79.7	148.9	177.9	-61	0	0	0	0	112	Q102 T103 D105 F119	Q102-C107 CarbonylContact C-O 3.56Å; Q102-C107 VanDerWaalsContact CA-O 3.31Å; Q102-C107 WeakPolarHBondContact CA-O 3.38Å; T103-C107 PolarHBondContact N-O 3.2Å; T103-C107 WeakPolarHBondContact OG1-CB 3.37Å; T103-C107 PolarHBondContact OG1-N 3.22Å; T103-C107 VanDerWaalsContact OG1-N 3.09Å; T103-C107 PolarHBondContact OG1-O 2.81Å; T103-C107 VanDerWaalsContact OG1-O 3.08Å; D105-C107 PolarHBondContact OD2-SG 3.37Å; C107-F119 CarbonylContact C-O 3.59Å; C107-F119 WeakPolarHBondContact CA-O 3.47Å
108	F	93.1	Very high	88.7	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	138.2	177.8	-62.1	-76.3	0	0	0	111.1	I100 E101 Q102 F119 V120 I122 L125 F531 E533	I100-F108 HydrophobicContact CG2-CB 3.95Å; I100-F108 HydrophobicContact CG2-CD1 3.89Å; I100-F108 HydrophobicContact CG2-CG 4.32Å; E101-F108 CarbonylContact O-C 3.59Å; E101-F108 VanDerWaalsContact O-CA 3.31Å; E101-F108 WeakPolarHBondContact O-CA 3.45Å; Q102-F108 HydrophobicContact CB-CD1 4.03Å; Q102-F108 HydrophobicContact CB-CE1 3.93Å; Q102-F108 HydrophobicContact CG-CD1 4.17Å; Q102-F108 HydrophobicContact CG-CE1 3.89Å; Q102-F108 HydrophobicContact CG-CZ 4.37Å; F108-F119 WeakPolarHBondContact CD2-O 3.24Å; F108-F119 PolarHBondContact N-O 2.82Å; F108-V120 WeakPolarHBondContact CE2-O 3.29Å; F108-I122 HydrophobicContact CD1-CD1 4.32Å; F108-I122 HydrophobicContact CD1-CG1 3.82Å; F108-I122 HydrophobicContact CD2-CG1 4.08Å; F108-I122 HydrophobicContact CE1-CD1 4.06Å; F108-I122 HydrophobicContact CE1-CG1 3.92Å; F108-I122 HydrophobicContact CE2-CG1 4.18Å; F108-I122 HydrophobicContact CG-CG1 3.89Å; F108-I122 HydrophobicContact CZ-CD1 4.36Å; F108-I122 HydrophobicContact CZ-CG1 4.1Å; F108-L125 HydrophobicContact CB-CD2 4.01Å; F108-F531 HydrophobicContact CE1-CB 4.1Å; F108-F531 HydrophobicContact CE1-CD1 4.33Å; F108-F531 HydrophobicContact CE1-CG 4.49Å; F108-F531 HydrophobicContact CZ-CB 4.2Å; F108-E533 HydrophobicContact CE2-CG 4.04Å; F108-E533 HydrophobicContact CZ-CG 4.11Å
109	C	93.6	Very high	88.5	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146.7	180	54.4	0	0	0	0	112.8	E101 D114 K115	E101-C109 PolarHBondContact N-O 3.18Å; E101-C109 PolarHBondContact O-N 3.31Å; C109-D114 HydrophobicContact CB-CB 3.66Å; C109-K115 HydrophobicContact CB-CG 4.49Å
110	F	93.7	Very high	88.3	Confident	18 Å²	18	51.3 Å²	51.3	8%	0.079	25%	0.253	C	S	.	.	S	Bend	trans	-90.1	-31.2	160.2	-67.2	-50.4	0	0	0	111.4	V86 I98 I100 D114 L125 V126 Y129 I136 L146	V86-F110 HydrophobicContact CB-CE1 4.2Å; V86-F110 HydrophobicContact CG2-CE1 3.55Å; V86-F110 HydrophobicContact CG2-CZ 3.69Å; I98-F110 HydrophobicContact CG2-CB 4.32Å; I98-F110 HydrophobicContact CG2-CD1 3.51Å; I98-F110 HydrophobicContact CG2-CE1 4.14Å; I98-F110 HydrophobicContact CG2-CG 4.21Å; I100-F110 HydrophobicContact CD1-CE1 4.36Å; I100-F110 HydrophobicContact CG1-CD1 4.33Å; I100-F110 HydrophobicContact CG1-CE1 3.71Å; F110-D114 PolarHBondContact N-OD2 3.42Å; F110-L125 HydrophobicContact CD1-CD2 4.31Å; F110-L125 HydrophobicContact CD2-CD1 3.99Å; F110-L125 HydrophobicContact CD2-CD2 4.1Å; F110-L125 HydrophobicContact CD2-CG 4Å; F110-L125 HydrophobicContact CE1-CD2 4.24Å; F110-L125 HydrophobicContact CE2-CD1 4.23Å; F110-L125 HydrophobicContact CE2-CD2 3.99Å; F110-L125 HydrophobicContact CE2-CG 3.77Å; F110-L125 HydrophobicContact CG-CD2 4.25Å; F110-L125 HydrophobicContact CZ-CD2 4.05Å; F110-L125 HydrophobicContact CZ-CG 4.24Å; F110-V126 HydrophobicContact CZ-CG2 4.2Å; F110-Y129 HydrophobicContact CD2-CD1 4.26Å; F110-Y129 AromaticContact CD2-CD2 3.52Å; F110-Y129 HydrophobicContact CD2-CD2 3.52Å; F110-Y129 HydrophobicContact CD2-CE1 4.28Å; F110-Y129 AromaticContact CD2-CE2 3.56Å; F110-Y129 HydrophobicContact CD2-CE2 3.56Å; F110-Y129 AromaticContact CD2-CG 3.9Å; F110-Y129 HydrophobicContact CD2-CG 3.9Å; F110-Y129 AromaticContact CD2-CZ 3.94Å; F110-Y129 AromaticContact CE2-CD2 3.7Å; F110-Y129 HydrophobicContact CE2-CD2 3.7Å; F110-Y129 HydrophobicContact CE2-CE2 4.22Å; F110-Y129 AromaticContact CE2-CG 3.94Å; F110-Y129 HydrophobicContact CE2-CG 3.94Å; F110-I136 HydrophobicContact CB-CG2 3.96Å; F110-I136 HydrophobicContact CD2-CD1 3.64Å; F110-I136 HydrophobicContact CD2-CG1 4.1Å; F110-I136 HydrophobicContact CE2-CD1 3.75Å; F110-I136 HydrophobicContact CG-CD1 4.16Å; F110-I136 HydrophobicContact CG-CG2 4.37Å; F110-I136 HydrophobicContact CZ-CD1 4.32Å; F110-L146 HydrophobicContact CE2-CD1 4.24Å; F110-L146 HydrophobicContact CZ-CD1 4.37Å
111	Q	91	Very high	88.1	Confident	40 Å²	40	51.2 Å²	51.2	19%	0.187	25%	0.253	C	S	.	.	S	Bend	trans	-147.1	163	-175	52.2	-176.3	67.4	0	0	111.4	E113 D114 Y129	Q111-E113 WeakPolarHBondContact CB-OE2 3.39Å; Q111-E113 WeakPolarHBondContact CG-OE2 3.16Å; Q111-E113 PolarHBondContact NE2-OE2 2.87Å; Q111-E113 PolarHBondContact O-N 3.46Å; Q111-E113 VanDerWaalsContact O-N 3.13Å; Q111-D114 WeakPolarHBondContact CG-OD2 3.48Å; Q111-D114 PolarHBondContact N-OD2 3.23Å; Q111-D114 VanDerWaalsContact N-OD2 3.11Å; Q111-D114 WeakPolarHBondContact O-CB 3.45Å; Q111-D114 PolarHBondContact O-N 2.78Å; Q111-Y129 VanDerWaalsContact CD-OH 3.22Å; Q111-Y129 WeakPolarHBondContact CG-OH 3.19Å
112	D	86.5	Confident	88.1	Confident	106 Å²	106	46.8 Å²	46.8	57%	0.567	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-57.5	-30.8	-173.1	-79.6	-34.2	0	0	0	113.8	D114 K115	D112-D114 PolarHBondContact O-N 2.65Å; D112-K115 WeakPolarHBondContact O-CB 3.15Å; D112-K115 WeakPolarHBondContact O-CG 3.47Å; D112-K115 PolarHBondContact O-N 3.37Å; D112-K115 WeakPolarHBondContact OD1-CE 3.29Å; D112-K115 IonicContact OD1-NZ 2.68Å; D112-K115 PolarHBondContact OD1-NZ 3.28Å
113	E	85.6	Confident	88.2	Confident	100 Å²	100	44.9 Å²	44.9	47%	0.467	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-65.5	-28	179.4	-60.8	80.9	-173.3	0	0	112.5	R33 Q111 K115 W116	R33-E113 VanDerWaalsContact NH1-CB 3.26Å; R33-E113 PolarHBondContact NH1-O 3.12Å; Q111-E113 WeakPolarHBondContact CB-OE2 3.39Å; Q111-E113 WeakPolarHBondContact CG-OE2 3.16Å; Q111-E113 PolarHBondContact NE2-OE2 2.87Å; Q111-E113 PolarHBondContact O-N 3.46Å; Q111-E113 VanDerWaalsContact O-N 3.13Å; E113-K115 PolarHBondContact O-N 3.35Å; E113-W116 PolarHBondContact O-N 2.99Å
114	D	88.4	Confident	88.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-70.7	-19.4	-177.3	-55.2	-24.4	0	0	0	112.5	R33 C109 F110 Q111 D112 W116 D117 A118 F119 L125 Y129	R33-D114 IonicContact CZ-OD1 2.99Å; R33-D114 IonicContact NH1-OD1 2.73Å; R33-D114 PolarHBondContact NH1-OD1 3.06Å; R33-D114 IonicContact NH2-OD1 3.74Å; R33-D114 PolarHBondContact NH2-OD1 3Å; C109-D114 HydrophobicContact CB-CB 3.66Å; F110-D114 PolarHBondContact N-OD2 3.42Å; Q111-D114 WeakPolarHBondContact CG-OD2 3.48Å; Q111-D114 PolarHBondContact N-OD2 3.23Å; Q111-D114 VanDerWaalsContact N-OD2 3.11Å; Q111-D114 WeakPolarHBondContact O-CB 3.45Å; Q111-D114 PolarHBondContact O-N 2.78Å; D112-D114 PolarHBondContact O-N 2.65Å; D114-W116 PolarHBondContact O-N 2.98Å; D114-W116 VanDerWaalsContact O-N 3.17Å; D114-D117 PolarHBondContact O-N 2.61Å; D114-A118 PolarHBondContact O-N 2.81Å; D114-F119 HydrophobicContact CB-CD2 4.17Å; D114-F119 HydrophobicContact CB-CE2 4.21Å; D114-L125 HydrophobicContact CB-CD1 4.46Å; D114-Y129 PolarHBondContact OD1-OH 2.86Å; D114-Y129 PolarHBondContact OD2-OH 3.41Å
115	K	84.3	Confident	88.6	Confident	84 Å²	84	36.9 Å²	36.9	37%	0.365	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-59.2	-27.3	175.8	-61.4	178.9	174.5	164	0	111.9	T103 C109 D112 E113	T103-K115 HydrophobicContact CG2-CD 4.27Å; T103-K115 HydrophobicContact CG2-CG 3.97Å; C109-K115 HydrophobicContact CB-CG 4.49Å; D112-K115 WeakPolarHBondContact O-CB 3.15Å; D112-K115 WeakPolarHBondContact O-CG 3.47Å; D112-K115 PolarHBondContact O-N 3.37Å; D112-K115 WeakPolarHBondContact OD1-CE 3.29Å; D112-K115 IonicContact OD1-NZ 2.68Å; D112-K115 PolarHBondContact OD1-NZ 3.28Å; E113-K115 PolarHBondContact O-N 3.35Å
116	W	80.5	Confident	89.2	Confident	231 Å²	231	33.5 Å²	33.5	88%	0.875	16%	0.157	S	C	*	.	G	3₁₀ helix	trans	-84.6	-21.5	178.2	-57.1	98.4	0	0	0	113.3	E113 D114 A118	E113-W116 PolarHBondContact O-N 2.99Å; D114-W116 PolarHBondContact O-N 2.98Å; D114-W116 VanDerWaalsContact O-N 3.17Å; W116-A118 VanDerWaalsContact C-N 3.34Å
117	D	81.2	Confident	89.4	Confident	35 Å²	35	35 Å²	35	19%	0.187	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-13.7	179.1	-64.7	-52.1	0	0	0	112.3	R33 D114 F119	R33-D117 IonicContact CZ-OD2 2.81Å; R33-D117 IonicContact NE-OD2 3.28Å; R33-D117 IonicContact NH1-OD2 3.02Å; R33-D117 PolarHBondContact NH1-OD2 2.86Å; D114-D117 PolarHBondContact O-N 2.61Å; D117-F119 HydrophobicContact CB-CD2 3.96Å; D117-F119 HydrophobicContact CB-CE1 4.43Å; D117-F119 HydrophobicContact CB-CE2 3.43Å; D117-F119 VanDerWaalsContact CB-CE2 3.43Å; D117-F119 HydrophobicContact CB-CZ 3.7Å; D117-F119 PolarHBondContact O-N 3.45Å
118	A	82.9	Confident	89.3	Confident	21 Å²	21	35.1 Å²	35.1	17%	0.174	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	55.7	175.8	0	0	0	0	0	112.9	D114 W116 V120 K536	D114-A118 PolarHBondContact O-N 2.81Å; W116-A118 VanDerWaalsContact C-N 3.34Å; A118-V120 PolarHBondContact O-N 3.4Å; A118-V120 VanDerWaalsContact O-N 3.12Å; A118-K536 WeakPolarHBondContact O-CE 3.49Å; A118-K536 PolarHBondContact O-NZ 3.42Å
119	F	90.8	Very high	89.3	Confident	13 Å²	13	35 Å²	35	6%	0.057	17%	0.165	C	C	.	.			trans	-72.1	103.1	174.6	-62.5	-69.1	0	0	0	110.3	L39 C107 F108 D114 D117 L125 F128	L39-F119 HydrophobicContact CD1-CE1 4.33Å; C107-F119 CarbonylContact C-O 3.59Å; C107-F119 WeakPolarHBondContact CA-O 3.47Å; F108-F119 WeakPolarHBondContact CD2-O 3.24Å; F108-F119 PolarHBondContact N-O 2.82Å; D114-F119 HydrophobicContact CB-CD2 4.17Å; D114-F119 HydrophobicContact CB-CE2 4.21Å; D117-F119 HydrophobicContact CB-CD2 3.96Å; D117-F119 HydrophobicContact CB-CE1 4.43Å; D117-F119 HydrophobicContact CB-CE2 3.43Å; D117-F119 VanDerWaalsContact CB-CE2 3.43Å; D117-F119 HydrophobicContact CB-CZ 3.7Å; D117-F119 PolarHBondContact O-N 3.45Å; F119-L125 HydrophobicContact CB-CB 3.93Å; F119-L125 HydrophobicContact CD1-CB 4.48Å; F119-L125 HydrophobicContact CD2-CB 4.29Å; F119-L125 HydrophobicContact CD2-CD1 3.51Å; F119-L125 HydrophobicContact CE2-CD1 3.87Å; F119-L125 HydrophobicContact CG-CB 4Å; F119-L125 HydrophobicContact CG-CD1 4.09Å; F119-F128 HydrophobicContact CE1-CB 3.77Å; F119-F128 HydrophobicContact CE1-CD2 4.37Å; F119-F128 HydrophobicContact CE1-CG 4.03Å; F119-F128 HydrophobicContact CE2-CD1 4.31Å; F119-F128 HydrophobicContact CE2-CG 4.49Å; F119-F128 HydrophobicContact CZ-CB 3.71Å; F119-F128 AromaticContact CZ-CD1 3.75Å; F119-F128 HydrophobicContact CZ-CD1 3.75Å; F119-F128 AromaticContact CZ-CD2 3.94Å; F119-F128 HydrophobicContact CZ-CD2 3.94Å; F119-F128 HydrophobicContact CZ-CE1 4.35Å; F119-F128 AromaticContact CZ-CG 3.52Å; F119-F128 HydrophobicContact CZ-CG 3.52Å
120	V	90	Very high	89.2	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.177	C	C	.	.			trans	-87.9	-4.7	-177	-66.9	0	0	0	0	114.6	F108 A118 Y520 F534 K536	F108-V120 WeakPolarHBondContact CE2-O 3.29Å; A118-V120 PolarHBondContact O-N 3.4Å; A118-V120 VanDerWaalsContact O-N 3.12Å; V120-Y520 HydrophobicContact CG1-CD1 3.93Å; V120-Y520 HydrophobicContact CG1-CE1 3.7Å; V120-Y520 HydrophobicContact CG1-CG 4.47Å; V120-F534 HydrophobicContact CB-CB 4.12Å; V120-F534 WeakPolarHBondContact CB-O 3.45Å; V120-F534 WeakPolarHBondContact CG2-O 3.36Å; V120-F534 PolarHBondContact O-N 3.09Å; V120-K536 HydrophobicContact CG1-CG 4.17Å; V120-K536 HydrophobicContact CG2-CD 4.45Å; V120-K536 HydrophobicContact CG2-CG 3.72Å
121	T	91.9	Very high	88.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-131.6	150.7	171.5	69	0	0	0	0	109.9	P44 H123 S124 L125 L523 E533 F534 I544	P44-T121 HydrophobicContact CB-CG2 4.22Å; P44-T121 WeakPolarHBondContact CB-OG1 3.24Å; P44-T121 HydrophobicContact CG-CG2 3.64Å; T121-H123 VanDerWaalsContact C-N 3.27Å; T121-H123 PolarHBondContact O-N 2.94Å; T121-S124 PolarHBondContact O-N 2.73Å; T121-S124 WeakPolarHBondContact OG1-CB 3.36Å; T121-S124 PolarHBondContact OG1-N 2.8Å; T121-S124 VanDerWaalsContact OG1-N 3.16Å; T121-S124 PolarHBondContact OG1-OG 2.84Å; T121-L125 PolarHBondContact O-N 2.82Å; T121-L523 HydrophobicContact CG2-CD1 4.29Å; T121-E533 WeakPolarHBondContact CA-OE1 3.31Å; T121-E533 WeakPolarHBondContact CB-OE1 3.43Å; T121-E533 HydrophobicContact CG2-CB 4.37Å; T121-F534 WeakPolarHBondContact CG2-O 3.45Å; T121-I544 HydrophobicContact CG2-CD1 4.34Å
122	I	93.3	Very high	88.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.8	-35.3	178.6	-71.7	168.8	0	0	0	110.3	L47 I74 P84 I100 F108 L125 V126 E533	L47-I122 HydrophobicContact CB-CD1 4.36Å; L47-I122 HydrophobicContact CD1-CD1 4.31Å; L47-I122 HydrophobicContact CD1-CG2 4.14Å; L47-I122 HydrophobicContact CD2-CD1 3.78Å; L47-I122 HydrophobicContact CG-CD1 4.36Å; I74-I122 HydrophobicContact CD1-CG2 3.89Å; P84-I122 HydrophobicContact CB-CD1 4.25Å; P84-I122 HydrophobicContact CG-CD1 4.32Å; I100-I122 HydrophobicContact CD1-CD1 4.42Å; I100-I122 HydrophobicContact CD1-CG1 4.4Å; I100-I122 HydrophobicContact CD1-CG2 3.72Å; I100-I122 HydrophobicContact CG2-CG1 4.33Å; F108-I122 HydrophobicContact CD1-CD1 4.32Å; F108-I122 HydrophobicContact CD1-CG1 3.82Å; F108-I122 HydrophobicContact CD2-CG1 4.08Å; F108-I122 HydrophobicContact CE1-CD1 4.06Å; F108-I122 HydrophobicContact CE1-CG1 3.92Å; F108-I122 HydrophobicContact CE2-CG1 4.18Å; F108-I122 HydrophobicContact CG-CG1 3.89Å; F108-I122 HydrophobicContact CZ-CD1 4.36Å; F108-I122 HydrophobicContact CZ-CG1 4.1Å; I122-L125 PolarHBondContact O-N 3.17Å; I122-V126 HydrophobicContact CG2-CG2 4.02Å; I122-V126 WeakPolarHBondContact O-CB 3.48Å; I122-V126 VanDerWaalsContact O-CG2 3.25Å; I122-V126 WeakPolarHBondContact O-CG2 3.25Å; I122-V126 PolarHBondContact O-N 2.88Å; I122-E533 PolarHBondContact N-OE1 3.26Å
123	H	92.6	Very high	88.5	Confident	26 Å²	26	35.9 Å²	35.9	12%	0.12	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-46.3	176.5	176.2	-111.7	0	0	0	112.1	P44 Q45 L50 T121 L125 V126 V127	P44-H123 WeakPolarHBondContact CA-ND1 3.35Å; P44-H123 HydrophobicContact CB-CB 4.22Å; P44-H123 WeakPolarHBondContact CB-ND1 3.35Å; Q45-H123 PolarHBondContact N-ND1 3.28Å; Q45-H123 WeakPolarHBondContact O-CB 3.28Å; L50-H123 HydrophobicContact CD1-CB 4.34Å; L50-H123 HydrophobicContact CD2-CB 4.1Å; L50-H123 VanDerWaalsContact CD2-CD2 3.48Å; L50-H123 WeakPolarHBondContact CD2-CD2 3.39Å; T121-H123 VanDerWaalsContact C-N 3.27Å; T121-H123 PolarHBondContact O-N 2.94Å; H123-L125 VanDerWaalsContact C-N 3.31Å; H123-L125 PolarHBondContact O-N 3.14Å; H123-V126 PolarHBondContact O-N 2.75Å; H123-V127 WeakPolarHBondContact NE2-CG2 3.43Å; H123-V127 WeakPolarHBondContact O-CB 3.45Å; H123-V127 VanDerWaalsContact O-CG2 3.26Å; H123-V127 WeakPolarHBondContact O-CG2 3.29Å; H123-V127 PolarHBondContact O-N 2.71Å
124	S	90.7	Very high	88.7	Confident	19 Å²	19	31.4 Å²	31.4	13%	0.133	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-40.1	178.5	-63.7	0	0	0	0	112.1	T121 F128	T121-S124 PolarHBondContact O-N 2.73Å; T121-S124 WeakPolarHBondContact OG1-CB 3.36Å; T121-S124 PolarHBondContact OG1-N 2.8Å; T121-S124 VanDerWaalsContact OG1-N 3.16Å; T121-S124 PolarHBondContact OG1-OG 2.84Å; S124-F128 WeakPolarHBondContact O-CB 3.23Å; S124-F128 PolarHBondContact O-N 3.43Å; S124-F128 VanDerWaalsContact O-N 3.1Å
125	L	93.2	Very high	88.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.1	-52.7	173.6	175.8	67.5	0	0	0	111.2	I100 F108 F110 D114 F119 T121 I122 H123 V127 F128 Y129	I100-L125 HydrophobicContact CG2-CD2 3.89Å; F108-L125 HydrophobicContact CB-CD2 4.01Å; F110-L125 HydrophobicContact CD1-CD2 4.31Å; F110-L125 HydrophobicContact CD2-CD1 3.99Å; F110-L125 HydrophobicContact CD2-CD2 4.1Å; F110-L125 HydrophobicContact CD2-CG 4Å; F110-L125 HydrophobicContact CE1-CD2 4.24Å; F110-L125 HydrophobicContact CE2-CD1 4.23Å; F110-L125 HydrophobicContact CE2-CD2 3.99Å; F110-L125 HydrophobicContact CE2-CG 3.77Å; F110-L125 HydrophobicContact CG-CD2 4.25Å; F110-L125 HydrophobicContact CZ-CD2 4.05Å; F110-L125 HydrophobicContact CZ-CG 4.24Å; D114-L125 HydrophobicContact CB-CD1 4.46Å; F119-L125 HydrophobicContact CB-CB 3.93Å; F119-L125 HydrophobicContact CD1-CB 4.48Å; F119-L125 HydrophobicContact CD2-CB 4.29Å; F119-L125 HydrophobicContact CD2-CD1 3.51Å; F119-L125 HydrophobicContact CE2-CD1 3.87Å; F119-L125 HydrophobicContact CG-CB 4Å; F119-L125 HydrophobicContact CG-CD1 4.09Å; T121-L125 PolarHBondContact O-N 2.82Å; I122-L125 PolarHBondContact O-N 3.17Å; H123-L125 VanDerWaalsContact C-N 3.31Å; H123-L125 PolarHBondContact O-N 3.14Å; L125-V127 PolarHBondContact O-N 2.93Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.11Å; L125-Y129 HydrophobicContact CD1-CD2 3.89Å; L125-Y129 HydrophobicContact CD1-CE2 3.65Å; L125-Y129 HydrophobicContact CG-CD2 4.46Å; L125-Y129 WeakPolarHBondContact O-CD2 3.5Å; L125-Y129 PolarHBondContact O-N 3.37Å
126	V	94	Very high	89.3	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-43.7	-174.5	169.6	0	0	0	0	111.6	Y52 F72 I74 F110 I122 H123 F128 Y129 A130 L146	Y52-V126 HydrophobicContact CE2-CG1 4.08Å; F72-V126 HydrophobicContact CE2-CG1 3.72Å; F72-V126 HydrophobicContact CZ-CG1 4.02Å; I74-V126 HydrophobicContact CD1-CG2 3.68Å; F110-V126 HydrophobicContact CZ-CG2 4.2Å; I122-V126 HydrophobicContact CG2-CG2 4.02Å; I122-V126 WeakPolarHBondContact O-CB 3.48Å; I122-V126 VanDerWaalsContact O-CG2 3.25Å; I122-V126 WeakPolarHBondContact O-CG2 3.25Å; I122-V126 PolarHBondContact O-N 2.88Å; H123-V126 PolarHBondContact O-N 2.75Å; V126-F128 VanDerWaalsContact C-N 3.3Å; V126-F128 PolarHBondContact O-N 2.89Å; V126-Y129 PolarHBondContact O-N 3.12Å; V126-A130 WeakPolarHBondContact O-CB 3.09Å; V126-A130 PolarHBondContact O-N 2.99Å; V126-L146 HydrophobicContact CG1-CD1 4.1Å
127	V	89.7	Confident	89.8	Confident	37 Å²	37	23.8 Å²	23.8	22%	0.224	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-35.9	178	178.5	0	0	0	0	110.7	L39 H123 L125 K131	L39-V127 HydrophobicContact CD2-CB 3.99Å; L39-V127 HydrophobicContact CD2-CG1 3.4Å; L39-V127 VanDerWaalsContact CD2-CG1 3.4Å; H123-V127 WeakPolarHBondContact NE2-CG2 3.43Å; H123-V127 WeakPolarHBondContact O-CB 3.45Å; H123-V127 VanDerWaalsContact O-CG2 3.26Å; H123-V127 WeakPolarHBondContact O-CG2 3.29Å; H123-V127 PolarHBondContact O-N 2.71Å; L125-V127 PolarHBondContact O-N 2.93Å; V127-K131 HydrophobicContact CG1-CB 4.41Å; V127-K131 WeakPolarHBondContact O-CB 3.48Å; V127-K131 PolarHBondContact O-N 3.15Å
128	F	89.3	Confident	90.2	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-56	-53.5	172.3	176	-100.1	0	0	0	111.4	A32 R33 L39 F119 S124 L125 V126 Y132 V134	A32-F128 HydrophobicContact CB-CE2 3.92Å; A32-F128 HydrophobicContact CB-CZ 4.47Å; R33-F128 HydrophobicContact CG-CE2 4.47Å; R33-F128 HydrophobicContact CG-CZ 3.81Å; L39-F128 HydrophobicContact CD1-CB 3.48Å; L39-F128 VanDerWaalsContact CD1-CB 3.48Å; L39-F128 HydrophobicContact CD1-CD2 3.73Å; L39-F128 HydrophobicContact CD1-CG 4.08Å; F119-F128 HydrophobicContact CE1-CB 3.77Å; F119-F128 HydrophobicContact CE1-CD2 4.37Å; F119-F128 HydrophobicContact CE1-CG 4.03Å; F119-F128 HydrophobicContact CE2-CD1 4.31Å; F119-F128 HydrophobicContact CE2-CG 4.49Å; F119-F128 HydrophobicContact CZ-CB 3.71Å; F119-F128 AromaticContact CZ-CD1 3.75Å; F119-F128 HydrophobicContact CZ-CD1 3.75Å; F119-F128 AromaticContact CZ-CD2 3.94Å; F119-F128 HydrophobicContact CZ-CD2 3.94Å; F119-F128 HydrophobicContact CZ-CE1 4.35Å; F119-F128 AromaticContact CZ-CG 3.52Å; F119-F128 HydrophobicContact CZ-CG 3.52Å; S124-F128 WeakPolarHBondContact O-CB 3.23Å; S124-F128 PolarHBondContact O-N 3.43Å; S124-F128 VanDerWaalsContact O-N 3.1Å; L125-F128 WeakPolarHBondContact O-CB 3.44Å; L125-F128 PolarHBondContact O-N 3.11Å; V126-F128 VanDerWaalsContact C-N 3.3Å; V126-F128 PolarHBondContact O-N 2.89Å; F128-Y132 AromaticContact CD2-CD2 3.53Å; F128-Y132 HydrophobicContact CD2-CD2 3.53Å; F128-Y132 AromaticContact CD2-CE2 3.71Å; F128-Y132 HydrophobicContact CD2-CE2 3.71Å; F128-Y132 AromaticContact CE2-CD2 3.77Å; F128-Y132 HydrophobicContact CE2-CD2 3.77Å; F128-Y132 HydrophobicContact CE2-CE2 4.07Å; F128-Y132 HydrophobicContact CG-CD2 4.19Å; F128-Y132 VanDerWaalsContact O-CD2 3.24Å; F128-Y132 WeakPolarHBondContact O-CD2 3.49Å; F128-Y132 PolarHBondContact O-N 3.45Å; F128-Y132 VanDerWaalsContact O-N 3.12Å; F128-V134 HydrophobicContact CD1-CG2 4.37Å; F128-V134 HydrophobicContact CE1-CB 4.44Å; F128-V134 HydrophobicContact CE1-CG2 3.76Å; F128-V134 HydrophobicContact CZ-CG2 4.07Å
129	Y	92.6	Very high	90.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.4	-44	-177.6	-85.5	-89.8	0	0	0	112.6	R33 F110 Q111 D114 L125 V126 G133 V134 I136	R33-Y129 PolarHBondContact NH2-OH 3.21Å; F110-Y129 HydrophobicContact CD2-CD1 4.26Å; F110-Y129 AromaticContact CD2-CD2 3.52Å; F110-Y129 HydrophobicContact CD2-CD2 3.52Å; F110-Y129 HydrophobicContact CD2-CE1 4.28Å; F110-Y129 AromaticContact CD2-CE2 3.56Å; F110-Y129 HydrophobicContact CD2-CE2 3.56Å; F110-Y129 AromaticContact CD2-CG 3.9Å; F110-Y129 HydrophobicContact CD2-CG 3.9Å; F110-Y129 AromaticContact CD2-CZ 3.94Å; F110-Y129 AromaticContact CE2-CD2 3.7Å; F110-Y129 HydrophobicContact CE2-CD2 3.7Å; F110-Y129 HydrophobicContact CE2-CE2 4.22Å; F110-Y129 AromaticContact CE2-CG 3.94Å; F110-Y129 HydrophobicContact CE2-CG 3.94Å; Q111-Y129 VanDerWaalsContact CD-OH 3.22Å; Q111-Y129 WeakPolarHBondContact CG-OH 3.19Å; D114-Y129 PolarHBondContact OD1-OH 2.86Å; D114-Y129 PolarHBondContact OD2-OH 3.41Å; L125-Y129 HydrophobicContact CD1-CD2 3.89Å; L125-Y129 HydrophobicContact CD1-CE2 3.65Å; L125-Y129 HydrophobicContact CG-CD2 4.46Å; L125-Y129 WeakPolarHBondContact O-CD2 3.5Å; L125-Y129 PolarHBondContact O-N 3.37Å; V126-Y129 PolarHBondContact O-N 3.12Å; Y129-G133 WeakPolarHBondContact O-CA 3.49Å; Y129-G133 PolarHBondContact O-N 3.3Å; Y129-V134 HydrophobicContact CD1-CB 3.67Å; Y129-V134 HydrophobicContact CD1-CG1 4.07Å; Y129-V134 WeakPolarHBondContact CD1-O 3.27Å; Y129-V134 HydrophobicContact CE1-CB 3.82Å; Y129-V134 HydrophobicContact CE1-CG1 3.67Å; Y129-V134 HydrophobicContact CG-CB 4.44Å; Y129-V134 PolarHBondContact O-N 3.03Å; Y129-I136 HydrophobicContact CD1-CD1 3.8Å; Y129-I136 HydrophobicContact CD1-CG1 3.28Å; Y129-I136 HydrophobicContact CE1-CB 4.5Å; Y129-I136 HydrophobicContact CE1-CD1 4.29Å; Y129-I136 HydrophobicContact CE1-CG1 3.4Å; Y129-I136 VanDerWaalsContact CE1-CG1 3.4Å; Y129-I136 HydrophobicContact CG-CD1 4.21Å; Y129-I136 HydrophobicContact CG-CG1 4.16Å
130	A	90.9	Very high	89.9	Confident	32 Å²	32	33.4 Å²	33.4	26%	0.264	18%	0.179	S	C	.	.	H	α-helix	trans	-68.8	-44	179.4	0	0	0	0	0	112.5	V126 L146	V126-A130 WeakPolarHBondContact O-CB 3.09Å; V126-A130 PolarHBondContact O-N 2.99Å; A130-L146 HydrophobicContact CB-CB 4Å
131	K	85.2	Confident	89.6	Confident	115 Å²	115	36.4 Å²	36.4	50%	0.5	21%	0.211	S	C	.	.	H	α-helix	trans	-69.7	-39.9	-176.5	-176.1	176.1	179.1	175.9	0	112.7	L38 L39 V127	L38-K131 PolarHBondContact O-NZ 3.1Å; L39-K131 HydrophobicContact CD2-CD 4.3Å; V127-K131 HydrophobicContact CG1-CB 4.41Å; V127-K131 WeakPolarHBondContact O-CB 3.48Å; V127-K131 PolarHBondContact O-N 3.15Å
132	Y	85.2	Confident	89.4	Confident	25 Å²	25	37.8 Å²	37.8	10%	0.098	22%	0.222	C	C	.	.	H	α-helix	trans	-97.4	-1.8	-177.4	-61.2	-65.5	0	0	0	113.6	F25 V28 A32 L38 L39 F128 V134	F25-Y132 WeakPolarHBondContact CD1-O 3.16Å; V28-Y132 HydrophobicContact CG1-CD1 4.03Å; A32-Y132 HydrophobicContact CB-CD1 4.06Å; A32-Y132 HydrophobicContact CB-CD2 4Å; A32-Y132 HydrophobicContact CB-CE1 4.12Å; A32-Y132 HydrophobicContact CB-CE2 4.06Å; A32-Y132 HydrophobicContact CB-CG 4.01Å; L38-Y132 WeakPolarHBondContact CB-OH 3.44Å; L39-Y132 HydrophobicContact CD1-CE2 4.29Å; L39-Y132 HydrophobicContact CG-CE2 4.37Å; F128-Y132 AromaticContact CD2-CD2 3.53Å; F128-Y132 HydrophobicContact CD2-CD2 3.53Å; F128-Y132 AromaticContact CD2-CE2 3.71Å; F128-Y132 HydrophobicContact CD2-CE2 3.71Å; F128-Y132 AromaticContact CE2-CD2 3.77Å; F128-Y132 HydrophobicContact CE2-CD2 3.77Å; F128-Y132 HydrophobicContact CE2-CE2 4.07Å; F128-Y132 HydrophobicContact CG-CD2 4.19Å; F128-Y132 VanDerWaalsContact O-CD2 3.24Å; F128-Y132 WeakPolarHBondContact O-CD2 3.49Å; F128-Y132 PolarHBondContact O-N 3.45Å; F128-Y132 VanDerWaalsContact O-N 3.12Å; Y132-V134 PolarHBondContact O-N 3.13Å
133	G	87.2	Confident	89.3	Confident	11 Å²	11	41.7 Å²	41.7	11%	0.113	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	33.6	179.3	0	0	0	0	0	113	Y129	Y129-G133 WeakPolarHBondContact O-CA 3.49Å; Y129-G133 PolarHBondContact O-N 3.3Å
134	V	88.6	Confident	89.4	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.042	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-69.5	128.3	-178.2	-173.2	0	0	0	0	108.7	A29 F128 Y129 Y132	A29-V134 HydrophobicContact CB-CB 4.37Å; A29-V134 HydrophobicContact CB-CG1 4.04Å; A29-V134 HydrophobicContact CB-CG2 3.66Å; F128-V134 HydrophobicContact CD1-CG2 4.37Å; F128-V134 HydrophobicContact CE1-CB 4.44Å; F128-V134 HydrophobicContact CE1-CG2 3.76Å; F128-V134 HydrophobicContact CZ-CG2 4.07Å; Y129-V134 HydrophobicContact CD1-CB 3.67Å; Y129-V134 HydrophobicContact CD1-CG1 4.07Å; Y129-V134 WeakPolarHBondContact CD1-O 3.27Å; Y129-V134 HydrophobicContact CE1-CB 3.82Å; Y129-V134 HydrophobicContact CE1-CG1 3.67Å; Y129-V134 HydrophobicContact CG-CB 4.44Å; Y129-V134 PolarHBondContact O-N 3.03Å; Y132-V134 PolarHBondContact O-N 3.13Å
135	P	90.9	Very high	89.5	Confident	17 Å²	17	41.9 Å²	41.9	11%	0.11	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-70.7	133.9	176.7	27.9	-33.1	0	0	0	110.8	E143 V144	P135-E143 HydrophobicContact CB-CB 4.31Å; P135-V144 CarbonylContact C-O 3.51Å; P135-V144 WeakPolarHBondContact CA-O 3.17Å
136	I	94	Very high	89.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.1	172.6	-55.5	165.1	0	0	0	108.2	I98 F110 Y129 E143 V144 L146	I98-I136 HydrophobicContact CD1-CB 4.1Å; I98-I136 HydrophobicContact CD1-CD1 4.04Å; I98-I136 HydrophobicContact CD1-CG2 3.72Å; I98-I136 HydrophobicContact CG1-CG2 4.38Å; I98-I136 HydrophobicContact CG2-CG2 4.08Å; F110-I136 HydrophobicContact CB-CG2 3.96Å; F110-I136 HydrophobicContact CD2-CD1 3.64Å; F110-I136 HydrophobicContact CD2-CG1 4.1Å; F110-I136 HydrophobicContact CE2-CD1 3.75Å; F110-I136 HydrophobicContact CG-CD1 4.16Å; F110-I136 HydrophobicContact CG-CG2 4.37Å; F110-I136 HydrophobicContact CZ-CD1 4.32Å; Y129-I136 HydrophobicContact CD1-CD1 3.8Å; Y129-I136 HydrophobicContact CD1-CG1 3.28Å; Y129-I136 HydrophobicContact CE1-CB 4.5Å; Y129-I136 HydrophobicContact CE1-CD1 4.29Å; Y129-I136 HydrophobicContact CE1-CG1 3.4Å; Y129-I136 VanDerWaalsContact CE1-CG1 3.4Å; Y129-I136 HydrophobicContact CG-CD1 4.21Å; Y129-I136 HydrophobicContact CG-CG1 4.16Å; I136-E143 WeakPolarHBondContact O-CA 3.46Å; I136-V144 HydrophobicContact CB-CG2 4.19Å; I136-V144 PolarHBondContact N-O 3.38Å; I136-V144 PolarHBondContact O-N 3.17Å; I136-L146 HydrophobicContact CD1-CD1 4.28Å; I136-L146 HydrophobicContact CD1-CD2 4.02Å; I136-L146 HydrophobicContact CD1-CG 3.98Å
137	K	91.3	Very high	89.6	Confident	137 Å²	137	44.2 Å²	44.2	60%	0.596	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.8	173.8	-72.8	177.3	179.6	176.8	0	110.2	E143	K137-E143 WeakPolarHBondContact CE-OE1 3.36Å; K137-E143 HydrophobicContact CG-CG 3.91Å
138	T	90	Very high	89.7	Confident	13 Å²	13	44.9 Å²	44.9	8%	0.08	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-82.1	161.4	178.3	80.1	0	0	0	0	110.8	Q96 I98 A140 G141 A142 V144	Q96-T138 HydrophobicContact CB-CG2 3.9Å; Q96-T138 HydrophobicContact CG-CG2 4.13Å; Q96-T138 PolarHBondContact OE1-OG1 2.81Å; I98-T138 HydrophobicContact CD1-CG2 4.36Å; I98-T138 HydrophobicContact CG1-CG2 4.18Å; T138-A140 PolarHBondContact O-N 2.76Å; T138-A140 VanDerWaalsContact O-N 3.13Å; T138-A140 PolarHBondContact OG1-N 3.08Å; T138-G141 PolarHBondContact O-N 3.43Å; T138-A142 HydrophobicContact CG2-CB 4.38Å; T138-A142 PolarHBondContact N-O 2.85Å; T138-A142 PolarHBondContact OG1-N 3.19Å; T138-A142 PolarHBondContact OG1-O 3.08Å; T138-V144 HydrophobicContact CG2-CG1 4.33Å; T138-V144 HydrophobicContact CG2-CG2 3.76Å
139	K	83.8	Confident	90	Very high	173 Å²	173	48.9 Å²	48.9	75%	0.752	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.5	174.5	-64.6	-178.1	-179.3	172.8	0	112.6	G141	K139-G141 PolarHBondContact O-N 3.44Å
140	A	83.3	Confident	90.1	Very high	85 Å²	85	50.2 Å²	50.2	70%	0.702	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-2.5	174.9	0	0	0	0	0	113.4	T138 A142	T138-A140 PolarHBondContact O-N 2.76Å; T138-A140 VanDerWaalsContact O-N 3.13Å; T138-A140 PolarHBondContact OG1-N 3.08Å; A140-A142 VanDerWaalsContact C-N 3.32Å
141	G	84.5	Confident	90.1	Very high	65 Å²	65	52.5 Å²	52.5	67%	0.67	30%	0.301	S	S	*	.	S	Bend	trans	81.3	5.6	-177.4	0	0	0	0	0	114.5	T138 K139	T138-G141 PolarHBondContact O-N 3.43Å; K139-G141 PolarHBondContact O-N 3.44Å
142	A	87.7	Confident	90.2	Very high	28 Å²	28	47.1 Å²	47.1	23%	0.231	28%	0.277	C	S	.	.			trans	-76.5	148.9	173	0	0	0	0	0	110.4	T138 A140	T138-A142 HydrophobicContact CG2-CB 4.38Å; T138-A142 PolarHBondContact N-O 2.85Å; T138-A142 PolarHBondContact OG1-N 3.19Å; T138-A142 PolarHBondContact OG1-O 3.08Å; A140-A142 VanDerWaalsContact C-N 3.32Å
143	E	91.1	Very high	90.2	Very high	82 Å²	82	52.4 Å²	52.4	38%	0.383	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.6	168.2	-71.3	-171.1	172.7	0	0	108.8	P135 I136 K137	P135-E143 HydrophobicContact CB-CB 4.31Å; I136-E143 WeakPolarHBondContact O-CA 3.46Å; K137-E143 WeakPolarHBondContact CE-OE1 3.36Å; K137-E143 HydrophobicContact CG-CG 3.91Å
144	V	94.1	Very high	89.8	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.018	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	160	179.9	-67.4	0	0	0	0	111.1	V88 D90 Q96 I98 P135 I136 T138	V88-V144 HydrophobicContact CG1-CB 3.72Å; V88-V144 HydrophobicContact CG1-CG1 4.1Å; V88-V144 HydrophobicContact CG1-CG2 3.47Å; V88-V144 VanDerWaalsContact CG1-CG2 3.47Å; D90-V144 HydrophobicContact CB-CG1 3.68Å; Q96-V144 HydrophobicContact CB-CG1 4.05Å; Q96-V144 HydrophobicContact CG-CG1 3.64Å; I98-V144 HydrophobicContact CD1-CG2 3.57Å; P135-V144 CarbonylContact C-O 3.51Å; P135-V144 WeakPolarHBondContact CA-O 3.17Å; I136-V144 HydrophobicContact CB-CG2 4.19Å; I136-V144 PolarHBondContact N-O 3.38Å; I136-V144 PolarHBondContact O-N 3.17Å; T138-V144 HydrophobicContact CG2-CG1 4.33Å; T138-V144 HydrophobicContact CG2-CG2 3.76Å
145	R	93.7	Very high	89.5	Confident	47 Å²	47	58.6 Å²	58.6	18%	0.177	33%	0.328	C	S	.	.			trans	-131.3	146.8	-179.8	-62.4	-178.9	179.9	-157.6	3.4	109.9	D22 F25 V88 G147	D22-R145 IonicContact OD1-CZ 2.88Å; D22-R145 IonicContact OD1-NH2 3.05Å; D22-R145 PolarHBondContact OD1-NH2 2.7Å; F25-R145 VanDerWaalsContact CG-NH1 3.35Å; V88-R145 WeakPolarHBondContact CG2-O 3.26Å; R145-G147 PolarHBondContact O-N 3.4Å
146	L	95.3	Very high	89.2	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.037	34%	0.339	C	S	.	.			trans	-84.2	113	175.1	-53.3	-173.3	0	0	0	108.5	F72 V86 V88 F110 V126 A130 I136	F72-L146 HydrophobicContact CB-CD2 4.03Å; F72-L146 HydrophobicContact CD1-CB 3.88Å; F72-L146 HydrophobicContact CD1-CD2 4.42Å; F72-L146 HydrophobicContact CD2-CD2 4.26Å; F72-L146 HydrophobicContact CE1-CB 3.91Å; F72-L146 HydrophobicContact CE2-CD1 4.47Å; F72-L146 HydrophobicContact CG-CB 4.27Å; F72-L146 HydrophobicContact CG-CD2 3.98Å; F72-L146 HydrophobicContact CZ-CB 4.34Å; V86-L146 HydrophobicContact CG1-CD2 3.81Å; V88-L146 HydrophobicContact CB-CD2 4.38Å; V88-L146 HydrophobicContact CG2-CD2 4.42Å; F110-L146 HydrophobicContact CE2-CD1 4.24Å; F110-L146 HydrophobicContact CZ-CD1 4.37Å; V126-L146 HydrophobicContact CG1-CD1 4.1Å; A130-L146 HydrophobicContact CB-CB 4Å; I136-L146 HydrophobicContact CD1-CD1 4.28Å; I136-L146 HydrophobicContact CD1-CD2 4.02Å; I136-L146 HydrophobicContact CD1-CG 3.98Å
147	G	92.4	Very high	88.8	Confident	43 Å²	43	65.1 Å²	65.1	44%	0.443	36%	0.356	S	S	.	.			trans	-103.6	-99.1	179.2	0	0	0	0	0	111.3	D70 R145	D70-G147 CarbonylContact O-C 3.48Å; D70-G147 WeakPolarHBondContact O-CA 3.41Å; D70-G147 PolarHBondContact O-N 2.83Å; R145-G147 PolarHBondContact O-N 3.4Å
148	A	93.2	Very high	88.7	Confident	51 Å²	51	59.5 Å²	59.5	42%	0.421	33%	0.332	S	S	.	.	S	Bend	trans	-94.2	134.1	-174.8	0	0	0	0	0	112.5	D70 D71 F72	D70-A148 PolarHBondContact O-N 2.82Å; D71-A148 CarbonylContact C-O 3.59Å; D71-A148 WeakPolarHBondContact CA-O 3.46Å; F72-A148 WeakPolarHBondContact CD1-O 3.46Å; F72-A148 PolarHBondContact N-O 3.41Å
149	E	94.4	Very high	88.5	Confident	86 Å²	86	59.8 Å²	59.8	40%	0.402	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-76.4	120.1	177.9	-68.6	167	-169	0	0	111.5	Y52 F72 Q151	Y52-E149 HydrophobicContact CD1-CB 3.83Å; Y52-E149 HydrophobicContact CD1-CG 3.55Å; Y52-E149 WeakPolarHBondContact CD1-OE2 3.4Å; Y52-E149 HydrophobicContact CE1-CG 3.88Å; Y52-E149 WeakPolarHBondContact CE1-OE1 3.02Å; Y52-E149 VanDerWaalsContact CE1-OE2 3.32Å; Y52-E149 WeakPolarHBondContact CE1-OE2 3.39Å; Y52-E149 HydrophobicContact CG-CB 4.04Å; Y52-E149 HydrophobicContact CG-CG 3.95Å; F72-E149 HydrophobicContact CE1-CB 4.46Å; F72-E149 HydrophobicContact CE1-CG 3.72Å; F72-E149 HydrophobicContact CE2-CG 4.23Å; F72-E149 HydrophobicContact CZ-CB 4.38Å; F72-E149 HydrophobicContact CZ-CG 3.4Å; E149-Q151 PolarHBondContact O-N 3.49Å; E149-Q151 PolarHBondContact O-NE2 2.86Å
150	V	94.6	Very high	88.8	Confident	27 Å²	27	53.5 Å²	53.5	16%	0.164	31%	0.306	C	S	.	.			trans	-83	112.6	172.3	-178.4	0	0	0	0	109.7	Y52 H54 L65 L66 D71 F72 L73	Y52-V150 WeakPolarHBondContact CA-O 3.42Å; Y52-V150 WeakPolarHBondContact CB-O 3.19Å; H54-V150 PolarHBondContact NE2-O 3.17Å; L65-V150 HydrophobicContact CB-CG1 4.42Å; L66-V150 HydrophobicContact CD2-CG2 3.91Å; D71-V150 HydrophobicContact CB-CG2 3.89Å; F72-V150 PolarHBondContact O-N 3.36Å; L73-V150 HydrophobicContact CB-CB 4.24Å; L73-V150 HydrophobicContact CD2-CB 4.31Å; L73-V150 HydrophobicContact CD2-CG1 4.35Å
151	Q	90.7	Very high	89.1	Confident	81 Å²	81	50.3 Å²	50.3	38%	0.379	28%	0.278	S	S	.	.			trans	-66.6	140.7	-176.9	-57	-62.3	-61.3	0	0	111.8	H54 E149	H54-Q151 PolarHBondContact CE1-O 2.81Å; E149-Q151 PolarHBondContact O-N 3.49Å; E149-Q151 PolarHBondContact O-NE2 2.86Å
152	S	88.8	Confident	89.3	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	26%	0.255	C	S	.	.			trans	-83.8	126.9	178.8	-174.4	0	0	0	0	112.2	P51 F53 H54 N154 Y155 E156	P51-S152 PolarHBondContact O-N 2.85Å; F53-S152 WeakPolarHBondContact O-CB 3.29Å; F53-S152 PolarHBondContact O-OG 2.91Å; H54-S152 WeakPolarHBondContact CE1-CA 3.43Å; H54-S152 PolarHBondContact ND1-OG 3.11Å; S152-N154 PolarHBondContact O-N 2.85Å; S152-N154 PolarHBondContact OG-N 3.05Å; S152-Y155 WeakPolarHBondContact O-CB 3.1Å; S152-Y155 PolarHBondContact O-N 3.44Å; S152-Y155 VanDerWaalsContact O-N 3.08Å; S152-E156 PolarHBondContact O-N 2.67Å
153	H	83.7	Confident	89.2	Confident	137 Å²	137	55.9 Å²	55.9	63%	0.634	28%	0.282	S	S	*	.	H	α-helix	trans	-60.9	-30.9	170.4	-171.6	65.6	0	0	0	112.2	Y155 E156 K157	H153-Y155 VanDerWaalsContact C-N 3.33Å; H153-E156 PolarHBondContact O-N 2.72Å; H153-K157 WeakPolarHBondContact O-CB 3.46Å; H153-K157 PolarHBondContact O-N 3.34Å
154	N	80.7	Confident	88.9	Confident	76 Å²	76	53.4 Å²	53.4	41%	0.406	27%	0.272	S	S	.	.	H	α-helix	trans	-69.2	-31.4	175.9	-78.1	-36.6	0	0	0	112.8	H54 S152 K157	H54-N154 PolarHBondContact O-ND2 3.39Å; S152-N154 PolarHBondContact O-N 2.85Å; S152-N154 PolarHBondContact OG-N 3.05Å; N154-K157 WeakPolarHBondContact O-CG 3.46Å; N154-K157 WeakPolarHBondContact OD1-CE 3.47Å; N154-K157 PolarHBondContact OD1-NZ 3.25Å
155	Y	81.5	Confident	88.4	Confident	72 Å²	72	59.7 Å²	59.7	28%	0.282	30%	0.301	S	S	.	.	H	α-helix	trans	-70	-44.8	170.9	179.8	-94.5	0	0	0	110.3	Y49 P51 S152 H153 F159	Y49-Y155 WeakPolarHBondContact O-CE2 3.35Å; P51-Y155 HydrophobicContact CB-CD1 4.08Å; P51-Y155 HydrophobicContact CB-CE1 3.95Å; P51-Y155 HydrophobicContact CG-CE1 4.11Å; P51-Y155 HydrophobicContact CG-CE2 4.47Å; S152-Y155 WeakPolarHBondContact O-CB 3.1Å; S152-Y155 PolarHBondContact O-N 3.44Å; S152-Y155 VanDerWaalsContact O-N 3.08Å; H153-Y155 VanDerWaalsContact C-N 3.33Å; Y155-F159 AromaticContact CD1-CE1 3.72Å; Y155-F159 HydrophobicContact CD1-CE1 3.72Å; Y155-F159 AromaticContact CD1-CZ 3.77Å; Y155-F159 HydrophobicContact CD1-CZ 3.77Å; Y155-F159 AromaticContact CE1-CE1 3.55Å; Y155-F159 HydrophobicContact CE1-CE1 3.55Å; Y155-F159 AromaticContact CE1-CZ 3.72Å; Y155-F159 HydrophobicContact CE1-CZ 3.72Å; Y155-F159 WeakPolarHBondContact O-CE1 3.43Å
156	E	83.4	Confident	88	Confident	71 Å²	71	62.4 Å²	62.4	33%	0.332	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-42.7	-177	-65.6	-167.4	142.1	0	0	113.9	S152 H153 E158 F159 M160	S152-E156 PolarHBondContact O-N 2.67Å; H153-E156 PolarHBondContact O-N 2.72Å; E156-E158 PolarHBondContact O-N 2.99Å; E156-F159 VanDerWaalsContact CA-CZ 3.44Å; E156-F159 HydrophobicContact CB-CE2 3.97Å; E156-F159 HydrophobicContact CB-CZ 4.07Å; E156-F159 HydrophobicContact CG-CE2 4.07Å; E156-F159 HydrophobicContact CG-CZ 3.94Å; E156-F159 WeakPolarHBondContact O-CD2 3.49Å; E156-F159 WeakPolarHBondContact O-CE2 3.23Å; E156-F159 WeakPolarHBondContact O-CG 3.32Å; E156-F159 PolarHBondContact O-N 3.21Å; E156-M160 HydrophobicContact CB-CG 4.36Å; E156-M160 VanDerWaalsContact O-CG 3.29Å; E156-M160 WeakPolarHBondContact O-CG 3.31Å; E156-M160 PolarHBondContact O-N 2.95Å; E156-M160 VanDerWaalsContact O-N 3.15Å
157	K	86.1	Confident	87.6	Confident	82 Å²	82	63.7 Å²	63.7	36%	0.357	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-53.7	-28.8	-174.5	75.2	-176	179.5	-173.2	0	113.8	H153 N154 F159 M160 K252	H153-K157 WeakPolarHBondContact O-CB 3.46Å; H153-K157 PolarHBondContact O-N 3.34Å; N154-K157 WeakPolarHBondContact O-CG 3.46Å; N154-K157 WeakPolarHBondContact OD1-CE 3.47Å; N154-K157 PolarHBondContact OD1-NZ 3.25Å; K157-F159 PolarHBondContact O-N 2.82Å; K157-M160 PolarHBondContact O-N 3.23Å; K157-K252 PolarHBondContact O-NZ 3.34Å; K157-K252 VanDerWaalsContact O-NZ 3.13Å
158	E	88.7	Confident	87.5	Confident	19 Å²	19	66.6 Å²	66.6	9%	0.089	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-69.3	-20.3	-178.3	-64.2	-54.8	150.7	0	0	112.7	E156 Y192 K252 V255 S269	E156-E158 PolarHBondContact O-N 2.99Å; E158-Y192 PolarHBondContact OE2-OH 3.06Å; E158-K252 WeakPolarHBondContact O-CD 3.07Å; E158-K252 PolarHBondContact O-NZ 3.48Å; E158-V255 HydrophobicContact CB-CG1 4.09Å; E158-V255 VanDerWaalsContact O-CG1 3.31Å; E158-V255 WeakPolarHBondContact O-CG1 3.06Å; E158-S269 PolarHBondContact OE2-N 3.34Å; E158-S269 PolarHBondContact OE2-OG 3.44Å
159	F	87.1	Confident	87.4	Confident	19 Å²	19	68.6 Å²	68.6	8%	0.083	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-118.6	9.1	173.2	50	-103.9	0	0	0	113.9	Y155 E156 K157 H256 K330 A331	Y155-F159 AromaticContact CD1-CE1 3.72Å; Y155-F159 HydrophobicContact CD1-CE1 3.72Å; Y155-F159 AromaticContact CD1-CZ 3.77Å; Y155-F159 HydrophobicContact CD1-CZ 3.77Å; Y155-F159 AromaticContact CE1-CE1 3.55Å; Y155-F159 HydrophobicContact CE1-CE1 3.55Å; Y155-F159 AromaticContact CE1-CZ 3.72Å; Y155-F159 HydrophobicContact CE1-CZ 3.72Å; Y155-F159 WeakPolarHBondContact O-CE1 3.43Å; E156-F159 VanDerWaalsContact CA-CZ 3.44Å; E156-F159 HydrophobicContact CB-CE2 3.97Å; E156-F159 HydrophobicContact CB-CZ 4.07Å; E156-F159 HydrophobicContact CG-CE2 4.07Å; E156-F159 HydrophobicContact CG-CZ 3.94Å; E156-F159 WeakPolarHBondContact O-CD2 3.49Å; E156-F159 WeakPolarHBondContact O-CE2 3.23Å; E156-F159 WeakPolarHBondContact O-CG 3.32Å; E156-F159 PolarHBondContact O-N 3.21Å; K157-F159 PolarHBondContact O-N 2.82Å; F159-H256 HydrophobicContact CB-CB 3.57Å; F159-H256 HydrophobicContact CG-CB 4.49Å; F159-K330 HydrophobicContact CD2-CD 4.31Å; F159-K330 HydrophobicContact CD2-CG 4.09Å; F159-K330 HydrophobicContact CE2-CD 4.32Å; F159-A331 VanDerWaalsContact O-CB 3.3Å; F159-A331 WeakPolarHBondContact O-CB 3.4Å; F159-A331 PolarHBondContact O-N 2.85Å
160	M	89.1	Confident	87.3	Confident	42 Å²	42	64.9 Å²	64.9	21%	0.207	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-87.9	135.9	167.1	-56.4	-48.1	-79.6	0	0	110.4	E156 K157 K252 V329 K330	E156-M160 HydrophobicContact CB-CG 4.36Å; E156-M160 VanDerWaalsContact O-CG 3.29Å; E156-M160 WeakPolarHBondContact O-CG 3.31Å; E156-M160 PolarHBondContact O-N 2.95Å; E156-M160 VanDerWaalsContact O-N 3.15Å; K157-M160 PolarHBondContact O-N 3.23Å; M160-K252 WeakPolarHBondContact O-CD 3.27Å; M160-K252 VanDerWaalsContact O-CE 3.31Å; M160-K252 WeakPolarHBondContact O-CE 3.44Å; M160-V329 CarbonylContact C-O 3.6Å; M160-V329 HydrophobicContact CE-CB 3.87Å; M160-V329 HydrophobicContact CE-CG2 3.22Å; M160-K330 HydrophobicContact CE-CB 4.07Å; M160-K330 HydrophobicContact SD-CB 3.84Å; M160-K330 HydrophobicContact SD-CG 4.02Å
161	V	89.8	Confident	87.2	Confident	18 Å²	18	66.1 Å²	66.1	11%	0.109	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-75.3	130.8	172.9	179.4	0	0	0	0	108.3	D248 V329 A331	V161-D248 WeakPolarHBondContact CA-OD2 3.31Å; V161-D248 WeakPolarHBondContact CG1-OD2 3.17Å; V161-V329 VanDerWaalsContact CB-O 3.32Å; V161-V329 WeakPolarHBondContact CB-O 3.49Å; V161-V329 WeakPolarHBondContact CG2-O 3.2Å; V161-V329 PolarHBondContact N-O 2.89Å; V161-A331 HydrophobicContact CG2-CB 3.92Å
162	E	89.3	Confident	87.3	Confident	41 Å²	41	62.3 Å²	62.3	19%	0.192	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-72.6	135.4	174.3	-65.1	-175.7	-151.4	0	0	110.3	V164 L170 S171 Y172 D248	E162-V164 HydrophobicContact CB-CG1 4.33Å; E162-V164 HydrophobicContact CB-CG2 4.29Å; E162-V164 PolarHBondContact O-N 2.86Å; E162-L170 HydrophobicContact CB-CD2 3.87Å; E162-L170 HydrophobicContact CG-CD2 4.31Å; E162-L170 WeakPolarHBondContact OE2-CA 3.04Å; E162-S171 VanDerWaalsContact OE1-CB 3.32Å; E162-S171 WeakPolarHBondContact OE1-CB 3.03Å; E162-S171 PolarHBondContact OE1-N 2.6Å; E162-S171 PolarHBondContact OE1-OG 3.14Å; E162-S171 PolarHBondContact OE2-N 3.42Å; E162-Y172 VanDerWaalsContact OE1-CD1 3.31Å; E162-Y172 WeakPolarHBondContact OE1-CD1 3.49Å; E162-Y172 WeakPolarHBondContact OE1-CE1 3.48Å; E162-D248 PolarHBondContact N-OD2 3.39Å
163	E	85	Confident	87.6	Confident	169 Å²	169	63.8 Å²	63.8	79%	0.79	30%	0.304	S	S	*	.			trans	-77.9	50.9	-178.6	-63.3	-163.7	152.8	0	0	112.9	V329	E163-V329 HydrophobicContact CG-CG1 3.62Å; E163-V329 VanDerWaalsContact OE1-CG1 3.24Å; E163-V329 WeakPolarHBondContact OE1-CG1 3.43Å
164	V	86.1	Confident	87.9	Confident	29 Å²	29	57.3 Å²	57.3	18%	0.176	27%	0.274	C	S	.	.			trans	-104.2	151.9	179.7	-59.8	0	0	0	0	112.3	E162 Q169 L170 K246	E162-V164 HydrophobicContact CB-CG1 4.33Å; E162-V164 HydrophobicContact CB-CG2 4.29Å; E162-V164 PolarHBondContact O-N 2.86Å; V164-Q169 HydrophobicContact CB-CB 3.78Å; V164-Q169 HydrophobicContact CG1-CB 3.84Å; V164-Q169 HydrophobicContact CG2-CB 4.31Å; V164-L170 HydrophobicContact CG2-CD2 3.36Å; V164-L170 HydrophobicContact CG2-CG 3.89Å; V164-K246 PolarHBondContact O-NZ 3.3Å
165	Q	81.9	Confident	88.1	Confident	135 Å²	135	61 Å²	61	63%	0.631	29%	0.286	S	S	*	.	S	Bend	trans	-81.8	-37.7	-179.9	-69	-65.8	-20.1	0	0	111.5
166	H	86	Confident	88	Confident	105 Å²	105	62 Å²	62	49%	0.486	30%	0.296	S	S	.	.	S	Bend	trans	-127.1	147.9	-173.7	-56.7	-63.3	0	0	0	111.5	H168 Q169	H166-H168 VanDerWaalsContact CB-NE2 3.27Å; H166-H168 WeakPolarHBondContact CB-NE2 3.3Å; H166-H168 AromaticContact CD2-NE2 3.87Å; H166-H168 AromaticContact CG-NE2 3.71Å; H166-H168 PolarHBondContact O-N 2.76Å; H166-Q169 HydrophobicContact CB-CG 4.39Å; H166-Q169 VanDerWaalsContact N-OE1 3.09Å; H166-Q169 WeakPolarHBondContact O-CB 3.41Å; H166-Q169 PolarHBondContact O-N 3.36Å
167	F	87.8	Confident	88.1	Confident	34 Å²	34	59 Å²	59	15%	0.149	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59.7	-30.6	-177.5	66.5	-95.5	0	0	0	113	Q169 L170 Y173 P202 E203 L206	F167-Q169 PolarHBondContact O-N 3.26Å; F167-Q169 VanDerWaalsContact O-N 3.12Å; F167-L170 HydrophobicContact CB-CD1 4.1Å; F167-L170 VanDerWaalsContact O-CB 3.31Å; F167-L170 WeakPolarHBondContact O-CB 3.19Å; F167-L170 WeakPolarHBondContact O-CD1 3.32Å; F167-L170 VanDerWaalsContact O-CG 3.27Å; F167-L170 WeakPolarHBondContact O-CG 3.44Å; F167-L170 PolarHBondContact O-N 3.32Å; F167-L170 VanDerWaalsContact O-N 3.09Å; F167-Y173 AromaticContact CD2-CD2 3.96Å; F167-Y173 HydrophobicContact CD2-CD2 3.96Å; F167-Y173 AromaticContact CD2-CE2 3.76Å; F167-Y173 HydrophobicContact CD2-CE2 3.76Å; F167-Y173 HydrophobicContact CE2-CD2 4.42Å; F167-Y173 AromaticContact CE2-CE2 3.76Å; F167-Y173 HydrophobicContact CE2-CE2 3.76Å; F167-Y173 AromaticContact CE2-CZ 3.98Å; F167-Y173 WeakPolarHBondContact O-CB 3.42Å; F167-P202 HydrophobicContact CE2-CB 4.19Å; F167-P202 HydrophobicContact CZ-CB 3.89Å; F167-P202 HydrophobicContact CZ-CG 4Å; F167-E203 HydrophobicContact CD1-CG 4.41Å; F167-E203 HydrophobicContact CE1-CB 3.83Å; F167-E203 HydrophobicContact CE1-CG 4.04Å; F167-E203 HydrophobicContact CZ-CB 4.28Å; F167-L206 HydrophobicContact CD1-CD1 4.41Å; F167-L206 HydrophobicContact CD2-CD1 4.4Å; F167-L206 HydrophobicContact CD2-CD2 3.68Å; F167-L206 HydrophobicContact CE2-CD2 3.9Å; F167-L206 HydrophobicContact CG-CD1 4.19Å; F167-L206 HydrophobicContact CG-CD2 4.28Å
168	H	88.8	Confident	88	Confident	104 Å²	104	58.8 Å²	58.8	48%	0.481	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-71.4	-4.4	-179.7	66.9	68.1	0	0	0	113.6	H166 Y173	H166-H168 VanDerWaalsContact CB-NE2 3.27Å; H166-H168 WeakPolarHBondContact CB-NE2 3.3Å; H166-H168 AromaticContact CD2-NE2 3.87Å; H166-H168 AromaticContact CG-NE2 3.71Å; H166-H168 PolarHBondContact O-N 2.76Å; H168-Y173 HydrophobicContact CB-CD1 4.12Å; H168-Y173 HydrophobicContact CB-CE1 3.86Å
169	Q	91.1	Very high	87.5	Confident	93 Å²	93	59.8 Å²	59.8	44%	0.435	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-97.8	-7.4	175.3	-57.9	177.4	-51.3	0	0	112	V164 H166 F167	V164-Q169 HydrophobicContact CB-CB 3.78Å; V164-Q169 HydrophobicContact CG1-CB 3.84Å; V164-Q169 HydrophobicContact CG2-CB 4.31Å; H166-Q169 HydrophobicContact CB-CG 4.39Å; H166-Q169 VanDerWaalsContact N-OE1 3.09Å; H166-Q169 WeakPolarHBondContact O-CB 3.41Å; H166-Q169 PolarHBondContact O-N 3.36Å; F167-Q169 PolarHBondContact O-N 3.26Å; F167-Q169 VanDerWaalsContact O-N 3.12Å
170	L	92.7	Very high	87.4	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.037	32%	0.318	C	S	.	.	S	Bend	trans	-63.7	137.5	179.4	-65.9	166.6	0	0	0	110.1	E162 V164 F167 Y172 Y173 I194 D248	E162-L170 HydrophobicContact CB-CD2 3.87Å; E162-L170 HydrophobicContact CG-CD2 4.31Å; E162-L170 WeakPolarHBondContact OE2-CA 3.04Å; V164-L170 HydrophobicContact CG2-CD2 3.36Å; V164-L170 HydrophobicContact CG2-CG 3.89Å; F167-L170 HydrophobicContact CB-CD1 4.1Å; F167-L170 VanDerWaalsContact O-CB 3.31Å; F167-L170 WeakPolarHBondContact O-CB 3.19Å; F167-L170 WeakPolarHBondContact O-CD1 3.32Å; F167-L170 VanDerWaalsContact O-CG 3.27Å; F167-L170 WeakPolarHBondContact O-CG 3.44Å; F167-L170 PolarHBondContact O-N 3.32Å; F167-L170 VanDerWaalsContact O-N 3.09Å; L170-Y172 HydrophobicContact CB-CD1 4.36Å; L170-Y172 HydrophobicContact CB-CE1 4.13Å; L170-Y172 HydrophobicContact CD2-CE1 4.23Å; L170-Y172 PolarHBondContact O-N 3.17Å; L170-Y172 VanDerWaalsContact O-N 3.15Å; L170-Y173 WeakPolarHBondContact O-CB 3.5Å; L170-Y173 PolarHBondContact O-N 3.19Å; L170-I194 HydrophobicContact CB-CD1 4.46Å; L170-I194 HydrophobicContact CD1-CD1 3.53Å; L170-D248 HydrophobicContact CD1-CB 3.91Å; L170-D248 HydrophobicContact CD2-CB 3.56Å; L170-D248 VanDerWaalsContact CD2-CG 3.49Å; L170-D248 HydrophobicContact CG-CB 4.4Å
171	S	92.3	Very high	87.3	Confident	54 Å²	54	64.1 Å²	64.1	38%	0.378	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.2	-176.3	70.9	0	0	0	0	113	E162 S271 H272	E162-S171 VanDerWaalsContact OE1-CB 3.32Å; E162-S171 WeakPolarHBondContact OE1-CB 3.03Å; E162-S171 PolarHBondContact OE1-N 2.6Å; E162-S171 PolarHBondContact OE1-OG 3.14Å; E162-S171 PolarHBondContact OE2-N 3.42Å; S171-S271 CarbonylContact O-C 3.54Å; S171-S271 VanDerWaalsContact O-CA 3.28Å; S171-S271 WeakPolarHBondContact O-CA 3.26Å; S171-H272 PolarHBondContact O-N 3.14Å
172	Y	94.2	Very high	87.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	13.1	179.5	64.8	-84.8	0	0	0	113.5	E162 L170 H174 Y192 I194 D248 V251 V270	E162-Y172 VanDerWaalsContact OE1-CD1 3.31Å; E162-Y172 WeakPolarHBondContact OE1-CD1 3.49Å; E162-Y172 WeakPolarHBondContact OE1-CE1 3.48Å; L170-Y172 HydrophobicContact CB-CD1 4.36Å; L170-Y172 HydrophobicContact CB-CE1 4.13Å; L170-Y172 HydrophobicContact CD2-CE1 4.23Å; L170-Y172 PolarHBondContact O-N 3.17Å; L170-Y172 VanDerWaalsContact O-N 3.15Å; Y172-H174 PolarHBondContact O-CD2 3.13Å; Y172-Y192 HydrophobicContact CD2-CD2 4.43Å; Y172-Y192 HydrophobicContact CD2-CE2 4.06Å; Y172-Y192 HydrophobicContact CE2-CE2 4.17Å; Y172-I194 HydrophobicContact CD2-CB 4.42Å; Y172-I194 HydrophobicContact CD2-CD1 4.17Å; Y172-I194 HydrophobicContact CD2-CG1 3.73Å; Y172-I194 HydrophobicContact CD2-CG2 4.16Å; Y172-I194 HydrophobicContact CE2-CB 4.38Å; Y172-I194 HydrophobicContact CE2-CD1 3.69Å; Y172-I194 HydrophobicContact CE2-CG1 3.73Å; Y172-I194 HydrophobicContact CE2-CG2 3.83Å; Y172-I194 PolarHBondContact O-N 3.39Å; Y172-D248 WeakPolarHBondContact CE1-OD1 3.03Å; Y172-D248 WeakPolarHBondContact OH-CA 3.41Å; Y172-D248 PolarHBondContact OH-OD1 2.82Å; Y172-V251 HydrophobicContact CE2-CG1 4.11Å; Y172-V270 WeakPolarHBondContact CA-O 3.49Å
173	Y	93.6	Very high	87	Confident	32 Å²	32	61.9 Å²	61.9	13%	0.125	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.7	166.7	175.4	-93.1	0	0	0	111.2	F167 H168 L170 K175 I194 L206	F167-Y173 AromaticContact CD2-CD2 3.96Å; F167-Y173 HydrophobicContact CD2-CD2 3.96Å; F167-Y173 AromaticContact CD2-CE2 3.76Å; F167-Y173 HydrophobicContact CD2-CE2 3.76Å; F167-Y173 HydrophobicContact CE2-CD2 4.42Å; F167-Y173 AromaticContact CE2-CE2 3.76Å; F167-Y173 HydrophobicContact CE2-CE2 3.76Å; F167-Y173 AromaticContact CE2-CZ 3.98Å; F167-Y173 WeakPolarHBondContact O-CB 3.42Å; H168-Y173 HydrophobicContact CB-CD1 4.12Å; H168-Y173 HydrophobicContact CB-CE1 3.86Å; L170-Y173 WeakPolarHBondContact O-CB 3.5Å; L170-Y173 PolarHBondContact O-N 3.19Å; Y173-K175 HydrophobicContact CE1-CB 4.26Å; Y173-I194 CarbonylContact C-O 3.59Å; Y173-I194 WeakPolarHBondContact CA-O 3.38Å; Y173-I194 HydrophobicContact CD2-CD1 4.18Å; Y173-I194 HydrophobicContact CD2-CG1 4Å; Y173-I194 HydrophobicContact CG-CG1 4.43Å; Y173-L206 HydrophobicContact CD2-CD2 4.43Å; Y173-L206 HydrophobicContact CE2-CD2 4.12Å
174	H	91.8	Very high	87.1	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.3	-179.9	-66.7	-106	0	0	0	111.4	Y172 M177 I194 W195 V270 H272	Y172-H174 PolarHBondContact O-CD2 3.13Å; H174-M177 HydrophobicContact CB-CB 4.18Å; H174-M177 HydrophobicContact CB-CE 3.32Å; H174-M177 WeakPolarHBondContact ND1-CE 3.47Å; H174-I194 PolarHBondContact N-O 2.99Å; H174-W195 VanDerWaalsContact O-CB 3.27Å; H174-W195 WeakPolarHBondContact O-CB 3.44Å; H174-V270 PolarHBondContact NE2-O 2.92Å; H174-H272 AromaticContact ND1-ND1 3.73Å
175	K	84.6	Confident	87.3	Confident	153 Å²	153	55.9 Å²	55.9	67%	0.665	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	139.3	175.9	-173.9	178	179.1	178	0	110.5	Y173 M177	Y173-K175 HydrophobicContact CE1-CB 4.26Å; K175-M177 PolarHBondContact O-N 2.98Å
176	N	78.8	Confident	87.8	Confident	92 Å²	92	49.5 Å²	49.5	49%	0.492	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	33.1	179.7	-53.2	-49.8	0	0	0	113.7	K199	N176-K199 WeakPolarHBondContact OD1-CE 3.36Å; N176-K199 PolarHBondContact OD1-NZ 3.47Å
177	M	85.7	Confident	87.9	Confident	10 Å²	10	47.6 Å²	47.6	5%	0.049	25%	0.249	C	C	.	.			trans	-73.2	148.1	171.2	-169.1	64.4	75.3	0	0	109.5	H174 K175 D181 C182 L193 W195	H174-M177 HydrophobicContact CB-CB 4.18Å; H174-M177 HydrophobicContact CB-CE 3.32Å; H174-M177 WeakPolarHBondContact ND1-CE 3.47Å; K175-M177 PolarHBondContact O-N 2.98Å; M177-D181 VanDerWaalsContact SD-C 3.59Å; M177-D181 HydrophobicContact SD-CB 3.37Å; M177-D181 WeakPolarHBondContact SD-CB 3.43Å; M177-C182 WeakPolarHBondContact CG-SG 3.09Å; M177-L193 HydrophobicContact CE-CD1 4.42Å; M177-L193 HydrophobicContact CE-CD2 3.78Å; M177-L193 HydrophobicContact CG-CD1 4.32Å; M177-W195 HydrophobicContact CB-CB 3.65Å; M177-W195 HydrophobicContact CB-CD2 3.86Å; M177-W195 HydrophobicContact CB-CE3 4Å; M177-W195 HydrophobicContact CB-CG 3.74Å; M177-W195 HydrophobicContact CG-CB 4.29Å; M177-W195 HydrophobicContact CG-CD2 4.18Å; M177-W195 HydrophobicContact CG-CG 4.01Å; M177-W195 WeakPolarHBondContact O-CZ3 3.34Å
178	D	82.9	Confident	87.8	Confident	77 Å²	77	48 Å²	48	41%	0.412	25%	0.251	S	S	.	.			trans	-128.4	177.7	166.3	70.1	28	0	0	0	110.1	M180 D181 C182	D178-M180 VanDerWaalsContact C-N 3.27Å; D178-M180 PolarHBondContact O-N 3.36Å; D178-M180 WeakPolarHBondContact OD1-CA 3.32Å; D178-M180 WeakPolarHBondContact OD1-CB 3.4Å; D178-M180 PolarHBondContact OD1-N 2.98Å; D178-D181 PolarHBondContact O-N 3.29Å; D178-D181 PolarHBondContact OD1-N 3.44Å; D178-C182 WeakPolarHBondContact O-CB 3.14Å; D178-C182 PolarHBondContact O-N 2.77Å; D178-C182 PolarHBondContact O-SG 3.34Å; D178-C182 VanDerWaalsContact O-SG 3.36Å
179	A	79.6	Confident	87.8	Confident	39 Å²	39	45.5 Å²	45.5	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-32.7	-177.3	0	0	0	0	0	113.3	C182 G183	A179-C182 WeakPolarHBondContact O-CB 3.24Å; A179-G183 PolarHBondContact O-N 3.42Å
180	M	83.7	Confident	87.8	Confident	110 Å²	110	41 Å²	41	54%	0.542	22%	0.221	S	C	.	.	H	α-helix	trans	-74	-44.8	179.4	-71.6	-65.4	-59.6	0	0	111.1	D178 C182 G183 T184	D178-M180 VanDerWaalsContact C-N 3.27Å; D178-M180 PolarHBondContact O-N 3.36Å; D178-M180 WeakPolarHBondContact OD1-CA 3.32Å; D178-M180 WeakPolarHBondContact OD1-CB 3.4Å; D178-M180 PolarHBondContact OD1-N 2.98Å; M180-C182 VanDerWaalsContact C-N 3.28Å; M180-C182 PolarHBondContact O-N 3.43Å; M180-G183 PolarHBondContact O-N 3.28Å; M180-G183 VanDerWaalsContact O-N 3.13Å; M180-T184 PolarHBondContact O-N 2.96Å
181	D	87.5	Confident	87.9	Confident	43 Å²	43	40.8 Å²	40.8	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-36.7	175.4	-85	-0.6	0	0	0	110.9	M177 D178 G183 T184 T185 R275	M177-D181 VanDerWaalsContact SD-C 3.59Å; M177-D181 HydrophobicContact SD-CB 3.37Å; M177-D181 WeakPolarHBondContact SD-CB 3.43Å; D178-D181 PolarHBondContact O-N 3.29Å; D178-D181 PolarHBondContact OD1-N 3.44Å; D181-G183 PolarHBondContact O-N 3.35Å; D181-T184 PolarHBondContact O-N 3.45Å; D181-T184 PolarHBondContact O-OG1 3.08Å; D181-T185 VanDerWaalsContact O-CB 3.29Å; D181-T185 WeakPolarHBondContact O-CB 3.32Å; D181-T185 PolarHBondContact O-N 3.31Å; D181-T185 PolarHBondContact O-OG1 3.34Å; D181-R275 VanDerWaalsContact CG-NH2 3.34Å; D181-R275 IonicContact OD1-NH2 3.47Å; D181-R275 IonicContact OD2-CZ 3.12Å; D181-R275 IonicContact OD2-NH1 2.91Å; D181-R275 IonicContact OD2-NH2 3.37Å; D181-R275 PolarHBondContact OD2-NH2 3.33Å
182	C	88.1	Confident	88	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57	-47.3	171	-80.1	0	0	0	0	111.8	M177 D178 A179 M180 T184 T185 L186 I216	M177-C182 WeakPolarHBondContact CG-SG 3.09Å; D178-C182 WeakPolarHBondContact O-CB 3.14Å; D178-C182 PolarHBondContact O-N 2.77Å; D178-C182 PolarHBondContact O-SG 3.34Å; D178-C182 VanDerWaalsContact O-SG 3.36Å; A179-C182 WeakPolarHBondContact O-CB 3.24Å; M180-C182 VanDerWaalsContact C-N 3.28Å; M180-C182 PolarHBondContact O-N 3.43Å; C182-T184 VanDerWaalsContact C-N 3.28Å; C182-T184 PolarHBondContact O-N 3.32Å; C182-T185 PolarHBondContact O-N 2.83Å; C182-L186 WeakPolarHBondContact O-CB 3.31Å; C182-L186 WeakPolarHBondContact O-CG 3.24Å; C182-L186 PolarHBondContact O-N 3.17Å; C182-I216 HydrophobicContact CB-CG2 4.35Å
183	G	85.2	Confident	88.1	Confident	12 Å²	12	38.2 Å²	38.2	12%	0.124	20%	0.202	C	C	.	.	H	α-helix	trans	-65.2	-27.9	-177.4	0	0	0	0	0	114.6	A179 M180 D181 R211	A179-G183 PolarHBondContact O-N 3.42Å; M180-G183 PolarHBondContact O-N 3.28Å; M180-G183 VanDerWaalsContact O-N 3.13Å; D181-G183 PolarHBondContact O-N 3.35Å; G183-R211 PolarHBondContact O-NH1 2.75Å
184	T	86.5	Confident	88.1	Confident	56 Å²	56	36.7 Å²	36.7	34%	0.344	20%	0.196	S	C	.	.	H	α-helix	trans	-87.8	-18.5	175.7	57.4	0	0	0	0	113.3	M180 D181 C182 L187	M180-T184 PolarHBondContact O-N 2.96Å; D181-T184 PolarHBondContact O-N 3.45Å; D181-T184 PolarHBondContact O-OG1 3.08Å; C182-T184 VanDerWaalsContact C-N 3.28Å; C182-T184 PolarHBondContact O-N 3.32Å; T184-L187 WeakPolarHBondContact O-CD2 3.45Å
185	T	90.4	Very high	88.2	Confident	16 Å²	16	37.7 Å²	37.7	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-93.8	-39.6	-179.1	-57.8	0	0	0	0	112.3	D181 C182 L187 L193 V270	D181-T185 VanDerWaalsContact O-CB 3.29Å; D181-T185 WeakPolarHBondContact O-CB 3.32Å; D181-T185 PolarHBondContact O-N 3.31Å; D181-T185 PolarHBondContact O-OG1 3.34Å; C182-T185 PolarHBondContact O-N 2.83Å; T185-L187 PolarHBondContact O-N 3.4Å; T185-L193 HydrophobicContact CG2-CD2 3.82Å; T185-V270 HydrophobicContact CG2-CG1 3.74Å
186	L	92.6	Very high	88.4	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.			trans	-85.6	110.8	177	-57.4	177.3	0	0	0	108.4	C182 D191 L193 R211 I216 V270	C182-L186 WeakPolarHBondContact O-CB 3.31Å; C182-L186 WeakPolarHBondContact O-CG 3.24Å; C182-L186 PolarHBondContact O-N 3.17Å; L186-D191 HydrophobicContact CB-CB 4.39Å; L186-D191 HydrophobicContact CD2-CB 4.06Å; L186-L193 HydrophobicContact CD1-CG 4.41Å; L186-L193 HydrophobicContact CD2-CB 4.32Å; L186-L193 HydrophobicContact CD2-CD2 3.73Å; L186-L193 HydrophobicContact CD2-CG 3.89Å; L186-L193 HydrophobicContact CG-CD2 4.06Å; L186-L193 HydrophobicContact CG-CG 4.36Å; L186-R211 HydrophobicContact CB-CB 3.8Å; L186-R211 WeakPolarHBondContact O-CD 3.24Å; L186-R211 PolarHBondContact O-NH1 2.84Å; L186-I216 HydrophobicContact CB-CD1 4.03Å; L186-I216 HydrophobicContact CD1-CD1 4.11Å; L186-I216 HydrophobicContact CD1-CG2 4.16Å; L186-V270 HydrophobicContact CD2-CB 4.29Å; L186-V270 HydrophobicContact CD2-CG2 3.83Å
187	L	87.9	Confident	88.6	Confident	66 Å²	66	31.5 Å²	31.5	35%	0.346	17%	0.172	S	C	.	.			trans	-102.4	-34.3	-168.7	-60.5	-179	0	0	0	112.7	T184 T185 D191 R211 Y278	T184-L187 WeakPolarHBondContact O-CD2 3.45Å; T185-L187 PolarHBondContact O-N 3.4Å; L187-D191 PolarHBondContact N-OD2 2.54Å; L187-R211 PolarHBondContact O-NE 3.37Å; L187-Y278 HydrophobicContact CD1-CD2 4.37Å; L187-Y278 HydrophobicContact CD1-CE1 4.4Å; L187-Y278 HydrophobicContact CD1-CE2 4.25Å; L187-Y278 HydrophobicContact CD1-CG 4.5Å
188	Q	87	Confident	88.4	Confident	41 Å²	41	34 Å²	34	19%	0.192	19%	0.186	C	C	.	.	S	Bend	trans	-121.3	157	-174.3	-60.7	175.5	1.4	0	0	112	G190 D191 R211 N527	Q188-G190 PolarHBondContact O-N 3.24Å; Q188-D191 WeakPolarHBondContact CB-OD2 3.4Å; Q188-D191 PolarHBondContact N-OD2 3.32Å; Q188-D191 WeakPolarHBondContact O-CB 2.92Å; Q188-D191 PolarHBondContact O-N 3.08Å; Q188-R211 WeakPolarHBondContact O-CB 3.38Å; Q188-N527 PolarHBondContact NE2-OD1 3.45Å
189	D	88.6	Confident	88.1	Confident	52 Å²	52	37.6 Å²	37.6	28%	0.278	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	130.9	173.7	-77.3	4.5	0	0	0	110.7	D191 R211 W212 E213	D189-D191 VanDerWaalsContact C-N 3.27Å; D189-D191 PolarHBondContact O-N 3.1Å; D189-R211 WeakPolarHBondContact CA-O 3.1Å; D189-W212 HydrophobicContact CB-CE3 4.16Å; D189-W212 HydrophobicContact CB-CZ3 4.39Å; D189-W212 WeakPolarHBondContact OD1-CA 3.02Å; D189-E213 PolarHBondContact OD1-N 3.01Å; D189-E213 VanDerWaalsContact OD1-N 3.09Å; D189-E213 PolarHBondContact OD2-N 3.01Å
190	G	90.7	Very high	88.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	2.4	-174.9	0	0	0	0	0	115.4	Q188 R211 Q265 L267 R268	Q188-G190 PolarHBondContact O-N 3.24Å; G190-R211 PolarHBondContact N-O 2.92Å; G190-Q265 WeakPolarHBondContact CA-O 3.19Å; G190-L267 PolarHBondContact O-N 2.79Å; G190-R268 PolarHBondContact O-N 2.96Å
191	D	93.4	Very high	88.2	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	131.3	162.5	-73.1	-10.6	0	0	0	109.5	L186 L187 Q188 D189 V210 R211 R268 V270 R526	L186-D191 HydrophobicContact CB-CB 4.39Å; L186-D191 HydrophobicContact CD2-CB 4.06Å; L187-D191 PolarHBondContact N-OD2 2.54Å; Q188-D191 WeakPolarHBondContact CB-OD2 3.4Å; Q188-D191 PolarHBondContact N-OD2 3.32Å; Q188-D191 WeakPolarHBondContact O-CB 2.92Å; Q188-D191 PolarHBondContact O-N 3.08Å; D189-D191 VanDerWaalsContact C-N 3.27Å; D189-D191 PolarHBondContact O-N 3.1Å; D191-V210 VanDerWaalsContact O-CA 3.29Å; D191-V210 WeakPolarHBondContact O-CA 3.32Å; D191-V210 WeakPolarHBondContact O-CG2 3.31Å; D191-R211 PolarHBondContact O-N 3.49Å; D191-R268 CarbonylContact C-O 3.59Å; D191-R268 WeakPolarHBondContact CA-O 3.44Å; D191-R268 IonicContact OD1-CZ 3.87Å; D191-R268 VanDerWaalsContact OD1-CZ 3.28Å; D191-R268 IonicContact OD1-NE 3.41Å; D191-R268 PolarHBondContact OD1-NE 2.95Å; D191-R268 IonicContact OD1-NH2 2.65Å; D191-R268 PolarHBondContact OD1-NH2 2.92Å; D191-R268 IonicContact OD2-CZ 3.95Å; D191-R268 IonicContact OD2-NE 2.72Å; D191-R268 IonicContact OD2-NH2 3.78Å; D191-R268 PolarHBondContact OD2-NH2 2.76Å; D191-V270 HydrophobicContact CB-CG2 3.84Å; D191-R526 IonicContact OD1-NH2 3.82Å; D191-R526 PolarHBondContact OD1-NH2 2.77Å
192	Y	95.7	Very high	88	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156.5	-178.2	71.3	-91.1	0	0	0	113.2	E158 Y172 L208 S209 V251 V255 L266 R268 S269 V270	E158-Y192 PolarHBondContact OE2-OH 3.06Å; Y172-Y192 HydrophobicContact CD2-CD2 4.43Å; Y172-Y192 HydrophobicContact CD2-CE2 4.06Å; Y172-Y192 HydrophobicContact CE2-CE2 4.17Å; Y192-L208 HydrophobicContact CD2-CD1 3.88Å; Y192-L208 HydrophobicContact CG-CD1 4.33Å; Y192-S209 CarbonylContact C-O 3.54Å; Y192-S209 WeakPolarHBondContact CA-O 3.31Å; Y192-S209 WeakPolarHBondContact CB-O 3.46Å; Y192-V251 HydrophobicContact CD2-CG1 4.1Å; Y192-V251 HydrophobicContact CE2-CG1 3.52Å; Y192-V255 HydrophobicContact CE1-CG2 3.73Å; Y192-L266 HydrophobicContact CD1-CB 3.75Å; Y192-L266 HydrophobicContact CD1-CD2 4.34Å; Y192-L266 HydrophobicContact CE1-CB 3.99Å; Y192-L266 HydrophobicContact CG-CB 4.32Å; Y192-L266 HydrophobicContact CG-CD2 4.16Å; Y192-R268 VanDerWaalsContact CD1-C 3.4Å; Y192-R268 WeakPolarHBondContact CD1-O 3.42Å; Y192-R268 WeakPolarHBondContact CE1-O 3.41Å; Y192-R268 PolarHBondContact N-O 3.29Å; Y192-S269 WeakPolarHBondContact O-CA 3.33Å; Y192-S269 WeakPolarHBondContact OH-CB 3.23Å; Y192-V270 PolarHBondContact O-N 3.12Å
193	L	95.8	Very high	87.6	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	165.1	171.4	63.1	79.5	0	0	0	110.6	M177 T185 L186 W195 S209	M177-L193 HydrophobicContact CE-CD1 4.42Å; M177-L193 HydrophobicContact CE-CD2 3.78Å; M177-L193 HydrophobicContact CG-CD1 4.32Å; T185-L193 HydrophobicContact CG2-CD2 3.82Å; L186-L193 HydrophobicContact CD1-CG 4.41Å; L186-L193 HydrophobicContact CD2-CB 4.32Å; L186-L193 HydrophobicContact CD2-CD2 3.73Å; L186-L193 HydrophobicContact CD2-CG 3.89Å; L186-L193 HydrophobicContact CG-CD2 4.06Å; L186-L193 HydrophobicContact CG-CG 4.36Å; L193-W195 HydrophobicContact CD1-CB 4.46Å; L193-W195 HydrophobicContact CD1-CG 4.32Å; L193-S209 PolarHBondContact N-O 3.21Å; L193-S209 PolarHBondContact O-N 3.13Å
194	I	94.5	Very high	87.5	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146.9	171.7	62.9	172.2	0	0	0	110.8	L170 Y172 Y173 H174 T207 L208 I221 V251	L170-I194 HydrophobicContact CB-CD1 4.46Å; L170-I194 HydrophobicContact CD1-CD1 3.53Å; Y172-I194 HydrophobicContact CD2-CB 4.42Å; Y172-I194 HydrophobicContact CD2-CD1 4.17Å; Y172-I194 HydrophobicContact CD2-CG1 3.73Å; Y172-I194 HydrophobicContact CD2-CG2 4.16Å; Y172-I194 HydrophobicContact CE2-CB 4.38Å; Y172-I194 HydrophobicContact CE2-CD1 3.69Å; Y172-I194 HydrophobicContact CE2-CG1 3.73Å; Y172-I194 HydrophobicContact CE2-CG2 3.83Å; Y172-I194 PolarHBondContact O-N 3.39Å; Y173-I194 CarbonylContact C-O 3.59Å; Y173-I194 WeakPolarHBondContact CA-O 3.38Å; Y173-I194 HydrophobicContact CD2-CD1 4.18Å; Y173-I194 HydrophobicContact CD2-CG1 4Å; Y173-I194 HydrophobicContact CG-CG1 4.43Å; H174-I194 PolarHBondContact N-O 2.99Å; I194-T207 WeakPolarHBondContact CA-O 3.46Å; I194-L208 HydrophobicContact CG2-CB 4.44Å; I194-L208 HydrophobicContact CG2-CD1 3.91Å; I194-I221 HydrophobicContact CG2-CD1 3.89Å; I194-V251 HydrophobicContact CG2-CG2 4.26Å
195	W	92.9	Very high	87.5	Confident	23 Å²	23	48.8 Å²	48.8	9%	0.087	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	174.5	174.8	63.4	-72	0	0	0	109.7	H174 M177 L193 M197 L206 T207 S209	H174-W195 VanDerWaalsContact O-CB 3.27Å; H174-W195 WeakPolarHBondContact O-CB 3.44Å; M177-W195 HydrophobicContact CB-CB 3.65Å; M177-W195 HydrophobicContact CB-CD2 3.86Å; M177-W195 HydrophobicContact CB-CE3 4Å; M177-W195 HydrophobicContact CB-CG 3.74Å; M177-W195 HydrophobicContact CG-CB 4.29Å; M177-W195 HydrophobicContact CG-CD2 4.18Å; M177-W195 HydrophobicContact CG-CG 4.01Å; M177-W195 WeakPolarHBondContact O-CZ3 3.34Å; L193-W195 HydrophobicContact CD1-CB 4.46Å; L193-W195 HydrophobicContact CD1-CG 4.32Å; W195-M197 HydrophobicContact CH2-CG 3.78Å; W195-M197 HydrophobicContact CZ2-CG 4.25Å; W195-M197 HydrophobicContact CZ3-CB 4.33Å; W195-M197 HydrophobicContact CZ3-CG 3.97Å; W195-L206 CarbonylContact O-C 3.54Å; W195-L206 WeakPolarHBondContact O-CA 3.5Å; W195-T207 HydrophobicContact CZ2-CG2 4.47Å; W195-T207 PolarHBondContact N-O 3.47Å; W195-T207 PolarHBondContact O-N 2.85Å; W195-S209 PolarHBondContact NE1-OG 3.36Å
196	S	89.2	Confident	87.6	Confident	13 Å²	13	48.1 Å²	48.1	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.1	177.8	-63	0	0	0	0	110.3	P202 T205	S196-P202 WeakPolarHBondContact CB-O 3.19Å; S196-P202 WeakPolarHBondContact OG-CA 3.23Å; S196-P202 VanDerWaalsContact OG-CB 3.32Å; S196-P202 WeakPolarHBondContact OG-CB 3.16Å; S196-P202 PolarHBondContact OG-O 2.92Å; S196-T205 WeakPolarHBondContact CA-O 3.39Å
197	M	82.2	Confident	87.6	Confident	101 Å²	101	48.1 Å²	48.1	50%	0.498	24%	0.242	S	C	.	.	S	Bend	trans	-70.1	-36.5	177.1	-66.2	-169.5	-168.2	0	0	112.4	W195 T205 T207	W195-M197 HydrophobicContact CH2-CG 3.78Å; W195-M197 HydrophobicContact CZ2-CG 4.25Å; W195-M197 HydrophobicContact CZ3-CB 4.33Å; W195-M197 HydrophobicContact CZ3-CG 3.97Å; M197-T205 PolarHBondContact N-O 3.24Å; M197-T205 VanDerWaalsContact N-O 3.14Å; M197-T207 HydrophobicContact CE-CG2 3.71Å; M197-T207 WeakPolarHBondContact CE-OG1 3.39Å; M197-T207 WeakPolarHBondContact CG-OG1 3.24Å
198	D	82.1	Confident	88	Confident	62 Å²	62	45 Å²	45	33%	0.332	23%	0.226	S	C	.	.			trans	-108.9	122.7	178.6	-172.4	-5.2	0	0	0	111.1	N200 N201 P202 T205	D198-N200 VanDerWaalsContact C-N 3.29Å; D198-N200 PolarHBondContact O-N 2.82Å; D198-N200 WeakPolarHBondContact OD1-CB 3.19Å; D198-N200 PolarHBondContact OD1-N 3.4Å; D198-N201 CarbonylContact O-C 3.55Å; D198-N201 PolarHBondContact O-N 3.26Å; D198-P202 WeakPolarHBondContact O-CA 3.33Å; D198-T205 HydrophobicContact CB-CG2 3.6Å; D198-T205 PolarHBondContact N-OG1 3.09Å; D198-T205 PolarHBondContact O-OG1 3.14Å
199	K	76.2	Confident	88.4	Confident	153 Å²	153	43 Å²	43	67%	0.665	22%	0.217	S	C	*	.	S	Bend	trans	-69.7	-27	178.1	-59.5	-173.8	-171.5	-170.5	0	112.8	N176	N176-K199 WeakPolarHBondContact OD1-CE 3.36Å; N176-K199 PolarHBondContact OD1-NZ 3.47Å
200	N	82.1	Confident	88.7	Confident	151 Å²	151	40.6 Å²	40.6	81%	0.807	20%	0.203	S	C	*	.	S	Bend	trans	-82.3	-25	-178.3	-61.5	-42	0	0	0	111.9	D198	D198-N200 VanDerWaalsContact C-N 3.29Å; D198-N200 PolarHBondContact O-N 2.82Å; D198-N200 WeakPolarHBondContact OD1-CB 3.19Å; D198-N200 PolarHBondContact OD1-N 3.4Å
201	N	83.1	Confident	88.8	Confident	55 Å²	55	42.1 Å²	42.1	29%	0.294	21%	0.209	S	C	.	.	S	Bend	trans	-138	67.9	-179.9	-164.2	-3.2	0	0	0	111.2	D198 E203 E204 T205	D198-N201 CarbonylContact O-C 3.55Å; D198-N201 PolarHBondContact O-N 3.26Å; N201-E203 VanDerWaalsContact C-N 3.33Å; N201-E203 PolarHBondContact O-N 3.06Å; N201-E204 PolarHBondContact ND2-OE2 3.29Å; N201-E204 WeakPolarHBondContact OD1-CG 3.21Å; N201-T205 PolarHBondContact O-N 2.93Å; N201-T205 PolarHBondContact O-OG1 3.27Å
202	P	83.1	Confident	88.7	Confident	41 Å²	41	42.7 Å²	42.7	27%	0.266	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-32.3	-168.1	25.7	-34.9	0	0	0	113.1	F167 S196 D198 T205 L206	F167-P202 HydrophobicContact CE2-CB 4.19Å; F167-P202 HydrophobicContact CZ-CB 3.89Å; F167-P202 HydrophobicContact CZ-CG 4Å; S196-P202 WeakPolarHBondContact CB-O 3.19Å; S196-P202 WeakPolarHBondContact OG-CA 3.23Å; S196-P202 VanDerWaalsContact OG-CB 3.32Å; S196-P202 WeakPolarHBondContact OG-CB 3.16Å; S196-P202 PolarHBondContact OG-O 2.92Å; D198-P202 WeakPolarHBondContact O-CA 3.33Å; P202-T205 PolarHBondContact O-N 3.43Å; P202-L206 WeakPolarHBondContact O-CG 3.22Å; P202-L206 PolarHBondContact O-N 3.4Å
203	E	81.1	Confident	88.1	Confident	85 Å²	85	45.8 Å²	45.8	40%	0.397	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-36.6	-177.1	-166.7	173.9	171.2	0	0	112.5	F167 N201 T205 K223	F167-E203 HydrophobicContact CD1-CG 4.41Å; F167-E203 HydrophobicContact CE1-CB 3.83Å; F167-E203 HydrophobicContact CE1-CG 4.04Å; F167-E203 HydrophobicContact CZ-CB 4.28Å; N201-E203 VanDerWaalsContact C-N 3.33Å; N201-E203 PolarHBondContact O-N 3.06Å; E203-T205 VanDerWaalsContact C-N 3.29Å; E203-K223 IonicContact OE1-NZ 2.67Å; E203-K223 PolarHBondContact OE1-NZ 2.82Å
204	E	82.5	Confident	87.5	Confident	132 Å²	132	51.5 Å²	51.5	62%	0.617	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.1	177.9	-65.7	-173	179.7	0	0	113.4	N201	N201-E204 PolarHBondContact ND2-OE2 3.29Å; N201-E204 WeakPolarHBondContact OD1-CG 3.21Å
205	T	86.6	Confident	87.2	Confident	32 Å²	32	56 Å²	56	20%	0.196	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	18.9	-179	63.4	0	0	0	0	113.2	S196 M197 D198 N201 P202 E203 T207	S196-T205 WeakPolarHBondContact CA-O 3.39Å; M197-T205 PolarHBondContact N-O 3.24Å; M197-T205 VanDerWaalsContact N-O 3.14Å; D198-T205 HydrophobicContact CB-CG2 3.6Å; D198-T205 PolarHBondContact N-OG1 3.09Å; D198-T205 PolarHBondContact O-OG1 3.14Å; N201-T205 PolarHBondContact O-N 2.93Å; N201-T205 PolarHBondContact O-OG1 3.27Å; P202-T205 PolarHBondContact O-N 3.43Å; E203-T205 VanDerWaalsContact C-N 3.29Å; T205-T207 PolarHBondContact O-N 2.84Å; T205-T207 PolarHBondContact O-OG1 3.1Å; T205-T207 VanDerWaalsContact O-OG1 3.09Å
206	L	92.3	Very high	87.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	129.2	172.3	-76.9	173.6	0	0	0	110.1	F167 Y173 W195 P202 I221 A247	F167-L206 HydrophobicContact CD1-CD1 4.41Å; F167-L206 HydrophobicContact CD2-CD1 4.4Å; F167-L206 HydrophobicContact CD2-CD2 3.68Å; F167-L206 HydrophobicContact CE2-CD2 3.9Å; F167-L206 HydrophobicContact CG-CD1 4.19Å; F167-L206 HydrophobicContact CG-CD2 4.28Å; Y173-L206 HydrophobicContact CD2-CD2 4.43Å; Y173-L206 HydrophobicContact CE2-CD2 4.12Å; W195-L206 CarbonylContact O-C 3.54Å; W195-L206 WeakPolarHBondContact O-CA 3.5Å; P202-L206 WeakPolarHBondContact O-CG 3.22Å; P202-L206 PolarHBondContact O-N 3.4Å; L206-I221 HydrophobicContact CB-CB 4.2Å; L206-I221 PolarHBondContact O-N 3.04Å; L206-A247 HydrophobicContact CD1-CB 4.2Å
207	T	93.1	Very high	87.4	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.1	-175.7	-58.7	0	0	0	0	108.5	I194 W195 M197 T205 H218 I219	I194-T207 WeakPolarHBondContact CA-O 3.46Å; W195-T207 HydrophobicContact CZ2-CG2 4.47Å; W195-T207 PolarHBondContact N-O 3.47Å; W195-T207 PolarHBondContact O-N 2.85Å; M197-T207 HydrophobicContact CE-CG2 3.71Å; M197-T207 WeakPolarHBondContact CE-OG1 3.39Å; M197-T207 WeakPolarHBondContact CG-OG1 3.24Å; T205-T207 PolarHBondContact O-N 2.84Å; T205-T207 PolarHBondContact O-OG1 3.1Å; T205-T207 VanDerWaalsContact O-OG1 3.09Å; T207-H218 HydrophobicContact CG2-CB 4.08Å; T207-I219 WeakPolarHBondContact CA-O 3.47Å
208	L	95.1	Very high	87.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.6	167.5	175.9	63.7	0	0	0	108.1	Y192 I194 I219 I221 L266	Y192-L208 HydrophobicContact CD2-CD1 3.88Å; Y192-L208 HydrophobicContact CG-CD1 4.33Å; I194-L208 HydrophobicContact CG2-CB 4.44Å; I194-L208 HydrophobicContact CG2-CD1 3.91Å; L208-I219 HydrophobicContact CB-CB 4.32Å; L208-I219 HydrophobicContact CD2-CD1 4.45Å; L208-I219 PolarHBondContact N-O 3.16Å; L208-I219 PolarHBondContact O-N 3.06Å; L208-I221 HydrophobicContact CB-CD1 3.63Å; L208-I221 HydrophobicContact CB-CG1 3.88Å; L208-L266 HydrophobicContact CD1-CD1 4.36Å; L208-L266 HydrophobicContact CD1-CD2 4.32Å; L208-L266 HydrophobicContact CD2-CD1 3.68Å; L208-L266 HydrophobicContact CD2-CD2 3.96Å; L208-L266 HydrophobicContact CD2-CG 4.41Å; L208-L266 HydrophobicContact CG-CD2 4.35Å
209	S	95.8	Very high	88.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.5	174.5	-55.4	0	0	0	0	109.2	Y192 L193 W195 E217 H218	Y192-S209 CarbonylContact C-O 3.54Å; Y192-S209 WeakPolarHBondContact CA-O 3.31Å; Y192-S209 WeakPolarHBondContact CB-O 3.46Å; L193-S209 PolarHBondContact N-O 3.21Å; L193-S209 PolarHBondContact O-N 3.13Å; W195-S209 PolarHBondContact NE1-OG 3.36Å; S209-E217 WeakPolarHBondContact CA-O 3.34Å; S209-H218 PolarHBondContact OG-ND1 2.91Å
210	V	95.5	Very high	89.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.7	-177.1	56.4	0	0	0	0	109.7	D191 I216 E217 V264 L266	D191-V210 VanDerWaalsContact O-CA 3.29Å; D191-V210 WeakPolarHBondContact O-CA 3.32Å; D191-V210 WeakPolarHBondContact O-CG2 3.31Å; V210-I216 CarbonylContact O-C 3.55Å; V210-I216 WeakPolarHBondContact O-CA 3.2Å; V210-E217 HydrophobicContact CG1-CB 4.05Å; V210-E217 PolarHBondContact N-O 3.01Å; V210-E217 PolarHBondContact O-N 2.83Å; V210-V264 HydrophobicContact CG1-CB 4.02Å; V210-V264 HydrophobicContact CG1-CG2 3.42Å; V210-V264 VanDerWaalsContact CG1-CG2 3.42Å; V210-L266 HydrophobicContact CB-CD2 3.92Å; V210-L266 HydrophobicContact CG1-CD2 4.27Å; V210-L266 HydrophobicContact CG2-CD2 3.91Å
211	R	93.5	Very high	89.5	Confident	32 Å²	32	38.8 Å²	38.8	12%	0.121	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	135.3	173	178.9	164.4	-170.8	126.1	7.5	110.9	G183 L186 L187 Q188 D189 G190 D191 N214 K215 I216	G183-R211 PolarHBondContact O-NH1 2.75Å; L186-R211 HydrophobicContact CB-CB 3.8Å; L186-R211 WeakPolarHBondContact O-CD 3.24Å; L186-R211 PolarHBondContact O-NH1 2.84Å; L187-R211 PolarHBondContact O-NE 3.37Å; Q188-R211 WeakPolarHBondContact O-CB 3.38Å; D189-R211 WeakPolarHBondContact CA-O 3.1Å; G190-R211 PolarHBondContact N-O 2.92Å; D191-R211 PolarHBondContact O-N 3.49Å; R211-N214 PolarHBondContact NH2-OD1 2.71Å; R211-K215 CarbonylContact C-O 3.6Å; R211-K215 WeakPolarHBondContact CA-O 3.34Å; R211-I216 HydrophobicContact CB-CD1 3.59Å; R211-I216 HydrophobicContact CG-CD1 3.91Å
212	W	90.8	Very high	89.9	Confident	13 Å²	13	42.5 Å²	42.5	5%	0.049	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	129.7	177.1	-158.3	-101.5	0	0	0	110.3	D189 N214 K215 G263 V264 Q265 S551 G554 I556	D189-W212 HydrophobicContact CB-CE3 4.16Å; D189-W212 HydrophobicContact CB-CZ3 4.39Å; D189-W212 WeakPolarHBondContact OD1-CA 3.02Å; W212-N214 VanDerWaalsContact C-N 3.3Å; W212-N214 PolarHBondContact O-N 3.17Å; W212-K215 PolarHBondContact N-O 3.36Å; W212-K215 WeakPolarHBondContact O-CA 3.44Å; W212-K215 WeakPolarHBondContact O-CB 3.45Å; W212-K215 PolarHBondContact O-N 3.48Å; W212-K215 VanDerWaalsContact O-O 3.09Å; W212-G263 PolarHBondContact NE1-O 2.97Å; W212-V264 HydrophobicContact CB-CB 4.19Å; W212-V264 HydrophobicContact CB-CG1 3.49Å; W212-V264 VanDerWaalsContact CB-CG1 3.49Å; W212-V264 HydrophobicContact CD2-CB 4.18Å; W212-V264 HydrophobicContact CD2-CG1 4.14Å; W212-V264 HydrophobicContact CE3-CB 4.4Å; W212-V264 HydrophobicContact CG-CB 4.1Å; W212-V264 HydrophobicContact CG-CG1 3.55Å; W212-Q265 HydrophobicContact CH2-CB 3.79Å; W212-Q265 HydrophobicContact CZ3-CB 3.77Å; W212-S551 VanDerWaalsContact CZ2-CB 3.49Å; W212-S551 WeakPolarHBondContact CZ2-OG 3.35Å; W212-G554 PolarHBondContact NE1-O 2.82Å; W212-I556 HydrophobicContact CH2-CD1 3.78Å; W212-I556 HydrophobicContact CH2-CG1 4.33Å; W212-I556 HydrophobicContact CZ2-CD1 3.72Å; W212-I556 HydrophobicContact CZ2-CG1 3.96Å
213	E	83.4	Confident	90.3	Very high	65 Å²	65	44.2 Å²	44.2	30%	0.304	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	44.2	179.7	-63.9	-165.4	105.5	0	0	114.2	D189 K215 K508 G554	D189-E213 PolarHBondContact OD1-N 3.01Å; D189-E213 VanDerWaalsContact OD1-N 3.09Å; D189-E213 PolarHBondContact OD2-N 3.01Å; E213-K215 PolarHBondContact O-N 2.84Å; E213-K508 IonicContact OE1-NZ 2.95Å; E213-K508 PolarHBondContact OE1-NZ 3.08Å; E213-K508 IonicContact OE2-NZ 3.83Å; E213-K508 PolarHBondContact OE2-NZ 2.76Å; E213-G554 WeakPolarHBondContact OE1-CA 3.45Å; E213-G554 PolarHBondContact OE1-N 3.08Å; E213-G554 VanDerWaalsContact OE1-N 3.14Å
214	N	82.1	Confident	90.8	Very high	121 Å²	121	42.4 Å²	42.4	65%	0.647	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	9.8	-174.6	-63.1	-46.7	0	0	0	115.7	R211 W212	R211-N214 PolarHBondContact NH2-OD1 2.71Å; W212-N214 VanDerWaalsContact C-N 3.3Å; W212-N214 PolarHBondContact O-N 3.17Å
215	K	89.4	Confident	91.1	Very high	95 Å²	95	45 Å²	45	41%	0.413	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	158.8	171.8	-63	176.5	-177	172.1	0	109.9	R211 W212 E213	R211-K215 CarbonylContact C-O 3.6Å; R211-K215 WeakPolarHBondContact CA-O 3.34Å; W212-K215 PolarHBondContact N-O 3.36Å; W212-K215 WeakPolarHBondContact O-CA 3.44Å; W212-K215 WeakPolarHBondContact O-CB 3.45Å; W212-K215 PolarHBondContact O-N 3.48Å; W212-K215 VanDerWaalsContact O-O 3.09Å; E213-K215 PolarHBondContact O-N 2.84Å
216	I	91.9	Very high	91.2	Very high	27 Å²	27	50 Å²	50	14%	0.138	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.2	170.3	-53.9	-56	0	0	0	108	C182 L186 V210 R211 H218	C182-I216 HydrophobicContact CB-CG2 4.35Å; L186-I216 HydrophobicContact CB-CD1 4.03Å; L186-I216 HydrophobicContact CD1-CD1 4.11Å; L186-I216 HydrophobicContact CD1-CG2 4.16Å; V210-I216 CarbonylContact O-C 3.55Å; V210-I216 WeakPolarHBondContact O-CA 3.2Å; R211-I216 HydrophobicContact CB-CD1 3.59Å; R211-I216 HydrophobicContact CG-CD1 3.91Å; I216-H218 VanDerWaalsContact CG2-CE1 3.45Å; I216-H218 WeakPolarHBondContact CG2-CE1 3.26Å
217	E	92.8	Very high	91.1	Very high	39 Å²	39	51.8 Å²	51.8	18%	0.182	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.4	173.7	-73.5	-58.8	145.1	0	0	110.3	S209 V210 V264 S291	S209-E217 WeakPolarHBondContact CA-O 3.34Å; V210-E217 HydrophobicContact CG1-CB 4.05Å; V210-E217 PolarHBondContact N-O 3.01Å; V210-E217 PolarHBondContact O-N 2.83Å; E217-V264 HydrophobicContact CB-CG1 4.03Å; E217-V264 HydrophobicContact CB-CG2 4.33Å; E217-V264 HydrophobicContact CG-CG1 3.68Å; E217-S291 PolarHBondContact OE1-OG 3.47Å
218	H	92.5	Very high	91	Very high	32 Å²	32	57.6 Å²	57.6	15%	0.148	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.9	-176.9	-62.2	-67.9	0	0	0	110.5	T207 S209 I216	T207-H218 HydrophobicContact CG2-CB 4.08Å; S209-H218 PolarHBondContact OG-ND1 2.91Å; I216-H218 VanDerWaalsContact CG2-CE1 3.45Å; I216-H218 WeakPolarHBondContact CG2-CE1 3.26Å
219	I	92.8	Very high	90.8	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.9	-176.1	-61.5	156.4	0	0	0	109	T207 L208 I221 L261 V264	T207-I219 WeakPolarHBondContact CA-O 3.47Å; L208-I219 HydrophobicContact CB-CB 4.32Å; L208-I219 HydrophobicContact CD2-CD1 4.45Å; L208-I219 PolarHBondContact N-O 3.16Å; L208-I219 PolarHBondContact O-N 3.06Å; I219-I221 PolarHBondContact O-N 3.44Å; I219-L261 HydrophobicContact CD1-CD2 4.04Å; I219-L261 HydrophobicContact CD1-CG 4.11Å; I219-L261 HydrophobicContact CG2-CD2 3.95Å; I219-V264 HydrophobicContact CD1-CG2 3.99Å
220	S	91.5	Very high	90.7	Very high	37 Å²	37	58.7 Å²	58.7	26%	0.259	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.6	176.3	-170	0	0	0	0	111.2	K222	S220-K222 WeakPolarHBondContact OG-CE 3.44Å
221	I	91.5	Very high	90.6	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.015	30%	0.296	C	S	.	.			trans	-98.6	109.5	177.6	-56.5	164.9	0	0	0	108.4	I194 L206 L208 I219 Y230 Y250 V251	I194-I221 HydrophobicContact CG2-CD1 3.89Å; L206-I221 HydrophobicContact CB-CB 4.2Å; L206-I221 PolarHBondContact O-N 3.04Å; L208-I221 HydrophobicContact CB-CD1 3.63Å; L208-I221 HydrophobicContact CB-CG1 3.88Å; I219-I221 PolarHBondContact O-N 3.44Å; I221-Y230 HydrophobicContact CG2-CD1 3.6Å; I221-Y230 HydrophobicContact CG2-CE1 3.5Å; I221-Y250 HydrophobicContact CG1-CE1 4.29Å; I221-Y250 HydrophobicContact CG2-CD1 3.86Å; I221-Y250 HydrophobicContact CG2-CE1 4.08Å; I221-V251 HydrophobicContact CD1-CG2 3.96Å
222	K	90.8	Very high	90.6	Very high	133 Å²	133	60 Å²	60	58%	0.578	29%	0.291	S	S	*	.			trans	-126.2	147	-178.8	-60.8	-174.3	-175.2	-178.8	0	111.4	S220 Y230	S220-K222 WeakPolarHBondContact OG-CE 3.44Å; K222-Y230 WeakPolarHBondContact O-CD1 3.37Å
223	K	91.2	Very high	90.6	Very high	77 Å²	77	61 Å²	61	34%	0.335	30%	0.3	S	S	.	.			trans	-73.7	144.1	168.2	-72.5	172.7	173.4	166.8	0	109.4	E203 R229 Y230	E203-K223 IonicContact OE1-NZ 2.67Å; E203-K223 PolarHBondContact OE1-NZ 2.82Å; K223-R229 CarbonylContact C-O 3.58Å; K223-R229 WeakPolarHBondContact CA-O 3.42Å; K223-Y230 HydrophobicContact CD-CE2 4.34Å; K223-Y230 HydrophobicContact CG-CD1 4.1Å; K223-Y230 HydrophobicContact CG-CD2 4.22Å; K223-Y230 HydrophobicContact CG-CE1 3.68Å; K223-Y230 HydrophobicContact CG-CE2 3.82Å; K223-Y230 HydrophobicContact CG-CG 4.35Å
224	D	92.7	Very high	90.8	Very high	47 Å²	47	61.9 Å²	61.9	25%	0.251	30%	0.302	S	S	.	.			trans	-60.5	137.7	164.7	176	-104	0	0	0	110.3	N226 L227 L228 R229 I231	D224-N226 VanDerWaalsContact C-N 3.29Å; D224-N226 PolarHBondContact O-N 2.9Å; D224-N226 WeakPolarHBondContact OD1-CA 3.44Å; D224-N226 WeakPolarHBondContact OD1-CB 3.09Å; D224-N226 PolarHBondContact OD1-N 3.11Å; D224-L227 HydrophobicContact CB-CB 4.42Å; D224-L227 PolarHBondContact OD1-N 2.89Å; D224-L228 VanDerWaalsContact O-CA 3.24Å; D224-L228 WeakPolarHBondContact O-CA 3.07Å; D224-L228 PolarHBondContact O-N 2.85Å; D224-R229 PolarHBondContact N-O 3.31Å; D224-I231 HydrophobicContact CB-CD1 3.77Å; D224-I231 HydrophobicContact CB-CG1 3.72Å
225	K	88.7	Confident	90.7	Very high	188 Å²	188	62.3 Å²	62.3	82%	0.817	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-29.6	-174.4	-66.6	-177.1	-179	178.5	0	112.4
226	N	88.8	Confident	90.2	Very high	136 Å²	136	60.1 Å²	60.1	73%	0.727	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-46.5	-175	-60.5	-30.5	0	0	0	111	D224	D224-N226 VanDerWaalsContact C-N 3.29Å; D224-N226 PolarHBondContact O-N 2.9Å; D224-N226 WeakPolarHBondContact OD1-CA 3.44Å; D224-N226 WeakPolarHBondContact OD1-CB 3.09Å; D224-N226 PolarHBondContact OD1-N 3.11Å
227	L	89.2	Confident	89.4	Confident	38 Å²	38	63.4 Å²	63.4	20%	0.199	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-17	-176.5	-62.3	-176.1	0	0	0	113.6	D224 R229 I231	D224-L227 HydrophobicContact CB-CB 4.42Å; D224-L227 PolarHBondContact OD1-N 2.89Å; L227-R229 HydrophobicContact CB-CB 4.37Å; L227-R229 WeakPolarHBondContact O-CG 3.27Å; L227-R229 PolarHBondContact O-N 2.65Å; L227-I231 HydrophobicContact CD1-CD1 3.88Å
228	L	90.5	Very high	88.6	Confident	123 Å²	123	67.1 Å²	67.1	64%	0.644	35%	0.345	S	S	*	.	S	Bend	trans	54.2	33.4	-173.6	-57.5	176.4	0	0	0	112.7	D224	D224-L228 VanDerWaalsContact O-CA 3.24Å; D224-L228 WeakPolarHBondContact O-CA 3.07Å; D224-L228 PolarHBondContact O-N 2.85Å
229	R	92.3	Very high	88.1	Confident	17 Å²	17	67 Å²	67	6%	0.064	34%	0.344	C	S	.	.	S	Bend	trans	-134.7	160.9	-177	-72.1	-179.2	-119.1	157.8	2.3	110.3	K223 D224 L227 S243 V244 A395 G396 Y397 T410	K223-R229 CarbonylContact C-O 3.58Å; K223-R229 WeakPolarHBondContact CA-O 3.42Å; D224-R229 PolarHBondContact N-O 3.31Å; L227-R229 HydrophobicContact CB-CB 4.37Å; L227-R229 WeakPolarHBondContact O-CG 3.27Å; L227-R229 PolarHBondContact O-N 2.65Å; R229-S243 PolarHBondContact NH1-OG 3.36Å; R229-V244 WeakPolarHBondContact CB-O 3.32Å; R229-A395 PolarHBondContact NH1-O 2.86Å; R229-A395 PolarHBondContact NH2-O 2.86Å; R229-G396 PolarHBondContact NH1-O 3.01Å; R229-Y397 VanDerWaalsContact CZ-CE1 3.48Å; R229-Y397 VanDerWaalsContact NH2-CE1 3.31Å; R229-Y397 PolarHBondContact NH2-OH 2.86Å; R229-Y397 VanDerWaalsContact NH2-OH 3.11Å; R229-T410 VanDerWaalsContact NH1-CG2 3.25Å
230	Y	93.1	Very high	87.7	Confident	6 Å²	6	68.2 Å²	68.2	2%	0.024	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	124.2	175	-57	-83	0	0	0	109.1	I221 K222 K223 S243 V244 K246 A247 Y250	I221-Y230 HydrophobicContact CG2-CD1 3.6Å; I221-Y230 HydrophobicContact CG2-CE1 3.5Å; K222-Y230 WeakPolarHBondContact O-CD1 3.37Å; K223-Y230 HydrophobicContact CD-CE2 4.34Å; K223-Y230 HydrophobicContact CG-CD1 4.1Å; K223-Y230 HydrophobicContact CG-CD2 4.22Å; K223-Y230 HydrophobicContact CG-CE1 3.68Å; K223-Y230 HydrophobicContact CG-CE2 3.82Å; K223-Y230 HydrophobicContact CG-CG 4.35Å; Y230-S243 CarbonylContact O-C 3.58Å; Y230-S243 WeakPolarHBondContact O-CA 3.49Å; Y230-S243 WeakPolarHBondContact O-CB 3.49Å; Y230-V244 PolarHBondContact N-O 3.46Å; Y230-V244 PolarHBondContact O-N 3.29Å; Y230-K246 VanDerWaalsContact CE2-C 3.43Å; Y230-A247 HydrophobicContact CE1-CB 4.48Å; Y230-A247 HydrophobicContact CE2-CB 4.09Å; Y230-Y250 HydrophobicContact CG-CG 4.41Å
231	I	94	Very high	87.7	Confident	55 Å²	55	68.3 Å²	68.3	28%	0.282	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.3	-179	-54.7	-56.3	0	0	0	109	D224 L227 T241 Y250	D224-I231 HydrophobicContact CB-CD1 3.77Å; D224-I231 HydrophobicContact CB-CG1 3.72Å; L227-I231 HydrophobicContact CD1-CD1 3.88Å; I231-T241 HydrophobicContact CD1-CG2 3.99Å; I231-T241 HydrophobicContact CG2-CG2 3.87Å; I231-Y250 VanDerWaalsContact O-CE2 3.26Å; I231-Y250 WeakPolarHBondContact O-CE2 3.46Å
232	L	93.2	Very high	87.8	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.026	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-75.6	147.4	173.4	-69.6	178.6	0	0	0	110.1	E242 V244 Y250 P334	L232-E242 HydrophobicContact CB-CB 4.23Å; L232-E242 HydrophobicContact CD1-CB 4.15Å; L232-E242 PolarHBondContact N-O 3.16Å; L232-V244 HydrophobicContact CD1-CG1 4.07Å; L232-V244 HydrophobicContact CD2-CG1 4.32Å; L232-V244 HydrophobicContact CD2-CG2 4.35Å; L232-V244 HydrophobicContact CG-CG1 4.27Å; L232-Y250 HydrophobicContact CD2-CD2 4.17Å; L232-P334 HydrophobicContact CB-CG 4.22Å; L232-P334 HydrophobicContact CD1-CG 4.36Å
233	P	90.7	Very high	88	Confident	35 Å²	35	62.2 Å²	62.2	23%	0.227	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-62.7	148.9	177.2	27.3	-35	0	0	0	111	L254 V259 P334 H336	P233-L254 HydrophobicContact CG-CD2 3.76Å; P233-V259 HydrophobicContact CB-CG1 4.35Å; P233-V259 HydrophobicContact CG-CG1 3.85Å; P233-V259 HydrophobicContact CG-CG2 3.95Å; P233-P334 HydrophobicContact CG-CG 4.21Å; P233-H336 PolarHBondContact O-CE1 3.44Å
234	K	87.7	Confident	88	Confident	82 Å²	82	58.9 Å²	58.9	36%	0.357	31%	0.31	S	S	.	.			trans	-132.2	139.2	175.6	60.1	-179.4	173.4	175.9	0	110.8	N236 P237 R239 T241	K234-N236 WeakPolarHBondContact CD-O 3.34Å; K234-P237 PolarHBondContact NZ-O 2.79Å; K234-R239 PolarHBondContact NZ-O 3.1Å; K234-T241 PolarHBondContact NZ-OG1 2.78Å
235	E	80.1	Confident	87.8	Confident	131 Å²	131	59 Å²	59	61%	0.612	32%	0.318	S	S	*	.	S	Bend	trans	-67.2	-34.3	178.9	-173.5	-175.3	-174.4	0	0	112.9	R239 H336	E235-R239 IonicContact OE2-CZ 3.11Å; E235-R239 IonicContact OE2-NH1 2.65Å; E235-R239 PolarHBondContact OE2-NH1 3.45Å; E235-R239 IonicContact OE2-NH2 2.78Å; E235-R239 PolarHBondContact OE2-NH2 2.94Å; E235-H336 HydrophobicContact CB-CB 4.15Å
236	N	77.7	Confident	87.9	Confident	48 Å²	48	52.5 Å²	52.5	26%	0.257	29%	0.289	S	S	.	.	S	Bend	trans	-132.8	132.4	-178	176	-28.7	0	0	0	109.5	K234 C238 R239	K234-N236 WeakPolarHBondContact CD-O 3.34Å; N236-C238 PolarHBondContact O-N 3.45Å; N236-C238 WeakPolarHBondContact OD1-CB 3.45Å; N236-C238 PolarHBondContact OD1-N 2.89Å; N236-R239 HydrophobicContact CB-CG 4.08Å; N236-R239 WeakPolarHBondContact O-CB 3.48Å; N236-R239 PolarHBondContact O-N 2.68Å
237	P	75.8	Confident	88	Confident	97 Å²	97	46.3 Å²	46.3	63%	0.63	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.2	-178.6	23.5	-34.8	0	0	0	114.1	K234 R239	K234-P237 PolarHBondContact NZ-O 2.79Å; P237-R239 PolarHBondContact O-N 3.09Å
238	C	75.6	Confident	88.2	Confident	116 Å²	116	44.7 Å²	44.7	78%	0.784	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-6.2	177.8	-60.3	0	0	0	0	113.8	N236	N236-C238 PolarHBondContact O-N 3.45Å; N236-C238 WeakPolarHBondContact OD1-CB 3.45Å; N236-C238 PolarHBondContact OD1-N 2.89Å
239	R	82	Confident	88.3	Confident	31 Å²	31	39.6 Å²	39.6	12%	0.117	22%	0.223	C	C	.	.	S	Bend	trans	-78.9	154.6	176.4	-67	-172.2	-173.3	167.5	12.3	111.8	K234 E235 N236 P237	K234-R239 PolarHBondContact NZ-O 3.1Å; E235-R239 IonicContact OE2-CZ 3.11Å; E235-R239 IonicContact OE2-NH1 2.65Å; E235-R239 PolarHBondContact OE2-NH1 3.45Å; E235-R239 IonicContact OE2-NH2 2.78Å; E235-R239 PolarHBondContact OE2-NH2 2.94Å; N236-R239 HydrophobicContact CB-CG 4.08Å; N236-R239 WeakPolarHBondContact O-CB 3.48Å; N236-R239 PolarHBondContact O-N 2.68Å; P237-R239 PolarHBondContact O-N 3.09Å
240	P	85.7	Confident	88.3	Confident	28 Å²	28	40.1 Å²	40.1	18%	0.182	23%	0.226	C	C	.	.			trans	-53.5	144.7	178.3	-24.1	33.1	0	0	0	112.5	E242 L335 A371 E392 F398	P240-E242 PolarHBondContact O-N 2.93Å; P240-L335 HydrophobicContact CG-CD2 4.47Å; P240-A371 HydrophobicContact CG-CB 4.26Å; P240-E392 WeakPolarHBondContact CB-OE2 3.43Å; P240-F398 HydrophobicContact CB-CE1 3.61Å; P240-F398 HydrophobicContact CB-CZ 3.86Å; P240-F398 HydrophobicContact CG-CE1 4.47Å
241	T	90.7	Very high	88.4	Confident	38 Å²	38	39.9 Å²	39.9	23%	0.233	23%	0.225	C	C	.	.			trans	-88.4	102.8	-178.2	-64.8	0	0	0	0	109.5	I231 K234	I231-T241 HydrophobicContact CD1-CG2 3.99Å; I231-T241 HydrophobicContact CG2-CG2 3.87Å; K234-T241 PolarHBondContact NZ-OG1 2.78Å
242	E	93.7	Very high	88.4	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.037	21%	0.212	C	C	.	.			trans	-88.4	148.6	178.4	-64.6	179.3	110.9	0	0	111.6	L232 P240 L335 F398 N411 V412	L232-E242 HydrophobicContact CB-CB 4.23Å; L232-E242 HydrophobicContact CD1-CB 4.15Å; L232-E242 PolarHBondContact N-O 3.16Å; P240-E242 PolarHBondContact O-N 2.93Å; E242-L335 VanDerWaalsContact OE2-CB 3.24Å; E242-L335 WeakPolarHBondContact OE2-CB 3.13Å; E242-L335 PolarHBondContact OE2-N 3.14Å; E242-F398 HydrophobicContact CG-CE2 4.15Å; E242-F398 HydrophobicContact CG-CZ 3.95Å; E242-N411 HydrophobicContact CB-CB 4.01Å; E242-N411 HydrophobicContact CG-CB 4.11Å; E242-N411 WeakPolarHBondContact OE1-CA 3.27Å; E242-N411 WeakPolarHBondContact OE1-CB 3.39Å; E242-V412 PolarHBondContact OE1-N 2.83Å
243	S	94.3	Very high	88.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	164.1	-176.8	62.1	0	0	0	0	112.7	R229 Y230 T410	R229-S243 PolarHBondContact NH1-OG 3.36Å; Y230-S243 CarbonylContact O-C 3.58Å; Y230-S243 WeakPolarHBondContact O-CA 3.49Å; Y230-S243 WeakPolarHBondContact O-CB 3.49Å; S243-T410 PolarHBondContact N-O 3.21Å; S243-T410 WeakPolarHBondContact O-CB 3.38Å; S243-T410 PolarHBondContact O-OG1 3.13Å
244	V	92.5	Very high	88.7	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.7	175.3	-64.7	0	0	0	0	111.1	R229 Y230 L232 C249	R229-V244 WeakPolarHBondContact CB-O 3.32Å; Y230-V244 PolarHBondContact N-O 3.46Å; Y230-V244 PolarHBondContact O-N 3.29Å; L232-V244 HydrophobicContact CD1-CG1 4.07Å; L232-V244 HydrophobicContact CD2-CG1 4.32Å; L232-V244 HydrophobicContact CD2-CG2 4.35Å; L232-V244 HydrophobicContact CG-CG1 4.27Å; V244-C249 HydrophobicContact CB-CB 3.85Å; V244-C249 HydrophobicContact CG1-CB 4.26Å; V244-C249 HydrophobicContact CG2-CB 4.02Å
245	A	88.2	Confident	88.9	Confident	50 Å²	50	32.4 Å²	32.4	41%	0.413	19%	0.187	S	C	.	.	S	Bend	trans	-82.5	-28.5	-170.4	0	0	0	0	0	114.6
246	K	90.3	Very high	89.4	Confident	51 Å²	51	27 Å²	27	22%	0.222	16%	0.162	C	C	.	.	S	Bend	trans	-115.5	148.5	-175.2	-63.5	-175.5	176.5	-173.7	0	111	V164 Y230 D248 C249 Y250	V164-K246 PolarHBondContact O-NZ 3.3Å; Y230-K246 VanDerWaalsContact CE2-C 3.43Å; K246-D248 VanDerWaalsContact C-N 3.27Å; K246-D248 PolarHBondContact O-N 3.27Å; K246-C249 HydrophobicContact CB-CB 4.45Å; K246-C249 PolarHBondContact O-N 2.85Å; K246-Y250 PolarHBondContact O-N 2.8Å; K246-Y250 VanDerWaalsContact O-N 3.14Å
247	A	91.2	Very high	89.9	Confident	6 Å²	6	25.1 Å²	25.1	5%	0.05	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-39.2	176.7	0	0	0	0	0	111.7	L206 Y230 Y250 V251	L206-A247 HydrophobicContact CD1-CB 4.2Å; Y230-A247 HydrophobicContact CE1-CB 4.48Å; Y230-A247 HydrophobicContact CE2-CB 4.09Å; A247-Y250 WeakPolarHBondContact O-CA 3.44Å; A247-Y250 VanDerWaalsContact O-CB 3.32Å; A247-Y250 WeakPolarHBondContact O-CB 3.04Å; A247-Y250 PolarHBondContact O-N 2.98Å; A247-Y250 VanDerWaalsContact O-N 3.09Å; A247-V251 WeakPolarHBondContact O-CG2 2.95Å; A247-V251 PolarHBondContact O-N 3.09Å
248	D	92.9	Very high	90.5	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.027	14%	0.135	C	C	.	.	H	α-helix	trans	-62.9	-45.1	177.2	-175.5	45.7	0	0	0	112.6	V161 E162 L170 Y172 K246 Y250 V251 K252	V161-D248 WeakPolarHBondContact CA-OD2 3.31Å; V161-D248 WeakPolarHBondContact CG1-OD2 3.17Å; E162-D248 PolarHBondContact N-OD2 3.39Å; L170-D248 HydrophobicContact CD1-CB 3.91Å; L170-D248 HydrophobicContact CD2-CB 3.56Å; L170-D248 VanDerWaalsContact CD2-CG 3.49Å; L170-D248 HydrophobicContact CG-CB 4.4Å; Y172-D248 WeakPolarHBondContact CE1-OD1 3.03Å; Y172-D248 WeakPolarHBondContact OH-CA 3.41Å; Y172-D248 PolarHBondContact OH-OD1 2.82Å; K246-D248 VanDerWaalsContact C-N 3.27Å; K246-D248 PolarHBondContact O-N 3.27Å; D248-Y250 PolarHBondContact O-N 3.44Å; D248-V251 PolarHBondContact O-N 2.99Å; D248-K252 VanDerWaalsContact O-CB 3.31Å; D248-K252 WeakPolarHBondContact O-CB 3.38Å; D248-K252 VanDerWaalsContact O-CG 3.26Å; D248-K252 WeakPolarHBondContact O-CG 3.42Å; D248-K252 PolarHBondContact O-N 3.05Å; D248-K252 WeakPolarHBondContact OD1-CG 3.45Å
249	C	92.4	Very high	91.3	Very high	16 Å²	16	18.5 Å²	18.5	11%	0.108	10%	0.102	C	C	.	.	H	α-helix	trans	-57.4	-38.5	173	-58.1	0	0	0	0	111.1	V244 K246 S253	V244-C249 HydrophobicContact CB-CB 3.85Å; V244-C249 HydrophobicContact CG1-CB 4.26Å; V244-C249 HydrophobicContact CG2-CB 4.02Å; K246-C249 HydrophobicContact CB-CB 4.45Å; K246-C249 PolarHBondContact O-N 2.85Å; C249-S253 WeakPolarHBondContact O-CB 3.36Å; C249-S253 PolarHBondContact O-N 3.36Å; C249-S253 PolarHBondContact O-OG 2.73Å
250	Y	93.6	Very high	91.6	Very high	28 Å²	28	19 Å²	19	11%	0.11	11%	0.106	C	C	.	.	H	α-helix	trans	-63.8	-56.5	177	173	-102	0	0	0	111.1	I221 Y230 I231 L232 K246 A247 D248 K252 S253 L254	I221-Y250 HydrophobicContact CG1-CE1 4.29Å; I221-Y250 HydrophobicContact CG2-CD1 3.86Å; I221-Y250 HydrophobicContact CG2-CE1 4.08Å; Y230-Y250 HydrophobicContact CG-CG 4.41Å; I231-Y250 VanDerWaalsContact O-CE2 3.26Å; I231-Y250 WeakPolarHBondContact O-CE2 3.46Å; L232-Y250 HydrophobicContact CD2-CD2 4.17Å; K246-Y250 PolarHBondContact O-N 2.8Å; K246-Y250 VanDerWaalsContact O-N 3.14Å; A247-Y250 WeakPolarHBondContact O-CA 3.44Å; A247-Y250 VanDerWaalsContact O-CB 3.32Å; A247-Y250 WeakPolarHBondContact O-CB 3.04Å; A247-Y250 PolarHBondContact O-N 2.98Å; A247-Y250 VanDerWaalsContact O-N 3.09Å; D248-Y250 PolarHBondContact O-N 3.44Å; Y250-K252 PolarHBondContact O-N 2.9Å; Y250-S253 WeakPolarHBondContact O-CB 3.3Å; Y250-S253 PolarHBondContact O-N 2.86Å; Y250-S253 VanDerWaalsContact O-N 3.13Å; Y250-L254 HydrophobicContact CD1-CD1 4.3Å; Y250-L254 HydrophobicContact CE1-CD1 3.69Å; Y250-L254 HydrophobicContact CE1-CG 4.44Å; Y250-L254 HydrophobicContact CE2-CD1 4.46Å; Y250-L254 HydrophobicContact CE2-CD2 4.3Å; Y250-L254 WeakPolarHBondContact O-CG 2.96Å; Y250-L254 PolarHBondContact O-N 3.31Å; Y250-L254 VanDerWaalsContact O-N 3.1Å
251	V	95	Very high	91.8	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.6	-49.2	-178.6	175.4	0	0	0	0	111.3	Y172 Y192 I194 I221 A247 D248 S253 L254 V255 L266	Y172-V251 HydrophobicContact CE2-CG1 4.11Å; Y192-V251 HydrophobicContact CD2-CG1 4.1Å; Y192-V251 HydrophobicContact CE2-CG1 3.52Å; I194-V251 HydrophobicContact CG2-CG2 4.26Å; I221-V251 HydrophobicContact CD1-CG2 3.96Å; A247-V251 WeakPolarHBondContact O-CG2 2.95Å; A247-V251 PolarHBondContact O-N 3.09Å; D248-V251 PolarHBondContact O-N 2.99Å; V251-S253 VanDerWaalsContact C-N 3.27Å; V251-S253 PolarHBondContact O-N 3.08Å; V251-L254 WeakPolarHBondContact O-CB 3.22Å; V251-L254 PolarHBondContact O-N 2.86Å; V251-L254 VanDerWaalsContact O-N 3.08Å; V251-V255 WeakPolarHBondContact O-CG2 3.47Å; V251-V255 PolarHBondContact O-N 2.99Å; V251-V255 VanDerWaalsContact O-N 3.08Å; V251-L266 HydrophobicContact CG1-CD1 4.2Å
252	K	94	Very high	91.5	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-66.5	-27.7	179.6	-61.5	-70.5	-177.3	175.4	0	112.5	K157 E158 M160 D248 Y250 H256 A331	K157-K252 PolarHBondContact O-NZ 3.34Å; K157-K252 VanDerWaalsContact O-NZ 3.13Å; E158-K252 WeakPolarHBondContact O-CD 3.07Å; E158-K252 PolarHBondContact O-NZ 3.48Å; M160-K252 WeakPolarHBondContact O-CD 3.27Å; M160-K252 VanDerWaalsContact O-CE 3.31Å; M160-K252 WeakPolarHBondContact O-CE 3.44Å; D248-K252 VanDerWaalsContact O-CB 3.31Å; D248-K252 WeakPolarHBondContact O-CB 3.38Å; D248-K252 VanDerWaalsContact O-CG 3.26Å; D248-K252 WeakPolarHBondContact O-CG 3.42Å; D248-K252 PolarHBondContact O-N 3.05Å; D248-K252 WeakPolarHBondContact OD1-CG 3.45Å; Y250-K252 PolarHBondContact O-N 2.9Å; K252-H256 WeakPolarHBondContact O-CB 3.32Å; K252-H256 PolarHBondContact O-N 3.41Å; K252-A331 VanDerWaalsContact C-CB 3.42Å; K252-A331 HydrophobicContact CB-CB 3.43Å; K252-A331 VanDerWaalsContact CB-CB 3.43Å
253	S	93.7	Very high	91.1	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.007	12%	0.115	C	C	.	.	H	α-helix	trans	-68.2	-38	171.9	-61.1	0	0	0	0	111.7	C249 Y250 V251 G257 R332	C249-S253 WeakPolarHBondContact O-CB 3.36Å; C249-S253 PolarHBondContact O-N 3.36Å; C249-S253 PolarHBondContact O-OG 2.73Å; Y250-S253 WeakPolarHBondContact O-CB 3.3Å; Y250-S253 PolarHBondContact O-N 2.86Å; Y250-S253 VanDerWaalsContact O-N 3.13Å; V251-S253 VanDerWaalsContact C-N 3.27Å; V251-S253 PolarHBondContact O-N 3.08Å; S253-G257 PolarHBondContact O-N 2.88Å; S253-R332 WeakPolarHBondContact CA-O 3.31Å; S253-R332 WeakPolarHBondContact CB-O 3.03Å; S253-R332 PolarHBondContact OG-O 3.28Å
254	L	94.8	Very high	91	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-63.5	-45.4	174.4	-58.8	-179.4	0	0	0	111.2	P233 Y250 V251 R258 V259 L261 L266	P233-L254 HydrophobicContact CG-CD2 3.76Å; Y250-L254 HydrophobicContact CD1-CD1 4.3Å; Y250-L254 HydrophobicContact CE1-CD1 3.69Å; Y250-L254 HydrophobicContact CE1-CG 4.44Å; Y250-L254 HydrophobicContact CE2-CD1 4.46Å; Y250-L254 HydrophobicContact CE2-CD2 4.3Å; Y250-L254 WeakPolarHBondContact O-CG 2.96Å; Y250-L254 PolarHBondContact O-N 3.31Å; Y250-L254 VanDerWaalsContact O-N 3.1Å; V251-L254 WeakPolarHBondContact O-CB 3.22Å; V251-L254 PolarHBondContact O-N 2.86Å; V251-L254 VanDerWaalsContact O-N 3.08Å; L254-R258 PolarHBondContact O-N 2.94Å; L254-V259 HydrophobicContact CB-CB 4.28Å; L254-V259 HydrophobicContact CD2-CB 4.01Å; L254-V259 HydrophobicContact CD2-CG1 4.04Å; L254-V259 HydrophobicContact CD2-CG2 4.02Å; L254-V259 PolarHBondContact O-N 2.73Å; L254-L261 HydrophobicContact CD1-CD2 3.83Å; L254-L266 HydrophobicContact CB-CD1 3.91Å; L254-L266 HydrophobicContact CD1-CD1 3.96Å
255	V	93.4	Very high	91	Very high	13 Å²	13	20.6 Å²	20.6	8%	0.079	11%	0.114	C	C	.	.	H	α-helix	trans	-63	-48.7	176.6	179.4	0	0	0	0	110.7	E158 Y192 V251 G257 R258 L266	E158-V255 HydrophobicContact CB-CG1 4.09Å; E158-V255 VanDerWaalsContact O-CG1 3.31Å; E158-V255 WeakPolarHBondContact O-CG1 3.06Å; Y192-V255 HydrophobicContact CE1-CG2 3.73Å; V251-V255 WeakPolarHBondContact O-CG2 3.47Å; V251-V255 PolarHBondContact O-N 2.99Å; V251-V255 VanDerWaalsContact O-N 3.08Å; V255-G257 VanDerWaalsContact C-N 3.31Å; V255-G257 PolarHBondContact O-N 3.08Å; V255-R258 PolarHBondContact O-N 2.85Å; V255-L266 HydrophobicContact CG2-CB 3.59Å; V255-L266 HydrophobicContact CG2-CD1 4.24Å
256	H	90.2	Very high	91.3	Very high	17 Å²	17	18.5 Å²	18.5	8%	0.079	10%	0.095	C	C	.	.	H	α-helix	trans	-62.9	-37.9	-178.2	-170.8	-158.8	0	0	0	112.8	F159 K252 R258 K330 A331 R333	F159-H256 HydrophobicContact CB-CB 3.57Å; F159-H256 HydrophobicContact CG-CB 4.49Å; K252-H256 WeakPolarHBondContact O-CB 3.32Å; K252-H256 PolarHBondContact O-N 3.41Å; H256-R258 VanDerWaalsContact C-N 3.28Å; H256-K330 WeakPolarHBondContact CE1-CE 3.44Å; H256-K330 WeakPolarHBondContact NE2-CE 3.39Å; H256-A331 PolarHBondContact CE1-O 3.44Å; H256-A331 PolarHBondContact ND1-O 2.82Å; H256-R333 PolarHBondContact CD2-NE 3.13Å; H256-R333 PolarHBondContact CD2-NH2 3.44Å; H256-R333 PolarHBondContact CE1-NE 3.03Å; H256-R333 VanDerWaalsContact CE1-NE 3.29Å; H256-R333 WeakPolarHBondContact ND1-CG 3.2Å; H256-R333 PolarHBondContact NE2-NE 3.44Å; H256-R333 PolarHBondContact NE2-NH2 3.27Å; H256-R333 VanDerWaalsContact NE2-NH2 3.1Å; H256-R333 PolarHBondContact O-NE 3.45Å
257	G	88.4	Confident	91.2	Very high	9 Å²	9	17.3 Å²	17.3	9%	0.093	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.7	174.9	0	0	0	0	0	114	S253 V255 V259	S253-G257 PolarHBondContact O-N 2.88Å; V255-G257 VanDerWaalsContact C-N 3.31Å; V255-G257 PolarHBondContact O-N 3.08Å; G257-V259 PolarHBondContact O-N 3.19Å
258	R	88.9	Confident	91.3	Very high	61 Å²	61	21 Å²	21	23%	0.23	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	39.3	-169.7	-68.9	-165	-178.6	-164	1.7	112.4	L254 V255 H256 I260 Q265 N548 Q549	L254-R258 PolarHBondContact O-N 2.94Å; V255-R258 PolarHBondContact O-N 2.85Å; H256-R258 VanDerWaalsContact C-N 3.28Å; R258-I260 PolarHBondContact O-N 2.8Å; R258-Q265 PolarHBondContact O-NE2 2.55Å; R258-Q265 VanDerWaalsContact O-NE2 3.09Å; R258-N548 PolarHBondContact NH1-O 3.41Å; R258-Q549 PolarHBondContact O-OE1 2.94Å
259	V	91.1	Very high	91.3	Very high	14 Å²	14	21.5 Å²	21.5	9%	0.085	11%	0.108	C	C	.	.			trans	-63.8	133.1	-176.4	177	0	0	0	0	110.2	P233 L254 G257 L337	P233-V259 HydrophobicContact CB-CG1 4.35Å; P233-V259 HydrophobicContact CG-CG1 3.85Å; P233-V259 HydrophobicContact CG-CG2 3.95Å; L254-V259 HydrophobicContact CB-CB 4.28Å; L254-V259 HydrophobicContact CD2-CB 4.01Å; L254-V259 HydrophobicContact CD2-CG1 4.04Å; L254-V259 HydrophobicContact CD2-CG2 4.02Å; L254-V259 PolarHBondContact O-N 2.73Å; G257-V259 PolarHBondContact O-N 3.19Å; V259-L337 HydrophobicContact CG2-CD1 3.57Å
260	I	89.5	Confident	91.3	Very high	40 Å²	40	21.1 Å²	21.1	21%	0.205	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.7	166.5	-51	-45.3	0	0	0	108.1	R258 V264 Q265 W503 I556	R258-I260 PolarHBondContact O-N 2.8Å; I260-V264 WeakPolarHBondContact CA-O 2.86Å; I260-Q265 HydrophobicContact CD1-CB 3.73Å; I260-Q265 HydrophobicContact CD1-CG 3.9Å; I260-W503 HydrophobicContact CB-CH2 4.48Å; I260-W503 HydrophobicContact CG1-CH2 4.27Å; I260-W503 HydrophobicContact CG2-CH2 3.59Å; I260-W503 HydrophobicContact CG2-CZ2 3.82Å; I260-I556 HydrophobicContact CD1-CD1 3.25Å; I260-I556 HydrophobicContact CG1-CD1 4.12Å
261	L	88.7	Confident	91.1	Very high	34 Å²	34	20.6 Å²	20.6	18%	0.178	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.2	-179.7	-175.1	61	0	0	0	108	I219 L254 G263 V264	I219-L261 HydrophobicContact CD1-CD2 4.04Å; I219-L261 HydrophobicContact CD1-CG 4.11Å; I219-L261 HydrophobicContact CG2-CD2 3.95Å; L254-L261 HydrophobicContact CD1-CD2 3.83Å; L261-G263 PolarHBondContact O-N 3.11Å; L261-V264 PolarHBondContact N-O 2.78Å; L261-V264 WeakPolarHBondContact O-CG2 3.44Å; L261-V264 PolarHBondContact O-N 3.05Å; L261-V264 VanDerWaalsContact O-N 3.08Å
262	N	85.2	Confident	90.1	Very high	69 Å²	69	25.6 Å²	25.6	37%	0.369	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	34.9	-175.1	-62.8	-0.9	0	0	0	113.8	V264 Q504	N262-V264 VanDerWaalsContact C-N 3.28Å; N262-V264 PolarHBondContact O-N 3.18Å; N262-Q504 PolarHBondContact O-NE2 3.12Å
263	G	85.8	Confident	88.6	Confident	8 Å²	8	29.2 Å²	29.2	8%	0.082	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	10.1	-179.8	0	0	0	0	0	115.5	W212 L261 W503	W212-G263 PolarHBondContact NE1-O 2.97Å; L261-G263 PolarHBondContact O-N 3.11Å; G263-W503 WeakPolarHBondContact O-CZ2 3.11Å
264	V	91	Very high	87	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	154.9	174.7	-57.7	0	0	0	0	111.3	V210 W212 E217 I219 I260 L261 N262	V210-V264 HydrophobicContact CG1-CB 4.02Å; V210-V264 HydrophobicContact CG1-CG2 3.42Å; V210-V264 VanDerWaalsContact CG1-CG2 3.42Å; W212-V264 HydrophobicContact CB-CB 4.19Å; W212-V264 HydrophobicContact CB-CG1 3.49Å; W212-V264 VanDerWaalsContact CB-CG1 3.49Å; W212-V264 HydrophobicContact CD2-CB 4.18Å; W212-V264 HydrophobicContact CD2-CG1 4.14Å; W212-V264 HydrophobicContact CE3-CB 4.4Å; W212-V264 HydrophobicContact CG-CB 4.1Å; W212-V264 HydrophobicContact CG-CG1 3.55Å; E217-V264 HydrophobicContact CB-CG1 4.03Å; E217-V264 HydrophobicContact CB-CG2 4.33Å; E217-V264 HydrophobicContact CG-CG1 3.68Å; I219-V264 HydrophobicContact CD1-CG2 3.99Å; I260-V264 WeakPolarHBondContact CA-O 2.86Å; L261-V264 PolarHBondContact N-O 2.78Å; L261-V264 WeakPolarHBondContact O-CG2 3.44Å; L261-V264 PolarHBondContact O-N 3.05Å; L261-V264 VanDerWaalsContact O-N 3.08Å; N262-V264 VanDerWaalsContact C-N 3.28Å; N262-V264 PolarHBondContact O-N 3.18Å
265	Q	92.4	Very high	85.1	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.4	179.7	-170.6	169.6	56.1	0	0	111.5	G190 W212 R258 I260 L267 Q549 I556	G190-Q265 WeakPolarHBondContact CA-O 3.19Å; W212-Q265 HydrophobicContact CH2-CB 3.79Å; W212-Q265 HydrophobicContact CZ3-CB 3.77Å; R258-Q265 PolarHBondContact O-NE2 2.55Å; R258-Q265 VanDerWaalsContact O-NE2 3.09Å; I260-Q265 HydrophobicContact CD1-CB 3.73Å; I260-Q265 HydrophobicContact CD1-CG 3.9Å; Q265-L267 HydrophobicContact CG-CD2 4.01Å; Q265-L267 HydrophobicContact CG-CG 4.4Å; Q265-Q549 PolarHBondContact OE1-O 3.49Å; Q265-I556 HydrophobicContact CB-CD1 4.15Å
266	L	93.8	Very high	82.5	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.031	23%	0.227	C	C	.	.			trans	-93.9	123.3	175.3	-49.4	-177.5	0	0	0	109.9	Y192 L208 V210 V251 L254 V255	Y192-L266 HydrophobicContact CD1-CB 3.75Å; Y192-L266 HydrophobicContact CD1-CD2 4.34Å; Y192-L266 HydrophobicContact CE1-CB 3.99Å; Y192-L266 HydrophobicContact CG-CB 4.32Å; Y192-L266 HydrophobicContact CG-CD2 4.16Å; L208-L266 HydrophobicContact CD1-CD1 4.36Å; L208-L266 HydrophobicContact CD1-CD2 4.32Å; L208-L266 HydrophobicContact CD2-CD1 3.68Å; L208-L266 HydrophobicContact CD2-CD2 3.96Å; L208-L266 HydrophobicContact CD2-CG 4.41Å; L208-L266 HydrophobicContact CG-CD2 4.35Å; V210-L266 HydrophobicContact CB-CD2 3.92Å; V210-L266 HydrophobicContact CG1-CD2 4.27Å; V210-L266 HydrophobicContact CG2-CD2 3.91Å; V251-L266 HydrophobicContact CG1-CD1 4.2Å; L254-L266 HydrophobicContact CB-CD1 3.91Å; L254-L266 HydrophobicContact CD1-CD1 3.96Å; V255-L266 HydrophobicContact CG2-CB 3.59Å; V255-L266 HydrophobicContact CG2-CD1 4.24Å
267	L	90.1	Very high	80	Confident	27 Å²	27	54.4 Å²	54.4	14%	0.141	26%	0.261	C	S	.	.			trans	-122.5	-45	-176.5	-63.3	179.6	0	0	0	113.4	G190 Q265	G190-L267 PolarHBondContact O-N 2.79Å; Q265-L267 HydrophobicContact CG-CD2 4.01Å; Q265-L267 HydrophobicContact CG-CG 4.4Å
268	R	91.3	Very high	77.7	Confident	83 Å²	83	60.8 Å²	60.8	31%	0.313	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	126.6	-177	-177.5	178.8	65.5	166	1.5	111.7	G190 D191 Y192	G190-R268 PolarHBondContact O-N 2.96Å; D191-R268 CarbonylContact C-O 3.59Å; D191-R268 WeakPolarHBondContact CA-O 3.44Å; D191-R268 IonicContact OD1-CZ 3.87Å; D191-R268 VanDerWaalsContact OD1-CZ 3.28Å; D191-R268 IonicContact OD1-NE 3.41Å; D191-R268 PolarHBondContact OD1-NE 2.95Å; D191-R268 IonicContact OD1-NH2 2.65Å; D191-R268 PolarHBondContact OD1-NH2 2.92Å; D191-R268 IonicContact OD2-CZ 3.95Å; D191-R268 IonicContact OD2-NE 2.72Å; D191-R268 IonicContact OD2-NH2 3.78Å; D191-R268 PolarHBondContact OD2-NH2 2.76Å; Y192-R268 VanDerWaalsContact CD1-C 3.4Å; Y192-R268 WeakPolarHBondContact CD1-O 3.42Å; Y192-R268 WeakPolarHBondContact CE1-O 3.41Å; Y192-R268 PolarHBondContact N-O 3.29Å
269	S	93.7	Very high	75.1	Confident	16 Å²	16	60.8 Å²	60.8	11%	0.112	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.1	170	43.3	0	0	0	0	111	E158 Y192	E158-S269 PolarHBondContact OE2-N 3.34Å; E158-S269 PolarHBondContact OE2-OG 3.44Å; Y192-S269 WeakPolarHBondContact O-CA 3.33Å; Y192-S269 WeakPolarHBondContact OH-CB 3.23Å
270	V	93	Very high	72.2	Confident	8 Å²	8	68.4 Å²	68.4	5%	0.048	34%	0.343	C	S	.	.			trans	-96.9	113.9	174.1	-177.6	0	0	0	0	109.2	Y172 H174 T185 L186 D191 Y192 D274	Y172-V270 WeakPolarHBondContact CA-O 3.49Å; H174-V270 PolarHBondContact NE2-O 2.92Å; T185-V270 HydrophobicContact CG2-CG1 3.74Å; L186-V270 HydrophobicContact CD2-CB 4.29Å; L186-V270 HydrophobicContact CD2-CG2 3.83Å; D191-V270 HydrophobicContact CB-CG2 3.84Å; Y192-V270 PolarHBondContact O-N 3.12Å; V270-D274 HydrophobicContact CG1-CB 4.08Å
271	S	88.8	Confident	69.2	Low	17 Å²	17	68.6 Å²	68.6	12%	0.119	36%	0.355	C	S	.	.			trans	-77.6	158.7	-176.1	75.4	0	0	0	0	112	S171 S273 D274	S171-S271 CarbonylContact O-C 3.54Å; S171-S271 VanDerWaalsContact O-CA 3.28Å; S171-S271 WeakPolarHBondContact O-CA 3.26Å; S271-S273 PolarHBondContact O-N 3.45Å; S271-S273 PolarHBondContact OG-N 2.83Å; S271-S273 PolarHBondContact OG-OG 2.79Å; S271-D274 WeakPolarHBondContact CA-OD2 3.43Å; S271-D274 WeakPolarHBondContact CB-OD2 3.21Å; S271-D274 PolarHBondContact N-OD2 3.09Å; S271-D274 PolarHBondContact O-N 2.91Å; S271-D274 PolarHBondContact OG-N 2.96Å; S271-D274 PolarHBondContact OG-OD1 3.31Å; S271-D274 PolarHBondContact OG-OD2 2.83Å
272	H	74.1	Confident	66.3	Low	104 Å²	104	72.2 Å²	72.2	48%	0.481	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.2	173.2	-171.5	64.2	0	0	0	113	S171 H174 D274	S171-H272 PolarHBondContact O-N 3.14Å; H174-H272 AromaticContact ND1-ND1 3.73Å; H272-D274 VanDerWaalsContact C-N 3.32Å; H272-D274 PolarHBondContact O-N 3.44Å
273	S	63.7	Low	63.9	Low	80 Å²	80	74.5 Å²	74.5	56%	0.559	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-32.9	175.8	19.7	0	0	0	0	113.3	S271 R275 R276	S271-S273 PolarHBondContact O-N 3.45Å; S271-S273 PolarHBondContact OG-N 2.83Å; S271-S273 PolarHBondContact OG-OG 2.79Å; S273-R275 PolarHBondContact O-N 3.29Å; S273-R276 PolarHBondContact O-N 2.79Å; S273-R276 VanDerWaalsContact O-N 3.11Å
274	D	60	Low	61.2	Low	66 Å²	66	79.4 Å²	79.4	35%	0.353	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-65.1	-27	-175.6	-60.3	-34.9	0	0	0	111.9	V270 S271 H272 R276 M277 Y278	V270-D274 HydrophobicContact CG1-CB 4.08Å; S271-D274 WeakPolarHBondContact CA-OD2 3.43Å; S271-D274 WeakPolarHBondContact CB-OD2 3.21Å; S271-D274 PolarHBondContact N-OD2 3.09Å; S271-D274 PolarHBondContact O-N 2.91Å; S271-D274 PolarHBondContact OG-N 2.96Å; S271-D274 PolarHBondContact OG-OD1 3.31Å; S271-D274 PolarHBondContact OG-OD2 2.83Å; H272-D274 VanDerWaalsContact C-N 3.32Å; H272-D274 PolarHBondContact O-N 3.44Å; D274-R276 PolarHBondContact O-N 3.13Å; D274-M277 PolarHBondContact O-N 3.33Å; D274-Y278 WeakPolarHBondContact O-CD2 3.49Å
275	R	53	Low	58.1	Low	108 Å²	108	84.5 Å²	84.5	41%	0.408	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-60.1	-30.2	176.4	-163.5	178.7	-175.1	175	7.8	112.7	D181 S273 M277	D181-R275 VanDerWaalsContact CG-NH2 3.34Å; D181-R275 IonicContact OD1-NH2 3.47Å; D181-R275 IonicContact OD2-CZ 3.12Å; D181-R275 IonicContact OD2-NH1 2.91Å; D181-R275 IonicContact OD2-NH2 3.37Å; D181-R275 PolarHBondContact OD2-NH2 3.33Å; S273-R275 PolarHBondContact O-N 3.29Å; R275-M277 VanDerWaalsContact C-N 3.32Å; R275-M277 PolarHBondContact O-N 2.54Å
276	R	40.3	Very low	55	Low	225 Å²	225	88.3 Å²	88.3	85%	0.849	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-73.3	-22.8	-178.4	-70.7	-169.7	-174.7	-174.9	3.1	113.2	S273 D274	S273-R276 PolarHBondContact O-N 2.79Å; S273-R276 VanDerWaalsContact O-N 3.11Å; D274-R276 PolarHBondContact O-N 3.13Å
277	M	36.6	Very low	51.8	Low	163 Å²	163	95.3 Å²	95.3	80%	0.803	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-31.8	-178.2	-80.6	-82.6	-179.4	0	0	112.8	D274 R275	D274-M277 PolarHBondContact O-N 3.33Å; R275-M277 VanDerWaalsContact C-N 3.32Å; R275-M277 PolarHBondContact O-N 2.54Å
278	Y	41.8	Very low	48.8	Very low	144 Å²	144	98.7 Å²	98.7	57%	0.565	55%	0.552	S	S	*	*	S	Bend	trans	-101.9	4.4	-170.5	-63.7	-76.3	0	0	0	115.3	L187 D274 N280 G281	L187-Y278 HydrophobicContact CD1-CD2 4.37Å; L187-Y278 HydrophobicContact CD1-CE1 4.4Å; L187-Y278 HydrophobicContact CD1-CE2 4.25Å; L187-Y278 HydrophobicContact CD1-CG 4.5Å; D274-Y278 WeakPolarHBondContact O-CD2 3.49Å; Y278-N280 PolarHBondContact O-N 2.84Å; Y278-G281 PolarHBondContact O-N 2.75Å
279	G	32.3	Very low	45.6	Very low	61 Å²	61	98.3 Å²	98.3	63%	0.629	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	1.2	-174.2	0	0	0	0	0	117.5
280	N	30.6	Very low	42.4	Very low	173 Å²	173	106 Å²	106	93%	0.925	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	12.6	-178	-84.5	-14.4	0	0	0	115.3	Y278	Y278-N280 PolarHBondContact O-N 2.84Å
281	G	27.6	Very low	39.2	Very low	45 Å²	45	107.8 Å²	107.8	46%	0.464	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-100.6	127.1	177.6	0	0	0	0	0	112.8	Y278 F283	Y278-G281 PolarHBondContact O-N 2.75Å; G281-F283 VanDerWaalsContact O-CD2 3.31Å; G281-F283 WeakPolarHBondContact O-CD2 3.17Å; G281-F283 WeakPolarHBondContact O-CE2 3.29Å; G281-F283 PolarHBondContact O-N 3.2Å
282	A	27.9	Very low	36.1	Very low	109 Å²	109	112.9 Å²	112.9	90%	0.901	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-63.2	123.6	173.4	0	0	0	0	0	110.9
283	F	33.7	Very low	33.7	Very low	118 Å²	118	110.8 Å²	110.8	52%	0.518	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-86.4	146.7	-175.7	-70.2	-89.3	0	0	0	112.6	G281	G281-F283 VanDerWaalsContact O-CD2 3.31Å; G281-F283 WeakPolarHBondContact O-CD2 3.17Å; G281-F283 WeakPolarHBondContact O-CE2 3.29Å; G281-F283 PolarHBondContact O-N 3.2Å
284	P	28.9	Very low	31.8	Very low	111 Å²	111	111.2 Å²	111.2	72%	0.721	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-71.4	144	162.4	20.6	-13.9	0	0	0	110.6	V286	P284-V286 PolarHBondContact O-N 2.81Å
285	A	26.2	Very low	30	Very low	110 Å²	110	112.3 Å²	112.3	91%	0.909	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-53.6	120.3	-178	0	0	0	0	0	111.7
286	V	28.2	Very low	28.8	Very low	81 Å²	81	111.3 Å²	111.3	49%	0.491	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-89.9	123.6	177.2	179.9	0	0	0	0	108.7	P284 T288	P284-V286 PolarHBondContact O-N 2.81Å; V286-T288 PolarHBondContact O-N 2.88Å
287	D	27.1	Very low	28.1	Very low	152 Å²	152	107.8 Å²	107.8	81%	0.813	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-67.1	120.4	174.6	-116.3	-22.7	0	0	0	110.6	S289	D287-S289 PolarHBondContact O-N 2.86Å; D287-S289 VanDerWaalsContact O-N 3.11Å
288	T	25.3	Very low	27.7	Very low	99 Å²	99	105.5 Å²	105.5	61%	0.607	65%	0.645	S	S	*	*			trans	-84.7	73.4	-175	40.9	0	0	0	0	111.6	V286	V286-T288 PolarHBondContact O-N 2.88Å
289	S	25.5	Very low	26.8	Very low	75 Å²	75	106.6 Å²	106.6	52%	0.524	66%	0.66	S	S	.	*			trans	-101.7	106.4	165.5	60.5	0	0	0	0	110.3	D287 S291	D287-S289 PolarHBondContact O-N 2.86Å; D287-S289 VanDerWaalsContact O-N 3.11Å; S289-S291 PolarHBondContact O-N 3.17Å
290	Y	26.5	Very low	26.3	Very low	176 Å²	176	115.3 Å²	115.3	69%	0.69	67%	0.674	S	S	*	*			trans	-76.6	109.4	177	-68.3	-82.3	0	0	0	110
291	S	24.6	Very low	26	Very low	47 Å²	47	115.3 Å²	115.3	33%	0.329	67%	0.668	S	S	.	*			trans	-73.7	124.9	162	-73.5	0	0	0	0	109.2	E217 S289	E217-S291 PolarHBondContact OE1-OG 3.47Å; S289-S291 PolarHBondContact O-N 3.17Å
292	T	24.9	Very low	25.8	Very low	123 Å²	123	117.3 Å²	117.3	76%	0.755	68%	0.681	S	S	*	*			trans	-60.6	135.8	171.3	38.6	0	0	0	0	110.9	T294	T292-T294 PolarHBondContact O-N 2.91Å
293	A	23.2	Very low	25.7	Very low	61 Å²	61	119.2 Å²	119.2	50%	0.504	68%	0.676	S	S	.	*			trans	-57.1	103.2	173.4	0	0	0	0	0	110.5	S295	A293-S295 PolarHBondContact O-N 2.94Å; A293-S295 VanDerWaalsContact O-N 3.1Å
294	T	23.3	Very low	25.1	Very low	88 Å²	88	119.2 Å²	119.2	54%	0.54	69%	0.69	S	S	.	*			trans	-73.4	106.2	175.8	-53.5	0	0	0	0	108	T292 V296	T292-T294 PolarHBondContact O-N 2.91Å; T294-V296 PolarHBondContact O-N 3.35Å
295	S	23.5	Very low	25	Very low	90 Å²	90	119.1 Å²	119.1	63%	0.629	69%	0.692	S	S	*	*			trans	-68.6	126.4	174.4	-68.3	0	0	0	0	109.6	A293 N297	A293-S295 PolarHBondContact O-N 2.94Å; A293-S295 VanDerWaalsContact O-N 3.1Å; S295-N297 PolarHBondContact O-N 3.37Å
296	V	27.4	Very low	25	Very low	87 Å²	87	122 Å²	122	53%	0.527	69%	0.691	S	S	.	*			trans	-64.4	105.8	173.2	-177.6	0	0	0	0	108.6	T294 T298	T294-V296 PolarHBondContact O-N 3.35Å; V296-T298 HydrophobicContact CG1-CG2 4.2Å; V296-T298 PolarHBondContact O-N 2.81Å
297	N	24.3	Very low	24.9	Very low	151 Å²	151	125.5 Å²	125.5	81%	0.807	71%	0.705	S	S	*	*			trans	-76.7	98.7	152.9	-78.2	-28.3	0	0	0	105.9	S295 L299	S295-N297 PolarHBondContact O-N 3.37Å; N297-L299 PolarHBondContact O-N 2.97Å; N297-L299 VanDerWaalsContact O-N 3.09Å
298	T	29.2	Very low	24.8	Very low	115 Å²	115	122.7 Å²	122.7	71%	0.706	70%	0.697	S	S	*	*			trans	-50.3	120	163	41.1	0	0	0	0	107.3	V296 R300	V296-T298 HydrophobicContact CG1-CG2 4.2Å; V296-T298 PolarHBondContact O-N 2.81Å; T298-R300 PolarHBondContact O-N 2.95Å; T298-R300 VanDerWaalsContact O-N 3.15Å
299	L	23	Very low	24.9	Very low	166 Å²	166	123.3 Å²	123.3	87%	0.869	71%	0.712	S	S	*	*			trans	-44.3	121.6	-180	-82.7	153.6	0	0	0	109.9	N297 E301	N297-L299 PolarHBondContact O-N 2.97Å; N297-L299 VanDerWaalsContact O-N 3.09Å; L299-E301 PolarHBondContact O-N 3.22Å
300	R	22	Very low	24.9	Very low	244 Å²	244	125.2 Å²	125.2	92%	0.921	72%	0.721	S	S	*	*			trans	-55.4	113.6	-173.7	-162.1	176.7	177.7	-168.6	-1.6	110	T298 A302	T298-R300 PolarHBondContact O-N 2.95Å; T298-R300 VanDerWaalsContact O-N 3.15Å; R300-A302 PolarHBondContact O-N 2.84Å
301	E	23.8	Very low	24.9	Very low	174 Å²	174	125.3 Å²	125.3	81%	0.813	73%	0.727	S	S	*	*			trans	-65.7	126.8	167.9	-80	-179.5	160.2	0	0	109.5	L299	L299-E301 PolarHBondContact O-N 3.22Å
302	A	22.5	Very low	25	Very low	87 Å²	87	131.8 Å²	131.8	72%	0.719	76%	0.755	S	S	*	*			trans	-82.5	136.6	167	0	0	0	0	0	109.8	R300	R300-A302 PolarHBondContact O-N 2.84Å
303	D	25.7	Very low	25.1	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	76%	0.761	S	S	*	*			trans	62.5	97.1	156.7	-59.9	-16.5	0	0	0	120.2
304	S	22.3	Very low	25.2	Very low	118 Å²	118	139.4 Å²	139.4	83%	0.825	78%	0.778	S	S	*	*			trans	-24.5	122.7	147.8	53.8	0	0	0	0	116
305	S	27.3	Very low	25.4	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	79%	0.792	S	S	*	*			trans	-133.1	132.6	144.5	50.6	0	0	0	0	110	I307	S305-I307 PolarHBondContact O-N 2.98Å
306	I	24.5	Very low	25.4	Very low	171 Å²	171	145.2 Å²	145.2	88%	0.877	81%	0.806	S	S	*	*			trans	-72.3	117.1	-165.3	-63.8	156.4	0	0	0	109.4
307	I	26.4	Very low	25.4	Very low	154 Å²	154	147.5 Å²	147.5	79%	0.79	81%	0.814	S	S	*	*			trans	-121.9	118.8	165	-56.7	-179.7	0	0	0	108.4	S305	S305-I307 PolarHBondContact O-N 2.98Å
308	S	25.7	Very low	25.6	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	80%	0.803	S	S	*	*			trans	-64.9	127.6	-174.4	54.1	0	0	0	0	112.8	T310	S308-T310 PolarHBondContact O-N 2.9Å
309	A	26.3	Very low	25.7	Very low	112 Å²	112	143.2 Å²	143.2	93%	0.926	80%	0.798	S	S	*	*	S	Bend	trans	-77.6	41.9	-175.9	0	0	0	0	0	115.3
310	T	26.8	Very low	26.1	Very low	115 Å²	115	145.2 Å²	145.2	71%	0.706	79%	0.794	S	S	*	*			trans	-111	4.6	-169.3	14.3	0	0	0	0	117.3	S308	S308-T310 PolarHBondContact O-N 2.9Å
311	E	26.1	Very low	26.7	Very low	178 Å²	178	139.5 Å²	139.5	83%	0.832	78%	0.781	S	S	*	*	S	Bend	trans	-135.5	80.1	177.3	-71.5	-170.1	151.3	0	0	112.6
312	M	26.6	Very low	27.1	Very low	184 Å²	184	141.5 Å²	141.5	91%	0.906	78%	0.781	S	S	*	*			trans	-167.1	17.5	150.9	-112	176.3	-90.2	0	0	117.1	K314	M312-K314 VanDerWaalsContact C-N 3.32Å; M312-K314 PolarHBondContact O-N 3.41Å
313	T	26.8	Very low	27.9	Very low	145 Å²	145	140.2 Å²	140.2	89%	0.89	76%	0.758	S	S	*	*			trans	-85.3	26.4	178.8	34.5	0	0	0	0	115.8
314	K	26.7	Very low	28.4	Very low	198 Å²	198	136.3 Å²	136.3	86%	0.861	74%	0.741	S	S	*	*	S	Bend	trans	-131.3	74.1	178.2	-76.4	-175.3	179.5	173.9	0	114	M312	M312-K314 VanDerWaalsContact C-N 3.32Å; M312-K314 PolarHBondContact O-N 3.41Å
315	K	25.7	Very low	29.3	Very low	188 Å²	188	135.1 Å²	135.1	82%	0.817	74%	0.738	S	S	*	*			trans	163	99.1	136.3	-95.9	174.3	176.4	177.2	0	108.1	I317	K315-I317 HydrophobicContact CB-CG1 4.5Å; K315-I317 PolarHBondContact O-N 3.3Å
316	A	25.3	Very low	29.9	Very low	113 Å²	113	133.6 Å²	133.6	93%	0.934	72%	0.722	S	S	*	*			trans	-67	72.1	166.9	0	0	0	0	0	110	S318	A316-S318 PolarHBondContact O-N 3.03Å
317	I	27.3	Very low	31.2	Very low	135 Å²	135	126.1 Å²	126.1	69%	0.692	68%	0.683	S	S	*	*			trans	-86	100.5	158.4	-59.4	175	0	0	0	103.8	K315 P319	K315-I317 HydrophobicContact CB-CG1 4.5Å; K315-I317 PolarHBondContact O-N 3.3Å; I317-P319 WeakPolarHBondContact O-CD 3.43Å
318	S	27.4	Very low	32.6	Very low	83 Å²	83	121 Å²	121	58%	0.58	67%	0.668	S	S	*	*			trans	-47	110.5	171.2	-179.8	0	0	0	0	107.8	A316 R320	A316-S318 PolarHBondContact O-N 3.03Å; S318-R320 PolarHBondContact O-N 2.84Å; S318-R320 WeakPolarHBondContact OG-CG 3.41Å
319	P	30.9	Very low	34.9	Very low	92 Å²	92	119 Å²	119	60%	0.597	65%	0.652	S	S	*	*			trans	-76.7	71	175	31.1	-27.8	0	0	0	105.9	I317 L321	I317-P319 WeakPolarHBondContact O-CD 3.43Å; P319-L321 VanDerWaalsContact C-N 3.26Å; P319-L321 PolarHBondContact O-N 3.15Å
320	R	31	Very low	37.6	Very low	209 Å²	209	117.7 Å²	117.7	79%	0.789	63%	0.625	S	S	*	*			trans	-59.7	97.5	169.4	-79.1	-172.2	168.3	178	-4.7	106.4	S318 R322	S318-R320 PolarHBondContact O-N 2.84Å; S318-R320 WeakPolarHBondContact OG-CG 3.41Å; R320-R322 VanDerWaalsContact C-N 3.34Å; R320-R322 PolarHBondContact O-N 2.94Å
321	L	36	Very low	40.5	Very low	123 Å²	123	112.3 Å²	112.3	64%	0.644	59%	0.593	S	S	*	*	S	Bend	trans	3.5	72.4	160.9	-75.4	85.6	0	0	0	114.8	P319	P319-L321 VanDerWaalsContact C-N 3.26Å; P319-L321 PolarHBondContact O-N 3.15Å
322	R	31.6	Very low	43.4	Very low	217 Å²	217	105.4 Å²	105.4	82%	0.819	56%	0.559	S	S	*	*			trans	-84.3	-1.9	158	-74.6	-162.2	-176.9	-166.9	1.8	112	R320 C324	R320-R322 VanDerWaalsContact C-N 3.34Å; R320-R322 PolarHBondContact O-N 2.94Å; R322-C324 PolarHBondContact O-N 2.97Å
323	R	39.8	Very low	46.4	Very low	60 Å²	60	100 Å²	100	23%	0.226	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.7	-159.5	-77.6	-172	-179.8	164.1	4	115.3	Y397	R323-Y397 VanDerWaalsContact NH2-CE1 3.28Å; R323-Y397 PolarHBondContact NH2-OH 2.93Å
324	C	35.6	Very low	49.4	Very low	66 Å²	66	93 Å²	93	45%	0.446	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-24.3	-173.4	-59.6	0	0	0	0	114.4	R322 L326	R322-C324 PolarHBondContact O-N 2.97Å; C324-L326 PolarHBondContact O-N 2.56Å
325	A	40.8	Very low	52.6	Low	93 Å²	93	83.8 Å²	83.8	77%	0.769	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-71.9	-26.2	-170.3	0	0	0	0	0	114.1	L327	A325-L327 PolarHBondContact O-N 2.76Å
326	L	41.5	Very low	55.6	Low	78 Å²	78	76.8 Å²	76.8	41%	0.408	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-73.1	-24.5	-171	-74.4	169.9	0	0	0	113.9	C324 M407 H422	C324-L326 PolarHBondContact O-N 2.56Å; L326-M407 HydrophobicContact CD1-CE 3.79Å; L326-H422 PolarHBondContact O-CE1 3.4Å; L326-H422 PolarHBondContact O-NE2 2.95Å
327	L	50.4	Low	58.5	Low	14 Å²	14	73.8 Å²	73.8	7%	0.073	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-123.1	15.6	-164.8	-59.8	173.7	0	0	0	113.9	A325 R332 E414	A325-L327 PolarHBondContact O-N 2.76Å; L327-R332 PolarHBondContact O-NH2 2.86Å; L327-E414 HydrophobicContact CD1-CB 4.21Å; L327-E414 HydrophobicContact CD1-CG 3.34Å; L327-E414 WeakPolarHBondContact CD1-O 3.28Å
328	G	56.6	Low	61.5	Low	45 Å²	45	67.7 Å²	67.7	46%	0.464	35%	0.353	S	S	.	.			trans	75.5	162.9	-172.4	0	0	0	0	0	112.7	K330 R332	G328-K330 PolarHBondContact O-N 2.72Å; G328-R332 PolarHBondContact O-NH2 2.8Å
329	V	72.8	Confident	64.3	Low	52 Å²	52	66 Å²	66	32%	0.315	34%	0.34	S	S	.	.	S	Bend	trans	-71.4	2.8	179.2	-83	0	0	0	0	114	M160 V161 E163	M160-V329 CarbonylContact C-O 3.6Å; M160-V329 HydrophobicContact CE-CB 3.87Å; M160-V329 HydrophobicContact CE-CG2 3.22Å; V161-V329 VanDerWaalsContact CB-O 3.32Å; V161-V329 WeakPolarHBondContact CB-O 3.49Å; V161-V329 WeakPolarHBondContact CG2-O 3.2Å; V161-V329 PolarHBondContact N-O 2.89Å; E163-V329 HydrophobicContact CG-CG1 3.62Å; E163-V329 VanDerWaalsContact OE1-CG1 3.24Å; E163-V329 WeakPolarHBondContact OE1-CG1 3.43Å
330	K	83.1	Confident	67.2	Low	83 Å²	83	62.5 Å²	62.5	36%	0.361	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-73.1	130.2	179.8	-166.5	166.9	-175.5	168.6	0	111.4	F159 M160 H256 G328 R332	F159-K330 HydrophobicContact CD2-CD 4.31Å; F159-K330 HydrophobicContact CD2-CG 4.09Å; F159-K330 HydrophobicContact CE2-CD 4.32Å; M160-K330 HydrophobicContact CE-CB 4.07Å; M160-K330 HydrophobicContact SD-CB 3.84Å; M160-K330 HydrophobicContact SD-CG 4.02Å; H256-K330 WeakPolarHBondContact CE1-CE 3.44Å; H256-K330 WeakPolarHBondContact NE2-CE 3.39Å; G328-K330 PolarHBondContact O-N 2.72Å; K330-R332 PolarHBondContact O-NH2 3.45Å
331	A	87.6	Confident	70	Confident	3 Å²	3	52.8 Å²	52.8	3%	0.025	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.5	150.4	176.2	0	0	0	0	0	111.4	F159 V161 K252 H256	F159-A331 VanDerWaalsContact O-CB 3.3Å; F159-A331 WeakPolarHBondContact O-CB 3.4Å; F159-A331 PolarHBondContact O-N 2.85Å; V161-A331 HydrophobicContact CG2-CB 3.92Å; K252-A331 VanDerWaalsContact C-CB 3.42Å; K252-A331 HydrophobicContact CB-CB 3.43Å; K252-A331 VanDerWaalsContact CB-CB 3.43Å; H256-A331 PolarHBondContact CE1-O 3.44Å; H256-A331 PolarHBondContact ND1-O 2.82Å
332	R	87.7	Confident	72.6	Confident	32 Å²	32	48.2 Å²	48.2	12%	0.121	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-87.3	146.4	-173.6	-58.7	-62.4	157.7	-160.1	-18.2	110.9	S253 L327 G328 K330 N411 D413 E414 S417	S253-R332 WeakPolarHBondContact CA-O 3.31Å; S253-R332 WeakPolarHBondContact CB-O 3.03Å; S253-R332 PolarHBondContact OG-O 3.28Å; L327-R332 PolarHBondContact O-NH2 2.86Å; G328-R332 PolarHBondContact O-NH2 2.8Å; K330-R332 PolarHBondContact O-NH2 3.45Å; R332-N411 WeakPolarHBondContact CB-OD1 3.44Å; R332-N411 WeakPolarHBondContact CG-OD1 3.45Å; R332-D413 VanDerWaalsContact CA-OD2 3.31Å; R332-D413 WeakPolarHBondContact CA-OD2 3.37Å; R332-D413 HydrophobicContact CB-CB 4.12Å; R332-D413 WeakPolarHBondContact CD-OD2 3.46Å; R332-E414 HydrophobicContact CG-CB 4.42Å; R332-S417 PolarHBondContact NH1-OG 2.94Å; R332-S417 VanDerWaalsContact NH1-OG 3.13Å
333	R	89.6	Confident	75.4	Confident	70 Å²	70	38.2 Å²	38.2	26%	0.264	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-88.4	141.7	170.7	-61.4	-174.2	-175.2	-168.9	-1.1	109.8	H256 L337 L338 D413	H256-R333 PolarHBondContact CD2-NE 3.13Å; H256-R333 PolarHBondContact CD2-NH2 3.44Å; H256-R333 PolarHBondContact CE1-NE 3.03Å; H256-R333 VanDerWaalsContact CE1-NE 3.29Å; H256-R333 WeakPolarHBondContact ND1-CG 3.2Å; H256-R333 PolarHBondContact NE2-NE 3.44Å; H256-R333 PolarHBondContact NE2-NH2 3.27Å; H256-R333 VanDerWaalsContact NE2-NH2 3.1Å; H256-R333 PolarHBondContact O-NE 3.45Å; R333-L337 HydrophobicContact CB-CB 4.39Å; R333-L337 VanDerWaalsContact CD-O 3.27Å; R333-L337 WeakPolarHBondContact CD-O 3.37Å; R333-L338 HydrophobicContact CB-CD2 3.76Å; R333-L338 HydrophobicContact CB-CG 4.48Å; R333-D413 PolarHBondContact N-OD2 3.1Å
334	P	91	Very high	77.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-53.4	146.6	162.4	-22	32.3	0	0	0	110.6	L232 P233 H336 L337 L338	L232-P334 HydrophobicContact CB-CG 4.22Å; L232-P334 HydrophobicContact CD1-CG 4.36Å; P233-P334 HydrophobicContact CG-CG 4.21Å; P334-H336 PolarHBondContact O-N 3.27Å; P334-H336 VanDerWaalsContact O-N 3.08Å; P334-L337 HydrophobicContact CB-CD1 4.44Å; P334-L337 HydrophobicContact CG-CD1 4.11Å; P334-L337 WeakPolarHBondContact O-CA 3.45Å; P334-L337 PolarHBondContact O-N 2.87Å; P334-L338 PolarHBondContact O-N 3.23Å
335	L	92.4	Very high	80.4	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.016	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-45.7	-46	-176.7	171.3	60.8	0	0	0	112.6	P240 E242 L337 L338 F341 V362 A371 V412	P240-L335 HydrophobicContact CG-CD2 4.47Å; E242-L335 VanDerWaalsContact OE2-CB 3.24Å; E242-L335 WeakPolarHBondContact OE2-CB 3.13Å; E242-L335 PolarHBondContact OE2-N 3.14Å; L335-L337 PolarHBondContact O-N 2.55Å; L335-L338 HydrophobicContact CD1-CD1 4.02Å; L335-L338 WeakPolarHBondContact O-CB 3.46Å; L335-L338 PolarHBondContact O-N 2.83Å; L335-L338 VanDerWaalsContact O-N 3.17Å; L335-F341 HydrophobicContact CD1-CD2 3.53Å; L335-F341 HydrophobicContact CD1-CE2 3.87Å; L335-F341 HydrophobicContact CD1-CG 4.11Å; L335-F341 HydrophobicContact CD2-CE2 4.21Å; L335-F341 HydrophobicContact CG-CD2 3.97Å; L335-F341 HydrophobicContact CG-CE2 3.92Å; L335-F341 HydrophobicContact CG-CG 4.39Å; L335-F341 HydrophobicContact CG-CZ 4.29Å; L335-F341 VanDerWaalsContact O-CB 3.23Å; L335-F341 WeakPolarHBondContact O-CB 3.31Å; L335-F341 WeakPolarHBondContact O-CD1 3.4Å; L335-F341 VanDerWaalsContact O-CG 3.29Å; L335-F341 WeakPolarHBondContact O-CG 3.48Å; L335-V362 HydrophobicContact CD1-CG1 3.84Å; L335-A371 HydrophobicContact CD2-CB 4.25Å; L335-V412 HydrophobicContact CD1-CB 4.16Å; L335-V412 HydrophobicContact CD1-CG1 4.01Å; L335-V412 HydrophobicContact CD1-CG2 4.28Å; L335-V412 HydrophobicContact CD2-CG2 4.44Å
336	H	88.3	Confident	83	Confident	42 Å²	42	37.3 Å²	37.3	19%	0.194	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-67.2	-15.6	-177	71.5	-80.1	0	0	0	114.7	P233 E235 P334 F341	P233-H336 PolarHBondContact O-CE1 3.44Å; E235-H336 HydrophobicContact CB-CB 4.15Å; P334-H336 PolarHBondContact O-N 3.27Å; P334-H336 VanDerWaalsContact O-N 3.08Å; H336-F341 HydrophobicContact CB-CE1 4.42Å
337	L	88.1	Confident	85.5	Confident	49 Å²	49	34.4 Å²	34.4	26%	0.257	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-109.3	6.3	-179.6	-58.2	172.3	0	0	0	111.9	V259 R333 P334 L335	V259-L337 HydrophobicContact CG2-CD1 3.57Å; R333-L337 HydrophobicContact CB-CB 4.39Å; R333-L337 VanDerWaalsContact CD-O 3.27Å; R333-L337 WeakPolarHBondContact CD-O 3.37Å; P334-L337 HydrophobicContact CB-CD1 4.44Å; P334-L337 HydrophobicContact CG-CD1 4.11Å; P334-L337 WeakPolarHBondContact O-CA 3.45Å; P334-L337 PolarHBondContact O-N 2.87Å; L335-L337 PolarHBondContact O-N 2.55Å
338	L	88.7	Confident	87.6	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.037	20%	0.198	C	C	.	.			trans	-70.9	132.4	174.9	-67.1	173.5	0	0	0	110.2	R333 P334 L335 Y340 F341 V412 D413	R333-L338 HydrophobicContact CB-CD2 3.76Å; R333-L338 HydrophobicContact CB-CG 4.48Å; P334-L338 PolarHBondContact O-N 3.23Å; L335-L338 HydrophobicContact CD1-CD1 4.02Å; L335-L338 WeakPolarHBondContact O-CB 3.46Å; L335-L338 PolarHBondContact O-N 2.83Å; L335-L338 VanDerWaalsContact O-N 3.17Å; L338-Y340 HydrophobicContact CB-CD2 4.49Å; L338-Y340 HydrophobicContact CB-CE2 4.23Å; L338-Y340 HydrophobicContact CD1-CE2 3.9Å; L338-Y340 PolarHBondContact O-N 2.84Å; L338-Y340 VanDerWaalsContact O-N 3.11Å; L338-F341 HydrophobicContact CB-CB 3.96Å; L338-F341 WeakPolarHBondContact O-CB 3.35Å; L338-F341 PolarHBondContact O-N 2.98Å; L338-V412 HydrophobicContact CD1-CG1 4.33Å; L338-D413 HydrophobicContact CD1-CB 4.27Å; L338-D413 HydrophobicContact CD2-CB 3.58Å; L338-D413 WeakPolarHBondContact CD2-OD1 3.45Å
339	P	86.8	Confident	89.3	Confident	47 Å²	47	39.7 Å²	39.7	31%	0.305	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-29.7	179	-28.8	36.6	0	0	0	114.1	I446 R447	P339-I446 HydrophobicContact CB-CD1 3.71Å; P339-I446 HydrophobicContact CB-CG2 3.93Å; P339-I446 CarbonylContact O-C 3.54Å; P339-I446 WeakPolarHBondContact O-CA 3.32Å; P339-R447 WeakPolarHBondContact O-CB 3.19Å; P339-R447 PolarHBondContact O-N 3.26Å
340	Y	90.9	Very high	90.3	Very high	20 Å²	20	37.2 Å²	37.2	8%	0.078	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	16.9	-179.8	51.5	-97.1	0	0	0	113	L338 F360 V362 D413 I416 P444 I445	L338-Y340 HydrophobicContact CB-CD2 4.49Å; L338-Y340 HydrophobicContact CB-CE2 4.23Å; L338-Y340 HydrophobicContact CD1-CE2 3.9Å; L338-Y340 PolarHBondContact O-N 2.84Å; L338-Y340 VanDerWaalsContact O-N 3.11Å; Y340-F360 HydrophobicContact CD2-CE2 4.36Å; Y340-F360 HydrophobicContact CG-CE2 4.46Å; Y340-V362 HydrophobicContact CD2-CB 4.36Å; Y340-V362 HydrophobicContact CD2-CG2 3.89Å; Y340-V362 HydrophobicContact CE2-CG2 3.94Å; Y340-V362 PolarHBondContact O-N 2.9Å; Y340-D413 PolarHBondContact OH-OD1 2.96Å; Y340-I416 HydrophobicContact CE2-CB 4.34Å; Y340-I416 HydrophobicContact CE2-CG1 4.33Å; Y340-I416 HydrophobicContact CE2-CG2 3.9Å; Y340-P444 HydrophobicContact CD1-CB 3.91Å; Y340-P444 HydrophobicContact CG-CB 4.23Å; Y340-I445 VanDerWaalsContact CA-O 3.28Å; Y340-I445 WeakPolarHBondContact CA-O 3.31Å; Y340-I445 VanDerWaalsContact CB-O 3.25Å; Y340-I445 WeakPolarHBondContact CB-O 3.4Å
341	F	91.3	Very high	90.9	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.022	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.5	173.9	179.6	-111	0	0	0	112	L335 H336 L338 G343 V362 V364 R447	L335-F341 HydrophobicContact CD1-CD2 3.53Å; L335-F341 HydrophobicContact CD1-CE2 3.87Å; L335-F341 HydrophobicContact CD1-CG 4.11Å; L335-F341 HydrophobicContact CD2-CE2 4.21Å; L335-F341 HydrophobicContact CG-CD2 3.97Å; L335-F341 HydrophobicContact CG-CE2 3.92Å; L335-F341 HydrophobicContact CG-CG 4.39Å; L335-F341 HydrophobicContact CG-CZ 4.29Å; L335-F341 VanDerWaalsContact O-CB 3.23Å; L335-F341 WeakPolarHBondContact O-CB 3.31Å; L335-F341 WeakPolarHBondContact O-CD1 3.4Å; L335-F341 VanDerWaalsContact O-CG 3.29Å; L335-F341 WeakPolarHBondContact O-CG 3.48Å; H336-F341 HydrophobicContact CB-CE1 4.42Å; L338-F341 HydrophobicContact CB-CB 3.96Å; L338-F341 WeakPolarHBondContact O-CB 3.35Å; L338-F341 PolarHBondContact O-N 2.98Å; F341-G343 VanDerWaalsContact CE1-CA 3.47Å; F341-V362 CarbonylContact C-O 3.55Å; F341-V362 VanDerWaalsContact CA-O 3.28Å; F341-V362 WeakPolarHBondContact CA-O 3.26Å; F341-V362 HydrophobicContact CD2-CB 4.32Å; F341-V362 HydrophobicContact CD2-CG1 4.05Å; F341-V362 WeakPolarHBondContact CD2-O 3.38Å; F341-V364 HydrophobicContact CE2-CG2 4.07Å; F341-V364 HydrophobicContact CZ-CG2 4.01Å; F341-R447 VanDerWaalsContact O-CD 3.31Å; F341-R447 WeakPolarHBondContact O-CD 3.24Å
342	F	90.8	Very high	91.2	Very high	26 Å²	26	41.4 Å²	41.4	11%	0.114	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	13	-172.5	-83.7	-114.5	0	0	0	114	Y353 L361 V362 F363 I445 R447	F342-Y353 AromaticContact CD1-CD2 3.71Å; F342-Y353 HydrophobicContact CD1-CD2 3.71Å; F342-Y353 AromaticContact CD1-CE2 3.66Å; F342-Y353 HydrophobicContact CD1-CE2 3.66Å; F342-Y353 HydrophobicContact CD1-CG 4.2Å; F342-Y353 AromaticContact CE1-CD1 3.76Å; F342-Y353 HydrophobicContact CE1-CD1 3.76Å; F342-Y353 AromaticContact CE1-CD2 3.57Å; F342-Y353 HydrophobicContact CE1-CD2 3.57Å; F342-Y353 AromaticContact CE1-CE1 3.95Å; F342-Y353 HydrophobicContact CE1-CE1 3.95Å; F342-Y353 AromaticContact CE1-CE2 3.79Å; F342-Y353 HydrophobicContact CE1-CE2 3.79Å; F342-Y353 AromaticContact CE1-CG 3.56Å; F342-Y353 HydrophobicContact CE1-CG 3.56Å; F342-Y353 AromaticContact CE1-CZ 3.98Å; F342-Y353 HydrophobicContact CZ-CG 4.27Å; F342-L361 HydrophobicContact CB-CD1 4.22Å; F342-L361 HydrophobicContact CD1-CD2 4.26Å; F342-L361 HydrophobicContact CD2-CB 3.84Å; F342-L361 HydrophobicContact CD2-CD1 4.04Å; F342-L361 HydrophobicContact CD2-CD2 3.91Å; F342-L361 HydrophobicContact CD2-CG 4.15Å; F342-L361 HydrophobicContact CE1-CD2 4.17Å; F342-L361 HydrophobicContact CE2-CB 3.88Å; F342-L361 HydrophobicContact CE2-CD2 3.82Å; F342-L361 HydrophobicContact CE2-CG 4.34Å; F342-L361 HydrophobicContact CG-CD1 4.12Å; F342-L361 HydrophobicContact CG-CD2 4.14Å; F342-L361 HydrophobicContact CZ-CD2 3.96Å; F342-V362 PolarHBondContact N-O 2.87Å; F342-F363 HydrophobicContact CB-CB 4.19Å; F342-I445 HydrophobicContact CE2-CG2 4.32Å; F342-I445 WeakPolarHBondContact CE2-O 3.29Å; F342-I445 HydrophobicContact CZ-CG2 3.91Å; F342-R447 HydrophobicContact CD2-CB 4.05Å; F342-R447 HydrophobicContact CE1-CB 4.48Å; F342-R447 HydrophobicContact CE2-CB 3.72Å; F342-R447 HydrophobicContact CZ-CB 3.96Å; F342-R447 HydrophobicContact CZ-CG 4.48Å
343	G	88.8	Confident	91.3	Very high	8 Å²	8	44.3 Å²	44.3	8%	0.082	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.4	-147.7	-178.6	0	0	0	0	0	112	F341 F363 V364	F341-G343 VanDerWaalsContact CE1-CA 3.47Å; G343-F363 CarbonylContact O-C 3.59Å; G343-F363 WeakPolarHBondContact O-CA 3.47Å; G343-F363 WeakPolarHBondContact O-CB 3.39Å; G343-V364 PolarHBondContact O-N 3.06Å
344	E	90.6	Very high	91.5	Very high	115 Å²	115	41.2 Å²	41.2	54%	0.537	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	121.5	173.7	-73.9	175.9	-155.4	0	0	110.6	V364 T366	E344-V364 WeakPolarHBondContact CA-O 3.48Å; E344-V364 HydrophobicContact CG-CB 3.85Å; E344-V364 HydrophobicContact CG-CG1 3.99Å; E344-T366 HydrophobicContact CB-CG2 4.41Å
345	C	89.9	Confident	91.4	Very high	13 Å²	13	48.2 Å²	48.2	9%	0.088	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	157.2	175.8	74.6	0	0	0	0	112.8	F363 V364 S365 T366	C345-F363 HydrophobicContact CB-CD2 4.48Å; C345-F363 VanDerWaalsContact O-CD2 3.32Å; C345-F363 WeakPolarHBondContact O-CD2 3.19Å; C345-F363 WeakPolarHBondContact O-CE2 3.47Å; C345-F363 WeakPolarHBondContact SG-CB 3.31Å; C345-F363 WeakPolarHBondContact SG-CD2 3.38Å; C345-F363 WeakPolarHBondContact SG-CG 3.12Å; C345-V364 PolarHBondContact N-O 2.96Å; C345-S365 WeakPolarHBondContact O-CA 3.45Å; C345-T366 PolarHBondContact O-N 2.89Å; C345-T366 VanDerWaalsContact O-N 3.13Å
346	H	95.4	Very high	91.3	Very high	72 Å²	72	56.5 Å²	56.5	33%	0.333	27%	0.268	S	S	.	.			trans	-75.7	139	174.2	-174.3	-93.3	0	0	0	109.7	S348 K349 A350 T366 R367	H346-S348 VanDerWaalsContact C-N 3.26Å; H346-S348 PolarHBondContact CE1-OG 3.22Å; H346-S348 VanDerWaalsContact CE1-OG 3.28Å; H346-S348 PolarHBondContact ND1-N 2.98Å; H346-S348 PolarHBondContact ND1-OG 3.09Å; H346-S348 PolarHBondContact O-N 2.98Å; H346-S348 VanDerWaalsContact O-N 3.11Å; H346-K349 WeakPolarHBondContact O-CB 3.33Å; H346-K349 PolarHBondContact O-N 2.83Å; H346-A350 PolarHBondContact O-N 3.37Å; H346-A350 VanDerWaalsContact O-N 3.14Å; H346-T366 WeakPolarHBondContact CA-OG1 3.38Å; H346-R367 PolarHBondContact NE2-NH2 2.89Å
347	P	94.2	Very high	91.4	Very high	16 Å²	16	58.1 Å²	58.1	10%	0.104	28%	0.278	C	S	.	.	H	α-helix	trans	-48.6	-41.7	-178.6	-32.8	37.1	0	0	0	115.1	K349 A350 N351 F363	P347-K349 VanDerWaalsContact C-N 3.32Å; P347-K349 PolarHBondContact O-N 2.81Å; P347-A350 WeakPolarHBondContact O-CB 3.27Å; P347-A350 PolarHBondContact O-N 2.87Å; P347-N351 VanDerWaalsContact O-CG 3.3Å; P347-N351 PolarHBondContact O-N 3.36Å; P347-N351 VanDerWaalsContact O-N 3.13Å; P347-N351 PolarHBondContact O-ND2 3.33Å; P347-N351 PolarHBondContact O-OD1 2.99Å; P347-F363 HydrophobicContact CB-CZ 4.3Å; P347-F363 HydrophobicContact CG-CE2 4.19Å; P347-F363 HydrophobicContact CG-CZ 4.21Å
348	S	94.3	Very high	91.5	Very high	63 Å²	63	55.9 Å²	55.9	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-38.5	177.7	-51.8	0	0	0	0	113.3	H346 N351	H346-S348 VanDerWaalsContact C-N 3.26Å; H346-S348 PolarHBondContact CE1-OG 3.22Å; H346-S348 VanDerWaalsContact CE1-OG 3.28Å; H346-S348 PolarHBondContact ND1-N 2.98Å; H346-S348 PolarHBondContact ND1-OG 3.09Å; H346-S348 PolarHBondContact O-N 2.98Å; H346-S348 VanDerWaalsContact O-N 3.11Å; S348-N351 WeakPolarHBondContact O-CB 3.1Å; S348-N351 PolarHBondContact O-N 3.15Å
349	K	93.6	Very high	91.7	Very high	108 Å²	108	55.8 Å²	55.8	47%	0.47	27%	0.267	S	S	.	.	H	α-helix	trans	-70.8	-36.4	177	-172.4	177.3	-178.5	-178.8	0	110.9	H346 P347 N351 E352 Y353	H346-K349 WeakPolarHBondContact O-CB 3.33Å; H346-K349 PolarHBondContact O-N 2.83Å; P347-K349 VanDerWaalsContact C-N 3.32Å; P347-K349 PolarHBondContact O-N 2.81Å; K349-N351 VanDerWaalsContact C-N 3.26Å; K349-N351 PolarHBondContact O-N 2.87Å; K349-E352 WeakPolarHBondContact O-CB 3.11Å; K349-E352 PolarHBondContact O-N 3.4Å; K349-Y353 WeakPolarHBondContact CE-OH 3.02Å; K349-Y353 HydrophobicContact CG-CE2 4.23Å; K349-Y353 VanDerWaalsContact O-CD2 3.3Å; K349-Y353 WeakPolarHBondContact O-CD2 3.33Å; K349-Y353 WeakPolarHBondContact O-CE2 3.1Å
350	A	93.5	Very high	92.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-39.3	174.6	0	0	0	0	0	112	H346 P347 E352 Y353 L361 F363 V374	H346-A350 PolarHBondContact O-N 3.37Å; H346-A350 VanDerWaalsContact O-N 3.14Å; P347-A350 WeakPolarHBondContact O-CB 3.27Å; P347-A350 PolarHBondContact O-N 2.87Å; A350-E352 VanDerWaalsContact C-N 3.28Å; A350-E352 PolarHBondContact O-N 2.84Å; A350-Y353 PolarHBondContact O-N 3.22Å; A350-L361 HydrophobicContact CB-CD1 4.27Å; A350-F363 HydrophobicContact CB-CD1 3.98Å; A350-F363 HydrophobicContact CB-CE1 3.75Å; A350-F363 HydrophobicContact CB-CE2 4.31Å; A350-F363 HydrophobicContact CB-CG 4.37Å; A350-F363 HydrophobicContact CB-CZ 3.92Å; A350-V374 HydrophobicContact CB-CG1 4.05Å
351	N	95	Very high	92.3	Very high	28 Å²	28	52.7 Å²	52.7	15%	0.15	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-32	179.1	-65	-20.7	0	0	0	113.9	P347 S348 K349 Y353 L354 V374 W385 H387	P347-N351 VanDerWaalsContact O-CG 3.3Å; P347-N351 PolarHBondContact O-N 3.36Å; P347-N351 VanDerWaalsContact O-N 3.13Å; P347-N351 PolarHBondContact O-ND2 3.33Å; P347-N351 PolarHBondContact O-OD1 2.99Å; S348-N351 WeakPolarHBondContact O-CB 3.1Å; S348-N351 PolarHBondContact O-N 3.15Å; K349-N351 VanDerWaalsContact C-N 3.26Å; K349-N351 PolarHBondContact O-N 2.87Å; N351-Y353 PolarHBondContact O-N 3.08Å; N351-L354 PolarHBondContact O-N 3.07Å; N351-L354 VanDerWaalsContact O-N 3.14Å; N351-V374 WeakPolarHBondContact OD1-CG2 2.77Å; N351-W385 HydrophobicContact CB-CD2 4.02Å; N351-W385 HydrophobicContact CB-CG 3.85Å; N351-W385 VanDerWaalsContact CG-CG 3.42Å; N351-W385 PolarHBondContact O-NE1 3.24Å; N351-W385 VanDerWaalsContact OD1-CB 3.25Å; N351-W385 WeakPolarHBondContact OD1-CB 3.39Å; N351-W385 VanDerWaalsContact OD1-CG 3.31Å; N351-H387 PolarHBondContact OD1-CE1 3.14Å; N351-H387 PolarHBondContact OD1-NE2 3.14Å
352	E	93.4	Very high	92.5	Very high	145 Å²	145	52.5 Å²	52.5	68%	0.678	25%	0.248	S	C	*	.	H	α-helix	trans	-63.7	-25.8	-178.5	-66.7	169.2	-159.3	0	0	112.2	K349 A350 L354	K349-E352 WeakPolarHBondContact O-CB 3.11Å; K349-E352 PolarHBondContact O-N 3.4Å; A350-E352 VanDerWaalsContact C-N 3.28Å; A350-E352 PolarHBondContact O-N 2.84Å; E352-L354 VanDerWaalsContact C-N 3.3Å; E352-L354 PolarHBondContact O-N 2.72Å
353	Y	90.7	Very high	92.7	Very high	93 Å²	93	51.2 Å²	51.2	37%	0.365	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.1	178.1	-59.3	-67.2	0	0	0	113.9	F342 K349 A350 N351 L361	F342-Y353 AromaticContact CD1-CD2 3.71Å; F342-Y353 HydrophobicContact CD1-CD2 3.71Å; F342-Y353 AromaticContact CD1-CE2 3.66Å; F342-Y353 HydrophobicContact CD1-CE2 3.66Å; F342-Y353 HydrophobicContact CD1-CG 4.2Å; F342-Y353 AromaticContact CE1-CD1 3.76Å; F342-Y353 HydrophobicContact CE1-CD1 3.76Å; F342-Y353 AromaticContact CE1-CD2 3.57Å; F342-Y353 HydrophobicContact CE1-CD2 3.57Å; F342-Y353 AromaticContact CE1-CE1 3.95Å; F342-Y353 HydrophobicContact CE1-CE1 3.95Å; F342-Y353 AromaticContact CE1-CE2 3.79Å; F342-Y353 HydrophobicContact CE1-CE2 3.79Å; F342-Y353 AromaticContact CE1-CG 3.56Å; F342-Y353 HydrophobicContact CE1-CG 3.56Å; F342-Y353 AromaticContact CE1-CZ 3.98Å; F342-Y353 HydrophobicContact CZ-CG 4.27Å; K349-Y353 WeakPolarHBondContact CE-OH 3.02Å; K349-Y353 HydrophobicContact CG-CE2 4.23Å; K349-Y353 VanDerWaalsContact O-CD2 3.3Å; K349-Y353 WeakPolarHBondContact O-CD2 3.33Å; K349-Y353 WeakPolarHBondContact O-CE2 3.1Å; A350-Y353 PolarHBondContact O-N 3.22Å; N351-Y353 PolarHBondContact O-N 3.08Å; Y353-L361 HydrophobicContact CD2-CD2 4.11Å; Y353-L361 HydrophobicContact CG-CD2 4.28Å
354	L	93.5	Very high	93	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.026	24%	0.242	C	C	.	.			trans	-103	112.1	-174.6	-52.6	-178.2	0	0	0	110.4	N351 E352 D359 L361 V374 K376 I445	N351-L354 PolarHBondContact O-N 3.07Å; N351-L354 VanDerWaalsContact O-N 3.14Å; E352-L354 VanDerWaalsContact C-N 3.3Å; E352-L354 PolarHBondContact O-N 2.72Å; L354-D359 HydrophobicContact CB-CB 4.16Å; L354-D359 HydrophobicContact CD2-CB 3.98Å; L354-L361 HydrophobicContact CD2-CD2 3.8Å; L354-L361 HydrophobicContact CD2-CG 4.07Å; L354-L361 HydrophobicContact CG-CD2 4.43Å; L354-V374 HydrophobicContact CD1-CB 4.34Å; L354-V374 HydrophobicContact CD1-CG1 3.94Å; L354-V374 HydrophobicContact CD1-CG2 3.74Å; L354-K376 HydrophobicContact CB-CB 3.69Å; L354-K376 HydrophobicContact CB-CD 4.11Å; L354-K376 HydrophobicContact CD1-CB 4.11Å; L354-K376 WeakPolarHBondContact O-CD 3.35Å; L354-K376 PolarHBondContact O-NZ 2.78Å; L354-K376 VanDerWaalsContact O-NZ 3.08Å; L354-I445 HydrophobicContact CD2-CB 4.31Å; L354-I445 HydrophobicContact CD2-CG1 3.6Å
355	E	89.8	Confident	93.2	Very high	147 Å²	147	46.2 Å²	46.2	69%	0.687	22%	0.219	S	C	*	.			trans	-104.8	-38.6	-170.9	-69.6	-175.7	-175.7	0	0	112.9	D359 K376	E355-D359 PolarHBondContact N-OD2 2.72Å; E355-K376 VanDerWaalsContact C-NZ 3.26Å; E355-K376 WeakPolarHBondContact O-CE 3.37Å; E355-K376 PolarHBondContact O-NZ 3.4Å
356	R	90	Very high	93.4	Very high	177 Å²	177	49.5 Å²	49.5	67%	0.668	24%	0.239	S	C	*	.	S	Bend	trans	-113.9	162	-174.3	-52.7	176.1	-177.9	173.6	0.1	111.6	G358 D359	R356-G358 PolarHBondContact O-N 3.37Å; R356-D359 WeakPolarHBondContact CB-OD1 2.97Å; R356-D359 PolarHBondContact N-OD2 3.47Å; R356-D359 VanDerWaalsContact O-CB 3.28Å; R356-D359 WeakPolarHBondContact O-CB 3.46Å; R356-D359 PolarHBondContact O-N 3.41Å
357	N	89.8	Confident	93.2	Very high	76 Å²	76	54.9 Å²	54.9	41%	0.406	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	132.2	175.3	-172.9	49.5	0	0	0	110.9	D359 I377 S378	N357-D359 PolarHBondContact O-N 3.09Å; N357-I377 WeakPolarHBondContact OD1-CA 3.49Å; N357-S378 WeakPolarHBondContact CB-OG 3.3Å; N357-S378 PolarHBondContact OD1-N 3.37Å; N357-S378 PolarHBondContact OD1-O 2.91Å
358	G	89.6	Confident	93	Very high	3 Å²	3	57.1 Å²	57.1	3%	0.031	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	4.5	-178.9	0	0	0	0	0	114.4	R356 K376 I442 N443	R356-G358 PolarHBondContact O-N 3.37Å; G358-K376 PolarHBondContact N-O 3.42Å; G358-I442 PolarHBondContact O-N 3.05Å; G358-N443 PolarHBondContact O-N 3.39Å
359	D	93.9	Very high	92.8	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.027	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	135.5	167.3	-72.4	4.6	0	0	0	109.5	L354 E355 R356 N357 V375 K376 N443 I445	L354-D359 HydrophobicContact CB-CB 4.16Å; L354-D359 HydrophobicContact CD2-CB 3.98Å; E355-D359 PolarHBondContact N-OD2 2.72Å; R356-D359 WeakPolarHBondContact CB-OD1 2.97Å; R356-D359 PolarHBondContact N-OD2 3.47Å; R356-D359 VanDerWaalsContact O-CB 3.28Å; R356-D359 WeakPolarHBondContact O-CB 3.46Å; R356-D359 PolarHBondContact O-N 3.41Å; N357-D359 PolarHBondContact O-N 3.09Å; D359-V375 WeakPolarHBondContact O-CA 3.43Å; D359-K376 PolarHBondContact O-N 3.09Å; D359-N443 WeakPolarHBondContact CA-O 3.32Å; D359-N443 VanDerWaalsContact OD1-CB 3.29Å; D359-N443 WeakPolarHBondContact OD1-CB 3.48Å; D359-N443 PolarHBondContact OD1-ND2 2.84Å; D359-I445 HydrophobicContact CB-CD1 3.9Å; D359-I445 HydrophobicContact CB-CG1 3.9Å
360	F	95.3	Very high	92.7	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	155.5	-179.8	72.9	-88.6	0	0	0	113.4	Y340 L373 V374 V375 I416 L441 N443 P444 I445	Y340-F360 HydrophobicContact CD2-CE2 4.36Å; Y340-F360 HydrophobicContact CG-CE2 4.46Å; F360-L373 HydrophobicContact CB-CD1 4.14Å; F360-L373 HydrophobicContact CD2-CD1 3.86Å; F360-L373 HydrophobicContact CG-CD1 4.39Å; F360-V374 WeakPolarHBondContact CA-O 3.1Å; F360-V374 WeakPolarHBondContact CB-O 3.41Å; F360-V375 HydrophobicContact CB-CB 4.44Å; F360-V375 HydrophobicContact CB-CG1 4.38Å; F360-V375 HydrophobicContact CB-CG2 3.96Å; F360-I416 HydrophobicContact CE2-CG2 3.69Å; F360-I416 HydrophobicContact CZ-CG2 4.2Å; F360-L441 HydrophobicContact CB-CD2 4.04Å; F360-L441 HydrophobicContact CD1-CB 3.7Å; F360-L441 HydrophobicContact CD1-CD2 4.26Å; F360-L441 HydrophobicContact CD1-CG 4.46Å; F360-L441 HydrophobicContact CD2-CD1 4.45Å; F360-L441 HydrophobicContact CE1-CB 3.64Å; F360-L441 HydrophobicContact CE2-CD1 4.46Å; F360-L441 HydrophobicContact CG-CB 4.22Å; F360-L441 HydrophobicContact CG-CD2 4.04Å; F360-L441 HydrophobicContact CZ-CB 4.11Å; F360-N443 WeakPolarHBondContact CD1-O 3.48Å; F360-N443 VanDerWaalsContact CE1-C 3.48Å; F360-N443 PolarHBondContact N-O 3.4Å; F360-P444 HydrophobicContact CE1-CB 3.9Å; F360-P444 HydrophobicContact CE1-CG 4.31Å; F360-P444 HydrophobicContact CE2-CB 3.9Å; F360-P444 HydrophobicContact CZ-CB 3.47Å; F360-P444 VanDerWaalsContact CZ-CB 3.47Å; F360-P444 HydrophobicContact CZ-CG 4.1Å; F360-I445 PolarHBondContact O-N 3.45Å
361	L	95.6	Very high	92.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	167.1	170.4	64.6	83.4	0	0	0	110.9	F342 A350 Y353 L354 F363 V374 I445	F342-L361 HydrophobicContact CB-CD1 4.22Å; F342-L361 HydrophobicContact CD1-CD2 4.26Å; F342-L361 HydrophobicContact CD2-CB 3.84Å; F342-L361 HydrophobicContact CD2-CD1 4.04Å; F342-L361 HydrophobicContact CD2-CD2 3.91Å; F342-L361 HydrophobicContact CD2-CG 4.15Å; F342-L361 HydrophobicContact CE1-CD2 4.17Å; F342-L361 HydrophobicContact CE2-CB 3.88Å; F342-L361 HydrophobicContact CE2-CD2 3.82Å; F342-L361 HydrophobicContact CE2-CG 4.34Å; F342-L361 HydrophobicContact CG-CD1 4.12Å; F342-L361 HydrophobicContact CG-CD2 4.14Å; F342-L361 HydrophobicContact CZ-CD2 3.96Å; A350-L361 HydrophobicContact CB-CD1 4.27Å; Y353-L361 HydrophobicContact CD2-CD2 4.11Å; Y353-L361 HydrophobicContact CG-CD2 4.28Å; L354-L361 HydrophobicContact CD2-CD2 3.8Å; L354-L361 HydrophobicContact CD2-CG 4.07Å; L354-L361 HydrophobicContact CG-CD2 4.43Å; L361-F363 HydrophobicContact CD1-CB 4.31Å; L361-F363 HydrophobicContact CD1-CD1 3.77Å; L361-F363 HydrophobicContact CD1-CG 4.43Å; L361-V374 HydrophobicContact CD1-CG1 3.54Å; L361-V374 HydrophobicContact CG-CG1 3.66Å; L361-V374 PolarHBondContact N-O 3.16Å; L361-V374 VanDerWaalsContact N-O 3.11Å; L361-V374 PolarHBondContact O-N 3.14Å; L361-I445 HydrophobicContact CB-CB 4.44Å
362	V	95.2	Very high	92.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.2	176.6	-177.7	0	0	0	0	109.8	L335 Y340 F341 F342 T372 L373 I390 I416	L335-V362 HydrophobicContact CD1-CG1 3.84Å; Y340-V362 HydrophobicContact CD2-CB 4.36Å; Y340-V362 HydrophobicContact CD2-CG2 3.89Å; Y340-V362 HydrophobicContact CE2-CG2 3.94Å; Y340-V362 PolarHBondContact O-N 2.9Å; F341-V362 CarbonylContact C-O 3.55Å; F341-V362 VanDerWaalsContact CA-O 3.28Å; F341-V362 WeakPolarHBondContact CA-O 3.26Å; F341-V362 HydrophobicContact CD2-CB 4.32Å; F341-V362 HydrophobicContact CD2-CG1 4.05Å; F341-V362 WeakPolarHBondContact CD2-O 3.38Å; F342-V362 PolarHBondContact N-O 2.87Å; V362-T372 WeakPolarHBondContact CA-O 3.32Å; V362-L373 HydrophobicContact CG2-CD1 4.08Å; V362-I390 HydrophobicContact CG1-CD1 3.85Å; V362-I416 HydrophobicContact CG2-CD1 4.35Å; V362-I416 HydrophobicContact CG2-CG1 4.29Å
363	F	94.9	Very high	92.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	164.4	176.7	68	-75.8	0	0	0	110.7	F342 G343 C345 P347 A350 L361 A371 T372 V374 H387	F342-F363 HydrophobicContact CB-CB 4.19Å; G343-F363 CarbonylContact O-C 3.59Å; G343-F363 WeakPolarHBondContact O-CA 3.47Å; G343-F363 WeakPolarHBondContact O-CB 3.39Å; C345-F363 HydrophobicContact CB-CD2 4.48Å; C345-F363 VanDerWaalsContact O-CD2 3.32Å; C345-F363 WeakPolarHBondContact O-CD2 3.19Å; C345-F363 WeakPolarHBondContact O-CE2 3.47Å; C345-F363 WeakPolarHBondContact SG-CB 3.31Å; C345-F363 WeakPolarHBondContact SG-CD2 3.38Å; C345-F363 WeakPolarHBondContact SG-CG 3.12Å; P347-F363 HydrophobicContact CB-CZ 4.3Å; P347-F363 HydrophobicContact CG-CE2 4.19Å; P347-F363 HydrophobicContact CG-CZ 4.21Å; A350-F363 HydrophobicContact CB-CD1 3.98Å; A350-F363 HydrophobicContact CB-CE1 3.75Å; A350-F363 HydrophobicContact CB-CE2 4.31Å; A350-F363 HydrophobicContact CB-CG 4.37Å; A350-F363 HydrophobicContact CB-CZ 3.92Å; L361-F363 HydrophobicContact CD1-CB 4.31Å; L361-F363 HydrophobicContact CD1-CD1 3.77Å; L361-F363 HydrophobicContact CD1-CG 4.43Å; F363-A371 CarbonylContact O-C 3.59Å; F363-A371 WeakPolarHBondContact O-CA 3.41Å; F363-T372 WeakPolarHBondContact CD1-O 3.41Å; F363-T372 HydrophobicContact CE1-CG2 3.97Å; F363-T372 HydrophobicContact CZ-CG2 4.04Å; F363-T372 PolarHBondContact N-O 3.07Å; F363-T372 PolarHBondContact O-N 3.12Å; F363-V374 HydrophobicContact CD1-CG1 4.06Å; F363-V374 HydrophobicContact CE1-CB 3.94Å; F363-V374 HydrophobicContact CE1-CG1 3.73Å; F363-H387 AromaticContact CZ-CD2 3.95Å
364	V	94.6	Very high	93.1	Very high	12 Å²	12	44.1 Å²	44.1	7%	0.073	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.5	166.2	177.5	0	0	0	0	107.8	F341 G343 E344 C345 T366	F341-V364 HydrophobicContact CE2-CG2 4.07Å; F341-V364 HydrophobicContact CZ-CG2 4.01Å; G343-V364 PolarHBondContact O-N 3.06Å; E344-V364 WeakPolarHBondContact CA-O 3.48Å; E344-V364 HydrophobicContact CG-CB 3.85Å; E344-V364 HydrophobicContact CG-CG1 3.99Å; C345-V364 PolarHBondContact N-O 2.96Å; V364-T366 PolarHBondContact O-N 3.35Å
365	S	94.9	Very high	93	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.042	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122.5	-177	168.5	0	0	0	0	110.7	C345 R367 S368 G369 R370	C345-S365 WeakPolarHBondContact O-CA 3.45Å; S365-R367 PolarHBondContact O-N 2.9Å; S365-R367 VanDerWaalsContact O-N 3.1Å; S365-R367 PolarHBondContact OG-N 3.24Å; S365-S368 WeakPolarHBondContact CB-OG 3.36Å; S365-S368 PolarHBondContact O-N 3.13Å; S365-S368 PolarHBondContact OG-N 3Å; S365-S368 PolarHBondContact OG-OG 3.3Å; S365-G369 WeakPolarHBondContact O-CA 3.34Å; S365-G369 PolarHBondContact O-N 2.88Å; S365-R370 PolarHBondContact N-O 3.45Å
366	T	93.1	Very high	93.1	Very high	82 Å²	82	38.2 Å²	38.2	50%	0.503	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.8	174.6	56.3	0	0	0	0	113.2	E344 C345 H346 V364	E344-T366 HydrophobicContact CB-CG2 4.41Å; C345-T366 PolarHBondContact O-N 2.89Å; C345-T366 VanDerWaalsContact O-N 3.13Å; H346-T366 WeakPolarHBondContact CA-OG1 3.38Å; V364-T366 PolarHBondContact O-N 3.35Å
367	R	91.9	Very high	93	Very high	185 Å²	185	30.1 Å²	30.1	70%	0.698	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-37.1	176.1	-174.8	179.8	-66.4	174.8	0.1	112.9	H346 S365	H346-R367 PolarHBondContact NE2-NH2 2.89Å; S365-R367 PolarHBondContact O-N 2.9Å; S365-R367 VanDerWaalsContact O-N 3.1Å; S365-R367 PolarHBondContact OG-N 3.24Å
368	S	90.7	Very high	92.7	Very high	63 Å²	63	28.1 Å²	28.1	44%	0.441	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-15	-174.1	61	0	0	0	0	113.9	S365 R370	S365-S368 WeakPolarHBondContact CB-OG 3.36Å; S365-S368 PolarHBondContact O-N 3.13Å; S365-S368 PolarHBondContact OG-N 3Å; S365-S368 PolarHBondContact OG-OG 3.3Å; S368-R370 PolarHBondContact O-N 3.49Å; S368-R370 PolarHBondContact OG-N 3.38Å
369	G	89.9	Confident	92.1	Very high	57 Å²	57	31.1 Å²	31.1	59%	0.588	17%	0.17	S	C	*	.	S	Bend	trans	68.3	11.7	-169.8	0	0	0	0	0	113.7	S365	S365-G369 WeakPolarHBondContact O-CA 3.34Å; S365-G369 PolarHBondContact O-N 2.88Å
370	R	92	Very high	91.2	Very high	96 Å²	96	40.6 Å²	40.6	36%	0.362	21%	0.214	S	C	.	.	S	Bend	trans	-112.2	143.5	-172.2	-60.2	-173.3	68	-179.9	0.6	112.4	S365 S368 T372 I390 Q391	S365-R370 PolarHBondContact N-O 3.45Å; S368-R370 PolarHBondContact O-N 3.49Å; S368-R370 PolarHBondContact OG-N 3.38Å; R370-T372 PolarHBondContact O-N 2.82Å; R370-T372 PolarHBondContact O-OG1 3.49Å; R370-I390 PolarHBondContact NH2-O 2.86Å; R370-I390 VanDerWaalsContact NH2-O 3.16Å; R370-Q391 VanDerWaalsContact CZ-OE1 3.28Å
371	A	94.4	Very high	90.2	Very high	5 Å²	5	46.2 Å²	46.2	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	127.9	166.9	0	0	0	0	0	109.5	P240 L335 F363 I390	P240-A371 HydrophobicContact CG-CB 4.26Å; L335-A371 HydrophobicContact CD2-CB 4.25Å; F363-A371 CarbonylContact O-C 3.59Å; F363-A371 WeakPolarHBondContact O-CA 3.41Å; A371-I390 HydrophobicContact CB-CB 4.26Å; A371-I390 HydrophobicContact CB-CD1 4.07Å; A371-I390 WeakPolarHBondContact O-CB 3.48Å; A371-I390 PolarHBondContact O-N 2.99Å
372	T	95.5	Very high	89.3	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	130.4	-169.8	-57.6	0	0	0	0	108.5	V362 F363 R370 H387	V362-T372 WeakPolarHBondContact CA-O 3.32Å; F363-T372 WeakPolarHBondContact CD1-O 3.41Å; F363-T372 HydrophobicContact CE1-CG2 3.97Å; F363-T372 HydrophobicContact CZ-CG2 4.04Å; F363-T372 PolarHBondContact N-O 3.07Å; F363-T372 PolarHBondContact O-N 3.12Å; R370-T372 PolarHBondContact O-N 2.82Å; R370-T372 PolarHBondContact O-OG1 3.49Å; T372-H387 HydrophobicContact CG2-CB 4.15Å
373	L	95.4	Very high	88.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	130.3	169.1	171.4	67	0	0	0	108.2	F360 V362 V375 V388 L400 I416 L426 L441	F360-L373 HydrophobicContact CB-CD1 4.14Å; F360-L373 HydrophobicContact CD2-CD1 3.86Å; F360-L373 HydrophobicContact CG-CD1 4.39Å; V362-L373 HydrophobicContact CG2-CD1 4.08Å; L373-V375 HydrophobicContact CD1-CG2 4.36Å; L373-V375 HydrophobicContact CD2-CG2 4.37Å; L373-V375 HydrophobicContact CG-CG2 4.08Å; L373-V388 HydrophobicContact CB-CB 4.41Å; L373-V388 PolarHBondContact N-O 3.11Å; L373-V388 PolarHBondContact O-N 3.18Å; L373-L400 HydrophobicContact CB-CD2 4.41Å; L373-L400 HydrophobicContact CD2-CD1 3.6Å; L373-L400 HydrophobicContact CD2-CD2 4.18Å; L373-I416 HydrophobicContact CD1-CD1 4.03Å; L373-I416 HydrophobicContact CD2-CD1 3.96Å; L373-I416 HydrophobicContact CG-CD1 4.45Å; L373-L426 HydrophobicContact CD2-CD1 4.47Å; L373-L441 HydrophobicContact CD1-CD1 4.43Å; L373-L441 HydrophobicContact CD1-CD2 4.33Å; L373-L441 HydrophobicContact CD2-CD1 4Å; L373-L441 HydrophobicContact CD2-CD2 4.01Å
374	V	94	Very high	88.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138	169.5	59.2	0	0	0	0	110.5	A350 N351 L354 F360 L361 F363 W385 W386	A350-V374 HydrophobicContact CB-CG1 4.05Å; N351-V374 WeakPolarHBondContact OD1-CG2 2.77Å; L354-V374 HydrophobicContact CD1-CB 4.34Å; L354-V374 HydrophobicContact CD1-CG1 3.94Å; L354-V374 HydrophobicContact CD1-CG2 3.74Å; F360-V374 WeakPolarHBondContact CA-O 3.1Å; F360-V374 WeakPolarHBondContact CB-O 3.41Å; L361-V374 HydrophobicContact CD1-CG1 3.54Å; L361-V374 HydrophobicContact CG-CG1 3.66Å; L361-V374 PolarHBondContact N-O 3.16Å; L361-V374 VanDerWaalsContact N-O 3.11Å; L361-V374 PolarHBondContact O-N 3.14Å; F363-V374 HydrophobicContact CD1-CG1 4.06Å; F363-V374 HydrophobicContact CE1-CB 3.94Å; F363-V374 HydrophobicContact CE1-CG1 3.73Å; V374-W385 HydrophobicContact CG2-CB 4.24Å; V374-W386 CarbonylContact C-O 3.57Å; V374-W386 VanDerWaalsContact CA-O 3.24Å; V374-W386 WeakPolarHBondContact CA-O 3.32Å
375	V	93.2	Very high	88.1	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133	179.3	-168.3	0	0	0	0	109.6	D359 F360 L373 W385 W386 L426 V439 L441	D359-V375 WeakPolarHBondContact O-CA 3.43Å; F360-V375 HydrophobicContact CB-CB 4.44Å; F360-V375 HydrophobicContact CB-CG1 4.38Å; F360-V375 HydrophobicContact CB-CG2 3.96Å; L373-V375 HydrophobicContact CD1-CG2 4.36Å; L373-V375 HydrophobicContact CD2-CG2 4.37Å; L373-V375 HydrophobicContact CG-CG2 4.08Å; V375-W385 WeakPolarHBondContact O-CA 3.49Å; V375-W386 PolarHBondContact N-O 3.42Å; V375-W386 PolarHBondContact O-N 2.99Å; V375-L426 HydrophobicContact CG2-CD1 4.07Å; V375-V439 HydrophobicContact CB-CG1 4.2Å; V375-V439 HydrophobicContact CG1-CG1 3.83Å; V375-L441 HydrophobicContact CB-CD2 4.49Å; V375-L441 HydrophobicContact CG1-CD2 4.3Å; V375-L441 HydrophobicContact CG2-CD2 3.35Å
376	K	91.7	Very high	87.8	Confident	29 Å²	29	57.6 Å²	57.6	13%	0.126	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.2	171.2	177	169.6	-173.8	174.4	0	110.2	L354 E355 G358 D359 T383	L354-K376 HydrophobicContact CB-CB 3.69Å; L354-K376 HydrophobicContact CB-CD 4.11Å; L354-K376 HydrophobicContact CD1-CB 4.11Å; L354-K376 WeakPolarHBondContact O-CD 3.35Å; L354-K376 PolarHBondContact O-NZ 2.78Å; L354-K376 VanDerWaalsContact O-NZ 3.08Å; E355-K376 VanDerWaalsContact C-NZ 3.26Å; E355-K376 WeakPolarHBondContact O-CE 3.37Å; E355-K376 PolarHBondContact O-NZ 3.4Å; G358-K376 PolarHBondContact N-O 3.42Å; D359-K376 PolarHBondContact O-N 3.09Å; K376-T383 HydrophobicContact CG-CG2 4.46Å
377	I	86.8	Confident	87.7	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.036	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.2	178.1	-60.3	149.2	0	0	0	106.8	N357 T383 A384 W386 L437 V439	N357-I377 WeakPolarHBondContact OD1-CA 3.49Å; I377-T383 CarbonylContact O-C 3.59Å; I377-T383 WeakPolarHBondContact O-CA 3.38Å; I377-A384 PolarHBondContact N-O 3.2Å; I377-A384 PolarHBondContact O-N 3.27Å; I377-W386 HydrophobicContact CD1-CB 3.8Å; I377-W386 HydrophobicContact CD1-CD2 3.25Å; I377-W386 HydrophobicContact CD1-CE3 3.98Å; I377-W386 HydrophobicContact CD1-CG 3.16Å; I377-W386 HydrophobicContact CD1-CZ2 4.12Å; I377-L437 HydrophobicContact CG2-CB 4.33Å; I377-L437 HydrophobicContact CG2-CD1 3.47Å; I377-L437 VanDerWaalsContact CG2-CD1 3.47Å; I377-V439 HydrophobicContact CD1-CB 4.19Å; I377-V439 HydrophobicContact CD1-CG1 3.74Å; I377-V439 HydrophobicContact CD1-CG2 3.35Å; I377-V439 HydrophobicContact CG1-CB 4.35Å; I377-V439 HydrophobicContact CG1-CG1 3.73Å; I377-V439 HydrophobicContact CG1-CG2 3.74Å
378	S	83.1	Confident	87.7	Confident	33 Å²	33	47.5 Å²	47.5	23%	0.231	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.9	177	58.7	0	0	0	0	110.7	N357 T382 T383	N357-S378 WeakPolarHBondContact CB-OG 3.3Å; N357-S378 PolarHBondContact OD1-N 3.37Å; N357-S378 PolarHBondContact OD1-O 2.91Å; S378-T382 CarbonylContact C-O 3.56Å; S378-T382 VanDerWaalsContact CA-O 3.25Å; S378-T382 WeakPolarHBondContact CA-O 3.15Å; S378-T383 WeakPolarHBondContact CB-OG1 3.34Å
379	N	78	Confident	87.8	Confident	67 Å²	67	46.3 Å²	46.3	36%	0.358	25%	0.253	S	S	.	.			trans	-116	-172	164.4	72.1	19.3	0	0	0	109.2	T381 T382 L437	N379-T381 PolarHBondContact O-N 3.15Å; N379-T381 VanDerWaalsContact O-N 3.1Å; N379-T381 WeakPolarHBondContact OD1-CA 3.43Å; N379-T381 PolarHBondContact OD1-N 3.3Å; N379-T381 PolarHBondContact OD1-OG1 3.13Å; N379-T382 PolarHBondContact N-O 2.83Å; N379-T382 PolarHBondContact ND2-OG1 3.08Å; N379-T382 PolarHBondContact OD1-N 2.95Å; N379-T382 PolarHBondContact OD1-OG1 3.28Å; N379-T382 VanDerWaalsContact OD1-OG1 3.07Å; N379-L437 HydrophobicContact CB-CD1 4.36Å
380	E	75.7	Confident	88	Confident	204 Å²	204	44 Å²	44	95%	0.953	23%	0.227	S	C	*	.	S	Bend	trans	-59.3	-22.2	-179.6	-62.7	-178.1	176.6	0	0	114.2
381	T	74.4	Confident	88.1	Confident	119 Å²	119	41.6 Å²	41.6	73%	0.73	22%	0.22	S	C	*	.	S	Bend	trans	-117.1	-25.5	-169.6	59.8	0	0	0	0	114.2	N379	N379-T381 PolarHBondContact O-N 3.15Å; N379-T381 VanDerWaalsContact O-N 3.1Å; N379-T381 WeakPolarHBondContact OD1-CA 3.43Å; N379-T381 PolarHBondContact OD1-N 3.3Å; N379-T381 PolarHBondContact OD1-OG1 3.13Å
382	T	76.1	Confident	88	Confident	61 Å²	61	44.8 Å²	44.8	37%	0.374	23%	0.234	S	C	.	.			trans	-139.4	142	-170.8	60.7	0	0	0	0	111.1	S378 N379	S378-T382 CarbonylContact C-O 3.56Å; S378-T382 VanDerWaalsContact CA-O 3.25Å; S378-T382 WeakPolarHBondContact CA-O 3.15Å; N379-T382 PolarHBondContact N-O 2.83Å; N379-T382 PolarHBondContact ND2-OG1 3.08Å; N379-T382 PolarHBondContact OD1-N 2.95Å; N379-T382 PolarHBondContact OD1-OG1 3.28Å; N379-T382 VanDerWaalsContact OD1-OG1 3.07Å
383	T	84.8	Confident	87.8	Confident	74 Å²	74	46.7 Å²	46.7	45%	0.454	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.2	167	-65.8	0	0	0	0	108	K376 I377 S378 W385	K376-T383 HydrophobicContact CG-CG2 4.46Å; I377-T383 CarbonylContact O-C 3.59Å; I377-T383 WeakPolarHBondContact O-CA 3.38Å; S378-T383 WeakPolarHBondContact CB-OG1 3.34Å; T383-W385 HydrophobicContact CG2-CH2 4.03Å; T383-W385 HydrophobicContact CG2-CZ2 4.12Å; T383-W385 HydrophobicContact CG2-CZ3 4.4Å
384	A	85.6	Confident	87.5	Confident	17 Å²	17	52.5 Å²	52.5	14%	0.14	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	159.6	179.8	0	0	0	0	0	110.5	I377	I377-A384 PolarHBondContact N-O 3.2Å; I377-A384 PolarHBondContact O-N 3.27Å
385	W	88.6	Confident	87.3	Confident	99 Å²	99	54.2 Å²	54.2	38%	0.375	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.5	175.5	-62.7	-96.7	0	0	0	109.4	N351 V374 V375 T383 H387	N351-W385 HydrophobicContact CB-CD2 4.02Å; N351-W385 HydrophobicContact CB-CG 3.85Å; N351-W385 VanDerWaalsContact CG-CG 3.42Å; N351-W385 PolarHBondContact O-NE1 3.24Å; N351-W385 VanDerWaalsContact OD1-CB 3.25Å; N351-W385 WeakPolarHBondContact OD1-CB 3.39Å; N351-W385 VanDerWaalsContact OD1-CG 3.31Å; V374-W385 HydrophobicContact CG2-CB 4.24Å; V375-W385 WeakPolarHBondContact O-CA 3.49Å; T383-W385 HydrophobicContact CG2-CH2 4.03Å; T383-W385 HydrophobicContact CG2-CZ2 4.12Å; T383-W385 HydrophobicContact CG2-CZ3 4.4Å; W385-H387 PolarHBondContact O-ND1 2.85Å
386	W	89	Confident	87.2	Confident	7 Å²	7	54.3 Å²	54.3	3%	0.027	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.9	177.7	-77	20.6	0	0	0	109.5	V374 V375 I377 Y430 R431 T433 V439	V374-W386 CarbonylContact C-O 3.57Å; V374-W386 VanDerWaalsContact CA-O 3.24Å; V374-W386 WeakPolarHBondContact CA-O 3.32Å; V375-W386 PolarHBondContact N-O 3.42Å; V375-W386 PolarHBondContact O-N 2.99Å; I377-W386 HydrophobicContact CD1-CB 3.8Å; I377-W386 HydrophobicContact CD1-CD2 3.25Å; I377-W386 HydrophobicContact CD1-CE3 3.98Å; I377-W386 HydrophobicContact CD1-CG 3.16Å; I377-W386 HydrophobicContact CD1-CZ2 4.12Å; W386-Y430 WeakPolarHBondContact CZ2-O 3.43Å; W386-R431 HydrophobicContact CH2-CG 3.84Å; W386-R431 HydrophobicContact CZ2-CG 4.35Å; W386-T433 PolarHBondContact NE1-OG1 3.21Å; W386-V439 HydrophobicContact CD2-CG2 4.11Å; W386-V439 HydrophobicContact CE3-CB 4.23Å; W386-V439 HydrophobicContact CE3-CG1 4.44Å; W386-V439 HydrophobicContact CE3-CG2 3.69Å; W386-V439 HydrophobicContact CH2-CG2 3.55Å; W386-V439 HydrophobicContact CZ2-CG2 3.99Å; W386-V439 HydrophobicContact CZ3-CB 4.09Å; W386-V439 HydrophobicContact CZ3-CG2 3.41Å; W386-V439 VanDerWaalsContact CZ3-CG2 3.41Å
387	H	90.9	Very high	87.3	Confident	54 Å²	54	54.8 Å²	54.8	25%	0.25	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.6	177.5	-63.4	77.5	0	0	0	108.4	N351 F363 T372 W385	N351-H387 PolarHBondContact OD1-CE1 3.14Å; N351-H387 PolarHBondContact OD1-NE2 3.14Å; F363-H387 AromaticContact CZ-CD2 3.95Å; T372-H387 HydrophobicContact CG2-CB 4.15Å; W385-H387 PolarHBondContact O-ND1 2.85Å
388	V	91.7	Very high	87.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	105.7	-174.9	-178.1	0	0	0	0	108.3	L373 I390 L400 L426 Y430	L373-V388 HydrophobicContact CB-CB 4.41Å; L373-V388 PolarHBondContact N-O 3.11Å; L373-V388 PolarHBondContact O-N 3.18Å; V388-I390 PolarHBondContact O-N 3.34Å; V388-L400 HydrophobicContact CG1-CB 4.04Å; V388-L400 HydrophobicContact CG1-CD2 3.85Å; V388-L400 HydrophobicContact CG1-CG 4.42Å; V388-L426 HydrophobicContact CG2-CD1 4.3Å; V388-Y430 HydrophobicContact CB-CE1 4.46Å; V388-Y430 HydrophobicContact CB-CE2 4.47Å; V388-Y430 HydrophobicContact CG1-CE1 4.38Å; V388-Y430 HydrophobicContact CG1-CE2 3.78Å; V388-Y430 HydrophobicContact CG2-CD1 4.21Å; V388-Y430 HydrophobicContact CG2-CD2 4.09Å; V388-Y430 HydrophobicContact CG2-CE1 4.22Å; V388-Y430 HydrophobicContact CG2-CE2 4.1Å; V388-Y430 HydrophobicContact CG2-CG 4.15Å
389	P	92.5	Very high	88.2	Confident	38 Å²	38	54.9 Å²	54.9	25%	0.247	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	127.9	177.7	-16.9	30.4	0	0	0	110.4	Q391	P389-Q391 PolarHBondContact O-N 3.44Å; P389-Q391 PolarHBondContact O-NE2 3.05Å
390	I	94.9	Very high	88.9	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.041	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-73.2	124.7	175.1	-60.1	164.8	0	0	0	108	V362 R370 A371 V388 F398 L400 V412 L415	V362-I390 HydrophobicContact CG1-CD1 3.85Å; R370-I390 PolarHBondContact NH2-O 2.86Å; R370-I390 VanDerWaalsContact NH2-O 3.16Å; A371-I390 HydrophobicContact CB-CB 4.26Å; A371-I390 HydrophobicContact CB-CD1 4.07Å; A371-I390 WeakPolarHBondContact O-CB 3.48Å; A371-I390 PolarHBondContact O-N 2.99Å; V388-I390 PolarHBondContact O-N 3.34Å; I390-F398 HydrophobicContact CG2-CB 4.5Å; I390-F398 HydrophobicContact CG2-CD1 3.94Å; I390-L400 HydrophobicContact CB-CD2 4.48Å; I390-L400 HydrophobicContact CG1-CD2 3.7Å; I390-V412 HydrophobicContact CD1-CG1 3.77Å; I390-V412 HydrophobicContact CD1-CG2 4.39Å; I390-V412 HydrophobicContact CG2-CG2 4.38Å; I390-L415 HydrophobicContact CG2-CD2 4.04Å
391	Q	94	Very high	89.5	Confident	46 Å²	46	42.6 Å²	42.6	22%	0.215	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	147.6	-178.9	-53.3	-63.7	-39	0	0	110.9	R370 P389 F398 W399	R370-Q391 VanDerWaalsContact CZ-OE1 3.28Å; P389-Q391 PolarHBondContact O-N 3.44Å; P389-Q391 PolarHBondContact O-NE2 3.05Å; Q391-F398 CarbonylContact O-C 3.5Å; Q391-F398 VanDerWaalsContact O-CA 3.23Å; Q391-F398 WeakPolarHBondContact O-CA 3.35Å; Q391-W399 HydrophobicContact CB-CD2 3.55Å; Q391-W399 HydrophobicContact CB-CE3 4.18Å; Q391-W399 HydrophobicContact CB-CG 3.91Å; Q391-W399 HydrophobicContact CB-CH2 4.02Å; Q391-W399 HydrophobicContact CB-CZ2 3.42Å; Q391-W399 VanDerWaalsContact CB-CZ2 3.42Å; Q391-W399 HydrophobicContact CB-CZ3 4.4Å; Q391-W399 VanDerWaalsContact CB-NE1 3.31Å; Q391-W399 HydrophobicContact CG-CZ2 4.27Å; Q391-W399 PolarHBondContact N-O 3.05Å; Q391-W399 PolarHBondContact O-N 2.88Å
392	E	93	Very high	90.1	Very high	72 Å²	72	41.1 Å²	41.1	34%	0.336	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	141.8	175.9	-175.5	-176.7	-177.5	0	0	108.6	P240 Y397 F398 W399	P240-E392 WeakPolarHBondContact CB-OE2 3.43Å; E392-Y397 WeakPolarHBondContact CA-O 3.47Å; E392-F398 HydrophobicContact CB-CD1 4.19Å; E392-F398 HydrophobicContact CB-CE1 4.01Å; E392-F398 HydrophobicContact CG-CD1 4.42Å; E392-F398 HydrophobicContact CG-CE1 3.98Å; E392-F398 HydrophobicContact CG-CZ 4.11Å; E392-W399 WeakPolarHBondContact O-CH2 3.33Å
393	N	91.2	Very high	90.5	Very high	46 Å²	46	40.5 Å²	40.5	25%	0.246	23%	0.227	C	C	.	.			trans	-105.7	171	175.2	62.3	23	0	0	0	110.7	A395 G396 Y397 W399	N393-A395 PolarHBondContact O-N 3.24Å; N393-A395 WeakPolarHBondContact OD1-CA 3.39Å; N393-A395 WeakPolarHBondContact OD1-CB 3.2Å; N393-A395 PolarHBondContact OD1-N 3.09Å; N393-G396 PolarHBondContact O-N 2.81Å; N393-G396 PolarHBondContact OD1-N 3.04Å; N393-Y397 PolarHBondContact N-O 2.99Å; N393-Y397 PolarHBondContact OD1-N 2.79Å; N393-W399 HydrophobicContact CB-CH2 3.55Å; N393-W399 HydrophobicContact CB-CZ3 3.47Å; N393-W399 VanDerWaalsContact CB-CZ3 3.47Å
394	S	88.8	Confident	90.8	Very high	122 Å²	122	37.2 Å²	37.2	85%	0.853	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-14.9	177	54.6	0	0	0	0	114.7
395	A	90.1	Very high	90.9	Very high	35 Å²	35	39.4 Å²	39.4	29%	0.289	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	9.7	174.9	0	0	0	0	0	113.1	R229 N393 Y397	R229-A395 PolarHBondContact NH1-O 2.86Å; R229-A395 PolarHBondContact NH2-O 2.86Å; N393-A395 PolarHBondContact O-N 3.24Å; N393-A395 WeakPolarHBondContact OD1-CA 3.39Å; N393-A395 WeakPolarHBondContact OD1-CB 3.2Å; N393-A395 PolarHBondContact OD1-N 3.09Å; A395-Y397 HydrophobicContact CB-CD2 3.69Å; A395-Y397 HydrophobicContact CB-CE2 3.72Å; A395-Y397 PolarHBondContact O-N 2.91Å
396	G	89.8	Confident	90.9	Very high	3 Å²	3	44.4 Å²	44.4	3%	0.031	23%	0.234	C	C	.	.			trans	63.9	39.9	178.6	0	0	0	0	0	113	R229 N393	R229-G396 PolarHBondContact NH1-O 3.01Å; N393-G396 PolarHBondContact O-N 2.81Å; N393-G396 PolarHBondContact OD1-N 3.04Å
397	Y	94.3	Very high	91	Very high	39 Å²	39	46.4 Å²	46.4	15%	0.153	24%	0.244	C	C	.	.			trans	-108	141.2	171.7	-62.1	-62.1	0	0	0	111.2	R229 R323 E392 N393 A395 W399 L408 F409 T410	R229-Y397 VanDerWaalsContact CZ-CE1 3.48Å; R229-Y397 VanDerWaalsContact NH2-CE1 3.31Å; R229-Y397 PolarHBondContact NH2-OH 2.86Å; R229-Y397 VanDerWaalsContact NH2-OH 3.11Å; R323-Y397 VanDerWaalsContact NH2-CE1 3.28Å; R323-Y397 PolarHBondContact NH2-OH 2.93Å; E392-Y397 WeakPolarHBondContact CA-O 3.47Å; N393-Y397 PolarHBondContact N-O 2.99Å; N393-Y397 PolarHBondContact OD1-N 2.79Å; A395-Y397 HydrophobicContact CB-CD2 3.69Å; A395-Y397 HydrophobicContact CB-CE2 3.72Å; A395-Y397 PolarHBondContact O-N 2.91Å; Y397-W399 VanDerWaalsContact O-CE3 3.29Å; Y397-W399 WeakPolarHBondContact O-CZ3 3.27Å; Y397-L408 VanDerWaalsContact CD1-C 3.49Å; Y397-L408 HydrophobicContact CD1-CB 3.78Å; Y397-L408 HydrophobicContact CD1-CD2 4.34Å; Y397-L408 VanDerWaalsContact CD1-O 3.29Å; Y397-L408 WeakPolarHBondContact CD1-O 3.38Å; Y397-L408 HydrophobicContact CD2-CD2 3.86Å; Y397-L408 HydrophobicContact CE1-CB 3.64Å; Y397-L408 HydrophobicContact CE1-CD2 4.25Å; Y397-L408 HydrophobicContact CE1-CG 4.48Å; Y397-L408 WeakPolarHBondContact CE1-O 3.46Å; Y397-L408 HydrophobicContact CE2-CD2 3.76Å; Y397-L408 HydrophobicContact CG-CB 4.34Å; Y397-L408 HydrophobicContact CG-CD2 4.14Å; Y397-F409 CarbonylContact C-O 3.57Å; Y397-F409 WeakPolarHBondContact CA-O 3.07Å; Y397-T410 HydrophobicContact CD1-CG2 3.95Å; Y397-T410 HydrophobicContact CE1-CG2 3.81Å
398	F	94.8	Very high	91	Very high	3 Å²	3	46 Å²	46	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	143	-174.7	-63.7	-91	0	0	0	112.5	P240 E242 I390 Q391 E392 F409 T410 V412 L415	P240-F398 HydrophobicContact CB-CE1 3.61Å; P240-F398 HydrophobicContact CB-CZ 3.86Å; P240-F398 HydrophobicContact CG-CE1 4.47Å; E242-F398 HydrophobicContact CG-CE2 4.15Å; E242-F398 HydrophobicContact CG-CZ 3.95Å; I390-F398 HydrophobicContact CG2-CB 4.5Å; I390-F398 HydrophobicContact CG2-CD1 3.94Å; Q391-F398 CarbonylContact O-C 3.5Å; Q391-F398 VanDerWaalsContact O-CA 3.23Å; Q391-F398 WeakPolarHBondContact O-CA 3.35Å; E392-F398 HydrophobicContact CB-CD1 4.19Å; E392-F398 HydrophobicContact CB-CE1 4.01Å; E392-F398 HydrophobicContact CG-CD1 4.42Å; E392-F398 HydrophobicContact CG-CE1 3.98Å; E392-F398 HydrophobicContact CG-CZ 4.11Å; F398-F409 PolarHBondContact N-O 3.25Å; F398-T410 WeakPolarHBondContact CE2-O 3.49Å; F398-V412 HydrophobicContact CD1-CG2 4.12Å; F398-V412 HydrophobicContact CE1-CG2 4.27Å; F398-L415 HydrophobicContact CB-CD2 4Å
399	W	94.3	Very high	91.1	Very high	38 Å²	38	46.2 Å²	46.2	14%	0.144	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	156.9	173.2	64.5	99.7	0	0	0	113.4	Q391 E392 N393 Y397 D404 I405	Q391-W399 HydrophobicContact CB-CD2 3.55Å; Q391-W399 HydrophobicContact CB-CE3 4.18Å; Q391-W399 HydrophobicContact CB-CG 3.91Å; Q391-W399 HydrophobicContact CB-CH2 4.02Å; Q391-W399 HydrophobicContact CB-CZ2 3.42Å; Q391-W399 VanDerWaalsContact CB-CZ2 3.42Å; Q391-W399 HydrophobicContact CB-CZ3 4.4Å; Q391-W399 VanDerWaalsContact CB-NE1 3.31Å; Q391-W399 HydrophobicContact CG-CZ2 4.27Å; Q391-W399 PolarHBondContact N-O 3.05Å; Q391-W399 PolarHBondContact O-N 2.88Å; E392-W399 WeakPolarHBondContact O-CH2 3.33Å; N393-W399 HydrophobicContact CB-CH2 3.55Å; N393-W399 HydrophobicContact CB-CZ3 3.47Å; N393-W399 VanDerWaalsContact CB-CZ3 3.47Å; Y397-W399 VanDerWaalsContact O-CE3 3.29Å; Y397-W399 WeakPolarHBondContact O-CZ3 3.27Å; W399-D404 HydrophobicContact CB-CB 3.77Å; W399-I405 HydrophobicContact CB-CG1 4.28Å; W399-I405 HydrophobicContact CD2-CD1 4.22Å; W399-I405 HydrophobicContact CD2-CG1 3.68Å; W399-I405 HydrophobicContact CE3-CG1 4.07Å; W399-I405 HydrophobicContact CG-CG1 3.77Å; W399-I405 HydrophobicContact CZ2-CD1 4.43Å
400	L	92	Very high	91	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	24%	0.235	C	C	.	.	S	Bend	trans	-98.5	-32.3	168.3	-63.6	178.1	0	0	0	111.5	L373 V388 I390 D404 L415 Y419 L426	L373-L400 HydrophobicContact CB-CD2 4.41Å; L373-L400 HydrophobicContact CD2-CD1 3.6Å; L373-L400 HydrophobicContact CD2-CD2 4.18Å; V388-L400 HydrophobicContact CG1-CB 4.04Å; V388-L400 HydrophobicContact CG1-CD2 3.85Å; V388-L400 HydrophobicContact CG1-CG 4.42Å; I390-L400 HydrophobicContact CB-CD2 4.48Å; I390-L400 HydrophobicContact CG1-CD2 3.7Å; L400-D404 PolarHBondContact N-OD2 3.34Å; L400-D404 VanDerWaalsContact N-OD2 3.12Å; L400-L415 HydrophobicContact CD2-CD2 4.19Å; L400-L415 HydrophobicContact CG-CD1 4.19Å; L400-L415 HydrophobicContact CG-CD2 3.98Å; L400-L415 HydrophobicContact CG-CG 4.2Å; L400-Y419 HydrophobicContact CB-CE2 4.39Å; L400-Y419 HydrophobicContact CD1-CD1 4.44Å; L400-Y419 HydrophobicContact CD1-CD2 3.92Å; L400-Y419 HydrophobicContact CD1-CE1 4.3Å; L400-Y419 HydrophobicContact CD1-CE2 3.74Å; L400-Y419 HydrophobicContact CD1-CG 4.25Å; L400-Y419 HydrophobicContact CG-CE2 4.27Å; L400-L426 HydrophobicContact CB-CD2 4.32Å; L400-L426 HydrophobicContact CD1-CD2 3.64Å
401	Q	89.1	Confident	90.9	Very high	10 Å²	10	44.5 Å²	44.5	5%	0.047	23%	0.233	C	C	.	.	S	Bend	trans	-141.6	156.6	-180	61.8	-166.1	12.8	0	0	110.7	S403 D404 Y419	Q401-S403 WeakPolarHBondContact CG-OG 3.38Å; Q401-S403 PolarHBondContact NE2-OG 3.18Å; Q401-S403 PolarHBondContact O-N 3.13Å; Q401-D404 VanDerWaalsContact CG-CG 3.46Å; Q401-D404 WeakPolarHBondContact CG-OD1 3.35Å; Q401-D404 WeakPolarHBondContact CG-OD2 3.46Å; Q401-D404 PolarHBondContact N-OD2 3.47Å; Q401-D404 VanDerWaalsContact N-OD2 3.16Å; Q401-D404 PolarHBondContact NE2-OD1 3.43Å; Q401-D404 VanDerWaalsContact NE2-OD1 3.1Å; Q401-D404 WeakPolarHBondContact O-CB 3.39Å; Q401-D404 PolarHBondContact O-N 3.36Å; Q401-Y419 VanDerWaalsContact CG-OH 3.29Å; Q401-Y419 WeakPolarHBondContact CG-OH 3.27Å; Q401-Y419 PolarHBondContact NE2-OH 3.28Å
402	T	86.1	Confident	90.9	Very high	89 Å²	89	42.3 Å²	42.3	55%	0.546	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-55.6	-32.6	-172.2	-49.9	0	0	0	0	113.5	D404 I405	T402-D404 PolarHBondContact O-N 3.34Å; T402-I405 HydrophobicContact CG2-CD1 4.06Å; T402-I405 WeakPolarHBondContact O-CG1 3.1Å; T402-I405 PolarHBondContact O-N 2.93Å
403	S	85.9	Confident	90.8	Very high	48 Å²	48	39.6 Å²	39.6	34%	0.336	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-66.8	-17.7	177.8	55.3	0	0	0	0	114.4	Q401 R406	Q401-S403 WeakPolarHBondContact CG-OG 3.38Å; Q401-S403 PolarHBondContact NE2-OG 3.18Å; Q401-S403 PolarHBondContact O-N 3.13Å; S403-R406 WeakPolarHBondContact O-CG 3.34Å; S403-R406 PolarHBondContact O-NE 2.88Å
404	D	89.8	Confident	90.8	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.027	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-83.2	-17.5	-179.5	-45.7	-22.9	0	0	0	112	W399 L400 Q401 T402 R406 M407 F409 Y419	W399-D404 HydrophobicContact CB-CB 3.77Å; L400-D404 PolarHBondContact N-OD2 3.34Å; L400-D404 VanDerWaalsContact N-OD2 3.12Å; Q401-D404 VanDerWaalsContact CG-CG 3.46Å; Q401-D404 WeakPolarHBondContact CG-OD1 3.35Å; Q401-D404 WeakPolarHBondContact CG-OD2 3.46Å; Q401-D404 PolarHBondContact N-OD2 3.47Å; Q401-D404 VanDerWaalsContact N-OD2 3.16Å; Q401-D404 PolarHBondContact NE2-OD1 3.43Å; Q401-D404 VanDerWaalsContact NE2-OD1 3.1Å; Q401-D404 WeakPolarHBondContact O-CB 3.39Å; Q401-D404 PolarHBondContact O-N 3.36Å; T402-D404 PolarHBondContact O-N 3.34Å; D404-R406 PolarHBondContact O-N 3.11Å; D404-M407 WeakPolarHBondContact O-CA 3.46Å; D404-M407 WeakPolarHBondContact O-CB 3.19Å; D404-M407 PolarHBondContact O-N 2.96Å; D404-F409 HydrophobicContact CB-CE2 4.25Å; D404-Y419 PolarHBondContact OD1-OH 2.88Å; D404-Y419 PolarHBondContact OD2-OH 2.78Å
405	I	88.9	Confident	91	Very high	62 Å²	62	32.5 Å²	32.5	32%	0.318	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-54.1	-35.2	-177.9	-64.9	172.9	0	0	0	111	W399 T402 M407 L408	W399-I405 HydrophobicContact CB-CG1 4.28Å; W399-I405 HydrophobicContact CD2-CD1 4.22Å; W399-I405 HydrophobicContact CD2-CG1 3.68Å; W399-I405 HydrophobicContact CE3-CG1 4.07Å; W399-I405 HydrophobicContact CG-CG1 3.77Å; W399-I405 HydrophobicContact CZ2-CD1 4.43Å; T402-I405 HydrophobicContact CG2-CD1 4.06Å; T402-I405 WeakPolarHBondContact O-CG1 3.1Å; T402-I405 PolarHBondContact O-N 2.93Å; I405-M407 PolarHBondContact O-N 3.43Å; I405-L408 VanDerWaalsContact O-CD2 3.27Å; I405-L408 WeakPolarHBondContact O-CD2 3.2Å; I405-L408 PolarHBondContact O-N 3.39Å
406	R	88.8	Confident	91.2	Very high	205 Å²	205	30.9 Å²	30.9	77%	0.774	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-69.2	-16.7	177.3	73.4	-168.8	173.9	165.9	0.8	114.5	S403 D404	S403-R406 WeakPolarHBondContact O-CG 3.34Å; S403-R406 PolarHBondContact O-NE 2.88Å; D404-R406 PolarHBondContact O-N 3.11Å
407	M	90.1	Very high	91.1	Very high	49 Å²	49	31.5 Å²	31.5	24%	0.241	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-79.8	-24	177.4	-57.6	-59.5	-70.5	0	0	111.5	L326 D404 I405 F409 Y418	L326-M407 HydrophobicContact CD1-CE 3.79Å; D404-M407 WeakPolarHBondContact O-CA 3.46Å; D404-M407 WeakPolarHBondContact O-CB 3.19Å; D404-M407 PolarHBondContact O-N 2.96Å; I405-M407 PolarHBondContact O-N 3.43Å; M407-F409 HydrophobicContact CB-CD2 3.88Å; M407-F409 HydrophobicContact CB-CE1 4.11Å; M407-F409 HydrophobicContact CB-CE2 3.4Å; M407-F409 VanDerWaalsContact CB-CE2 3.4Å; M407-F409 HydrophobicContact CB-CG 4.44Å; M407-F409 HydrophobicContact CB-CZ 3.53Å; M407-F409 HydrophobicContact CE-CZ 4.29Å; M407-F409 HydrophobicContact CG-CE2 3.92Å; M407-F409 HydrophobicContact CG-CZ 3.99Å; M407-F409 PolarHBondContact O-N 3.05Å; M407-Y418 HydrophobicContact CE-CD2 4.37Å; M407-Y418 HydrophobicContact CE-CE2 3.87Å
408	L	90.9	Very high	90.9	Very high	44 Å²	44	31.4 Å²	31.4	23%	0.23	15%	0.153	C	C	.	.			trans	58.3	44	172.6	-52.7	168.1	0	0	0	113.1	Y397 I405	Y397-L408 VanDerWaalsContact CD1-C 3.49Å; Y397-L408 HydrophobicContact CD1-CB 3.78Å; Y397-L408 HydrophobicContact CD1-CD2 4.34Å; Y397-L408 VanDerWaalsContact CD1-O 3.29Å; Y397-L408 WeakPolarHBondContact CD1-O 3.38Å; Y397-L408 HydrophobicContact CD2-CD2 3.86Å; Y397-L408 HydrophobicContact CE1-CB 3.64Å; Y397-L408 HydrophobicContact CE1-CD2 4.25Å; Y397-L408 HydrophobicContact CE1-CG 4.48Å; Y397-L408 WeakPolarHBondContact CE1-O 3.46Å; Y397-L408 HydrophobicContact CE2-CD2 3.76Å; Y397-L408 HydrophobicContact CG-CB 4.34Å; Y397-L408 HydrophobicContact CG-CD2 4.14Å; I405-L408 VanDerWaalsContact O-CD2 3.27Å; I405-L408 WeakPolarHBondContact O-CD2 3.2Å; I405-L408 PolarHBondContact O-N 3.39Å
409	F	93.1	Very high	90.7	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.022	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-60.8	134.2	175.1	-60.5	-62.2	0	0	0	110.6	Y397 F398 D404 M407 E414 L415 Y418	Y397-F409 CarbonylContact C-O 3.57Å; Y397-F409 WeakPolarHBondContact CA-O 3.07Å; F398-F409 PolarHBondContact N-O 3.25Å; D404-F409 HydrophobicContact CB-CE2 4.25Å; M407-F409 HydrophobicContact CB-CD2 3.88Å; M407-F409 HydrophobicContact CB-CE1 4.11Å; M407-F409 HydrophobicContact CB-CE2 3.4Å; M407-F409 VanDerWaalsContact CB-CE2 3.4Å; M407-F409 HydrophobicContact CB-CG 4.44Å; M407-F409 HydrophobicContact CB-CZ 3.53Å; M407-F409 HydrophobicContact CE-CZ 4.29Å; M407-F409 HydrophobicContact CG-CE2 3.92Å; M407-F409 HydrophobicContact CG-CZ 3.99Å; M407-F409 PolarHBondContact O-N 3.05Å; F409-E414 WeakPolarHBondContact CA-OE2 3.48Å; F409-E414 HydrophobicContact CD1-CB 4.24Å; F409-E414 HydrophobicContact CD1-CG 3.71Å; F409-E414 HydrophobicContact CE1-CG 4.32Å; F409-L415 HydrophobicContact CB-CB 4.18Å; F409-L415 HydrophobicContact CD2-CB 4.17Å; F409-L415 HydrophobicContact CD2-CD1 3.49Å; F409-L415 VanDerWaalsContact CD2-CD1 3.49Å; F409-L415 HydrophobicContact CD2-CG 4.42Å; F409-L415 HydrophobicContact CE2-CD1 3.69Å; F409-L415 HydrophobicContact CG-CB 4.13Å; F409-L415 HydrophobicContact CG-CD1 4.3Å; F409-Y418 HydrophobicContact CE1-CG 4.09Å; F409-Y418 HydrophobicContact CE2-CD1 4.12Å; F409-Y418 HydrophobicContact CE2-CG 4.44Å; F409-Y418 AromaticContact CZ-CD1 3.57Å; F409-Y418 HydrophobicContact CZ-CD1 3.57Å; F409-Y418 HydrophobicContact CZ-CD2 4.13Å; F409-Y418 HydrophobicContact CZ-CE1 4.26Å; F409-Y418 AromaticContact CZ-CG 3.49Å; F409-Y418 HydrophobicContact CZ-CG 3.49Å; F409-Y418 VanDerWaalsContact CZ-CG 3.49Å
410	T	92.1	Very high	90.4	Very high	8 Å²	8	31.6 Å²	31.6	5%	0.049	16%	0.155	C	C	.	.			trans	-107.3	-1.5	-173.7	65.5	0	0	0	0	114	R229 S243 Y397 F398 E414	R229-T410 VanDerWaalsContact NH1-CG2 3.25Å; S243-T410 PolarHBondContact N-O 3.21Å; S243-T410 WeakPolarHBondContact O-CB 3.38Å; S243-T410 PolarHBondContact O-OG1 3.13Å; Y397-T410 HydrophobicContact CD1-CG2 3.95Å; Y397-T410 HydrophobicContact CE1-CG2 3.81Å; F398-T410 WeakPolarHBondContact CE2-O 3.49Å; T410-E414 PolarHBondContact N-OE2 2.83Å
411	N	92.5	Very high	90.2	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.011	18%	0.177	C	C	.	.	S	Bend	trans	-153.8	161.7	176.7	60.4	86.7	0	0	0	109.9	E242 R332 D413 E414 L415	E242-N411 HydrophobicContact CB-CB 4.01Å; E242-N411 HydrophobicContact CG-CB 4.11Å; E242-N411 WeakPolarHBondContact OE1-CA 3.27Å; E242-N411 WeakPolarHBondContact OE1-CB 3.39Å; R332-N411 WeakPolarHBondContact CB-OD1 3.44Å; R332-N411 WeakPolarHBondContact CG-OD1 3.45Å; N411-D413 WeakPolarHBondContact OD1-CB 3.44Å; N411-D413 PolarHBondContact OD1-N 3.01Å; N411-E414 VanDerWaalsContact OD1-CB 3.27Å; N411-E414 WeakPolarHBondContact OD1-CB 3.39Å; N411-E414 PolarHBondContact OD1-N 3.2Å; N411-L415 PolarHBondContact O-N 3.11Å
412	V	93.6	Very high	90	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.2	-36.5	-176	176.7	0	0	0	0	111.5	E242 L335 L338 I390 F398 E414 L415 I416	E242-V412 PolarHBondContact OE1-N 2.83Å; L335-V412 HydrophobicContact CD1-CB 4.16Å; L335-V412 HydrophobicContact CD1-CG1 4.01Å; L335-V412 HydrophobicContact CD1-CG2 4.28Å; L335-V412 HydrophobicContact CD2-CG2 4.44Å; L338-V412 HydrophobicContact CD1-CG1 4.33Å; I390-V412 HydrophobicContact CD1-CG1 3.77Å; I390-V412 HydrophobicContact CD1-CG2 4.39Å; I390-V412 HydrophobicContact CG2-CG2 4.38Å; F398-V412 HydrophobicContact CD1-CG2 4.12Å; F398-V412 HydrophobicContact CE1-CG2 4.27Å; V412-E414 VanDerWaalsContact C-N 3.33Å; V412-E414 PolarHBondContact O-N 3.15Å; V412-L415 WeakPolarHBondContact O-CB 3.36Å; V412-L415 PolarHBondContact O-N 3Å; V412-I416 HydrophobicContact CG1-CG1 3.95Å; V412-I416 WeakPolarHBondContact O-CG1 3.33Å; V412-I416 PolarHBondContact O-N 3.08Å
413	D	91.7	Very high	90	Very high	15 Å²	15	40.6 Å²	40.6	8%	0.08	19%	0.188	C	C	.	.	H	α-helix	trans	-60.9	-42.6	179.2	-168.6	19.9	0	0	0	112.1	R332 R333 L338 Y340 N411 I416 S417	R332-D413 VanDerWaalsContact CA-OD2 3.31Å; R332-D413 WeakPolarHBondContact CA-OD2 3.37Å; R332-D413 HydrophobicContact CB-CB 4.12Å; R332-D413 WeakPolarHBondContact CD-OD2 3.46Å; R333-D413 PolarHBondContact N-OD2 3.1Å; L338-D413 HydrophobicContact CD1-CB 4.27Å; L338-D413 HydrophobicContact CD2-CB 3.58Å; L338-D413 WeakPolarHBondContact CD2-OD1 3.45Å; Y340-D413 PolarHBondContact OH-OD1 2.96Å; N411-D413 WeakPolarHBondContact OD1-CB 3.44Å; N411-D413 PolarHBondContact OD1-N 3.01Å; D413-I416 PolarHBondContact O-N 3.27Å; D413-S417 WeakPolarHBondContact O-CB 3.5Å; D413-S417 PolarHBondContact O-N 2.89Å; D413-S417 PolarHBondContact O-OG 3.49Å; D413-S417 PolarHBondContact OD1-OG 3.23Å
414	E	90.5	Very high	90	Very high	19 Å²	19	40.8 Å²	40.8	9%	0.089	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-45.7	175.9	-163.6	-172.4	-169.8	0	0	111.1	L327 R332 F409 T410 N411 V412 Y418	L327-E414 HydrophobicContact CD1-CB 4.21Å; L327-E414 HydrophobicContact CD1-CG 3.34Å; L327-E414 WeakPolarHBondContact CD1-O 3.28Å; R332-E414 HydrophobicContact CG-CB 4.42Å; F409-E414 WeakPolarHBondContact CA-OE2 3.48Å; F409-E414 HydrophobicContact CD1-CB 4.24Å; F409-E414 HydrophobicContact CD1-CG 3.71Å; F409-E414 HydrophobicContact CE1-CG 4.32Å; T410-E414 PolarHBondContact N-OE2 2.83Å; N411-E414 VanDerWaalsContact OD1-CB 3.27Å; N411-E414 WeakPolarHBondContact OD1-CB 3.39Å; N411-E414 PolarHBondContact OD1-N 3.2Å; V412-E414 VanDerWaalsContact C-N 3.33Å; V412-E414 PolarHBondContact O-N 3.15Å; E414-Y418 PolarHBondContact O-N 3.43Å
415	L	93.1	Very high	89.9	Confident	0 Å²	0	42 Å²	42	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-51.6	176.3	173.1	62.4	0	0	0	111.4	I390 F398 L400 F409 N411 V412 Y418 Y419	I390-L415 HydrophobicContact CG2-CD2 4.04Å; F398-L415 HydrophobicContact CB-CD2 4Å; L400-L415 HydrophobicContact CD2-CD2 4.19Å; L400-L415 HydrophobicContact CG-CD1 4.19Å; L400-L415 HydrophobicContact CG-CD2 3.98Å; L400-L415 HydrophobicContact CG-CG 4.2Å; F409-L415 HydrophobicContact CB-CB 4.18Å; F409-L415 HydrophobicContact CD2-CB 4.17Å; F409-L415 HydrophobicContact CD2-CD1 3.49Å; F409-L415 VanDerWaalsContact CD2-CD1 3.49Å; F409-L415 HydrophobicContact CD2-CG 4.42Å; F409-L415 HydrophobicContact CE2-CD1 3.69Å; F409-L415 HydrophobicContact CG-CB 4.13Å; F409-L415 HydrophobicContact CG-CD1 4.3Å; N411-L415 PolarHBondContact O-N 3.11Å; V412-L415 WeakPolarHBondContact O-CB 3.36Å; V412-L415 PolarHBondContact O-N 3Å; L415-Y418 WeakPolarHBondContact O-CB 3.45Å; L415-Y418 PolarHBondContact O-N 3.11Å; L415-Y419 HydrophobicContact CD1-CD2 4.09Å; L415-Y419 HydrophobicContact CD1-CE2 3.76Å; L415-Y419 WeakPolarHBondContact O-CD2 3.37Å; L415-Y419 PolarHBondContact O-N 2.72Å
416	I	92.8	Very high	89.7	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-41.8	-178.4	-63.5	-57.4	0	0	0	111.4	Y340 F360 V362 L373 V412 D413 Y418 Y419 H420 L441	Y340-I416 HydrophobicContact CE2-CB 4.34Å; Y340-I416 HydrophobicContact CE2-CG1 4.33Å; Y340-I416 HydrophobicContact CE2-CG2 3.9Å; F360-I416 HydrophobicContact CE2-CG2 3.69Å; F360-I416 HydrophobicContact CZ-CG2 4.2Å; V362-I416 HydrophobicContact CG2-CD1 4.35Å; V362-I416 HydrophobicContact CG2-CG1 4.29Å; L373-I416 HydrophobicContact CD1-CD1 4.03Å; L373-I416 HydrophobicContact CD2-CD1 3.96Å; L373-I416 HydrophobicContact CG-CD1 4.45Å; V412-I416 HydrophobicContact CG1-CG1 3.95Å; V412-I416 WeakPolarHBondContact O-CG1 3.33Å; V412-I416 PolarHBondContact O-N 3.08Å; D413-I416 PolarHBondContact O-N 3.27Å; I416-Y418 PolarHBondContact O-N 3.27Å; I416-Y419 PolarHBondContact O-N 3.36Å; I416-H420 WeakPolarHBondContact O-CB 3.43Å; I416-H420 PolarHBondContact O-N 3.23Å; I416-L441 HydrophobicContact CD1-CD1 4.2Å; I416-L441 HydrophobicContact CG2-CD1 4.19Å
417	S	89.6	Confident	88.8	Confident	16 Å²	16	33.7 Å²	33.7	11%	0.112	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-38.2	175.4	-67.8	0	0	0	0	111.5	R332 D413 N421	R332-S417 PolarHBondContact NH1-OG 2.94Å; R332-S417 VanDerWaalsContact NH1-OG 3.13Å; D413-S417 WeakPolarHBondContact O-CB 3.5Å; D413-S417 PolarHBondContact O-N 2.89Å; D413-S417 PolarHBondContact O-OG 3.49Å; D413-S417 PolarHBondContact OD1-OG 3.23Å; S417-N421 WeakPolarHBondContact O-CB 3.48Å; S417-N421 PolarHBondContact O-N 2.88Å; S417-N421 PolarHBondContact O-ND2 3.45Å
418	Y	89.3	Confident	87.2	Confident	36 Å²	36	33.7 Å²	33.7	14%	0.141	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-49.1	176.2	172.1	-104.2	0	0	0	112.2	M407 F409 E414 L415 I416 H422 Q424	M407-Y418 HydrophobicContact CE-CD2 4.37Å; M407-Y418 HydrophobicContact CE-CE2 3.87Å; F409-Y418 HydrophobicContact CE1-CG 4.09Å; F409-Y418 HydrophobicContact CE2-CD1 4.12Å; F409-Y418 HydrophobicContact CE2-CG 4.44Å; F409-Y418 AromaticContact CZ-CD1 3.57Å; F409-Y418 HydrophobicContact CZ-CD1 3.57Å; F409-Y418 HydrophobicContact CZ-CD2 4.13Å; F409-Y418 HydrophobicContact CZ-CE1 4.26Å; F409-Y418 AromaticContact CZ-CG 3.49Å; F409-Y418 HydrophobicContact CZ-CG 3.49Å; F409-Y418 VanDerWaalsContact CZ-CG 3.49Å; E414-Y418 PolarHBondContact O-N 3.43Å; L415-Y418 WeakPolarHBondContact O-CB 3.45Å; L415-Y418 PolarHBondContact O-N 3.11Å; I416-Y418 PolarHBondContact O-N 3.27Å; Y418-H422 AromaticContact CD2-CE1 3.79Å; Y418-H422 AromaticContact CD2-ND1 3.41Å; Y418-H422 WeakPolarHBondContact CD2-ND1 3.41Å; Y418-H422 AromaticContact CE2-ND1 3.86Å; Y418-H422 WeakPolarHBondContact O-CB 3.48Å; Y418-H422 PolarHBondContact O-N 3.43Å; Y418-H422 VanDerWaalsContact O-N 3.12Å; Y418-H422 PolarHBondContact O-ND1 3.15Å; Y418-H422 VanDerWaalsContact O-ND1 3.12Å; Y418-Q424 HydrophobicContact CE1-CB 4.2Å; Y418-Q424 HydrophobicContact CE1-CG 4.01Å
419	Y	91	Very high	85.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.6	-43.5	178.5	-85.4	-96.3	0	0	0	112.6	L400 Q401 D404 L415 I416 R423 Q424 L426 L441	L400-Y419 HydrophobicContact CB-CE2 4.39Å; L400-Y419 HydrophobicContact CD1-CD1 4.44Å; L400-Y419 HydrophobicContact CD1-CD2 3.92Å; L400-Y419 HydrophobicContact CD1-CE1 4.3Å; L400-Y419 HydrophobicContact CD1-CE2 3.74Å; L400-Y419 HydrophobicContact CD1-CG 4.25Å; L400-Y419 HydrophobicContact CG-CE2 4.27Å; Q401-Y419 VanDerWaalsContact CG-OH 3.29Å; Q401-Y419 WeakPolarHBondContact CG-OH 3.27Å; Q401-Y419 PolarHBondContact NE2-OH 3.28Å; D404-Y419 PolarHBondContact OD1-OH 2.88Å; D404-Y419 PolarHBondContact OD2-OH 2.78Å; L415-Y419 HydrophobicContact CD1-CD2 4.09Å; L415-Y419 HydrophobicContact CD1-CE2 3.76Å; L415-Y419 WeakPolarHBondContact O-CD2 3.37Å; L415-Y419 PolarHBondContact O-N 2.72Å; I416-Y419 PolarHBondContact O-N 3.36Å; Y419-R423 WeakPolarHBondContact O-CA 3.43Å; Y419-R423 PolarHBondContact O-N 3.41Å; Y419-Q424 HydrophobicContact CD1-CB 3.82Å; Y419-Q424 HydrophobicContact CD1-CG 3.96Å; Y419-Q424 WeakPolarHBondContact CD1-O 3.47Å; Y419-Q424 HydrophobicContact CE1-CB 4.17Å; Y419-Q424 HydrophobicContact CE1-CG 3.75Å; Y419-Q424 HydrophobicContact CG-CB 4.25Å; Y419-Q424 PolarHBondContact O-N 3.21Å; Y419-Q424 VanDerWaalsContact O-N 3.08Å; Y419-L426 HydrophobicContact CD1-CD2 3.88Å; Y419-L426 HydrophobicContact CD1-CG 4.4Å; Y419-L426 HydrophobicContact CE1-CD2 3.51Å; Y419-L426 HydrophobicContact CE1-CG 4.26Å; Y419-L441 HydrophobicContact CG-CD1 4.47Å
420	H	88.3	Confident	83.9	Confident	45 Å²	45	40.3 Å²	40.3	21%	0.208	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-54.4	-179.3	-178	60.6	0	0	0	111.9	I416 R423 L441 I442	I416-H420 WeakPolarHBondContact O-CB 3.43Å; I416-H420 PolarHBondContact O-N 3.23Å; H420-R423 PolarHBondContact O-N 3.48Å; H420-R423 PolarHBondContact O-NH1 3.26Å; H420-L441 HydrophobicContact CB-CB 4.42Å; H420-L441 PolarHBondContact ND1-O 3.45Å; H420-I442 PolarHBondContact CE1-O 3.22Å
421	N	86	Confident	82.1	Confident	89 Å²	89	44.5 Å²	44.5	48%	0.476	21%	0.214	S	C	.	.	H	α-helix	trans	-71.1	-36.3	-172.4	-64.6	-13.4	0	0	0	112.8	S417	S417-N421 WeakPolarHBondContact O-CB 3.48Å; S417-N421 PolarHBondContact O-N 2.88Å; S417-N421 PolarHBondContact O-ND2 3.45Å
422	H	85.6	Confident	80.3	Confident	81 Å²	81	53.4 Å²	53.4	38%	0.375	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	2.6	179.7	-59.3	86.8	0	0	0	113.4	L326 Y418 Q424	L326-H422 PolarHBondContact O-CE1 3.4Å; L326-H422 PolarHBondContact O-NE2 2.95Å; Y418-H422 AromaticContact CD2-CE1 3.79Å; Y418-H422 AromaticContact CD2-ND1 3.41Å; Y418-H422 WeakPolarHBondContact CD2-ND1 3.41Å; Y418-H422 AromaticContact CE2-ND1 3.86Å; Y418-H422 WeakPolarHBondContact O-CB 3.48Å; Y418-H422 PolarHBondContact O-N 3.43Å; Y418-H422 VanDerWaalsContact O-N 3.12Å; Y418-H422 PolarHBondContact O-ND1 3.15Å; Y418-H422 VanDerWaalsContact O-ND1 3.12Å; H422-Q424 PolarHBondContact O-N 3.08Å
423	R	85.6	Confident	78.4	Confident	121 Å²	121	57.9 Å²	57.9	46%	0.457	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	45.4	-173.6	-60	-65.7	-167.8	-107.2	3	111.3	Y419 H420 P425 Y440	Y419-R423 WeakPolarHBondContact O-CA 3.43Å; Y419-R423 PolarHBondContact O-N 3.41Å; H420-R423 PolarHBondContact O-N 3.48Å; H420-R423 PolarHBondContact O-NH1 3.26Å; R423-P425 WeakPolarHBondContact O-CD 3.42Å; R423-Y440 HydrophobicContact CB-CD1 4.27Å; R423-Y440 VanDerWaalsContact O-CD1 3.25Å; R423-Y440 WeakPolarHBondContact O-CD1 3.31Å; R423-Y440 WeakPolarHBondContact O-CE1 3.24Å
424	Q	87.3	Confident	76.7	Confident	53 Å²	53	57.6 Å²	57.6	25%	0.248	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-71.8	126.4	178.3	-177.7	61.7	39.8	0	0	108.8	Y418 Y419 H422	Y418-Q424 HydrophobicContact CE1-CB 4.2Å; Y418-Q424 HydrophobicContact CE1-CG 4.01Å; Y419-Q424 HydrophobicContact CD1-CB 3.82Å; Y419-Q424 HydrophobicContact CD1-CG 3.96Å; Y419-Q424 WeakPolarHBondContact CD1-O 3.47Å; Y419-Q424 HydrophobicContact CE1-CB 4.17Å; Y419-Q424 HydrophobicContact CE1-CG 3.75Å; Y419-Q424 HydrophobicContact CG-CB 4.25Å; Y419-Q424 PolarHBondContact O-N 3.21Å; Y419-Q424 VanDerWaalsContact O-N 3.08Å; H422-Q424 PolarHBondContact O-N 3.08Å
425	P	87.6	Confident	75.1	Confident	31 Å²	31	60.6 Å²	60.6	20%	0.201	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-71.9	141.5	175.3	28.2	-34.9	0	0	0	111.2	R423 N438 V439 Y440	R423-P425 WeakPolarHBondContact O-CD 3.42Å; P425-N438 HydrophobicContact CB-CB 4.49Å; P425-V439 WeakPolarHBondContact CA-O 3.3Å; P425-Y440 HydrophobicContact CB-CD1 4.38Å; P425-Y440 HydrophobicContact CB-CE1 3.82Å; P425-Y440 HydrophobicContact CG-CE1 4.33Å
426	L	84	Confident	73.7	Confident	9 Å²	9	69.2 Å²	69.2	5%	0.047	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-70.7	124.7	165.4	-65.4	168.6	0	0	0	109	L373 V375 V388 L400 Y419 V439 L441	L373-L426 HydrophobicContact CD2-CD1 4.47Å; V375-L426 HydrophobicContact CG2-CD1 4.07Å; V388-L426 HydrophobicContact CG2-CD1 4.3Å; L400-L426 HydrophobicContact CB-CD2 4.32Å; L400-L426 HydrophobicContact CD1-CD2 3.64Å; Y419-L426 HydrophobicContact CD1-CD2 3.88Å; Y419-L426 HydrophobicContact CD1-CG 4.4Å; Y419-L426 HydrophobicContact CE1-CD2 3.51Å; Y419-L426 HydrophobicContact CE1-CG 4.26Å; L426-V439 HydrophobicContact CB-CB 4.36Å; L426-V439 HydrophobicContact CD1-CB 4.48Å; L426-V439 HydrophobicContact CD1-CG1 3.96Å; L426-V439 PolarHBondContact N-O 3.47Å; L426-L441 HydrophobicContact CD1-CD2 4.29Å
427	L	70.2	Confident	72.5	Confident	82 Å²	82	71.4 Å²	71.4	43%	0.429	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-75.4	166.6	-173.7	-67.3	173.5	0	0	0	113.8	E429	L427-E429 PolarHBondContact O-N 3.35Å
428	A	56.7	Low	72	Confident	49 Å²	49	75 Å²	75	41%	0.405	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-56.3	-13.5	-163.4	0	0	0	0	0	118.1	Y430 R431	A428-Y430 PolarHBondContact O-N 3.3Å; A428-R431 HydrophobicContact CB-CG 4.3Å; A428-R431 VanDerWaalsContact O-CB 3.22Å; A428-R431 WeakPolarHBondContact O-CB 3.47Å; A428-R431 PolarHBondContact O-N 3.26Å
429	E	59.7	Low	71.6	Confident	130 Å²	130	73.4 Å²	73.4	61%	0.607	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-59.8	-21.3	-176.5	-65.2	173.4	-167.9	0	0	112.4	L427	L427-E429 PolarHBondContact O-N 3.35Å
430	Y	55.4	Low	71.5	Confident	58 Å²	58	77 Å²	77	23%	0.227	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-99.4	4.1	177.6	-58.3	-80.9	0	0	0	114.5	W386 V388 A428 Q432	W386-Y430 WeakPolarHBondContact CZ2-O 3.43Å; V388-Y430 HydrophobicContact CB-CE1 4.46Å; V388-Y430 HydrophobicContact CB-CE2 4.47Å; V388-Y430 HydrophobicContact CG1-CE1 4.38Å; V388-Y430 HydrophobicContact CG1-CE2 3.78Å; V388-Y430 HydrophobicContact CG2-CD1 4.21Å; V388-Y430 HydrophobicContact CG2-CD2 4.09Å; V388-Y430 HydrophobicContact CG2-CE1 4.22Å; V388-Y430 HydrophobicContact CG2-CE2 4.1Å; V388-Y430 HydrophobicContact CG2-CG 4.15Å; A428-Y430 PolarHBondContact O-N 3.3Å; Y430-Q432 PolarHBondContact O-N 3.02Å
431	R	53.9	Low	71.7	Confident	96 Å²	96	74.9 Å²	74.9	36%	0.362	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	11.4	-177.3	-85.5	178.1	-179.7	-178.1	1.4	116.2	W386 A428 T433 A434 P435	W386-R431 HydrophobicContact CH2-CG 3.84Å; W386-R431 HydrophobicContact CZ2-CG 4.35Å; A428-R431 HydrophobicContact CB-CG 4.3Å; A428-R431 VanDerWaalsContact O-CB 3.22Å; A428-R431 WeakPolarHBondContact O-CB 3.47Å; A428-R431 PolarHBondContact O-N 3.26Å; R431-T433 PolarHBondContact O-N 3.12Å; R431-A434 PolarHBondContact O-N 3.24Å; R431-P435 VanDerWaalsContact CD-O 3.23Å; R431-P435 WeakPolarHBondContact CD-O 3.02Å; R431-P435 PolarHBondContact NE-O 3.1Å; R431-P435 PolarHBondContact NH1-O 3.43Å
432	Q	54.4	Low	71.9	Confident	189 Å²	189	73.5 Å²	73.5	88%	0.883	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-29.6	-174.5	-68.8	-174.9	10.8	0	0	113.1	Y430	Y430-Q432 PolarHBondContact O-N 3.02Å
433	T	54.5	Low	72.2	Confident	94 Å²	94	72.6 Å²	72.6	58%	0.577	36%	0.362	S	S	*	.	S	Bend	trans	-108	-16.8	-176.9	51.5	0	0	0	0	115.4	W386 R431	W386-T433 PolarHBondContact NE1-OG1 3.21Å; R431-T433 PolarHBondContact O-N 3.12Å
434	A	56	Low	72.5	Confident	10 Å²	10	69 Å²	69	8%	0.083	35%	0.354	C	S	.	.			trans	-155.6	82.6	-175.5	0	0	0	0	0	112	R431 E436 L437	R431-A434 PolarHBondContact O-N 3.24Å; A434-E436 PolarHBondContact O-N 3.27Å; A434-L437 HydrophobicContact CB-CB 4.41Å; A434-L437 HydrophobicContact CB-CD1 3.91Å; A434-L437 HydrophobicContact CB-CG 4.28Å
435	P	56.4	Low	72.7	Confident	82 Å²	82	68.2 Å²	68.2	53%	0.532	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-16.6	-170.8	24.4	-32.6	0	0	0	115.4	R431	R431-P435 VanDerWaalsContact CD-O 3.23Å; R431-P435 WeakPolarHBondContact CD-O 3.02Å; R431-P435 PolarHBondContact NE-O 3.1Å; R431-P435 PolarHBondContact NH1-O 3.43Å
436	E	62.8	Low	72.5	Confident	181 Å²	181	71.1 Å²	71.1	85%	0.846	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-8.5	-174	-60.8	-173.4	176.5	0	0	113.8	A434	A434-E436 PolarHBondContact O-N 3.27Å
437	L	69	Low	72	Confident	47 Å²	47	75.4 Å²	75.4	25%	0.246	38%	0.379	C	S	.	.			trans	-92.9	127.1	-175.1	-63.9	177.5	0	0	0	111.4	I377 N379 A434	I377-L437 HydrophobicContact CG2-CB 4.33Å; I377-L437 HydrophobicContact CG2-CD1 3.47Å; I377-L437 VanDerWaalsContact CG2-CD1 3.47Å; N379-L437 HydrophobicContact CB-CD1 4.36Å; A434-L437 HydrophobicContact CB-CB 4.41Å; A434-L437 HydrophobicContact CB-CD1 3.91Å; A434-L437 HydrophobicContact CB-CG 4.28Å
438	N	77.2	Confident	71.7	Confident	91 Å²	91	81 Å²	81	49%	0.487	40%	0.395	S	S	.	.			trans	-80.7	127.1	163.1	-69.7	-29.7	0	0	0	108.6	P425 Y440	P425-N438 HydrophobicContact CB-CB 4.49Å; N438-Y440 HydrophobicContact CB-CD2 4.33Å; N438-Y440 HydrophobicContact CB-CE2 3.41Å; N438-Y440 VanDerWaalsContact CB-CE2 3.41Å; N438-Y440 WeakPolarHBondContact CB-OH 3.5Å; N438-Y440 PolarHBondContact ND2-OH 2.88Å
439	V	82.6	Confident	71.7	Confident	3 Å²	3	82.5 Å²	82.5	2%	0.018	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-104.4	123.1	-175.8	-177.5	0	0	0	0	109.2	V375 I377 W386 P425 L426	V375-V439 HydrophobicContact CB-CG1 4.2Å; V375-V439 HydrophobicContact CG1-CG1 3.83Å; I377-V439 HydrophobicContact CD1-CB 4.19Å; I377-V439 HydrophobicContact CD1-CG1 3.74Å; I377-V439 HydrophobicContact CD1-CG2 3.35Å; I377-V439 HydrophobicContact CG1-CB 4.35Å; I377-V439 HydrophobicContact CG1-CG1 3.73Å; I377-V439 HydrophobicContact CG1-CG2 3.74Å; W386-V439 HydrophobicContact CD2-CG2 4.11Å; W386-V439 HydrophobicContact CE3-CB 4.23Å; W386-V439 HydrophobicContact CE3-CG1 4.44Å; W386-V439 HydrophobicContact CE3-CG2 3.69Å; W386-V439 HydrophobicContact CH2-CG2 3.55Å; W386-V439 HydrophobicContact CZ2-CG2 3.99Å; W386-V439 HydrophobicContact CZ3-CB 4.09Å; W386-V439 HydrophobicContact CZ3-CG2 3.41Å; W386-V439 VanDerWaalsContact CZ3-CG2 3.41Å; P425-V439 WeakPolarHBondContact CA-O 3.3Å; L426-V439 HydrophobicContact CB-CB 4.36Å; L426-V439 HydrophobicContact CD1-CB 4.48Å; L426-V439 HydrophobicContact CD1-CG1 3.96Å; L426-V439 PolarHBondContact N-O 3.47Å
440	Y	88.6	Confident	71.4	Confident	77 Å²	77	81 Å²	81	30%	0.302	40%	0.396	S	S	.	.			trans	-121.8	148.6	-178.1	-57.9	-81.6	0	0	0	110.3	R423 P425 N438 I442	R423-Y440 HydrophobicContact CB-CD1 4.27Å; R423-Y440 VanDerWaalsContact O-CD1 3.25Å; R423-Y440 WeakPolarHBondContact O-CD1 3.31Å; R423-Y440 WeakPolarHBondContact O-CE1 3.24Å; P425-Y440 HydrophobicContact CB-CD1 4.38Å; P425-Y440 HydrophobicContact CB-CE1 3.82Å; P425-Y440 HydrophobicContact CG-CE1 4.33Å; N438-Y440 HydrophobicContact CB-CD2 4.33Å; N438-Y440 HydrophobicContact CB-CE2 3.41Å; N438-Y440 VanDerWaalsContact CB-CE2 3.41Å; N438-Y440 WeakPolarHBondContact CB-OH 3.5Å; N438-Y440 PolarHBondContact ND2-OH 2.88Å; Y440-I442 PolarHBondContact O-N 2.8Å
441	L	91.5	Very high	71.8	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	40%	0.397	C	S	.	.			trans	-84.7	101	171.6	-54.7	-168.7	0	0	0	108.6	F360 L373 V375 I416 Y419 H420 L426	F360-L441 HydrophobicContact CB-CD2 4.04Å; F360-L441 HydrophobicContact CD1-CB 3.7Å; F360-L441 HydrophobicContact CD1-CD2 4.26Å; F360-L441 HydrophobicContact CD1-CG 4.46Å; F360-L441 HydrophobicContact CD2-CD1 4.45Å; F360-L441 HydrophobicContact CE1-CB 3.64Å; F360-L441 HydrophobicContact CE2-CD1 4.46Å; F360-L441 HydrophobicContact CG-CB 4.22Å; F360-L441 HydrophobicContact CG-CD2 4.04Å; F360-L441 HydrophobicContact CZ-CB 4.11Å; L373-L441 HydrophobicContact CD1-CD1 4.43Å; L373-L441 HydrophobicContact CD1-CD2 4.33Å; L373-L441 HydrophobicContact CD2-CD1 4Å; L373-L441 HydrophobicContact CD2-CD2 4.01Å; V375-L441 HydrophobicContact CB-CD2 4.49Å; V375-L441 HydrophobicContact CG1-CD2 4.3Å; V375-L441 HydrophobicContact CG2-CD2 3.35Å; I416-L441 HydrophobicContact CD1-CD1 4.2Å; I416-L441 HydrophobicContact CG2-CD1 4.19Å; Y419-L441 HydrophobicContact CG-CD1 4.47Å; H420-L441 HydrophobicContact CB-CB 4.42Å; H420-L441 PolarHBondContact ND1-O 3.45Å; L426-L441 HydrophobicContact CD1-CD2 4.29Å
442	I	90.4	Very high	72.9	Confident	60 Å²	60	84.3 Å²	84.3	31%	0.308	41%	0.411	S	S	.	.			trans	-103.1	-55.4	-172.6	-51.5	-178.6	0	0	0	110.7	G358 H420 Y440	G358-I442 PolarHBondContact O-N 3.05Å; H420-I442 PolarHBondContact CE1-O 3.22Å; Y440-I442 PolarHBondContact O-N 2.8Å
443	N	91.4	Very high	74.4	Confident	61 Å²	61	76.4 Å²	76.4	33%	0.326	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	105.4	-174.3	-46.1	-54.8	0	0	0	110.1	G358 D359 F360 I445	G358-N443 PolarHBondContact O-N 3.39Å; D359-N443 WeakPolarHBondContact CA-O 3.32Å; D359-N443 VanDerWaalsContact OD1-CB 3.29Å; D359-N443 WeakPolarHBondContact OD1-CB 3.48Å; D359-N443 PolarHBondContact OD1-ND2 2.84Å; F360-N443 WeakPolarHBondContact CD1-O 3.48Å; F360-N443 VanDerWaalsContact CE1-C 3.48Å; F360-N443 PolarHBondContact N-O 3.4Å; N443-I445 PolarHBondContact O-N 3.16Å
444	P	92.4	Very high	75.8	Confident	45 Å²	45	73.4 Å²	73.4	29%	0.292	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	119	170.5	23.7	-29.1	0	0	0	108.9	Y340 F360 I446	Y340-P444 HydrophobicContact CD1-CB 3.91Å; Y340-P444 HydrophobicContact CG-CB 4.23Å; F360-P444 HydrophobicContact CE1-CB 3.9Å; F360-P444 HydrophobicContact CE1-CG 4.31Å; F360-P444 HydrophobicContact CE2-CB 3.9Å; F360-P444 HydrophobicContact CZ-CB 3.47Å; F360-P444 VanDerWaalsContact CZ-CB 3.47Å; F360-P444 HydrophobicContact CZ-CG 4.1Å; P444-I446 HydrophobicContact CB-CD1 4.25Å; P444-I446 HydrophobicContact CG-CD1 4.46Å; P444-I446 PolarHBondContact O-N 3.49Å
445	I	91	Very high	77.2	Confident	37 Å²	37	74.8 Å²	74.8	19%	0.19	36%	0.362	C	S	.	.			trans	-75.2	111.6	171	-61	-49.3	0	0	0	107.4	Y340 F342 L354 D359 F360 L361 N443 R447	Y340-I445 VanDerWaalsContact CA-O 3.28Å; Y340-I445 WeakPolarHBondContact CA-O 3.31Å; Y340-I445 VanDerWaalsContact CB-O 3.25Å; Y340-I445 WeakPolarHBondContact CB-O 3.4Å; F342-I445 HydrophobicContact CE2-CG2 4.32Å; F342-I445 WeakPolarHBondContact CE2-O 3.29Å; F342-I445 HydrophobicContact CZ-CG2 3.91Å; L354-I445 HydrophobicContact CD2-CB 4.31Å; L354-I445 HydrophobicContact CD2-CG1 3.6Å; D359-I445 HydrophobicContact CB-CD1 3.9Å; D359-I445 HydrophobicContact CB-CG1 3.9Å; F360-I445 PolarHBondContact O-N 3.45Å; L361-I445 HydrophobicContact CB-CB 4.44Å; N443-I445 PolarHBondContact O-N 3.16Å; I445-R447 PolarHBondContact O-N 2.96Å
446	I	84.1	Confident	78.7	Confident	93 Å²	93	72.2 Å²	72.2	48%	0.477	34%	0.343	S	S	.	.			trans	-77.2	122.1	178.8	-51.3	-57.6	0	0	0	107.5	P339 P444 R448	P339-I446 HydrophobicContact CB-CD1 3.71Å; P339-I446 HydrophobicContact CB-CG2 3.93Å; P339-I446 CarbonylContact O-C 3.54Å; P339-I446 WeakPolarHBondContact O-CA 3.32Å; P444-I446 HydrophobicContact CB-CD1 4.25Å; P444-I446 HydrophobicContact CG-CD1 4.46Å; P444-I446 PolarHBondContact O-N 3.49Å; I446-R448 PolarHBondContact O-N 2.86Å
447	R	73.8	Confident	79.9	Confident	98 Å²	98	65.4 Å²	65.4	37%	0.37	31%	0.311	S	S	.	.			trans	-55.8	113.8	166.5	-177.5	179	179.4	-175	-1.9	106	P339 F341 F342 I445 T449	P339-R447 WeakPolarHBondContact O-CB 3.19Å; P339-R447 PolarHBondContact O-N 3.26Å; F341-R447 VanDerWaalsContact O-CD 3.31Å; F341-R447 WeakPolarHBondContact O-CD 3.24Å; F342-R447 HydrophobicContact CD2-CB 4.05Å; F342-R447 HydrophobicContact CE1-CB 4.48Å; F342-R447 HydrophobicContact CE2-CB 3.72Å; F342-R447 HydrophobicContact CZ-CB 3.96Å; F342-R447 HydrophobicContact CZ-CG 4.48Å; I445-R447 PolarHBondContact O-N 2.96Å; R447-T449 PolarHBondContact O-N 2.93Å
448	R	63.4	Low	80.4	Confident	200 Å²	200	69.8 Å²	69.8	76%	0.755	34%	0.343	S	S	*	.			trans	-60.6	98.4	155.3	-65.5	-172.7	-174.8	148.5	3.9	104.1	I446 D450 D451	I446-R448 PolarHBondContact O-N 2.86Å; R448-D450 PolarHBondContact O-N 3.38Å; R448-D451 WeakPolarHBondContact CB-OD2 3.39Å; R448-D451 WeakPolarHBondContact CD-OD2 3.38Å
449	T	57.3	Low	80.6	Confident	81 Å²	81	67.5 Å²	67.5	50%	0.497	33%	0.334	S	S	.	.			trans	-38.6	138.7	165.4	37.6	0	0	0	0	106.9	R447 D451	R447-T449 PolarHBondContact O-N 2.93Å; T449-D451 VanDerWaalsContact C-N 3.26Å; T449-D451 WeakPolarHBondContact O-CA 3.4Å; T449-D451 PolarHBondContact O-N 3.35Å; T449-D451 VanDerWaalsContact O-OD1 3.1Å
450	D	53.2	Low	80.4	Confident	99 Å²	99	77 Å²	77	53%	0.529	38%	0.375	S	S	.	.			trans	-41.3	99.5	-175.4	-106.3	-50.9	0	0	0	108.7	R448 R452 E453	R448-D450 PolarHBondContact O-N 3.38Å; D450-R452 PolarHBondContact O-N 2.91Å; D450-E453 PolarHBondContact O-N 3.08Å
451	D	63.7	Low	80.3	Confident	49 Å²	49	76.7 Å²	76.7	26%	0.262	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-61.5	-23.5	-158.6	-80.2	-36.8	0	0	0	107.6	F42 R448 T449 E453 L454 V455	F42-D451 HydrophobicContact CE1-CB 3.85Å; F42-D451 HydrophobicContact CZ-CB 4.08Å; R448-D451 WeakPolarHBondContact CB-OD2 3.39Å; R448-D451 WeakPolarHBondContact CD-OD2 3.38Å; T449-D451 VanDerWaalsContact C-N 3.26Å; T449-D451 WeakPolarHBondContact O-CA 3.4Å; T449-D451 PolarHBondContact O-N 3.35Å; T449-D451 VanDerWaalsContact O-OD1 3.1Å; D451-E453 PolarHBondContact O-N 2.76Å; D451-E453 VanDerWaalsContact O-N 3.11Å; D451-L454 CarbonylContact O-C 3.52Å; D451-L454 WeakPolarHBondContact O-CA 3.37Å; D451-L454 PolarHBondContact O-N 3.11Å; D451-V455 HydrophobicContact CB-CG2 3.77Å; D451-V455 WeakPolarHBondContact O-CA 3.39Å; D451-V455 VanDerWaalsContact O-CB 3.24Å; D451-V455 WeakPolarHBondContact O-CB 3.46Å; D451-V455 WeakPolarHBondContact O-CG2 3.43Å; D451-V455 PolarHBondContact O-N 3.34Å
452	R	77.1	Confident	80.3	Confident	174 Å²	174	77.8 Å²	77.8	66%	0.657	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-41.3	-35.9	168.2	-56.5	-175.6	177.5	-153.5	-2.5	116.3	D450 L454 K543 R562	D450-R452 PolarHBondContact O-N 2.91Å; R452-L454 VanDerWaalsContact C-N 3.33Å; R452-K543 PolarHBondContact O-NZ 3.08Å; R452-R562 PolarHBondContact O-NH2 3.21Å
453	E	85.9	Confident	80.4	Confident	23 Å²	23	78.4 Å²	78.4	11%	0.107	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-83.3	-12.4	176.8	-56.7	-45.2	147.7	0	0	113.8	D450 D451 K543 V546 A560 R562	D450-E453 PolarHBondContact O-N 3.08Å; D451-E453 PolarHBondContact O-N 2.76Å; D451-E453 VanDerWaalsContact O-N 3.11Å; E453-K543 WeakPolarHBondContact O-CD 3.22Å; E453-K543 IonicContact OE2-NZ 2.68Å; E453-K543 PolarHBondContact OE2-NZ 3.02Å; E453-V546 HydrophobicContact CB-CG1 4.33Å; E453-A560 WeakPolarHBondContact OE2-CB 3.34Å; E453-A560 PolarHBondContact OE2-N 3.27Å; E453-A560 VanDerWaalsContact OE2-N 3.09Å; E453-R562 IonicContact OE1-CZ 3.77Å; E453-R562 IonicContact OE1-NH1 3.57Å; E453-R562 PolarHBondContact OE1-NH1 3.24Å; E453-R562 IonicContact OE1-NH2 3.06Å; E453-R562 PolarHBondContact OE1-NH2 3.1Å; E453-R562 VanDerWaalsContact OE1-NH2 3.16Å; E453-R562 IonicContact OE2-CZ 3.68Å; E453-R562 IonicContact OE2-NH1 3.44Å; E453-R562 IonicContact OE2-NH2 3.97Å; E453-R562 PolarHBondContact OE2-NH2 2.9Å
454	L	84.3	Confident	80.4	Confident	30 Å²	30	79.9 Å²	79.9	16%	0.157	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-17.2	177.3	-52	-177.3	0	0	0	112	F42 A43 D451 R452 V546 R547	F42-L454 CarbonylContact C-O 3.57Å; F42-L454 WeakPolarHBondContact CA-O 3.47Å; F42-L454 HydrophobicContact CD1-CB 3.91Å; F42-L454 HydrophobicContact CE1-CB 4.4Å; A43-L454 PolarHBondContact N-O 2.85Å; D451-L454 CarbonylContact O-C 3.52Å; D451-L454 WeakPolarHBondContact O-CA 3.37Å; D451-L454 PolarHBondContact O-N 3.11Å; R452-L454 VanDerWaalsContact C-N 3.33Å; L454-V546 HydrophobicContact CD2-CG1 4.32Å; L454-R547 HydrophobicContact CD2-CB 3.76Å; L454-R547 HydrophobicContact CD2-CG 4.16Å
455	V	85.2	Confident	80.4	Confident	40 Å²	40	78.1 Å²	78.1	24%	0.242	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-84.7	131.9	-176.6	166.8	0	0	0	0	109.4	Y41 F42 D451	Y41-V455 CarbonylContact O-C 3.46Å; Y41-V455 WeakPolarHBondContact O-CA 3.16Å; Y41-V455 WeakPolarHBondContact O-CG1 3.36Å; F42-V455 HydrophobicContact CD1-CG2 3.81Å; F42-V455 HydrophobicContact CE1-CG2 3.5Å; F42-V455 VanDerWaalsContact CE1-CG2 3.5Å; F42-V455 HydrophobicContact CE2-CG2 4.35Å; F42-V455 HydrophobicContact CG-CG2 4.38Å; F42-V455 HydrophobicContact CZ-CG2 3.79Å; D451-V455 HydrophobicContact CB-CG2 3.77Å; D451-V455 WeakPolarHBondContact O-CA 3.39Å; D451-V455 VanDerWaalsContact O-CB 3.24Å; D451-V455 WeakPolarHBondContact O-CB 3.46Å; D451-V455 WeakPolarHBondContact O-CG2 3.43Å; D451-V455 PolarHBondContact O-N 3.34Å
456	L	87.9	Confident	80.5	Confident	27 Å²	27	78.3 Å²	78.3	14%	0.141	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-73.8	134.1	176.3	-54	-170	0	0	0	109.9	D40 Y41 A43 D539 E540 K543	D40-L456 WeakPolarHBondContact O-CB 3.19Å; D40-L456 VanDerWaalsContact O-CD1 3.32Å; D40-L456 WeakPolarHBondContact O-CD1 3.33Å; D40-L456 WeakPolarHBondContact O-CG 3.38Å; Y41-L456 PolarHBondContact O-N 2.74Å; A43-L456 HydrophobicContact CB-CD2 4.1Å; L456-D539 WeakPolarHBondContact CA-OD2 3.32Å; L456-E540 HydrophobicContact CD1-CB 4.03Å; L456-E540 HydrophobicContact CD1-CG 4Å; L456-E540 HydrophobicContact CD2-CB 4.08Å; L456-E540 HydrophobicContact CD2-CG 4.3Å; L456-K543 HydrophobicContact CD2-CB 3.84Å; L456-K543 HydrophobicContact CD2-CG 3.97Å
457	E	87.9	Confident	81.1	Confident	38 Å²	38	73.9 Å²	73.9	18%	0.178	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-78.5	133	177.5	-64.4	-171.8	-163.1	0	0	109.7	C459 L465 S466 Y467 D539 R562	E457-C459 PolarHBondContact O-N 3.37Å; E457-L465 HydrophobicContact CB-CD2 3.92Å; E457-S466 PolarHBondContact OE1-OG 3.47Å; E457-S466 VanDerWaalsContact OE2-CB 3.24Å; E457-S466 WeakPolarHBondContact OE2-CB 3.39Å; E457-S466 PolarHBondContact OE2-N 3.43Å; E457-S466 PolarHBondContact OE2-OG 3.24Å; E457-Y467 WeakPolarHBondContact OE1-CD1 3.43Å; E457-D539 PolarHBondContact N-OD2 3.16Å; E457-R562 IonicContact OE1-NE 3.16Å; E457-R562 PolarHBondContact OE1-NE 3.16Å; E457-R562 IonicContact OE1-NH2 3.38Å
458	P	80.5	Confident	82.1	Confident	139 Å²	139	70.1 Å²	70.1	90%	0.903	35%	0.353	S	S	*	.			trans	-75.9	73.5	-178.4	32.7	-36	0	0	0	110.6
459	C	80	Confident	83.7	Confident	44 Å²	44	60.6 Å²	60.6	30%	0.297	32%	0.317	S	S	.	.			trans	-118.1	143.9	-171.4	-68.7	0	0	0	0	110.3	E457 D464 L465	E457-C459 PolarHBondContact O-N 3.37Å; C459-D464 HydrophobicContact CB-CB 3.68Å; C459-D464 VanDerWaalsContact SG-C 3.6Å; C459-D464 PolarHBondContact SG-O 2.86Å; C459-L465 HydrophobicContact CB-CD2 3.86Å; C459-L465 HydrophobicContact CB-CG 4.47Å
460	K	77.9	Confident	85.5	Confident	202 Å²	202	57.3 Å²	57.3	88%	0.878	30%	0.299	S	S	*	.	S	Bend	trans	-91	-33	177.3	-70.3	-177.2	-178.8	176.9	0	111.5	D464	K460-D464 PolarHBondContact N-OD2 2.83Å; K460-D464 VanDerWaalsContact N-OD2 3.08Å
461	T	87.9	Confident	87.4	Confident	71 Å²	71	57.4 Å²	57.4	44%	0.436	30%	0.295	S	S	.	.	S	Bend	trans	-130.2	169	177.8	76.3	0	0	0	0	110.6	E463 D464	T461-E463 WeakPolarHBondContact CB-OE2 3.31Å; T461-E463 PolarHBondContact O-N 3.44Å; T461-E463 PolarHBondContact OG1-OE2 3.2Å; T461-D464 PolarHBondContact N-OD2 3.13Å; T461-D464 PolarHBondContact O-N 3.2Å
462	V	90.2	Very high	88.9	Confident	23 Å²	23	55.8 Å²	55.8	14%	0.139	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-64.7	-31	179.6	-179.9	0	0	0	0	111.1	D464 L465 Y468 L489 I497 V538	V462-D464 PolarHBondContact O-N 3.4Å; V462-L465 HydrophobicContact CG1-CD1 4.07Å; V462-L465 VanDerWaalsContact O-CB 3.3Å; V462-L465 WeakPolarHBondContact O-CB 3.36Å; V462-L465 WeakPolarHBondContact O-CG 3.43Å; V462-L465 PolarHBondContact O-N 2.92Å; V462-L465 VanDerWaalsContact O-N 3.13Å; V462-Y468 HydrophobicContact CG1-CD2 4.06Å; V462-Y468 WeakPolarHBondContact O-CB 3.16Å; V462-L489 HydrophobicContact CG1-CD1 3.9Å; V462-I497 HydrophobicContact CB-CD1 4.18Å; V462-I497 HydrophobicContact CG1-CD1 4.1Å; V462-I497 HydrophobicContact CG1-CG2 4.35Å; V462-I497 HydrophobicContact CG2-CD1 4.13Å; V462-V538 HydrophobicContact CG2-CB 4.06Å; V462-V538 HydrophobicContact CG2-CG2 3.63Å
463	E	92.5	Very high	89.5	Confident	73 Å²	73	49.3 Å²	49.3	34%	0.341	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-67.2	-24.7	-179.3	-61.8	72.1	-157.6	0	0	113.1	T461 L465 Y468 R491	T461-E463 WeakPolarHBondContact CB-OE2 3.31Å; T461-E463 PolarHBondContact O-N 3.44Å; T461-E463 PolarHBondContact OG1-OE2 3.2Å; E463-L465 PolarHBondContact O-N 3.04Å; E463-Y468 HydrophobicContact CB-CD1 4.21Å; E463-Y468 HydrophobicContact CB-CE1 4.06Å; E463-Y468 HydrophobicContact CG-CD1 4.41Å; E463-Y468 HydrophobicContact CG-CE1 3.81Å; E463-R491 IonicContact OE1-CZ 3.79Å; E463-R491 IonicContact OE1-NH2 2.64Å; E463-R491 PolarHBondContact OE1-NH2 3.02Å
464	D	91.5	Very high	89.7	Confident	92 Å²	92	52.7 Å²	52.7	49%	0.492	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-75.4	-13	176.7	-64.4	-32.8	0	0	0	112.2	C459 K460 T461 V462	C459-D464 HydrophobicContact CB-CB 3.68Å; C459-D464 VanDerWaalsContact SG-C 3.6Å; C459-D464 PolarHBondContact SG-O 2.86Å; K460-D464 PolarHBondContact N-OD2 2.83Å; K460-D464 VanDerWaalsContact N-OD2 3.08Å; T461-D464 PolarHBondContact N-OD2 3.13Å; T461-D464 PolarHBondContact O-N 3.2Å; V462-D464 PolarHBondContact O-N 3.4Å
465	L	93.8	Very high	90.1	Very high	8 Å²	8	59.3 Å²	59.3	4%	0.042	32%	0.322	C	S	.	.	S	Bend	trans	-69	133.4	-177.3	-64	172.5	0	0	0	110.6	E457 C459 V462 E463 Y467 Y468 L489 D539	E457-L465 HydrophobicContact CB-CD2 3.92Å; C459-L465 HydrophobicContact CB-CD2 3.86Å; C459-L465 HydrophobicContact CB-CG 4.47Å; V462-L465 HydrophobicContact CG1-CD1 4.07Å; V462-L465 VanDerWaalsContact O-CB 3.3Å; V462-L465 WeakPolarHBondContact O-CB 3.36Å; V462-L465 WeakPolarHBondContact O-CG 3.43Å; V462-L465 PolarHBondContact O-N 2.92Å; V462-L465 VanDerWaalsContact O-N 3.13Å; E463-L465 PolarHBondContact O-N 3.04Å; L465-Y467 HydrophobicContact CB-CD1 4.36Å; L465-Y467 HydrophobicContact CB-CE1 4.15Å; L465-Y467 HydrophobicContact CD1-CE2 4.37Å; L465-Y467 HydrophobicContact CD2-CE1 4.29Å; L465-Y467 PolarHBondContact O-N 3.04Å; L465-Y468 WeakPolarHBondContact O-CB 3.24Å; L465-Y468 PolarHBondContact O-N 2.83Å; L465-L489 HydrophobicContact CD1-CD1 3.6Å; L465-D539 HydrophobicContact CD1-CB 4.1Å; L465-D539 HydrophobicContact CD2-CB 3.65Å
466	S	93	Very high	90.4	Very high	41 Å²	41	60.4 Å²	60.4	29%	0.287	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.5	-175.9	67	0	0	0	0	114.3	E457 R562 K563	E457-S466 PolarHBondContact OE1-OG 3.47Å; E457-S466 VanDerWaalsContact OE2-CB 3.24Å; E457-S466 WeakPolarHBondContact OE2-CB 3.39Å; E457-S466 PolarHBondContact OE2-N 3.43Å; E457-S466 PolarHBondContact OE2-OG 3.24Å; S466-R562 CarbonylContact O-C 3.49Å; S466-R562 VanDerWaalsContact O-CA 3.31Å; S466-R562 WeakPolarHBondContact O-CA 3.4Å; S466-R562 WeakPolarHBondContact O-CB 3.38Å; S466-R562 WeakPolarHBondContact OG-CD 3.04Å; S466-R562 WeakPolarHBondContact OG-CG 3.45Å; S466-R562 PolarHBondContact OG-NE 2.84Å; S466-R562 VanDerWaalsContact OG-NE 3.17Å; S466-K563 PolarHBondContact O-N 3.3Å
467	Y	95.4	Very high	90.7	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	16.1	177.2	59.2	-87.2	0	0	0	113.3	E457 L465 Y487 L489 D539 L542 A560 V561	E457-Y467 WeakPolarHBondContact OE1-CD1 3.43Å; L465-Y467 HydrophobicContact CB-CD1 4.36Å; L465-Y467 HydrophobicContact CB-CE1 4.15Å; L465-Y467 HydrophobicContact CD1-CE2 4.37Å; L465-Y467 HydrophobicContact CD2-CE1 4.29Å; L465-Y467 PolarHBondContact O-N 3.04Å; Y467-Y487 HydrophobicContact CD2-CE2 4.18Å; Y467-Y487 HydrophobicContact CE2-CE2 4.01Å; Y467-L489 HydrophobicContact CD2-CB 4.36Å; Y467-L489 HydrophobicContact CD2-CD1 3.96Å; Y467-L489 HydrophobicContact CD2-CG 3.99Å; Y467-L489 HydrophobicContact CE2-CD1 3.42Å; Y467-L489 VanDerWaalsContact CE2-CD1 3.42Å; Y467-L489 HydrophobicContact CE2-CG 3.77Å; Y467-L489 PolarHBondContact O-N 3.43Å; Y467-D539 WeakPolarHBondContact CE1-OD1 3.36Å; Y467-D539 WeakPolarHBondContact OH-CA 3.47Å; Y467-D539 PolarHBondContact OH-OD1 3.19Å; Y467-L542 HydrophobicContact CE2-CD1 3.85Å; Y467-A560 HydrophobicContact CD1-CB 3.93Å; Y467-A560 HydrophobicContact CD2-CB 4.26Å; Y467-A560 HydrophobicContact CG-CB 3.78Å; Y467-V561 WeakPolarHBondContact CA-O 3.48Å; Y467-V561 WeakPolarHBondContact CB-O 3.4Å
468	Y	96.1	Very high	90.8	Very high	18 Å²	18	61 Å²	61	7%	0.071	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.7	169	174.1	-96.9	0	0	0	111.4	V462 E463 L465 L489 R491 K563	V462-Y468 HydrophobicContact CG1-CD2 4.06Å; V462-Y468 WeakPolarHBondContact O-CB 3.16Å; E463-Y468 HydrophobicContact CB-CD1 4.21Å; E463-Y468 HydrophobicContact CB-CE1 4.06Å; E463-Y468 HydrophobicContact CG-CD1 4.41Å; E463-Y468 HydrophobicContact CG-CE1 3.81Å; L465-Y468 WeakPolarHBondContact O-CB 3.24Å; L465-Y468 PolarHBondContact O-N 2.83Å; Y468-L489 CarbonylContact C-O 3.59Å; Y468-L489 WeakPolarHBondContact CA-O 2.98Å; Y468-L489 HydrophobicContact CD2-CB 3.97Å; Y468-R491 HydrophobicContact CE2-CG 4.2Å; Y468-R491 WeakPolarHBondContact OH-CD 3.42Å; Y468-R491 WeakPolarHBondContact OH-CG 3.25Å; Y468-R491 PolarHBondContact OH-NE 3.04Å; Y468-K563 WeakPolarHBondContact O-CE 3.44Å; Y468-K563 PolarHBondContact O-NZ 2.66Å
469	F	96.5	Very high	91.3	Very high	1 Å²	1	61.8 Å²	61.8	0%	0.004	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-0.4	-173.7	-78.1	-105.6	0	0	0	115.2	I472 L480 L488 L489 V561 K563 Y567	F469-I472 HydrophobicContact CB-CB 4.45Å; F469-I472 HydrophobicContact CB-CD1 4.34Å; F469-I472 HydrophobicContact CB-CG2 4.1Å; F469-I472 HydrophobicContact CD1-CD1 4.03Å; F469-I472 HydrophobicContact CG-CD1 4.48Å; F469-L480 HydrophobicContact CD1-CD1 4.07Å; F469-L480 HydrophobicContact CE1-CD1 3.78Å; F469-L480 HydrophobicContact CE1-CD2 4.44Å; F469-L480 HydrophobicContact CZ-CD1 4.34Å; F469-L488 HydrophobicContact CB-CD1 4.33Å; F469-L488 HydrophobicContact CD2-CB 3.95Å; F469-L488 HydrophobicContact CD2-CD1 4.16Å; F469-L488 HydrophobicContact CD2-CD2 3.96Å; F469-L488 HydrophobicContact CD2-CG 4.26Å; F469-L488 HydrophobicContact CE2-CB 4.08Å; F469-L488 HydrophobicContact CE2-CD2 4.05Å; F469-L488 HydrophobicContact CG-CD1 4.44Å; F469-L488 HydrophobicContact CG-CD2 4.33Å; F469-L488 HydrophobicContact CZ-CD2 4.48Å; F469-L489 PolarHBondContact N-O 3.05Å; F469-V561 WeakPolarHBondContact CE2-O 3.27Å; F469-K563 HydrophobicContact CD1-CG 4.03Å; F469-K563 HydrophobicContact CD2-CG 4.32Å; F469-K563 HydrophobicContact CE1-CG 3.69Å; F469-K563 HydrophobicContact CE2-CG 3.98Å; F469-K563 HydrophobicContact CG-CG 4.35Å; F469-K563 HydrophobicContact CZ-CB 4.34Å; F469-K563 HydrophobicContact CZ-CG 3.66Å; F469-Y567 HydrophobicContact CD1-CD1 4.08Å; F469-Y567 AromaticContact CD1-CE1 3.87Å; F469-Y567 HydrophobicContact CD1-CE1 3.87Å; F469-Y567 HydrophobicContact CD1-CE2 4.44Å; F469-Y567 HydrophobicContact CD1-CG 4.47Å; F469-Y567 HydrophobicContact CE1-CD1 4.12Å; F469-Y567 HydrophobicContact CE1-CD2 4.07Å; F469-Y567 HydrophobicContact CE1-CE1 4.22Å; F469-Y567 HydrophobicContact CE1-CE2 4.16Å; F469-Y567 HydrophobicContact CE1-CG 4.05Å
470	G	94.7	Very high	92	Very high	12 Å²	12	61.4 Å²	61.4	12%	0.124	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.4	-141.9	-175.4	0	0	0	0	0	111.5	R490 R491	G470-R490 CarbonylContact O-C 3.39Å; G470-R490 VanDerWaalsContact O-CA 3.26Å; G470-R490 WeakPolarHBondContact O-CA 3.35Å; G470-R490 VanDerWaalsContact O-CB 3.23Å; G470-R490 WeakPolarHBondContact O-CB 3.41Å; G470-R491 PolarHBondContact O-N 3Å
471	K	94.4	Very high	92.9	Very high	101 Å²	101	51.8 Å²	51.8	44%	0.439	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117.9	172.8	-64.3	-172.2	-177.9	-172.3	0	108.5	R491 D492 E493 D495	K471-R491 HydrophobicContact CG-CB 4.04Å; K471-D492 WeakPolarHBondContact CE-O 3.46Å; K471-E493 PolarHBondContact NZ-O 3.11Å; K471-D495 WeakPolarHBondContact CE-OD1 3.44Å; K471-D495 VanDerWaalsContact NZ-CG 3.35Å; K471-D495 IonicContact NZ-OD1 3.76Å; K471-D495 PolarHBondContact NZ-OD1 3.39Å; K471-D495 IonicContact NZ-OD2 3.44Å; K471-D495 PolarHBondContact NZ-OD2 2.96Å
472	I	94.1	Very high	93.1	Very high	15 Å²	15	53.9 Å²	53.9	8%	0.077	29%	0.287	C	S	.	.			trans	-138.5	141.6	-178.6	-173.1	177.5	0	0	0	108.8	F469 D476 L477 L480 R490 Y567	F469-I472 HydrophobicContact CB-CB 4.45Å; F469-I472 HydrophobicContact CB-CD1 4.34Å; F469-I472 HydrophobicContact CB-CG2 4.1Å; F469-I472 HydrophobicContact CD1-CD1 4.03Å; F469-I472 HydrophobicContact CG-CD1 4.48Å; I472-D476 HydrophobicContact CD1-CB 3.55Å; I472-D476 HydrophobicContact CG1-CB 3.56Å; I472-D476 WeakPolarHBondContact CG1-OD2 3.4Å; I472-L477 HydrophobicContact CG2-CD2 4.17Å; I472-L480 HydrophobicContact CD1-CD1 3.46Å; I472-L480 VanDerWaalsContact CD1-CD1 3.46Å; I472-R490 HydrophobicContact CG2-CB 3.7Å; I472-R490 VanDerWaalsContact CG2-CD 3.45Å; I472-R490 HydrophobicContact CG2-CG 4.25Å; I472-Y567 WeakPolarHBondContact CD1-OH 3.39Å
473	G	90.6	Very high	93.1	Very high	37 Å²	37	56.4 Å²	56.4	38%	0.381	30%	0.304	S	S	.	.			trans	-81	162.1	-176.9	0	0	0	0	0	113	E475 D476 L477	G473-E475 PolarHBondContact O-N 3.36Å; G473-D476 PolarHBondContact N-OD2 2.73Å; G473-D476 PolarHBondContact O-N 2.69Å; G473-L477 WeakPolarHBondContact O-CG 3.44Å; G473-L477 PolarHBondContact O-N 3.42Å
474	N	90.3	Very high	93	Very high	94 Å²	94	55.7 Å²	55.7	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-24.8	177.6	-73.9	-6.5	0	0	0	113.3	L477 V478	N474-L477 PolarHBondContact O-N 3.36Å; N474-V478 PolarHBondContact O-N 3.21Å
475	E	90.9	Very high	93	Very high	169 Å²	169	51.3 Å²	51.3	79%	0.79	28%	0.279	S	S	*	.	H	α-helix	trans	-63.8	-47.2	177.5	-62	-177.7	-174.8	0	0	110.6	G473 L477 V478	G473-E475 PolarHBondContact O-N 3.36Å; E475-L477 VanDerWaalsContact C-N 3.32Å; E475-L477 PolarHBondContact O-N 2.99Å; E475-V478 PolarHBondContact O-N 2.89Å
476	D	92.5	Very high	93.1	Very high	63 Å²	63	51.5 Å²	51.5	34%	0.337	28%	0.281	S	S	.	.	H	α-helix	trans	-66.7	-34	176.7	-50	-52.3	0	0	0	112	I472 G473 V478 E479 L480	I472-D476 HydrophobicContact CD1-CB 3.55Å; I472-D476 HydrophobicContact CG1-CB 3.56Å; I472-D476 WeakPolarHBondContact CG1-OD2 3.4Å; G473-D476 PolarHBondContact N-OD2 2.73Å; G473-D476 PolarHBondContact O-N 2.69Å; D476-V478 PolarHBondContact O-N 3.25Å; D476-E479 PolarHBondContact O-N 3.4Å; D476-E479 VanDerWaalsContact O-N 3.08Å; D476-L480 WeakPolarHBondContact O-CB 3.47Å; D476-L480 WeakPolarHBondContact O-CG 3.42Å; D476-L480 PolarHBondContact O-N 3.48Å
477	L	93.9	Very high	93.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-35.8	177.2	-67.8	-179.2	0	0	0	112.3	I472 G473 N474 E475 E479 L480 L481 L488 L507	I472-L477 HydrophobicContact CG2-CD2 4.17Å; G473-L477 WeakPolarHBondContact O-CG 3.44Å; G473-L477 PolarHBondContact O-N 3.42Å; N474-L477 PolarHBondContact O-N 3.36Å; E475-L477 VanDerWaalsContact C-N 3.32Å; E475-L477 PolarHBondContact O-N 2.99Å; L477-E479 VanDerWaalsContact C-N 3.26Å; L477-E479 PolarHBondContact O-N 2.93Å; L477-L480 PolarHBondContact O-N 2.69Å; L477-L481 HydrophobicContact CB-CD1 4.41Å; L477-L481 HydrophobicContact CD2-CD1 4.25Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.47Å; L477-L481 PolarHBondContact O-N 2.94Å; L477-L488 HydrophobicContact CD2-CD1 3.82Å; L477-L488 HydrophobicContact CD2-CD2 3.88Å; L477-L488 HydrophobicContact CD2-CG 4.1Å; L477-L507 HydrophobicContact CB-CD1 3.83Å; L477-L507 HydrophobicContact CB-CD2 4.35Å; L477-L507 HydrophobicContact CD1-CD1 4.4Å
478	V	90.9	Very high	93.4	Very high	79 Å²	79	49.6 Å²	49.6	48%	0.479	27%	0.267	S	S	.	.	H	α-helix	trans	-66.7	-32.3	177.9	176	0	0	0	0	111.2	N474 E475 D476 L507	N474-V478 PolarHBondContact O-N 3.21Å; E475-V478 PolarHBondContact O-N 2.89Å; D476-V478 PolarHBondContact O-N 3.25Å; V478-L507 HydrophobicContact CG2-CD1 3.84Å
479	E	90.8	Very high	93.5	Very high	155 Å²	155	48.7 Å²	48.7	72%	0.724	26%	0.264	S	S	*	.	H	α-helix	trans	-80.5	-27.4	177.3	-59.1	-165	165.1	0	0	113	D476 L477 L482	D476-E479 PolarHBondContact O-N 3.4Å; D476-E479 VanDerWaalsContact O-N 3.08Å; L477-E479 VanDerWaalsContact C-N 3.26Å; L477-E479 PolarHBondContact O-N 2.93Å; E479-L482 WeakPolarHBondContact O-CD2 3.37Å
480	L	94.7	Very high	93.5	Very high	36 Å²	36	49.6 Å²	49.6	19%	0.188	27%	0.267	C	S	.	.	H	α-helix	trans	-89.9	-42.7	-178.1	-69.4	174	0	0	0	113.3	F469 I472 D476 L477 L482 L488 V561 Y567	F469-L480 HydrophobicContact CD1-CD1 4.07Å; F469-L480 HydrophobicContact CE1-CD1 3.78Å; F469-L480 HydrophobicContact CE1-CD2 4.44Å; F469-L480 HydrophobicContact CZ-CD1 4.34Å; I472-L480 HydrophobicContact CD1-CD1 3.46Å; I472-L480 VanDerWaalsContact CD1-CD1 3.46Å; D476-L480 WeakPolarHBondContact O-CB 3.47Å; D476-L480 WeakPolarHBondContact O-CG 3.42Å; D476-L480 PolarHBondContact O-N 3.48Å; L477-L480 PolarHBondContact O-N 2.69Å; L480-L482 PolarHBondContact O-N 3.35Å; L480-L488 HydrophobicContact CB-CD2 4.17Å; L480-L488 HydrophobicContact CD1-CD2 3.92Å; L480-V561 HydrophobicContact CB-CG1 4.25Å; L480-V561 HydrophobicContact CD2-CG1 4.46Å; L480-Y567 HydrophobicContact CD1-CE2 4.07Å; L480-Y567 HydrophobicContact CD2-CD2 4.49Å; L480-Y567 HydrophobicContact CD2-CE2 4.24Å
481	L	95.9	Very high	93.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.			trans	-94.2	89.8	-176.4	-54.8	179.4	0	0	0	109.1	L477 D486 L488 R502 L507 V561	L477-L481 HydrophobicContact CB-CD1 4.41Å; L477-L481 HydrophobicContact CD2-CD1 4.25Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.47Å; L477-L481 PolarHBondContact O-N 2.94Å; L481-D486 HydrophobicContact CB-CB 4.37Å; L481-D486 HydrophobicContact CD2-CB 4.07Å; L481-L488 HydrophobicContact CD2-CD2 3.96Å; L481-L488 HydrophobicContact CD2-CG 4.08Å; L481-L488 HydrophobicContact CG-CD2 4.38Å; L481-R502 HydrophobicContact CB-CB 3.86Å; L481-R502 WeakPolarHBondContact O-CD 3.46Å; L481-R502 PolarHBondContact O-NH1 3.17Å; L481-L507 HydrophobicContact CB-CD2 4.28Å; L481-L507 HydrophobicContact CD1-CD2 3.77Å; L481-V561 HydrophobicContact CD2-CB 4.21Å; L481-V561 HydrophobicContact CD2-CG2 3.77Å
482	L	91.8	Very high	93.5	Very high	115 Å²	115	48.2 Å²	48.2	60%	0.602	26%	0.256	S	S	*	.			trans	-93.1	-35.4	-169.3	-62.5	179.3	0	0	0	112.7	E479 L480 D486	E479-L482 WeakPolarHBondContact O-CD2 3.37Å; L480-L482 PolarHBondContact O-N 3.35Å; L482-D486 PolarHBondContact N-OD2 3.28Å
483	C	91	Very high	93.4	Very high	75 Å²	75	55.4 Å²	55.4	51%	0.507	29%	0.29	S	S	.	.	S	Bend	trans	-112.7	154.6	-175	-62.1	0	0	0	0	112.4	G485 D486	C483-G485 PolarHBondContact O-N 3.49Å; C483-D486 WeakPolarHBondContact CB-OD2 3.48Å; C483-D486 PolarHBondContact N-OD2 3.07Å; C483-D486 VanDerWaalsContact O-CB 3.23Å; C483-D486 WeakPolarHBondContact O-CB 3.31Å; C483-D486 PolarHBondContact O-N 2.77Å
484	D	91.2	Very high	93.4	Very high	58 Å²	58	60 Å²	60	31%	0.31	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	118.5	173.9	-89.7	4.1	0	0	0	111.9	W503 Q504 D505 K558	D484-W503 HydrophobicContact CB-CE3 4.32Å; D484-Q504 PolarHBondContact OD1-N 3.11Å; D484-Q504 WeakPolarHBondContact OD2-CA 3.46Å; D484-Q504 PolarHBondContact OD2-N 3.22Å; D484-D505 PolarHBondContact OD1-N 3.49Å; D484-K558 WeakPolarHBondContact O-CD 3.5Å; D484-K558 PolarHBondContact O-NZ 3.02Å
485	G	91.7	Very high	93.5	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	97	-1.8	-174.5	0	0	0	0	0	113.7	C483 R502 I556 K558 Q559	C483-G485 PolarHBondContact O-N 3.49Å; G485-R502 PolarHBondContact N-O 3.11Å; G485-I556 WeakPolarHBondContact CA-O 3.38Å; G485-K558 PolarHBondContact O-N 3.5Å; G485-Q559 PolarHBondContact O-N 3.28Å; G485-Q559 VanDerWaalsContact O-N 3.16Å
486	D	95.2	Very high	93.6	Very high	13 Å²	13	51.7 Å²	51.7	7%	0.07	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	135.3	166.4	-72.6	-3.8	0	0	0	109	L481 L482 C483 A501 R502 Q559 V561	L481-D486 HydrophobicContact CB-CB 4.37Å; L481-D486 HydrophobicContact CD2-CB 4.07Å; L482-D486 PolarHBondContact N-OD2 3.28Å; C483-D486 WeakPolarHBondContact CB-OD2 3.48Å; C483-D486 PolarHBondContact N-OD2 3.07Å; C483-D486 VanDerWaalsContact O-CB 3.23Å; C483-D486 WeakPolarHBondContact O-CB 3.31Å; C483-D486 PolarHBondContact O-N 2.77Å; D486-A501 CarbonylContact O-C 3.55Å; D486-A501 WeakPolarHBondContact O-CA 3.37Å; D486-R502 PolarHBondContact O-N 2.99Å; D486-Q559 WeakPolarHBondContact CA-O 3.31Å; D486-V561 HydrophobicContact CB-CG2 3.89Å
487	Y	97.4	Very high	93.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	158	180	74.4	-86	0	0	0	113	Y467 V499 S500 L542 V546 L557 Q559 A560 V561	Y467-Y487 HydrophobicContact CD2-CE2 4.18Å; Y467-Y487 HydrophobicContact CE2-CE2 4.01Å; Y487-V499 HydrophobicContact CD2-CG1 4Å; Y487-V499 HydrophobicContact CG-CG1 4.33Å; Y487-S500 CarbonylContact C-O 3.59Å; Y487-S500 WeakPolarHBondContact CA-O 3.05Å; Y487-L542 HydrophobicContact CE2-CB 4.27Å; Y487-L542 HydrophobicContact CE2-CD1 3.97Å; Y487-V546 HydrophobicContact CE1-CG2 3.68Å; Y487-L557 HydrophobicContact CD1-CB 3.8Å; Y487-L557 HydrophobicContact CD1-CD2 4.17Å; Y487-L557 HydrophobicContact CD1-CG 4.39Å; Y487-L557 HydrophobicContact CE1-CB 3.98Å; Y487-L557 HydrophobicContact CG-CB 4.39Å; Y487-L557 HydrophobicContact CG-CD1 4.43Å; Y487-L557 HydrophobicContact CG-CD2 3.98Å; Y487-Q559 VanDerWaalsContact CD1-C 3.47Å; Y487-Q559 WeakPolarHBondContact CD1-O 3.45Å; Y487-Q559 PolarHBondContact N-O 3.04Å; Y487-A560 HydrophobicContact CE1-CB 4.08Å; Y487-A560 HydrophobicContact CE2-CB 4.01Å; Y487-A560 CarbonylContact O-C 3.6Å; Y487-A560 WeakPolarHBondContact O-CA 3.31Å; Y487-V561 PolarHBondContact O-N 2.96Å
488	L	97.8	Very high	93.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	164.3	170.2	62.9	80.4	0	0	0	110.8	F469 L477 L480 L481 R490 V499 S500	F469-L488 HydrophobicContact CB-CD1 4.33Å; F469-L488 HydrophobicContact CD2-CB 3.95Å; F469-L488 HydrophobicContact CD2-CD1 4.16Å; F469-L488 HydrophobicContact CD2-CD2 3.96Å; F469-L488 HydrophobicContact CD2-CG 4.26Å; F469-L488 HydrophobicContact CE2-CB 4.08Å; F469-L488 HydrophobicContact CE2-CD2 4.05Å; F469-L488 HydrophobicContact CG-CD1 4.44Å; F469-L488 HydrophobicContact CG-CD2 4.33Å; F469-L488 HydrophobicContact CZ-CD2 4.48Å; L477-L488 HydrophobicContact CD2-CD1 3.82Å; L477-L488 HydrophobicContact CD2-CD2 3.88Å; L477-L488 HydrophobicContact CD2-CG 4.1Å; L480-L488 HydrophobicContact CB-CD2 4.17Å; L480-L488 HydrophobicContact CD1-CD2 3.92Å; L481-L488 HydrophobicContact CD2-CD2 3.96Å; L481-L488 HydrophobicContact CD2-CG 4.08Å; L481-L488 HydrophobicContact CG-CD2 4.38Å; L488-R490 HydrophobicContact CD1-CB 4.08Å; L488-R490 HydrophobicContact CD1-CG 4.38Å; L488-V499 WeakPolarHBondContact O-CA 3.45Å; L488-S500 PolarHBondContact N-O 3.39Å; L488-S500 PolarHBondContact O-N 3.25Å
489	L	97.8	Very high	94.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	138	173.1	-76.9	170.9	0	0	0	110.6	V462 L465 Y467 Y468 F469 I497 V499 V512 V538 L542	V462-L489 HydrophobicContact CG1-CD1 3.9Å; L465-L489 HydrophobicContact CD1-CD1 3.6Å; Y467-L489 HydrophobicContact CD2-CB 4.36Å; Y467-L489 HydrophobicContact CD2-CD1 3.96Å; Y467-L489 HydrophobicContact CD2-CG 3.99Å; Y467-L489 HydrophobicContact CE2-CD1 3.42Å; Y467-L489 VanDerWaalsContact CE2-CD1 3.42Å; Y467-L489 HydrophobicContact CE2-CG 3.77Å; Y467-L489 PolarHBondContact O-N 3.43Å; Y468-L489 CarbonylContact C-O 3.59Å; Y468-L489 WeakPolarHBondContact CA-O 2.98Å; Y468-L489 HydrophobicContact CD2-CB 3.97Å; F469-L489 PolarHBondContact N-O 3.05Å; L489-I497 HydrophobicContact CD2-CG2 3.98Å; L489-V499 HydrophobicContact CD2-CG2 3.63Å; L489-V512 HydrophobicContact CD2-CG2 4.06Å; L489-V538 HydrophobicContact CD1-CG1 3.73Å; L489-V538 HydrophobicContact CD2-CG1 4Å; L489-L542 HydrophobicContact CD1-CD1 4.06Å; L489-L542 HydrophobicContact CD2-CD1 3.93Å; L489-L542 HydrophobicContact CG-CD1 3.98Å
490	R	96	Very high	94.5	Very high	19 Å²	19	38.7 Å²	38.7	7%	0.072	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	173.2	172.7	66.7	174.6	-177	91.9	1.9	111.5	G470 I472 L488 L498 S500 D509	G470-R490 CarbonylContact O-C 3.39Å; G470-R490 VanDerWaalsContact O-CA 3.26Å; G470-R490 WeakPolarHBondContact O-CA 3.35Å; G470-R490 VanDerWaalsContact O-CB 3.23Å; G470-R490 WeakPolarHBondContact O-CB 3.41Å; I472-R490 HydrophobicContact CG2-CB 3.7Å; I472-R490 VanDerWaalsContact CG2-CD 3.45Å; I472-R490 HydrophobicContact CG2-CG 4.25Å; L488-R490 HydrophobicContact CD1-CB 4.08Å; L488-R490 HydrophobicContact CD1-CG 4.38Å; R490-L498 HydrophobicContact CG-CD1 3.59Å; R490-L498 HydrophobicContact CG-CG 3.94Å; R490-L498 PolarHBondContact N-O 2.75Å; R490-L498 PolarHBondContact O-N 2.89Å; R490-S500 WeakPolarHBondContact CD-OG 3.44Å; R490-S500 PolarHBondContact NE-OG 2.65Å; R490-D509 IonicContact CZ-OD1 3.51Å; R490-D509 IonicContact CZ-OD2 3.33Å; R490-D509 IonicContact NE-OD1 2.86Å; R490-D509 IonicContact NH2-OD1 3.72Å; R490-D509 PolarHBondContact NH2-OD1 3.02Å; R490-D509 IonicContact NH2-OD2 3.81Å; R490-D509 PolarHBondContact NH2-OD2 3.41Å
491	R	95.5	Very high	94.6	Very high	65 Å²	65	37 Å²	37	25%	0.245	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	146.6	167.8	-71.5	-172.5	-176	-174.5	3.2	110.7	E463 Y468 G470 K471 D495 A496 I497	E463-R491 IonicContact OE1-CZ 3.79Å; E463-R491 IonicContact OE1-NH2 2.64Å; E463-R491 PolarHBondContact OE1-NH2 3.02Å; Y468-R491 HydrophobicContact CE2-CG 4.2Å; Y468-R491 WeakPolarHBondContact OH-CD 3.42Å; Y468-R491 WeakPolarHBondContact OH-CG 3.25Å; Y468-R491 PolarHBondContact OH-NE 3.04Å; G470-R491 PolarHBondContact O-N 3Å; K471-R491 HydrophobicContact CG-CB 4.04Å; R491-D495 WeakPolarHBondContact CD-OD1 3.48Å; R491-D495 IonicContact NH1-OD1 3.44Å; R491-D495 PolarHBondContact NH1-OD1 2.8Å; R491-D495 VanDerWaalsContact NH1-OD1 3.12Å; R491-A496 WeakPolarHBondContact CA-O 3.29Å; R491-I497 HydrophobicContact CG-CG1 4.39Å
492	D	93.9	Very high	94.6	Very high	19 Å²	19	39.5 Å²	39.5	10%	0.102	20%	0.202	C	C	.	.			trans	-81.7	-175.3	165.7	80.4	-17.7	0	0	0	111.6	K471 N494 D495 A496 L498	K471-D492 WeakPolarHBondContact CE-O 3.46Å; D492-N494 PolarHBondContact O-N 3.44Å; D492-N494 VanDerWaalsContact OD1-C 3.26Å; D492-N494 VanDerWaalsContact OD1-CA 3.31Å; D492-N494 WeakPolarHBondContact OD1-CA 3.39Å; D492-N494 WeakPolarHBondContact OD1-CB 3.42Å; D492-N494 PolarHBondContact OD1-N 3.04Å; D492-N494 PolarHBondContact OD2-ND2 2.89Å; D492-D495 PolarHBondContact O-N 3.02Å; D492-D495 VanDerWaalsContact O-N 3.15Å; D492-D495 PolarHBondContact OD1-N 3.48Å; D492-A496 PolarHBondContact N-O 2.86Å; D492-A496 VanDerWaalsContact N-O 3.13Å; D492-A496 WeakPolarHBondContact OD1-CB 3.32Å; D492-A496 PolarHBondContact OD1-N 2.95Å; D492-L498 HydrophobicContact CB-CD2 3.81Å
493	E	91.3	Very high	94.7	Very high	166 Å²	166	34 Å²	34	78%	0.776	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.6	175.2	-66.1	-65.6	161.4	0	0	112.6	K471 D495	K471-E493 PolarHBondContact NZ-O 3.11Å; E493-D495 VanDerWaalsContact C-N 3.27Å; E493-D495 PolarHBondContact O-N 3.21Å
494	N	92	Very high	94.6	Very high	134 Å²	134	34.9 Å²	34.9	72%	0.717	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	10.1	-179.2	-51.9	-63	0	0	0	113.3	D492 A496	D492-N494 PolarHBondContact O-N 3.44Å; D492-N494 VanDerWaalsContact OD1-C 3.26Å; D492-N494 VanDerWaalsContact OD1-CA 3.31Å; D492-N494 WeakPolarHBondContact OD1-CA 3.39Å; D492-N494 WeakPolarHBondContact OD1-CB 3.42Å; D492-N494 PolarHBondContact OD1-N 3.04Å; D492-N494 PolarHBondContact OD2-ND2 2.89Å; N494-A496 PolarHBondContact O-N 2.92Å
495	D	91.2	Very high	94.3	Very high	74 Å²	74	38 Å²	38	40%	0.396	19%	0.186	S	C	.	.			trans	64.7	12.5	-176.5	-77.6	-70.9	0	0	0	115.4	K471 R491 D492 E493	K471-D495 WeakPolarHBondContact CE-OD1 3.44Å; K471-D495 VanDerWaalsContact NZ-CG 3.35Å; K471-D495 IonicContact NZ-OD1 3.76Å; K471-D495 PolarHBondContact NZ-OD1 3.39Å; K471-D495 IonicContact NZ-OD2 3.44Å; K471-D495 PolarHBondContact NZ-OD2 2.96Å; R491-D495 WeakPolarHBondContact CD-OD1 3.48Å; R491-D495 IonicContact NH1-OD1 3.44Å; R491-D495 PolarHBondContact NH1-OD1 2.8Å; R491-D495 VanDerWaalsContact NH1-OD1 3.12Å; D492-D495 PolarHBondContact O-N 3.02Å; D492-D495 VanDerWaalsContact O-N 3.15Å; D492-D495 PolarHBondContact OD1-N 3.48Å; E493-D495 VanDerWaalsContact C-N 3.27Å; E493-D495 PolarHBondContact O-N 3.21Å
496	A	94.2	Very high	94.3	Very high	15 Å²	15	41.5 Å²	41.5	12%	0.124	21%	0.208	C	C	.	.			trans	-74.1	137.6	175.9	0	0	0	0	0	110.8	R491 D492 N494 Y511 E513	R491-A496 WeakPolarHBondContact CA-O 3.29Å; D492-A496 PolarHBondContact N-O 2.86Å; D492-A496 VanDerWaalsContact N-O 3.13Å; D492-A496 WeakPolarHBondContact OD1-CB 3.32Å; D492-A496 PolarHBondContact OD1-N 2.95Å; N494-A496 PolarHBondContact O-N 2.92Å; A496-Y511 HydrophobicContact CB-CD1 4.09Å; A496-Y511 HydrophobicContact CB-CE1 4.09Å; A496-E513 WeakPolarHBondContact CA-OE1 3.4Å
497	I	94.5	Very high	94.3	Very high	23 Å²	23	43.7 Å²	43.7	12%	0.118	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	126.5	-178.4	-59.1	175.6	0	0	0	110.1	V462 L489 R491 V512 E513	V462-I497 HydrophobicContact CB-CD1 4.18Å; V462-I497 HydrophobicContact CG1-CD1 4.1Å; V462-I497 HydrophobicContact CG1-CG2 4.35Å; V462-I497 HydrophobicContact CG2-CD1 4.13Å; L489-I497 HydrophobicContact CD2-CG2 3.98Å; R491-I497 HydrophobicContact CG-CG1 4.39Å; I497-V512 HydrophobicContact CG2-CB 4.4Å; I497-V512 HydrophobicContact CG2-CG2 4.16Å; I497-V512 PolarHBondContact O-N 2.64Å; I497-E513 PolarHBondContact N-OE1 3.15Å
498	L	95.8	Very high	94.1	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.1	177.6	70.3	91.8	0	0	0	112.3	R490 D492 S500 D509 I510 Y511	R490-L498 HydrophobicContact CG-CD1 3.59Å; R490-L498 HydrophobicContact CG-CG 3.94Å; R490-L498 PolarHBondContact N-O 2.75Å; R490-L498 PolarHBondContact O-N 2.89Å; D492-L498 HydrophobicContact CB-CD2 3.81Å; L498-S500 WeakPolarHBondContact CD1-OG 3.38Å; L498-D509 HydrophobicContact CD1-CB 3.92Å; L498-D509 WeakPolarHBondContact CD1-OD1 3.46Å; L498-I510 CarbonylContact C-O 3.57Å; L498-I510 VanDerWaalsContact CA-O 3.27Å; L498-I510 WeakPolarHBondContact CA-O 3.33Å; L498-I510 WeakPolarHBondContact CB-O 3.4Å; L498-Y511 HydrophobicContact CB-CD1 4.28Å; L498-Y511 HydrophobicContact CD2-CE1 4.21Å
499	V	97.4	Very high	94	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.6	168.6	178.3	0	0	0	0	107.6	Y487 L488 L489 D509 I510 V512 L542 L557	Y487-V499 HydrophobicContact CD2-CG1 4Å; Y487-V499 HydrophobicContact CG-CG1 4.33Å; L488-V499 WeakPolarHBondContact O-CA 3.45Å; L489-V499 HydrophobicContact CD2-CG2 3.63Å; V499-D509 CarbonylContact O-C 3.59Å; V499-D509 WeakPolarHBondContact O-CA 3.45Å; V499-I510 PolarHBondContact N-O 2.77Å; V499-I510 PolarHBondContact O-N 3.19Å; V499-V512 HydrophobicContact CG2-CG2 3.66Å; V499-L542 HydrophobicContact CG2-CD1 3.83Å; V499-L542 HydrophobicContact CG2-CD2 3.47Å; V499-L542 VanDerWaalsContact CG2-CD2 3.47Å; V499-L542 HydrophobicContact CG2-CG 4.29Å; V499-L557 HydrophobicContact CG1-CD1 4.33Å; V499-L557 HydrophobicContact CG1-CD2 4.15Å
500	S	98	Very high	93.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.3	167.1	-65.3	0	0	0	0	108.8	Y487 L488 R490 L498 K508 D509	Y487-S500 CarbonylContact C-O 3.59Å; Y487-S500 WeakPolarHBondContact CA-O 3.05Å; L488-S500 PolarHBondContact N-O 3.39Å; L488-S500 PolarHBondContact O-N 3.25Å; R490-S500 WeakPolarHBondContact CD-OG 3.44Å; R490-S500 PolarHBondContact NE-OG 2.65Å; L498-S500 WeakPolarHBondContact CD1-OG 3.38Å; S500-K508 WeakPolarHBondContact CA-O 3.14Å; S500-D509 WeakPolarHBondContact CB-OD1 3.37Å; S500-D509 PolarHBondContact OG-OD1 2.97Å
501	A	97.5	Very high	93.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146.4	179.5	0	0	0	0	0	111.3	D486 K508 V555 L557	D486-A501 CarbonylContact O-C 3.55Å; D486-A501 WeakPolarHBondContact O-CA 3.37Å; A501-K508 PolarHBondContact N-O 3.08Å; A501-K508 PolarHBondContact O-N 2.81Å; A501-V555 HydrophobicContact CB-CG1 3.86Å; A501-L557 HydrophobicContact CB-CD2 3.74Å
502	R	95.7	Very high	93.7	Very high	52 Å²	52	50.2 Å²	50.2	20%	0.196	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130.2	167.2	178.6	168.7	-172.2	131.7	4.8	109.8	L481 G485 D486 D505 V506 L507	L481-R502 HydrophobicContact CB-CB 3.86Å; L481-R502 WeakPolarHBondContact O-CD 3.46Å; L481-R502 PolarHBondContact O-NH1 3.17Å; G485-R502 PolarHBondContact N-O 3.11Å; D486-R502 PolarHBondContact O-N 2.99Å; R502-D505 IonicContact CZ-OD1 3.69Å; R502-D505 IonicContact NE-OD1 3.94Å; R502-D505 IonicContact NH2-OD1 2.82Å; R502-D505 PolarHBondContact NH2-OD1 2.91Å; R502-V506 WeakPolarHBondContact CA-O 3.34Å; R502-L507 HydrophobicContact CB-CD2 4.38Å
503	W	93.7	Very high	93.4	Very high	1 Å²	1	53.8 Å²	53.8	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	128	178	-169.2	-108.4	0	0	0	110.9	I260 G263 D484 D505 V506 G554 V555 I556	I260-W503 HydrophobicContact CB-CH2 4.48Å; I260-W503 HydrophobicContact CG1-CH2 4.27Å; I260-W503 HydrophobicContact CG2-CH2 3.59Å; I260-W503 HydrophobicContact CG2-CZ2 3.82Å; G263-W503 WeakPolarHBondContact O-CZ2 3.11Å; D484-W503 HydrophobicContact CB-CE3 4.32Å; W503-D505 PolarHBondContact O-N 2.79Å; W503-V506 PolarHBondContact N-O 3.13Å; W503-V506 WeakPolarHBondContact O-CG2 2.9Å; W503-V506 PolarHBondContact O-N 3Å; W503-G554 PolarHBondContact NE1-O 2.82Å; W503-G554 VanDerWaalsContact NE1-O 3.14Å; W503-V555 HydrophobicContact CB-CG1 4.15Å; W503-V555 HydrophobicContact CB-CG2 4.13Å; W503-V555 HydrophobicContact CD2-CG1 4.31Å; W503-V555 HydrophobicContact CE3-CG1 4.28Å; W503-V555 HydrophobicContact CG-CG1 4.27Å; W503-V555 HydrophobicContact CG-CG2 4.26Å; W503-I556 HydrophobicContact CH2-CB 3.61Å; W503-I556 HydrophobicContact CH2-CD1 4.22Å; W503-I556 HydrophobicContact CH2-CG1 4.1Å; W503-I556 HydrophobicContact CZ2-CB 4.3Å; W503-I556 HydrophobicContact CZ2-CD1 4.47Å; W503-I556 HydrophobicContact CZ2-CG1 4.36Å; W503-I556 HydrophobicContact CZ3-CB 3.95Å; W503-I556 VanDerWaalsContact CZ3-O 3.24Å; W503-I556 WeakPolarHBondContact CZ3-O 3.26Å
504	Q	88.3	Confident	93.3	Very high	92 Å²	92	49.6 Å²	49.6	43%	0.43	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	44.9	-178	-62	175.6	-49.1	0	0	112	N262 D484 V506	N262-Q504 PolarHBondContact O-NE2 3.12Å; D484-Q504 PolarHBondContact OD1-N 3.11Å; D484-Q504 WeakPolarHBondContact OD2-CA 3.46Å; D484-Q504 PolarHBondContact OD2-N 3.22Å; Q504-V506 PolarHBondContact O-N 2.97Å; Q504-V506 VanDerWaalsContact O-N 3.11Å
505	D	85.5	Confident	93.3	Very high	123 Å²	123	45.3 Å²	45.3	66%	0.658	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	15	-177.9	-67.7	-49	0	0	0	116	D484 R502 W503	D484-D505 PolarHBondContact OD1-N 3.49Å; R502-D505 IonicContact CZ-OD1 3.69Å; R502-D505 IonicContact NE-OD1 3.94Å; R502-D505 IonicContact NH2-OD1 2.82Å; R502-D505 PolarHBondContact NH2-OD1 2.91Å; W503-D505 PolarHBondContact O-N 2.79Å
506	V	91.4	Very high	93.3	Very high	74 Å²	74	46.4 Å²	46.4	45%	0.448	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	147.6	171.2	-60.7	0	0	0	0	111.3	R502 W503 Q504 K508	R502-V506 WeakPolarHBondContact CA-O 3.34Å; W503-V506 PolarHBondContact N-O 3.13Å; W503-V506 WeakPolarHBondContact O-CG2 2.9Å; W503-V506 PolarHBondContact O-N 3Å; Q504-V506 PolarHBondContact O-N 2.97Å; Q504-V506 VanDerWaalsContact O-N 3.11Å; V506-K508 HydrophobicContact CG2-CG 4.26Å
507	L	94.4	Very high	92.9	Very high	59 Å²	59	48.3 Å²	48.3	31%	0.309	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.1	167.8	-67.6	177.6	0	0	0	108.9	L477 V478 L481 R502	L477-L507 HydrophobicContact CB-CD1 3.83Å; L477-L507 HydrophobicContact CB-CD2 4.35Å; L477-L507 HydrophobicContact CD1-CD1 4.4Å; V478-L507 HydrophobicContact CG2-CD1 3.84Å; L481-L507 HydrophobicContact CB-CD2 4.28Å; L481-L507 HydrophobicContact CD1-CD2 3.77Å; R502-L507 HydrophobicContact CB-CD2 4.38Å
508	K	94.7	Very high	92.3	Very high	49 Å²	49	52.6 Å²	52.6	21%	0.213	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.7	172.7	-71.1	-161.2	-176.1	178.8	0	109.9	E213 S500 A501 V506 Q553 V555	E213-K508 IonicContact OE1-NZ 2.95Å; E213-K508 PolarHBondContact OE1-NZ 3.08Å; E213-K508 IonicContact OE2-NZ 3.83Å; E213-K508 PolarHBondContact OE2-NZ 2.76Å; S500-K508 WeakPolarHBondContact CA-O 3.14Å; A501-K508 PolarHBondContact N-O 3.08Å; A501-K508 PolarHBondContact O-N 2.81Å; V506-K508 HydrophobicContact CG2-CG 4.26Å; K508-Q553 PolarHBondContact NZ-O 2.86Å; K508-V555 HydrophobicContact CB-CG2 4.06Å; K508-V555 HydrophobicContact CD-CG2 3.48Å; K508-V555 VanDerWaalsContact CD-CG2 3.48Å; K508-V555 HydrophobicContact CG-CG2 4.26Å
509	D	95.3	Very high	91.7	Very high	61 Å²	61	54.7 Å²	54.7	33%	0.326	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.2	175.4	-69.7	-35.7	0	0	0	110	R490 L498 V499 S500	R490-D509 IonicContact CZ-OD1 3.51Å; R490-D509 IonicContact CZ-OD2 3.33Å; R490-D509 IonicContact NE-OD1 2.86Å; R490-D509 IonicContact NH2-OD1 3.72Å; R490-D509 PolarHBondContact NH2-OD1 3.02Å; R490-D509 IonicContact NH2-OD2 3.81Å; R490-D509 PolarHBondContact NH2-OD2 3.41Å; L498-D509 HydrophobicContact CD1-CB 3.92Å; L498-D509 WeakPolarHBondContact CD1-OD1 3.46Å; V499-D509 CarbonylContact O-C 3.59Å; V499-D509 WeakPolarHBondContact O-CA 3.45Å; S500-D509 WeakPolarHBondContact CB-OD1 3.37Å; S500-D509 PolarHBondContact OG-OD1 2.97Å
510	I	95.5	Very high	91.4	Very high	3 Å²	3	57 Å²	57	2%	0.015	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	117.8	-178	-55.1	169.1	0	0	0	109.4	L498 V499 V512 Y515 L552 Q553 V555	L498-I510 CarbonylContact C-O 3.57Å; L498-I510 VanDerWaalsContact CA-O 3.27Å; L498-I510 WeakPolarHBondContact CA-O 3.33Å; L498-I510 WeakPolarHBondContact CB-O 3.4Å; V499-I510 PolarHBondContact N-O 2.77Å; V499-I510 PolarHBondContact O-N 3.19Å; I510-V512 PolarHBondContact O-N 2.75Å; I510-Y515 HydrophobicContact CG2-CE2 4.07Å; I510-L552 HydrophobicContact CB-CD2 4.23Å; I510-L552 HydrophobicContact CD1-CB 4.12Å; I510-L552 HydrophobicContact CD1-CD2 3.78Å; I510-L552 HydrophobicContact CD1-CG 3.9Å; I510-L552 VanDerWaalsContact CD1-O 3.27Å; I510-L552 WeakPolarHBondContact CD1-O 3.49Å; I510-L552 HydrophobicContact CG2-CD2 3.65Å; I510-L552 HydrophobicContact CG2-CG 3.98Å; I510-Q553 HydrophobicContact CD1-CB 4.36Å; I510-V555 HydrophobicContact CD1-CB 4.29Å; I510-V555 HydrophobicContact CD1-CG2 4.15Å
511	Y	95.4	Very high	91.1	Very high	106 Å²	106	58.4 Å²	58.4	42%	0.416	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	118.4	179.5	-68.1	-89.1	0	0	0	111.2	A496 L498 S514	A496-Y511 HydrophobicContact CB-CD1 4.09Å; A496-Y511 HydrophobicContact CB-CE1 4.09Å; L498-Y511 HydrophobicContact CB-CD1 4.28Å; L498-Y511 HydrophobicContact CD2-CE1 4.21Å; Y511-S514 PolarHBondContact O-N 3.1Å; Y511-S514 PolarHBondContact O-OG 2.98Å
512	V	91.7	Very high	90.9	Very high	3 Å²	3	63.1 Å²	63.1	2%	0.018	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-69.5	-38.1	-175.9	-177.1	0	0	0	0	110.8	L489 I497 V499 I510 S514 Y515 Y521 V538 F541	L489-V512 HydrophobicContact CD2-CG2 4.06Å; I497-V512 HydrophobicContact CG2-CB 4.4Å; I497-V512 HydrophobicContact CG2-CG2 4.16Å; I497-V512 PolarHBondContact O-N 2.64Å; V499-V512 HydrophobicContact CG2-CG2 3.66Å; I510-V512 PolarHBondContact O-N 2.75Å; V512-S514 PolarHBondContact O-N 3.03Å; V512-S514 VanDerWaalsContact O-N 3.11Å; V512-Y515 WeakPolarHBondContact O-CB 3.41Å; V512-Y515 PolarHBondContact O-N 3.11Å; V512-Y521 HydrophobicContact CG1-CD1 3.9Å; V512-Y521 HydrophobicContact CG1-CE1 3.69Å; V512-V538 HydrophobicContact CG1-CB 4.48Å; V512-V538 HydrophobicContact CG1-CG1 4.01Å; V512-V538 HydrophobicContact CG1-CG2 3.93Å; V512-V538 HydrophobicContact CG2-CG1 4.47Å; V512-F541 HydrophobicContact CG1-CD1 4.37Å
513	E	88.6	Confident	90.7	Very high	93 Å²	93	60.8 Å²	60.8	44%	0.435	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-58.4	-24.5	179.2	-65.9	167.7	-157.8	0	0	113.3	A496 I497 Y515 E516	A496-E513 WeakPolarHBondContact CA-OE1 3.4Å; I497-E513 PolarHBondContact N-OE1 3.15Å; E513-Y515 PolarHBondContact O-N 3.03Å; E513-Y515 VanDerWaalsContact O-N 3.12Å; E513-E516 WeakPolarHBondContact O-CB 3.23Å; E513-E516 PolarHBondContact O-N 3.24Å
514	S	89.4	Confident	90.3	Very high	78 Å²	78	62.6 Å²	62.6	55%	0.545	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-64.6	-15.1	174.9	71.9	0	0	0	0	113.7	Y511 V512	Y511-S514 PolarHBondContact O-N 3.1Å; Y511-S514 PolarHBondContact O-OG 2.98Å; V512-S514 PolarHBondContact O-N 3.03Å; V512-S514 VanDerWaalsContact O-N 3.11Å
515	Y	90.8	Very high	89.7	Confident	44 Å²	44	60.9 Å²	60.9	17%	0.173	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-103.3	-6	176.2	-61.8	-89.1	0	0	0	112.3	I510 V512 E513 Y521 K522 P524 F541 L552	I510-Y515 HydrophobicContact CG2-CE2 4.07Å; V512-Y515 WeakPolarHBondContact O-CB 3.41Å; V512-Y515 PolarHBondContact O-N 3.11Å; E513-Y515 PolarHBondContact O-N 3.03Å; E513-Y515 VanDerWaalsContact O-N 3.12Å; Y515-Y521 CarbonylContact O-C 3.57Å; Y515-Y521 WeakPolarHBondContact O-CA 3.36Å; Y515-K522 WeakPolarHBondContact O-CB 3.5Å; Y515-K522 PolarHBondContact O-N 3.4Å; Y515-P524 HydrophobicContact CE1-CG 4.33Å; Y515-F541 HydrophobicContact CD1-CE2 4.27Å; Y515-F541 AromaticContact CD1-CZ 3.99Å; Y515-F541 HydrophobicContact CD1-CZ 3.99Å; Y515-F541 HydrophobicContact CD2-CE1 4.42Å; Y515-F541 AromaticContact CD2-CZ 3.92Å; Y515-F541 HydrophobicContact CD2-CZ 3.92Å; Y515-F541 HydrophobicContact CE2-CZ 4.5Å; Y515-F541 HydrophobicContact CG-CE1 4.49Å; Y515-F541 HydrophobicContact CG-CE2 4.15Å; Y515-F541 AromaticContact CG-CZ 3.65Å; Y515-F541 HydrophobicContact CG-CZ 3.65Å; Y515-L552 HydrophobicContact CE1-CD1 3.78Å; Y515-L552 HydrophobicContact CE2-CD1 3.81Å; Y515-L552 HydrophobicContact CE2-CG 4.46Å; Y515-L552 WeakPolarHBondContact OH-CD1 3.29Å
516	E	90.7	Very high	88.9	Confident	97 Å²	97	58.7 Å²	58.7	45%	0.453	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	131.3	179.8	-165.5	-179	160	0	0	111.1	E513 Y520 Y521	E513-E516 WeakPolarHBondContact O-CB 3.23Å; E513-E516 PolarHBondContact O-N 3.24Å; E516-Y520 CarbonylContact C-O 3.59Å; E516-Y520 WeakPolarHBondContact CA-O 3.46Å; E516-Y521 HydrophobicContact CB-CD1 4.24Å; E516-Y521 HydrophobicContact CB-CE1 4.01Å; E516-Y521 HydrophobicContact CG-CE1 4.21Å
517	C	85.6	Confident	87.5	Confident	55 Å²	55	58.5 Å²	58.5	37%	0.372	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	112.3	179	-173.8	0	0	0	0	108.7	G519 Y520 F534	C517-G519 VanDerWaalsContact C-N 3.26Å; C517-G519 PolarHBondContact O-N 2.74Å; C517-Y520 PolarHBondContact N-O 3.36Å; C517-Y520 PolarHBondContact O-N 3.03Å; C517-F534 HydrophobicContact CB-CE1 4.17Å
518	S	82.2	Confident	85.5	Confident	113 Å²	113	60.5 Å²	60.5	79%	0.79	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	36.1	177.3	-55.4	0	0	0	0	114.5	Y520	S518-Y520 VanDerWaalsContact C-N 3.29Å; S518-Y520 PolarHBondContact O-N 3.27Å
519	G	83.7	Confident	83.8	Confident	45 Å²	45	65.8 Å²	65.8	46%	0.464	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	0.8	-179	0	0	0	0	0	115	C517	C517-G519 VanDerWaalsContact C-N 3.26Å; C517-G519 PolarHBondContact O-N 2.74Å
520	Y	90.5	Very high	82.2	Confident	48 Å²	48	64.8 Å²	64.8	19%	0.188	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	164.9	171	-62.2	-64.2	0	0	0	110.9	D105 V120 E516 C517 S518 F534 A535 K536	D105-Y520 WeakPolarHBondContact O-CE2 3.41Å; V120-Y520 HydrophobicContact CG1-CD1 3.93Å; V120-Y520 HydrophobicContact CG1-CE1 3.7Å; V120-Y520 HydrophobicContact CG1-CG 4.47Å; E516-Y520 CarbonylContact C-O 3.59Å; E516-Y520 WeakPolarHBondContact CA-O 3.46Å; C517-Y520 PolarHBondContact N-O 3.36Å; C517-Y520 PolarHBondContact O-N 3.03Å; S518-Y520 VanDerWaalsContact C-N 3.29Å; S518-Y520 PolarHBondContact O-N 3.27Å; Y520-F534 HydrophobicContact CG-CB 4.47Å; Y520-A535 CarbonylContact C-O 3.47Å; Y520-A535 WeakPolarHBondContact CA-O 3.48Å; Y520-K536 HydrophobicContact CD1-CG 4.44Å; Y520-K536 HydrophobicContact CE1-CG 4.18Å
521	Y	92.7	Very high	81.4	Confident	30 Å²	30	67.2 Å²	67.2	12%	0.118	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.6	175.8	-61.3	-87.5	0	0	0	110.4	V512 Y515 E516 L523 F534 A535 S537 V538 F541	V512-Y521 HydrophobicContact CG1-CD1 3.9Å; V512-Y521 HydrophobicContact CG1-CE1 3.69Å; Y515-Y521 CarbonylContact O-C 3.57Å; Y515-Y521 WeakPolarHBondContact O-CA 3.36Å; E516-Y521 HydrophobicContact CB-CD1 4.24Å; E516-Y521 HydrophobicContact CB-CE1 4.01Å; E516-Y521 HydrophobicContact CG-CE1 4.21Å; Y521-L523 PolarHBondContact O-N 2.96Å; Y521-F534 CarbonylContact O-C 3.53Å; Y521-F534 VanDerWaalsContact O-CA 3.24Å; Y521-F534 WeakPolarHBondContact O-CA 3.43Å; Y521-A535 PolarHBondContact N-O 3.03Å; Y521-A535 PolarHBondContact O-N 2.79Å; Y521-S537 VanDerWaalsContact CD2-C 3.49Å; Y521-V538 HydrophobicContact CE1-CG2 3.98Å; Y521-V538 HydrophobicContact CE2-CG2 3.91Å; Y521-V538 VanDerWaalsContact CZ-CG2 3.45Å; Y521-V538 VanDerWaalsContact OH-CG2 3.27Å; Y521-V538 WeakPolarHBondContact OH-CG2 3.25Å; Y521-F541 HydrophobicContact CG-CB 4.24Å; Y521-F541 HydrophobicContact CG-CG 4.42Å
522	K	92.7	Very high	80.9	Confident	99 Å²	99	63.7 Å²	63.7	43%	0.43	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	121.4	179.5	176.7	164.4	-178.5	174.5	0	110.6	Y515 T532 F534	Y515-K522 WeakPolarHBondContact O-CB 3.5Å; Y515-K522 PolarHBondContact O-N 3.4Å; K522-T532 HydrophobicContact CB-CG2 4.5Å; K522-T532 HydrophobicContact CD-CG2 3.75Å; K522-T532 HydrophobicContact CG-CG2 3.55Å; K522-F534 HydrophobicContact CB-CD1 4.05Å; K522-F534 HydrophobicContact CB-CE1 3.97Å; K522-F534 HydrophobicContact CG-CE1 4.36Å
523	L	91.8	Very high	81	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.016	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-82.1	140.7	179.7	-67.2	156.8	0	0	0	110.5	L46 T121 Y521 A525 E533 F534 F541 I544	L46-L523 HydrophobicContact CD2-CB 4.12Å; L46-L523 HydrophobicContact CD2-CD1 3.64Å; L46-L523 HydrophobicContact CD2-CG 4.35Å; T121-L523 HydrophobicContact CG2-CD1 4.29Å; Y521-L523 PolarHBondContact O-N 2.96Å; L523-A525 PolarHBondContact O-N 2.81Å; L523-E533 WeakPolarHBondContact CB-O 3.27Å; L523-E533 HydrophobicContact CD1-CB 4.08Å; L523-E533 PolarHBondContact N-O 2.75Å; L523-F534 VanDerWaalsContact CD1-C 3.42Å; L523-F534 WeakPolarHBondContact CD1-O 3.33Å; L523-F541 HydrophobicContact CD2-CD2 3.66Å; L523-F541 HydrophobicContact CD2-CE2 4.06Å; L523-F541 HydrophobicContact CG-CD2 4.48Å; L523-I544 HydrophobicContact CD1-CD1 3.69Å; L523-I544 HydrophobicContact CD1-CG2 4.11Å; L523-I544 HydrophobicContact CD2-CB 4.06Å; L523-I544 HydrophobicContact CD2-CD1 4.23Å; L523-I544 HydrophobicContact CD2-CG2 3.7Å
524	P	85.6	Confident	81.2	Confident	39 Å²	39	61 Å²	61	25%	0.253	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-60.8	123.6	174.4	-21.2	32.1	0	0	0	110.9	Y515 L545 V550 L552	Y515-P524 HydrophobicContact CE1-CG 4.33Å; P524-L545 HydrophobicContact CG-CD2 4.11Å; P524-V550 HydrophobicContact CB-CG1 3.91Å; P524-V550 HydrophobicContact CG-CG1 4.05Å; P524-L552 HydrophobicContact CG-CD1 4.12Å
525	A	76.1	Confident	81.3	Confident	56 Å²	56	57.3 Å²	57.3	46%	0.463	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-95.3	144	175.8	0	0	0	0	0	110.6	L523 N527	L523-A525 PolarHBondContact O-N 2.81Å; A525-N527 WeakPolarHBondContact CB-O 3.45Å
526	R	68.8	Low	81.2	Confident	78 Å²	78	59.1 Å²	59.1	29%	0.294	34%	0.339	S	S	.	.	S	Bend	trans	-72.9	-31	175.3	-162.4	179.9	176.3	173.8	0.8	112.3	D191	D191-R526 IonicContact OD1-NH2 3.82Å; D191-R526 PolarHBondContact OD1-NH2 2.77Å
527	N	62.1	Low	81.2	Confident	69 Å²	69	56.7 Å²	56.7	37%	0.369	33%	0.333	S	S	.	.	S	Bend	trans	-114.3	131.1	173.2	-74.3	-17.6	0	0	0	109.4	Q188 A525 D529 T530	Q188-N527 PolarHBondContact NE2-OD1 3.45Å; A525-N527 WeakPolarHBondContact CB-O 3.45Å; N527-D529 PolarHBondContact O-N 2.83Å; N527-T530 HydrophobicContact CB-CG2 3.71Å; N527-T530 PolarHBondContact O-OG1 3.38Å
528	A	52.3	Low	81.6	Confident	102 Å²	102	54.3 Å²	54.3	84%	0.843	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.5	175.5	0	0	0	0	0	112.3	T530	A528-T530 VanDerWaalsContact C-N 3.25Å; A528-T530 PolarHBondContact O-N 3.01Å
529	D	57.3	Low	82.1	Confident	159 Å²	159	49.2 Å²	49.2	85%	0.85	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	11.6	-176.7	-57.7	-35.8	0	0	0	113.5	N527	N527-D529 PolarHBondContact O-N 2.83Å
530	T	62.5	Low	82.5	Confident	41 Å²	41	47.5 Å²	47.5	25%	0.252	26%	0.261	S	S	.	.	S	Bend	trans	-105.4	163.9	178.9	51.7	0	0	0	0	112.9	N527 A528 T532	N527-T530 HydrophobicContact CB-CG2 3.71Å; N527-T530 PolarHBondContact O-OG1 3.38Å; A528-T530 VanDerWaalsContact C-N 3.25Å; A528-T530 PolarHBondContact O-N 3.01Å; T530-T532 PolarHBondContact O-N 3.03Å
531	F	78.1	Confident	82.7	Confident	54 Å²	54	45.2 Å²	45.2	24%	0.237	25%	0.252	C	S	.	.			trans	-43.6	135.6	166.9	-56.1	-88.2	0	0	0	110.3	L76 L82 P84 F108	L76-F531 HydrophobicContact CD2-CE2 4.39Å; L82-F531 WeakPolarHBondContact O-CE2 3.24Å; P84-F531 VanDerWaalsContact CD-CE1 3.4Å; P84-F531 HydrophobicContact CG-CD1 3.91Å; P84-F531 HydrophobicContact CG-CD2 3.14Å; P84-F531 HydrophobicContact CG-CE1 3.87Å; P84-F531 HydrophobicContact CG-CE2 3.24Å; P84-F531 HydrophobicContact CG-CG 3.6Å; P84-F531 HydrophobicContact CG-CZ 3.62Å; F108-F531 HydrophobicContact CE1-CB 4.1Å; F108-F531 HydrophobicContact CE1-CD1 4.33Å; F108-F531 HydrophobicContact CE1-CG 4.49Å; F108-F531 HydrophobicContact CZ-CB 4.2Å
532	T	86.8	Confident	82.8	Confident	32 Å²	32	43.8 Å²	43.8	20%	0.196	25%	0.246	C	C	.	.			trans	-89.7	118.2	174.7	-61.9	0	0	0	0	107.8	Q102 K522 T530 F534	Q102-T532 PolarHBondContact NE2-O 3.12Å; K522-T532 HydrophobicContact CB-CG2 4.5Å; K522-T532 HydrophobicContact CD-CG2 3.75Å; K522-T532 HydrophobicContact CG-CG2 3.55Å; T530-T532 PolarHBondContact O-N 3.03Å; T532-F534 HydrophobicContact CG2-CD1 4.35Å; T532-F534 HydrophobicContact CG2-CD2 4.32Å; T532-F534 HydrophobicContact CG2-CE1 3.76Å; T532-F534 HydrophobicContact CG2-CE2 3.73Å; T532-F534 HydrophobicContact CG2-CZ 3.42Å; T532-F534 VanDerWaalsContact CG2-CZ 3.42Å; T532-F534 WeakPolarHBondContact O-CD2 3.49Å; T532-F534 VanDerWaalsContact O-CE2 3.27Å; T532-F534 WeakPolarHBondContact O-CE2 3.39Å
533	E	92.3	Very high	82.8	Confident	18 Å²	18	39.1 Å²	39.1	8%	0.084	23%	0.226	C	C	.	.			trans	-87.4	151.9	168.8	-63.6	-173.3	96.4	0	0	109.5	L46 L47 F108 T121 I122 L523	L46-E533 WeakPolarHBondContact CA-OE2 3.34Å; L46-E533 HydrophobicContact CD2-CB 4Å; L46-E533 WeakPolarHBondContact CD2-OE2 3.38Å; L47-E533 PolarHBondContact N-OE2 3.25Å; F108-E533 HydrophobicContact CE2-CG 4.04Å; F108-E533 HydrophobicContact CZ-CG 4.11Å; T121-E533 WeakPolarHBondContact CA-OE1 3.31Å; T121-E533 WeakPolarHBondContact CB-OE1 3.43Å; T121-E533 HydrophobicContact CG2-CB 4.37Å; I122-E533 PolarHBondContact N-OE1 3.26Å; L523-E533 WeakPolarHBondContact CB-O 3.27Å; L523-E533 HydrophobicContact CD1-CB 4.08Å; L523-E533 PolarHBondContact N-O 2.75Å
534	F	92.7	Very high	82.9	Confident	21 Å²	21	39 Å²	39	9%	0.092	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	166.2	-178.9	-56.2	-96	0	0	0	111.8	V120 T121 C517 Y520 Y521 K522 L523 T532	V120-F534 HydrophobicContact CB-CB 4.12Å; V120-F534 WeakPolarHBondContact CB-O 3.45Å; V120-F534 WeakPolarHBondContact CG2-O 3.36Å; V120-F534 PolarHBondContact O-N 3.09Å; T121-F534 WeakPolarHBondContact CG2-O 3.45Å; C517-F534 HydrophobicContact CB-CE1 4.17Å; Y520-F534 HydrophobicContact CG-CB 4.47Å; Y521-F534 CarbonylContact O-C 3.53Å; Y521-F534 VanDerWaalsContact O-CA 3.24Å; Y521-F534 WeakPolarHBondContact O-CA 3.43Å; K522-F534 HydrophobicContact CB-CD1 4.05Å; K522-F534 HydrophobicContact CB-CE1 3.97Å; K522-F534 HydrophobicContact CG-CE1 4.36Å; L523-F534 VanDerWaalsContact CD1-C 3.42Å; L523-F534 WeakPolarHBondContact CD1-O 3.33Å; T532-F534 HydrophobicContact CG2-CD1 4.35Å; T532-F534 HydrophobicContact CG2-CD2 4.32Å; T532-F534 HydrophobicContact CG2-CE1 3.76Å; T532-F534 HydrophobicContact CG2-CE2 3.73Å; T532-F534 HydrophobicContact CG2-CZ 3.42Å; T532-F534 VanDerWaalsContact CG2-CZ 3.42Å; T532-F534 WeakPolarHBondContact O-CD2 3.49Å; T532-F534 VanDerWaalsContact O-CE2 3.27Å; T532-F534 WeakPolarHBondContact O-CE2 3.39Å
535	A	92.4	Very high	83.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	147.9	168.5	0	0	0	0	0	110.7	Y520 Y521 E540 F541 I544	Y520-A535 CarbonylContact C-O 3.47Å; Y520-A535 WeakPolarHBondContact CA-O 3.48Å; Y521-A535 PolarHBondContact N-O 3.03Å; Y521-A535 PolarHBondContact O-N 2.79Å; A535-E540 HydrophobicContact CB-CB 4.1Å; A535-E540 HydrophobicContact CB-CG 4.02Å; A535-F541 HydrophobicContact CB-CB 3.8Å; A535-I544 HydrophobicContact CB-CD1 4.02Å
536	K	88.3	Confident	84.1	Confident	82 Å²	82	35 Å²	35	36%	0.357	20%	0.195	S	C	.	.	S	Bend	trans	-79.7	-20.1	-178	-58.3	-178.5	179.8	-177.4	0	113.9	A118 V120 Y520 E540	A118-K536 WeakPolarHBondContact O-CE 3.49Å; A118-K536 PolarHBondContact O-NZ 3.42Å; V120-K536 HydrophobicContact CG1-CG 4.17Å; V120-K536 HydrophobicContact CG2-CD 4.45Å; V120-K536 HydrophobicContact CG2-CG 3.72Å; Y520-K536 HydrophobicContact CD1-CG 4.44Å; Y520-K536 HydrophobicContact CE1-CG 4.18Å; K536-E540 VanDerWaalsContact CB-OE2 3.24Å; K536-E540 WeakPolarHBondContact CB-OE2 3.47Å; K536-E540 WeakPolarHBondContact CG-OE2 3.48Å; K536-E540 PolarHBondContact N-OE2 2.77Å
537	S	90.5	Very high	85	Confident	47 Å²	47	34.4 Å²	34.4	33%	0.329	19%	0.192	S	C	.	.	S	Bend	trans	-148	165.5	-177.6	68	0	0	0	0	111.2	Y521 D539 E540 F541	Y521-S537 VanDerWaalsContact CD2-C 3.49Å; S537-D539 PolarHBondContact O-N 2.71Å; S537-E540 PolarHBondContact O-N 3.47Å; S537-E540 WeakPolarHBondContact OG-CB 3.4Å; S537-E540 PolarHBondContact OG-N 3.25Å; S537-F541 WeakPolarHBondContact O-CB 3.43Å; S537-F541 PolarHBondContact O-N 3.21Å
538	V	93.4	Very high	86.3	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-41.1	171.6	177.5	0	0	0	0	110.8	V462 L489 V512 Y521 F541 L542	V462-V538 HydrophobicContact CG2-CB 4.06Å; V462-V538 HydrophobicContact CG2-CG2 3.63Å; L489-V538 HydrophobicContact CD1-CG1 3.73Å; L489-V538 HydrophobicContact CD2-CG1 4Å; V512-V538 HydrophobicContact CG1-CB 4.48Å; V512-V538 HydrophobicContact CG1-CG1 4.01Å; V512-V538 HydrophobicContact CG1-CG2 3.93Å; V512-V538 HydrophobicContact CG2-CG1 4.47Å; Y521-V538 HydrophobicContact CE1-CG2 3.98Å; Y521-V538 HydrophobicContact CE2-CG2 3.91Å; Y521-V538 VanDerWaalsContact CZ-CG2 3.45Å; Y521-V538 VanDerWaalsContact OH-CG2 3.27Å; Y521-V538 WeakPolarHBondContact OH-CG2 3.25Å; V538-F541 WeakPolarHBondContact O-CB 3.35Å; V538-F541 PolarHBondContact O-N 2.88Å; V538-L542 HydrophobicContact CG1-CD1 3.99Å; V538-L542 HydrophobicContact CG1-CG 4.36Å; V538-L542 VanDerWaalsContact O-CG 3.3Å; V538-L542 WeakPolarHBondContact O-CG 3.22Å; V538-L542 PolarHBondContact O-N 3.17Å
539	D	93.4	Very high	88.1	Confident	6 Å²	6	29 Å²	29	3%	0.032	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-49.8	179.2	-176.7	54.9	0	0	0	111.4	L456 E457 L465 Y467 S537 F541 L542 K543	L456-D539 WeakPolarHBondContact CA-OD2 3.32Å; E457-D539 PolarHBondContact N-OD2 3.16Å; L465-D539 HydrophobicContact CD1-CB 4.1Å; L465-D539 HydrophobicContact CD2-CB 3.65Å; Y467-D539 WeakPolarHBondContact CE1-OD1 3.36Å; Y467-D539 WeakPolarHBondContact OH-CA 3.47Å; Y467-D539 PolarHBondContact OH-OD1 3.19Å; S537-D539 PolarHBondContact O-N 2.71Å; D539-F541 VanDerWaalsContact C-N 3.27Å; D539-F541 PolarHBondContact O-N 3.03Å; D539-L542 PolarHBondContact O-N 3.29Å; D539-K543 VanDerWaalsContact O-CB 3.32Å; D539-K543 WeakPolarHBondContact O-CB 3.4Å; D539-K543 WeakPolarHBondContact O-CG 3.48Å; D539-K543 PolarHBondContact O-N 3.21Å; D539-K543 VanDerWaalsContact OD1-CE 3.22Å; D539-K543 WeakPolarHBondContact OD1-CE 3.36Å
540	E	92	Very high	89.6	Confident	10 Å²	10	21.9 Å²	21.9	5%	0.047	11%	0.109	C	C	.	.	H	α-helix	trans	-58.9	-41.1	176.1	-172.7	178.6	-155.1	0	0	111.6	L456 A535 K536 S537 K543 I544	L456-E540 HydrophobicContact CD1-CB 4.03Å; L456-E540 HydrophobicContact CD1-CG 4Å; L456-E540 HydrophobicContact CD2-CB 4.08Å; L456-E540 HydrophobicContact CD2-CG 4.3Å; A535-E540 HydrophobicContact CB-CB 4.1Å; A535-E540 HydrophobicContact CB-CG 4.02Å; K536-E540 VanDerWaalsContact CB-OE2 3.24Å; K536-E540 WeakPolarHBondContact CB-OE2 3.47Å; K536-E540 WeakPolarHBondContact CG-OE2 3.48Å; K536-E540 PolarHBondContact N-OE2 2.77Å; S537-E540 PolarHBondContact O-N 3.47Å; S537-E540 WeakPolarHBondContact OG-CB 3.4Å; S537-E540 PolarHBondContact OG-N 3.25Å; E540-K543 PolarHBondContact O-N 3.33Å; E540-I544 HydrophobicContact CG-CD1 3.78Å; E540-I544 HydrophobicContact CG-CG1 4.24Å; E540-I544 WeakPolarHBondContact O-CB 3.31Å; E540-I544 WeakPolarHBondContact O-CG1 3.49Å; E540-I544 PolarHBondContact O-N 2.96Å
541	F	94.6	Very high	90.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-55.8	-54.8	175.8	174.6	-109.1	0	0	0	111.6	V512 Y515 Y521 L523 A535 S537 V538 D539 K543 I544 L545 L552	V512-F541 HydrophobicContact CG1-CD1 4.37Å; Y515-F541 HydrophobicContact CD1-CE2 4.27Å; Y515-F541 AromaticContact CD1-CZ 3.99Å; Y515-F541 HydrophobicContact CD1-CZ 3.99Å; Y515-F541 HydrophobicContact CD2-CE1 4.42Å; Y515-F541 AromaticContact CD2-CZ 3.92Å; Y515-F541 HydrophobicContact CD2-CZ 3.92Å; Y515-F541 HydrophobicContact CE2-CZ 4.5Å; Y515-F541 HydrophobicContact CG-CE1 4.49Å; Y515-F541 HydrophobicContact CG-CE2 4.15Å; Y515-F541 AromaticContact CG-CZ 3.65Å; Y515-F541 HydrophobicContact CG-CZ 3.65Å; Y521-F541 HydrophobicContact CG-CB 4.24Å; Y521-F541 HydrophobicContact CG-CG 4.42Å; L523-F541 HydrophobicContact CD2-CD2 3.66Å; L523-F541 HydrophobicContact CD2-CE2 4.06Å; L523-F541 HydrophobicContact CG-CD2 4.48Å; A535-F541 HydrophobicContact CB-CB 3.8Å; S537-F541 WeakPolarHBondContact O-CB 3.43Å; S537-F541 PolarHBondContact O-N 3.21Å; V538-F541 WeakPolarHBondContact O-CB 3.35Å; V538-F541 PolarHBondContact O-N 2.88Å; D539-F541 VanDerWaalsContact C-N 3.27Å; D539-F541 PolarHBondContact O-N 3.03Å; F541-K543 PolarHBondContact O-N 3.02Å; F541-I544 PolarHBondContact O-N 2.64Å; F541-L545 HydrophobicContact CD1-CD1 4.19Å; F541-L545 HydrophobicContact CE1-CD1 3.72Å; F541-L545 HydrophobicContact CE2-CD1 4.23Å; F541-L545 HydrophobicContact CZ-CD1 3.75Å; F541-L545 WeakPolarHBondContact O-CG 3.05Å; F541-L545 PolarHBondContact O-N 2.96Å; F541-L545 VanDerWaalsContact O-N 3.13Å; F541-L552 HydrophobicContact CE1-CD2 4.35Å; F541-L552 HydrophobicContact CZ-CD1 3.98Å
542	L	95.2	Very high	91.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67	-40.4	-177.6	-60.5	176.6	0	0	0	112.1	Y467 Y487 L489 V499 V538 D539 I544 L545 V546 L557	Y467-L542 HydrophobicContact CE2-CD1 3.85Å; Y487-L542 HydrophobicContact CE2-CB 4.27Å; Y487-L542 HydrophobicContact CE2-CD1 3.97Å; L489-L542 HydrophobicContact CD1-CD1 4.06Å; L489-L542 HydrophobicContact CD2-CD1 3.93Å; L489-L542 HydrophobicContact CG-CD1 3.98Å; V499-L542 HydrophobicContact CG2-CD1 3.83Å; V499-L542 HydrophobicContact CG2-CD2 3.47Å; V499-L542 VanDerWaalsContact CG2-CD2 3.47Å; V499-L542 HydrophobicContact CG2-CG 4.29Å; V538-L542 HydrophobicContact CG1-CD1 3.99Å; V538-L542 HydrophobicContact CG1-CG 4.36Å; V538-L542 VanDerWaalsContact O-CG 3.3Å; V538-L542 WeakPolarHBondContact O-CG 3.22Å; V538-L542 PolarHBondContact O-N 3.17Å; D539-L542 PolarHBondContact O-N 3.29Å; L542-I544 VanDerWaalsContact C-N 3.34Å; L542-I544 PolarHBondContact O-N 3.29Å; L542-L545 HydrophobicContact CD2-CD1 4.35Å; L542-L545 WeakPolarHBondContact O-CB 3.42Å; L542-L545 PolarHBondContact O-N 3.34Å; L542-V546 WeakPolarHBondContact O-CG2 3.38Å; L542-V546 PolarHBondContact O-N 3.38Å; L542-L557 HydrophobicContact CD2-CD1 3.85Å
543	K	93.3	Very high	91.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-68.3	-32.9	179.8	-60.8	-74.7	176.8	-176.9	0	111.6	A43 R452 E453 L456 D539 E540 F541 R547	A43-K543 VanDerWaalsContact CB-C 3.43Å; A43-K543 HydrophobicContact CB-CB 3.53Å; R452-K543 PolarHBondContact O-NZ 3.08Å; E453-K543 WeakPolarHBondContact O-CD 3.22Å; E453-K543 IonicContact OE2-NZ 2.68Å; E453-K543 PolarHBondContact OE2-NZ 3.02Å; L456-K543 HydrophobicContact CD2-CB 3.84Å; L456-K543 HydrophobicContact CD2-CG 3.97Å; D539-K543 VanDerWaalsContact O-CB 3.32Å; D539-K543 WeakPolarHBondContact O-CB 3.4Å; D539-K543 WeakPolarHBondContact O-CG 3.48Å; D539-K543 PolarHBondContact O-N 3.21Å; D539-K543 VanDerWaalsContact OD1-CE 3.22Å; D539-K543 WeakPolarHBondContact OD1-CE 3.36Å; E540-K543 PolarHBondContact O-N 3.33Å; F541-K543 PolarHBondContact O-N 3.02Å; K543-R547 WeakPolarHBondContact O-CB 3.38Å; K543-R547 PolarHBondContact O-N 3.2Å
544	I	92.8	Very high	91.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64	-45.4	170.1	-71.4	169.2	0	0	0	110.3	A43 P44 L46 T121 L523 A535 E540 F541 L542 V546 R547 N548	A43-I544 HydrophobicContact CB-CG1 3.99Å; P44-I544 HydrophobicContact CG-CD1 3.53Å; P44-I544 HydrophobicContact CG-CG1 3.76Å; L46-I544 HydrophobicContact CD1-CG2 4.35Å; L46-I544 HydrophobicContact CD2-CG2 3.92Å; L46-I544 HydrophobicContact CG-CG2 3.91Å; T121-I544 HydrophobicContact CG2-CD1 4.34Å; L523-I544 HydrophobicContact CD1-CD1 3.69Å; L523-I544 HydrophobicContact CD1-CG2 4.11Å; L523-I544 HydrophobicContact CD2-CB 4.06Å; L523-I544 HydrophobicContact CD2-CD1 4.23Å; L523-I544 HydrophobicContact CD2-CG2 3.7Å; A535-I544 HydrophobicContact CB-CD1 4.02Å; E540-I544 HydrophobicContact CG-CD1 3.78Å; E540-I544 HydrophobicContact CG-CG1 4.24Å; E540-I544 WeakPolarHBondContact O-CB 3.31Å; E540-I544 WeakPolarHBondContact O-CG1 3.49Å; E540-I544 PolarHBondContact O-N 2.96Å; F541-I544 PolarHBondContact O-N 2.64Å; L542-I544 VanDerWaalsContact C-N 3.34Å; L542-I544 PolarHBondContact O-N 3.29Å; I544-V546 PolarHBondContact O-N 3.11Å; I544-R547 PolarHBondContact O-N 3.01Å; I544-N548 WeakPolarHBondContact CG2-ND2 3.38Å; I544-N548 WeakPolarHBondContact O-CB 3.36Å; I544-N548 PolarHBondContact O-N 2.79Å; I544-N548 PolarHBondContact O-ND2 3.15Å
545	L	93.9	Very high	91.1	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.4	-45.9	178.1	-64	174.1	0	0	0	111.3	P524 F541 L542 Q549 V550 L552 L557	P524-L545 HydrophobicContact CG-CD2 4.11Å; F541-L545 HydrophobicContact CD1-CD1 4.19Å; F541-L545 HydrophobicContact CE1-CD1 3.72Å; F541-L545 HydrophobicContact CE2-CD1 4.23Å; F541-L545 HydrophobicContact CZ-CD1 3.75Å; F541-L545 WeakPolarHBondContact O-CG 3.05Å; F541-L545 PolarHBondContact O-N 2.96Å; F541-L545 VanDerWaalsContact O-N 3.13Å; L542-L545 HydrophobicContact CD2-CD1 4.35Å; L542-L545 WeakPolarHBondContact O-CB 3.42Å; L542-L545 PolarHBondContact O-N 3.34Å; L545-Q549 CarbonylContact O-C 3.58Å; L545-Q549 WeakPolarHBondContact O-CA 3.41Å; L545-Q549 PolarHBondContact O-N 2.91Å; L545-V550 HydrophobicContact CD2-CB 3.67Å; L545-V550 HydrophobicContact CD2-CG1 3.65Å; L545-V550 PolarHBondContact O-N 3.13Å; L545-L552 HydrophobicContact CD1-CB 4.23Å; L545-L552 HydrophobicContact CD1-CD1 3.94Å; L545-L552 HydrophobicContact CD1-CD2 3.82Å; L545-L552 HydrophobicContact CD1-CG 4.22Å; L545-L557 HydrophobicContact CD1-CD1 4.32Å
546	V	92.8	Very high	91.1	Very high	13 Å²	13	20 Å²	20	8%	0.079	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-51.2	175.6	171.9	0	0	0	0	111	E453 L454 Y487 L542 I544 N548 Q549 L557 K558	E453-V546 HydrophobicContact CB-CG1 4.33Å; L454-V546 HydrophobicContact CD2-CG1 4.32Å; Y487-V546 HydrophobicContact CE1-CG2 3.68Å; L542-V546 WeakPolarHBondContact O-CG2 3.38Å; L542-V546 PolarHBondContact O-N 3.38Å; I544-V546 PolarHBondContact O-N 3.11Å; V546-N548 VanDerWaalsContact C-N 3.32Å; V546-N548 PolarHBondContact O-N 2.93Å; V546-Q549 PolarHBondContact O-N 2.8Å; V546-L557 HydrophobicContact CG2-CB 3.71Å; V546-K558 WeakPolarHBondContact CG1-O 3.31Å
547	R	89.4	Confident	91.3	Very high	64 Å²	64	16.1 Å²	16.1	24%	0.242	8%	0.083	C	C	.	.	H	α-helix	trans	-57.9	-44.9	-178.2	-178.9	172.3	177.2	133.8	1.9	112.3	A43 L454 K543 I544	A43-R547 WeakPolarHBondContact O-CD 3.31Å; A43-R547 PolarHBondContact O-NE 2.84Å; A43-R547 PolarHBondContact O-NH1 3.48Å; L454-R547 HydrophobicContact CD2-CB 3.76Å; L454-R547 HydrophobicContact CD2-CG 4.16Å; K543-R547 WeakPolarHBondContact O-CB 3.38Å; K543-R547 PolarHBondContact O-N 3.2Å; I544-R547 PolarHBondContact O-N 3.01Å
548	N	88.8	Confident	91.4	Very high	2 Å²	2	18 Å²	18	1%	0.011	9%	0.085	C	C	.	.	H	α-helix	trans	-91.3	-5.2	-175	-63.6	-82.7	0	0	0	112.2	P44 Q45 L46 Y49 R258 I544 V546 V550	P44-N548 PolarHBondContact O-ND2 2.67Å; Q45-N548 WeakPolarHBondContact CA-OD1 3.48Å; L46-N548 HydrophobicContact CD1-CB 4.49Å; L46-N548 PolarHBondContact N-OD1 3.02Å; L46-N548 VanDerWaalsContact N-OD1 3.11Å; Y49-N548 HydrophobicContact CD2-CB 4.25Å; Y49-N548 HydrophobicContact CE2-CB 4.37Å; R258-N548 PolarHBondContact NH1-O 3.41Å; I544-N548 WeakPolarHBondContact CG2-ND2 3.38Å; I544-N548 WeakPolarHBondContact O-CB 3.36Å; I544-N548 PolarHBondContact O-N 2.79Å; I544-N548 PolarHBondContact O-ND2 3.15Å; V546-N548 VanDerWaalsContact C-N 3.32Å; V546-N548 PolarHBondContact O-N 2.93Å; N548-V550 HydrophobicContact CB-CG2 3.68Å; N548-V550 PolarHBondContact O-N 3.35Å
549	Q	89.1	Confident	91.3	Very high	56 Å²	56	22.8 Å²	22.8	26%	0.262	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	42.1	-172.7	-61.1	-177.3	9.1	0	0	112.4	R258 Q265 L545 V546 I556	R258-Q549 PolarHBondContact O-OE1 2.94Å; Q265-Q549 PolarHBondContact OE1-O 3.49Å; L545-Q549 CarbonylContact O-C 3.58Å; L545-Q549 WeakPolarHBondContact O-CA 3.41Å; L545-Q549 PolarHBondContact O-N 2.91Å; V546-Q549 PolarHBondContact O-N 2.8Å; Q549-I556 HydrophobicContact CB-CG2 3.92Å; Q549-I556 HydrophobicContact CG-CG2 4.28Å
550	V	89.5	Confident	91.4	Very high	9 Å²	9	22.5 Å²	22.5	6%	0.055	11%	0.106	C	C	.	.			trans	-76.9	128.9	179.3	175	0	0	0	0	108.5	L46 Y49 P524 L545 N548 L552	L46-V550 HydrophobicContact CD1-CG2 3.71Å; Y49-V550 HydrophobicContact CE2-CG2 3.99Å; P524-V550 HydrophobicContact CB-CG1 3.91Å; P524-V550 HydrophobicContact CG-CG1 4.05Å; L545-V550 HydrophobicContact CD2-CB 3.67Å; L545-V550 HydrophobicContact CD2-CG1 3.65Å; L545-V550 PolarHBondContact O-N 3.13Å; N548-V550 HydrophobicContact CB-CG2 3.68Å; N548-V550 PolarHBondContact O-N 3.35Å; V550-L552 PolarHBondContact O-N 3.08Å
551	S	89.1	Confident	91.5	Very high	23 Å²	23	23.1 Å²	23.1	16%	0.161	11%	0.11	C	C	.	.			trans	-65.7	126.3	174.5	-175.3	0	0	0	0	110.7	W212 G554 V555	W212-S551 VanDerWaalsContact CZ2-CB 3.49Å; W212-S551 WeakPolarHBondContact CZ2-OG 3.35Å; S551-G554 WeakPolarHBondContact OG-CA 3.44Å; S551-G554 PolarHBondContact OG-N 3.5Å; S551-G554 VanDerWaalsContact OG-N 3.14Å; S551-V555 CarbonylContact C-O 3.39Å; S551-V555 WeakPolarHBondContact CA-O 3.21Å
552	L	89.2	Confident	91.3	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-111.2	103.5	170.6	-165	72.1	0	0	0	107.8	I510 Y515 P524 F541 L545 V550 G554 V555	I510-L552 HydrophobicContact CB-CD2 4.23Å; I510-L552 HydrophobicContact CD1-CB 4.12Å; I510-L552 HydrophobicContact CD1-CD2 3.78Å; I510-L552 HydrophobicContact CD1-CG 3.9Å; I510-L552 VanDerWaalsContact CD1-O 3.27Å; I510-L552 WeakPolarHBondContact CD1-O 3.49Å; I510-L552 HydrophobicContact CG2-CD2 3.65Å; I510-L552 HydrophobicContact CG2-CG 3.98Å; Y515-L552 HydrophobicContact CE1-CD1 3.78Å; Y515-L552 HydrophobicContact CE2-CD1 3.81Å; Y515-L552 HydrophobicContact CE2-CG 4.46Å; Y515-L552 WeakPolarHBondContact OH-CD1 3.29Å; P524-L552 HydrophobicContact CG-CD1 4.12Å; F541-L552 HydrophobicContact CE1-CD2 4.35Å; F541-L552 HydrophobicContact CZ-CD1 3.98Å; L545-L552 HydrophobicContact CD1-CB 4.23Å; L545-L552 HydrophobicContact CD1-CD1 3.94Å; L545-L552 HydrophobicContact CD1-CD2 3.82Å; L545-L552 HydrophobicContact CD1-CG 4.22Å; V550-L552 PolarHBondContact O-N 3.08Å; L552-G554 PolarHBondContact O-N 2.81Å; L552-V555 PolarHBondContact N-O 3.42Å; L552-V555 WeakPolarHBondContact O-CB 3.49Å; L552-V555 PolarHBondContact O-N 3.09Å
553	Q	86.7	Confident	90.8	Very high	100 Å²	100	28.8 Å²	28.8	47%	0.467	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	48.8	-174.3	-53.6	-174	17	0	0	111.9	K508 I510 V555	K508-Q553 PolarHBondContact NZ-O 2.86Å; I510-Q553 HydrophobicContact CD1-CB 4.36Å; Q553-V555 VanDerWaalsContact C-N 3.25Å; Q553-V555 PolarHBondContact O-N 3.24Å
554	G	86.5	Confident	89.8	Confident	1 Å²	1	33 Å²	33	1%	0.01	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	-11.4	179.8	0	0	0	0	0	116.8	W212 E213 W503 S551 L552	W212-G554 PolarHBondContact NE1-O 2.82Å; E213-G554 WeakPolarHBondContact OE1-CA 3.45Å; E213-G554 PolarHBondContact OE1-N 3.08Å; E213-G554 VanDerWaalsContact OE1-N 3.14Å; W503-G554 PolarHBondContact NE1-O 2.82Å; W503-G554 VanDerWaalsContact NE1-O 3.14Å; S551-G554 WeakPolarHBondContact OG-CA 3.44Å; S551-G554 PolarHBondContact OG-N 3.5Å; S551-G554 VanDerWaalsContact OG-N 3.14Å; L552-G554 PolarHBondContact O-N 2.81Å
555	V	91.5	Very high	87.9	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-93.1	132.7	-176.7	-175.4	0	0	0	0	109.8	A501 W503 K508 I510 S551 L552 Q553 L557	A501-V555 HydrophobicContact CB-CG1 3.86Å; W503-V555 HydrophobicContact CB-CG1 4.15Å; W503-V555 HydrophobicContact CB-CG2 4.13Å; W503-V555 HydrophobicContact CD2-CG1 4.31Å; W503-V555 HydrophobicContact CE3-CG1 4.28Å; W503-V555 HydrophobicContact CG-CG1 4.27Å; W503-V555 HydrophobicContact CG-CG2 4.26Å; K508-V555 HydrophobicContact CB-CG2 4.06Å; K508-V555 HydrophobicContact CD-CG2 3.48Å; K508-V555 VanDerWaalsContact CD-CG2 3.48Å; K508-V555 HydrophobicContact CG-CG2 4.26Å; I510-V555 HydrophobicContact CD1-CB 4.29Å; I510-V555 HydrophobicContact CD1-CG2 4.15Å; S551-V555 CarbonylContact C-O 3.39Å; S551-V555 WeakPolarHBondContact CA-O 3.21Å; L552-V555 PolarHBondContact N-O 3.42Å; L552-V555 WeakPolarHBondContact O-CB 3.49Å; L552-V555 PolarHBondContact O-N 3.09Å; Q553-V555 VanDerWaalsContact C-N 3.25Å; Q553-V555 PolarHBondContact O-N 3.24Å; V555-L557 HydrophobicContact CG1-CD2 3.82Å
556	I	92.5	Very high	85.8	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.227	C	C	.	.			trans	-103.6	108.6	166.8	-60.9	171.8	0	0	0	107.8	W212 I260 Q265 G485 W503 Q549	W212-I556 HydrophobicContact CH2-CD1 3.78Å; W212-I556 HydrophobicContact CH2-CG1 4.33Å; W212-I556 HydrophobicContact CZ2-CD1 3.72Å; W212-I556 HydrophobicContact CZ2-CG1 3.96Å; I260-I556 HydrophobicContact CD1-CD1 3.25Å; I260-I556 HydrophobicContact CG1-CD1 4.12Å; Q265-I556 HydrophobicContact CB-CD1 4.15Å; G485-I556 WeakPolarHBondContact CA-O 3.38Å; W503-I556 HydrophobicContact CH2-CB 3.61Å; W503-I556 HydrophobicContact CH2-CD1 4.22Å; W503-I556 HydrophobicContact CH2-CG1 4.1Å; W503-I556 HydrophobicContact CZ2-CB 4.3Å; W503-I556 HydrophobicContact CZ2-CD1 4.47Å; W503-I556 HydrophobicContact CZ2-CG1 4.36Å; W503-I556 HydrophobicContact CZ3-CB 3.95Å; W503-I556 VanDerWaalsContact CZ3-O 3.24Å; W503-I556 WeakPolarHBondContact CZ3-O 3.26Å; Q549-I556 HydrophobicContact CB-CG2 3.92Å; Q549-I556 HydrophobicContact CG-CG2 4.28Å
557	L	94.1	Very high	83.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.			trans	-67.9	138.2	173.6	-53.3	-179.4	0	0	0	109.4	Y487 V499 A501 L542 L545 V546 V555	Y487-L557 HydrophobicContact CD1-CB 3.8Å; Y487-L557 HydrophobicContact CD1-CD2 4.17Å; Y487-L557 HydrophobicContact CD1-CG 4.39Å; Y487-L557 HydrophobicContact CE1-CB 3.98Å; Y487-L557 HydrophobicContact CG-CB 4.39Å; Y487-L557 HydrophobicContact CG-CD1 4.43Å; Y487-L557 HydrophobicContact CG-CD2 3.98Å; V499-L557 HydrophobicContact CG1-CD1 4.33Å; V499-L557 HydrophobicContact CG1-CD2 4.15Å; A501-L557 HydrophobicContact CB-CD2 3.74Å; L542-L557 HydrophobicContact CD2-CD1 3.85Å; L545-L557 HydrophobicContact CD1-CD1 4.32Å; V546-L557 HydrophobicContact CG2-CB 3.71Å; V555-L557 HydrophobicContact CG1-CD2 3.82Å
558	K	91	Very high	81.9	Confident	88 Å²	88	48.6 Å²	48.6	38%	0.383	24%	0.244	S	C	.	.			trans	-128.6	-46	-178.8	-63.3	-179.2	-165.3	150.9	0	112.7	D484 G485 V546	D484-K558 WeakPolarHBondContact O-CD 3.5Å; D484-K558 PolarHBondContact O-NZ 3.02Å; G485-K558 PolarHBondContact O-N 3.5Å; V546-K558 WeakPolarHBondContact CG1-O 3.31Å
559	Q	92	Very high	79.6	Confident	103 Å²	103	51.3 Å²	51.3	48%	0.481	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	125	-170.5	-177.9	171.3	0.8	0	0	111.4	G485 D486 Y487 V561	G485-Q559 PolarHBondContact O-N 3.28Å; G485-Q559 VanDerWaalsContact O-N 3.16Å; D486-Q559 WeakPolarHBondContact CA-O 3.31Å; Y487-Q559 VanDerWaalsContact CD1-C 3.47Å; Y487-Q559 WeakPolarHBondContact CD1-O 3.45Å; Y487-Q559 PolarHBondContact N-O 3.04Å; Q559-V561 PolarHBondContact O-N 3.22Å
560	A	94.6	Very high	77.6	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.008	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	121	172.4	0	0	0	0	0	110.5	E453 Y467 Y487 R562	E453-A560 WeakPolarHBondContact OE2-CB 3.34Å; E453-A560 PolarHBondContact OE2-N 3.27Å; E453-A560 VanDerWaalsContact OE2-N 3.09Å; Y467-A560 HydrophobicContact CD1-CB 3.93Å; Y467-A560 HydrophobicContact CD2-CB 4.26Å; Y467-A560 HydrophobicContact CG-CB 3.78Å; Y487-A560 HydrophobicContact CE1-CB 4.08Å; Y487-A560 HydrophobicContact CE2-CB 4.01Å; Y487-A560 CarbonylContact O-C 3.6Å; Y487-A560 WeakPolarHBondContact O-CA 3.31Å; A560-R562 PolarHBondContact O-NH1 3.49Å
561	V	94.8	Very high	75.4	Confident	23 Å²	23	54.9 Å²	54.9	14%	0.139	29%	0.285	C	S	.	.			trans	-77.2	122.3	169.3	178.4	0	0	0	0	107.9	Y467 F469 L480 L481 D486 Y487 Q559	Y467-V561 WeakPolarHBondContact CA-O 3.48Å; Y467-V561 WeakPolarHBondContact CB-O 3.4Å; F469-V561 WeakPolarHBondContact CE2-O 3.27Å; L480-V561 HydrophobicContact CB-CG1 4.25Å; L480-V561 HydrophobicContact CD2-CG1 4.46Å; L481-V561 HydrophobicContact CD2-CB 4.21Å; L481-V561 HydrophobicContact CD2-CG2 3.77Å; D486-V561 HydrophobicContact CB-CG2 3.89Å; Y487-V561 PolarHBondContact O-N 2.96Å; Q559-V561 PolarHBondContact O-N 3.22Å
562	R	91.2	Very high	73.3	Confident	58 Å²	58	56.1 Å²	56.1	22%	0.219	30%	0.297	C	S	.	.			trans	-108	150.2	-174.1	-68.6	175.2	-176.8	80.5	-6.2	111.2	R452 E453 E457 S466 A560 T564	R452-R562 PolarHBondContact O-NH2 3.21Å; E453-R562 IonicContact OE1-CZ 3.77Å; E453-R562 IonicContact OE1-NH1 3.57Å; E453-R562 PolarHBondContact OE1-NH1 3.24Å; E453-R562 IonicContact OE1-NH2 3.06Å; E453-R562 PolarHBondContact OE1-NH2 3.1Å; E453-R562 VanDerWaalsContact OE1-NH2 3.16Å; E453-R562 IonicContact OE2-CZ 3.68Å; E453-R562 IonicContact OE2-NH1 3.44Å; E453-R562 IonicContact OE2-NH2 3.97Å; E453-R562 PolarHBondContact OE2-NH2 2.9Å; E457-R562 IonicContact OE1-NE 3.16Å; E457-R562 PolarHBondContact OE1-NE 3.16Å; E457-R562 IonicContact OE1-NH2 3.38Å; S466-R562 CarbonylContact O-C 3.49Å; S466-R562 VanDerWaalsContact O-CA 3.31Å; S466-R562 WeakPolarHBondContact O-CA 3.4Å; S466-R562 WeakPolarHBondContact O-CB 3.38Å; S466-R562 WeakPolarHBondContact OG-CD 3.04Å; S466-R562 WeakPolarHBondContact OG-CG 3.45Å; S466-R562 PolarHBondContact OG-NE 2.84Å; S466-R562 VanDerWaalsContact OG-NE 3.17Å; A560-R562 PolarHBondContact O-NH1 3.49Å; R562-T564 PolarHBondContact O-N 3.35Å
563	K	85	Confident	71.2	Confident	61 Å²	61	61.5 Å²	61.5	27%	0.265	33%	0.325	S	S	.	.			trans	-56.2	124.9	170	-73.8	176	167.8	163.7	0	109	S466 Y468 F469	S466-K563 PolarHBondContact O-N 3.3Å; Y468-K563 WeakPolarHBondContact O-CE 3.44Å; Y468-K563 PolarHBondContact O-NZ 2.66Å; F469-K563 HydrophobicContact CD1-CG 4.03Å; F469-K563 HydrophobicContact CD2-CG 4.32Å; F469-K563 HydrophobicContact CE1-CG 3.69Å; F469-K563 HydrophobicContact CE2-CG 3.98Å; F469-K563 HydrophobicContact CG-CG 4.35Å; F469-K563 HydrophobicContact CZ-CB 4.34Å; F469-K563 HydrophobicContact CZ-CG 3.66Å
564	T	71.8	Confident	69.2	Low	88 Å²	88	63.1 Å²	63.1	54%	0.54	33%	0.333	S	S	.	.			trans	-88.3	157.7	164.5	61.7	0	0	0	0	108.3	R562 K566 Y567	R562-T564 PolarHBondContact O-N 3.35Å; T564-K566 PolarHBondContact O-N 3.49Å; T564-Y567 WeakPolarHBondContact O-CB 3.17Å; T564-Y567 PolarHBondContact O-N 3.39Å
565	S	52.6	Low	67	Low	105 Å²	105	73.3 Å²	73.3	73%	0.734	37%	0.371	S	S	*	.	H	α-helix	trans	-55.2	-18.8	176.5	50.8	0	0	0	0	114.2
566	K	49.9	Very low	64.4	Low	162 Å²	162	79.9 Å²	79.9	70%	0.704	41%	0.407	S	S	*	.	H	α-helix	trans	-68.2	-32.4	171.2	-83.4	-173.2	172.7	-174.2	0	113.4	T564 S569 V570	T564-K566 PolarHBondContact O-N 3.49Å; K566-S569 PolarHBondContact O-N 3.3Å; K566-S569 PolarHBondContact O-OG 2.88Å; K566-V570 WeakPolarHBondContact O-CG2 3.39Å; K566-V570 PolarHBondContact O-N 2.94Å
567	Y	50.2	Low	61.6	Low	45 Å²	45	91.2 Å²	91.2	18%	0.176	46%	0.459	C	S	.	.	H	α-helix	trans	-72	-37.8	-178.1	-143.5	-85	0	0	0	111.2	F469 I472 L480 T564 S569 V570 Q571	F469-Y567 HydrophobicContact CD1-CD1 4.08Å; F469-Y567 AromaticContact CD1-CE1 3.87Å; F469-Y567 HydrophobicContact CD1-CE1 3.87Å; F469-Y567 HydrophobicContact CD1-CE2 4.44Å; F469-Y567 HydrophobicContact CD1-CG 4.47Å; F469-Y567 HydrophobicContact CE1-CD1 4.12Å; F469-Y567 HydrophobicContact CE1-CD2 4.07Å; F469-Y567 HydrophobicContact CE1-CE1 4.22Å; F469-Y567 HydrophobicContact CE1-CE2 4.16Å; F469-Y567 HydrophobicContact CE1-CG 4.05Å; I472-Y567 WeakPolarHBondContact CD1-OH 3.39Å; L480-Y567 HydrophobicContact CD1-CE2 4.07Å; L480-Y567 HydrophobicContact CD2-CD2 4.49Å; L480-Y567 HydrophobicContact CD2-CE2 4.24Å; T564-Y567 WeakPolarHBondContact O-CB 3.17Å; T564-Y567 PolarHBondContact O-N 3.39Å; Y567-S569 VanDerWaalsContact C-N 3.26Å; Y567-S569 PolarHBondContact O-N 2.68Å; Y567-V570 PolarHBondContact O-N 3.13Å; Y567-V570 VanDerWaalsContact O-N 3.13Å; Y567-Q571 PolarHBondContact O-N 3.47Å; Y567-Q571 VanDerWaalsContact O-N 3.17Å
568	D	50.1	Low	60	Low	92 Å²	92	95.8 Å²	95.8	49%	0.492	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-34	175.8	-65.7	-24.6	0	0	0	112	A572	D568-A572 VanDerWaalsContact O-CB 3.29Å; D568-A572 WeakPolarHBondContact O-CB 3.5Å; D568-A572 PolarHBondContact O-N 3.34Å
569	S	41.3	Very low	58.4	Low	60 Å²	60	96.2 Å²	96.2	42%	0.42	49%	0.487	S	S	.	.	H	α-helix	trans	-69.4	-33.6	174.7	44.7	0	0	0	0	113.5	K566 Y567 A572 D573	K566-S569 PolarHBondContact O-N 3.3Å; K566-S569 PolarHBondContact O-OG 2.88Å; Y567-S569 VanDerWaalsContact C-N 3.26Å; Y567-S569 PolarHBondContact O-N 2.68Å; S569-A572 PolarHBondContact O-N 3.19Å; S569-D573 PolarHBondContact O-N 2.49Å
570	V	46.1	Very low	56.5	Low	82 Å²	82	95.8 Å²	95.8	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-73.2	-42	-179.3	178.7	0	0	0	0	110.8	K566 Y567 D573 E574	K566-V570 WeakPolarHBondContact O-CG2 3.39Å; K566-V570 PolarHBondContact O-N 2.94Å; Y567-V570 PolarHBondContact O-N 3.13Å; Y567-V570 VanDerWaalsContact O-N 3.13Å; V570-D573 PolarHBondContact O-N 3.24Å; V570-E574 PolarHBondContact O-N 3.5Å
571	Q	44.1	Very low	54.3	Low	57 Å²	57	101.4 Å²	101.4	27%	0.266	52%	0.516	S	S	.	.	H	α-helix	trans	-68.5	-33.4	173.2	-89.5	-171.4	-17.4	0	0	112.6	Y567 D573 E574 W575	Y567-Q571 PolarHBondContact O-N 3.47Å; Y567-Q571 VanDerWaalsContact O-N 3.17Å; Q571-D573 PolarHBondContact O-N 2.65Å; Q571-E574 PolarHBondContact O-N 2.82Å; Q571-W575 PolarHBondContact O-N 3.12Å
572	A	44.8	Very low	51.7	Low	50 Å²	50	106.3 Å²	106.3	41%	0.413	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-27.9	176.5	0	0	0	0	0	113	D568 S569 N576	D568-A572 VanDerWaalsContact O-CB 3.29Å; D568-A572 WeakPolarHBondContact O-CB 3.5Å; D568-A572 PolarHBondContact O-N 3.34Å; S569-A572 PolarHBondContact O-N 3.19Å; A572-N576 PolarHBondContact O-ND2 3.25Å
573	D	44.4	Very low	49.1	Very low	114 Å²	114	109.5 Å²	109.5	61%	0.61	56%	0.561	S	S	*	*	H	α-helix	trans	-79	-37	176.4	-73.7	-20.1	0	0	0	111.7	S569 V570 Q571 W575 N576	S569-D573 PolarHBondContact O-N 2.49Å; V570-D573 PolarHBondContact O-N 3.24Å; Q571-D573 PolarHBondContact O-N 2.65Å; D573-W575 VanDerWaalsContact C-N 3.28Å; D573-W575 PolarHBondContact O-N 3.07Å; D573-N576 PolarHBondContact O-N 2.84Å; D573-N576 VanDerWaalsContact O-N 3.14Å
574	E	43.8	Very low	46.5	Very low	135 Å²	135	112.9 Å²	112.9	63%	0.631	58%	0.582	S	S	*	*	H	α-helix	trans	-68.1	-21.9	176.6	-77.7	-173.2	160.9	0	0	114.3	V570 Q571	V570-E574 PolarHBondContact O-N 3.5Å; Q571-E574 PolarHBondContact O-N 2.82Å
575	W	40.6	Very low	44.6	Very low	215 Å²	215	114.8 Å²	114.8	81%	0.814	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-3.7	174.8	-73.3	66.2	0	0	0	113.4	Q571 D573	Q571-W575 PolarHBondContact O-N 3.12Å; D573-W575 VanDerWaalsContact C-N 3.28Å; D573-W575 PolarHBondContact O-N 3.07Å
576	N	38.1	Very low	43.9	Very low	138 Å²	138	115.7 Å²	115.7	74%	0.738	57%	0.573	S	S	*	*			trans	-106.1	1.4	177	-77.9	-43.1	0	0	0	113.8	A572 D573	A572-N576 PolarHBondContact O-ND2 3.25Å; D573-N576 PolarHBondContact O-N 2.84Å; D573-N576 VanDerWaalsContact O-N 3.14Å
577	E	34	Very low	43.4	Very low	238 Å²	238	111.5 Å²	111.5	100%	1.112	56%	0.561	S	S	*	*			trans	-100.2	0	163.9	-70.8	-168.4	161	0	0	111.1

Retrieved 577 of 577 residues in 997.8 ms (Link to these results)

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