A0A077Z485_TRITR Loading...

Cuticlin 1

AlphaFold DB , UniProt , Accession A0A077Z485, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 507 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	36.9	Very low	58.4	Low	222 Å²	222	134.9 Å²	134.9	100%	1.094	66%	0.662	S	S	*	*				0	124.9	0	-85.2	153.3	76.9	0	0	108.2	Y3	M1-Y3 PolarHBondContact O-N 3.25Å; M1-Y3 VanDerWaalsContact O-N 3.17Å
2	N	43.3	Very low	59.5	Low	160 Å²	160	130.7 Å²	130.7	86%	0.856	64%	0.644	S	S	*	*			trans	-69.8	101.1	-166.3	-68.9	-21.3	0	0	0	112.7	H4	N2-H4 PolarHBondContact O-N 3.47Å
3	Y	48.4	Very low	60.5	Low	224 Å²	224	127.7 Å²	127.7	88%	0.878	63%	0.631	S	S	*	*			trans	-79.6	69	166.7	-77.9	-86.9	0	0	0	110.3	M1	M1-Y3 PolarHBondContact O-N 3.25Å; M1-Y3 VanDerWaalsContact O-N 3.17Å
4	H	52.6	Low	61.4	Low	155 Å²	155	125 Å²	125	72%	0.718	62%	0.619	S	S	*	*			trans	-126.4	10.3	175.4	-115.6	-74.2	0	0	0	115	N2	N2-H4 PolarHBondContact O-N 3.47Å
5	W	50.7	Low	62	Low	245 Å²	245	120.3 Å²	120.3	93%	0.928	60%	0.603	S	S	*	*			trans	-116.4	52.7	177.4	-69.9	85.5	0	0	0	112.3	S7	W5-S7 PolarHBondContact O-N 3.21Å
6	I	55.8	Low	62.4	Low	102 Å²	102	114.6 Å²	114.6	52%	0.523	58%	0.581	S	S	.	*			trans	-85.3	103.3	153.2	-57.9	175.9	0	0	0	104.8	R11	I6-R11 HydrophobicContact CG2-CG 4.39Å
7	S	67.4	Low	62.7	Low	72 Å²	72	113.6 Å²	113.6	50%	0.503	58%	0.577	S	S	.	*			trans	-54.1	156	179	67.9	0	0	0	0	110.6	W5 A9 G10 R11	W5-S7 PolarHBondContact O-N 3.21Å; S7-A9 PolarHBondContact O-N 2.99Å; S7-G10 WeakPolarHBondContact O-CA 3.46Å; S7-G10 PolarHBondContact O-N 3.01Å; S7-R11 PolarHBondContact O-N 3.16Å
8	A	70.1	Confident	62.8	Low	78 Å²	78	114.2 Å²	114.2	65%	0.645	58%	0.58	S	S	*	*	H	α-helix	trans	-50.7	-31.5	177.3	0	0	0	0	0	112.8	R11 L12	A8-R11 PolarHBondContact O-N 3.2Å; A8-L12 PolarHBondContact O-N 3.32Å; A8-L12 VanDerWaalsContact O-N 3.09Å
9	A	65.6	Low	63	Low	39 Å²	39	114.2 Å²	114.2	32%	0.322	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-38.1	173.9	0	0	0	0	0	113.4	S7 L12 L13	S7-A9 PolarHBondContact O-N 2.99Å; A9-L12 PolarHBondContact O-N 3.2Å; A9-L13 WeakPolarHBondContact O-CB 3.38Å; A9-L13 PolarHBondContact O-N 3.41Å
10	G	76.7	Confident	62.9	Low	17 Å²	17	112.3 Å²	112.3	18%	0.175	59%	0.589	C	S	.	*	H	α-helix	trans	-66.6	-36.7	175.1	0	0	0	0	0	112.5	S7 I14	S7-G10 WeakPolarHBondContact O-CA 3.46Å; S7-G10 PolarHBondContact O-N 3.01Å; G10-I14 WeakPolarHBondContact O-CD1 3.45Å; G10-I14 WeakPolarHBondContact O-CG1 3.43Å; G10-I14 PolarHBondContact O-N 2.91Å; G10-I14 VanDerWaalsContact O-N 3.07Å
11	R	74.6	Confident	62.6	Low	170 Å²	170	112.3 Å²	112.3	64%	0.642	59%	0.589	S	S	*	*	H	α-helix	trans	-66.1	-41.5	174.4	-64.3	-175.3	-179	-166.8	-2.8	111.8	I6 S7 A8 I14 S15	I6-R11 HydrophobicContact CG2-CG 4.39Å; S7-R11 PolarHBondContact O-N 3.16Å; A8-R11 PolarHBondContact O-N 3.2Å; R11-I14 PolarHBondContact O-N 3.42Å; R11-S15 PolarHBondContact O-N 2.92Å; R11-S15 PolarHBondContact O-OG 3.08Å
12	L	72.2	Confident	63.5	Low	84 Å²	84	104.2 Å²	104.2	44%	0.44	56%	0.563	S	S	.	*	H	α-helix	trans	-65.7	-41.3	177.8	-114.9	152.8	0	0	0	112.6	A8 A9 S15 A16 F470	A8-L12 PolarHBondContact O-N 3.32Å; A8-L12 VanDerWaalsContact O-N 3.09Å; A9-L12 PolarHBondContact O-N 3.2Å; L12-S15 WeakPolarHBondContact CA-OG 3.29Å; L12-S15 PolarHBondContact O-N 3.1Å; L12-S15 PolarHBondContact O-OG 3.43Å; L12-A16 WeakPolarHBondContact O-CB 3.49Å; L12-A16 PolarHBondContact O-N 2.92Å; L12-F470 HydrophobicContact CD2-CE1 4.07Å
13	L	71.6	Confident	64.1	Low	92 Å²	92	107.7 Å²	107.7	48%	0.482	56%	0.564	S	S	.	*	H	α-helix	trans	-63	-43.5	174.1	-91.2	159	0	0	0	112.1	A9 A16 L17	A9-L13 WeakPolarHBondContact O-CB 3.38Å; A9-L13 PolarHBondContact O-N 3.41Å; L13-A16 PolarHBondContact O-N 2.85Å; L13-L17 WeakPolarHBondContact O-CB 3.23Å; L13-L17 PolarHBondContact O-N 2.84Å
14	I	72.9	Confident	64.6	Low	90 Å²	90	103 Å²	103	46%	0.462	56%	0.559	S	S	.	*	H	α-helix	trans	-64.5	-42.4	176.6	-66.6	164.2	0	0	0	110.5	G10 R11 L17 L18	G10-I14 WeakPolarHBondContact O-CD1 3.45Å; G10-I14 WeakPolarHBondContact O-CG1 3.43Å; G10-I14 PolarHBondContact O-N 2.91Å; G10-I14 VanDerWaalsContact O-N 3.07Å; R11-I14 PolarHBondContact O-N 3.42Å; I14-L17 PolarHBondContact O-N 3.38Å; I14-L18 HydrophobicContact CG2-CD1 3.92Å; I14-L18 HydrophobicContact CG2-CG 4.49Å; I14-L18 WeakPolarHBondContact O-CB 3.39Å; I14-L18 VanDerWaalsContact O-CG 3.28Å; I14-L18 WeakPolarHBondContact O-CG 3.47Å; I14-L18 PolarHBondContact O-N 3.27Å
15	S	70.3	Confident	65.3	Low	55 Å²	55	102.6 Å²	102.6	39%	0.385	57%	0.567	S	S	.	*	H	α-helix	trans	-65.2	-39.3	175.4	56.6	0	0	0	0	112.8	R11 L12 L18 V19	R11-S15 PolarHBondContact O-N 2.92Å; R11-S15 PolarHBondContact O-OG 3.08Å; L12-S15 WeakPolarHBondContact CA-OG 3.29Å; L12-S15 PolarHBondContact O-N 3.1Å; L12-S15 PolarHBondContact O-OG 3.43Å; S15-L18 PolarHBondContact O-N 2.88Å; S15-V19 WeakPolarHBondContact O-CG2 3.35Å; S15-V19 PolarHBondContact O-N 3.45Å
16	A	69.1	Low	66.1	Low	29 Å²	29	98 Å²	98	24%	0.24	55%	0.554	C	S	.	*	H	α-helix	trans	-67	-39.1	176.9	0	0	0	0	0	111.8	L12 L13 L18 V19 A20	L12-A16 WeakPolarHBondContact O-CB 3.49Å; L12-A16 PolarHBondContact O-N 2.92Å; L13-A16 PolarHBondContact O-N 2.85Å; A16-L18 VanDerWaalsContact C-N 3.35Å; A16-V19 PolarHBondContact O-N 2.93Å; A16-A20 VanDerWaalsContact O-CB 3.25Å; A16-A20 WeakPolarHBondContact O-CB 3.32Å; A16-A20 PolarHBondContact O-N 3.14Å
17	L	67.6	Low	67.1	Low	98 Å²	98	96.6 Å²	96.6	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-38.2	171.9	-89.7	151.7	0	0	0	112.1	L13 I14 N21	L13-L17 WeakPolarHBondContact O-CB 3.23Å; L13-L17 PolarHBondContact O-N 2.84Å; I14-L17 PolarHBondContact O-N 3.38Å; L17-N21 VanDerWaalsContact O-CB 3.25Å; L17-N21 WeakPolarHBondContact O-CB 3.4Å; L17-N21 VanDerWaalsContact O-CG 3.32Å; L17-N21 PolarHBondContact O-N 3.34Å
18	L	65.2	Low	67.7	Low	123 Å²	123	101.3 Å²	101.3	64%	0.644	56%	0.558	S	S	*	*	H	α-helix	trans	-68.9	-38.8	176.2	-75.6	165.7	0	0	0	112.2	I14 S15 A16 N21 G22	I14-L18 HydrophobicContact CG2-CD1 3.92Å; I14-L18 HydrophobicContact CG2-CG 4.49Å; I14-L18 WeakPolarHBondContact O-CB 3.39Å; I14-L18 VanDerWaalsContact O-CG 3.28Å; I14-L18 WeakPolarHBondContact O-CG 3.47Å; I14-L18 PolarHBondContact O-N 3.27Å; S15-L18 PolarHBondContact O-N 2.88Å; A16-L18 VanDerWaalsContact C-N 3.35Å; L18-N21 CarbonylContact O-C 3.56Å; L18-G22 PolarHBondContact O-N 2.96Å
19	V	65.3	Low	68.5	Low	115 Å²	115	98.1 Å²	98.1	70%	0.697	53%	0.53	S	S	*	.	H	α-helix	trans	-71.8	-40.2	175.9	175.8	0	0	0	0	111.4	S15 A16 N21 G22	S15-V19 WeakPolarHBondContact O-CG2 3.35Å; S15-V19 PolarHBondContact O-N 3.45Å; A16-V19 PolarHBondContact O-N 2.93Å; V19-N21 VanDerWaalsContact C-N 3.27Å; V19-N21 PolarHBondContact O-N 2.98Å; V19-G22 PolarHBondContact O-N 3.25Å; V19-G22 VanDerWaalsContact O-N 3.17Å
20	A	62.3	Low	69.7	Low	76 Å²	76	98.5 Å²	98.5	63%	0.628	53%	0.526	S	S	*	.	H	α-helix	trans	-66.3	-30.3	176	0	0	0	0	0	112.5	A16 G22	A16-A20 VanDerWaalsContact O-CB 3.25Å; A16-A20 WeakPolarHBondContact O-CB 3.32Å; A16-A20 PolarHBondContact O-N 3.14Å; A20-G22 VanDerWaalsContact C-N 3.32Å
21	N	55.4	Low	70.4	Confident	112 Å²	112	98.4 Å²	98.4	60%	0.599	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	22.3	174.6	-68.3	-14.8	0	0	0	113	L17 L18 V19 R23	L17-N21 VanDerWaalsContact O-CB 3.25Å; L17-N21 WeakPolarHBondContact O-CB 3.4Å; L17-N21 VanDerWaalsContact O-CG 3.32Å; L17-N21 PolarHBondContact O-N 3.34Å; L18-N21 CarbonylContact O-C 3.56Å; V19-N21 VanDerWaalsContact C-N 3.27Å; V19-N21 PolarHBondContact O-N 2.98Å; N21-R23 PolarHBondContact O-N 3.46Å
22	G	55.7	Low	71.2	Confident	52 Å²	52	93 Å²	93	54%	0.536	51%	0.512	S	S	.	.			trans	-57.7	86.4	165.3	0	0	0	0	0	109.1	L18 V19 A20 T24	L18-G22 PolarHBondContact O-N 2.96Å; V19-G22 PolarHBondContact O-N 3.25Å; V19-G22 VanDerWaalsContact O-N 3.17Å; A20-G22 VanDerWaalsContact C-N 3.32Å; G22-T24 VanDerWaalsContact C-N 3.29Å; G22-T24 PolarHBondContact O-N 2.92Å
23	R	56.3	Low	72.1	Confident	233 Å²	233	91.2 Å²	91.2	88%	0.879	51%	0.51	S	S	*	.			trans	-64.2	96.9	172.7	-72.4	-177.5	177.9	178.3	-1.1	105.4	N21 V25	N21-R23 PolarHBondContact O-N 3.46Å; R23-V25 PolarHBondContact O-N 3.36Å
24	T	59.9	Low	73.1	Confident	127 Å²	127	91.8 Å²	91.8	78%	0.779	52%	0.517	S	S	*	.			trans	-57.4	112.8	161.9	56.1	0	0	0	0	105.4	G22 K26	G22-T24 VanDerWaalsContact C-N 3.29Å; G22-T24 PolarHBondContact O-N 2.92Å; T24-K26 PolarHBondContact O-N 3.18Å
25	V	65.9	Low	74.1	Confident	145 Å²	145	88.3 Å²	88.3	88%	0.879	50%	0.501	S	S	*	.			trans	-67.4	90.2	174	179.5	0	0	0	0	106	R23	R23-V25 PolarHBondContact O-N 3.36Å
26	K	68	Low	75.3	Confident	150 Å²	150	92.3 Å²	92.3	65%	0.652	51%	0.513	S	S	*	.			trans	-79.4	124.3	173.7	-164.7	-175.4	176.4	-171.5	0	106.6	T24 Q28	T24-K26 PolarHBondContact O-N 3.18Å; K26-Q28 PolarHBondContact O-N 3.47Å
27	F	76.4	Confident	76.6	Confident	71 Å²	71	93.4 Å²	93.4	31%	0.311	52%	0.517	S	S	.	.			trans	-56.8	131.4	167.6	-166.3	-101.5	0	0	0	108.1	N29 L107 L115	F27-N29 VanDerWaalsContact C-N 3.33Å; F27-N29 HydrophobicContact CD1-CB 4.01Å; F27-N29 WeakPolarHBondContact CD1-O 3.36Å; F27-N29 HydrophobicContact CE1-CB 3.64Å; F27-N29 PolarHBondContact O-N 3.44Å; F27-L107 HydrophobicContact CD1-CB 4.42Å; F27-L107 HydrophobicContact CE1-CB 3.84Å; F27-L107 WeakPolarHBondContact CZ-O 3.43Å; F27-L115 HydrophobicContact CB-CD1 3.41Å; F27-L115 VanDerWaalsContact CB-CD1 3.41Å; F27-L115 HydrophobicContact CD1-CD1 4.15Å; F27-L115 HydrophobicContact CG-CD1 4.09Å
28	Q	80.5	Confident	78	Confident	172 Å²	172	92.1 Å²	92.1	80%	0.804	51%	0.508	S	S	*	.	S	Bend	trans	-74.3	-26.1	-167	-68	-179.4	-1.2	0	0	113	K26 S52	K26-Q28 PolarHBondContact O-N 3.47Å; Q28-S52 WeakPolarHBondContact O-CB 3.43Å; Q28-S52 PolarHBondContact O-OG 3.45Å; Q28-S52 VanDerWaalsContact O-OG 3.1Å
29	N	87.9	Confident	79.4	Confident	11 Å²	11	89 Å²	89	6%	0.059	50%	0.496	C	S	.	.			trans	-90.1	143.8	-179.4	-150.4	8.9	0	0	0	111.8	F27 T51 S52 G53 L54	F27-N29 VanDerWaalsContact C-N 3.33Å; F27-N29 HydrophobicContact CD1-CB 4.01Å; F27-N29 WeakPolarHBondContact CD1-O 3.36Å; F27-N29 HydrophobicContact CE1-CB 3.64Å; F27-N29 PolarHBondContact O-N 3.44Å; N29-T51 PolarHBondContact OD1-N 3.47Å; N29-S52 WeakPolarHBondContact CA-OG 3.33Å; N29-S52 WeakPolarHBondContact CB-OG 3.33Å; N29-S52 PolarHBondContact N-OG 3.21Å; N29-S52 PolarHBondContact OD1-N 3.5Å; N29-S52 PolarHBondContact OD1-OG 3.02Å; N29-G53 PolarHBondContact ND2-O 2.89Å; N29-G53 PolarHBondContact OD1-N 3Å; N29-G53 PolarHBondContact OD1-O 3.4Å; N29-L54 PolarHBondContact ND2-O 3.47Å
30	D	90.1	Very high	80.8	Confident	46 Å²	46	86.1 Å²	86.1	25%	0.246	48%	0.476	C	S	.	.			trans	-151.6	171.7	178.1	-155.2	-14.6	0	0	0	109	T50 T51	D30-T50 CarbonylContact O-C 3.52Å; D30-T50 WeakPolarHBondContact O-CA 3.46Å; D30-T51 HydrophobicContact CB-CG2 4.19Å; D30-T51 PolarHBondContact N-OG1 3.3Å; D30-T51 PolarHBondContact O-N 3.31Å; D30-T51 PolarHBondContact O-OG1 3.03Å
31	F	91.3	Very high	82	Confident	16 Å²	16	86.4 Å²	86.4	7%	0.07	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-82.5	122.4	175.8	-64.3	-93	0	0	0	110.3	L48 V105 L107 L115 R117 Y119	F31-L48 HydrophobicContact CE1-CD2 4.48Å; F31-V105 HydrophobicContact CE1-CB 3.79Å; F31-V105 HydrophobicContact CE1-CG1 3.54Å; F31-V105 HydrophobicContact CE1-CG2 4.28Å; F31-V105 HydrophobicContact CZ-CB 3.74Å; F31-V105 HydrophobicContact CZ-CG1 3.6Å; F31-L107 HydrophobicContact CD2-CD1 3.99Å; F31-L107 HydrophobicContact CE2-CD1 3.6Å; F31-L107 HydrophobicContact CE2-CG 3.97Å; F31-L107 HydrophobicContact CZ-CD1 4.26Å; F31-L107 HydrophobicContact CZ-CD2 4.39Å; F31-L107 HydrophobicContact CZ-CG 4.15Å; F31-L115 VanDerWaalsContact CE2-O 3.26Å; F31-L115 WeakPolarHBondContact CE2-O 3.38Å; F31-R117 HydrophobicContact CD2-CG 4.11Å; F31-R117 HydrophobicContact CE1-CB 4.46Å; F31-R117 HydrophobicContact CE2-CB 4.1Å; F31-R117 HydrophobicContact CE2-CG 3.66Å; F31-R117 HydrophobicContact CZ-CB 3.89Å; F31-R117 HydrophobicContact CZ-CG 3.99Å; F31-Y119 HydrophobicContact CE1-CE2 4.19Å
32	A	91.3	Very high	83.6	Confident	55 Å²	55	86.2 Å²	86.2	46%	0.455	47%	0.467	S	S	.	.	S	Bend	trans	-77.4	-32.7	174.2	0	0	0	0	0	111.8	N49 T51	A32-N49 HydrophobicContact CB-CB 4.29Å; A32-N49 WeakPolarHBondContact CB-O 3.46Å; A32-N49 PolarHBondContact N-O 3.01Å; A32-T51 HydrophobicContact CB-CG2 4.09Å
33	A	91.4	Very high	85.4	Confident	47 Å²	47	83.7 Å²	83.7	39%	0.388	44%	0.442	S	S	.	.	S	Bend	trans	-149.7	173.5	177.8	0	0	0	0	0	111.4	N49	A33-N49 HydrophobicContact CB-CB 4.49Å
34	V	92.3	Very high	87.3	Confident	104 Å²	104	72.6 Å²	72.6	63%	0.63	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-66.4	141.5	164.3	-179.5	0	0	0	0	108.1	Y119	V34-Y119 HydrophobicContact CG1-CE1 4.31Å
35	P	94.4	Very high	89	Confident	18 Å²	18	67.2 Å²	67.2	12%	0.117	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-54.8	145.3	175.7	14.4	-27.1	0	0	0	113.3	V46 K47 L48 Y119	P35-V46 HydrophobicContact CB-CG1 4.05Å; P35-K47 CarbonylContact C-O 3.34Å; P35-K47 VanDerWaalsContact CA-O 3.24Å; P35-K47 WeakPolarHBondContact CA-O 3.38Å; P35-K47 WeakPolarHBondContact CB-O 3.42Å; P35-L48 HydrophobicContact CB-CD2 3.8Å; P35-L48 HydrophobicContact CG-CD2 4.27Å; P35-Y119 HydrophobicContact CG-CD1 4.04Å; P35-Y119 HydrophobicContact CG-CD2 3.7Å; P35-Y119 HydrophobicContact CG-CE1 4.06Å; P35-Y119 HydrophobicContact CG-CE2 3.7Å; P35-Y119 HydrophobicContact CG-CG 3.85Å
36	E	95.9	Very high	90.5	Very high	138 Å²	138	60.5 Å²	60.5	65%	0.645	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	138.4	163.4	-67.6	177.6	-179.5	0	0	108.9	K47	E36-K47 HydrophobicContact CB-CB 4.21Å; E36-K47 PolarHBondContact N-O 2.96Å; E36-K47 PolarHBondContact O-N 3.04Å
37	V	96	Very high	91.9	Very high	53 Å²	53	56 Å²	56	32%	0.321	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.5	-177	178.2	0	0	0	0	108.8	I44 I45 V121	V37-I44 HydrophobicContact CG1-CG2 3.8Å; V37-I45 WeakPolarHBondContact CA-O 3.47Å; V37-V121 HydrophobicContact CG1-CG1 3.61Å; V37-V121 HydrophobicContact CG1-CG2 4.41Å; V37-V121 HydrophobicContact CG2-CG2 3.85Å
38	E	96.6	Very high	92.8	Very high	71 Å²	71	53.4 Å²	53.4	33%	0.332	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.9	172.9	-57.9	176.1	167.3	0	0	109.2	I44 I45 K47	E38-I44 WeakPolarHBondContact O-CA 3.46Å; E38-I45 HydrophobicContact CB-CB 4.18Å; E38-I45 PolarHBondContact N-O 3.19Å; E38-I45 PolarHBondContact O-N 2.96Å; E38-K47 IonicContact OE1-NZ 2.64Å; E38-K47 PolarHBondContact OE1-NZ 3.45Å; E38-K47 WeakPolarHBondContact OE2-CE 3.21Å; E38-K47 IonicContact OE2-NZ 2.96Å; E38-K47 PolarHBondContact OE2-NZ 2.95Å
39	C	95.4	Very high	93.4	Very high	57 Å²	57	49.9 Å²	49.9	39%	0.385	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	92.3	177.6	-63.1	0	0	0	0	109.4	C123	C39-C123 HydrophobicContact CB-CB 3.58Å; C39-C123 WeakPolarHBondContact CB-SG 3.32Å; C39-C123 VanDerWaalsContact SG-CA 3.59Å; C39-C123 WeakPolarHBondContact SG-CB 3.49Å; C39-C123 CovalentContact SG-SG 2.03Å; C39-C123 PolarHBondContact SG-SG 2.53Å
40	N	92.9	Very high	93.7	Very high	54 Å²	54	50.1 Å²	50.1	29%	0.289	28%	0.284	S	S	.	.			trans	-92	162.9	176.5	-58.4	-39.1	0	0	0	110.7	E42 A43 I45 Y125	N40-E42 VanDerWaalsContact C-N 3.26Å; N40-E42 PolarHBondContact O-N 3.48Å; N40-A43 WeakPolarHBondContact CA-O 3.49Å; N40-A43 VanDerWaalsContact CB-O 3.27Å; N40-A43 WeakPolarHBondContact CB-O 3.34Å; N40-A43 PolarHBondContact N-O 2.93Å; N40-I45 VanDerWaalsContact ND2-CD1 3.32Å; N40-I45 WeakPolarHBondContact ND2-CD1 3.42Å; N40-Y125 PolarHBondContact O-OH 3.01Å
41	P	88.1	Confident	93.7	Very high	83 Å²	83	51.8 Å²	51.8	54%	0.539	30%	0.296	S	S	.	.	S	Bend	trans	-56.8	-36.6	177.7	-26.8	35.8	0	0	0	113.8
42	E	89.2	Confident	93.5	Very high	107 Å²	107	54.3 Å²	54.3	50%	0.5	32%	0.316	S	S	.	.	S	Bend	trans	-98.2	-27.3	-177	-60.3	176.8	167.5	0	0	114.5	N40 R78 L81	N40-E42 VanDerWaalsContact C-N 3.26Å; N40-E42 PolarHBondContact O-N 3.48Å; E42-R78 IonicContact OE2-NH2 3.67Å; E42-R78 PolarHBondContact OE2-NH2 3.4Å; E42-L81 PolarHBondContact O-N 3.1Å
43	A	93.6	Very high	93.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	149	-170.7	0	0	0	0	0	114.3	N40 R78 F79 L80 L81	N40-A43 WeakPolarHBondContact CA-O 3.49Å; N40-A43 VanDerWaalsContact CB-O 3.27Å; N40-A43 WeakPolarHBondContact CB-O 3.34Å; N40-A43 PolarHBondContact N-O 2.93Å; A43-R78 HydrophobicContact CB-CG 3.68Å; A43-F79 CarbonylContact C-O 3.52Å; A43-F79 WeakPolarHBondContact CA-O 3.33Å; A43-F79 VanDerWaalsContact CB-O 3.32Å; A43-F79 WeakPolarHBondContact CB-O 3.44Å; A43-L80 HydrophobicContact CB-CD2 4.28Å; A43-L81 VanDerWaalsContact C-CD1 3.41Å
44	I	95.5	Very high	93.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124.3	166.1	-54.3	-178.5	0	0	0	108.1	V37 E38 V46 F79 L81 V99 F103 V121	V37-I44 HydrophobicContact CG1-CG2 3.8Å; E38-I44 WeakPolarHBondContact O-CA 3.46Å; I44-V46 HydrophobicContact CG2-CG2 4.44Å; I44-F79 PolarHBondContact N-O 3.41Å; I44-F79 PolarHBondContact O-N 2.89Å; I44-L81 HydrophobicContact CD1-CD1 4.49Å; I44-L81 HydrophobicContact CG1-CD1 3.66Å; I44-V99 HydrophobicContact CD1-CG1 4.17Å; I44-F103 HydrophobicContact CB-CZ 4.11Å; I44-F103 HydrophobicContact CD1-CE2 4.49Å; I44-F103 HydrophobicContact CD1-CZ 4.16Å; I44-F103 HydrophobicContact CG2-CE2 3.94Å; I44-F103 HydrophobicContact CG2-CZ 3.84Å; I44-V121 HydrophobicContact CG2-CG1 4.32Å
45	I	96.9	Very high	93.7	Very high	14 Å²	14	51.1 Å²	51.1	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123	176	-51.8	177.6	0	0	0	108.8	V37 E38 N40 K47 E76 A77 R78	V37-I45 WeakPolarHBondContact CA-O 3.47Å; E38-I45 HydrophobicContact CB-CB 4.18Å; E38-I45 PolarHBondContact N-O 3.19Å; E38-I45 PolarHBondContact O-N 2.96Å; N40-I45 VanDerWaalsContact ND2-CD1 3.32Å; N40-I45 WeakPolarHBondContact ND2-CD1 3.42Å; I45-K47 HydrophobicContact CG2-CG 4.12Å; I45-E76 HydrophobicContact CG2-CG 3.95Å; I45-A77 WeakPolarHBondContact CA-O 3.38Å; I45-R78 HydrophobicContact CG1-CB 4.34Å; I45-R78 HydrophobicContact CG1-CG 4.17Å
46	V	96.9	Very high	93.7	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.1	176.9	-179.3	0	0	0	0	108.6	P35 I44 L48 E76 A77 F79 F103	P35-V46 HydrophobicContact CB-CG1 4.05Å; I44-V46 HydrophobicContact CG2-CG2 4.44Å; V46-L48 HydrophobicContact CG1-CD2 4.37Å; V46-E76 WeakPolarHBondContact O-CA 3.38Å; V46-A77 PolarHBondContact N-O 3.4Å; V46-A77 PolarHBondContact O-N 2.71Å; V46-F79 HydrophobicContact CB-CE2 4.4Å; V46-F79 HydrophobicContact CG2-CD2 4.29Å; V46-F79 HydrophobicContact CG2-CE2 4.03Å; V46-F103 HydrophobicContact CG2-CD1 4.13Å; V46-F103 HydrophobicContact CG2-CD2 3.83Å; V46-F103 HydrophobicContact CG2-CE1 4.3Å; V46-F103 HydrophobicContact CG2-CE2 3.98Å; V46-F103 HydrophobicContact CG2-CG 3.89Å; V46-F103 HydrophobicContact CG2-CZ 4.22Å
47	K	96.8	Very high	93.6	Very high	55 Å²	55	46.5 Å²	46.5	24%	0.239	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.1	179.4	-64.7	179.1	-177	175	0	110	P35 E36 E38 I45 N75 E76	P35-K47 CarbonylContact C-O 3.34Å; P35-K47 VanDerWaalsContact CA-O 3.24Å; P35-K47 WeakPolarHBondContact CA-O 3.38Å; P35-K47 WeakPolarHBondContact CB-O 3.42Å; E36-K47 HydrophobicContact CB-CB 4.21Å; E36-K47 PolarHBondContact N-O 2.96Å; E36-K47 PolarHBondContact O-N 3.04Å; E38-K47 IonicContact OE1-NZ 2.64Å; E38-K47 PolarHBondContact OE1-NZ 3.45Å; E38-K47 WeakPolarHBondContact OE2-CE 3.21Å; E38-K47 IonicContact OE2-NZ 2.96Å; E38-K47 PolarHBondContact OE2-NZ 2.95Å; I45-K47 HydrophobicContact CG2-CG 4.12Å; K47-N75 CarbonylContact C-O 3.47Å; K47-N75 WeakPolarHBondContact CA-O 3.38Å; K47-E76 WeakPolarHBondContact CE-OE1 3.49Å; K47-E76 HydrophobicContact CG-CG 4.05Å
48	L	95.5	Very high	93.7	Very high	17 Å²	17	44 Å²	44	9%	0.089	25%	0.253	C	S	.	.			trans	-106.2	144.9	-176.2	-61.4	174	0	0	0	111.3	F31 P35 V46 A55 I58 N75 V105	F31-L48 HydrophobicContact CE1-CD2 4.48Å; P35-L48 HydrophobicContact CB-CD2 3.8Å; P35-L48 HydrophobicContact CG-CD2 4.27Å; V46-L48 HydrophobicContact CG1-CD2 4.37Å; L48-A55 HydrophobicContact CD1-CB 3.86Å; L48-I58 HydrophobicContact CD1-CD1 3.31Å; L48-I58 HydrophobicContact CD1-CG1 3.68Å; L48-I58 HydrophobicContact CG-CD1 4.04Å; L48-N75 HydrophobicContact CB-CB 4.05Å; L48-N75 WeakPolarHBondContact CB-O 3.3Å; L48-N75 PolarHBondContact N-O 3.41Å; L48-V105 HydrophobicContact CD1-CB 4.38Å; L48-V105 HydrophobicContact CD1-CG1 3.49Å; L48-V105 VanDerWaalsContact CD1-CG1 3.49Å; L48-V105 HydrophobicContact CD1-CG2 3.95Å; L48-V105 HydrophobicContact CD2-CG1 4.26Å; L48-V105 HydrophobicContact CD2-CG2 3.66Å; L48-V105 HydrophobicContact CG-CG2 4.43Å
49	N	93.9	Very high	93.6	Very high	98 Å²	98	41.1 Å²	41.1	52%	0.524	24%	0.239	S	C	.	.			trans	-118.2	114.1	166.8	-165.9	-2.9	0	0	0	109.5	A32 A33	A32-N49 HydrophobicContact CB-CB 4.29Å; A32-N49 WeakPolarHBondContact CB-O 3.46Å; A32-N49 PolarHBondContact N-O 3.01Å; A33-N49 HydrophobicContact CB-CB 4.49Å
50	T	93.3	Very high	93.6	Very high	16 Å²	16	38.6 Å²	38.6	10%	0.098	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-116.2	153	-174.8	53.2	0	0	0	0	111	D30 G53 N75 L107	D30-T50 CarbonylContact O-C 3.52Å; D30-T50 WeakPolarHBondContact O-CA 3.46Å; T50-G53 WeakPolarHBondContact CB-O 3.36Å; T50-G53 PolarHBondContact OG1-O 3.3Å; T50-N75 PolarHBondContact OG1-ND2 2.96Å; T50-L107 HydrophobicContact CG2-CD2 4.36Å
51	T	91.3	Very high	93.5	Very high	82 Å²	82	40.8 Å²	40.8	50%	0.503	23%	0.226	S	C	.	.	S	Bend	trans	-79.8	-31.8	-170.5	56.8	0	0	0	0	114.6	N29 D30 A32	N29-T51 PolarHBondContact OD1-N 3.47Å; D30-T51 HydrophobicContact CB-CG2 4.19Å; D30-T51 PolarHBondContact N-OG1 3.3Å; D30-T51 PolarHBondContact O-N 3.31Å; D30-T51 PolarHBondContact O-OG1 3.03Å; A32-T51 HydrophobicContact CB-CG2 4.09Å
52	S	86.4	Confident	93.4	Very high	69 Å²	69	38.8 Å²	38.8	48%	0.483	22%	0.22	S	C	.	.	S	Bend	trans	-137.2	7	-168.7	83.6	0	0	0	0	115.6	Q28 N29	Q28-S52 WeakPolarHBondContact O-CB 3.43Å; Q28-S52 PolarHBondContact O-OG 3.45Å; Q28-S52 VanDerWaalsContact O-OG 3.1Å; N29-S52 WeakPolarHBondContact CA-OG 3.33Å; N29-S52 WeakPolarHBondContact CB-OG 3.33Å; N29-S52 PolarHBondContact N-OG 3.21Å; N29-S52 PolarHBondContact OD1-N 3.5Å; N29-S52 PolarHBondContact OD1-OG 3.02Å
53	G	89.6	Confident	93.5	Very high	36 Å²	36	34 Å²	34	37%	0.371	20%	0.198	S	C	.	.	S	Bend	trans	156.2	178	179.7	0	0	0	0	0	112.9	N29 T50	N29-G53 PolarHBondContact ND2-O 2.89Å; N29-G53 PolarHBondContact OD1-N 3Å; N29-G53 PolarHBondContact OD1-O 3.4Å; T50-G53 WeakPolarHBondContact CB-O 3.36Å; T50-G53 PolarHBondContact OG1-O 3.3Å
54	L	94.6	Very high	93.3	Very high	103 Å²	103	36.8 Å²	36.8	54%	0.539	21%	0.211	S	C	.	.			trans	-64.9	149.3	-178.2	-56	174.4	0	0	0	111.7	N29 Q73 N75	N29-L54 PolarHBondContact ND2-O 3.47Å; L54-Q73 WeakPolarHBondContact CD1-O 3.22Å; L54-N75 WeakPolarHBondContact CA-OD1 3.37Å; L54-N75 HydrophobicContact CD2-CB 4.05Å
55	A	94.2	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.			trans	-63	143.9	169.7	0	0	0	0	0	110	L48 I58 Q73 T74 N75 V105 L107	L48-A55 HydrophobicContact CD1-CB 3.86Å; A55-I58 HydrophobicContact CB-CG1 4.42Å; A55-Q73 WeakPolarHBondContact O-CA 3.44Å; A55-Q73 PolarHBondContact O-N 3.32Å; A55-T74 PolarHBondContact O-N 3.11Å; A55-N75 PolarHBondContact N-OD1 2.87Å; A55-V105 HydrophobicContact CB-CG1 3.87Å; A55-L107 HydrophobicContact CB-CD2 4.14Å
56	S	94.6	Very high	92.8	Very high	25 Å²	25	47.1 Å²	47.1	18%	0.175	26%	0.264	C	S	.	.	S	Bend	trans	-66.7	-44.3	-179.5	-69.4	0	0	0	0	111	Q72 Q73 Q106 L107	S56-Q72 CarbonylContact O-C 3.58Å; S56-Q72 WeakPolarHBondContact O-CA 3.46Å; S56-Q73 PolarHBondContact O-N 3.23Å; S56-Q106 WeakPolarHBondContact CA-O 3.31Å; S56-Q106 WeakPolarHBondContact CB-O 3.46Å; S56-Q106 PolarHBondContact N-O 2.81Å; S56-L107 WeakPolarHBondContact CB-O 3.21Å; S56-L107 PolarHBondContact OG-O 2.75Å
57	K	95	Very high	92.5	Very high	34 Å²	34	51 Å²	51	15%	0.148	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	148.1	173	-60.2	-168.7	-178.1	-175.3	0	112.8	F59 H64 F71 Q72 Q106	K57-F59 HydrophobicContact CB-CD1 4.12Å; K57-H64 PolarHBondContact NZ-CE1 2.99Å; K57-H64 VanDerWaalsContact NZ-CE1 3.3Å; K57-H64 PolarHBondContact NZ-NE2 3.4Å; K57-F71 CarbonylContact C-O 3.54Å; K57-F71 WeakPolarHBondContact CA-O 3.28Å; K57-Q72 HydrophobicContact CD-CG 4.42Å; K57-Q72 HydrophobicContact CG-CG 4.15Å; K57-Q106 HydrophobicContact CB-CB 4.31Å; K57-Q106 PolarHBondContact N-O 2.99Å; K57-Q106 PolarHBondContact O-N 3Å
58	I	96.8	Very high	92.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.8	165.5	-45.5	176.7	0	0	0	106.9	L48 A55 F71 T74 A77 F79 V104 V105	L48-I58 HydrophobicContact CD1-CD1 3.31Å; L48-I58 HydrophobicContact CD1-CG1 3.68Å; L48-I58 HydrophobicContact CG-CD1 4.04Å; A55-I58 HydrophobicContact CB-CG1 4.42Å; I58-F71 PolarHBondContact N-O 3.17Å; I58-F71 PolarHBondContact O-N 2.8Å; I58-T74 HydrophobicContact CD1-CG2 4.01Å; I58-T74 WeakPolarHBondContact CD1-O 3.34Å; I58-T74 HydrophobicContact CG1-CG2 4.4Å; I58-A77 HydrophobicContact CB-CB 4.02Å; I58-A77 HydrophobicContact CD1-CB 3.89Å; I58-A77 HydrophobicContact CG2-CB 3.99Å; I58-F79 HydrophobicContact CG2-CE2 4.27Å; I58-F79 HydrophobicContact CG2-CZ 3.98Å; I58-V104 WeakPolarHBondContact CA-O 3.42Å; I58-V105 HydrophobicContact CG2-CG2 4.42Å
59	F	96.1	Very high	92.3	Very high	10 Å²	10	52.8 Å²	52.8	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	159	-177.5	61.3	-86.2	0	0	0	112.7	K57 H64 C69 F103 V104 Q106 I112	K57-F59 HydrophobicContact CB-CD1 4.12Å; F59-H64 AromaticContact CD1-CD2 3.86Å; F59-H64 HydrophobicContact CD2-CB 3.71Å; F59-H64 AromaticContact CE1-CD2 3.81Å; F59-H64 HydrophobicContact CE2-CB 3.86Å; F59-H64 HydrophobicContact CG-CB 4.26Å; F59-H64 AromaticContact CZ-CD2 3.94Å; F59-C69 CarbonylContact C-O 3.58Å; F59-C69 WeakPolarHBondContact CA-O 3.29Å; F59-C69 VanDerWaalsContact CB-O 3.3Å; F59-C69 WeakPolarHBondContact CB-O 3.25Å; F59-F103 WeakPolarHBondContact O-CA 3.25Å; F59-V104 HydrophobicContact CD1-CB 4.34Å; F59-V104 HydrophobicContact CD2-CB 4.13Å; F59-V104 HydrophobicContact CE1-CB 3.9Å; F59-V104 HydrophobicContact CE1-CG1 3.8Å; F59-V104 HydrophobicContact CE2-CB 3.65Å; F59-V104 HydrophobicContact CE2-CG1 4.05Å; F59-V104 HydrophobicContact CE2-CG2 3.95Å; F59-V104 HydrophobicContact CG-CB 4.46Å; F59-V104 HydrophobicContact CZ-CB 3.53Å; F59-V104 HydrophobicContact CZ-CG1 3.44Å; F59-V104 VanDerWaalsContact CZ-CG1 3.44Å; F59-V104 HydrophobicContact CZ-CG2 4.21Å; F59-V104 PolarHBondContact N-O 2.85Å; F59-V104 PolarHBondContact O-N 2.9Å; F59-Q106 HydrophobicContact CE1-CB 4.02Å; F59-I112 HydrophobicContact CZ-CD1 4.19Å
60	V	94.7	Very high	92.4	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.024	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	134.4	172.2	-174.5	0	0	0	0	109.5	G62 H63 C69 F79 C84 S101 F103	V60-G62 PolarHBondContact O-N 3.3Å; V60-H63 HydrophobicContact CB-CB 4.32Å; V60-H63 CarbonylContact O-C 3.53Å; V60-H63 PolarHBondContact O-N 2.82Å; V60-C69 PolarHBondContact N-O 3.01Å; V60-F79 HydrophobicContact CG2-CD1 3.51Å; V60-F79 HydrophobicContact CG2-CE1 3.67Å; V60-F79 HydrophobicContact CG2-CG 4.19Å; V60-F79 HydrophobicContact CG2-CZ 4.45Å; V60-C84 HydrophobicContact CB-CB 4.07Å; V60-C84 HydrophobicContact CG1-CB 4.39Å; V60-C84 VanDerWaalsContact CG1-O 3.28Å; V60-C84 WeakPolarHBondContact CG1-O 3.37Å; V60-C84 HydrophobicContact CG2-CB 3.72Å; V60-S101 VanDerWaalsContact CG1-OG 3.3Å; V60-S101 WeakPolarHBondContact CG1-OG 3.21Å; V60-F103 HydrophobicContact CG2-CD1 3.91Å; V60-F103 HydrophobicContact CG2-CE1 3.72Å
61	R	90.1	Very high	92.6	Very high	100 Å²	100	50.8 Å²	50.8	38%	0.377	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	132.5	176.1	-175.7	175.8	-178.4	-164.9	-9.5	110	H63 T102 V104 E417	R61-H63 VanDerWaalsContact C-N 3.26Å; R61-H63 PolarHBondContact O-N 3.3Å; R61-H63 PolarHBondContact O-ND1 2.98Å; R61-T102 HydrophobicContact CB-CG2 4.18Å; R61-T102 WeakPolarHBondContact CB-O 3.33Å; R61-T102 PolarHBondContact N-O 3.09Å; R61-V104 HydrophobicContact CB-CG2 4.24Å; R61-E417 IonicContact CZ-OE1 3.17Å; R61-E417 IonicContact NH1-OE1 3.28Å; R61-E417 PolarHBondContact NH1-OE1 3.33Å; R61-E417 IonicContact NH1-OE2 3.78Å; R61-E417 IonicContact NH2-OE1 2.9Å; R61-E417 PolarHBondContact NH2-OE1 3.34Å
62	G	87.5	Confident	92.7	Very high	41 Å²	41	53.2 Å²	53.2	42%	0.423	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-25	-175.9	0	0	0	0	0	114.7	V60	V60-G62 PolarHBondContact O-N 3.3Å
63	H	91	Very high	93.1	Very high	7 Å²	7	57.4 Å²	57.4	3%	0.032	31%	0.313	C	S	.	.			trans	-115.8	37.2	-170.2	-52.6	78.1	0	0	0	111.7	V60 R61 D65 E66 C69 C84 G85 G202	V60-H63 HydrophobicContact CB-CB 4.32Å; V60-H63 CarbonylContact O-C 3.53Å; V60-H63 PolarHBondContact O-N 2.82Å; R61-H63 VanDerWaalsContact C-N 3.26Å; R61-H63 PolarHBondContact O-N 3.3Å; R61-H63 PolarHBondContact O-ND1 2.98Å; H63-D65 VanDerWaalsContact C-N 3.3Å; H63-D65 PolarHBondContact O-N 3.28Å; H63-E66 IonicContact CD2-OE1 3.62Å; H63-E66 PolarHBondContact CD2-OE1 3.09Å; H63-E66 IonicContact CD2-OE2 3.56Å; H63-E66 PolarHBondContact CD2-OE2 3.48Å; H63-E66 VanDerWaalsContact CD2-OE2 3.28Å; H63-E66 IonicContact CG-OE1 3.4Å; H63-E66 IonicContact CG-OE2 3.02Å; H63-C69 HydrophobicContact CB-CB 3.64Å; H63-C84 PolarHBondContact CE1-O 3.31Å; H63-C84 PolarHBondContact ND1-O 3.07Å; H63-C84 VanDerWaalsContact NE2-C 3.28Å; H63-G85 VanDerWaalsContact CE1-CA 3.46Å; H63-G85 WeakPolarHBondContact CE1-CA 3.35Å; H63-G85 PolarHBondContact CE1-N 3.45Å; H63-G85 WeakPolarHBondContact NE2-CA 3.43Å; H63-G85 PolarHBondContact NE2-N 2.99Å; H63-G202 PolarHBondContact CE1-O 3.24Å; H63-G202 PolarHBondContact ND1-O 3.39Å; H63-G202 PolarHBondContact NE2-O 3.07Å
64	H	89.6	Confident	93.4	Very high	58 Å²	58	57.4 Å²	57.4	27%	0.269	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.4	-178	167.1	-89.8	0	0	0	113.2	K57 F59 S70	K57-H64 PolarHBondContact NZ-CE1 2.99Å; K57-H64 VanDerWaalsContact NZ-CE1 3.3Å; K57-H64 PolarHBondContact NZ-NE2 3.4Å; F59-H64 AromaticContact CD1-CD2 3.86Å; F59-H64 HydrophobicContact CD2-CB 3.71Å; F59-H64 AromaticContact CE1-CD2 3.81Å; F59-H64 HydrophobicContact CE2-CB 3.86Å; F59-H64 HydrophobicContact CG-CB 4.26Å; F59-H64 AromaticContact CZ-CD2 3.94Å; H64-S70 WeakPolarHBondContact O-CB 3.5Å; H64-S70 PolarHBondContact O-OG 2.95Å
65	D	90	Very high	93.5	Very high	150 Å²	150	54 Å²	54	80%	0.802	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-4	-173.3	-60.4	-35.6	0	0	0	113	H63	H63-D65 VanDerWaalsContact C-N 3.3Å; H63-D65 PolarHBondContact O-N 3.28Å
66	E	91.8	Very high	93.6	Very high	81 Å²	81	59 Å²	59	38%	0.379	31%	0.312	S	S	.	.			trans	-90.1	128.5	-178.6	-74.3	167.8	-145	0	0	111.8	H63 N68 C69 S70	H63-E66 IonicContact CD2-OE1 3.62Å; H63-E66 PolarHBondContact CD2-OE1 3.09Å; H63-E66 IonicContact CD2-OE2 3.56Å; H63-E66 PolarHBondContact CD2-OE2 3.48Å; H63-E66 VanDerWaalsContact CD2-OE2 3.28Å; H63-E66 IonicContact CG-OE1 3.4Å; H63-E66 IonicContact CG-OE2 3.02Å; E66-N68 VanDerWaalsContact C-N 3.29Å; E66-N68 PolarHBondContact O-N 3.5Å; E66-C69 HydrophobicContact CB-CB 3.91Å; E66-C69 CarbonylContact O-C 3.55Å; E66-C69 PolarHBondContact O-N 3.04Å; E66-C69 PolarHBondContact OE2-SG 2.9Å; E66-S70 VanDerWaalsContact O-CB 3.28Å; E66-S70 WeakPolarHBondContact O-CB 3.42Å; E66-S70 PolarHBondContact O-N 2.98Å; E66-S70 VanDerWaalsContact O-N 3.1Å
67	A	90.5	Very high	93.7	Very high	86 Å²	86	57.9 Å²	57.9	71%	0.711	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-32.2	-172.7	0	0	0	0	0	114.1
68	N	92.2	Very high	93.7	Very high	106 Å²	106	61.5 Å²	61.5	57%	0.567	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.4	179.8	-65.5	-15.3	0	0	0	113.2	E66	E66-N68 VanDerWaalsContact C-N 3.29Å; E66-N68 PolarHBondContact O-N 3.5Å
69	C	95.6	Very high	93.7	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.014	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	4.1	-175.1	-52.5	0	0	0	0	112.4	F59 V60 H63 E66 F79 C84	F59-C69 CarbonylContact C-O 3.58Å; F59-C69 WeakPolarHBondContact CA-O 3.29Å; F59-C69 VanDerWaalsContact CB-O 3.3Å; F59-C69 WeakPolarHBondContact CB-O 3.25Å; V60-C69 PolarHBondContact N-O 3.01Å; H63-C69 HydrophobicContact CB-CB 3.64Å; E66-C69 HydrophobicContact CB-CB 3.91Å; E66-C69 CarbonylContact O-C 3.55Å; E66-C69 PolarHBondContact O-N 3.04Å; E66-C69 PolarHBondContact OE2-SG 2.9Å; C69-F79 WeakPolarHBondContact O-CE1 3.05Å; C69-C84 WeakPolarHBondContact CA-SG 3.48Å; C69-C84 HydrophobicContact CB-CB 3.68Å; C69-C84 WeakPolarHBondContact CB-SG 3.2Å; C69-C84 WeakPolarHBondContact SG-CA 3.14Å; C69-C84 WeakPolarHBondContact SG-CB 3.07Å; C69-C84 CovalentContact SG-SG 2.02Å; C69-C84 PolarHBondContact SG-SG 3.39Å
70	S	96.1	Very high	93.5	Very high	14 Å²	14	64.5 Å²	64.5	10%	0.098	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	109.4	-174.6	-170.1	0	0	0	0	110.6	H64 E66	H64-S70 WeakPolarHBondContact O-CB 3.5Å; H64-S70 PolarHBondContact O-OG 2.95Å; E66-S70 VanDerWaalsContact O-CB 3.28Å; E66-S70 WeakPolarHBondContact O-CB 3.42Å; E66-S70 PolarHBondContact O-N 2.98Å; E66-S70 VanDerWaalsContact O-N 3.1Å
71	F	96.6	Very high	93.2	Very high	59 Å²	59	64.4 Å²	64.4	26%	0.259	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.4	-177.8	-59.4	-88.1	0	0	0	110	K57 I58 T74 A77 R78 F79	K57-F71 CarbonylContact C-O 3.54Å; K57-F71 WeakPolarHBondContact CA-O 3.28Å; I58-F71 PolarHBondContact N-O 3.17Å; I58-F71 PolarHBondContact O-N 2.8Å; F71-T74 HydrophobicContact CB-CG2 3.6Å; F71-A77 HydrophobicContact CB-CB 4.18Å; F71-A77 HydrophobicContact CD2-CB 3.51Å; F71-A77 HydrophobicContact CE2-CB 4.11Å; F71-A77 HydrophobicContact CG-CB 3.93Å; F71-R78 WeakPolarHBondContact CE2-O 3.26Å; F71-R78 WeakPolarHBondContact CZ-O 3.41Å; F71-F79 HydrophobicContact CD2-CD1 4.39Å; F71-F79 AromaticContact CD2-CE1 3.68Å; F71-F79 HydrophobicContact CD2-CE1 3.68Å; F71-F79 AromaticContact CD2-CZ 3.79Å; F71-F79 HydrophobicContact CD2-CZ 3.79Å; F71-F79 AromaticContact CE2-CD1 3.72Å; F71-F79 HydrophobicContact CE2-CD1 3.72Å; F71-F79 AromaticContact CE2-CE1 3.46Å; F71-F79 HydrophobicContact CE2-CE1 3.46Å; F71-F79 VanDerWaalsContact CE2-CE1 3.46Å; F71-F79 HydrophobicContact CE2-CG 4.36Å; F71-F79 AromaticContact CE2-CZ 3.91Å; F71-F79 HydrophobicContact CE2-CZ 3.91Å
72	Q	95	Very high	92.9	Very high	133 Å²	133	62.9 Å²	62.9	62%	0.621	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	148.5	-176.6	-51.3	-173.4	22.3	0	0	111.1	S56 K57 T74	S56-Q72 CarbonylContact O-C 3.58Å; S56-Q72 WeakPolarHBondContact O-CA 3.46Å; K57-Q72 HydrophobicContact CD-CG 4.42Å; K57-Q72 HydrophobicContact CG-CG 4.15Å; Q72-T74 VanDerWaalsContact C-N 3.28Å; Q72-T74 PolarHBondContact O-N 3.38Å
73	Q	94.2	Very high	92.8	Very high	156 Å²	156	64 Å²	64	73%	0.729	33%	0.326	S	S	*	.	S	Bend	trans	49.1	46.5	173.8	-61.4	-172.3	-29.2	0	0	113.3	L54 A55 S56	L54-Q73 WeakPolarHBondContact CD1-O 3.22Å; A55-Q73 WeakPolarHBondContact O-CA 3.44Å; A55-Q73 PolarHBondContact O-N 3.32Å; S56-Q73 PolarHBondContact O-N 3.23Å
74	T	95.8	Very high	92.7	Very high	36 Å²	36	64 Å²	64	22%	0.221	33%	0.327	C	S	.	.			trans	-138.6	153.8	-179.6	-174.3	0	0	0	0	110.7	A55 I58 F71 Q72 E76	A55-T74 PolarHBondContact O-N 3.11Å; I58-T74 HydrophobicContact CD1-CG2 4.01Å; I58-T74 WeakPolarHBondContact CD1-O 3.34Å; I58-T74 HydrophobicContact CG1-CG2 4.4Å; F71-T74 HydrophobicContact CB-CG2 3.6Å; Q72-T74 VanDerWaalsContact C-N 3.28Å; Q72-T74 PolarHBondContact O-N 3.38Å; T74-E76 VanDerWaalsContact CG2-O 3.29Å; T74-E76 WeakPolarHBondContact CG2-O 3.2Å; T74-E76 PolarHBondContact OG1-N 3.4Å; T74-E76 PolarHBondContact OG1-O 3.46Å
75	N	95.9	Very high	92.3	Very high	31 Å²	31	63.1 Å²	63.1	17%	0.166	33%	0.333	C	S	.	.	S	Bend	trans	-104.1	-1.5	167.4	-81.4	-2.9	0	0	0	112	K47 L48 T50 L54 A55	K47-N75 CarbonylContact C-O 3.47Å; K47-N75 WeakPolarHBondContact CA-O 3.38Å; L48-N75 HydrophobicContact CB-CB 4.05Å; L48-N75 WeakPolarHBondContact CB-O 3.3Å; L48-N75 PolarHBondContact N-O 3.41Å; T50-N75 PolarHBondContact OG1-ND2 2.96Å; L54-N75 WeakPolarHBondContact CA-OD1 3.37Å; L54-N75 HydrophobicContact CD2-CB 4.05Å; A55-N75 PolarHBondContact N-OD1 2.87Å
76	E	96.3	Very high	92.2	Very high	106 Å²	106	56.6 Å²	56.6	50%	0.495	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.7	178	-175.7	169.1	169.6	0	0	109.3	I45 V46 K47 T74	I45-E76 HydrophobicContact CG2-CG 3.95Å; V46-E76 WeakPolarHBondContact O-CA 3.38Å; K47-E76 WeakPolarHBondContact CE-OE1 3.49Å; K47-E76 HydrophobicContact CG-CG 4.05Å; T74-E76 VanDerWaalsContact CG2-O 3.29Å; T74-E76 WeakPolarHBondContact CG2-O 3.2Å; T74-E76 PolarHBondContact OG1-N 3.4Å; T74-E76 PolarHBondContact OG1-O 3.46Å
77	A	96.7	Very high	92	Very high	2 Å²	2	53.7 Å²	53.7	2%	0.017	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.4	179.2	0	0	0	0	0	110.2	I45 V46 I58 F71 F79	I45-A77 WeakPolarHBondContact CA-O 3.38Å; V46-A77 PolarHBondContact N-O 3.4Å; V46-A77 PolarHBondContact O-N 2.71Å; I58-A77 HydrophobicContact CB-CB 4.02Å; I58-A77 HydrophobicContact CD1-CB 3.89Å; I58-A77 HydrophobicContact CG2-CB 3.99Å; F71-A77 HydrophobicContact CB-CB 4.18Å; F71-A77 HydrophobicContact CD2-CB 3.51Å; F71-A77 HydrophobicContact CE2-CB 4.11Å; F71-A77 HydrophobicContact CG-CB 3.93Å; A77-F79 HydrophobicContact CB-CD2 4.33Å; A77-F79 HydrophobicContact CB-CE2 3.45Å; A77-F79 VanDerWaalsContact CB-CE2 3.45Å; A77-F79 HydrophobicContact CB-CZ 3.62Å
78	R	96	Very high	91.9	Very high	109 Å²	109	51.7 Å²	51.7	41%	0.411	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117	179.2	177.5	178.3	172.8	117.2	-2	109	E42 A43 I45 F71	E42-R78 IonicContact OE2-NH2 3.67Å; E42-R78 PolarHBondContact OE2-NH2 3.4Å; A43-R78 HydrophobicContact CB-CG 3.68Å; I45-R78 HydrophobicContact CG1-CB 4.34Å; I45-R78 HydrophobicContact CG1-CG 4.17Å; F71-R78 WeakPolarHBondContact CE2-O 3.26Å; F71-R78 WeakPolarHBondContact CZ-O 3.41Å
79	F	95.3	Very high	91.7	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.9	-179.7	-57.8	-86.1	0	0	0	109.8	A43 I44 V46 I58 V60 C69 F71 A77 F103	A43-F79 CarbonylContact C-O 3.52Å; A43-F79 WeakPolarHBondContact CA-O 3.33Å; A43-F79 VanDerWaalsContact CB-O 3.32Å; A43-F79 WeakPolarHBondContact CB-O 3.44Å; I44-F79 PolarHBondContact N-O 3.41Å; I44-F79 PolarHBondContact O-N 2.89Å; V46-F79 HydrophobicContact CB-CE2 4.4Å; V46-F79 HydrophobicContact CG2-CD2 4.29Å; V46-F79 HydrophobicContact CG2-CE2 4.03Å; I58-F79 HydrophobicContact CG2-CE2 4.27Å; I58-F79 HydrophobicContact CG2-CZ 3.98Å; V60-F79 HydrophobicContact CG2-CD1 3.51Å; V60-F79 HydrophobicContact CG2-CE1 3.67Å; V60-F79 HydrophobicContact CG2-CG 4.19Å; V60-F79 HydrophobicContact CG2-CZ 4.45Å; C69-F79 WeakPolarHBondContact O-CE1 3.05Å; F71-F79 HydrophobicContact CD2-CD1 4.39Å; F71-F79 AromaticContact CD2-CE1 3.68Å; F71-F79 HydrophobicContact CD2-CE1 3.68Å; F71-F79 AromaticContact CD2-CZ 3.79Å; F71-F79 HydrophobicContact CD2-CZ 3.79Å; F71-F79 AromaticContact CE2-CD1 3.72Å; F71-F79 HydrophobicContact CE2-CD1 3.72Å; F71-F79 AromaticContact CE2-CE1 3.46Å; F71-F79 HydrophobicContact CE2-CE1 3.46Å; F71-F79 VanDerWaalsContact CE2-CE1 3.46Å; F71-F79 HydrophobicContact CE2-CG 4.36Å; F71-F79 AromaticContact CE2-CZ 3.91Å; F71-F79 HydrophobicContact CE2-CZ 3.91Å; A77-F79 HydrophobicContact CB-CD2 4.33Å; A77-F79 HydrophobicContact CB-CE2 3.45Å; A77-F79 VanDerWaalsContact CB-CE2 3.45Å; A77-F79 HydrophobicContact CB-CZ 3.62Å; F79-F103 HydrophobicContact CB-CE1 4.08Å; F79-F103 HydrophobicContact CD1-CE1 4.08Å; F79-F103 AromaticContact CD2-CD1 3.73Å; F79-F103 HydrophobicContact CD2-CD1 3.73Å; F79-F103 AromaticContact CD2-CE1 3.2Å; F79-F103 HydrophobicContact CD2-CE1 3.2Å; F79-F103 AromaticContact CD2-CZ 3.99Å; F79-F103 HydrophobicContact CD2-CZ 3.99Å; F79-F103 HydrophobicContact CE1-CD1 4.31Å; F79-F103 HydrophobicContact CE1-CE1 4.31Å; F79-F103 AromaticContact CE2-CD1 3.46Å; F79-F103 HydrophobicContact CE2-CD1 3.46Å; F79-F103 VanDerWaalsContact CE2-CD1 3.46Å; F79-F103 AromaticContact CE2-CE1 3.49Å; F79-F103 HydrophobicContact CE2-CE1 3.49Å; F79-F103 VanDerWaalsContact CE2-CE1 3.49Å; F79-F103 HydrophobicContact CE2-CG 4.48Å; F79-F103 HydrophobicContact CG-CD1 4.26Å; F79-F103 AromaticContact CG-CE1 3.52Å; F79-F103 HydrophobicContact CG-CE1 3.52Å; F79-F103 HydrophobicContact CG-CZ 4.38Å; F79-F103 AromaticContact CZ-CD1 3.79Å; F79-F103 HydrophobicContact CZ-CD1 3.79Å; F79-F103 HydrophobicContact CZ-CE1 4.05Å
80	L	92.7	Very high	91.4	Very high	74 Å²	74	53 Å²	53	39%	0.387	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	141.2	177.4	-60.9	178.7	0	0	0	110.5	A43 H82 D83 I86	A43-L80 HydrophobicContact CB-CD2 4.28Å; L80-H82 PolarHBondContact O-N 3.35Å; L80-D83 PolarHBondContact O-N 2.91Å; L80-I86 VanDerWaalsContact O-CD1 3.26Å; L80-I86 WeakPolarHBondContact O-CD1 3.48Å
81	L	88.5	Confident	90.8	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.7	-176.6	-103.5	73.4	0	0	0	114.4	E42 A43 I44 R88 V99 Y125 I290	E42-L81 PolarHBondContact O-N 3.1Å; A43-L81 VanDerWaalsContact C-CD1 3.41Å; I44-L81 HydrophobicContact CD1-CD1 4.49Å; I44-L81 HydrophobicContact CG1-CD1 3.66Å; L81-R88 PolarHBondContact O-NH1 3.3Å; L81-R88 VanDerWaalsContact O-NH1 3.12Å; L81-V99 HydrophobicContact CD2-CG1 4.22Å; L81-V99 HydrophobicContact CD2-CG2 4.16Å; L81-V99 HydrophobicContact CG-CG1 4.13Å; L81-Y125 HydrophobicContact CD2-CE2 4.08Å; L81-I290 HydrophobicContact CD2-CD1 4.38Å
82	H	84.3	Confident	90.2	Very high	68 Å²	68	52.8 Å²	52.8	32%	0.315	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	8	-177.3	-54.6	-66.7	0	0	0	113.7	L80 P287	L80-H82 PolarHBondContact O-N 3.35Å; H82-P287 VanDerWaalsContact C-CG 3.42Å; H82-P287 WeakPolarHBondContact O-CG 3.41Å
83	D	84.7	Confident	89.3	Confident	66 Å²	66	51.3 Å²	51.3	35%	0.353	25%	0.248	S	C	.	.	S	Bend	trans	-138.9	-172.7	-177.2	-70.8	-41.9	0	0	0	110.5	L80 G85 I86	L80-D83 PolarHBondContact O-N 2.91Å; D83-G85 PolarHBondContact O-N 3.08Å; D83-G85 VanDerWaalsContact O-N 3.12Å; D83-I86 WeakPolarHBondContact O-CG1 3.41Å; D83-I86 PolarHBondContact O-N 2.93Å
84	C	89.5	Confident	88.6	Confident	6 Å²	6	47.2 Å²	47.2	4%	0.041	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	25.6	170.6	-48.3	0	0	0	0	115.1	V60 H63 C69 I86	V60-C84 HydrophobicContact CB-CB 4.07Å; V60-C84 HydrophobicContact CG1-CB 4.39Å; V60-C84 VanDerWaalsContact CG1-O 3.28Å; V60-C84 WeakPolarHBondContact CG1-O 3.37Å; V60-C84 HydrophobicContact CG2-CB 3.72Å; H63-C84 PolarHBondContact CE1-O 3.31Å; H63-C84 PolarHBondContact ND1-O 3.07Å; H63-C84 VanDerWaalsContact NE2-C 3.28Å; C69-C84 WeakPolarHBondContact CA-SG 3.48Å; C69-C84 HydrophobicContact CB-CB 3.68Å; C69-C84 WeakPolarHBondContact CB-SG 3.2Å; C69-C84 WeakPolarHBondContact SG-CA 3.14Å; C69-C84 WeakPolarHBondContact SG-CB 3.07Å; C69-C84 CovalentContact SG-SG 2.02Å; C69-C84 PolarHBondContact SG-SG 3.39Å; C84-I86 HydrophobicContact CB-CG1 4.47Å; C84-I86 PolarHBondContact O-N 3.49Å; C84-I86 VanDerWaalsContact O-N 3.14Å
85	G	81.9	Confident	88	Confident	40 Å²	40	49.4 Å²	49.4	41%	0.412	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	30.5	179.6	0	0	0	0	0	113.9	H63 D83 V87	H63-G85 VanDerWaalsContact CE1-CA 3.46Å; H63-G85 WeakPolarHBondContact CE1-CA 3.35Å; H63-G85 PolarHBondContact CE1-N 3.45Å; H63-G85 WeakPolarHBondContact NE2-CA 3.43Å; H63-G85 PolarHBondContact NE2-N 2.99Å; D83-G85 PolarHBondContact O-N 3.08Å; D83-G85 VanDerWaalsContact O-N 3.12Å; G85-V87 PolarHBondContact O-N 3.42Å
86	I	87.7	Confident	87.6	Confident	13 Å²	13	48.3 Å²	48.3	7%	0.067	24%	0.237	C	C	.	.			trans	-62.4	126	174.1	-66.1	176.5	0	0	0	108.9	L80 D83 C84 V99	L80-I86 VanDerWaalsContact O-CD1 3.26Å; L80-I86 WeakPolarHBondContact O-CD1 3.48Å; D83-I86 WeakPolarHBondContact O-CG1 3.41Å; D83-I86 PolarHBondContact O-N 2.93Å; C84-I86 HydrophobicContact CB-CG1 4.47Å; C84-I86 PolarHBondContact O-N 3.49Å; C84-I86 VanDerWaalsContact O-N 3.14Å; I86-V99 HydrophobicContact CG2-CG1 3.22Å
87	V	87.1	Confident	87.3	Confident	19 Å²	19	45.5 Å²	45.5	12%	0.115	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.5	-175.8	-178.2	0	0	0	0	109.5	G85 E89 V99 T100	G85-V87 PolarHBondContact O-N 3.42Å; V87-E89 HydrophobicContact CG1-CG 4.22Å; V87-V99 CarbonylContact O-C 3.52Å; V87-V99 WeakPolarHBondContact O-CA 3.11Å; V87-T100 PolarHBondContact N-O 2.83Å; V87-T100 PolarHBondContact O-N 2.68Å
88	R	88.2	Confident	87	Confident	44 Å²	44	45.4 Å²	45.4	17%	0.166	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.4	177	-47.7	-177.9	82.6	82	4.4	108.4	L81 V97 A98	L81-R88 PolarHBondContact O-NH1 3.3Å; L81-R88 VanDerWaalsContact O-NH1 3.12Å; R88-V97 HydrophobicContact CB-CG1 4.28Å; R88-A98 CarbonylContact C-O 3.57Å; R88-A98 WeakPolarHBondContact CA-O 3.47Å
89	E	88.1	Confident	86.8	Confident	30 Å²	30	40.2 Å²	40.2	14%	0.14	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	117	179.3	-65.4	174.4	161.9	0	0	108.9	V87 A98 D413 S415	V87-E89 HydrophobicContact CG1-CG 4.22Å; E89-A98 HydrophobicContact CB-CB 4.38Å; E89-A98 PolarHBondContact N-O 2.99Å; E89-A98 PolarHBondContact O-N 3.42Å; E89-D413 WeakPolarHBondContact CA-OD2 3.24Å; E89-D413 HydrophobicContact CB-CB 3.93Å; E89-D413 HydrophobicContact CG-CB 4.27Å; E89-S415 WeakPolarHBondContact OE1-CB 3.24Å; E89-S415 PolarHBondContact OE1-OG 3.2Å
90	R	89.3	Confident	86.6	Confident	105 Å²	105	40.9 Å²	40.9	40%	0.396	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	133.4	168.6	-65	177.9	-176.3	168.7	4	109.6	E411 D413	R90-E411 IonicContact NH1-OE2 3.26Å; R90-E411 PolarHBondContact NH1-OE2 2.73Å; R90-D413 WeakPolarHBondContact CB-OD2 3.49Å; R90-D413 PolarHBondContact N-OD2 2.99Å; R90-D413 PolarHBondContact O-N 2.87Å
91	Q	83.3	Confident	86.6	Confident	53 Å²	53	37.7 Å²	37.7	25%	0.248	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.4	178.2	-57.4	-158.7	-46.8	0	0	110.9	K95 G96 A98 F124	Q91-K95 WeakPolarHBondContact O-CA 3.41Å; Q91-G96 PolarHBondContact N-O 2.92Å; Q91-G96 PolarHBondContact O-N 3.21Å; Q91-G96 VanDerWaalsContact O-N 3.09Å; Q91-A98 HydrophobicContact CG-CB 4.16Å; Q91-F124 HydrophobicContact CB-CE2 4.01Å; Q91-F124 HydrophobicContact CG-CE2 4.16Å; Q91-F124 VanDerWaalsContact OE1-CE2 3.29Å
92	L	83.3	Confident	86.8	Confident	16 Å²	16	38.8 Å²	38.8	8%	0.084	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-31.3	-178.9	-58	-179.6	0	0	0	112.8	P94 K95 L152 L257 L410 E411 A412	L92-P94 VanDerWaalsContact C-C 3.47Å; L92-P94 CarbonylContact C-O 3.49Å; L92-P94 CarbonylContact O-C 3.5Å; L92-K95 PolarHBondContact O-N 3.42Å; L92-L152 HydrophobicContact CB-CB 4.05Å; L92-L152 HydrophobicContact CB-CD1 4.24Å; L92-L152 VanDerWaalsContact O-CD1 3.31Å; L92-L152 WeakPolarHBondContact O-CD1 3.46Å; L92-L257 HydrophobicContact CD1-CD1 3.25Å; L92-L257 HydrophobicContact CD1-CG 4.43Å; L92-L410 HydrophobicContact CD1-CD1 4Å; L92-L410 HydrophobicContact CD1-CD2 4Å; L92-L410 HydrophobicContact CD1-CG 3.71Å; L92-L410 HydrophobicContact CD2-CD1 3.26Å; L92-L410 HydrophobicContact CD2-CG 3.75Å; L92-L410 HydrophobicContact CG-CD1 4.12Å; L92-L410 HydrophobicContact CG-CG 4.32Å; L92-E411 WeakPolarHBondContact CD2-O 3.41Å; L92-A412 HydrophobicContact CD1-CB 3.87Å; L92-A412 HydrophobicContact CG-CB 3.93Å
93	K	76.6	Confident	87.3	Confident	103 Å²	103	35.7 Å²	35.7	45%	0.448	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.9	102.1	-174.7	-166.6	173.8	-174	177.3	0	112.3	Q154	K93-Q154 HydrophobicContact CB-CG 4.38Å; K93-Q154 HydrophobicContact CD-CG 4.37Å
94	P	79.9	Confident	87.8	Confident	70 Å²	70	33.2 Å²	33.2	46%	0.455	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	cis	-68.4	162.3	-10.9	30.7	-33.8	0	0	0	111.7	L92 G96 F124 L126	L92-P94 VanDerWaalsContact C-C 3.47Å; L92-P94 CarbonylContact C-O 3.49Å; L92-P94 CarbonylContact O-C 3.5Å; P94-G96 PolarHBondContact O-N 3.37Å; P94-F124 HydrophobicContact CB-CE1 4.42Å; P94-F124 HydrophobicContact CG-CD1 4.33Å; P94-F124 HydrophobicContact CG-CE1 3.54Å; P94-F124 HydrophobicContact CG-CZ 3.76Å; P94-F124 WeakPolarHBondContact O-CZ 3.11Å; P94-L126 HydrophobicContact CB-CD2 3.57Å; P94-L126 HydrophobicContact CG-CD2 3.68Å
95	K	82.8	Confident	88.1	Confident	82 Å²	82	33 Å²	33	36%	0.357	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	127.5	176.7	-163.3	-170.3	-171.4	-155.5	0	109.5	Q91 L92 E127	Q91-K95 WeakPolarHBondContact O-CA 3.41Å; L92-K95 PolarHBondContact O-N 3.42Å; K95-E127 HydrophobicContact CD-CB 4.25Å; K95-E127 VanDerWaalsContact CD-OE2 3.28Å; K95-E127 WeakPolarHBondContact CD-OE2 3.02Å; K95-E127 WeakPolarHBondContact CE-OE2 3.02Å; K95-E127 HydrophobicContact CG-CB 4.28Å; K95-E127 IonicContact NZ-OE1 2.64Å; K95-E127 PolarHBondContact NZ-OE1 3.13Å; K95-E127 IonicContact NZ-OE2 3.21Å; K95-E127 PolarHBondContact NZ-OE2 3.43Å; K95-E127 VanDerWaalsContact NZ-OE2 3.09Å; K95-E127 PolarHBondContact O-N 3.27Å
96	G	87.4	Confident	88.7	Confident	7 Å²	7	31.4 Å²	31.4	7%	0.072	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.6	-167.2	178.6	0	0	0	0	0	113.4	Q91 P94 Y125	Q91-G96 PolarHBondContact N-O 2.92Å; Q91-G96 PolarHBondContact O-N 3.21Å; Q91-G96 VanDerWaalsContact O-N 3.09Å; P94-G96 PolarHBondContact O-N 3.37Å; G96-Y125 CarbonylContact C-O 3.56Å; G96-Y125 WeakPolarHBondContact CA-O 3.48Å
97	V	89.3	Confident	89	Confident	47 Å²	47	30.8 Å²	30.8	29%	0.285	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.6	-175.6	-177.1	0	0	0	0	109.9	R88 V99 Y125	R88-V97 HydrophobicContact CB-CG1 4.28Å; V97-V99 HydrophobicContact CG1-CG2 4.2Å; V97-Y125 PolarHBondContact N-O 2.95Å; V97-Y125 PolarHBondContact O-N 3.17Å
98	A	91.1	Very high	89.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.6	169.7	0	0	0	0	0	110	R88 E89 Q91 R122 C123 F124	R88-A98 CarbonylContact C-O 3.57Å; R88-A98 WeakPolarHBondContact CA-O 3.47Å; E89-A98 HydrophobicContact CB-CB 4.38Å; E89-A98 PolarHBondContact N-O 2.99Å; E89-A98 PolarHBondContact O-N 3.42Å; Q91-A98 HydrophobicContact CG-CB 4.16Å; A98-R122 VanDerWaalsContact CB-NH2 3.28Å; A98-C123 CarbonylContact C-O 3.5Å; A98-C123 WeakPolarHBondContact CA-O 3.4Å; A98-F124 HydrophobicContact CB-CD2 3.9Å; A98-F124 HydrophobicContact CB-CE2 4.41Å
99	V	92.4	Very high	89.2	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.3	178.1	179.8	0	0	0	0	108.1	I44 L81 I86 V87 V97 R122 C123 Y125	I44-V99 HydrophobicContact CD1-CG1 4.17Å; L81-V99 HydrophobicContact CD2-CG1 4.22Å; L81-V99 HydrophobicContact CD2-CG2 4.16Å; L81-V99 HydrophobicContact CG-CG1 4.13Å; I86-V99 HydrophobicContact CG2-CG1 3.22Å; V87-V99 CarbonylContact O-C 3.52Å; V87-V99 WeakPolarHBondContact O-CA 3.11Å; V97-V99 HydrophobicContact CG1-CG2 4.2Å; V99-R122 CarbonylContact O-C 3.53Å; V99-R122 WeakPolarHBondContact O-CA 3.4Å; V99-C123 HydrophobicContact CB-CB 4.32Å; V99-C123 PolarHBondContact N-O 2.9Å; V99-C123 PolarHBondContact O-N 3.31Å; V99-Y125 HydrophobicContact CB-CE2 4.02Å; V99-Y125 HydrophobicContact CG2-CD2 3.85Å; V99-Y125 HydrophobicContact CG2-CE2 3.64Å
100	T	91.5	Very high	89.3	Confident	15 Å²	15	39.2 Å²	39.2	9%	0.092	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.4	-173.8	-57.6	0	0	0	0	111.2	V87 K120 V121	V87-T100 PolarHBondContact N-O 2.83Å; V87-T100 PolarHBondContact O-N 2.68Å; T100-K120 HydrophobicContact CG2-CD 4.44Å; T100-K120 VanDerWaalsContact CG2-CE 3.47Å; T100-K120 HydrophobicContact CG2-CG 4.09Å; T100-V121 WeakPolarHBondContact CA-O 3.1Å
101	S	91.9	Very high	89.3	Confident	7 Å²	7	41 Å²	41	5%	0.049	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	150.6	174.3	-172	0	0	0	0	111.5	V60 V121	V60-S101 VanDerWaalsContact CG1-OG 3.3Å; V60-S101 WeakPolarHBondContact CG1-OG 3.21Å; S101-V121 PolarHBondContact N-O 2.86Å; S101-V121 PolarHBondContact O-N 3Å
102	T	92.4	Very high	89.6	Confident	24 Å²	24	44 Å²	44	15%	0.147	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.3	176.7	-59.3	0	0	0	0	109.9	R61 A118 Y119	R61-T102 HydrophobicContact CB-CG2 4.18Å; R61-T102 WeakPolarHBondContact CB-O 3.33Å; R61-T102 PolarHBondContact N-O 3.09Å; T102-A118 HydrophobicContact CG2-CB 4.1Å; T102-Y119 WeakPolarHBondContact CA-O 3.3Å
103	F	95.1	Very high	89.9	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.2	179.4	-57.5	-76.7	0	0	0	110.4	I44 V46 F59 V60 F79 A118 Y119 V121	I44-F103 HydrophobicContact CB-CZ 4.11Å; I44-F103 HydrophobicContact CD1-CE2 4.49Å; I44-F103 HydrophobicContact CD1-CZ 4.16Å; I44-F103 HydrophobicContact CG2-CE2 3.94Å; I44-F103 HydrophobicContact CG2-CZ 3.84Å; V46-F103 HydrophobicContact CG2-CD1 4.13Å; V46-F103 HydrophobicContact CG2-CD2 3.83Å; V46-F103 HydrophobicContact CG2-CE1 4.3Å; V46-F103 HydrophobicContact CG2-CE2 3.98Å; V46-F103 HydrophobicContact CG2-CG 3.89Å; V46-F103 HydrophobicContact CG2-CZ 4.22Å; F59-F103 WeakPolarHBondContact O-CA 3.25Å; V60-F103 HydrophobicContact CG2-CD1 3.91Å; V60-F103 HydrophobicContact CG2-CE1 3.72Å; F79-F103 HydrophobicContact CB-CE1 4.08Å; F79-F103 HydrophobicContact CD1-CE1 4.08Å; F79-F103 AromaticContact CD2-CD1 3.73Å; F79-F103 HydrophobicContact CD2-CD1 3.73Å; F79-F103 AromaticContact CD2-CE1 3.2Å; F79-F103 HydrophobicContact CD2-CE1 3.2Å; F79-F103 AromaticContact CD2-CZ 3.99Å; F79-F103 HydrophobicContact CD2-CZ 3.99Å; F79-F103 HydrophobicContact CE1-CD1 4.31Å; F79-F103 HydrophobicContact CE1-CE1 4.31Å; F79-F103 AromaticContact CE2-CD1 3.46Å; F79-F103 HydrophobicContact CE2-CD1 3.46Å; F79-F103 VanDerWaalsContact CE2-CD1 3.46Å; F79-F103 AromaticContact CE2-CE1 3.49Å; F79-F103 HydrophobicContact CE2-CE1 3.49Å; F79-F103 VanDerWaalsContact CE2-CE1 3.49Å; F79-F103 HydrophobicContact CE2-CG 4.48Å; F79-F103 HydrophobicContact CG-CD1 4.26Å; F79-F103 AromaticContact CG-CE1 3.52Å; F79-F103 HydrophobicContact CG-CE1 3.52Å; F79-F103 HydrophobicContact CG-CZ 4.38Å; F79-F103 AromaticContact CZ-CD1 3.79Å; F79-F103 HydrophobicContact CZ-CD1 3.79Å; F79-F103 HydrophobicContact CZ-CE1 4.05Å; F103-A118 CarbonylContact O-C 3.59Å; F103-A118 VanDerWaalsContact O-CA 3.31Å; F103-A118 WeakPolarHBondContact O-CA 3.28Å; F103-Y119 PolarHBondContact N-O 3.49Å; F103-Y119 PolarHBondContact O-N 3.07Å; F103-V121 HydrophobicContact CD2-CB 3.88Å; F103-V121 HydrophobicContact CD2-CG2 3.58Å; F103-V121 HydrophobicContact CE2-CB 3.65Å; F103-V121 HydrophobicContact CE2-CG1 4.06Å; F103-V121 HydrophobicContact CE2-CG2 3.8Å
104	V	95.3	Very high	90.5	Very high	15 Å²	15	50.9 Å²	50.9	9%	0.091	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.6	176.9	-175.4	0	0	0	0	108.7	I58 F59 R61 A118	I58-V104 WeakPolarHBondContact CA-O 3.42Å; F59-V104 HydrophobicContact CD1-CB 4.34Å; F59-V104 HydrophobicContact CD2-CB 4.13Å; F59-V104 HydrophobicContact CE1-CB 3.9Å; F59-V104 HydrophobicContact CE1-CG1 3.8Å; F59-V104 HydrophobicContact CE2-CB 3.65Å; F59-V104 HydrophobicContact CE2-CG1 4.05Å; F59-V104 HydrophobicContact CE2-CG2 3.95Å; F59-V104 HydrophobicContact CG-CB 4.46Å; F59-V104 HydrophobicContact CZ-CB 3.53Å; F59-V104 HydrophobicContact CZ-CG1 3.44Å; F59-V104 VanDerWaalsContact CZ-CG1 3.44Å; F59-V104 HydrophobicContact CZ-CG2 4.21Å; F59-V104 PolarHBondContact N-O 2.85Å; F59-V104 PolarHBondContact O-N 2.9Å; R61-V104 HydrophobicContact CB-CG2 4.24Å; V104-A118 HydrophobicContact CG2-CB 4.14Å
105	V	96.3	Very high	91	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	108.7	174.6	-175.6	0	0	0	0	108.2	F31 L48 A55 I58 D116 R117 Y119	F31-V105 HydrophobicContact CE1-CB 3.79Å; F31-V105 HydrophobicContact CE1-CG1 3.54Å; F31-V105 HydrophobicContact CE1-CG2 4.28Å; F31-V105 HydrophobicContact CZ-CB 3.74Å; F31-V105 HydrophobicContact CZ-CG1 3.6Å; L48-V105 HydrophobicContact CD1-CB 4.38Å; L48-V105 HydrophobicContact CD1-CG1 3.49Å; L48-V105 VanDerWaalsContact CD1-CG1 3.49Å; L48-V105 HydrophobicContact CD1-CG2 3.95Å; L48-V105 HydrophobicContact CD2-CG1 4.26Å; L48-V105 HydrophobicContact CD2-CG2 3.66Å; L48-V105 HydrophobicContact CG-CG2 4.43Å; A55-V105 HydrophobicContact CB-CG1 3.87Å; I58-V105 HydrophobicContact CG2-CG2 4.42Å; V105-D116 WeakPolarHBondContact O-CA 3.32Å; V105-D116 WeakPolarHBondContact O-CB 3.5Å; V105-R117 PolarHBondContact N-O 3.49Å; V105-R117 PolarHBondContact O-N 3.44Å; V105-Y119 HydrophobicContact CG2-CD2 4.17Å; V105-Y119 HydrophobicContact CG2-CE2 4.09Å
106	Q	94.5	Very high	91.4	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.033	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.8	178.8	173.5	178.7	86.9	0	0	109.6	S56 K57 F59 H108 F111	S56-Q106 WeakPolarHBondContact CA-O 3.31Å; S56-Q106 WeakPolarHBondContact CB-O 3.46Å; S56-Q106 PolarHBondContact N-O 2.81Å; K57-Q106 HydrophobicContact CB-CB 4.31Å; K57-Q106 PolarHBondContact N-O 2.99Å; K57-Q106 PolarHBondContact O-N 3Å; F59-Q106 HydrophobicContact CE1-CB 4.02Å; Q106-H108 VanDerWaalsContact CD-O 3.31Å; Q106-H108 WeakPolarHBondContact CG-O 3.32Å; Q106-H108 PolarHBondContact OE1-O 3Å; Q106-F111 VanDerWaalsContact NE2-C 3.27Å; Q106-F111 PolarHBondContact NE2-O 3.38Å
107	L	93.5	Very high	91.8	Very high	1 Å²	1	52 Å²	52	1%	0.005	25%	0.252	C	S	.	.			trans	-82.9	-37.3	175.1	-64.7	-177.7	0	0	0	111.1	F27 F31 T50 A55 S56 L115 D116	F27-L107 HydrophobicContact CD1-CB 4.42Å; F27-L107 HydrophobicContact CE1-CB 3.84Å; F27-L107 WeakPolarHBondContact CZ-O 3.43Å; F31-L107 HydrophobicContact CD2-CD1 3.99Å; F31-L107 HydrophobicContact CE2-CD1 3.6Å; F31-L107 HydrophobicContact CE2-CG 3.97Å; F31-L107 HydrophobicContact CZ-CD1 4.26Å; F31-L107 HydrophobicContact CZ-CD2 4.39Å; F31-L107 HydrophobicContact CZ-CG 4.15Å; T50-L107 HydrophobicContact CG2-CD2 4.36Å; A55-L107 HydrophobicContact CB-CD2 4.14Å; S56-L107 WeakPolarHBondContact CB-O 3.21Å; S56-L107 PolarHBondContact OG-O 2.75Å; L107-L115 HydrophobicContact CD1-CB 4.49Å; L107-D116 PolarHBondContact N-OD1 3.32Å
108	H	90.6	Very high	92.1	Very high	49 Å²	49	52.8 Å²	52.8	23%	0.227	26%	0.263	C	S	.	.	S	Bend	trans	-77.7	132.4	-179.8	-176.8	-85.4	0	0	0	111.7	Q106 F110 F111 T113	Q106-H108 VanDerWaalsContact CD-O 3.31Å; Q106-H108 WeakPolarHBondContact CG-O 3.32Å; Q106-H108 PolarHBondContact OE1-O 3Å; H108-F110 VanDerWaalsContact C-N 3.28Å; H108-F110 PolarHBondContact ND1-N 3.36Å; H108-F110 PolarHBondContact O-N 3.21Å; H108-F110 VanDerWaalsContact O-N 3.08Å; H108-F111 WeakPolarHBondContact CB-O 3.29Å; H108-F111 AromaticContact CE1-CD2 3.6Å; H108-F111 AromaticContact ND1-CD2 3.99Å; H108-F111 PolarHBondContact ND1-N 3.47Å; H108-T113 HydrophobicContact CB-CG2 3.59Å
109	P	89	Confident	92.2	Very high	59 Å²	59	54.7 Å²	54.7	38%	0.383	27%	0.271	S	S	.	.	S	Bend	trans	-61.5	-24.6	-169.7	-26.6	34.6	0	0	0	117.2
110	F	89.2	Confident	92.3	Very high	161 Å²	161	61.8 Å²	61.8	71%	0.706	30%	0.302	S	S	*	.	S	Bend	trans	-124.8	-18.8	-169.6	-58.7	-68.1	0	0	0	115.5	H108	H108-F110 VanDerWaalsContact C-N 3.28Å; H108-F110 PolarHBondContact ND1-N 3.36Å; H108-F110 PolarHBondContact O-N 3.21Å; H108-F110 VanDerWaalsContact O-N 3.08Å
111	F	89.5	Confident	92.4	Very high	142 Å²	142	61.8 Å²	61.8	62%	0.623	30%	0.302	S	S	*	.	S	Bend	trans	-144.2	146.5	-165.6	-61.8	-62.1	0	0	0	109.7	Q106 H108 T113	Q106-F111 VanDerWaalsContact NE2-C 3.27Å; Q106-F111 PolarHBondContact NE2-O 3.38Å; H108-F111 WeakPolarHBondContact CB-O 3.29Å; H108-F111 AromaticContact CE1-CD2 3.6Å; H108-F111 AromaticContact ND1-CD2 3.99Å; H108-F111 PolarHBondContact ND1-N 3.47Å; F111-T113 HydrophobicContact CB-CG2 4.44Å; F111-T113 PolarHBondContact O-N 3.01Å
112	I	89.5	Confident	92.5	Very high	118 Å²	118	67.2 Å²	67.2	61%	0.605	32%	0.321	S	S	*	.			trans	-74.4	120.6	167.1	-58.6	176.6	0	0	0	107.9	F59 D116	F59-I112 HydrophobicContact CZ-CD1 4.19Å; I112-D116 WeakPolarHBondContact CA-OD2 3.35Å; I112-D116 HydrophobicContact CG2-CB 4.26Å
113	T	90.9	Very high	92.6	Very high	49 Å²	49	66.2 Å²	66.2	30%	0.301	32%	0.315	S	S	.	.			trans	-117.6	171.2	-177.9	70.1	0	0	0	0	111.2	H108 F111 L115 D116	H108-T113 HydrophobicContact CB-CG2 3.59Å; F111-T113 HydrophobicContact CB-CG2 4.44Å; F111-T113 PolarHBondContact O-N 3.01Å; T113-L115 PolarHBondContact O-N 2.9Å; T113-L115 VanDerWaalsContact O-N 3.09Å; T113-L115 PolarHBondContact OG1-N 2.77Å; T113-D116 PolarHBondContact N-OD2 3.1Å; T113-D116 WeakPolarHBondContact O-CB 3.4Å; T113-D116 PolarHBondContact O-N 3.45Å; T113-D116 PolarHBondContact OG1-OD2 3.48Å
114	K	89.2	Confident	92.4	Very high	213 Å²	213	69 Å²	69	93%	0.926	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.4	175.2	-177.7	174.3	178.9	179.2	0	113.8	D116	K114-D116 VanDerWaalsContact C-N 3.33Å
115	L	88.7	Confident	92.2	Very high	58 Å²	58	70.7 Å²	70.7	30%	0.304	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-22	179.1	-65	176.7	0	0	0	112.2	F27 F31 L107 T113	F27-L115 HydrophobicContact CB-CD1 3.41Å; F27-L115 VanDerWaalsContact CB-CD1 3.41Å; F27-L115 HydrophobicContact CD1-CD1 4.15Å; F27-L115 HydrophobicContact CG-CD1 4.09Å; F31-L115 VanDerWaalsContact CE2-O 3.26Å; F31-L115 WeakPolarHBondContact CE2-O 3.38Å; L107-L115 HydrophobicContact CD1-CB 4.49Å; T113-L115 PolarHBondContact O-N 2.9Å; T113-L115 VanDerWaalsContact O-N 3.09Å; T113-L115 PolarHBondContact OG1-N 2.77Å
116	D	93.2	Very high	91.7	Very high	19 Å²	19	76.6 Å²	76.6	10%	0.102	36%	0.363	C	S	.	.			trans	-75.1	154	-177.1	-57	-24.8	0	0	0	110.6	V105 L107 I112 T113 K114	V105-D116 WeakPolarHBondContact O-CA 3.32Å; V105-D116 WeakPolarHBondContact O-CB 3.5Å; L107-D116 PolarHBondContact N-OD1 3.32Å; I112-D116 WeakPolarHBondContact CA-OD2 3.35Å; I112-D116 HydrophobicContact CG2-CB 4.26Å; T113-D116 PolarHBondContact N-OD2 3.1Å; T113-D116 WeakPolarHBondContact O-CB 3.4Å; T113-D116 PolarHBondContact O-N 3.45Å; T113-D116 PolarHBondContact OG1-OD2 3.48Å; K114-D116 VanDerWaalsContact C-N 3.33Å
117	R	94.7	Very high	90.9	Very high	105 Å²	105	81.3 Å²	81.3	40%	0.396	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.6	-175.4	-65.6	-177.8	-176.2	178.8	7.7	110.8	F31 V105 Y119	F31-R117 HydrophobicContact CD2-CG 4.11Å; F31-R117 HydrophobicContact CE1-CB 4.46Å; F31-R117 HydrophobicContact CE2-CB 4.1Å; F31-R117 HydrophobicContact CE2-CG 3.66Å; F31-R117 HydrophobicContact CZ-CB 3.89Å; F31-R117 HydrophobicContact CZ-CG 3.99Å; V105-R117 PolarHBondContact N-O 3.49Å; V105-R117 PolarHBondContact O-N 3.44Å; R117-Y119 HydrophobicContact CB-CD2 4.46Å; R117-Y119 HydrophobicContact CB-CE2 3.69Å; R117-Y119 WeakPolarHBondContact CD-OH 3.08Å
118	A	94.7	Very high	89.7	Confident	64 Å²	64	84.7 Å²	84.7	53%	0.529	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.6	171.4	0	0	0	0	0	109.3	T102 F103 V104	T102-A118 HydrophobicContact CG2-CB 4.1Å; F103-A118 CarbonylContact O-C 3.59Å; F103-A118 VanDerWaalsContact O-CA 3.31Å; F103-A118 WeakPolarHBondContact O-CA 3.28Å; V104-A118 HydrophobicContact CG2-CB 4.14Å
119	Y	94.9	Very high	88.3	Confident	40 Å²	40	88.4 Å²	88.4	16%	0.157	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.9	-178.9	-60.9	-80	0	0	0	109.4	F31 V34 P35 T102 F103 V105 R117 V121	F31-Y119 HydrophobicContact CE1-CE2 4.19Å; V34-Y119 HydrophobicContact CG1-CE1 4.31Å; P35-Y119 HydrophobicContact CG-CD1 4.04Å; P35-Y119 HydrophobicContact CG-CD2 3.7Å; P35-Y119 HydrophobicContact CG-CE1 4.06Å; P35-Y119 HydrophobicContact CG-CE2 3.7Å; P35-Y119 HydrophobicContact CG-CG 3.85Å; T102-Y119 WeakPolarHBondContact CA-O 3.3Å; F103-Y119 PolarHBondContact N-O 3.49Å; F103-Y119 PolarHBondContact O-N 3.07Å; V105-Y119 HydrophobicContact CG2-CD2 4.17Å; V105-Y119 HydrophobicContact CG2-CE2 4.09Å; R117-Y119 HydrophobicContact CB-CD2 4.46Å; R117-Y119 HydrophobicContact CB-CE2 3.69Å; R117-Y119 WeakPolarHBondContact CD-OH 3.08Å; Y119-V121 PolarHBondContact O-N 2.88Å
120	K	93.1	Very high	86.6	Confident	150 Å²	150	93.4 Å²	93.4	65%	0.652	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	107.4	171.7	-174.8	171.6	-177.6	171	0	108.6	T100	T100-K120 HydrophobicContact CG2-CD 4.44Å; T100-K120 VanDerWaalsContact CG2-CE 3.47Å; T100-K120 HydrophobicContact CG2-CG 4.09Å
121	V	94.7	Very high	85.1	Confident	15 Å²	15	90.8 Å²	90.8	9%	0.091	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.5	-179.6	168.8	0	0	0	0	109.1	V37 I44 T100 S101 F103 Y119	V37-V121 HydrophobicContact CG1-CG1 3.61Å; V37-V121 HydrophobicContact CG1-CG2 4.41Å; V37-V121 HydrophobicContact CG2-CG2 3.85Å; I44-V121 HydrophobicContact CG2-CG1 4.32Å; T100-V121 WeakPolarHBondContact CA-O 3.1Å; S101-V121 PolarHBondContact N-O 2.86Å; S101-V121 PolarHBondContact O-N 3Å; F103-V121 HydrophobicContact CD2-CB 3.88Å; F103-V121 HydrophobicContact CD2-CG2 3.58Å; F103-V121 HydrophobicContact CE2-CB 3.65Å; F103-V121 HydrophobicContact CE2-CG1 4.06Å; F103-V121 HydrophobicContact CE2-CG2 3.8Å; Y119-V121 PolarHBondContact O-N 2.88Å
122	R	93.7	Very high	83.1	Confident	121 Å²	121	91.5 Å²	91.5	46%	0.457	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	107	177.4	-177	176.6	-178.9	-78.2	0.4	109.5	A98 V99	A98-R122 VanDerWaalsContact CB-NH2 3.28Å; V99-R122 CarbonylContact O-C 3.53Å; V99-R122 WeakPolarHBondContact O-CA 3.4Å
123	C	94.3	Very high	81.5	Confident	2 Å²	2	90.9 Å²	90.9	1%	0.014	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	146.3	170.3	-60.6	0	0	0	0	109	C39 A98 V99 Y125	C39-C123 HydrophobicContact CB-CB 3.58Å; C39-C123 WeakPolarHBondContact CB-SG 3.32Å; C39-C123 VanDerWaalsContact SG-CA 3.59Å; C39-C123 WeakPolarHBondContact SG-CB 3.49Å; C39-C123 CovalentContact SG-SG 2.03Å; C39-C123 PolarHBondContact SG-SG 2.53Å; A98-C123 CarbonylContact C-O 3.5Å; A98-C123 WeakPolarHBondContact CA-O 3.4Å; V99-C123 HydrophobicContact CB-CB 4.32Å; V99-C123 PolarHBondContact N-O 2.9Å; V99-C123 PolarHBondContact O-N 3.31Å; C123-Y125 HydrophobicContact CB-CE2 3.7Å
124	F	92.1	Very high	80.3	Confident	60 Å²	60	93.4 Å²	93.4	26%	0.263	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.2	176.7	-174.1	-91.2	0	0	0	109.8	Q91 P94 A98 L126	Q91-F124 HydrophobicContact CB-CE2 4.01Å; Q91-F124 HydrophobicContact CG-CE2 4.16Å; Q91-F124 VanDerWaalsContact OE1-CE2 3.29Å; P94-F124 HydrophobicContact CB-CE1 4.42Å; P94-F124 HydrophobicContact CG-CD1 4.33Å; P94-F124 HydrophobicContact CG-CE1 3.54Å; P94-F124 HydrophobicContact CG-CZ 3.76Å; P94-F124 WeakPolarHBondContact O-CZ 3.11Å; A98-F124 HydrophobicContact CB-CD2 3.9Å; A98-F124 HydrophobicContact CB-CE2 4.41Å; F124-L126 HydrophobicContact CD1-CD2 4.3Å; F124-L126 HydrophobicContact CD1-CG 4.17Å; F124-L126 HydrophobicContact CE1-CB 4.49Å; F124-L126 HydrophobicContact CE1-CD2 3.59Å; F124-L126 HydrophobicContact CE1-CG 3.83Å
125	Y	90.5	Very high	78.6	Confident	52 Å²	52	90.9 Å²	90.9	20%	0.204	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	111.1	-178.7	-58.4	-93.8	0	0	0	107.8	N40 L81 G96 V97 V99 C123	N40-Y125 PolarHBondContact O-OH 3.01Å; L81-Y125 HydrophobicContact CD2-CE2 4.08Å; G96-Y125 CarbonylContact C-O 3.56Å; G96-Y125 WeakPolarHBondContact CA-O 3.48Å; V97-Y125 PolarHBondContact N-O 2.95Å; V97-Y125 PolarHBondContact O-N 3.17Å; V99-Y125 HydrophobicContact CB-CE2 4.02Å; V99-Y125 HydrophobicContact CG2-CD2 3.85Å; V99-Y125 HydrophobicContact CG2-CE2 3.64Å; C123-Y125 HydrophobicContact CB-CE2 3.7Å
126	L	84.6	Confident	77.4	Confident	124 Å²	124	94.8 Å²	94.8	65%	0.649	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	137.1	176.7	-71.7	159.1	0	0	0	109.6	P94 F124 A128	P94-L126 HydrophobicContact CB-CD2 3.57Å; P94-L126 HydrophobicContact CG-CD2 3.68Å; F124-L126 HydrophobicContact CD1-CD2 4.3Å; F124-L126 HydrophobicContact CD1-CG 4.17Å; F124-L126 HydrophobicContact CE1-CB 4.49Å; F124-L126 HydrophobicContact CE1-CD2 3.59Å; F124-L126 HydrophobicContact CE1-CG 3.83Å; L126-A128 PolarHBondContact O-N 3.49Å
127	E	78.1	Confident	75.4	Confident	106 Å²	106	103.3 Å²	103.3	50%	0.495	54%	0.536	S	S	.	.			trans	-81.6	111.6	164.4	-164.2	-178.7	155.5	0	0	107.2	K95	K95-E127 HydrophobicContact CD-CB 4.25Å; K95-E127 VanDerWaalsContact CD-OE2 3.28Å; K95-E127 WeakPolarHBondContact CD-OE2 3.02Å; K95-E127 WeakPolarHBondContact CE-OE2 3.02Å; K95-E127 HydrophobicContact CG-CB 4.28Å; K95-E127 IonicContact NZ-OE1 2.64Å; K95-E127 PolarHBondContact NZ-OE1 3.13Å; K95-E127 IonicContact NZ-OE2 3.21Å; K95-E127 PolarHBondContact NZ-OE2 3.43Å; K95-E127 VanDerWaalsContact NZ-OE2 3.09Å; K95-E127 PolarHBondContact O-N 3.27Å
128	A	68	Low	73.6	Confident	71 Å²	71	102.3 Å²	102.3	59%	0.587	54%	0.541	S	S	*	.			trans	-79.8	121.7	176.7	0	0	0	0	0	109.1	L126 H130	L126-A128 PolarHBondContact O-N 3.49Å; A128-H130 PolarHBondContact O-N 2.74Å
129	D	62	Low	71.8	Confident	128 Å²	128	105.3 Å²	105.3	68%	0.684	56%	0.559	S	S	*	*			trans	-69.5	86.8	162.3	-64.6	-35.4	0	0	0	107.2	T131	D129-T131 PolarHBondContact O-N 3.21Å
130	H	53.6	Low	70.1	Confident	164 Å²	164	106.8 Å²	106.8	76%	0.759	57%	0.572	S	S	*	*			trans	-71.8	85.2	173.7	-114.9	-77.4	0	0	0	108.2	A128 I132	A128-H130 PolarHBondContact O-N 2.74Å; H130-I132 PolarHBondContact O-N 3.42Å
131	T	58	Low	68.7	Low	106 Å²	106	107.1 Å²	107.1	65%	0.65	58%	0.579	S	S	*	*			trans	-66.5	106.5	157.4	57.9	0	0	0	0	105.9	D129 T133	D129-T131 PolarHBondContact O-N 3.21Å; T131-T133 PolarHBondContact O-N 3.09Å
132	I	46.9	Very low	67.3	Low	157 Å²	157	111.7 Å²	111.7	81%	0.805	61%	0.612	S	S	*	*			trans	-67.6	86.4	167.5	-58.4	175.1	0	0	0	106	H130 S134	H130-I132 PolarHBondContact O-N 3.42Å; I132-S134 PolarHBondContact O-N 3.28Å; I132-S134 VanDerWaalsContact O-N 3.09Å
133	T	56.3	Low	65.7	Low	104 Å²	104	110.9 Å²	110.9	64%	0.638	62%	0.622	S	S	*	*			trans	-73.3	102.9	170	53.8	0	0	0	0	106.7	T131	T131-T133 PolarHBondContact O-N 3.09Å
134	S	64.5	Low	64.4	Low	102 Å²	102	115.6 Å²	115.6	71%	0.713	66%	0.655	S	S	*	*			trans	-64.3	132.5	165.7	177	0	0	0	0	108.7	I132 L136	I132-S134 PolarHBondContact O-N 3.28Å; I132-S134 VanDerWaalsContact O-N 3.09Å; S134-L136 PolarHBondContact O-N 3.02Å
135	N	53.8	Low	62.8	Low	161 Å²	161	116.9 Å²	116.9	86%	0.861	67%	0.67	S	S	*	*			trans	-72.2	67.9	177.9	-54.2	-10.8	0	0	0	110
136	L	64	Low	61.3	Low	139 Å²	139	121.8 Å²	121.8	73%	0.728	70%	0.698	S	S	*	*			trans	-100.9	93.7	164.8	-173.4	62.6	0	0	0	107.9	S134 V138	S134-L136 PolarHBondContact O-N 3.02Å; L136-V138 VanDerWaalsContact C-N 3.28Å; L136-V138 HydrophobicContact CD1-CG2 4.38Å; L136-V138 HydrophobicContact CD2-CG2 4.2Å; L136-V138 HydrophobicContact CG-CG2 3.91Å; L136-V138 PolarHBondContact O-N 2.75Å
137	E	50.8	Low	59.9	Low	199 Å²	199	121.8 Å²	121.8	93%	0.93	70%	0.699	S	S	*	*			trans	-71.9	85.9	173.9	-169.6	172.3	-167.5	0	0	109
138	V	57.2	Low	58.9	Low	83 Å²	83	124.5 Å²	124.5	50%	0.503	71%	0.711	S	S	.	*			trans	-106.1	123.1	162.8	177.4	0	0	0	0	106.6	L136 T140	L136-V138 VanDerWaalsContact C-N 3.28Å; L136-V138 HydrophobicContact CD1-CG2 4.38Å; L136-V138 HydrophobicContact CD2-CG2 4.2Å; L136-V138 HydrophobicContact CG-CG2 3.91Å; L136-V138 PolarHBondContact O-N 2.75Å; V138-T140 HydrophobicContact CG1-CG2 3.95Å; V138-T140 PolarHBondContact O-N 3.46Å
139	S	56.4	Low	58.3	Low	127 Å²	127	129.5 Å²	129.5	89%	0.888	72%	0.722	S	S	*	*			trans	-66.9	79.5	172	42.6	0	0	0	0	110
140	T	59.5	Low	58.3	Low	72 Å²	72	126.7 Å²	126.7	44%	0.442	71%	0.71	S	S	.	*			trans	-89.4	158.8	162.1	56.2	0	0	0	0	109.3	V138 S142 F398	V138-T140 HydrophobicContact CG1-CG2 3.95Å; V138-T140 PolarHBondContact O-N 3.46Å; T140-S142 PolarHBondContact O-N 2.66Å; T140-S142 VanDerWaalsContact O-N 3.09Å; T140-F398 HydrophobicContact CG2-CE2 4.43Å; T140-F398 HydrophobicContact CG2-CZ 4.4Å
141	I	63.6	Low	59.2	Low	157 Å²	157	122.4 Å²	122.4	81%	0.805	70%	0.698	S	S	*	*			trans	-48.8	120.1	169	-74.2	164.8	0	0	0	107.2	P143	I141-P143 WeakPolarHBondContact O-CD 3.46Å
142	S	65.4	Low	60.2	Low	110 Å²	110	119.9 Å²	119.9	77%	0.769	68%	0.681	S	S	*	*			trans	-59.5	110.2	170.9	-67	0	0	0	0	107.7	T140 S144	T140-S142 PolarHBondContact O-N 2.66Å; T140-S142 VanDerWaalsContact O-N 3.09Å; S142-S144 PolarHBondContact O-N 3.17Å
143	P	60.4	Low	62.1	Low	104 Å²	104	112.6 Å²	112.6	68%	0.675	64%	0.643	S	S	*	*			trans	-63.3	129.3	169.4	28.1	-30.6	0	0	0	106.6	I141 P145	I141-P143 WeakPolarHBondContact O-CD 3.46Å; P143-P145 VanDerWaalsContact O-CD 3.23Å; P143-P145 WeakPolarHBondContact O-CD 3.27Å
144	S	66.6	Low	63.7	Low	102 Å²	102	111.8 Å²	111.8	71%	0.713	63%	0.633	S	S	*	*			trans	-61.8	115.5	158.5	174.4	0	0	0	0	105.3	S142 I146	S142-S144 PolarHBondContact O-N 3.17Å; S144-I146 PolarHBondContact O-N 3.01Å; S144-I146 VanDerWaalsContact O-N 3.1Å
145	P	58.4	Low	65.1	Low	87 Å²	87	108 Å²	108	57%	0.565	61%	0.606	S	S	*	*			trans	-57.4	124.9	168	26.4	-32	0	0	0	106.5	P143 D147	P143-P145 VanDerWaalsContact O-CD 3.23Å; P143-P145 WeakPolarHBondContact O-CD 3.27Å; P145-D147 PolarHBondContact O-N 2.96Å
146	I	59.6	Low	67	Low	154 Å²	154	105.7 Å²	105.7	79%	0.79	59%	0.588	S	S	*	*			trans	-81.4	90.9	160.5	-62.3	175.1	0	0	0	102.9	S144 Q148	S144-I146 PolarHBondContact O-N 3.01Å; S144-I146 VanDerWaalsContact O-N 3.1Å; I146-Q148 PolarHBondContact O-N 3.38Å
147	D	54	Low	68.6	Low	125 Å²	125	99.5 Å²	99.5	67%	0.668	56%	0.555	S	S	*	*			trans	-67.5	86.5	172.1	-65.5	-38.9	0	0	0	107.1	P145 E149	P145-D147 PolarHBondContact O-N 2.96Å; D147-E149 PolarHBondContact O-N 3.3Å
148	Q	57.2	Low	70.7	Confident	163 Å²	163	91.7 Å²	91.7	76%	0.762	52%	0.52	S	S	*	.			trans	-77.7	85	164.4	-169.9	171.3	-13.1	0	0	106.4	I146 T150	I146-Q148 PolarHBondContact O-N 3.38Å; Q148-T150 PolarHBondContact O-N 2.95Å
149	E	56.1	Low	72.6	Confident	176 Å²	176	87.8 Å²	87.8	82%	0.822	50%	0.496	S	S	*	.			trans	-64.8	79.1	170.1	-70.2	-170.8	173.5	0	0	109.1	D147 S151	D147-E149 PolarHBondContact O-N 3.3Å; E149-S151 VanDerWaalsContact C-N 3.3Å; E149-S151 PolarHBondContact O-N 3.22Å
150	T	62.4	Low	74.6	Confident	68 Å²	68	84.9 Å²	84.9	42%	0.417	47%	0.465	S	S	.	.			trans	-73.2	97	161.1	-54.3	0	0	0	0	105.5	Q148 L152 Y190	Q148-T150 PolarHBondContact O-N 2.95Å; T150-L152 PolarHBondContact O-N 2.88Å; T150-Y190 HydrophobicContact CG2-CE2 4.34Å; T150-Y190 WeakPolarHBondContact CG2-OH 3.47Å
151	S	71.4	Confident	76.3	Confident	74 Å²	74	84 Å²	84	52%	0.517	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-71.2	120.7	-177.7	73	0	0	0	0	109.8	E149	E149-S151 VanDerWaalsContact C-N 3.3Å; E149-S151 PolarHBondContact O-N 3.22Å
152	L	79.4	Confident	77.7	Confident	54 Å²	54	81.3 Å²	81.3	28%	0.283	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-56.9	140.2	171.8	-60.7	173.3	0	0	0	110.3	L92 T150 L410	L92-L152 HydrophobicContact CB-CB 4.05Å; L92-L152 HydrophobicContact CB-CD1 4.24Å; L92-L152 VanDerWaalsContact O-CD1 3.31Å; L92-L152 WeakPolarHBondContact O-CD1 3.46Å; T150-L152 PolarHBondContact O-N 2.88Å; L152-L410 HydrophobicContact CD1-CD1 4.13Å; L152-L410 HydrophobicContact CD2-CD1 3.83Å; L152-L410 HydrophobicContact CD2-CD2 3.64Å; L152-L410 HydrophobicContact CD2-CG 4.43Å
153	P	86.6	Confident	79.2	Confident	3 Å²	3	83.3 Å²	83.3	2%	0.019	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-76.8	147.5	-177.9	31.1	-34.2	0	0	0	112.9	C184 D185 A186 Y190 L257	P153-C184 HydrophobicContact CB-CB 4.41Å; P153-D185 VanDerWaalsContact C-OD1 3.28Å; P153-D185 WeakPolarHBondContact CA-OD1 3.42Å; P153-D185 VanDerWaalsContact CB-OD1 3.25Å; P153-D185 WeakPolarHBondContact CB-OD1 3.4Å; P153-A186 HydrophobicContact CB-CB 4.16Å; P153-A186 HydrophobicContact CG-CB 4.29Å; P153-Y190 HydrophobicContact CG-CD2 4.26Å; P153-L257 HydrophobicContact CG-CD1 3.5Å; P153-L257 HydrophobicContact CG-CD2 4.35Å
154	Q	89.7	Confident	80.8	Confident	88 Å²	88	80 Å²	80	41%	0.411	41%	0.41	S	S	.	.			trans	-86	115.8	166.3	-57.9	-168.6	-31.3	0	0	110.8	K93 C184 D185	K93-Q154 HydrophobicContact CB-CG 4.38Å; K93-Q154 HydrophobicContact CD-CG 4.37Å; Q154-C184 WeakPolarHBondContact O-CA 3.16Å; Q154-D185 WeakPolarHBondContact CA-OD1 3.12Å; Q154-D185 PolarHBondContact N-OD1 2.98Å; Q154-D185 PolarHBondContact O-N 2.9Å; Q154-D185 VanDerWaalsContact O-N 3.16Å
155	C	94.4	Very high	82.1	Confident	22 Å²	22	80.7 Å²	80.7	15%	0.149	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	144.4	171.4	-59.8	0	0	0	0	111.8	E183 C184 I255 A412 V414	C155-E183 CarbonylContact C-O 3.53Å; C155-E183 VanDerWaalsContact CA-O 3.3Å; C155-E183 WeakPolarHBondContact CA-O 3.33Å; C155-C184 VanDerWaalsContact CA-SG 3.59Å; C155-C184 HydrophobicContact CB-CB 4.11Å; C155-C184 WeakPolarHBondContact CB-SG 3.33Å; C155-C184 WeakPolarHBondContact SG-CB 3.23Å; C155-C184 CovalentContact SG-SG 2.04Å; C155-C184 PolarHBondContact SG-SG 2.03Å; C155-I255 HydrophobicContact CB-CD1 3.72Å; C155-A412 HydrophobicContact CB-CB 4.37Å; C155-V414 HydrophobicContact CB-CG1 4.11Å
156	K	94.8	Very high	83.8	Confident	112 Å²	112	77.1 Å²	77.1	49%	0.487	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.9	-179.2	-66.3	176.4	-173.8	163.6	0	109.5	W182 E183	K156-W182 WeakPolarHBondContact O-CA 3.02Å; K156-E183 PolarHBondContact N-O 2.94Å; K156-E183 PolarHBondContact O-N 2.72Å
157	Y	96.3	Very high	85.4	Confident	10 Å²	10	77.2 Å²	77.2	4%	0.039	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.3	176	171.3	-143.3	0	0	0	109.9	L159 H180 V181 W182 F251 V414 Q416	Y157-L159 HydrophobicContact CE2-CD2 4.32Å; Y157-H180 HydrophobicContact CE2-CB 4.05Å; Y157-H180 AromaticContact CE2-ND1 3.83Å; Y157-H180 AromaticContact CZ-ND1 3.71Å; Y157-H180 PolarHBondContact OH-CE1 2.97Å; Y157-H180 PolarHBondContact OH-ND1 2.8Å; Y157-V181 WeakPolarHBondContact CA-O 3.3Å; Y157-W182 AromaticContact CD2-CD1 3.64Å; Y157-W182 HydrophobicContact CD2-CD2 4.22Å; Y157-W182 AromaticContact CD2-CE2 3.75Å; Y157-W182 HydrophobicContact CD2-CG 4.17Å; Y157-W182 HydrophobicContact CD2-CZ2 4.38Å; Y157-W182 AromaticContact CD2-NE1 3.34Å; Y157-W182 VanDerWaalsContact CD2-NE1 3.34Å; Y157-W182 HydrophobicContact CE2-CD2 4.5Å; Y157-W182 AromaticContact CE2-CE2 3.78Å; Y157-W182 AromaticContact CE2-CZ2 3.94Å; Y157-W182 HydrophobicContact CE2-CZ2 3.94Å; Y157-W182 AromaticContact CE2-NE1 3.74Å; Y157-W182 AromaticContact CG-CD1 3.81Å; Y157-W182 AromaticContact CG-NE1 3.61Å; Y157-F251 HydrophobicContact CE1-CB 3.53Å; Y157-F251 WeakPolarHBondContact OH-CB 3.21Å; Y157-F251 WeakPolarHBondContact OH-CG 3.4Å; Y157-V414 HydrophobicContact CD1-CG2 4.31Å; Y157-V414 HydrophobicContact CG-CG2 4.26Å; Y157-Q416 HydrophobicContact CD1-CB 3.71Å; Y157-Q416 HydrophobicContact CE1-CB 3.58Å; Y157-Q416 HydrophobicContact CG-CB 4.4Å; Y157-Q416 PolarHBondContact O-NE2 3.12Å
158	N	96.3	Very high	87.4	Confident	35 Å²	35	73.6 Å²	73.6	19%	0.187	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.6	-176.8	-65.6	-67.4	0	0	0	111.3	V181	N158-V181 PolarHBondContact N-O 3Å; N158-V181 PolarHBondContact O-N 2.96Å
159	L	96.8	Very high	89	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.5	168.5	-66.9	171.3	0	0	0	108.8	Y157 A168 V169 W179 F251 Q416 I418	Y157-L159 HydrophobicContact CE2-CD2 4.32Å; L159-A168 WeakPolarHBondContact O-CA 3.28Å; L159-V169 HydrophobicContact CB-CB 4.32Å; L159-V169 PolarHBondContact O-N 2.85Å; L159-W179 CarbonylContact C-O 3.57Å; L159-W179 WeakPolarHBondContact CA-O 3.16Å; L159-F251 HydrophobicContact CD1-CD2 3.96Å; L159-F251 HydrophobicContact CD1-CE2 4.04Å; L159-Q416 HydrophobicContact CB-CG 4.47Å; L159-Q416 HydrophobicContact CD1-CB 4.48Å; L159-Q416 HydrophobicContact CD1-CG 3.83Å; L159-Q416 HydrophobicContact CG-CG 3.9Å; L159-I418 HydrophobicContact CD1-CB 3.91Å; L159-I418 HydrophobicContact CD1-CD1 4.13Å; L159-I418 HydrophobicContact CD1-CG2 4.12Å
160	R	97.2	Very high	90.7	Very high	65 Å²	65	64.5 Å²	64.5	25%	0.245	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.9	-172.6	-61.5	-80	-176.8	176.1	4.5	110.5	R163 P164 G166 E167 V178 W179 V181	R160-R163 WeakPolarHBondContact CB-O 3.39Å; R160-P164 WeakPolarHBondContact CG-O 3.1Å; R160-G166 WeakPolarHBondContact CD-O 3.41Å; R160-G166 PolarHBondContact NH1-O 3.02Å; R160-E167 WeakPolarHBondContact CA-O 3.3Å; R160-V178 CarbonylContact O-C 3.48Å; R160-V178 VanDerWaalsContact O-CA 3.32Å; R160-V178 WeakPolarHBondContact O-CA 3.39Å; R160-W179 HydrophobicContact CB-CB 4.18Å; R160-W179 PolarHBondContact N-O 2.64Å; R160-W179 PolarHBondContact O-N 3.47Å; R160-V181 HydrophobicContact CB-CG2 4.42Å; R160-V181 HydrophobicContact CG-CB 4.43Å; R160-V181 HydrophobicContact CG-CG2 3.9Å
161	M	95.7	Very high	92.2	Very high	55 Å²	55	67.7 Å²	67.7	27%	0.271	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.3	-174.2	-157.8	58.2	147.4	0	0	111.6	R163 E167 V169 D176 V178	M161-R163 PolarHBondContact O-N 3.37Å; M161-E167 PolarHBondContact N-O 2.84Å; M161-V169 HydrophobicContact CB-CG2 3.55Å; M161-V169 HydrophobicContact CG-CG2 4.18Å; M161-V169 HydrophobicContact SD-CG2 3.8Å; M161-D176 HydrophobicContact CE-CB 4.22Å; M161-V178 HydrophobicContact SD-CG1 4.09Å
162	E	94.1	Very high	93.3	Very high	100 Å²	100	64.3 Å²	64.3	47%	0.467	30%	0.303	S	S	.	.	S	Bend	trans	60.2	-31.2	175.2	-61.6	-65.3	157.7	0	0	117.5	R177 W179	E162-R177 PolarHBondContact N-O 3.05Å; E162-R177 IonicContact OE2-NE 2.76Å; E162-W179 VanDerWaalsContact C-NE1 3.28Å; E162-W179 PolarHBondContact O-NE1 2.79Å
163	R	95.4	Very high	94	Very high	151 Å²	151	68.2 Å²	68.2	57%	0.57	31%	0.314	S	S	*	.	S	Bend	trans	-144	157.9	-177.6	-68.6	-177.9	-79.5	151.1	-4.2	111.5	R160 M161 D165 G166 W179	R160-R163 WeakPolarHBondContact CB-O 3.39Å; M161-R163 PolarHBondContact O-N 3.37Å; R163-D165 VanDerWaalsContact C-N 3.28Å; R163-D165 VanDerWaalsContact CB-OD1 3.24Å; R163-D165 WeakPolarHBondContact CB-OD1 3.38Å; R163-D165 IonicContact NH1-OD1 3.04Å; R163-D165 IonicContact NH1-OD2 2.82Å; R163-D165 PolarHBondContact O-N 3.08Å; R163-G166 PolarHBondContact O-N 2.82Å; R163-W179 VanDerWaalsContact CA-CD1 3.47Å; R163-W179 VanDerWaalsContact N-CD1 3.29Å
164	P	94.1	Very high	94.3	Very high	35 Å²	35	71.4 Å²	71.4	23%	0.227	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-37.4	176.7	-19.3	27.1	0	0	0	113.7	R160 G166 W179 V181 E235	R160-P164 WeakPolarHBondContact CG-O 3.1Å; P164-G166 PolarHBondContact O-N 2.85Å; P164-W179 HydrophobicContact CB-CE3 4.33Å; P164-W179 HydrophobicContact CG-CD2 3.82Å; P164-W179 HydrophobicContact CG-CE3 3.51Å; P164-W179 HydrophobicContact CG-CG 4.46Å; P164-W179 HydrophobicContact CG-CH2 4.09Å; P164-W179 HydrophobicContact CG-CZ2 4.4Å; P164-W179 HydrophobicContact CG-CZ3 3.64Å; P164-V181 HydrophobicContact CB-CG2 4.24Å; P164-E235 VanDerWaalsContact CB-OE2 3.22Å; P164-E235 WeakPolarHBondContact CB-OE2 3.22Å; P164-E235 VanDerWaalsContact CG-OE2 3.23Å; P164-E235 WeakPolarHBondContact CG-OE2 3.44Å
165	D	93.9	Very high	94.4	Very high	117 Å²	117	69.4 Å²	69.4	63%	0.626	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	7.9	177.8	69.3	-37.7	0	0	0	113.5	R163	R163-D165 VanDerWaalsContact C-N 3.28Å; R163-D165 VanDerWaalsContact CB-OD1 3.24Å; R163-D165 WeakPolarHBondContact CB-OD1 3.38Å; R163-D165 IonicContact NH1-OD1 3.04Å; R163-D165 IonicContact NH1-OD2 2.82Å; R163-D165 PolarHBondContact O-N 3.08Å
166	G	93.7	Very high	94.4	Very high	12 Å²	12	69.5 Å²	69.5	12%	0.124	33%	0.332	C	S	.	.	S	Bend	trans	-67.8	179.7	-173.5	0	0	0	0	0	115.3	R160 R163 P164	R160-G166 WeakPolarHBondContact CD-O 3.41Å; R160-G166 PolarHBondContact NH1-O 3.02Å; R163-G166 PolarHBondContact O-N 2.82Å; P164-G166 PolarHBondContact O-N 2.85Å
167	E	94.6	Very high	94.5	Very high	156 Å²	156	68.7 Å²	68.7	73%	0.729	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-65.1	141.9	172.5	-171.4	177.6	170.4	0	0	110.3	R160 M161 V169	R160-E167 WeakPolarHBondContact CA-O 3.3Å; M161-E167 PolarHBondContact N-O 2.84Å; E167-V169 PolarHBondContact O-N 2.81Å
168	A	94.6	Very high	94.5	Very high	48 Å²	48	68.4 Å²	68.4	40%	0.397	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-66.2	128.3	175.6	0	0	0	0	0	110.8	L159	L159-A168 WeakPolarHBondContact O-CA 3.28Å
169	V	92.3	Very high	94.5	Very high	8 Å²	8	68.8 Å²	68.8	5%	0.048	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-96.7	129.6	-173.8	-176.5	0	0	0	0	110.5	L159 M161 E167 Y171 A172 V178 I418	L159-V169 HydrophobicContact CB-CB 4.32Å; L159-V169 PolarHBondContact O-N 2.85Å; M161-V169 HydrophobicContact CB-CG2 3.55Å; M161-V169 HydrophobicContact CG-CG2 4.18Å; M161-V169 HydrophobicContact SD-CG2 3.8Å; E167-V169 PolarHBondContact O-N 2.81Å; V169-Y171 VanDerWaalsContact CG1-O 3.3Å; V169-Y171 WeakPolarHBondContact CG1-O 2.96Å; V169-A172 HydrophobicContact CG1-CB 3.97Å; V169-V178 HydrophobicContact CG2-CG1 4.42Å; V169-I418 HydrophobicContact CB-CD1 4.46Å; V169-I418 HydrophobicContact CG1-CD1 3.53Å; V169-I418 HydrophobicContact CG1-CG1 4.29Å
170	R	91.9	Very high	94.6	Very high	141 Å²	141	68.8 Å²	68.8	53%	0.532	32%	0.324	S	S	.	.	S	Bend	trans	-115.8	-22.4	170.4	-63.9	-61.4	-176.5	-174.9	-7.3	112.9	L419	R170-L419 PolarHBondContact O-N 3.39Å
171	Y	93.6	Very high	94.6	Very high	135 Å²	135	66 Å²	66	53%	0.529	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	138.7	177.5	56.8	-86.8	0	0	0	108.5	V169 L419	V169-Y171 VanDerWaalsContact CG1-O 3.3Å; V169-Y171 WeakPolarHBondContact CG1-O 2.96Å; Y171-L419 CarbonylContact C-O 3.45Å; Y171-L419 WeakPolarHBondContact CA-O 3.3Å
172	A	93.8	Very high	94.7	Very high	2 Å²	2	63.4 Å²	63.4	2%	0.017	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	161.2	174.4	0	0	0	0	0	109.6	V169 D176 V240 I418 L419 V420 L421	V169-A172 HydrophobicContact CG1-CB 3.97Å; A172-D176 HydrophobicContact CB-CB 4.29Å; A172-V240 HydrophobicContact CB-CB 4.49Å; A172-V240 HydrophobicContact CB-CG1 4.27Å; A172-V240 HydrophobicContact CB-CG2 3.78Å; A172-I418 HydrophobicContact CB-CD1 3.78Å; A172-L419 PolarHBondContact N-O 2.92Å; A172-V420 CarbonylContact O-C 3.51Å; A172-V420 VanDerWaalsContact O-CA 3.31Å; A172-V420 WeakPolarHBondContact O-CA 3.35Å; A172-L421 PolarHBondContact O-N 2.76Å
173	R	93.8	Very high	94.8	Very high	136 Å²	136	62.7 Å²	62.7	51%	0.513	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	156.6	172.7	-62.1	171.2	-61.3	-117.3	-9.9	110	G175 D176 V240 L421	R173-G175 PolarHBondContact O-N 2.83Å; R173-D176 IonicContact CZ-OD1 3.68Å; R173-D176 IonicContact CZ-OD2 3.89Å; R173-D176 PolarHBondContact N-OD2 2.93Å; R173-D176 IonicContact NE-OD1 3.95Å; R173-D176 PolarHBondContact NE-OD1 2.9Å; R173-D176 IonicContact NE-OD2 3.86Å; R173-D176 IonicContact NH2-OD1 3.9Å; R173-D176 PolarHBondContact NH2-OD1 2.99Å; R173-D176 IonicContact NH2-OD2 3.21Å; R173-D176 WeakPolarHBondContact O-CB 3.29Å; R173-D176 PolarHBondContact O-N 3.02Å; R173-V240 WeakPolarHBondContact O-CB 2.99Å; R173-L421 WeakPolarHBondContact CA-O 3.46Å; R173-L421 HydrophobicContact CG-CB 4.14Å
174	I	92.8	Very high	94.7	Very high	71 Å²	71	56 Å²	56	36%	0.364	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	131.1	170.5	-60.1	173.2	0	0	0	109.4	D176 V240 K242 V420 L421 V423	I174-D176 VanDerWaalsContact C-N 3.29Å; I174-D176 PolarHBondContact O-N 2.72Å; I174-V240 WeakPolarHBondContact CA-O 3.42Å; I174-K242 HydrophobicContact CD1-CD 4.15Å; I174-K242 HydrophobicContact CD1-CG 4.19Å; I174-K242 HydrophobicContact CG1-CD 4.44Å; I174-K242 HydrophobicContact CG1-CG 4.41Å; I174-V420 HydrophobicContact CG1-CG1 3.63Å; I174-L421 PolarHBondContact N-O 3.28Å; I174-V423 HydrophobicContact CB-CG2 4.29Å
175	G	92.6	Very high	94.5	Very high	45 Å²	45	58.8 Å²	58.8	46%	0.464	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	-3.6	-179.6	0	0	0	0	0	115.6	R173 V240	R173-G175 PolarHBondContact O-N 2.83Å; G175-V240 PolarHBondContact N-O 2.87Å
176	D	94.8	Very high	93.6	Very high	25 Å²	25	53.4 Å²	53.4	13%	0.134	26%	0.259	C	S	.	.			trans	-63	149.4	165.4	-72.7	-16.9	0	0	0	109.1	M161 A172 R173 I174 V240	M161-D176 HydrophobicContact CE-CB 4.22Å; A172-D176 HydrophobicContact CB-CB 4.29Å; R173-D176 IonicContact CZ-OD1 3.68Å; R173-D176 IonicContact CZ-OD2 3.89Å; R173-D176 PolarHBondContact N-OD2 2.93Å; R173-D176 IonicContact NE-OD1 3.95Å; R173-D176 PolarHBondContact NE-OD1 2.9Å; R173-D176 IonicContact NE-OD2 3.86Å; R173-D176 IonicContact NH2-OD1 3.9Å; R173-D176 PolarHBondContact NH2-OD1 2.99Å; R173-D176 IonicContact NH2-OD2 3.21Å; R173-D176 WeakPolarHBondContact O-CB 3.29Å; R173-D176 PolarHBondContact O-N 3.02Å; I174-D176 VanDerWaalsContact C-N 3.29Å; I174-D176 PolarHBondContact O-N 2.72Å; D176-V240 HydrophobicContact CB-CG2 4.38Å; D176-V240 WeakPolarHBondContact O-CG2 3.49Å; D176-V240 PolarHBondContact O-N 3.47Å
177	R	95.6	Very high	92.9	Very high	95 Å²	95	55.1 Å²	55.1	36%	0.358	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.9	-179	179.8	-175.8	-59.3	-66	4	110.7	E162 E237 L239	E162-R177 PolarHBondContact N-O 3.05Å; E162-R177 IonicContact OE2-NE 2.76Å; R177-E237 WeakPolarHBondContact CD-OE1 3.26Å; R177-E237 HydrophobicContact CG-CG 4.17Å; R177-E237 IonicContact CZ-OE1 3.68Å; R177-E237 IonicContact NE-OE1 3.05Å; R177-E237 PolarHBondContact NE-OE1 3.3Å; R177-E237 VanDerWaalsContact NH1-CD 3.34Å; R177-E237 IonicContact NH1-OE1 2.59Å; R177-E237 PolarHBondContact NH1-OE1 3.21Å; R177-L239 HydrophobicContact CB-CD2 4.34Å
178	V	96.7	Very high	92.3	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.018	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.8	178.5	-63.7	0	0	0	0	111.3	R160 M161 V169 T238 V240	R160-V178 CarbonylContact O-C 3.48Å; R160-V178 VanDerWaalsContact O-CA 3.32Å; R160-V178 WeakPolarHBondContact O-CA 3.39Å; M161-V178 HydrophobicContact SD-CG1 4.09Å; V169-V178 HydrophobicContact CG2-CG1 4.42Å; V178-T238 WeakPolarHBondContact CG2-OG1 3.34Å; V178-T238 PolarHBondContact N-O 2.79Å; V178-T238 PolarHBondContact O-N 2.81Å; V178-T238 VanDerWaalsContact O-O 3.12Å; V178-V240 HydrophobicContact CB-CG2 4.17Å; V178-V240 HydrophobicContact CG1-CG2 3.46Å; V178-V240 VanDerWaalsContact CG1-CG2 3.46Å; V178-V240 HydrophobicContact CG2-CG2 3.62Å
179	W	97.3	Very high	91.9	Very high	43 Å²	43	55 Å²	55	16%	0.163	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.3	176.6	-74.4	76	0	0	0	109.2	L159 R160 E162 R163 P164 V181 E235 Q236 E237	L159-W179 CarbonylContact C-O 3.57Å; L159-W179 WeakPolarHBondContact CA-O 3.16Å; R160-W179 HydrophobicContact CB-CB 4.18Å; R160-W179 PolarHBondContact N-O 2.64Å; R160-W179 PolarHBondContact O-N 3.47Å; E162-W179 VanDerWaalsContact C-NE1 3.28Å; E162-W179 PolarHBondContact O-NE1 2.79Å; R163-W179 VanDerWaalsContact CA-CD1 3.47Å; R163-W179 VanDerWaalsContact N-CD1 3.29Å; P164-W179 HydrophobicContact CB-CE3 4.33Å; P164-W179 HydrophobicContact CG-CD2 3.82Å; P164-W179 HydrophobicContact CG-CE3 3.51Å; P164-W179 HydrophobicContact CG-CG 4.46Å; P164-W179 HydrophobicContact CG-CH2 4.09Å; P164-W179 HydrophobicContact CG-CZ2 4.4Å; P164-W179 HydrophobicContact CG-CZ3 3.64Å; W179-V181 HydrophobicContact CB-CG2 4.24Å; W179-E235 HydrophobicContact CE3-CB 4.22Å; W179-E235 HydrophobicContact CE3-CG 4.44Å; W179-E235 HydrophobicContact CZ3-CB 4.39Å; W179-E235 HydrophobicContact CZ3-CG 4.12Å; W179-Q236 CarbonylContact C-O 3.55Å; W179-Q236 WeakPolarHBondContact CA-O 3.43Å; W179-E237 HydrophobicContact CD2-CB 4.08Å; W179-E237 HydrophobicContact CE3-CB 4.22Å; W179-E237 HydrophobicContact CH2-CB 4.15Å; W179-E237 HydrophobicContact CZ2-CB 3.95Å; W179-E237 HydrophobicContact CZ2-CG 4.17Å; W179-E237 HydrophobicContact CZ3-CB 4.27Å
180	H	97.8	Very high	91.8	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	119.7	168.7	-64.7	-111.5	0	0	0	107.5	Y157 W182 E235 Q236 T238 F251	Y157-H180 HydrophobicContact CE2-CB 4.05Å; Y157-H180 AromaticContact CE2-ND1 3.83Å; Y157-H180 AromaticContact CZ-ND1 3.71Å; Y157-H180 PolarHBondContact OH-CE1 2.97Å; Y157-H180 PolarHBondContact OH-ND1 2.8Å; H180-W182 HydrophobicContact CB-CE3 4.36Å; H180-W182 HydrophobicContact CB-CH2 3.38Å; H180-W182 HydrophobicContact CB-CZ2 3.94Å; H180-W182 HydrophobicContact CB-CZ3 3.61Å; H180-E235 CarbonylContact O-C 3.58Å; H180-E235 VanDerWaalsContact O-CA 3.23Å; H180-E235 WeakPolarHBondContact O-CA 3.32Å; H180-Q236 HydrophobicContact CB-CB 4.44Å; H180-Q236 PolarHBondContact N-O 2.9Å; H180-Q236 PolarHBondContact O-N 3.38Å; H180-T238 PolarHBondContact CD2-OG1 2.83Å; H180-T238 PolarHBondContact NE2-OG1 2.98Å; H180-F251 AromaticContact CE1-CD1 3.8Å; H180-F251 AromaticContact CE1-CE1 3.64Å; H180-F251 AromaticContact CE1-CZ 3.83Å
181	V	97.7	Very high	91.8	Very high	7 Å²	7	48.5 Å²	48.5	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	117.2	-176.7	-178.5	0	0	0	0	109.1	Y157 N158 R160 P164 W179 E183	Y157-V181 WeakPolarHBondContact CA-O 3.3Å; N158-V181 PolarHBondContact N-O 3Å; N158-V181 PolarHBondContact O-N 2.96Å; R160-V181 HydrophobicContact CB-CG2 4.42Å; R160-V181 HydrophobicContact CG-CB 4.43Å; R160-V181 HydrophobicContact CG-CG2 3.9Å; P164-V181 HydrophobicContact CB-CG2 4.24Å; W179-V181 HydrophobicContact CB-CG2 4.24Å; V181-E183 HydrophobicContact CG1-CG 3.98Å
182	W	97.5	Very high	91.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.3	174.9	-59.7	-91.2	0	0	0	109.6	K156 Y157 H180 M192 V194 M222 P225 S233 A234 Q236	K156-W182 WeakPolarHBondContact O-CA 3.02Å; Y157-W182 AromaticContact CD2-CD1 3.64Å; Y157-W182 HydrophobicContact CD2-CD2 4.22Å; Y157-W182 AromaticContact CD2-CE2 3.75Å; Y157-W182 HydrophobicContact CD2-CG 4.17Å; Y157-W182 HydrophobicContact CD2-CZ2 4.38Å; Y157-W182 AromaticContact CD2-NE1 3.34Å; Y157-W182 VanDerWaalsContact CD2-NE1 3.34Å; Y157-W182 HydrophobicContact CE2-CD2 4.5Å; Y157-W182 AromaticContact CE2-CE2 3.78Å; Y157-W182 AromaticContact CE2-CZ2 3.94Å; Y157-W182 HydrophobicContact CE2-CZ2 3.94Å; Y157-W182 AromaticContact CE2-NE1 3.74Å; Y157-W182 AromaticContact CG-CD1 3.81Å; Y157-W182 AromaticContact CG-NE1 3.61Å; H180-W182 HydrophobicContact CB-CE3 4.36Å; H180-W182 HydrophobicContact CB-CH2 3.38Å; H180-W182 HydrophobicContact CB-CZ2 3.94Å; H180-W182 HydrophobicContact CB-CZ3 3.61Å; W182-M192 HydrophobicContact CB-SD 4.34Å; W182-V194 HydrophobicContact CB-CG2 3.86Å; W182-V194 HydrophobicContact CD2-CG1 4.06Å; W182-V194 HydrophobicContact CD2-CG2 3.91Å; W182-V194 HydrophobicContact CE3-CG2 4.31Å; W182-V194 HydrophobicContact CG-CG1 4.35Å; W182-V194 HydrophobicContact CG-CG2 3.71Å; W182-V194 HydrophobicContact CZ2-CG1 4.06Å; W182-M222 HydrophobicContact CH2-SD 4.35Å; W182-P225 HydrophobicContact CH2-CG 4.13Å; W182-P225 HydrophobicContact CZ3-CB 3.99Å; W182-P225 HydrophobicContact CZ3-CG 3.92Å; W182-S233 CarbonylContact O-C 3.57Å; W182-S233 WeakPolarHBondContact O-CA 3.37Å; W182-S233 WeakPolarHBondContact O-CB 3.5Å; W182-A234 HydrophobicContact CB-CB 4.48Å; W182-A234 HydrophobicContact CE3-CB 4.17Å; W182-A234 PolarHBondContact N-O 2.92Å; W182-A234 PolarHBondContact O-N 2.83Å; W182-Q236 HydrophobicContact CH2-CB 4.42Å; W182-Q236 HydrophobicContact CZ3-CB 4.05Å
183	E	95.6	Very high	92	Very high	85 Å²	85	42.5 Å²	42.5	40%	0.397	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	134.5	-177	-66.8	171.8	165.1	0	0	109	C155 K156 V181	C155-E183 CarbonylContact C-O 3.53Å; C155-E183 VanDerWaalsContact CA-O 3.3Å; C155-E183 WeakPolarHBondContact CA-O 3.33Å; K156-E183 PolarHBondContact N-O 2.94Å; K156-E183 PolarHBondContact O-N 2.72Å; V181-E183 HydrophobicContact CG1-CG 3.98Å
184	C	94	Very high	92.2	Very high	10 Å²	10	36 Å²	36	7%	0.068	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138	169.1	-55.1	0	0	0	0	108.1	P153 Q154 C155 A186 M192 S232	P153-C184 HydrophobicContact CB-CB 4.41Å; Q154-C184 WeakPolarHBondContact O-CA 3.16Å; C155-C184 VanDerWaalsContact CA-SG 3.59Å; C155-C184 HydrophobicContact CB-CB 4.11Å; C155-C184 WeakPolarHBondContact CB-SG 3.33Å; C155-C184 WeakPolarHBondContact SG-CB 3.23Å; C155-C184 CovalentContact SG-SG 2.04Å; C155-C184 PolarHBondContact SG-SG 2.03Å; C184-A186 HydrophobicContact CB-CB 4.36Å; C184-A186 PolarHBondContact O-N 2.87Å; C184-M192 HydrophobicContact CB-CE 3.54Å; C184-M192 VanDerWaalsContact N-CE 3.28Å; C184-M192 WeakPolarHBondContact SG-CE 3.36Å; C184-S232 PolarHBondContact N-O 3.01Å
185	D	90.3	Very high	92.3	Very high	95 Å²	95	32.9 Å²	32.9	51%	0.508	19%	0.189	S	C	.	.			trans	-76.9	45.6	173.6	66	-0.4	0	0	0	111.8	P153 Q154 G187	P153-D185 VanDerWaalsContact C-OD1 3.28Å; P153-D185 WeakPolarHBondContact CA-OD1 3.42Å; P153-D185 VanDerWaalsContact CB-OD1 3.25Å; P153-D185 WeakPolarHBondContact CB-OD1 3.4Å; Q154-D185 WeakPolarHBondContact CA-OD1 3.12Å; Q154-D185 PolarHBondContact N-OD1 2.98Å; Q154-D185 PolarHBondContact O-N 2.9Å; Q154-D185 VanDerWaalsContact O-N 3.16Å; D185-G187 PolarHBondContact O-N 2.84Å; D185-G187 VanDerWaalsContact O-N 3.14Å
186	A	73.7	Confident	92.5	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.033	17%	0.174	C	C	.	.			trans	-65.9	-9.4	-178.8	0	0	0	0	0	115.3	P153 C184 D188 S189 Y190	P153-A186 HydrophobicContact CB-CB 4.16Å; P153-A186 HydrophobicContact CG-CB 4.29Å; C184-A186 HydrophobicContact CB-CB 4.36Å; C184-A186 PolarHBondContact O-N 2.87Å; A186-D188 PolarHBondContact O-N 3Å; A186-S189 PolarHBondContact O-N 3.01Å; A186-S189 PolarHBondContact O-OG 2.99Å; A186-S189 VanDerWaalsContact O-OG 3.12Å; A186-Y190 WeakPolarHBondContact CB-O 3.31Å; A186-Y190 PolarHBondContact O-N 2.99Å
187	G	79.7	Confident	92.5	Very high	47 Å²	47	30.5 Å²	30.5	49%	0.485	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	-139.7	-165.4	0	0	0	0	0	111	D185 K260	D185-G187 PolarHBondContact O-N 2.84Å; D185-G187 VanDerWaalsContact O-N 3.14Å; G187-K260 PolarHBondContact O-NZ 2.72Å
188	D	81.2	Confident	92.5	Very high	146 Å²	146	26.3 Å²	26.3	78%	0.781	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	2.3	178.9	-64.5	-33.8	0	0	0	113.7	A186 K260	A186-D188 PolarHBondContact O-N 3Å; D188-K260 WeakPolarHBondContact O-CD 3.14Å
189	S	86.7	Confident	92.3	Very high	56 Å²	56	26.2 Å²	26.2	39%	0.392	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-31.7	-174.8	56.9	0	0	0	0	113.8	A186 K260	A186-S189 PolarHBondContact O-N 3.01Å; A186-S189 PolarHBondContact O-OG 2.99Å; A186-S189 VanDerWaalsContact O-OG 3.12Å; S189-K260 PolarHBondContact O-N 2.97Å
190	Y	89.7	Confident	92.1	Very high	13 Å²	13	26.6 Å²	26.6	5%	0.051	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.5	-178.6	-55.9	-89.2	0	0	0	113.1	T150 P153 A186 C258 V259 K260	T150-Y190 HydrophobicContact CG2-CE2 4.34Å; T150-Y190 WeakPolarHBondContact CG2-OH 3.47Å; P153-Y190 HydrophobicContact CG-CD2 4.26Å; A186-Y190 WeakPolarHBondContact CB-O 3.31Å; A186-Y190 PolarHBondContact O-N 2.99Å; Y190-C258 CarbonylContact C-O 3.29Å; Y190-C258 WeakPolarHBondContact CA-O 3.39Å; Y190-V259 HydrophobicContact CD1-CG2 4.03Å; Y190-V259 HydrophobicContact CE1-CG2 3.71Å; Y190-K260 VanDerWaalsContact C-CE 3.46Å; Y190-K260 WeakPolarHBondContact O-CE 3.5Å; Y190-K260 PolarHBondContact O-NZ 3.12Å
191	G	93.1	Very high	91.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	168.8	161.3	0	0	0	0	0	110.4	L231 L257 C258	G191-L231 CarbonylContact C-O 3.59Å; G191-L231 VanDerWaalsContact CA-O 3.3Å; G191-L231 WeakPolarHBondContact CA-O 3.38Å; G191-L257 WeakPolarHBondContact O-CA 3.37Å; G191-C258 VanDerWaalsContact C-SG 3.59Å; G191-C258 PolarHBondContact N-O 3.42Å; G191-C258 PolarHBondContact O-N 2.58Å
192	M	95	Very high	90.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.1	179.7	84.9	175.7	69.9	0	0	113	W182 C184 V194 Y227 L231 S232 I255 K256 L257 T269	W182-M192 HydrophobicContact CB-SD 4.34Å; C184-M192 HydrophobicContact CB-CE 3.54Å; C184-M192 VanDerWaalsContact N-CE 3.28Å; C184-M192 WeakPolarHBondContact SG-CE 3.36Å; M192-V194 HydrophobicContact SD-CG2 4.37Å; M192-Y227 HydrophobicContact CG-CD1 4.49Å; M192-Y227 HydrophobicContact CG-CE1 4.1Å; M192-Y227 WeakPolarHBondContact O-CE1 3.43Å; M192-L231 PolarHBondContact N-O 3Å; M192-S232 WeakPolarHBondContact CE-O 3.4Å; M192-I255 HydrophobicContact CB-CG2 3.79Å; M192-I255 HydrophobicContact CG-CG2 4.44Å; M192-I255 HydrophobicContact SD-CG2 4.34Å; M192-K256 CarbonylContact C-O 3.33Å; M192-K256 WeakPolarHBondContact CA-O 3.24Å; M192-L257 HydrophobicContact CB-CD2 3.97Å; M192-T269 WeakPolarHBondContact O-CB 3.26Å; M192-T269 WeakPolarHBondContact O-CG2 3.41Å; M192-T269 PolarHBondContact O-OG1 3.09Å
193	L	95.7	Very high	89.9	Confident	10 Å²	10	33.3 Å²	33.3	5%	0.052	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	119.8	165.9	176.2	68.3	0	0	0	108.5	I255 K256 I268 P271	L193-I255 WeakPolarHBondContact O-CA 3.41Å; L193-K256 HydrophobicContact CB-CB 4.43Å; L193-K256 PolarHBondContact N-O 2.88Å; L193-K256 PolarHBondContact O-N 2.96Å; L193-I268 HydrophobicContact CB-CG2 4.37Å; L193-I268 HydrophobicContact CD2-CG2 4.21Å; L193-P271 HydrophobicContact CD1-CB 4.01Å; L193-P271 HydrophobicContact CD1-CG 4.06Å
194	V	97.5	Very high	89	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.4	169.6	-176.3	0	0	0	0	108.2	W182 M192 G214 Y227 A234 C253 I255	W182-V194 HydrophobicContact CB-CG2 3.86Å; W182-V194 HydrophobicContact CD2-CG1 4.06Å; W182-V194 HydrophobicContact CD2-CG2 3.91Å; W182-V194 HydrophobicContact CE3-CG2 4.31Å; W182-V194 HydrophobicContact CG-CG1 4.35Å; W182-V194 HydrophobicContact CG-CG2 3.71Å; W182-V194 HydrophobicContact CZ2-CG1 4.06Å; M192-V194 HydrophobicContact SD-CG2 4.37Å; V194-G214 VanDerWaalsContact O-CA 3.28Å; V194-G214 WeakPolarHBondContact O-CA 3.49Å; V194-Y227 PolarHBondContact N-OH 3.31Å; V194-A234 HydrophobicContact CG2-CB 4.1Å; V194-C253 HydrophobicContact CG1-CB 4.11Å; V194-I255 HydrophobicContact CG2-CG1 4.42Å
195	H	96.2	Very high	88.6	Confident	5 Å²	5	32 Å²	32	2%	0.023	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	173.2	-179.9	70.5	86.8	0	0	0	111.8	C197 Q254	H195-C197 VanDerWaalsContact C-N 3.29Å; H195-C197 PolarHBondContact O-N 2.94Å; H195-Q254 PolarHBondContact N-O 2.86Å; H195-Q254 PolarHBondContact O-N 2.94Å
196	S	95.4	Very high	88.5	Confident	20 Å²	20	29.3 Å²	29.3	14%	0.14	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.9	47	176.9	-53.1	0	0	0	0	112.5	I210 D211	S196-I210 CarbonylContact C-O 3.5Å; S196-I210 WeakPolarHBondContact CA-O 3.44Å; S196-I210 PolarHBondContact N-O 3.25Å; S196-D211 PolarHBondContact N-O 2.78Å
197	C	96.5	Very high	89.4	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.007	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	132.6	-179.8	-68.7	0	0	0	0	111	H195 E208 I209 I210 H252 C253	H195-C197 VanDerWaalsContact C-N 3.29Å; H195-C197 PolarHBondContact O-N 2.94Å; C197-E208 CarbonylContact O-C 3.56Å; C197-E208 WeakPolarHBondContact O-CA 3.44Å; C197-I209 HydrophobicContact CB-CD1 4.45Å; C197-I209 HydrophobicContact CB-CG1 3.91Å; C197-I209 WeakPolarHBondContact O-CG1 3.46Å; C197-I209 PolarHBondContact O-N 2.82Å; C197-I210 HydrophobicContact CB-CB 3.73Å; C197-I210 HydrophobicContact CB-CD1 4.06Å; C197-I210 HydrophobicContact CB-CG1 3.79Å; C197-I210 PolarHBondContact N-O 2.9Å; C197-I210 PolarHBondContact O-N 3.02Å; C197-H252 CarbonylContact C-O 3.57Å; C197-H252 WeakPolarHBondContact CA-O 3.29Å; C197-C253 HydrophobicContact CB-CB 4.13Å; C197-C253 WeakPolarHBondContact CB-SG 3.15Å; C197-C253 WeakPolarHBondContact SG-CB 3.01Å; C197-C253 CovalentContact SG-SG 2.04Å; C197-C253 PolarHBondContact SG-SG 2.91Å
198	S	94.2	Very high	90.1	Very high	6 Å²	6	31.9 Å²	31.9	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	149.8	176.8	56.2	0	0	0	0	112.4	Q206 I207 H252	S198-Q206 PolarHBondContact OG-OE1 3.21Å; S198-I207 CarbonylContact C-O 3.53Å; S198-I207 WeakPolarHBondContact CA-O 3.46Å; S198-H252 PolarHBondContact N-O 3.28Å; S198-H252 PolarHBondContact O-N 3.46Å
199	V	94.4	Very high	90.7	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.4	171.8	-165.4	0	0	0	0	108	Q206 I207 I209 F241 F243 V249 Q250 F251	V199-Q206 CarbonylContact O-C 3.58Å; V199-Q206 WeakPolarHBondContact O-CA 3.24Å; V199-I207 PolarHBondContact N-O 2.99Å; V199-I207 PolarHBondContact O-N 3.38Å; V199-I209 HydrophobicContact CG2-CD1 3.63Å; V199-I209 HydrophobicContact CG2-CG1 4.18Å; V199-I209 HydrophobicContact CG2-CG2 3.74Å; V199-F241 HydrophobicContact CB-CE2 4.43Å; V199-F241 HydrophobicContact CG1-CE2 3.98Å; V199-F241 HydrophobicContact CG1-CZ 4.43Å; V199-F241 HydrophobicContact CG2-CE2 3.91Å; V199-F241 HydrophobicContact CG2-CZ 3.78Å; V199-F243 HydrophobicContact CB-CE2 4.31Å; V199-F243 HydrophobicContact CB-CZ 4.39Å; V199-F243 HydrophobicContact CG1-CE2 3.77Å; V199-F243 HydrophobicContact CG1-CZ 4.33Å; V199-F243 WeakPolarHBondContact O-CZ 3.36Å; V199-V249 HydrophobicContact CG1-CG1 3.23Å; V199-Q250 CarbonylContact C-O 3.6Å; V199-Q250 WeakPolarHBondContact CA-O 2.89Å; V199-F251 HydrophobicContact CG1-CD1 4.4Å; V199-F251 HydrophobicContact CG1-CE1 4.2Å; V199-F251 HydrophobicContact CG2-CD1 3.94Å; V199-F251 HydrophobicContact CG2-CE1 3.85Å
200	R	92.1	Very high	91.1	Very high	51 Å²	51	22.5 Å²	22.5	19%	0.192	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	139.6	-175.7	-61.2	-179.5	177.1	159.3	4.2	110.8	N205 Q206 Q250 H252	R200-N205 WeakPolarHBondContact CA-O 3.32Å; R200-Q206 HydrophobicContact CG-CB 3.79Å; R200-Q250 HydrophobicContact CB-CB 4.32Å; R200-Q250 PolarHBondContact N-O 3.13Å; R200-Q250 PolarHBondContact O-N 3.48Å; R200-H252 VanDerWaalsContact CZ-CD2 3.49Å; R200-H252 PolarHBondContact NH2-CD2 3.21Å; R200-H252 PolarHBondContact NH2-NE2 2.93Å
201	D	88.2	Confident	91.3	Very high	14 Å²	14	22.6 Å²	22.6	8%	0.075	12%	0.122	C	C	.	.			trans	-91.6	-3.5	177.9	77.5	-19.1	0	0	0	113.8	K203 G204 N205 F243 V246	D201-K203 VanDerWaalsContact C-N 3.25Å; D201-K203 PolarHBondContact O-N 3.32Å; D201-K203 WeakPolarHBondContact OD1-CA 3.41Å; D201-K203 PolarHBondContact OD1-N 3.1Å; D201-G204 PolarHBondContact OD1-N 2.84Å; D201-N205 PolarHBondContact N-O 3.27Å; D201-N205 PolarHBondContact OD1-N 3.41Å; D201-N205 WeakPolarHBondContact OD2-CB 3.42Å; D201-N205 PolarHBondContact OD2-ND2 2.8Å; D201-F243 HydrophobicContact CB-CB 4.45Å; D201-F243 HydrophobicContact CB-CD1 4.48Å; D201-F243 HydrophobicContact CB-CD2 3.63Å; D201-F243 HydrophobicContact CB-CE2 3.9Å; D201-F243 HydrophobicContact CB-CG 3.96Å; D201-F243 HydrophobicContact CB-CZ 4.44Å; D201-V246 HydrophobicContact CB-CG1 4.32Å; D201-V246 HydrophobicContact CB-CG2 4.33Å
202	G	79.4	Confident	91.3	Very high	32 Å²	32	29.6 Å²	29.6	33%	0.33	16%	0.155	S	C	.	.	S	Bend	trans	71.5	14.1	-176.1	0	0	0	0	0	114.5	H63	H63-G202 PolarHBondContact CE1-O 3.24Å; H63-G202 PolarHBondContact ND1-O 3.39Å; H63-G202 PolarHBondContact NE2-O 3.07Å
203	K	78.7	Confident	91.2	Very high	103 Å²	103	36.8 Å²	36.8	45%	0.448	19%	0.186	S	C	.	.	S	Bend	trans	-120.1	17.4	171.7	-58.9	-178.9	176	177.1	0	112.3	D201	D201-K203 VanDerWaalsContact C-N 3.25Å; D201-K203 PolarHBondContact O-N 3.32Å; D201-K203 WeakPolarHBondContact OD1-CA 3.41Å; D201-K203 PolarHBondContact OD1-N 3.1Å
204	G	77.8	Confident	91.2	Very high	19 Å²	19	36.3 Å²	36.3	20%	0.196	18%	0.184	C	C	.	.	S	Bend	trans	85.7	-0.7	-178.1	0	0	0	0	0	115.2	D201 H284 V285	D201-G204 PolarHBondContact OD1-N 2.84Å; G204-H284 PolarHBondContact O-ND1 3.14Å; G204-V285 PolarHBondContact O-N 2.02Å
205	N	84.6	Confident	91.1	Very high	49 Å²	49	36.8 Å²	36.8	26%	0.262	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	132.9	171	-53.3	-55.2	0	0	0	109.4	R200 D201 L282	R200-N205 WeakPolarHBondContact CA-O 3.32Å; D201-N205 PolarHBondContact N-O 3.27Å; D201-N205 PolarHBondContact OD1-N 3.41Å; D201-N205 WeakPolarHBondContact OD2-CB 3.42Å; D201-N205 PolarHBondContact OD2-ND2 2.8Å; N205-L282 HydrophobicContact CB-CD2 4.44Å
206	Q	89.7	Confident	91	Very high	37 Å²	37	37.1 Å²	37.1	17%	0.173	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.7	170.9	85.2	-177.5	-0.4	0	0	112.1	S198 V199 R200 V283 V285	S198-Q206 PolarHBondContact OG-OE1 3.21Å; V199-Q206 CarbonylContact O-C 3.58Å; V199-Q206 WeakPolarHBondContact O-CA 3.24Å; R200-Q206 HydrophobicContact CG-CB 3.79Å; Q206-V283 PolarHBondContact N-O 2.91Å; Q206-V283 PolarHBondContact O-N 2.83Å; Q206-V285 HydrophobicContact CB-CG2 3.83Å; Q206-V285 HydrophobicContact CG-CG2 3.24Å; Q206-V285 VanDerWaalsContact OE1-CG2 3.29Å
207	I	92.6	Very high	90.8	Very high	33 Å²	33	37.1 Å²	37.1	17%	0.169	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.7	171.6	-60.3	175.1	0	0	0	106.8	S198 V199 I209 F243 L280 L282	S198-I207 CarbonylContact C-O 3.53Å; S198-I207 WeakPolarHBondContact CA-O 3.46Å; V199-I207 PolarHBondContact N-O 2.99Å; V199-I207 PolarHBondContact O-N 3.38Å; I207-I209 HydrophobicContact CG2-CG2 4.49Å; I207-F243 HydrophobicContact CD1-CE1 3.57Å; I207-F243 HydrophobicContact CD1-CZ 4.06Å; I207-F243 HydrophobicContact CG1-CE1 3.92Å; I207-F243 HydrophobicContact CG1-CZ 4.13Å; I207-L280 HydrophobicContact CG2-CB 3.87Å; I207-L280 HydrophobicContact CG2-CD1 4.29Å; I207-L280 HydrophobicContact CG2-CD2 3.99Å; I207-L280 HydrophobicContact CG2-CG 4.27Å; I207-L282 HydrophobicContact CD1-CD1 4.02Å; I207-L282 HydrophobicContact CG1-CB 4.43Å; I207-L282 HydrophobicContact CG1-CD1 4.07Å; I207-L282 HydrophobicContact CG1-CG 4.17Å
208	E	93	Very high	90.5	Very high	72 Å²	72	39.3 Å²	39.3	34%	0.336	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.2	171.6	-169.1	177.1	-160.7	0	0	109.5	C197 I210 D211 L217 L280	C197-E208 CarbonylContact O-C 3.56Å; C197-E208 WeakPolarHBondContact O-CA 3.44Å; E208-I210 WeakPolarHBondContact CG-O 3.35Å; E208-D211 WeakPolarHBondContact OE1-CA 3.02Å; E208-L217 HydrophobicContact CB-CD1 3.96Å; E208-L217 HydrophobicContact CG-CD1 3.74Å; E208-L217 WeakPolarHBondContact O-CD1 3.09Å; E208-L280 WeakPolarHBondContact O-CD2 3.05Å
209	I	94.8	Very high	90.3	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-22.6	-178.7	57.4	172.8	0	0	0	112.7	C197 V199 I207 L217 I221 M222 F251 L280	C197-I209 HydrophobicContact CB-CD1 4.45Å; C197-I209 HydrophobicContact CB-CG1 3.91Å; C197-I209 WeakPolarHBondContact O-CG1 3.46Å; C197-I209 PolarHBondContact O-N 2.82Å; V199-I209 HydrophobicContact CG2-CD1 3.63Å; V199-I209 HydrophobicContact CG2-CG1 4.18Å; V199-I209 HydrophobicContact CG2-CG2 3.74Å; I207-I209 HydrophobicContact CG2-CG2 4.49Å; I209-L217 PolarHBondContact O-N 3.44Å; I209-I221 HydrophobicContact CG2-CG2 4.34Å; I209-M222 HydrophobicContact CB-CE 4.31Å; I209-M222 HydrophobicContact CD1-CE 3.27Å; I209-M222 HydrophobicContact CD1-SD 3.89Å; I209-M222 HydrophobicContact CG1-CE 3.66Å; I209-F251 HydrophobicContact CD1-CD1 4.3Å; I209-F251 HydrophobicContact CD1-CE1 4.47Å; I209-L280 HydrophobicContact CG2-CD2 4.24Å
210	I	95	Very high	90	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.6	168.3	-55.4	-173.5	0	0	0	107.6	S196 C197 E208 G214 C215 M222 P225	S196-I210 CarbonylContact C-O 3.5Å; S196-I210 WeakPolarHBondContact CA-O 3.44Å; S196-I210 PolarHBondContact N-O 3.25Å; C197-I210 HydrophobicContact CB-CB 3.73Å; C197-I210 HydrophobicContact CB-CD1 4.06Å; C197-I210 HydrophobicContact CB-CG1 3.79Å; C197-I210 PolarHBondContact N-O 2.9Å; C197-I210 PolarHBondContact O-N 3.02Å; E208-I210 WeakPolarHBondContact CG-O 3.35Å; I210-G214 VanDerWaalsContact CG2-CA 3.46Å; I210-C215 WeakPolarHBondContact CA-O 3.39Å; I210-C215 WeakPolarHBondContact CG2-O 3.43Å; I210-M222 HydrophobicContact CD1-CE 3.4Å; I210-M222 HydrophobicContact CG1-CE 3.26Å; I210-P225 HydrophobicContact CD1-CG 3.52Å
211	D	93.4	Very high	89.9	Confident	15 Å²	15	51.6 Å²	51.6	8%	0.08	26%	0.26	C	S	.	.			trans	-72.8	175.5	179.1	73.6	8.7	0	0	0	113.8	S196 E208 K213 G214 C215 L217 R278	S196-D211 PolarHBondContact N-O 2.78Å; E208-D211 WeakPolarHBondContact OE1-CA 3.02Å; D211-K213 PolarHBondContact O-N 2.91Å; D211-K213 VanDerWaalsContact O-N 3.11Å; D211-K213 WeakPolarHBondContact OD1-CA 3.14Å; D211-K213 WeakPolarHBondContact OD1-CB 3.3Å; D211-K213 PolarHBondContact OD1-N 2.66Å; D211-G214 PolarHBondContact O-N 2.88Å; D211-G214 PolarHBondContact OD1-N 3.29Å; D211-G214 VanDerWaalsContact OD1-N 3.07Å; D211-C215 PolarHBondContact N-O 3.45Å; D211-C215 PolarHBondContact OD1-N 3.04Å; D211-L217 HydrophobicContact CB-CD2 3.96Å; D211-L217 HydrophobicContact CB-CG 4.32Å; D211-R278 IonicContact OD2-CZ 3.89Å; D211-R278 IonicContact OD2-NH1 2.72Å; D211-R278 PolarHBondContact OD2-NH1 2.92Å
212	E	93.8	Very high	90.1	Very high	148 Å²	148	51.1 Å²	51.1	69%	0.692	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.7	175.8	-62	178.7	173.8	0	0	114.3
213	K	93	Very high	90.7	Very high	150 Å²	150	52.7 Å²	52.7	65%	0.652	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.5	178.3	-62.3	179.7	179.3	179.3	0	112.5	D211 P271	D211-K213 PolarHBondContact O-N 2.91Å; D211-K213 VanDerWaalsContact O-N 3.11Å; D211-K213 WeakPolarHBondContact OD1-CA 3.14Å; D211-K213 WeakPolarHBondContact OD1-CB 3.3Å; D211-K213 PolarHBondContact OD1-N 2.66Å; K213-P271 VanDerWaalsContact O-CB 3.25Å; K213-P271 WeakPolarHBondContact O-CB 3.44Å
214	G	94.9	Very high	91.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	87.1	15	-176.1	0	0	0	0	0	114.1	V194 I210 D211 P271	V194-G214 VanDerWaalsContact O-CA 3.28Å; V194-G214 WeakPolarHBondContact O-CA 3.49Å; I210-G214 VanDerWaalsContact CG2-CA 3.46Å; D211-G214 PolarHBondContact O-N 2.88Å; D211-G214 PolarHBondContact OD1-N 3.29Å; D211-G214 VanDerWaalsContact OD1-N 3.07Å; G214-P271 WeakPolarHBondContact O-CG 3.38Å
215	C	95.1	Very high	92.4	Very high	11 Å²	11	48.6 Å²	48.6	7%	0.074	24%	0.238	C	C	.	.			trans	-98.7	138.8	179.8	-64.9	0	0	0	0	112.3	I210 D211 C273	I210-C215 WeakPolarHBondContact CA-O 3.39Å; I210-C215 WeakPolarHBondContact CG2-O 3.43Å; D211-C215 PolarHBondContact N-O 3.45Å; D211-C215 PolarHBondContact OD1-N 3.04Å; C215-C273 WeakPolarHBondContact CA-SG 3.19Å; C215-C273 HydrophobicContact CB-CB 3.79Å; C215-C273 WeakPolarHBondContact CB-SG 3.49Å; C215-C273 WeakPolarHBondContact SG-CA 2.81Å; C215-C273 WeakPolarHBondContact SG-CB 3.22Å; C215-C273 CovalentContact SG-SG 2.04Å; C215-C273 PolarHBondContact SG-SG 2.74Å
216	A	93.9	Very high	93	Very high	11 Å²	11	52.7 Å²	52.7	9%	0.091	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-60	138.2	174.2	0	0	0	0	0	111.6	M222 T224	A216-M222 VanDerWaalsContact CB-O 3.22Å; A216-M222 WeakPolarHBondContact CB-O 3.05Å; A216-T224 WeakPolarHBondContact CB-OG1 3.25Å; A216-T224 PolarHBondContact N-OG1 3.4Å; A216-T224 VanDerWaalsContact N-OG1 3.11Å
217	L	92.7	Very high	93.3	Very high	20 Å²	20	52.5 Å²	52.5	11%	0.105	25%	0.252	C	S	.	.	S	Bend	trans	-90.8	-25.8	173.7	-68	179.6	0	0	0	112.2	E208 I209 D211 R278 L280	E208-L217 HydrophobicContact CB-CD1 3.96Å; E208-L217 HydrophobicContact CG-CD1 3.74Å; E208-L217 WeakPolarHBondContact O-CD1 3.09Å; I209-L217 PolarHBondContact O-N 3.44Å; D211-L217 HydrophobicContact CB-CD2 3.96Å; D211-L217 HydrophobicContact CB-CG 4.32Å; L217-R278 HydrophobicContact CD2-CB 4.14Å; L217-R278 HydrophobicContact CD2-CG 4.48Å; L217-R278 CarbonylContact O-C 3.45Å; L217-R278 VanDerWaalsContact O-C 3.29Å; L217-R278 WeakPolarHBondContact O-CB 3.47Å; L217-L280 HydrophobicContact CB-CD2 3.88Å
218	D	90.2	Very high	93.4	Very high	48 Å²	48	53.5 Å²	53.5	26%	0.257	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-148.5	100.6	178	-174.5	-14.9	0	0	0	111.1	F220 I221 M222 L280	D218-F220 PolarHBondContact O-N 3.36Å; D218-F220 VanDerWaalsContact O-N 3.13Å; D218-F220 VanDerWaalsContact OD1-CB 3.24Å; D218-F220 WeakPolarHBondContact OD1-CB 3.37Å; D218-F220 PolarHBondContact OD1-N 2.93Å; D218-I221 HydrophobicContact CB-CB 4.49Å; D218-I221 HydrophobicContact CB-CG1 4.44Å; D218-I221 PolarHBondContact O-N 2.79Å; D218-M222 PolarHBondContact O-N 3.02Å; D218-M222 VanDerWaalsContact O-O 3.13Å; D218-L280 HydrophobicContact CB-CD1 3.62Å; D218-L280 HydrophobicContact CB-CD2 3.8Å; D218-L280 HydrophobicContact CB-CG 3.59Å; D218-L280 VanDerWaalsContact OD2-CD1 3.27Å; D218-L280 WeakPolarHBondContact OD2-CD1 3.31Å
219	D	88.7	Confident	93.3	Very high	86 Å²	86	58.4 Å²	58.4	46%	0.46	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21	-178.8	-51.8	-22.7	0	0	0	113.3
220	F	88.4	Confident	93.1	Very high	193 Å²	193	60.3 Å²	60.3	85%	0.846	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-34.4	175.9	-179.1	-97	0	0	0	111.7	D218	D218-F220 PolarHBondContact O-N 3.36Å; D218-F220 VanDerWaalsContact O-N 3.13Å; D218-F220 VanDerWaalsContact OD1-CB 3.24Å; D218-F220 WeakPolarHBondContact OD1-CB 3.37Å; D218-F220 PolarHBondContact OD1-N 2.93Å
221	I	90	Very high	93	Very high	38 Å²	38	62 Å²	62	20%	0.195	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-49.7	177.6	-61	-157.4	0	0	0	110.4	I209 D218 F241 L280	I209-I221 HydrophobicContact CG2-CG2 4.34Å; D218-I221 HydrophobicContact CB-CB 4.49Å; D218-I221 HydrophobicContact CB-CG1 4.44Å; D218-I221 PolarHBondContact O-N 2.79Å; I221-F241 HydrophobicContact CG2-CD1 3.84Å; I221-F241 HydrophobicContact CG2-CD2 4.44Å; I221-F241 HydrophobicContact CG2-CE1 3.26Å; I221-F241 HydrophobicContact CG2-CE2 3.91Å; I221-F241 HydrophobicContact CG2-CG 4.41Å; I221-F241 HydrophobicContact CG2-CZ 3.28Å; I221-L280 HydrophobicContact CD1-CD1 3.24Å; I221-L280 HydrophobicContact CG1-CD1 4Å
222	M	92.1	Very high	93	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.015	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-160.2	120.6	179.3	-174.4	171.5	77	0	0	110.1	W182 I209 I210 A216 D218 Q236 T238	W182-M222 HydrophobicContact CH2-SD 4.35Å; I209-M222 HydrophobicContact CB-CE 4.31Å; I209-M222 HydrophobicContact CD1-CE 3.27Å; I209-M222 HydrophobicContact CD1-SD 3.89Å; I209-M222 HydrophobicContact CG1-CE 3.66Å; I210-M222 HydrophobicContact CD1-CE 3.4Å; I210-M222 HydrophobicContact CG1-CE 3.26Å; A216-M222 VanDerWaalsContact CB-O 3.22Å; A216-M222 WeakPolarHBondContact CB-O 3.05Å; D218-M222 PolarHBondContact O-N 3.02Å; D218-M222 VanDerWaalsContact O-O 3.13Å; M222-Q236 HydrophobicContact CG-CG 3.64Å; M222-Q236 HydrophobicContact SD-CG 4.46Å; M222-T238 HydrophobicContact CB-CG2 3.74Å; M222-T238 HydrophobicContact CG-CG2 3.45Å; M222-T238 VanDerWaalsContact CG-CG2 3.45Å; M222-T238 HydrophobicContact SD-CG2 4.05Å
223	D	93.2	Very high	93.1	Very high	66 Å²	66	56.8 Å²	56.8	35%	0.353	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-74.6	170	174.9	-167.1	5.1	0	0	0	111.4	Q236	D223-Q236 VanDerWaalsContact O-CG 3.3Å; D223-Q236 WeakPolarHBondContact O-CG 3.23Å
224	T	95	Very high	93.3	Very high	29 Å²	29	49.7 Å²	49.7	18%	0.178	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-65.5	128.4	-177.8	-62.2	0	0	0	0	110.7	A216 Q236 P271	A216-T224 WeakPolarHBondContact CB-OG1 3.25Å; A216-T224 PolarHBondContact N-OG1 3.4Å; A216-T224 VanDerWaalsContact N-OG1 3.11Å; T224-Q236 PolarHBondContact O-OE1 2.93Å; T224-Q236 VanDerWaalsContact O-OE1 3.06Å; T224-P271 HydrophobicContact CG2-CG 3.98Å
225	P	96.9	Very high	93.4	Very high	6 Å²	6	53 Å²	53	4%	0.039	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-56.2	139.5	-177.4	-26	33.7	0	0	0	113.9	W182 I210 Y227 A234	W182-P225 HydrophobicContact CH2-CG 4.13Å; W182-P225 HydrophobicContact CZ3-CB 3.99Å; W182-P225 HydrophobicContact CZ3-CG 3.92Å; I210-P225 HydrophobicContact CD1-CG 3.52Å; P225-Y227 HydrophobicContact CB-CE2 4.28Å; P225-Y227 WeakPolarHBondContact O-CD2 3.49Å; P225-Y227 VanDerWaalsContact O-CE2 3.3Å; P225-Y227 WeakPolarHBondContact O-CE2 3.32Å; P225-A234 HydrophobicContact CB-CB 4.18Å
226	K	96.5	Very high	93.5	Very high	136 Å²	136	53 Å²	53	59%	0.591	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.4	177.4	-65.3	174.7	-174.4	167.5	0	109.7	A234 E235	K226-A234 CarbonylContact O-C 3.5Å; K226-A234 VanDerWaalsContact O-CA 3.26Å; K226-A234 WeakPolarHBondContact O-CA 3.06Å; K226-E235 PolarHBondContact N-O 3.4Å; K226-E235 PolarHBondContact O-N 3.05Å
227	Y	96.1	Very high	93.6	Very high	33 Å²	33	56 Å²	56	13%	0.129	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	147.5	-177.8	-66.1	-100.4	0	0	0	110.6	M192 V194 P225 S233 A234 P270 P271	M192-Y227 HydrophobicContact CG-CD1 4.49Å; M192-Y227 HydrophobicContact CG-CE1 4.1Å; M192-Y227 WeakPolarHBondContact O-CE1 3.43Å; V194-Y227 PolarHBondContact N-OH 3.31Å; P225-Y227 HydrophobicContact CB-CE2 4.28Å; P225-Y227 WeakPolarHBondContact O-CD2 3.49Å; P225-Y227 VanDerWaalsContact O-CE2 3.3Å; P225-Y227 WeakPolarHBondContact O-CE2 3.32Å; Y227-S233 WeakPolarHBondContact CA-O 3.5Å; Y227-A234 HydrophobicContact CD1-CB 3.74Å; Y227-A234 HydrophobicContact CE1-CB 3.66Å; Y227-A234 HydrophobicContact CE2-CB 4.42Å; Y227-A234 HydrophobicContact CG-CB 4.17Å; Y227-P270 HydrophobicContact CD2-CB 3.8Å; Y227-P270 HydrophobicContact CD2-CG 4.23Å; Y227-P270 HydrophobicContact CE2-CB 4.39Å; Y227-P270 HydrophobicContact CG-CB 4.36Å; Y227-P270 HydrophobicContact CG-CG 4.33Å; Y227-P271 HydrophobicContact CE2-CG 4.36Å
228	N	94	Very high	93.7	Very high	53 Å²	53	55.5 Å²	55.5	28%	0.283	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-75.8	167.4	171.4	73	-15.1	0	0	0	111.8	S230 L231 S232 S233	N228-S230 PolarHBondContact ND2-OG 3.05Å; N228-S230 PolarHBondContact O-N 3.3Å; N228-S230 PolarHBondContact OD1-OG 3.03Å; N228-L231 PolarHBondContact O-N 2.83Å; N228-L231 WeakPolarHBondContact OD1-CA 3.23Å; N228-L231 PolarHBondContact OD1-N 2.76Å; N228-S232 PolarHBondContact OD1-N 3.49Å; N228-S233 PolarHBondContact N-O 2.78Å; N228-S233 PolarHBondContact ND2-OG 2.94Å; N228-S233 PolarHBondContact OD1-N 3.33Å; N228-S233 PolarHBondContact OD1-O 2.86Å
229	D	91.6	Very high	94	Very high	176 Å²	176	57.7 Å²	57.7	94%	0.941	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-31.5	-178.8	-61.9	-34.6	0	0	0	113	L231	D229-L231 VanDerWaalsContact C-N 3.3Å
230	S	91.3	Very high	94.3	Very high	44 Å²	44	54 Å²	54	31%	0.308	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	1.1	178.3	64.1	0	0	0	0	113.6	N228 S232 K260	N228-S230 PolarHBondContact ND2-OG 3.05Å; N228-S230 PolarHBondContact O-N 3.3Å; N228-S230 PolarHBondContact OD1-OG 3.03Å; S230-S232 PolarHBondContact O-N 2.64Å; S230-S232 PolarHBondContact OG-OG 3.39Å; S230-K260 WeakPolarHBondContact O-CE 3.4Å; S230-K260 PolarHBondContact O-NZ 2.74Å
231	L	93.3	Very high	94.5	Very high	35 Å²	35	47.2 Å²	47.2	18%	0.183	25%	0.245	C	C	.	.	S	Bend	trans	53.6	20.3	-177.9	-52	170.6	0	0	0	113.9	G191 M192 N228 D229 C265 T269 P270	G191-L231 CarbonylContact C-O 3.59Å; G191-L231 VanDerWaalsContact CA-O 3.3Å; G191-L231 WeakPolarHBondContact CA-O 3.38Å; M192-L231 PolarHBondContact N-O 3Å; N228-L231 PolarHBondContact O-N 2.83Å; N228-L231 WeakPolarHBondContact OD1-CA 3.23Å; N228-L231 PolarHBondContact OD1-N 2.76Å; D229-L231 VanDerWaalsContact C-N 3.3Å; L231-C265 HydrophobicContact CD1-CB 4.13Å; L231-T269 HydrophobicContact CB-CG2 4.38Å; L231-T269 HydrophobicContact CD1-CG2 4.12Å; L231-T269 HydrophobicContact CD2-CG2 4.4Å; L231-P270 HydrophobicContact CD2-CG 4.17Å
232	S	93.2	Very high	94.6	Very high	25 Å²	25	47.5 Å²	47.5	18%	0.175	25%	0.245	C	C	.	.	S	Bend	trans	-110.3	0	-175.1	68.1	0	0	0	0	113.1	C184 M192 N228 S230	C184-S232 PolarHBondContact N-O 3.01Å; M192-S232 WeakPolarHBondContact CE-O 3.4Å; N228-S232 PolarHBondContact OD1-N 3.49Å; S230-S232 PolarHBondContact O-N 2.64Å; S230-S232 PolarHBondContact OG-OG 3.39Å
233	S	95.5	Very high	94.5	Very high	29 Å²	29	48.9 Å²	48.9	20%	0.203	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	151.4	164.6	68	0	0	0	0	111	W182 Y227 N228	W182-S233 CarbonylContact O-C 3.57Å; W182-S233 WeakPolarHBondContact O-CA 3.37Å; W182-S233 WeakPolarHBondContact O-CB 3.5Å; Y227-S233 WeakPolarHBondContact CA-O 3.5Å; N228-S233 PolarHBondContact N-O 2.78Å; N228-S233 PolarHBondContact ND2-OG 2.94Å; N228-S233 PolarHBondContact OD1-N 3.33Å; N228-S233 PolarHBondContact OD1-O 2.86Å
234	A	97.2	Very high	94.3	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.5	171.3	0	0	0	0	0	109.9	W182 V194 P225 K226 Y227	W182-A234 HydrophobicContact CB-CB 4.48Å; W182-A234 HydrophobicContact CE3-CB 4.17Å; W182-A234 PolarHBondContact N-O 2.92Å; W182-A234 PolarHBondContact O-N 2.83Å; V194-A234 HydrophobicContact CG2-CB 4.1Å; P225-A234 HydrophobicContact CB-CB 4.18Å; K226-A234 CarbonylContact O-C 3.5Å; K226-A234 VanDerWaalsContact O-CA 3.26Å; K226-A234 WeakPolarHBondContact O-CA 3.06Å; Y227-A234 HydrophobicContact CD1-CB 3.74Å; Y227-A234 HydrophobicContact CE1-CB 3.66Å; Y227-A234 HydrophobicContact CE2-CB 4.42Å; Y227-A234 HydrophobicContact CG-CB 4.17Å
235	E	97	Very high	93.9	Very high	71 Å²	71	55.9 Å²	55.9	33%	0.332	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.8	179.1	62.9	-178.2	-146.2	0	0	112.2	P164 W179 H180 K226	P164-E235 VanDerWaalsContact CB-OE2 3.22Å; P164-E235 WeakPolarHBondContact CB-OE2 3.22Å; P164-E235 VanDerWaalsContact CG-OE2 3.23Å; P164-E235 WeakPolarHBondContact CG-OE2 3.44Å; W179-E235 HydrophobicContact CE3-CB 4.22Å; W179-E235 HydrophobicContact CE3-CG 4.44Å; W179-E235 HydrophobicContact CZ3-CB 4.39Å; W179-E235 HydrophobicContact CZ3-CG 4.12Å; H180-E235 CarbonylContact O-C 3.58Å; H180-E235 VanDerWaalsContact O-CA 3.23Å; H180-E235 WeakPolarHBondContact O-CA 3.32Å; K226-E235 PolarHBondContact N-O 3.4Å; K226-E235 PolarHBondContact O-N 3.05Å
236	Q	96.9	Very high	93.4	Very high	11 Å²	11	56.4 Å²	56.4	5%	0.051	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	133.1	174.9	-175.9	52.1	44.8	0	0	111.8	W179 H180 W182 M222 D223 T224 T238	W179-Q236 CarbonylContact C-O 3.55Å; W179-Q236 WeakPolarHBondContact CA-O 3.43Å; H180-Q236 HydrophobicContact CB-CB 4.44Å; H180-Q236 PolarHBondContact N-O 2.9Å; H180-Q236 PolarHBondContact O-N 3.38Å; W182-Q236 HydrophobicContact CH2-CB 4.42Å; W182-Q236 HydrophobicContact CZ3-CB 4.05Å; M222-Q236 HydrophobicContact CG-CG 3.64Å; M222-Q236 HydrophobicContact SD-CG 4.46Å; D223-Q236 VanDerWaalsContact O-CG 3.3Å; D223-Q236 WeakPolarHBondContact O-CG 3.23Å; T224-Q236 PolarHBondContact O-OE1 2.93Å; T224-Q236 VanDerWaalsContact O-OE1 3.06Å; Q236-T238 HydrophobicContact CG-CG2 4.3Å
237	E	96.2	Very high	93	Very high	74 Å²	74	54.4 Å²	54.4	35%	0.346	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	134.4	174.8	-176.6	-178.8	-155.3	0	0	110.7	R177 W179	R177-E237 WeakPolarHBondContact CD-OE1 3.26Å; R177-E237 HydrophobicContact CG-CG 4.17Å; R177-E237 IonicContact CZ-OE1 3.68Å; R177-E237 IonicContact NE-OE1 3.05Å; R177-E237 PolarHBondContact NE-OE1 3.3Å; R177-E237 VanDerWaalsContact NH1-CD 3.34Å; R177-E237 IonicContact NH1-OE1 2.59Å; R177-E237 PolarHBondContact NH1-OE1 3.21Å; W179-E237 HydrophobicContact CD2-CB 4.08Å; W179-E237 HydrophobicContact CE3-CB 4.22Å; W179-E237 HydrophobicContact CH2-CB 4.15Å; W179-E237 HydrophobicContact CZ2-CB 3.95Å; W179-E237 HydrophobicContact CZ2-CG 4.17Å; W179-E237 HydrophobicContact CZ3-CB 4.27Å
238	T	95.6	Very high	92.7	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.055	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	164.1	175.9	66.5	0	0	0	0	111.4	V178 H180 M222 Q236	V178-T238 WeakPolarHBondContact CG2-OG1 3.34Å; V178-T238 PolarHBondContact N-O 2.79Å; V178-T238 PolarHBondContact O-N 2.81Å; V178-T238 VanDerWaalsContact O-O 3.12Å; H180-T238 PolarHBondContact CD2-OG1 2.83Å; H180-T238 PolarHBondContact NE2-OG1 2.98Å; M222-T238 HydrophobicContact CB-CG2 3.74Å; M222-T238 HydrophobicContact CG-CG2 3.45Å; M222-T238 VanDerWaalsContact CG-CG2 3.45Å; M222-T238 HydrophobicContact SD-CG2 4.05Å; Q236-T238 HydrophobicContact CG-CG2 4.3Å
239	L	95.1	Very high	92.7	Very high	93 Å²	93	51.3 Å²	51.3	49%	0.487	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.4	165.6	-62.4	179	0	0	0	108.9	R177 F241	R177-L239 HydrophobicContact CB-CD2 4.34Å; L239-F241 WeakPolarHBondContact O-CD1 3.09Å; L239-F241 PolarHBondContact O-N 2.77Å
240	V	94.6	Very high	92.7	Very high	10 Å²	10	44.7 Å²	44.7	6%	0.061	25%	0.249	C	C	.	.			trans	-65.2	127.3	-178.2	174.5	0	0	0	0	110.9	A172 R173 I174 G175 D176 V178 V420	A172-V240 HydrophobicContact CB-CB 4.49Å; A172-V240 HydrophobicContact CB-CG1 4.27Å; A172-V240 HydrophobicContact CB-CG2 3.78Å; R173-V240 WeakPolarHBondContact O-CB 2.99Å; I174-V240 WeakPolarHBondContact CA-O 3.42Å; G175-V240 PolarHBondContact N-O 2.87Å; D176-V240 HydrophobicContact CB-CG2 4.38Å; D176-V240 WeakPolarHBondContact O-CG2 3.49Å; D176-V240 PolarHBondContact O-N 3.47Å; V178-V240 HydrophobicContact CB-CG2 4.17Å; V178-V240 HydrophobicContact CG1-CG2 3.46Å; V178-V240 VanDerWaalsContact CG1-CG2 3.46Å; V178-V240 HydrophobicContact CG2-CG2 3.62Å; V240-V420 HydrophobicContact CG1-CB 4.3Å; V240-V420 HydrophobicContact CG1-CG1 3.64Å; V240-V420 HydrophobicContact CG1-CG2 3.73Å
241	F	93.4	Very high	92.9	Very high	50 Å²	50	43.1 Å²	43.1	22%	0.219	24%	0.237	C	C	.	.			trans	-128.6	166.4	175.7	63.3	-87.6	0	0	0	110.7	V199 I221 L239 F251	V199-F241 HydrophobicContact CB-CE2 4.43Å; V199-F241 HydrophobicContact CG1-CE2 3.98Å; V199-F241 HydrophobicContact CG1-CZ 4.43Å; V199-F241 HydrophobicContact CG2-CE2 3.91Å; V199-F241 HydrophobicContact CG2-CZ 3.78Å; I221-F241 HydrophobicContact CG2-CD1 3.84Å; I221-F241 HydrophobicContact CG2-CD2 4.44Å; I221-F241 HydrophobicContact CG2-CE1 3.26Å; I221-F241 HydrophobicContact CG2-CE2 3.91Å; I221-F241 HydrophobicContact CG2-CG 4.41Å; I221-F241 HydrophobicContact CG2-CZ 3.28Å; L239-F241 WeakPolarHBondContact O-CD1 3.09Å; L239-F241 PolarHBondContact O-N 2.77Å; F241-F251 HydrophobicContact CE1-CE1 4.13Å; F241-F251 HydrophobicContact CE1-CZ 4.23Å; F241-F251 AromaticContact CZ-CE1 3.74Å; F241-F251 HydrophobicContact CZ-CE1 3.74Å; F241-F251 HydrophobicContact CZ-CZ 4.11Å
242	K	92.1	Very high	93	Very high	43 Å²	43	42 Å²	42	19%	0.187	23%	0.231	C	C	.	.			trans	-150.8	162.9	176	67.7	175.5	-155.2	170	0	112.2	I174 V246 V249 V420 D422	I174-K242 HydrophobicContact CD1-CD 4.15Å; I174-K242 HydrophobicContact CD1-CG 4.19Å; I174-K242 HydrophobicContact CG1-CD 4.44Å; I174-K242 HydrophobicContact CG1-CG 4.41Å; K242-V246 WeakPolarHBondContact CD-O 3.48Å; K242-V249 HydrophobicContact CB-CG2 3.66Å; K242-V420 HydrophobicContact CB-CB 3.9Å; K242-V420 HydrophobicContact CB-CG1 3.97Å; K242-V420 HydrophobicContact CB-CG2 4.09Å; K242-V420 HydrophobicContact CD-CB 3.87Å; K242-V420 HydrophobicContact CD-CG1 3.75Å; K242-V420 HydrophobicContact CG-CB 4.32Å; K242-V420 HydrophobicContact CG-CG1 4.03Å; K242-D422 WeakPolarHBondContact CE-OD1 3.33Å; K242-D422 IonicContact NZ-OD1 3.09Å; K242-D422 PolarHBondContact NZ-OD1 3Å; K242-D422 IonicContact NZ-OD2 3.39Å; K242-D422 PolarHBondContact NZ-OD2 3.02Å
243	F	90.6	Very high	93.2	Very high	32 Å²	32	41 Å²	41	14%	0.14	22%	0.224	C	C	.	.			trans	-68.7	152.1	165.5	-63.1	-89.3	0	0	0	110.9	V199 D201 I207 V246 L282	V199-F243 HydrophobicContact CB-CE2 4.31Å; V199-F243 HydrophobicContact CB-CZ 4.39Å; V199-F243 HydrophobicContact CG1-CE2 3.77Å; V199-F243 HydrophobicContact CG1-CZ 4.33Å; V199-F243 WeakPolarHBondContact O-CZ 3.36Å; D201-F243 HydrophobicContact CB-CB 4.45Å; D201-F243 HydrophobicContact CB-CD1 4.48Å; D201-F243 HydrophobicContact CB-CD2 3.63Å; D201-F243 HydrophobicContact CB-CE2 3.9Å; D201-F243 HydrophobicContact CB-CG 3.96Å; D201-F243 HydrophobicContact CB-CZ 4.44Å; I207-F243 HydrophobicContact CD1-CE1 3.57Å; I207-F243 HydrophobicContact CD1-CZ 4.06Å; I207-F243 HydrophobicContact CG1-CE1 3.92Å; I207-F243 HydrophobicContact CG1-CZ 4.13Å; F243-V246 HydrophobicContact CB-CB 4.15Å; F243-V246 HydrophobicContact CB-CG2 4.35Å; F243-V246 PolarHBondContact O-N 2.81Å; F243-L282 HydrophobicContact CE1-CD1 4.44Å
244	A	88.1	Confident	93.2	Very high	84 Å²	84	41.5 Å²	41.5	69%	0.694	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	140.3	172.2	0	0	0	0	0	110.6	V246	A244-V246 PolarHBondContact O-N 3.2Å
245	D	85.9	Confident	93.1	Very high	159 Å²	159	41.5 Å²	41.5	85%	0.85	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	12.6	177.3	-53.5	-41.8	0	0	0	116.5
246	V	87.1	Confident	92.9	Very high	16 Å²	16	41.2 Å²	41.2	10%	0.097	22%	0.22	C	C	.	.			trans	-121.5	127.2	177.6	179.6	0	0	0	0	109.5	D201 K242 F243 A244 A248	D201-V246 HydrophobicContact CB-CG1 4.32Å; D201-V246 HydrophobicContact CB-CG2 4.33Å; K242-V246 WeakPolarHBondContact CD-O 3.48Å; F243-V246 HydrophobicContact CB-CB 4.15Å; F243-V246 HydrophobicContact CB-CG2 4.35Å; F243-V246 PolarHBondContact O-N 2.81Å; A244-V246 PolarHBondContact O-N 3.2Å; V246-A248 VanDerWaalsContact CG1-O 3.24Å; V246-A248 WeakPolarHBondContact CG1-O 3.44Å
247	L	88.8	Confident	92.7	Very high	94 Å²	94	41.1 Å²	41.1	49%	0.492	22%	0.221	S	C	.	.			trans	-92.7	-25.3	179.8	-65.2	175.3	0	0	0	113.3	L419 V420	L247-L419 CarbonylContact O-C 3.58Å; L247-L419 WeakPolarHBondContact O-CA 3.04Å; L247-V420 WeakPolarHBondContact CD2-O 3.16Å; L247-V420 PolarHBondContact O-N 3.09Å
248	A	90.2	Very high	92.4	Very high	22 Å²	22	38 Å²	38	18%	0.182	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.7	-177.2	0	0	0	0	0	109.7	V246 L419	V246-A248 VanDerWaalsContact CG1-O 3.24Å; V246-A248 WeakPolarHBondContact CG1-O 3.44Å; A248-L419 HydrophobicContact CB-CD2 3.9Å
249	V	92.8	Very high	92.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.7	178.2	-179.7	0	0	0	0	107.9	V199 K242 F251 E417 I418 V420	V199-V249 HydrophobicContact CG1-CG1 3.23Å; K242-V249 HydrophobicContact CB-CG2 3.66Å; V249-F251 HydrophobicContact CG1-CE2 4.13Å; V249-F251 HydrophobicContact CG1-CZ 4.2Å; V249-E417 WeakPolarHBondContact O-CA 3.2Å; V249-I418 HydrophobicContact CB-CG2 4.14Å; V249-I418 PolarHBondContact N-O 2.78Å; V249-I418 PolarHBondContact O-N 2.88Å; V249-V420 HydrophobicContact CB-CG2 4.38Å; V249-V420 HydrophobicContact CG2-CG2 3.88Å
250	Q	92.4	Very high	91.8	Very high	36 Å²	36	38.1 Å²	38.1	17%	0.168	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.5	176.2	-177.2	179.7	48.6	0	0	110	V199 R200 Q416	V199-Q250 CarbonylContact C-O 3.6Å; V199-Q250 WeakPolarHBondContact CA-O 2.89Å; R200-Q250 HydrophobicContact CB-CB 4.32Å; R200-Q250 PolarHBondContact N-O 3.13Å; R200-Q250 PolarHBondContact O-N 3.48Å; Q250-Q416 CarbonylContact C-O 3.59Å; Q250-Q416 WeakPolarHBondContact CA-O 3.22Å
251	F	95.4	Very high	91.5	Very high	12 Å²	12	40.5 Å²	40.5	5%	0.053	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	136.5	169.4	-63.6	-84.4	0	0	0	109.2	Y157 L159 H180 V199 I209 F241 V249 S415 Q416 I418	Y157-F251 HydrophobicContact CE1-CB 3.53Å; Y157-F251 WeakPolarHBondContact OH-CB 3.21Å; Y157-F251 WeakPolarHBondContact OH-CG 3.4Å; L159-F251 HydrophobicContact CD1-CD2 3.96Å; L159-F251 HydrophobicContact CD1-CE2 4.04Å; H180-F251 AromaticContact CE1-CD1 3.8Å; H180-F251 AromaticContact CE1-CE1 3.64Å; H180-F251 AromaticContact CE1-CZ 3.83Å; V199-F251 HydrophobicContact CG1-CD1 4.4Å; V199-F251 HydrophobicContact CG1-CE1 4.2Å; V199-F251 HydrophobicContact CG2-CD1 3.94Å; V199-F251 HydrophobicContact CG2-CE1 3.85Å; I209-F251 HydrophobicContact CD1-CD1 4.3Å; I209-F251 HydrophobicContact CD1-CE1 4.47Å; F241-F251 HydrophobicContact CE1-CE1 4.13Å; F241-F251 HydrophobicContact CE1-CZ 4.23Å; F241-F251 AromaticContact CZ-CE1 3.74Å; F241-F251 HydrophobicContact CZ-CE1 3.74Å; F241-F251 HydrophobicContact CZ-CZ 4.11Å; V249-F251 HydrophobicContact CG1-CE2 4.13Å; V249-F251 HydrophobicContact CG1-CZ 4.2Å; F251-S415 CarbonylContact O-C 3.52Å; F251-S415 WeakPolarHBondContact O-CA 3.28Å; F251-S415 WeakPolarHBondContact O-CB 3.27Å; F251-Q416 PolarHBondContact N-O 3.48Å; F251-Q416 PolarHBondContact O-N 3.33Å; F251-I418 HydrophobicContact CD2-CG2 4.45Å; F251-I418 HydrophobicContact CE2-CG2 3.87Å
252	H	95	Very high	91.2	Very high	10 Å²	10	46.1 Å²	46.1	5%	0.046	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	134.1	178.4	176.1	81.7	0	0	0	109.1	C197 S198 R200 V414 S415	C197-H252 CarbonylContact C-O 3.57Å; C197-H252 WeakPolarHBondContact CA-O 3.29Å; S198-H252 PolarHBondContact N-O 3.28Å; S198-H252 PolarHBondContact O-N 3.46Å; R200-H252 VanDerWaalsContact CZ-CD2 3.49Å; R200-H252 PolarHBondContact NH2-CD2 3.21Å; R200-H252 PolarHBondContact NH2-NE2 2.93Å; H252-V414 WeakPolarHBondContact CA-O 3.47Å; H252-S415 PolarHBondContact ND1-OG 3.47Å
253	C	96.5	Very high	90.9	Very high	4 Å²	4	49.6 Å²	49.6	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.4	179	-64.8	0	0	0	0	110.3	V194 C197 V414	V194-C253 HydrophobicContact CG1-CB 4.11Å; C197-C253 HydrophobicContact CB-CB 4.13Å; C197-C253 WeakPolarHBondContact CB-SG 3.15Å; C197-C253 WeakPolarHBondContact SG-CB 3.01Å; C197-C253 CovalentContact SG-SG 2.04Å; C197-C253 PolarHBondContact SG-SG 2.91Å; C253-V414 HydrophobicContact CB-CG2 4.07Å; C253-V414 PolarHBondContact N-O 2.9Å; C253-V414 PolarHBondContact O-N 2.75Å
254	Q	95.7	Very high	90.8	Very high	41 Å²	41	49.8 Å²	49.8	19%	0.192	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.9	169.3	-53.3	-166.2	-55.9	0	0	109.4	H195 A412 D413	H195-Q254 PolarHBondContact N-O 2.86Å; H195-Q254 PolarHBondContact O-N 2.94Å; Q254-A412 CarbonylContact C-O 3.56Å; Q254-D413 WeakPolarHBondContact CG-OD1 3.4Å; Q254-D413 PolarHBondContact NE2-OD1 2.04Å
255	I	95.4	Very high	91	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.3	178.7	-61.5	175.9	0	0	0	108	C155 M192 L193 V194 L257 E411 A412 V414	C155-I255 HydrophobicContact CB-CD1 3.72Å; M192-I255 HydrophobicContact CB-CG2 3.79Å; M192-I255 HydrophobicContact CG-CG2 4.44Å; M192-I255 HydrophobicContact SD-CG2 4.34Å; L193-I255 WeakPolarHBondContact O-CA 3.41Å; V194-I255 HydrophobicContact CG2-CG1 4.42Å; I255-L257 HydrophobicContact CG2-CD2 4.23Å; I255-E411 WeakPolarHBondContact O-CA 3.2Å; I255-A412 PolarHBondContact N-O 2.85Å; I255-A412 PolarHBondContact O-N 3.23Å; I255-V414 HydrophobicContact CD1-CB 4.46Å; I255-V414 HydrophobicContact CD1-CG1 3.86Å; I255-V414 HydrophobicContact CD1-CG2 3.71Å; I255-V414 HydrophobicContact CG1-CG2 4.1Å
256	K	93	Very high	91.2	Very high	65 Å²	65	45.8 Å²	45.8	28%	0.283	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135.5	170.5	-175	170.3	-65.8	178.4	0	109.7	M192 L193	M192-K256 CarbonylContact C-O 3.33Å; M192-K256 WeakPolarHBondContact CA-O 3.24Å; L193-K256 HydrophobicContact CB-CB 4.43Å; L193-K256 PolarHBondContact N-O 2.88Å; L193-K256 PolarHBondContact O-N 2.96Å
257	L	92.1	Very high	91.3	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.052	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.5	178.1	-64.9	173.2	0	0	0	110.9	L92 P153 G191 M192 I255 L410	L92-L257 HydrophobicContact CD1-CD1 3.25Å; L92-L257 HydrophobicContact CD1-CG 4.43Å; P153-L257 HydrophobicContact CG-CD1 3.5Å; P153-L257 HydrophobicContact CG-CD2 4.35Å; G191-L257 WeakPolarHBondContact O-CA 3.37Å; M192-L257 HydrophobicContact CB-CD2 3.97Å; I255-L257 HydrophobicContact CG2-CD2 4.23Å; L257-L410 HydrophobicContact CB-CB 4.22Å; L257-L410 HydrophobicContact CB-CD2 3.9Å; L257-L410 HydrophobicContact CB-CG 4.26Å; L257-L410 HydrophobicContact CD1-CD2 3.38Å; L257-L410 HydrophobicContact CD1-CG 3.86Å; L257-L410 HydrophobicContact CG-CD2 4.26Å; L257-L410 PolarHBondContact N-O 2.99Å
258	C	91.1	Very high	91.4	Very high	8 Å²	8	47.1 Å²	47.1	5%	0.054	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	146.1	176	58.5	0	0	0	0	110	Y190 G191 C265 I268	Y190-C258 CarbonylContact C-O 3.29Å; Y190-C258 WeakPolarHBondContact CA-O 3.39Å; G191-C258 VanDerWaalsContact C-SG 3.59Å; G191-C258 PolarHBondContact N-O 3.42Å; G191-C258 PolarHBondContact O-N 2.58Å; C258-C265 VanDerWaalsContact C-SG 3.59Å; C258-C265 HydrophobicContact CB-CB 4.06Å; C258-C265 WeakPolarHBondContact CB-SG 2.92Å; C258-C265 PolarHBondContact O-SG 2.85Å; C258-C265 VanDerWaalsContact SG-CA 3.57Å; C258-C265 WeakPolarHBondContact SG-CB 3.44Å; C258-C265 CovalentContact SG-SG 2.05Å; C258-C265 PolarHBondContact SG-SG 2.91Å; C258-I268 HydrophobicContact CB-CD1 4.1Å; C258-I268 HydrophobicContact CB-CG2 4.48Å
259	V	89.8	Confident	91.5	Very high	59 Å²	59	46.4 Å²	46.4	36%	0.358	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.7	174.8	180	0	0	0	0	108.8	Y190 A261 G264	Y190-V259 HydrophobicContact CD1-CG2 4.03Å; Y190-V259 HydrophobicContact CE1-CG2 3.71Å; V259-A261 VanDerWaalsContact C-N 3.33Å; V259-A261 HydrophobicContact CG1-CB 3.91Å; V259-A261 PolarHBondContact O-N 2.72Å; V259-G264 CarbonylContact O-C 3.48Å; V259-G264 WeakPolarHBondContact O-CA 3.36Å; V259-G264 PolarHBondContact O-N 2.89Å
260	K	88.4	Confident	91.6	Very high	45 Å²	45	49.9 Å²	49.9	20%	0.196	30%	0.295	C	S	.	.			trans	-72.1	-25.3	-178.3	-75.4	165.3	169.4	161.6	0	113.7	G187 D188 S189 Y190 S230 N262 N263	G187-K260 PolarHBondContact O-NZ 2.72Å; D188-K260 WeakPolarHBondContact O-CD 3.14Å; S189-K260 PolarHBondContact O-N 2.97Å; Y190-K260 VanDerWaalsContact C-CE 3.46Å; Y190-K260 WeakPolarHBondContact O-CE 3.5Å; Y190-K260 PolarHBondContact O-NZ 3.12Å; S230-K260 WeakPolarHBondContact O-CE 3.4Å; S230-K260 PolarHBondContact O-NZ 2.74Å; K260-N262 PolarHBondContact O-N 3.33Å; K260-N263 PolarHBondContact O-N 3.33Å
261	A	87	Confident	91.7	Very high	61 Å²	61	49.2 Å²	49.2	50%	0.504	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-55.1	141	178.4	0	0	0	0	0	110.6	V259 N263 G264	V259-A261 VanDerWaalsContact C-N 3.33Å; V259-A261 HydrophobicContact CG1-CB 3.91Å; V259-A261 PolarHBondContact O-N 2.72Å; A261-N263 PolarHBondContact O-N 2.83Å; A261-G264 PolarHBondContact O-N 3.12Å; A261-G264 VanDerWaalsContact O-N 3.1Å
262	N	87.1	Confident	91.5	Very high	167 Å²	167	55.2 Å²	55.2	89%	0.893	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	54.2	34.2	179.7	-53.9	-31.4	0	0	0	114.3	K260 G264	K260-N262 PolarHBondContact O-N 3.33Å; N262-G264 PolarHBondContact O-N 2.59Å
263	N	86.9	Confident	91.4	Very high	116 Å²	116	56.9 Å²	56.9	62%	0.62	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	58.3	28.8	-177	-59.5	-13.1	0	0	0	114	K260 A261 C265 E266	K260-N263 PolarHBondContact O-N 3.33Å; A261-N263 PolarHBondContact O-N 2.83Å; N263-C265 PolarHBondContact O-N 3.14Å; N263-E266 HydrophobicContact CB-CB 4.26Å; N263-E266 WeakPolarHBondContact O-CB 3.28Å; N263-E266 PolarHBondContact O-N 2.8Å
264	G	87.6	Confident	90.8	Very high	37 Å²	37	63.4 Å²	63.4	38%	0.381	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-5.1	-177.8	0	0	0	0	0	115.8	V259 A261 N262 I268	V259-G264 CarbonylContact O-C 3.48Å; V259-G264 WeakPolarHBondContact O-CA 3.36Å; V259-G264 PolarHBondContact O-N 2.89Å; A261-G264 PolarHBondContact O-N 3.12Å; A261-G264 VanDerWaalsContact O-N 3.1Å; N262-G264 PolarHBondContact O-N 2.59Å; G264-I268 WeakPolarHBondContact O-CD1 3.3Å
265	C	91.8	Very high	89.6	Confident	7 Å²	7	69.3 Å²	69.3	5%	0.047	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-8.6	173.2	-68.8	0	0	0	0	114	L231 C258 N263 G267 I268 T269	L231-C265 HydrophobicContact CD1-CB 4.13Å; C258-C265 VanDerWaalsContact C-SG 3.59Å; C258-C265 HydrophobicContact CB-CB 4.06Å; C258-C265 WeakPolarHBondContact CB-SG 2.92Å; C258-C265 PolarHBondContact O-SG 2.85Å; C258-C265 VanDerWaalsContact SG-CA 3.57Å; C258-C265 WeakPolarHBondContact SG-CB 3.44Å; C258-C265 CovalentContact SG-SG 2.05Å; C258-C265 PolarHBondContact SG-SG 2.91Å; N263-C265 PolarHBondContact O-N 3.14Å; C265-G267 PolarHBondContact O-N 3.24Å; C265-I268 PolarHBondContact O-N 3.16Å; C265-I268 VanDerWaalsContact O-N 3.11Å; C265-T269 HydrophobicContact CB-CG2 3.99Å; C265-T269 PolarHBondContact O-N 3.37Å; C265-T269 VanDerWaalsContact O-N 3.13Å
266	E	91.4	Very high	88.1	Confident	151 Å²	151	74.3 Å²	74.3	71%	0.706	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	128.6	-179.7	-172.3	174.3	-177.6	0	0	110.7	N263 I268	N263-E266 HydrophobicContact CB-CB 4.26Å; N263-E266 WeakPolarHBondContact O-CB 3.28Å; N263-E266 PolarHBondContact O-N 2.8Å; E266-I268 PolarHBondContact O-N 3.19Å
267	G	89.1	Confident	86.4	Confident	74 Å²	74	77.6 Å²	77.6	76%	0.763	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-3.9	-175.4	0	0	0	0	0	115.1	C265	C265-G267 PolarHBondContact O-N 3.24Å
268	I	90.9	Very high	85.2	Confident	64 Å²	64	82.1 Å²	82.1	33%	0.328	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-52	172.5	-57.5	-179.7	0	0	0	110	L193 C258 G264 C265 E266	L193-I268 HydrophobicContact CB-CG2 4.37Å; L193-I268 HydrophobicContact CD2-CG2 4.21Å; C258-I268 HydrophobicContact CB-CD1 4.1Å; C258-I268 HydrophobicContact CB-CG2 4.48Å; G264-I268 WeakPolarHBondContact O-CD1 3.3Å; C265-I268 PolarHBondContact O-N 3.16Å; C265-I268 VanDerWaalsContact O-N 3.11Å; E266-I268 PolarHBondContact O-N 3.19Å
269	T	93	Very high	84.1	Confident	8 Å²	8	90.7 Å²	90.7	5%	0.049	51%	0.511	C	S	.	.	S	Bend	trans	-140.5	137.7	-177.9	-177.9	0	0	0	0	110.9	M192 L231 C265	M192-T269 WeakPolarHBondContact O-CB 3.26Å; M192-T269 WeakPolarHBondContact O-CG2 3.41Å; M192-T269 PolarHBondContact O-OG1 3.09Å; L231-T269 HydrophobicContact CB-CG2 4.38Å; L231-T269 HydrophobicContact CD1-CG2 4.12Å; L231-T269 HydrophobicContact CD2-CG2 4.4Å; C265-T269 HydrophobicContact CB-CG2 3.99Å; C265-T269 PolarHBondContact O-N 3.37Å; C265-T269 VanDerWaalsContact O-N 3.13Å
270	P	94.4	Very high	83.4	Confident	73 Å²	73	90.1 Å²	90.1	47%	0.474	51%	0.505	S	S	.	.	S	Bend	cis	-65	158.4	-7.9	-20	34.8	0	0	0	112.8	Y227 L231	Y227-P270 HydrophobicContact CD2-CB 3.8Å; Y227-P270 HydrophobicContact CD2-CG 4.23Å; Y227-P270 HydrophobicContact CE2-CB 4.39Å; Y227-P270 HydrophobicContact CG-CB 4.36Å; Y227-P270 HydrophobicContact CG-CG 4.33Å; L231-P270 HydrophobicContact CD2-CG 4.17Å
271	P	93.7	Very high	82.9	Confident	22 Å²	22	95.2 Å²	95.2	14%	0.143	53%	0.53	C	S	.	.			trans	-70.2	144.3	-179.2	29.4	-34.3	0	0	0	112	L193 K213 G214 T224 Y227 C273	L193-P271 HydrophobicContact CD1-CB 4.01Å; L193-P271 HydrophobicContact CD1-CG 4.06Å; K213-P271 VanDerWaalsContact O-CB 3.25Å; K213-P271 WeakPolarHBondContact O-CB 3.44Å; G214-P271 WeakPolarHBondContact O-CG 3.38Å; T224-P271 HydrophobicContact CG2-CG 3.98Å; Y227-P271 HydrophobicContact CE2-CG 4.36Å; P271-C273 PolarHBondContact O-N 3.04Å
272	V	92.7	Very high	82.3	Confident	138 Å²	138	97.2 Å²	97.2	84%	0.836	53%	0.532	S	S	*	.			trans	-93.3	98.6	174	-177.5	0	0	0	0	108.9
273	C	90.9	Very high	81.8	Confident	44 Å²	44	92.6 Å²	92.6	30%	0.297	51%	0.509	S	S	.	.			trans	-98.5	135.7	-176.9	-55.3	0	0	0	0	111.7	C215 P271	C215-C273 WeakPolarHBondContact CA-SG 3.19Å; C215-C273 HydrophobicContact CB-CB 3.79Å; C215-C273 WeakPolarHBondContact CB-SG 3.49Å; C215-C273 WeakPolarHBondContact SG-CA 2.81Å; C215-C273 WeakPolarHBondContact SG-CB 3.22Å; C215-C273 CovalentContact SG-SG 2.04Å; C215-C273 PolarHBondContact SG-SG 2.74Å; P271-C273 PolarHBondContact O-N 3.04Å
274	E	85	Confident	80.8	Confident	142 Å²	142	93.4 Å²	93.4	66%	0.664	51%	0.509	S	S	*	.			trans	-83.1	139.8	171.7	-163.1	179.7	164.8	0	0	109.2	Q276	E274-Q276 HydrophobicContact CG-CG 4.08Å; E274-Q276 PolarHBondContact O-N 3.03Å; E274-Q276 PolarHBondContact OE1-NE2 3.06Å; E274-Q276 PolarHBondContact OE2-NE2 2.81Å
275	N	71.2	Confident	79.6	Confident	165 Å²	165	93.9 Å²	93.9	88%	0.882	51%	0.505	S	S	*	.			trans	-71.1	72.1	172.7	-82.2	-7.4	0	0	0	110.4
276	Q	62.7	Low	77.8	Confident	104 Å²	104	102.3 Å²	102.3	49%	0.486	54%	0.54	S	S	.	.			trans	-118.8	118	168.3	-66.4	-174.2	6.2	0	0	108.3	E274 R278	E274-Q276 HydrophobicContact CG-CG 4.08Å; E274-Q276 PolarHBondContact O-N 3.03Å; E274-Q276 PolarHBondContact OE1-NE2 3.06Å; E274-Q276 PolarHBondContact OE2-NE2 2.81Å; Q276-R278 PolarHBondContact O-N 2.88Å
277	T	58.7	Low	76.1	Confident	135 Å²	135	97.1 Å²	97.1	83%	0.828	52%	0.52	S	S	*	.			trans	-61.8	105.7	168.3	46.5	0	0	0	0	108.5
278	R	66.6	Low	74.6	Confident	105 Å²	105	100.2 Å²	100.2	40%	0.396	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-89	157.5	170.9	-68.1	-178.8	179	162	5.5	109.1	D211 L217 Q276	D211-R278 IonicContact OD2-CZ 3.89Å; D211-R278 IonicContact OD2-NH1 2.72Å; D211-R278 PolarHBondContact OD2-NH1 2.92Å; L217-R278 HydrophobicContact CD2-CB 4.14Å; L217-R278 HydrophobicContact CD2-CG 4.48Å; L217-R278 CarbonylContact O-C 3.45Å; L217-R278 VanDerWaalsContact O-C 3.29Å; L217-R278 WeakPolarHBondContact O-CB 3.47Å; Q276-R278 PolarHBondContact O-N 2.88Å
279	Q	66.9	Low	72.6	Confident	188 Å²	188	102.1 Å²	102.1	88%	0.879	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-102.7	133.9	177	-73.2	-177.1	-27.8	0	0	108.6
280	L	76.1	Confident	70.4	Confident	46 Å²	46	105.1 Å²	105.1	24%	0.241	55%	0.546	C	S	.	.	P	Polyproline II helix	trans	-68.5	135.5	174.7	-61.1	168.1	0	0	0	110.4	I207 E208 I209 L217 D218 I221	I207-L280 HydrophobicContact CG2-CB 3.87Å; I207-L280 HydrophobicContact CG2-CD1 4.29Å; I207-L280 HydrophobicContact CG2-CD2 3.99Å; I207-L280 HydrophobicContact CG2-CG 4.27Å; E208-L280 WeakPolarHBondContact O-CD2 3.05Å; I209-L280 HydrophobicContact CG2-CD2 4.24Å; L217-L280 HydrophobicContact CB-CD2 3.88Å; D218-L280 HydrophobicContact CB-CD1 3.62Å; D218-L280 HydrophobicContact CB-CD2 3.8Å; D218-L280 HydrophobicContact CB-CG 3.59Å; D218-L280 VanDerWaalsContact OD2-CD1 3.27Å; D218-L280 WeakPolarHBondContact OD2-CD1 3.31Å; I221-L280 HydrophobicContact CD1-CD1 3.24Å; I221-L280 HydrophobicContact CG1-CD1 4Å
281	E	77.1	Confident	68.1	Low	152 Å²	152	106.3 Å²	106.3	71%	0.71	56%	0.562	S	S	*	*			trans	-114.6	139.4	173.4	-170.5	168.4	-177.9	0	0	110.1
282	L	74.6	Confident	65.5	Low	104 Å²	104	111.8 Å²	111.8	55%	0.545	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	114.2	178.2	-163.4	134.4	0	0	0	109.2	N205 I207 F243	N205-L282 HydrophobicContact CB-CD2 4.44Å; I207-L282 HydrophobicContact CD1-CD1 4.02Å; I207-L282 HydrophobicContact CG1-CB 4.43Å; I207-L282 HydrophobicContact CG1-CD1 4.07Å; I207-L282 HydrophobicContact CG1-CG 4.17Å; F243-L282 HydrophobicContact CE1-CD1 4.44Å
283	V	76.3	Confident	62.9	Low	69 Å²	69	108.4 Å²	108.4	42%	0.418	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.3	131.9	-178	-177.5	0	0	0	0	109.5	Q206	Q206-V283 PolarHBondContact N-O 2.91Å; Q206-V283 PolarHBondContact O-N 2.83Å
284	H	65.4	Low	60.3	Low	133 Å²	133	111.1 Å²	111.1	62%	0.616	60%	0.604	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86	120.5	170	-168.6	66.2	0	0	0	109.6	G204	G204-H284 PolarHBondContact O-ND1 3.14Å
285	V	63.1	Low	57.8	Low	48 Å²	48	113.1 Å²	113.1	29%	0.291	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-86.9	120	-176.4	-167.6	0	0	0	0	110	G204 Q206	G204-V285 PolarHBondContact O-N 2.02Å; Q206-V285 HydrophobicContact CB-CG2 3.83Å; Q206-V285 HydrophobicContact CG-CG2 3.24Å; Q206-V285 VanDerWaalsContact OE1-CG2 3.29Å
286	K	54	Low	56	Low	183 Å²	183	108.9 Å²	108.9	80%	0.796	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-91.8	123.7	155.8	-168.9	176.9	-178.7	-177.6	0	107.5
287	P	56.3	Low	54.6	Low	42 Å²	42	112.7 Å²	112.7	27%	0.273	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-65.4	144.6	-177.6	25.7	-34.2	0	0	0	111.8	H82	H82-P287 VanDerWaalsContact C-CG 3.42Å; H82-P287 WeakPolarHBondContact O-CG 3.41Å
288	E	57.4	Low	53	Low	139 Å²	139	113.7 Å²	113.7	65%	0.65	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-67.4	138.4	179.3	-70.6	-176.9	157.5	0	0	111.7
289	P	47.7	Very low	51.4	Low	104 Å²	104	115.3 Å²	115.3	68%	0.675	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-69.9	144.8	170.3	27.3	-30.4	0	0	0	111.5	A291	P289-A291 PolarHBondContact O-N 2.85Å
290	I	47.7	Very low	49.5	Very low	71 Å²	71	112 Å²	112	36%	0.364	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-67.4	125.5	169.3	-53	172.1	0	0	0	106.1	L81 E292	L81-I290 HydrophobicContact CD2-CD1 4.38Å; I290-E292 VanDerWaalsContact C-N 3.28Å; I290-E292 PolarHBondContact O-N 3.22Å
291	A	46.5	Very low	47.1	Very low	98 Å²	98	118.3 Å²	118.3	81%	0.81	67%	0.669	S	S	*	*			trans	-66.8	95.7	163.9	0	0	0	0	0	107.3	P289 G293	P289-A291 PolarHBondContact O-N 2.85Å; A291-G293 PolarHBondContact O-N 2.9Å
292	E	38.1	Very low	44.8	Very low	137 Å²	137	117 Å²	117	64%	0.64	68%	0.677	S	S	*	*			trans	-63.2	121.4	168.8	-71.4	178.1	164	0	0	107.4	I290 A294	I290-E292 VanDerWaalsContact C-N 3.28Å; I290-E292 PolarHBondContact O-N 3.22Å; E292-A294 PolarHBondContact O-N 3.39Å
293	G	38.2	Very low	42.3	Very low	68 Å²	68	117.3 Å²	117.3	70%	0.701	69%	0.688	S	S	*	*			trans	-56.1	113.5	165.9	0	0	0	0	0	107	A291 E295	A291-G293 PolarHBondContact O-N 2.9Å; G293-E295 PolarHBondContact O-N 2.79Å
294	A	37.2	Very low	40.1	Very low	100 Å²	100	118.7 Å²	118.7	83%	0.826	71%	0.707	S	S	*	*			trans	-54.8	108.7	179	0	0	0	0	0	108.6	E292 G296	E292-A294 PolarHBondContact O-N 3.39Å; A294-G296 PolarHBondContact O-N 3.1Å
295	E	31.9	Very low	38.1	Very low	184 Å²	184	120.1 Å²	120.1	86%	0.86	72%	0.718	S	S	*	*			trans	-60	109	168.5	-71.3	-177.2	153.4	0	0	106.9	G293 E297	G293-E295 PolarHBondContact O-N 2.79Å; E295-E297 VanDerWaalsContact C-N 3.35Å; E295-E297 PolarHBondContact O-N 3.26Å
296	G	33.7	Very low	36.3	Very low	77 Å²	77	122.5 Å²	122.5	79%	0.794	74%	0.743	S	S	*	*			trans	-63.9	96.5	173	0	0	0	0	0	109.3	A294 N298	A294-G296 PolarHBondContact O-N 3.1Å; G296-N298 PolarHBondContact O-N 3.3Å
297	E	33.1	Very low	35	Very low	184 Å²	184	118.1 Å²	118.1	86%	0.86	74%	0.741	S	S	*	*			trans	-60.6	127.7	166.2	-81.4	-176.7	117.9	0	0	109.9	E295 V299	E295-E297 VanDerWaalsContact C-N 3.35Å; E295-E297 PolarHBondContact O-N 3.26Å; E297-V299 PolarHBondContact O-N 2.78Å
298	N	25.8	Very low	33.4	Very low	156 Å²	156	125.7 Å²	125.7	83%	0.834	77%	0.773	S	S	*	*			trans	-47.5	121.6	170.7	-71.7	-45.1	0	0	0	111.7	G296	G296-N298 PolarHBondContact O-N 3.3Å
299	V	31.2	Very low	31.7	Very low	138 Å²	138	122.6 Å²	122.6	84%	0.836	78%	0.778	S	S	*	*			trans	-116.6	93.7	154	-176	0	0	0	0	108	E297 E301	E297-V299 PolarHBondContact O-N 2.78Å; V299-E301 PolarHBondContact O-N 3.09Å
300	T	28.8	Very low	30.6	Very low	118 Å²	118	126.2 Å²	126.2	72%	0.724	79%	0.786	S	S	*	*			trans	-50.8	121.1	157.7	28.4	0	0	0	0	110.3
301	E	24.3	Very low	29.3	Very low	179 Å²	179	130.5 Å²	130.5	84%	0.836	81%	0.809	S	S	*	*			trans	30.1	111.5	140.1	-63.3	179.8	158	0	0	117.5	V299	V299-E301 PolarHBondContact O-N 3.09Å
302	S	29.5	Very low	28.1	Very low	124 Å²	124	131.7 Å²	131.7	87%	0.867	81%	0.806	S	S	*	*				-165.3	120.3	113.7	-80.8	0	0	0	0	111.8
303	S	22.3	Very low	27.2	Very low	112 Å²	112	131 Å²	131	78%	0.783	81%	0.811	S	S	*	*			trans	-40.8	129.2	163.7	-164.4	0	0	0	0	113.8
304	A	30.8	Very low	26.7	Very low	98 Å²	98	133.2 Å²	133.2	81%	0.81	82%	0.816	S	S	*	*			trans	-157.5	99	145.2	0	0	0	0	0	109.5
305	L	22.6	Very low	26.1	Very low	163 Å²	163	132.1 Å²	132.1	85%	0.853	81%	0.807	S	S	*	*			trans	-57.3	131.4	154.7	-71.6	116.6	0	0	0	109.5
306	A	24.9	Very low	25.5	Very low	97 Å²	97	130.9 Å²	130.9	80%	0.802	81%	0.806	S	S	*	*				173	143.2	129.1	0	0	0	0	0	112.5
307	A	27.5	Very low	25.2	Very low	92 Å²	92	131.5 Å²	131.5	76%	0.76	80%	0.804	S	S	*	*			trans	82.3	84	153.7	0	0	0	0	0	118
308	E	22	Very low	24.6	Very low	201 Å²	201	128.4 Å²	128.4	94%	0.939	80%	0.803	S	S	*	*				10.7	128.5	117.3	-58.1	-178.3	161.2	0	0	117.1
309	G	22.8	Very low	24.5	Very low	74 Å²	74	128.4 Å²	128.4	76%	0.763	80%	0.802	S	S	*	*			trans	169.9	88.5	166.2	0	0	0	0	0	115.5
310	E	22.7	Very low	24.2	Very low	179 Å²	179	127.4 Å²	127.4	84%	0.836	80%	0.801	S	S	*	*			trans	82.2	88.7	146.4	-117.6	164.1	138.9	0	0	120.4	T312	E310-T312 PolarHBondContact O-N 2.81Å
311	L	20.8	Very low	24	Very low	161 Å²	161	129.4 Å²	129.4	84%	0.843	80%	0.802	S	S	*	*			trans	-59.4	113.7	148.6	-153.8	86.7	0	0	0	109.5
312	T	22.5	Very low	23.9	Very low	124 Å²	124	129.3 Å²	129.3	76%	0.761	80%	0.802	S	S	*	*			trans	-102	112.5	166.1	46.5	0	0	0	0	110	E310	E310-T312 PolarHBondContact O-N 2.81Å
313	T	18.4	Very low	23.5	Very low	121 Å²	121	127 Å²	127	74%	0.742	80%	0.797	S	S	*	*			trans	-70.6	132.9	169.2	48.7	0	0	0	0	111.2
314	S	27.8	Very low	23.6	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	80%	0.802	S	S	*	*			trans	-149.1	93.5	147.1	43.7	0	0	0	0	105.9
315	A	24	Very low	23	Very low	77 Å²	77	131.2 Å²	131.2	64%	0.636	80%	0.796	S	S	*	*				62.1	102	75.1	0	0	0	0	0	113
316	N	20.8	Very low	23	Very low	158 Å²	158	130.1 Å²	130.1	85%	0.845	80%	0.796	S	S	*	*			trans	64	122.2	135.2	-54	-10.2	0	0	0	118.5
317	A	25.6	Very low	22.8	Very low	91 Å²	91	134.4 Å²	134.4	75%	0.752	80%	0.8	S	S	*	*				176.5	123.9	83.7	0	0	0	0	0	111.1
318	S	20.6	Very low	22.6	Very low	119 Å²	119	134.7 Å²	134.7	83%	0.832	80%	0.802	S	S	*	*			trans	-70.4	140.6	158.9	45.2	0	0	0	0	111.3
319	L	23.6	Very low	22.6	Very low	155 Å²	155	129.7 Å²	129.7	81%	0.812	80%	0.795	S	S	*	*			trans	-137.5	106.3	165.3	-91.1	153.6	0	0	0	107.6
320	S	26.8	Very low	22.6	Very low	118 Å²	118	131 Å²	131	83%	0.825	80%	0.799	S	S	*	*			trans	-154.3	95.6	156.3	57.8	0	0	0	0	107.9
321	E	23.3	Very low	22.4	Very low	159 Å²	159	131.6 Å²	131.6	74%	0.743	80%	0.801	S	S	*	*			trans	-52.8	159.1	153.8	-60.3	168.8	152.5	0	0	109.4
322	E	21.6	Very low	22.5	Very low	178 Å²	178	133.9 Å²	133.9	83%	0.832	81%	0.808	S	S	*	*			cis	-173.5	157.3	-2.7	-112.9	179.5	158.7	0	0	105.7
323	G	22.8	Very low	22.4	Very low	75 Å²	75	137.1 Å²	137.1	77%	0.773	81%	0.811	S	S	*	*			trans	88	135.6	152.5	0	0	0	0	0	117.2
324	E	22.6	Very low	22.5	Very low	186 Å²	186	139.7 Å²	139.7	87%	0.869	82%	0.815	S	S	*	*			cis	-161.1	147.5	-12.9	-173.2	155.8	146.1	0	0	106.5
325	T	18.1	Very low	22.3	Very low	112 Å²	112	139.7 Å²	139.7	69%	0.687	82%	0.815	S	S	*	*			trans	-44.7	146.5	173	42.1	0	0	0	0	116.4
326	T	23.6	Very low	22.6	Very low	140 Å²	140	141.1 Å²	141.1	86%	0.859	82%	0.817	S	S	*	*				-170.9	141.1	109.5	21	0	0	0	0	112.9
327	E	20.7	Very low	22.9	Very low	188 Å²	188	138.1 Å²	138.1	88%	0.879	82%	0.815	S	S	*	*			trans	-67.3	147.7	-178	-60.1	156.9	130	0	0	112.9
328	A	23.2	Very low	22.8	Very low	97 Å²	97	142.1 Å²	142.1	80%	0.802	82%	0.818	S	S	*	*				171.6	122.2	111.9	0	0	0	0	0	112.5
329	A	23	Very low	22.9	Very low	96 Å²	96	144.8 Å²	144.8	79%	0.793	82%	0.817	S	S	*	*			trans	47.9	98.9	140.5	0	0	0	0	0	120.6
330	A	21.4	Very low	23.2	Very low	102 Å²	102	146.2 Å²	146.2	84%	0.843	82%	0.824	S	S	*	*				15.8	111.5	123.2	0	0	0	0	0	119.3
331	E	20.1	Very low	23.1	Very low	192 Å²	192	145.2 Å²	145.2	90%	0.897	82%	0.818	S	S	*	*			trans	-162.4	98.4	139.8	-135.5	173.8	-170.6	0	0	109.5
332	Q	22.5	Very low	23.4	Very low	208 Å²	208	146.7 Å²	146.7	97%	0.972	83%	0.825	S	S	*	*			trans	-146.1	113.4	158.9	-79.2	-163.6	-26.5	0	0	110.2
333	K	20.2	Very low	23.5	Very low	193 Å²	193	145.4 Å²	145.4	84%	0.839	82%	0.823	S	S	*	*			trans	-127.6	135	169.5	-160.2	-176.8	-176.1	-173.7	0	106.7
334	E	19.5	Very low	23.7	Very low	174 Å²	174	147.2 Å²	147.2	81%	0.813	82%	0.824	S	S	*	*			trans	87.1	112.6	154.3	-143.1	159.3	-174.3	0	0	119.7
335	S	24.2	Very low	23.9	Very low	116 Å²	116	144.6 Å²	144.6	81%	0.811	82%	0.821	S	S	*	*			trans	-149.1	137	136.2	-174.6	0	0	0	0	110.3
336	P	30.1	Very low	24.1	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	83%	0.828	S	S	*	*			trans	-108.9	166.4	-176.4	40.7	-32.2	0	0	0	113.8
337	A	28.5	Very low	24.9	Very low	95 Å²	95	145.9 Å²	145.9	79%	0.785	82%	0.821	S	S	*	*			trans	-178.4	98.5	147.5	0	0	0	0	0	107.7
338	E	23.5	Very low	25.3	Very low	176 Å²	176	143.6 Å²	143.6	82%	0.822	82%	0.819	S	S	*	*				57.7	97.5	87.3	-80	-169	143.1	0	0	116.2
339	Q	21.4	Very low	25.3	Very low	175 Å²	175	146 Å²	146	82%	0.818	82%	0.818	S	S	*	*				36.3	114.6	128.6	-88	148.2	-85.4	0	0	119.9
340	L	30.6	Very low	25.3	Very low	184 Å²	184	146.2 Å²	146.2	96%	0.963	82%	0.815	S	S	*	*			trans	-117.4	120.4	140.9	-133.2	84.1	0	0	0	109.6
341	S	23.3	Very low	25.5	Very low	98 Å²	98	146 Å²	146	69%	0.685	81%	0.807	S	S	*	*			trans	-103	140.6	179.2	50.1	0	0	0	0	111.1
342	Q	30.6	Very low	26	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.883	81%	0.805	S	S	*	*			trans	-160.5	96.2	152.7	-103.4	169	2.8	0	0	106.7
343	D	23.1	Very low	26.1	Very low	151 Å²	151	138.9 Å²	138.9	81%	0.807	79%	0.789	S	S	*	*				58.6	104.8	92.8	-88.5	-19.8	0	0	0	115.9
344	S	27.6	Very low	26.3	Very low	114 Å²	114	138.3 Å²	138.3	80%	0.797	79%	0.789	S	S	*	*				178.3	103.7	121.8	-77.6	0	0	0	0	114
345	V	26	Very low	27	Very low	130 Å²	130	135.7 Å²	135.7	79%	0.788	79%	0.787	S	S	*	*				49.3	106.9	125	-173	0	0	0	0	121.2
346	M	23.1	Very low	27	Very low	170 Å²	170	133.9 Å²	133.9	84%	0.837	79%	0.787	S	S	*	*				40.8	164.1	118.9	-63.2	-79.8	-143.5	0	0	122.7
347	P	41	Very low	26.5	Very low	110 Å²	110	132.5 Å²	132.5	71%	0.714	79%	0.792	S	S	*	*			cis	-134.6	164.6	-24.8	30.9	-11.1	0	0	0	114.4
348	V	27.6	Very low	26.7	Very low	139 Å²	139	133.4 Å²	133.4	84%	0.842	79%	0.79	S	S	*	*			trans	-102	114.6	164.8	179.9	0	0	0	0	108.4
349	N	24	Very low	26.7	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	79%	0.792	S	S	*	*			trans	-101.5	125.5	167.4	-164.2	25.8	0	0	0	108.8
350	S	23.9	Very low	27.1	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	80%	0.798	S	S	*	*			trans	-100.1	117.8	177.2	-60.4	0	0	0	0	109.1
351	S	24.3	Very low	26.8	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	79%	0.786	S	S	*	*			trans	-175.4	111.2	151.2	56	0	0	0	0	110.6
352	N	30	Very low	27	Very low	160 Å²	160	134 Å²	134	86%	0.856	80%	0.797	S	S	*	*			trans	-117.6	108.7	154.4	-95.9	-1.4	0	0	0	107.8
353	S	26	Very low	26.7	Very low	90 Å²	90	128.7 Å²	128.7	63%	0.629	79%	0.792	S	S	*	*			trans	11.6	113.8	135.3	43.4	0	0	0	0	117.2
354	E	24.3	Very low	26.7	Very low	180 Å²	180	127.7 Å²	127.7	84%	0.841	80%	0.797	S	S	*	*				83.8	160.4	88.4	-92.9	-176.3	106.9	0	0	114.3
355	P	33.4	Very low	26.5	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	79%	0.793	S	S	*	*			cis	-136.1	170.1	-34.8	35.2	-17.7	0	0	0	113.2
356	G	23.8	Very low	26.5	Very low	78 Å²	78	127.7 Å²	127.7	80%	0.804	80%	0.797	S	S	*	*			trans	154	103.6	160.3	0	0	0	0	0	115
357	G	20.9	Very low	26.4	Very low	77 Å²	77	126.5 Å²	126.5	79%	0.794	79%	0.794	S	S	*	*			trans	-80.1	-158.3	169.9	0	0	0	0	0	113.4
358	P	32.3	Very low	25.8	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	80%	0.802	S	S	*	*			cis	-130.4	164.9	0.5	38.8	-21.4	0	0	0	115.6
359	E	23.4	Very low	25.5	Very low	185 Å²	185	130.4 Å²	130.4	86%	0.864	81%	0.807	S	S	*	*			trans	26.4	118.8	143.5	-66.5	168.1	110.4	0	0	121
360	Q	29.5	Very low	25.7	Very low	205 Å²	205	127 Å²	127	96%	0.958	81%	0.808	S	S	*	*				-154.5	132.3	126.7	-113.6	172	4.1	0	0	111.5
361	A	25.5	Very low	25.6	Very low	85 Å²	85	128.6 Å²	128.6	70%	0.702	82%	0.819	S	S	*	*			trans	-97.4	171.7	-177.1	0	0	0	0	0	112
362	D	25.8	Very low	25.7	Very low	171 Å²	171	127.6 Å²	127.6	91%	0.914	82%	0.823	S	S	*	*			trans	70.6	128.3	170.3	-60.2	-24.8	0	0	0	115.3
363	G	24.6	Very low	25.5	Very low	77 Å²	77	129.1 Å²	129.1	79%	0.794	83%	0.825	S	S	*	*			cis	146.9	95.4	20.3	0	0	0	0	0	105.1
364	S	24.3	Very low	25.7	Very low	130 Å²	130	131 Å²	131	91%	0.909	84%	0.835	S	S	*	*			trans	-99.3	119.4	-177.7	54.2	0	0	0	0	110.3
365	G	23.2	Very low	25.7	Very low	69 Å²	69	127 Å²	127	71%	0.711	83%	0.833	S	S	*	*			trans	-130	133.2	171.7	0	0	0	0	0	111.5
366	M	25.5	Very low	25.5	Very low	176 Å²	176	126.4 Å²	126.4	87%	0.867	83%	0.832	S	S	*	*			trans	75.4	100.9	150.8	-70.5	164.6	151.3	0	0	119.8
367	D	21.3	Very low	25.9	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	83%	0.831	S	S	*	*				44.9	119.2	109.9	-52.1	-35.8	0	0	0	119.2
368	S	28.8	Very low	26.4	Very low	126 Å²	126	130.8 Å²	130.8	88%	0.881	83%	0.826	S	S	*	*			trans	-161.9	113.3	132.4	-80.5	0	0	0	0	110.8
369	E	20.8	Very low	26.3	Very low	205 Å²	205	130.8 Å²	130.8	96%	0.958	83%	0.829	S	S	*	*			trans	-66.4	144.6	158.7	-72.8	168.1	101.1	0	0	110.6
370	G	27.2	Very low	27	Very low	77 Å²	77	126.7 Å²	126.7	79%	0.794	83%	0.827	S	S	*	*			trans	-178.7	86.9	176.5	0	0	0	0	0	112.4
371	S	21.8	Very low	27.4	Very low	135 Å²	135	122.5 Å²	122.5	94%	0.944	82%	0.82	S	S	*	*			trans	-60.6	137.3	173.5	-58.7	0	0	0	0	113.2
372	G	27.7	Very low	27.9	Very low	76 Å²	76	127.1 Å²	127.1	78%	0.784	83%	0.827	S	S	*	*			trans	177.8	100.4	168.7	0	0	0	0	0	113.5
373	Q	25.2	Very low	28.6	Very low	192 Å²	192	125.5 Å²	125.5	90%	0.897	82%	0.824	S	S	*	*			trans	-59.3	158.1	165.4	-86.7	151.5	-52.3	0	0	111.9
374	P	30.6	Very low	29.3	Very low	129 Å²	129	127 Å²	127	84%	0.838	82%	0.817	S	S	*	*				-151.7	173.7	61.2	37.8	-14.7	0	0	0	118.4
375	A	25.4	Very low	30.2	Very low	96 Å²	96	126.9 Å²	126.9	79%	0.793	81%	0.807	S	S	*	*			trans	-76.3	145.3	-177.7	0	0	0	0	0	114.8
376	S	28.6	Very low	31.2	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	81%	0.81	S	S	*	*			trans	-174	145.5	130.3	49.4	0	0	0	0	113.1
377	N	31.7	Very low	32.5	Very low	146 Å²	146	131.5 Å²	131.5	78%	0.781	81%	0.807	S	S	*	*			trans	91.2	93.5	153.5	-65.4	-3.3	0	0	0	122.5
378	S	32.4	Very low	34.4	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	80%	0.803	S	S	*	*				55.1	111.1	121.8	66.6	0	0	0	0	123.1
379	S	29.5	Very low	35.8	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	81%	0.806	S	S	*	*				56.8	114.1	129.4	66.6	0	0	0	0	121.3
380	A	37.8	Very low	37.9	Very low	100 Å²	100	135 Å²	135	83%	0.826	80%	0.797	S	S	*	*				176.2	141.4	91.5	0	0	0	0	0	110.6
381	S	37.1	Very low	39.7	Very low	116 Å²	116	135.9 Å²	135.9	81%	0.811	78%	0.783	S	S	*	*			trans	-70.9	129	-163.7	-44.6	0	0	0	0	115.7
382	E	37.1	Very low	42	Very low	182 Å²	182	132.8 Å²	132.8	85%	0.85	76%	0.758	S	S	*	*			trans	-89.7	111.9	153.4	-89.6	-179.5	154.2	0	0	108.7	T384	E382-T384 PolarHBondContact O-N 2.92Å
383	V	40.1	Very low	43.7	Very low	138 Å²	138	136.1 Å²	136.1	84%	0.836	75%	0.748	S	S	*	*			trans	-72.8	96.2	172.1	179.2	0	0	0	0	107.7
384	T	39.6	Very low	45.7	Very low	108 Å²	108	131 Å²	131	66%	0.663	73%	0.733	S	S	*	*			trans	-89.7	104.8	164.9	35.1	0	0	0	0	107.8	E382 T386	E382-T384 PolarHBondContact O-N 2.92Å; T384-T386 PolarHBondContact O-N 3.39Å
385	D	43.6	Very low	47.5	Very low	128 Å²	128	127.9 Å²	127.9	68%	0.684	71%	0.708	S	S	*	*			trans	-65.3	96.7	175.3	-167.4	-5.4	0	0	0	109.1	R387	D385-R387 VanDerWaalsContact C-N 3.28Å; D385-R387 WeakPolarHBondContact OD1-CB 3.01Å; D385-R387 PolarHBondContact OD1-N 3.44Å; D385-R387 VanDerWaalsContact OD1-N 3.14Å
386	T	43.5	Very low	49.3	Very low	126 Å²	126	126.9 Å²	126.9	77%	0.773	69%	0.693	S	S	*	*			trans	-95.5	38	174.5	42.4	0	0	0	0	110.5	T384 S388	T384-T386 PolarHBondContact O-N 3.39Å; T386-S388 VanDerWaalsContact C-N 3.27Å; T386-S388 PolarHBondContact O-N 3.01Å
387	R	53.4	Low	50.7	Low	216 Å²	216	129.9 Å²	129.9	82%	0.815	69%	0.688	S	S	*	*			trans	-62.3	96.4	163.9	-96.1	-178.5	163.7	153.3	-3.8	109.3	D385 R389	D385-R387 VanDerWaalsContact C-N 3.28Å; D385-R387 WeakPolarHBondContact OD1-CB 3.01Å; D385-R387 PolarHBondContact OD1-N 3.44Å; D385-R387 VanDerWaalsContact OD1-N 3.14Å; R387-R389 PolarHBondContact O-N 2.88Å; R387-R389 VanDerWaalsContact O-N 3.17Å
388	S	61.4	Low	52	Low	99 Å²	99	127.1 Å²	127.1	69%	0.692	67%	0.669	S	S	*	*			trans	-32.6	116.8	166.1	179.5	0	0	0	0	110.4	T386 R390	T386-S388 VanDerWaalsContact C-N 3.27Å; T386-S388 PolarHBondContact O-N 3.01Å; S388-R390 PolarHBondContact O-N 2.98Å
389	R	57.7	Low	53.4	Low	248 Å²	248	126.2 Å²	126.2	94%	0.936	66%	0.66	S	S	*	*			trans	-62.1	90.2	166.6	-80.6	179.2	148.3	-175	-6.7	107.2	R387 N391	R387-R389 PolarHBondContact O-N 2.88Å; R387-R389 VanDerWaalsContact O-N 3.17Å; R389-N391 PolarHBondContact O-N 2.91Å
390	R	64.9	Low	54.7	Low	202 Å²	202	126.1 Å²	126.1	76%	0.762	65%	0.65	S	S	*	*			trans	-60.6	122.1	166.9	-78.4	-168.4	-176.1	100.9	-0.4	107.4	S388 V392	S388-R390 PolarHBondContact O-N 2.98Å; R390-V392 PolarHBondContact O-N 3.32Å; R390-V392 VanDerWaalsContact O-N 3.1Å
391	N	65.6	Low	55.4	Low	94 Å²	94	127.1 Å²	127.1	50%	0.503	65%	0.646	S	S	.	*			trans	-73.7	101.2	173.8	-172.5	19	0	0	0	108	R389 Y393 S394	R389-N391 PolarHBondContact O-N 2.91Å; N391-Y393 PolarHBondContact O-N 2.89Å; N391-Y393 VanDerWaalsContact O-N 3.16Å; N391-Y393 VanDerWaalsContact OD1-CD2 3.28Å; N391-Y393 WeakPolarHBondContact OD1-CD2 2.92Å; N391-S394 PolarHBondContact O-N 2.87Å; N391-S394 VanDerWaalsContact O-N 3.13Å; N391-S394 PolarHBondContact O-OG 3.17Å
392	V	69.9	Low	56	Low	70 Å²	70	127.1 Å²	127.1	42%	0.424	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-58.5	-27.8	-179.8	177.6	0	0	0	0	111.6	R390 S394 E395 W397	R390-V392 PolarHBondContact O-N 3.32Å; R390-V392 VanDerWaalsContact O-N 3.1Å; V392-S394 PolarHBondContact O-N 2.8Å; V392-E395 WeakPolarHBondContact O-CB 3.3Å; V392-E395 WeakPolarHBondContact O-CG 3.4Å; V392-E395 PolarHBondContact O-N 3.33Å; V392-E395 VanDerWaalsContact O-N 3.14Å; V392-W397 HydrophobicContact CG1-CH2 3.3Å; V392-W397 HydrophobicContact CG1-CZ2 3.56Å; V392-W397 HydrophobicContact CG1-CZ3 4.36Å
393	Y	62.1	Low	56.5	Low	147 Å²	147	127.6 Å²	127.6	58%	0.576	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-69.1	-13.3	178.9	-61.3	-65.8	0	0	0	115.1	N391 F398 T399	N391-Y393 PolarHBondContact O-N 2.89Å; N391-Y393 VanDerWaalsContact O-N 3.16Å; N391-Y393 VanDerWaalsContact OD1-CD2 3.28Å; N391-Y393 WeakPolarHBondContact OD1-CD2 2.92Å; Y393-F398 AromaticContact CD1-CD1 3.95Å; Y393-F398 HydrophobicContact CD1-CD1 3.95Å; Y393-F398 AromaticContact CD1-CE1 3.44Å; Y393-F398 HydrophobicContact CD1-CE1 3.44Å; Y393-F398 VanDerWaalsContact CD1-CE1 3.44Å; Y393-F398 HydrophobicContact CD1-CE2 4.08Å; Y393-F398 AromaticContact CD1-CZ 3.51Å; Y393-F398 HydrophobicContact CD1-CZ 3.51Å; Y393-F398 HydrophobicContact CE1-CE1 4Å; Y393-F398 HydrophobicContact CE1-CE2 4.11Å; Y393-F398 AromaticContact CE1-CZ 3.59Å; Y393-F398 HydrophobicContact CE1-CZ 3.59Å; Y393-T399 WeakPolarHBondContact O-CG2 3Å
394	S	67.3	Low	56.9	Low	83 Å²	83	129.7 Å²	129.7	58%	0.58	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-97.5	2.8	174	55.3	0	0	0	0	113.2	N391 V392	N391-S394 PolarHBondContact O-N 2.87Å; N391-S394 VanDerWaalsContact O-N 3.13Å; N391-S394 PolarHBondContact O-OG 3.17Å; V392-S394 PolarHBondContact O-N 2.8Å
395	E	68.1	Low	57.3	Low	65 Å²	65	132.5 Å²	132.5	30%	0.304	64%	0.643	S	S	.	*	S	Bend	trans	-75.1	138.9	178	-67.6	-74	164.7	0	0	110.5	V392 W397 F398 T399	V392-E395 WeakPolarHBondContact O-CB 3.3Å; V392-E395 WeakPolarHBondContact O-CG 3.4Å; V392-E395 PolarHBondContact O-N 3.33Å; V392-E395 VanDerWaalsContact O-N 3.14Å; E395-W397 VanDerWaalsContact C-N 3.26Å; E395-W397 HydrophobicContact CB-CD2 4.18Å; E395-W397 HydrophobicContact CB-CG 4.25Å; E395-W397 HydrophobicContact CB-CZ2 4.06Å; E395-W397 HydrophobicContact CG-CZ2 4.14Å; E395-W397 PolarHBondContact O-N 2.76Å; E395-F398 WeakPolarHBondContact O-CB 3.37Å; E395-F398 PolarHBondContact O-N 2.89Å; E395-T399 PolarHBondContact O-N 3.18Å; E395-T399 VanDerWaalsContact O-N 3.11Å; E395-T399 PolarHBondContact O-OG1 3.07Å
396	P	64.3	Low	57.8	Low	75 Å²	75	131.4 Å²	131.4	49%	0.487	64%	0.635	S	S	.	*	H	α-helix	trans	-53.6	-42.5	-177.3	-26.3	33.5	0	0	0	112.9	F398 T399 D400	P396-F398 PolarHBondContact O-N 2.8Å; P396-F398 VanDerWaalsContact O-N 3.09Å; P396-T399 WeakPolarHBondContact CA-OG1 3.35Å; P396-T399 PolarHBondContact O-N 2.91Å; P396-T399 VanDerWaalsContact O-N 3.13Å; P396-T399 PolarHBondContact O-OG1 2.75Å; P396-D400 VanDerWaalsContact O-CB 3.22Å; P396-D400 WeakPolarHBondContact O-CB 3.1Å; P396-D400 PolarHBondContact O-N 3.47Å
397	W	57.4	Low	58.4	Low	170 Å²	170	129.8 Å²	129.8	64%	0.644	63%	0.626	S	S	*	*	H	α-helix	trans	-64.3	-16.2	178.9	58.7	-97.8	0	0	0	114.2	V392 E395	V392-W397 HydrophobicContact CG1-CH2 3.3Å; V392-W397 HydrophobicContact CG1-CZ2 3.56Å; V392-W397 HydrophobicContact CG1-CZ3 4.36Å; E395-W397 VanDerWaalsContact C-N 3.26Å; E395-W397 HydrophobicContact CB-CD2 4.18Å; E395-W397 HydrophobicContact CB-CG 4.25Å; E395-W397 HydrophobicContact CB-CZ2 4.06Å; E395-W397 HydrophobicContact CG-CZ2 4.14Å; E395-W397 PolarHBondContact O-N 2.76Å
398	F	59.3	Low	58.6	Low	89 Å²	89	124.8 Å²	124.8	39%	0.39	62%	0.624	S	S	.	*	H	α-helix	trans	-95.6	-34.3	173.7	-165	-80.8	0	0	0	112	T140 Y393 E395 P396	T140-F398 HydrophobicContact CG2-CE2 4.43Å; T140-F398 HydrophobicContact CG2-CZ 4.4Å; Y393-F398 AromaticContact CD1-CD1 3.95Å; Y393-F398 HydrophobicContact CD1-CD1 3.95Å; Y393-F398 AromaticContact CD1-CE1 3.44Å; Y393-F398 HydrophobicContact CD1-CE1 3.44Å; Y393-F398 VanDerWaalsContact CD1-CE1 3.44Å; Y393-F398 HydrophobicContact CD1-CE2 4.08Å; Y393-F398 AromaticContact CD1-CZ 3.51Å; Y393-F398 HydrophobicContact CD1-CZ 3.51Å; Y393-F398 HydrophobicContact CE1-CE1 4Å; Y393-F398 HydrophobicContact CE1-CE2 4.11Å; Y393-F398 AromaticContact CE1-CZ 3.59Å; Y393-F398 HydrophobicContact CE1-CZ 3.59Å; E395-F398 WeakPolarHBondContact O-CB 3.37Å; E395-F398 PolarHBondContact O-N 2.89Å; P396-F398 PolarHBondContact O-N 2.8Å; P396-F398 VanDerWaalsContact O-N 3.09Å
399	T	62.6	Low	58.8	Low	82 Å²	82	125.9 Å²	125.9	50%	0.503	62%	0.623	S	S	.	*	H	α-helix	trans	-85.4	-23.2	-179	54.6	0	0	0	0	113.8	Y393 E395 P396 T401	Y393-T399 WeakPolarHBondContact O-CG2 3Å; E395-T399 PolarHBondContact O-N 3.18Å; E395-T399 VanDerWaalsContact O-N 3.11Å; E395-T399 PolarHBondContact O-OG1 3.07Å; P396-T399 WeakPolarHBondContact CA-OG1 3.35Å; P396-T399 PolarHBondContact O-N 2.91Å; P396-T399 VanDerWaalsContact O-N 3.13Å; P396-T399 PolarHBondContact O-OG1 2.75Å; T399-T401 PolarHBondContact O-N 3.46Å; T399-T401 VanDerWaalsContact O-N 3.09Å
400	D	56.7	Low	59.9	Low	110 Å²	110	115.3 Å²	115.3	59%	0.588	58%	0.584	S	S	*	*	S	Bend	trans	-72	105.8	178.2	-70.1	-16.1	0	0	0	108.1	P396	P396-D400 VanDerWaalsContact O-CB 3.22Å; P396-D400 WeakPolarHBondContact O-CB 3.1Å; P396-D400 PolarHBondContact O-N 3.47Å
401	T	51.6	Low	61	Low	121 Å²	121	107.6 Å²	107.6	74%	0.742	56%	0.557	S	S	*	*			trans	-53.6	126.3	162.5	36.7	0	0	0	0	107.5	T399 Y403	T399-T401 PolarHBondContact O-N 3.46Å; T399-T401 VanDerWaalsContact O-N 3.09Å; T401-Y403 VanDerWaalsContact C-N 3.32Å; T401-Y403 PolarHBondContact O-N 2.99Å
402	P	49.3	Very low	62.2	Low	117 Å²	117	103.4 Å²	103.4	76%	0.76	54%	0.536	S	S	*	.			trans	-61.2	100.9	176.1	24.5	-31.9	0	0	0	107.6	F404	P402-F404 PolarHBondContact O-N 2.96Å
403	Y	47.9	Very low	63.3	Low	191 Å²	191	100.9 Å²	100.9	75%	0.749	52%	0.52	S	S	*	.			trans	-75.9	109.8	167.3	-169.6	-100.1	0	0	0	104.7	T401 E405	T401-Y403 VanDerWaalsContact C-N 3.32Å; T401-Y403 PolarHBondContact O-N 2.99Å; Y403-E405 HydrophobicContact CD1-CB 4.34Å; Y403-E405 HydrophobicContact CD1-CG 4.19Å; Y403-E405 HydrophobicContact CE1-CG 4.27Å; Y403-E405 PolarHBondContact O-N 2.88Å
404	F	48.6	Very low	64.8	Low	183 Å²	183	94.4 Å²	94.4	80%	0.803	50%	0.495	S	S	*	.			trans	-63.7	94.8	164.3	-90.4	-88.7	0	0	0	106.6	P402 M406	P402-F404 PolarHBondContact O-N 2.96Å; F404-M406 PolarHBondContact O-N 2.9Å
405	E	47.6	Very low	66.1	Low	166 Å²	166	91.5 Å²	91.5	78%	0.776	48%	0.475	S	S	*	.			trans	-65.2	106.9	166.6	-132.4	164.3	-162.9	0	0	105.8	Y403	Y403-E405 HydrophobicContact CD1-CB 4.34Å; Y403-E405 HydrophobicContact CD1-CG 4.19Å; Y403-E405 HydrophobicContact CE1-CG 4.27Å; Y403-E405 PolarHBondContact O-N 2.88Å
406	M	53.8	Low	67.3	Low	106 Å²	106	89.3 Å²	89.3	52%	0.522	47%	0.465	S	S	.	.			trans	-55.1	131.3	173.3	-80.7	-171.9	-75.7	0	0	107.6	F404 S408	F404-M406 PolarHBondContact O-N 2.9Å; M406-S408 PolarHBondContact O-N 2.89Å; M406-S408 VanDerWaalsContact O-N 3.16Å
407	P	56.1	Low	68.6	Low	91 Å²	91	88.2 Å²	88.2	59%	0.591	45%	0.453	S	S	*	.			trans	-54.5	126.3	178.9	-22.1	30.2	0	0	0	109.7	D409	P407-D409 PolarHBondContact O-N 2.76Å
408	S	57.9	Low	70.3	Confident	111 Å²	111	80.3 Å²	80.3	78%	0.776	42%	0.423	S	S	*	.	S	Bend	trans	-60.5	-24.3	178.8	-53.6	0	0	0	0	112.8	M406	M406-S408 PolarHBondContact O-N 2.89Å; M406-S408 VanDerWaalsContact O-N 3.16Å
409	D	65.6	Low	71.9	Confident	123 Å²	123	79.5 Å²	79.5	66%	0.658	42%	0.423	S	S	*	.			trans	-112.2	64.1	-170.8	-56.8	-38.9	0	0	0	111.5	P407 E411	P407-D409 PolarHBondContact O-N 2.76Å; D409-E411 PolarHBondContact O-N 3.27Å
410	L	82	Confident	73.3	Confident	25 Å²	25	75.7 Å²	75.7	13%	0.131	40%	0.399	C	S	.	.			trans	-78.6	103.4	174.6	-169.5	70.8	0	0	0	110.1	L92 L152 L257	L92-L410 HydrophobicContact CD1-CD1 4Å; L92-L410 HydrophobicContact CD1-CD2 4Å; L92-L410 HydrophobicContact CD1-CG 3.71Å; L92-L410 HydrophobicContact CD2-CD1 3.26Å; L92-L410 HydrophobicContact CD2-CG 3.75Å; L92-L410 HydrophobicContact CG-CD1 4.12Å; L92-L410 HydrophobicContact CG-CG 4.32Å; L152-L410 HydrophobicContact CD1-CD1 4.13Å; L152-L410 HydrophobicContact CD2-CD1 3.83Å; L152-L410 HydrophobicContact CD2-CD2 3.64Å; L152-L410 HydrophobicContact CD2-CG 4.43Å; L257-L410 HydrophobicContact CB-CB 4.22Å; L257-L410 HydrophobicContact CB-CD2 3.9Å; L257-L410 HydrophobicContact CB-CG 4.26Å; L257-L410 HydrophobicContact CD1-CD2 3.38Å; L257-L410 HydrophobicContact CD1-CG 3.86Å; L257-L410 HydrophobicContact CG-CD2 4.26Å; L257-L410 PolarHBondContact N-O 2.99Å
411	E	87.7	Confident	74.8	Confident	41 Å²	41	74.5 Å²	74.5	19%	0.192	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.5	-178	-65.5	-174.8	164	0	0	112.5	R90 L92 I255 D409	R90-E411 IonicContact NH1-OE2 3.26Å; R90-E411 PolarHBondContact NH1-OE2 2.73Å; L92-E411 WeakPolarHBondContact CD2-O 3.41Å; I255-E411 WeakPolarHBondContact O-CA 3.2Å; D409-E411 PolarHBondContact O-N 3.27Å
412	A	90.6	Very high	76.5	Confident	6 Å²	6	73.1 Å²	73.1	5%	0.05	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.4	173.1	0	0	0	0	0	110.7	L92 C155 Q254 I255	L92-A412 HydrophobicContact CD1-CB 3.87Å; L92-A412 HydrophobicContact CG-CB 3.93Å; C155-A412 HydrophobicContact CB-CB 4.37Å; Q254-A412 CarbonylContact C-O 3.56Å; I255-A412 PolarHBondContact N-O 2.85Å; I255-A412 PolarHBondContact O-N 3.23Å
413	D	93.3	Very high	78	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.091	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.5	171.8	-63.5	-27.9	0	0	0	110.3	E89 R90 Q254	E89-D413 WeakPolarHBondContact CA-OD2 3.24Å; E89-D413 HydrophobicContact CB-CB 3.93Å; E89-D413 HydrophobicContact CG-CB 4.27Å; R90-D413 WeakPolarHBondContact CB-OD2 3.49Å; R90-D413 PolarHBondContact N-OD2 2.99Å; R90-D413 PolarHBondContact O-N 2.87Å; Q254-D413 WeakPolarHBondContact CG-OD1 3.4Å; Q254-D413 PolarHBondContact NE2-OD1 2.04Å
414	V	94.3	Very high	78.9	Confident	10 Å²	10	65.5 Å²	65.5	6%	0.061	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.1	177.2	-65.8	0	0	0	0	110.9	C155 Y157 H252 C253 I255	C155-V414 HydrophobicContact CB-CG1 4.11Å; Y157-V414 HydrophobicContact CD1-CG2 4.31Å; Y157-V414 HydrophobicContact CG-CG2 4.26Å; H252-V414 WeakPolarHBondContact CA-O 3.47Å; C253-V414 HydrophobicContact CB-CG2 4.07Å; C253-V414 PolarHBondContact N-O 2.9Å; C253-V414 PolarHBondContact O-N 2.75Å; I255-V414 HydrophobicContact CD1-CB 4.46Å; I255-V414 HydrophobicContact CD1-CG1 3.86Å; I255-V414 HydrophobicContact CD1-CG2 3.71Å; I255-V414 HydrophobicContact CG1-CG2 4.1Å
415	S	93	Very high	78.9	Confident	23 Å²	23	64.2 Å²	64.2	16%	0.161	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.3	177	-36.7	0	0	0	0	113.2	E89 F251 H252	E89-S415 WeakPolarHBondContact OE1-CB 3.24Å; E89-S415 PolarHBondContact OE1-OG 3.2Å; F251-S415 CarbonylContact O-C 3.52Å; F251-S415 WeakPolarHBondContact O-CA 3.28Å; F251-S415 WeakPolarHBondContact O-CB 3.27Å; H252-S415 PolarHBondContact ND1-OG 3.47Å
416	Q	93.6	Very high	78.8	Confident	19 Å²	19	63.2 Å²	63.2	9%	0.089	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	134.4	174.5	-172.1	68.4	-80.1	0	0	111.3	Y157 L159 Q250 F251	Y157-Q416 HydrophobicContact CD1-CB 3.71Å; Y157-Q416 HydrophobicContact CE1-CB 3.58Å; Y157-Q416 HydrophobicContact CG-CB 4.4Å; Y157-Q416 PolarHBondContact O-NE2 3.12Å; L159-Q416 HydrophobicContact CB-CG 4.47Å; L159-Q416 HydrophobicContact CD1-CB 4.48Å; L159-Q416 HydrophobicContact CD1-CG 3.83Å; L159-Q416 HydrophobicContact CG-CG 3.9Å; Q250-Q416 CarbonylContact C-O 3.59Å; Q250-Q416 WeakPolarHBondContact CA-O 3.22Å; F251-Q416 PolarHBondContact N-O 3.48Å; F251-Q416 PolarHBondContact O-N 3.33Å
417	E	92	Very high	78.2	Confident	52 Å²	52	61 Å²	61	24%	0.243	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.8	174.6	-174.7	-172.4	159.2	0	0	110.5	R61 V249	R61-E417 IonicContact CZ-OE1 3.17Å; R61-E417 IonicContact NH1-OE1 3.28Å; R61-E417 PolarHBondContact NH1-OE1 3.33Å; R61-E417 IonicContact NH1-OE2 3.78Å; R61-E417 IonicContact NH2-OE1 2.9Å; R61-E417 PolarHBondContact NH2-OE1 3.34Å; V249-E417 WeakPolarHBondContact O-CA 3.2Å
418	I	93.5	Very high	77.4	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.015	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142	173.2	-171.2	169.4	0	0	0	110.9	L159 V169 A172 V249 F251 V420	L159-I418 HydrophobicContact CD1-CB 3.91Å; L159-I418 HydrophobicContact CD1-CD1 4.13Å; L159-I418 HydrophobicContact CD1-CG2 4.12Å; V169-I418 HydrophobicContact CB-CD1 4.46Å; V169-I418 HydrophobicContact CG1-CD1 3.53Å; V169-I418 HydrophobicContact CG1-CG1 4.29Å; A172-I418 HydrophobicContact CB-CD1 3.78Å; V249-I418 HydrophobicContact CB-CG2 4.14Å; V249-I418 PolarHBondContact N-O 2.78Å; V249-I418 PolarHBondContact O-N 2.88Å; F251-I418 HydrophobicContact CD2-CG2 4.45Å; F251-I418 HydrophobicContact CE2-CG2 3.87Å; I418-V420 HydrophobicContact CG2-CG2 4.15Å
419	L	92.2	Very high	76.6	Confident	73 Å²	73	62 Å²	62	38%	0.382	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.6	170	-66.6	174.3	0	0	0	110.1	R170 Y171 A172 L247 A248	R170-L419 PolarHBondContact O-N 3.39Å; Y171-L419 CarbonylContact C-O 3.45Å; Y171-L419 WeakPolarHBondContact CA-O 3.3Å; A172-L419 PolarHBondContact N-O 2.92Å; L247-L419 CarbonylContact O-C 3.58Å; L247-L419 WeakPolarHBondContact O-CA 3.04Å; A248-L419 HydrophobicContact CB-CD2 3.9Å
420	V	92	Very high	75.5	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.1	179.2	-171.7	0	0	0	0	109.7	A172 I174 V240 K242 L247 V249 I418	A172-V420 CarbonylContact O-C 3.51Å; A172-V420 VanDerWaalsContact O-CA 3.31Å; A172-V420 WeakPolarHBondContact O-CA 3.35Å; I174-V420 HydrophobicContact CG1-CG1 3.63Å; V240-V420 HydrophobicContact CG1-CB 4.3Å; V240-V420 HydrophobicContact CG1-CG1 3.64Å; V240-V420 HydrophobicContact CG1-CG2 3.73Å; K242-V420 HydrophobicContact CB-CB 3.9Å; K242-V420 HydrophobicContact CB-CG1 3.97Å; K242-V420 HydrophobicContact CB-CG2 4.09Å; K242-V420 HydrophobicContact CD-CB 3.87Å; K242-V420 HydrophobicContact CD-CG1 3.75Å; K242-V420 HydrophobicContact CG-CB 4.32Å; K242-V420 HydrophobicContact CG-CG1 4.03Å; L247-V420 WeakPolarHBondContact CD2-O 3.16Å; L247-V420 PolarHBondContact O-N 3.09Å; V249-V420 HydrophobicContact CB-CG2 4.38Å; V249-V420 HydrophobicContact CG2-CG2 3.88Å; I418-V420 HydrophobicContact CG2-CG2 4.15Å
421	L	89.3	Confident	73.4	Confident	85 Å²	85	69.6 Å²	69.6	45%	0.445	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	136	177.6	-57.4	178.2	0	0	0	109.8	A172 R173 I174	A172-L421 PolarHBondContact O-N 2.76Å; R173-L421 WeakPolarHBondContact CA-O 3.46Å; R173-L421 HydrophobicContact CG-CB 4.14Å; I174-L421 PolarHBondContact N-O 3.28Å
422	D	86.7	Confident	71.1	Confident	92 Å²	92	75.1 Å²	75.1	49%	0.492	45%	0.453	S	S	.	.			trans	-63	146.9	171.1	-68.5	-54.8	0	0	0	110.4	K242 G424	K242-D422 WeakPolarHBondContact CE-OD1 3.33Å; K242-D422 IonicContact NZ-OD1 3.09Å; K242-D422 PolarHBondContact NZ-OD1 3Å; K242-D422 IonicContact NZ-OD2 3.39Å; K242-D422 PolarHBondContact NZ-OD2 3.02Å; D422-G424 VanDerWaalsContact C-N 3.34Å; D422-G424 PolarHBondContact O-N 3.07Å
423	V	80.5	Confident	68.8	Low	96 Å²	96	82.2 Å²	82.2	58%	0.582	49%	0.49	S	S	*	.			trans	-65.6	102.2	166.5	-177.9	0	0	0	0	106	I174 D425	I174-V423 HydrophobicContact CB-CG2 4.29Å; V423-D425 PolarHBondContact O-N 3.09Å
424	G	67.3	Low	66.2	Low	52 Å²	52	90.5 Å²	90.5	54%	0.536	53%	0.529	S	S	.	.			trans	-59.5	132.4	171.3	0	0	0	0	0	108.6	D422 T426	D422-G424 VanDerWaalsContact C-N 3.34Å; D422-G424 PolarHBondContact O-N 3.07Å; G424-T426 PolarHBondContact O-N 3.33Å
425	D	47.1	Very low	63.4	Low	156 Å²	156	99.5 Å²	99.5	83%	0.834	57%	0.567	S	S	*	*			trans	-55.9	90.8	168.8	-84.7	-25.1	0	0	0	108.8	V423 G427	V423-D425 PolarHBondContact O-N 3.09Å; D425-G427 PolarHBondContact O-N 2.59Å
426	T	46.2	Very low	60.9	Low	146 Å²	146	103 Å²	103	90%	0.896	59%	0.589	S	S	*	*			trans	-77.8	70.9	160.5	41.9	0	0	0	0	106.3	G424	G424-T426 PolarHBondContact O-N 3.33Å
427	G	40.9	Very low	58.3	Low	58 Å²	58	107.6 Å²	107.6	60%	0.598	61%	0.614	S	S	*	*			trans	177.6	63	-173.5	0	0	0	0	0	115.6	D425	D425-G427 PolarHBondContact O-N 2.59Å
428	S	40.4	Very low	55.9	Low	116 Å²	116	112.4 Å²	112.4	81%	0.811	64%	0.64	S	S	*	*	S	Bend	trans	-171.7	56	143.3	54.1	0	0	0	0	113.2
429	S	40.8	Very low	53.8	Low	109 Å²	109	122.4 Å²	122.4	76%	0.762	68%	0.678	S	S	*	*	S	Bend	trans	-167.8	131.1	144.7	-144.5	0	0	0	0	111.4
430	L	41	Very low	51.5	Low	153 Å²	153	123.9 Å²	123.9	80%	0.801	68%	0.684	S	S	*	*	S	Bend	trans	86.4	90.2	163.2	-49.6	176.3	0	0	0	116.1
431	N	38.9	Very low	49.2	Very low	153 Å²	153	128.6 Å²	128.6	82%	0.818	71%	0.714	S	S	*	*			trans	33.8	117.4	142.3	-63.1	-19.9	0	0	0	117.8	D433	N431-D433 PolarHBondContact O-N 2.84Å
432	D	39.5	Very low	47.7	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	72%	0.724	S	S	*	*	S	Bend	trans	-38	105.8	151.3	-59.9	-63.1	0	0	0	110.6
433	D	42	Very low	46.3	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	74%	0.743	S	S	*	*	S	Bend	trans	165.2	69.6	147	-82.4	-30.1	0	0	0	108.8	N431	N431-D433 PolarHBondContact O-N 2.84Å
434	E	39.1	Very low	44.9	Very low	191 Å²	191	138 Å²	138	89%	0.893	74%	0.739	S	S	*	*			trans	166	107.2	143.7	-97.8	176.2	129.4	0	0	107.4	P436	E434-P436 WeakPolarHBondContact O-CD 3.49Å
435	K	34.6	Very low	44.2	Very low	198 Å²	198	138.2 Å²	138.2	86%	0.861	74%	0.736	S	S	*	*			trans	-86.7	103	171.5	176.7	-176.9	-179.3	179.8	0	108.1
436	P	40.5	Very low	44.4	Very low	97 Å²	97	139.2 Å²	139.2	63%	0.63	74%	0.736	S	S	*	*			trans	-80.2	129.1	156.1	32.1	-29.6	0	0	0	107.9	E434 I438	E434-P436 WeakPolarHBondContact O-CD 3.49Å; P436-I438 HydrophobicContact CG-CG1 4.49Å; P436-I438 PolarHBondContact O-N 2.88Å
437	D	39.2	Very low	44.8	Very low	116 Å²	116	140.5 Å²	140.5	62%	0.62	73%	0.732	S	S	*	*			trans	-65.1	96.7	170.1	-170.9	10.4	0	0	0	108.7	R439	D437-R439 PolarHBondContact O-N 3.26Å
438	I	42.7	Very low	45.1	Very low	153 Å²	153	145.2 Å²	145.2	79%	0.785	74%	0.738	S	S	*	*			trans	-81.7	72.3	175	-52.5	177.5	0	0	0	107.8	P436	P436-I438 HydrophobicContact CG-CG1 4.49Å; P436-I438 PolarHBondContact O-N 2.88Å
439	R	48.5	Very low	45.4	Very low	213 Å²	213	146.7 Å²	146.7	80%	0.804	74%	0.736	S	S	*	*			trans	-119.2	73.1	162.2	-83.1	-178.5	167.1	172.4	-3.4	108.5	D437	D437-R439 PolarHBondContact O-N 3.26Å
440	M	44.3	Very low	45.4	Very low	103 Å²	103	146.6 Å²	146.6	51%	0.507	73%	0.733	S	S	.	*			trans	-140.5	132.1	165.7	-86.3	-176.3	-79.2	0	0	111.7	E444	M440-E444 HydrophobicContact SD-CB 4.39Å
441	P	44.6	Very low	46	Very low	100 Å²	100	148.4 Å²	148.4	65%	0.649	74%	0.737	S	S	*	*			trans	-67.3	152.9	178.5	24.7	-30.2	0	0	0	112.3	R443 E444	P441-R443 PolarHBondContact O-N 2.79Å; P441-E444 PolarHBondContact O-N 2.83Å
442	I	57.7	Low	46.9	Very low	127 Å²	127	146.1 Å²	146.1	65%	0.651	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.4	-20.4	-165.4	-62.6	176.6	0	0	0	114.8	E444	I442-E444 VanDerWaalsContact C-N 3.35Å; I442-E444 PolarHBondContact O-N 2.97Å
443	R	55.8	Low	47.2	Very low	238 Å²	238	145 Å²	145	90%	0.898	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-30.4	179.4	-160.1	171.4	179.9	158.6	-0.8	113.4	P441	P441-R443 PolarHBondContact O-N 2.79Å
444	E	51.4	Low	47.2	Very low	105 Å²	105	147.9 Å²	147.9	49%	0.491	73%	0.727	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	-23.1	178.7	-71.7	171.4	171.2	0	0	112.7	M440 P441 I442 Q446 E447	M440-E444 HydrophobicContact SD-CB 4.39Å; P441-E444 PolarHBondContact O-N 2.83Å; I442-E444 VanDerWaalsContact C-N 3.35Å; I442-E444 PolarHBondContact O-N 2.97Å; E444-Q446 PolarHBondContact O-N 3.03Å; E444-E447 PolarHBondContact O-N 2.96Å
445	A	52.2	Low	47.8	Very low	58 Å²	58	149 Å²	149	48%	0.479	72%	0.723	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60	-17.1	176.2	0	0	0	0	0	113.7	E447	A445-E447 VanDerWaalsContact C-N 3.31Å
446	Q	51.4	Low	48.8	Very low	177 Å²	177	144.5 Å²	144.5	83%	0.827	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-13.7	174	-65.8	-144.3	-81.5	0	0	114.1	E444	E444-Q446 PolarHBondContact O-N 3.03Å
447	E	54.6	Low	50	Low	173 Å²	173	145.8 Å²	145.8	81%	0.808	72%	0.721	S	S	*	*	S	Bend	trans	-101.5	-8.5	-169.6	-129.8	165.1	-175.4	0	0	115.4	E444 A445	E444-E447 PolarHBondContact O-N 2.96Å; A445-E447 VanDerWaalsContact C-N 3.31Å
448	Q	48.1	Very low	50.9	Low	156 Å²	156	143.8 Å²	143.8	73%	0.729	71%	0.71	S	S	*	*			trans	-122.2	19.5	-177.2	-86.2	164.5	-35.7	0	0	115.9
449	L	46.7	Very low	52.2	Low	147 Å²	147	141.6 Å²	141.6	77%	0.77	70%	0.704	S	S	*	*	S	Bend	trans	-66.4	134.4	167.2	-111.5	93.2	0	0	0	110.8
450	P	40.4	Very low	53.3	Low	108 Å²	108	136.6 Å²	136.6	70%	0.701	70%	0.702	S	S	*	*			trans	-61.6	139.5	-171	23.1	-32.5	0	0	0	112.6	S452	P450-S452 PolarHBondContact O-N 3.01Å
451	E	53.8	Low	54.9	Low	190 Å²	190	134 Å²	134	89%	0.888	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-56.9	1.5	-168.4	-90	-173.1	143.4	0	0	117.2	N453	E451-N453 PolarHBondContact O-N 2.86Å
452	S	59	Low	56.4	Low	106 Å²	106	130.6 Å²	130.6	74%	0.741	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-80.1	-14.1	-176.8	-174.8	0	0	0	0	114.9	P450	P450-S452 PolarHBondContact O-N 3.01Å
453	N	45.8	Very low	57.4	Low	132 Å²	132	129.1 Å²	129.1	71%	0.706	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-138.3	41.9	-176.9	-84.7	-30.9	0	0	0	113.6	E451 R455	E451-N453 PolarHBondContact O-N 2.86Å; N453-R455 PolarHBondContact O-N 3.18Å
454	R	41.3	Very low	58.4	Low	217 Å²	217	120.6 Å²	120.6	82%	0.819	66%	0.655	S	S	*	*			trans	-65.5	85	167.6	-163	176.5	-172.7	-173.7	3.7	109.5	V456	R454-V456 PolarHBondContact O-N 2.04Å
455	R	51.9	Low	59.8	Low	215 Å²	215	118.4 Å²	118.4	81%	0.811	66%	0.655	S	S	*	*			trans	-68.1	98	167.2	-63.4	-174	-167.8	-176	5.3	106.4	N453 C457	N453-R455 PolarHBondContact O-N 3.18Å; R455-C457 PolarHBondContact O-N 2.95Å
456	V	55.6	Low	61.5	Low	104 Å²	104	120 Å²	120	63%	0.63	66%	0.659	S	S	*	*			trans	-65.9	105.4	171.7	-177.1	0	0	0	0	107	R454 L458	R454-V456 PolarHBondContact O-N 2.04Å; V456-L458 VanDerWaalsContact C-N 3.27Å; V456-L458 HydrophobicContact CG1-CD2 4.35Å; V456-L458 HydrophobicContact CG1-CG 4.08Å; V456-L458 PolarHBondContact O-N 3.24Å
457	C	65	Low	63.2	Low	123 Å²	123	114.8 Å²	114.8	83%	0.831	64%	0.639	S	S	*	*			trans	-68.6	86.7	171.1	-68.4	0	0	0	0	108.7	R455	R455-C457 PolarHBondContact O-N 2.95Å
458	L	57.9	Low	64.7	Low	75 Å²	75	109.9 Å²	109.9	39%	0.393	62%	0.624	S	S	.	*			trans	-74.8	125.5	166.7	-73.8	165.9	0	0	0	107.6	V456 A462 L463 V466	V456-L458 VanDerWaalsContact C-N 3.27Å; V456-L458 HydrophobicContact CG1-CD2 4.35Å; V456-L458 HydrophobicContact CG1-CG 4.08Å; V456-L458 PolarHBondContact O-N 3.24Å; L458-A462 HydrophobicContact CB-CB 3.94Å; L458-A462 HydrophobicContact CD2-CB 3.59Å; L458-A462 HydrophobicContact CG-CB 4.29Å; L458-L463 HydrophobicContact CB-CD2 3.94Å; L458-L463 HydrophobicContact CB-CG 3.83Å; L458-L463 HydrophobicContact CD1-CD2 4.13Å; L458-V466 HydrophobicContact CD1-CG2 4.4Å
459	T	70.6	Confident	66.6	Low	106 Å²	106	104.2 Å²	104.2	65%	0.65	61%	0.607	S	S	*	*			trans	-55.5	155.3	170.9	60.4	0	0	0	0	109.4	G461 A462 L463	T459-G461 PolarHBondContact O-N 3.38Å; T459-A462 PolarHBondContact O-N 2.93Å; T459-L463 PolarHBondContact O-N 3.41Å; T459-L463 VanDerWaalsContact O-N 3.13Å
460	S	72.1	Confident	68.7	Low	109 Å²	109	103.4 Å²	103.4	76%	0.762	60%	0.597	S	S	*	*	H	α-helix	trans	-49.9	-35.3	-176.7	53.1	0	0	0	0	113.2	A464	S460-A464 PolarHBondContact O-N 2.68Å
461	G	76.4	Confident	71	Confident	47 Å²	47	100.7 Å²	100.7	49%	0.485	58%	0.579	S	S	.	*	H	α-helix	trans	-66.4	-40	174.6	0	0	0	0	0	114	T459 A464 A465	T459-G461 PolarHBondContact O-N 3.38Å; G461-A464 PolarHBondContact O-N 2.96Å; G461-A465 PolarHBondContact O-N 3.05Å; G461-A465 VanDerWaalsContact O-N 3.08Å
462	A	75.8	Confident	72.7	Confident	30 Å²	30	98 Å²	98	25%	0.248	56%	0.564	C	S	.	*	H	α-helix	trans	-73.2	-34.2	-179.3	0	0	0	0	0	112.2	L458 T459 A465 V466	L458-A462 HydrophobicContact CB-CB 3.94Å; L458-A462 HydrophobicContact CD2-CB 3.59Å; L458-A462 HydrophobicContact CG-CB 4.29Å; T459-A462 PolarHBondContact O-N 2.93Å; A462-A465 PolarHBondContact O-N 2.9Å; A462-V466 WeakPolarHBondContact O-CG2 3.2Å; A462-V466 PolarHBondContact O-N 2.91Å; A462-V466 VanDerWaalsContact O-N 3.1Å
463	L	78.7	Confident	74.3	Confident	95 Å²	95	96.7 Å²	96.7	50%	0.497	55%	0.552	S	S	.	*	H	α-helix	trans	-61.9	-44.2	169.8	-72.6	173.1	0	0	0	111.8	L458 T459 A465 V466 V467	L458-L463 HydrophobicContact CB-CD2 3.94Å; L458-L463 HydrophobicContact CB-CG 3.83Å; L458-L463 HydrophobicContact CD1-CD2 4.13Å; T459-L463 PolarHBondContact O-N 3.41Å; T459-L463 VanDerWaalsContact O-N 3.13Å; L463-A465 VanDerWaalsContact C-N 3.32Å; L463-A465 PolarHBondContact O-N 2.87Å; L463-V466 PolarHBondContact O-N 2.93Å; L463-V467 VanDerWaalsContact O-CG2 3.29Å; L463-V467 WeakPolarHBondContact O-CG2 3.36Å; L463-V467 PolarHBondContact O-N 2.83Å
464	A	78.1	Confident	76.4	Confident	59 Å²	59	92.2 Å²	92.2	49%	0.488	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-37.2	177.7	0	0	0	0	0	112.6	S460 G461 S468	S460-A464 PolarHBondContact O-N 2.68Å; G461-A464 PolarHBondContact O-N 2.96Å; A464-S468 WeakPolarHBondContact O-CB 3.28Å; A464-S468 PolarHBondContact O-N 2.84Å; A464-S468 PolarHBondContact O-OG 2.98Å
465	A	80.8	Confident	78.8	Confident	60 Å²	60	85.9 Å²	85.9	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-65.3	-43.4	175.2	0	0	0	0	0	112.4	G461 A462 L463 S468 G469	G461-A465 PolarHBondContact O-N 3.05Å; G461-A465 VanDerWaalsContact O-N 3.08Å; A462-A465 PolarHBondContact O-N 2.9Å; L463-A465 VanDerWaalsContact C-N 3.32Å; L463-A465 PolarHBondContact O-N 2.87Å; A465-S468 WeakPolarHBondContact CA-OG 3.46Å; A465-S468 PolarHBondContact O-N 2.86Å; A465-S468 PolarHBondContact O-OG 2.98Å; A465-G469 PolarHBondContact O-N 3.26Å
466	V	87.7	Confident	80.8	Confident	92 Å²	92	80 Å²	80	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-64.9	-44.3	177.5	174.7	0	0	0	0	111.1	L458 A462 L463 G469 F470	L458-V466 HydrophobicContact CD1-CG2 4.4Å; A462-V466 WeakPolarHBondContact O-CG2 3.2Å; A462-V466 PolarHBondContact O-N 2.91Å; A462-V466 VanDerWaalsContact O-N 3.1Å; L463-V466 PolarHBondContact O-N 2.93Å; V466-G469 PolarHBondContact O-N 2.94Å; V466-F470 PolarHBondContact O-N 3.23Å
467	V	87.5	Confident	82.6	Confident	66 Å²	66	80.4 Å²	80.4	40%	0.4	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-44.6	178.6	175.1	0	0	0	0	111.1	L463 F470 V471	L463-V467 VanDerWaalsContact O-CG2 3.29Å; L463-V467 WeakPolarHBondContact O-CG2 3.36Å; L463-V467 PolarHBondContact O-N 2.83Å; V467-F470 PolarHBondContact O-N 3.16Å; V467-V471 HydrophobicContact CG1-CG2 4.46Å; V467-V471 VanDerWaalsContact O-CG2 3.3Å; V467-V471 WeakPolarHBondContact O-CG2 3.32Å; V467-V471 PolarHBondContact O-N 2.85Å
468	S	85.6	Confident	83.9	Confident	71 Å²	71	77.4 Å²	77.4	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-39.8	178.3	58.5	0	0	0	0	112.8	A464 A465 F470 V471 F472	A464-S468 WeakPolarHBondContact O-CB 3.28Å; A464-S468 PolarHBondContact O-N 2.84Å; A464-S468 PolarHBondContact O-OG 2.98Å; A465-S468 WeakPolarHBondContact CA-OG 3.46Å; A465-S468 PolarHBondContact O-N 2.86Å; A465-S468 PolarHBondContact O-OG 2.98Å; S468-F470 PolarHBondContact O-N 3.05Å; S468-V471 PolarHBondContact O-N 3.27Å; S468-F472 WeakPolarHBondContact O-CB 3.38Å; S468-F472 PolarHBondContact O-N 2.77Å
469	G	88.1	Confident	85.6	Confident	36 Å²	36	78.3 Å²	78.3	37%	0.371	48%	0.478	S	S	.	.	H	α-helix	trans	-60.4	-43.8	172.9	0	0	0	0	0	112.6	A465 V466 F472 V473	A465-G469 PolarHBondContact O-N 3.26Å; V466-G469 PolarHBondContact O-N 2.94Å; G469-F472 PolarHBondContact O-N 2.88Å; G469-V473 WeakPolarHBondContact O-CG2 3.42Å; G469-V473 PolarHBondContact O-N 3.11Å; G469-V473 VanDerWaalsContact O-N 3.11Å
470	F	89.8	Confident	86.5	Confident	130 Å²	130	75.8 Å²	75.8	57%	0.57	47%	0.468	S	S	*	.	H	α-helix	trans	-65.2	-42.3	178.3	-156.1	-94.2	0	0	0	112.2	L12 V466 V467 S468 F472 V473 V474	L12-F470 HydrophobicContact CD2-CE1 4.07Å; V466-F470 PolarHBondContact O-N 3.23Å; V467-F470 PolarHBondContact O-N 3.16Å; S468-F470 PolarHBondContact O-N 3.05Å; F470-F472 VanDerWaalsContact C-N 3.32Å; F470-F472 PolarHBondContact O-N 3.09Å; F470-V473 PolarHBondContact O-N 2.89Å; F470-V474 HydrophobicContact CD1-CG2 4.17Å; F470-V474 HydrophobicContact CE1-CG2 4.14Å; F470-V474 WeakPolarHBondContact O-CG2 3.1Å; F470-V474 PolarHBondContact O-N 3.25Å; F470-V474 VanDerWaalsContact O-N 3.09Å
471	V	90.1	Very high	87.5	Confident	52 Å²	52	74.8 Å²	74.8	32%	0.315	46%	0.457	S	S	.	.	H	α-helix	trans	-61.6	-41.4	175.6	173.2	0	0	0	0	111	V467 S468 V473 V474 I475	V467-V471 HydrophobicContact CG1-CG2 4.46Å; V467-V471 VanDerWaalsContact O-CG2 3.3Å; V467-V471 WeakPolarHBondContact O-CG2 3.32Å; V467-V471 PolarHBondContact O-N 2.85Å; S468-V471 PolarHBondContact O-N 3.27Å; V471-V473 PolarHBondContact O-N 3.16Å; V471-V474 PolarHBondContact O-N 3.1Å; V471-I475 HydrophobicContact CG1-CD1 3.91Å; V471-I475 HydrophobicContact CG1-CG1 4.5Å; V471-I475 WeakPolarHBondContact O-CG1 3.03Å; V471-I475 PolarHBondContact O-N 3.13Å
472	F	89.1	Confident	88.2	Confident	132 Å²	132	78.3 Å²	78.3	58%	0.579	46%	0.459	S	S	*	.	H	α-helix	trans	-61.7	-43.5	177.8	-168.8	-103.8	0	0	0	112.1	S468 G469 F470 V474 I475 L476	S468-F472 WeakPolarHBondContact O-CB 3.38Å; S468-F472 PolarHBondContact O-N 2.77Å; G469-F472 PolarHBondContact O-N 2.88Å; F470-F472 VanDerWaalsContact C-N 3.32Å; F470-F472 PolarHBondContact O-N 3.09Å; F472-V474 PolarHBondContact O-N 2.95Å; F472-I475 PolarHBondContact O-N 3.02Å; F472-L476 HydrophobicContact CD1-CD1 3.86Å; F472-L476 HydrophobicContact CD1-CG 4.33Å; F472-L476 HydrophobicContact CE1-CD1 3.57Å; F472-L476 HydrophobicContact CE1-CG 4.14Å; F472-L476 HydrophobicContact CZ-CD1 4.33Å; F472-L476 HydrophobicContact CZ-CD2 4.5Å; F472-L476 WeakPolarHBondContact O-CG 3.17Å; F472-L476 PolarHBondContact O-N 3.18Å
473	V	91.8	Very high	88.8	Confident	79 Å²	79	80.5 Å²	80.5	48%	0.479	47%	0.469	S	S	.	.	H	α-helix	trans	-62.5	-42.6	176.5	174.5	0	0	0	0	111.5	G469 F470 V471 I475 L476 L477	G469-V473 WeakPolarHBondContact O-CG2 3.42Å; G469-V473 PolarHBondContact O-N 3.11Å; G469-V473 VanDerWaalsContact O-N 3.11Å; F470-V473 PolarHBondContact O-N 2.89Å; V471-V473 PolarHBondContact O-N 3.16Å; V473-I475 VanDerWaalsContact C-N 3.34Å; V473-I475 PolarHBondContact O-N 3.06Å; V473-L476 PolarHBondContact O-N 2.85Å; V473-L477 HydrophobicContact CG1-CD1 4.16Å; V473-L477 WeakPolarHBondContact O-CG 3.22Å; V473-L477 PolarHBondContact O-N 3.07Å
474	V	91.3	Very high	89.3	Confident	39 Å²	39	82.6 Å²	82.6	24%	0.236	48%	0.478	C	S	.	.	H	α-helix	trans	-63.2	-40.4	177.8	173.9	0	0	0	0	111.4	F470 V471 F472 L477 S478	F470-V474 HydrophobicContact CD1-CG2 4.17Å; F470-V474 HydrophobicContact CE1-CG2 4.14Å; F470-V474 WeakPolarHBondContact O-CG2 3.1Å; F470-V474 PolarHBondContact O-N 3.25Å; F470-V474 VanDerWaalsContact O-N 3.09Å; V471-V474 PolarHBondContact O-N 3.1Å; F472-V474 PolarHBondContact O-N 2.95Å; V474-L477 PolarHBondContact O-N 3.02Å; V474-S478 WeakPolarHBondContact O-CB 3.21Å; V474-S478 PolarHBondContact O-N 3.11Å
475	I	91.7	Very high	89.8	Confident	84 Å²	84	84.4 Å²	84.4	43%	0.431	48%	0.479	S	S	.	.	H	α-helix	trans	-62.8	-46.6	176.2	-68.3	168	0	0	0	110.4	V471 F472 V473 L477 S478 L479	V471-I475 HydrophobicContact CG1-CD1 3.91Å; V471-I475 HydrophobicContact CG1-CG1 4.5Å; V471-I475 WeakPolarHBondContact O-CG1 3.03Å; V471-I475 PolarHBondContact O-N 3.13Å; F472-I475 PolarHBondContact O-N 3.02Å; V473-I475 VanDerWaalsContact C-N 3.34Å; V473-I475 PolarHBondContact O-N 3.06Å; I475-L477 VanDerWaalsContact C-N 3.34Å; I475-L477 PolarHBondContact O-N 2.96Å; I475-S478 PolarHBondContact O-N 2.92Å; I475-S478 PolarHBondContact O-OG 2.96Å; I475-L479 HydrophobicContact CG2-CD1 4.07Å; I475-L479 HydrophobicContact CG2-CG 4.49Å; I475-L479 WeakPolarHBondContact O-CG 3.49Å; I475-L479 PolarHBondContact O-N 3.42Å
476	L	93.6	Very high	90.1	Very high	91 Å²	91	85.1 Å²	85.1	48%	0.476	47%	0.474	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178	-70.1	179.5	0	0	0	112.4	F472 V473 L479 A480	F472-L476 HydrophobicContact CD1-CD1 3.86Å; F472-L476 HydrophobicContact CD1-CG 4.33Å; F472-L476 HydrophobicContact CE1-CD1 3.57Å; F472-L476 HydrophobicContact CE1-CG 4.14Å; F472-L476 HydrophobicContact CZ-CD1 4.33Å; F472-L476 HydrophobicContact CZ-CD2 4.5Å; F472-L476 WeakPolarHBondContact O-CG 3.17Å; F472-L476 PolarHBondContact O-N 3.18Å; V473-L476 PolarHBondContact O-N 2.85Å; L476-L479 PolarHBondContact O-N 2.73Å; L476-A480 WeakPolarHBondContact O-CB 3.38Å; L476-A480 PolarHBondContact O-N 3.47Å
477	L	93.2	Very high	89.9	Confident	112 Å²	112	87.6 Å²	87.6	59%	0.586	48%	0.477	S	S	*	.	H	α-helix	trans	-65	-41.2	176.4	-69.7	174.7	0	0	0	111.8	V473 V474 I475 L479 A480 V481	V473-L477 HydrophobicContact CG1-CD1 4.16Å; V473-L477 WeakPolarHBondContact O-CG 3.22Å; V473-L477 PolarHBondContact O-N 3.07Å; V474-L477 PolarHBondContact O-N 3.02Å; I475-L477 VanDerWaalsContact C-N 3.34Å; I475-L477 PolarHBondContact O-N 2.96Å; L477-L479 PolarHBondContact O-N 2.94Å; L477-A480 PolarHBondContact O-N 3.3Å; L477-V481 WeakPolarHBondContact O-CG2 3.34Å; L477-V481 PolarHBondContact O-N 3.49Å
478	S	91.3	Very high	89.6	Confident	61 Å²	61	92 Å²	92	43%	0.427	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-40.3	177.4	75	0	0	0	0	112.4	V474 I475 V481 F482	V474-S478 WeakPolarHBondContact O-CB 3.21Å; V474-S478 PolarHBondContact O-N 3.11Å; I475-S478 PolarHBondContact O-N 2.92Å; I475-S478 PolarHBondContact O-OG 2.96Å; S478-V481 PolarHBondContact O-N 3.1Å; S478-F482 WeakPolarHBondContact O-CB 3.47Å; S478-F482 PolarHBondContact O-N 3.46Å
479	L	93.5	Very high	89.3	Confident	94 Å²	94	94.3 Å²	94.3	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-41.7	175.3	-73.1	173	0	0	0	111.3	I475 L476 L477 V481 F482 V483	I475-L479 HydrophobicContact CG2-CD1 4.07Å; I475-L479 HydrophobicContact CG2-CG 4.49Å; I475-L479 WeakPolarHBondContact O-CG 3.49Å; I475-L479 PolarHBondContact O-N 3.42Å; L476-L479 PolarHBondContact O-N 2.73Å; L477-L479 PolarHBondContact O-N 2.94Å; L479-V481 VanDerWaalsContact C-N 3.34Å; L479-V481 PolarHBondContact O-N 3.45Å; L479-F482 PolarHBondContact O-N 2.05Å; L479-V483 VanDerWaalsContact O-CG2 3.32Å; L479-V483 WeakPolarHBondContact O-CG2 3.38Å; L479-V483 PolarHBondContact O-N 2.92Å
480	A	90.6	Very high	88.8	Confident	53 Å²	53	98.2 Å²	98.2	44%	0.438	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-43.5	175.7	0	0	0	0	0	111.9	L476 L477 V483 M484	L476-A480 WeakPolarHBondContact O-CB 3.38Å; L476-A480 PolarHBondContact O-N 3.47Å; L477-A480 PolarHBondContact O-N 3.3Å; A480-V483 PolarHBondContact O-N 3.19Å; A480-M484 VanDerWaalsContact O-CG 3.23Å; A480-M484 WeakPolarHBondContact O-CG 3.02Å; A480-M484 PolarHBondContact O-N 2.8Å
481	V	92.5	Very high	88.1	Confident	87 Å²	87	95 Å²	95	53%	0.527	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-42.5	174.9	173.7	0	0	0	0	111.1	L477 S478 L479 V483 M484 L485	L477-V481 WeakPolarHBondContact O-CG2 3.34Å; L477-V481 PolarHBondContact O-N 3.49Å; S478-V481 PolarHBondContact O-N 3.1Å; L479-V481 VanDerWaalsContact C-N 3.34Å; L479-V481 PolarHBondContact O-N 3.45Å; V481-V483 PolarHBondContact O-N 3.21Å; V481-M484 WeakPolarHBondContact O-CB 3.4Å; V481-M484 PolarHBondContact O-N 3.21Å; V481-L485 HydrophobicContact CG1-CD1 4.26Å; V481-L485 HydrophobicContact CG1-CG 4.47Å; V481-L485 WeakPolarHBondContact O-CG 3.47Å; V481-L485 PolarHBondContact O-N 3.3Å
482	F	91.3	Very high	87.2	Confident	122 Å²	122	99.7 Å²	99.7	54%	0.535	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-43.9	178.2	-173.3	-108.3	0	0	0	112.1	S478 L479 M484 L485 I486	S478-F482 WeakPolarHBondContact O-CB 3.47Å; S478-F482 PolarHBondContact O-N 3.46Å; L479-F482 PolarHBondContact O-N 2.05Å; F482-M484 VanDerWaalsContact C-N 3.34Å; F482-M484 PolarHBondContact O-N 3.09Å; F482-L485 PolarHBondContact O-N 3.13Å; F482-I486 HydrophobicContact CD1-CD1 3.71Å; F482-I486 HydrophobicContact CE1-CD1 3.32Å; F482-I486 HydrophobicContact CE1-CG1 4.28Å; F482-I486 HydrophobicContact CZ-CD1 3.82Å; F482-I486 HydrophobicContact CZ-CG1 4.42Å; F482-I486 WeakPolarHBondContact O-CG1 3.25Å; F482-I486 PolarHBondContact O-N 3.14Å
483	V	89.4	Confident	86.2	Confident	76 Å²	76	97 Å²	97	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-40.8	174.6	172.9	0	0	0	0	111.3	L479 A480 V481 L485 I486 K487	L479-V483 VanDerWaalsContact O-CG2 3.32Å; L479-V483 WeakPolarHBondContact O-CG2 3.38Å; L479-V483 PolarHBondContact O-N 2.92Å; A480-V483 PolarHBondContact O-N 3.19Å; V481-V483 PolarHBondContact O-N 3.21Å; V483-L485 VanDerWaalsContact C-N 3.33Å; V483-L485 PolarHBondContact O-N 3.42Å; V483-I486 PolarHBondContact O-N 2.85Å; V483-K487 WeakPolarHBondContact O-CG 2.98Å; V483-K487 PolarHBondContact O-N 3.13Å
484	M	87.9	Confident	84.9	Confident	139 Å²	139	99.4 Å²	99.4	69%	0.685	51%	0.512	S	S	*	.	H	α-helix	trans	-60.1	-41.8	173.5	-74.6	-93.3	-149.9	0	0	111.9	A480 V481 F482 K487 R488	A480-M484 VanDerWaalsContact O-CG 3.23Å; A480-M484 WeakPolarHBondContact O-CG 3.02Å; A480-M484 PolarHBondContact O-N 2.8Å; V481-M484 WeakPolarHBondContact O-CB 3.4Å; V481-M484 PolarHBondContact O-N 3.21Å; F482-M484 VanDerWaalsContact C-N 3.34Å; F482-M484 PolarHBondContact O-N 3.09Å; M484-K487 PolarHBondContact O-N 3.22Å; M484-R488 VanDerWaalsContact O-CB 3.29Å; M484-R488 WeakPolarHBondContact O-CB 3.35Å; M484-R488 PolarHBondContact O-N 2.83Å
485	L	88.2	Confident	83.2	Confident	97 Å²	97	104.6 Å²	104.6	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-66.4	-41.2	177.7	-70.7	174.2	0	0	0	112	V481 F482 V483 R488 H489	V481-L485 HydrophobicContact CG1-CD1 4.26Å; V481-L485 HydrophobicContact CG1-CG 4.47Å; V481-L485 WeakPolarHBondContact O-CG 3.47Å; V481-L485 PolarHBondContact O-N 3.3Å; F482-L485 PolarHBondContact O-N 3.13Å; V483-L485 VanDerWaalsContact C-N 3.33Å; V483-L485 PolarHBondContact O-N 3.42Å; L485-R488 PolarHBondContact O-N 3.17Å; L485-H489 WeakPolarHBondContact O-CB 3.36Å; L485-H489 PolarHBondContact O-N 3.14Å
486	I	87	Confident	81.4	Confident	74 Å²	74	107.4 Å²	107.4	38%	0.379	55%	0.548	S	S	.	.	H	α-helix	trans	-62.7	-48	174.7	-68.9	170.8	0	0	0	110.4	F482 V483 R488 H489 Q490	F482-I486 HydrophobicContact CD1-CD1 3.71Å; F482-I486 HydrophobicContact CE1-CD1 3.32Å; F482-I486 HydrophobicContact CE1-CG1 4.28Å; F482-I486 HydrophobicContact CZ-CD1 3.82Å; F482-I486 HydrophobicContact CZ-CG1 4.42Å; F482-I486 WeakPolarHBondContact O-CG1 3.25Å; F482-I486 PolarHBondContact O-N 3.14Å; V483-I486 PolarHBondContact O-N 2.85Å; I486-R488 VanDerWaalsContact C-N 3.3Å; I486-R488 PolarHBondContact O-N 2.79Å; I486-H489 PolarHBondContact O-N 2.9Å; I486-H489 VanDerWaalsContact O-N 3.14Å; I486-Q490 PolarHBondContact O-N 3.06Å
487	K	83.7	Confident	79.3	Confident	144 Å²	144	106.1 Å²	106.1	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-59.5	-41.3	176.6	-77	-171.8	174.8	-175.4	0	111.6	V483 M484 Q490 A491	V483-K487 WeakPolarHBondContact O-CG 2.98Å; V483-K487 PolarHBondContact O-N 3.13Å; M484-K487 PolarHBondContact O-N 3.22Å; K487-Q490 PolarHBondContact O-N 3.11Å; K487-A491 WeakPolarHBondContact O-CB 3.34Å; K487-A491 PolarHBondContact O-N 2.04Å
488	R	82.4	Confident	77.2	Confident	158 Å²	158	104.2 Å²	104.2	60%	0.596	56%	0.558	S	S	*	*	H	α-helix	trans	-64.9	-38.3	175.6	-171.4	177.8	-174.7	-179	2.6	112.2	M484 L485 I486 R492	M484-R488 VanDerWaalsContact O-CB 3.29Å; M484-R488 WeakPolarHBondContact O-CB 3.35Å; M484-R488 PolarHBondContact O-N 2.83Å; L485-R488 PolarHBondContact O-N 3.17Å; I486-R488 VanDerWaalsContact C-N 3.3Å; I486-R488 PolarHBondContact O-N 2.79Å; R488-R492 PolarHBondContact O-N 2.72Å; R488-R492 VanDerWaalsContact O-N 3.08Å
489	H	79.7	Confident	75.1	Confident	121 Å²	121	111.3 Å²	111.3	56%	0.56	58%	0.577	S	S	*	*	H	α-helix	trans	-67.4	-46	176.1	-169	-79	0	0	0	111.1	L485 I486 A491 R492 V493	L485-H489 WeakPolarHBondContact O-CB 3.36Å; L485-H489 PolarHBondContact O-N 3.14Å; I486-H489 PolarHBondContact O-N 2.9Å; I486-H489 VanDerWaalsContact O-N 3.14Å; H489-A491 VanDerWaalsContact C-N 3.32Å; H489-A491 PolarHBondContact O-N 2.86Å; H489-R492 WeakPolarHBondContact O-CB 3.34Å; H489-R492 PolarHBondContact O-N 2.91Å; H489-R492 VanDerWaalsContact O-N 3.1Å; H489-V493 WeakPolarHBondContact O-CG2 3.34Å; H489-V493 PolarHBondContact O-N 3.13Å
490	Q	77.5	Confident	72.8	Confident	117 Å²	117	111.7 Å²	111.7	55%	0.547	59%	0.587	S	S	.	*	H	α-helix	trans	-60.6	-40	174.7	-73.9	-170.2	-32.3	0	0	112.1	I486 K487 R492 V493 N494	I486-Q490 PolarHBondContact O-N 3.06Å; K487-Q490 PolarHBondContact O-N 3.11Å; Q490-R492 VanDerWaalsContact C-N 3.32Å; Q490-R492 PolarHBondContact O-N 2.93Å; Q490-V493 PolarHBondContact O-N 3.49Å; Q490-N494 WeakPolarHBondContact O-CB 3.4Å; Q490-N494 PolarHBondContact O-N 3.42Å
491	A	74.9	Confident	70.5	Confident	63 Å²	63	115.5 Å²	115.5	52%	0.521	61%	0.605	S	S	.	*	H	α-helix	trans	-60.4	-39.4	173.1	0	0	0	0	0	112.4	K487 H489 M495	K487-A491 WeakPolarHBondContact O-CB 3.34Å; K487-A491 PolarHBondContact O-N 2.04Å; H489-A491 VanDerWaalsContact C-N 3.32Å; H489-A491 PolarHBondContact O-N 2.86Å; A491-M495 PolarHBondContact O-N 2.93Å; A491-M495 VanDerWaalsContact O-N 3.16Å
492	R	70.3	Confident	67.9	Low	151 Å²	151	117.3 Å²	117.3	57%	0.57	62%	0.62	S	S	*	*	H	α-helix	trans	-67.1	-42.4	174.3	-79.3	-175.5	176.4	176.5	-1.5	112.8	R488 H489 Q490 M495 M496	R488-R492 PolarHBondContact O-N 2.72Å; R488-R492 VanDerWaalsContact O-N 3.08Å; H489-R492 WeakPolarHBondContact O-CB 3.34Å; H489-R492 PolarHBondContact O-N 2.91Å; H489-R492 VanDerWaalsContact O-N 3.1Å; Q490-R492 VanDerWaalsContact C-N 3.32Å; Q490-R492 PolarHBondContact O-N 2.93Å; R492-M495 PolarHBondContact O-N 3.11Å; R492-M496 PolarHBondContact O-N 2.78Å
493	V	69.1	Low	65.3	Low	75 Å²	75	123.5 Å²	123.5	46%	0.455	64%	0.64	S	S	.	*	H	α-helix	trans	-66	-41.5	179.4	176.6	0	0	0	0	110.8	H489 Q490 M495 M496 G497	H489-V493 WeakPolarHBondContact O-CG2 3.34Å; H489-V493 PolarHBondContact O-N 3.13Å; Q490-V493 PolarHBondContact O-N 3.49Å; V493-M495 PolarHBondContact O-N 3.31Å; V493-M496 PolarHBondContact O-N 3.01Å; V493-G497 PolarHBondContact O-N 2.8Å
494	N	63.1	Low	63	Low	129 Å²	129	124.5 Å²	124.5	69%	0.69	66%	0.656	S	S	*	*	H	α-helix	trans	-64.8	-28.2	174.8	-71	-5	0	0	0	112.4	Q490	Q490-N494 WeakPolarHBondContact O-CB 3.4Å; Q490-N494 PolarHBondContact O-N 3.42Å
495	M	55.8	Low	60.6	Low	148 Å²	148	129.4 Å²	129.4	73%	0.729	67%	0.669	S	S	*	*	H	α-helix	trans	-76.6	-34.5	174.2	-142.8	-172.2	-157	0	0	112.6	A491 R492 V493 A498	A491-M495 PolarHBondContact O-N 2.93Å; A491-M495 VanDerWaalsContact O-N 3.16Å; R492-M495 PolarHBondContact O-N 3.11Å; V493-M495 PolarHBondContact O-N 3.31Å; M495-A498 PolarHBondContact O-N 3.27Å
496	M	53.9	Low	57.9	Low	143 Å²	143	134 Å²	134	70%	0.704	69%	0.685	S	S	*	*	H	α-helix	trans	-74.4	-26.5	176.5	-72.9	-178.7	174.6	0	0	112.9	R492 V493 A498 Y499	R492-M496 PolarHBondContact O-N 2.78Å; V493-M496 PolarHBondContact O-N 3.01Å; M496-A498 PolarHBondContact O-N 3.22Å; M496-Y499 PolarHBondContact O-N 3.46Å
497	G	50.4	Low	55.7	Low	65 Å²	65	143.8 Å²	143.8	67%	0.67	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-16.7	173	0	0	0	0	0	114.6	V493	V493-G497 PolarHBondContact O-N 2.8Å
498	A	48.4	Very low	54.3	Low	72 Å²	72	143.8 Å²	143.8	60%	0.595	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-8.8	178	0	0	0	0	0	114.3	M495 M496	M495-A498 PolarHBondContact O-N 3.27Å; M496-A498 PolarHBondContact O-N 3.22Å
499	Y	47.9	Very low	52.8	Low	210 Å²	210	143.1 Å²	143.1	82%	0.824	74%	0.737	S	S	*	*	S	Bend	trans	-124.9	54.2	-172	-88.5	-87.3	0	0	0	113	M496	M496-Y499 PolarHBondContact O-N 3.46Å
500	S	45.6	Very low	51.3	Low	102 Å²	102	144.3 Å²	144.3	71%	0.713	75%	0.747	S	S	*	*			trans	-162.5	43	163.2	62	0	0	0	0	115.3
501	T	42.3	Very low	49.7	Very low	133 Å²	133	145.9 Å²	145.9	82%	0.816	76%	0.759	S	S	*	*			trans	-117.9	57	167	45.8	0	0	0	0	111.6
502	C	37.9	Very low	48.2	Very low	124 Å²	124	151.1 Å²	151.1	84%	0.838	77%	0.774	S	S	*	*			trans	-158.3	79.6	168.6	-97.1	0	0	0	0	111.4
503	R	36.7	Very low	46.7	Very low	252 Å²	252	151.1 Å²	151.1	95%	0.951	79%	0.787	S	S	*	*			trans	179.8	100.4	146.6	-108	172.2	179.1	179.3	0.4	111.2
504	A	39.5	Very low	45.1	Very low	97 Å²	97	156.5 Å²	156.5	80%	0.802	81%	0.811	S	S	*	*				165.2	83.1	128	0	0	0	0	0	109
505	Y	39.1	Very low	43.7	Very low	243 Å²	243	158.6 Å²	158.6	95%	0.953	82%	0.82	S	S	*	*			trans	-91.1	114.7	149.6	-90	-84.7	0	0	0	106.5
506	K	31.7	Very low	42.7	Very low	193 Å²	193	159.5 Å²	159.5	84%	0.839	83%	0.828	S	S	*	*			trans	-129.3	107.1	168.3	-158.8	-177.3	-171.5	-175.3	0	105.8
507	F	39.1	Very low	41.7	Very low	280 Å²	280	161 Å²	161	100%	1.228	84%	0.839	S	S	*	*			trans	-136.5	0	153.1	-97.3	-76.1	0	0	0	106.6

Retrieved 507 of 507 residues in 296 ms (Link to these results)

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